A0A087XZ46_POEFO Loading...

Ras-related protein Rab-21

AlphaFold DB (A0A3B3V562), UniProt , Accession A0A087XZ46, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 220 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	41.8	Very low	45.8	Very low	246 Å²	246	112.3 Å²	112.3	100%	1.212	82%	0.818	S	S	*	*				0	104.8	0	-81.8	176.8	162.4	0	0	107.6
2	A	36.8	Very low	48.9	Very low	106 Å²	106	112.8 Å²	112.8	88%	0.876	79%	0.787	S	S	*	*			trans	-75.5	123	179.5	0	0	0	0	0	109.2	A4	A2-A4 PolarHBondContact O-N 3.45Å
3	T	40.9	Very low	52.2	Low	141 Å²	141	109.6 Å²	109.6	87%	0.865	76%	0.76	S	S	*	*			trans	-70.9	113.3	170.6	36.9	0	0	0	0	108.5	G5	T3-G5 PolarHBondContact O-N 3.46Å
4	A	44	Very low	55.3	Low	99 Å²	99	102.6 Å²	102.6	82%	0.818	71%	0.709	S	S	*	*			trans	-62	117.9	172.7	0	0	0	0	0	109.1	A2 A6	A2-A4 PolarHBondContact O-N 3.45Å; A4-A6 PolarHBondContact O-N 3.34Å
5	G	37.7	Very low	58.1	Low	75 Å²	75	101.7 Å²	101.7	77%	0.773	70%	0.703	S	S	*	*			trans	-61.7	117.8	167.5	0	0	0	0	0	109	T3 A7	T3-G5 PolarHBondContact O-N 3.46Å; G5-A7 PolarHBondContact O-N 3.16Å
6	A	46	Very low	60.5	Low	102 Å²	102	96.1 Å²	96.1	84%	0.843	66%	0.662	S	S	*	*			trans	-61.8	104.6	167.2	0	0	0	0	0	107.6	A4 G8	A4-A6 PolarHBondContact O-N 3.34Å; A6-G8 PolarHBondContact O-N 2.99Å
7	A	42.8	Very low	62.6	Low	96 Å²	96	92.6 Å²	92.6	79%	0.793	63%	0.633	S	S	*	*			trans	-55.2	113.5	169.3	0	0	0	0	0	107.6	G5 T9	G5-A7 PolarHBondContact O-N 3.16Å; A7-T9 PolarHBondContact O-N 2.99Å
8	G	42.3	Very low	64.5	Low	71 Å²	71	87.4 Å²	87.4	73%	0.732	60%	0.598	S	S	*	*			trans	-58.8	113.3	176.8	0	0	0	0	0	109	A6 S10	A6-G8 PolarHBondContact O-N 2.99Å; G8-S10 VanDerWaalsContact C-N 3.3Å; G8-S10 PolarHBondContact O-N 3.26Å
9	T	49	Very low	66.1	Low	144 Å²	144	82.8 Å²	82.8	88%	0.883	57%	0.566	S	S	*	*			trans	-56.5	103	157.7	1.8	0	0	0	0	105.9	A7 G11	A7-T9 PolarHBondContact O-N 2.99Å; T9-G11 PolarHBondContact O-N 3.15Å
10	S	55.6	Low	67.5	Low	119 Å²	119	78.8 Å²	78.8	83%	0.832	54%	0.538	S	S	*	.			trans	-65	80.4	170.4	39.8	0	0	0	0	107.5	G8 R12	G8-S10 VanDerWaalsContact C-N 3.3Å; G8-S10 PolarHBondContact O-N 3.26Å; S10-R12 PolarHBondContact O-N 3.4Å
11	G	67.3	Low	68.8	Low	36 Å²	36	75.1 Å²	75.1	37%	0.371	51%	0.513	S	S	.	.			trans	-55.2	116.7	-177.7	0	0	0	0	0	109.1	T9 T13	T9-G11 PolarHBondContact O-N 3.15Å; G11-T13 PolarHBondContact O-N 2.84Å; G11-T13 PolarHBondContact O-OG1 3.19Å
12	R	82.3	Confident	71.3	Confident	119 Å²	119	63.5 Å²	63.5	45%	0.449	46%	0.456	S	S	.	.			trans	-55.5	129.9	-178.8	-173.2	172.5	-174	143.1	28.5	109.9	S10 Y14 R63 E184	S10-R12 PolarHBondContact O-N 3.4Å; R12-Y14 HydrophobicContact CB-CE2 4.33Å; R12-Y14 WeakPolarHBondContact CD-OH 3.5Å; R12-Y14 HydrophobicContact CG-CD2 4.44Å; R12-Y14 HydrophobicContact CG-CE2 3.83Å; R12-Y14 PolarHBondContact NE-OH 3Å; R12-R63 PolarHBondContact O-N 3.39Å; R12-R63 VanDerWaalsContact O-N 3.09Å; R12-E184 VanDerWaalsContact CZ-CD 3.5Å; R12-E184 IonicContact CZ-OE1 3.69Å; R12-E184 VanDerWaalsContact CZ-OE1 3.3Å; R12-E184 IonicContact CZ-OE2 2.8Å; R12-E184 IonicContact NE-OE1 2.65Å; R12-E184 IonicContact NH1-OE1 2.94Å; R12-E184 IonicContact NH1-OE2 4Å; R12-E184 PolarHBondContact NH1-OE2 3.46Å; R12-E184 IonicContact NH2-OE1 3.84Å; R12-E184 PolarHBondContact NH2-OE1 3.26Å; R12-E184 IonicContact NH2-OE2 3.3Å; R12-E184 PolarHBondContact NH2-OE2 3.45Å
13	T	92.6	Very high	73.9	Confident	71 Å²	71	60 Å²	60	44%	0.436	42%	0.422	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	126.9	178	-58.3	0	0	0	0	109.1	G11 R63 N65	G11-T13 PolarHBondContact O-N 2.84Å; G11-T13 PolarHBondContact O-OG1 3.19Å; T13-R63 CarbonylContact C-O 3.37Å; T13-R63 VanDerWaalsContact CA-O 3.31Å; T13-R63 WeakPolarHBondContact CA-O 3.44Å; T13-R63 HydrophobicContact CG2-CB 4.14Å; T13-N65 WeakPolarHBondContact CG2-ND2 3.4Å
14	Y	95.6	Very high	76.2	Confident	12 Å²	12	54.4 Å²	54.4	5%	0.047	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	144	171.8	-64.1	-97	0	0	0	109.2	R12 F16 K62 R63 V64 N65 M177 A180 Q181	R12-Y14 HydrophobicContact CB-CE2 4.33Å; R12-Y14 WeakPolarHBondContact CD-OH 3.5Å; R12-Y14 HydrophobicContact CG-CD2 4.44Å; R12-Y14 HydrophobicContact CG-CE2 3.83Å; R12-Y14 PolarHBondContact NE-OH 3Å; Y14-F16 HydrophobicContact CD1-CE1 4.46Å; Y14-F16 HydrophobicContact CD1-CE2 4.24Å; Y14-F16 AromaticContact CD1-CZ 3.65Å; Y14-F16 HydrophobicContact CD1-CZ 3.65Å; Y14-F16 HydrophobicContact CG-CE2 4.1Å; Y14-F16 AromaticContact CG-CZ 3.99Å; Y14-F16 HydrophobicContact CG-CZ 3.99Å; Y14-K62 HydrophobicContact CD2-CB 4.33Å; Y14-K62 HydrophobicContact CE2-CB 4.08Å; Y14-K62 HydrophobicContact CE2-CD 3.82Å; Y14-K62 HydrophobicContact CE2-CG 4.17Å; Y14-R63 PolarHBondContact N-O 3.49Å; Y14-V64 CarbonylContact O-C 3.53Å; Y14-V64 WeakPolarHBondContact O-CA 3.31Å; Y14-N65 PolarHBondContact O-N 2.99Å; Y14-M177 HydrophobicContact CD1-CG 4.4Å; Y14-M177 HydrophobicContact CD2-CE 3.99Å; Y14-M177 HydrophobicContact CD2-CG 4.35Å; Y14-M177 HydrophobicContact CE2-CE 3.85Å; Y14-M177 HydrophobicContact CG-CG 4.23Å; Y14-A180 HydrophobicContact CD1-CB 4.31Å; Y14-A180 HydrophobicContact CE1-CB 4.14Å; Y14-Q181 HydrophobicContact CE1-CG 4.45Å; Y14-Q181 VanDerWaalsContact OH-CG 3.28Å; Y14-Q181 WeakPolarHBondContact OH-CG 3.32Å; Y14-Q181 PolarHBondContact OH-NE2 2.87Å
15	S	96.6	Very high	78.4	Confident	88 Å²	88	53.4 Å²	53.4	62%	0.615	38%	0.378	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-121.7	120.4	171.5	-65.3	0	0	0	0	107.6	N65	S15-N65 WeakPolarHBondContact CA-O 3.28Å
16	F	97.1	Very high	81.2	Confident	12 Å²	12	49.9 Å²	49.9	5%	0.053	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	142.7	179.7	-63.6	-56.7	0	0	0	111.3	Y14 V64 N65 L66 A67 N89 M176 M177 A180	Y14-F16 HydrophobicContact CD1-CE1 4.46Å; Y14-F16 HydrophobicContact CD1-CE2 4.24Å; Y14-F16 AromaticContact CD1-CZ 3.65Å; Y14-F16 HydrophobicContact CD1-CZ 3.65Å; Y14-F16 HydrophobicContact CG-CE2 4.1Å; Y14-F16 AromaticContact CG-CZ 3.99Å; Y14-F16 HydrophobicContact CG-CZ 3.99Å; F16-V64 HydrophobicContact CD2-CG1 3.7Å; F16-V64 HydrophobicContact CE2-CG1 4.15Å; F16-N65 PolarHBondContact N-O 2.86Å; F16-L66 HydrophobicContact CB-CD1 4.09Å; F16-A67 PolarHBondContact O-N 3.35Å; F16-N89 WeakPolarHBondContact CA-OD1 3.38Å; F16-N89 HydrophobicContact CB-CB 4.36Å; F16-N89 HydrophobicContact CD1-CB 3.89Å; F16-M176 HydrophobicContact CB-CE 3.67Å; F16-M176 HydrophobicContact CB-SD 4.04Å; F16-M176 HydrophobicContact CD1-CB 3.97Å; F16-M176 HydrophobicContact CD1-SD 4.35Å; F16-M176 HydrophobicContact CD2-CB 4.17Å; F16-M176 HydrophobicContact CD2-CE 3.9Å; F16-M176 HydrophobicContact CE1-CB 3.84Å; F16-M176 HydrophobicContact CE2-CB 4.07Å; F16-M176 HydrophobicContact CG-CB 4.13Å; F16-M176 HydrophobicContact CG-CE 3.8Å; F16-M176 HydrophobicContact CG-SD 4.12Å; F16-M176 HydrophobicContact CZ-CB 3.9Å; F16-M177 HydrophobicContact CE2-CB 4.46Å; F16-M177 HydrophobicContact CE2-CG 3.49Å; F16-M177 VanDerWaalsContact CE2-CG 3.49Å; F16-M177 HydrophobicContact CZ-CB 4.4Å; F16-M177 HydrophobicContact CZ-CG 3.83Å; F16-A180 HydrophobicContact CE1-CB 4.29Å; F16-A180 HydrophobicContact CZ-CB 4.4Å
17	K	95.7	Very high	83.5	Confident	37 Å²	37	45.6 Å²	45.6	16%	0.161	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	126.5	169	179.4	178.6	170.8	-179.5	0	109.6	A67 Y84 R86 S88 N89 G90	K17-A67 CarbonylContact C-O 3.56Å; K17-A67 WeakPolarHBondContact CA-O 3.49Å; K17-Y84 WeakPolarHBondContact CE-O 3.17Å; K17-Y84 PolarHBondContact NZ-O 3.22Å; K17-R86 PolarHBondContact NZ-O 3.18Å; K17-S88 WeakPolarHBondContact CE-OG 3.14Å; K17-N89 PolarHBondContact N-OD1 3.48Å; K17-N89 PolarHBondContact O-N 3Å; K17-G90 PolarHBondContact O-N 3.41Å
18	V	96.2	Very high	86	Confident	0 Å²	0	41.4 Å²	41.4	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	135.5	172.3	172	0	0	0	0	109.6	L66 A67 I68 W69 G90 I92 L172 M176	V18-L66 HydrophobicContact CB-CD1 4.27Å; V18-L66 HydrophobicContact CG2-CD1 3.64Å; V18-A67 PolarHBondContact N-O 3.39Å; V18-I68 WeakPolarHBondContact O-CA 3.33Å; V18-W69 PolarHBondContact O-N 3.44Å; V18-G90 VanDerWaalsContact CA-O 3.32Å; V18-G90 WeakPolarHBondContact CA-O 3.39Å; V18-I92 HydrophobicContact CG1-CD1 3.79Å; V18-I92 HydrophobicContact CG1-CG1 3.84Å; V18-L172 HydrophobicContact CG1-CD2 3.86Å; V18-L172 HydrophobicContact CG2-CD2 3.84Å; V18-L172 HydrophobicContact CG2-CG 4.43Å; V18-M176 HydrophobicContact CG2-CE 3.66Å; V18-M176 HydrophobicContact CG2-SD 3.85Å
19	V	95.1	Very high	88.5	Confident	0 Å²	0	39.7 Å²	39.7	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	138.8	174.3	66.1	0	0	0	0	110.4	L21 W69 T71 G90 A91 I92	V19-L21 HydrophobicContact CG1-CD1 4.39Å; V19-L21 HydrophobicContact CG1-CG 4.4Å; V19-L21 HydrophobicContact CG2-CD2 4.01Å; V19-L21 HydrophobicContact CG2-CG 4.16Å; V19-W69 HydrophobicContact CB-CB 4.35Å; V19-W69 HydrophobicContact CG2-CB 4.16Å; V19-T71 HydrophobicContact CG2-CG2 3.73Å; V19-G90 PolarHBondContact N-O 3.03Å; V19-G90 VanDerWaalsContact N-O 3.16Å; V19-A91 HydrophobicContact CG1-CB 3.88Å; V19-A91 WeakPolarHBondContact O-CA 3.49Å; V19-I92 PolarHBondContact O-N 3.39Å
20	L	95.3	Very high	90.7	Very high	1 Å²	1	34.5 Å²	34.5	1%	0.005	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	130.5	168.7	-74.5	80.6	0	0	0	109.3	K28 V32 I68 W69 T71 I92 V94	L20-K28 HydrophobicContact CB-CB 4.3Å; L20-K28 HydrophobicContact CB-CD 4.14Å; L20-K28 HydrophobicContact CB-CG 4.33Å; L20-K28 HydrophobicContact CD2-CB 4Å; L20-V32 HydrophobicContact CD1-CG2 3.67Å; L20-V32 HydrophobicContact CD2-CG2 3.34Å; L20-V32 HydrophobicContact CG-CG2 4.13Å; L20-I68 HydrophobicContact CD1-CG2 3.42Å; L20-I68 VanDerWaalsContact CD1-CG2 3.42Å; L20-W69 PolarHBondContact N-O 3.04Å; L20-T71 WeakPolarHBondContact O-CG2 3.41Å; L20-T71 PolarHBondContact O-OG1 3.02Å; L20-I92 WeakPolarHBondContact CA-O 3.31Å; L20-I92 HydrophobicContact CG-CB 4.13Å; L20-I92 HydrophobicContact CG-CG2 4.46Å; L20-V94 HydrophobicContact CD2-CG2 4.48Å
21	L	94.2	Very high	92.6	Very high	3 Å²	3	28.9 Å²	28.9	2%	0.016	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	159.8	176.6	-57.7	169.8	0	0	0	110	V19 T71 Y85 I92 L93 V94 W109 L113	V19-L21 HydrophobicContact CG1-CD1 4.39Å; V19-L21 HydrophobicContact CG1-CG 4.4Å; V19-L21 HydrophobicContact CG2-CD2 4.01Å; V19-L21 HydrophobicContact CG2-CG 4.16Å; L21-T71 HydrophobicContact CD2-CG2 4.1Å; L21-Y85 HydrophobicContact CD1-CD1 4.41Å; L21-I92 PolarHBondContact N-O 3.03Å; L21-L93 HydrophobicContact CB-CD2 3.73Å; L21-L93 HydrophobicContact CD1-CD2 4.05Å; L21-L93 HydrophobicContact CG-CD2 4.39Å; L21-L93 WeakPolarHBondContact O-CA 3.17Å; L21-V94 PolarHBondContact O-N 3.26Å; L21-W109 HydrophobicContact CB-CD2 4.14Å; L21-W109 HydrophobicContact CB-CG 4.21Å; L21-W109 HydrophobicContact CD1-CD2 4.31Å; L21-W109 HydrophobicContact CD1-CE3 3.94Å; L21-W109 HydrophobicContact CD1-CZ3 4.46Å; L21-W109 HydrophobicContact CD2-CZ3 4.39Å; L21-L113 HydrophobicContact CD1-CD1 3.98Å; L21-L113 HydrophobicContact CD1-CD2 3.95Å; L21-L113 HydrophobicContact CD1-CG 4.1Å
22	G	93.4	Very high	94	Very high	1 Å²	1	27.2 Å²	27.2	1%	0.01	16%	0.16	C	C	.	.			trans	143.7	167.2	-174.4	0	0	0	0	0	111.4	K28 G73 V94	G22-K28 PolarHBondContact O-NZ 3.11Å; G22-G73 VanDerWaalsContact O-CA 3.24Å; G22-G73 WeakPolarHBondContact O-CA 3.2Å; G22-V94 WeakPolarHBondContact CA-O 3.33Å
23	E	92	Very high	94.6	Very high	33 Å²	33	24.1 Å²	24.1	15%	0.154	15%	0.152	C	C	.	.	S	Bend	trans	-62.8	167.9	-177.1	-166.6	49.6	-113	0	0	112.8	V26 K28 G73 K105	E23-V26 HydrophobicContact CB-CG1 3.92Å; E23-V26 VanDerWaalsContact O-CG2 3.27Å; E23-V26 WeakPolarHBondContact O-CG2 3.42Å; E23-K28 PolarHBondContact O-NZ 2.93Å; E23-G73 CarbonylContact C-O 3.55Å; E23-K105 HydrophobicContact CB-CB 4.4Å; E23-K105 HydrophobicContact CB-CG 4.39Å; E23-K105 HydrophobicContact CG-CG 4.45Å; E23-K105 WeakPolarHBondContact OE2-CD 3.44Å; E23-K105 WeakPolarHBondContact OE2-CE 3.45Å; E23-K105 WeakPolarHBondContact OE2-CG 3.18Å; E23-K105 IonicContact OE2-NZ 3.45Å; E23-K105 PolarHBondContact OE2-NZ 3.12Å
24	G	89.7	Confident	94.7	Very high	23 Å²	23	22.6 Å²	22.6	24%	0.237	14%	0.138	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.5	147.7	171.9	0	0	0	0	0	111.9	V26 G73	G24-V26 PolarHBondContact O-N 3.03Å; G24-G73 PolarHBondContact N-O 3.3Å
25	C	90.7	Very high	94.8	Very high	78 Å²	78	22.5 Å²	22.5	53%	0.527	14%	0.138	S	C	.	.	T	Hydrogen-bonded Turn	trans	61.7	4	170.3	-59.1	0	0	0	0	118.1	G27 K129	C25-G27 PolarHBondContact O-N 3.44Å; C25-K129 PolarHBondContact O-NZ 3.11Å
26	V	94.9	Very high	94.7	Very high	1 Å²	1	20.1 Å²	20.1	1%	0.006	12%	0.12	C	C	.	.	S	Bend	trans	-67.9	-14.4	174.3	-56.6	0	0	0	0	113.8	E23 G24 K28 V94 D96 N128	E23-V26 HydrophobicContact CB-CG1 3.92Å; E23-V26 VanDerWaalsContact O-CG2 3.27Å; E23-V26 WeakPolarHBondContact O-CG2 3.42Å; G24-V26 PolarHBondContact O-N 3.03Å; V26-K28 HydrophobicContact CG2-CG 3.86Å; V26-V94 HydrophobicContact CB-CG1 4.35Å; V26-V94 HydrophobicContact CG2-CB 4.01Å; V26-V94 HydrophobicContact CG2-CG1 3.92Å; V26-D96 HydrophobicContact CB-CB 4.37Å; V26-D96 HydrophobicContact CG1-CB 4.29Å; V26-N128 PolarHBondContact O-ND2 3.45Å
27	G	94.9	Very high	94.5	Very high	12 Å²	12	23.9 Å²	23.9	12%	0.124	14%	0.138	C	C	.	.	S	Bend	trans	100	21.5	173.5	0	0	0	0	0	116.5	C25 T29 S30 L31	C25-G27 PolarHBondContact O-N 3.44Å; G27-T29 PolarHBondContact O-N 3.26Å; G27-S30 PolarHBondContact O-N 3.37Å; G27-L31 WeakPolarHBondContact O-CG 3.24Å; G27-L31 PolarHBondContact O-N 2.92Å
28	K	95.3	Very high	94.4	Very high	8 Å²	8	27 Å²	27	4%	0.035	16%	0.157	C	C	.	.	H	α-helix	trans	-48.7	-57.1	173	-64	-176.6	-63.9	-72.6	0	112.5	L20 G22 E23 V26 S30 L31 V32 D70 T71 V94	L20-K28 HydrophobicContact CB-CB 4.3Å; L20-K28 HydrophobicContact CB-CD 4.14Å; L20-K28 HydrophobicContact CB-CG 4.33Å; L20-K28 HydrophobicContact CD2-CB 4Å; G22-K28 PolarHBondContact O-NZ 3.11Å; E23-K28 PolarHBondContact O-NZ 2.93Å; V26-K28 HydrophobicContact CG2-CG 3.86Å; K28-S30 VanDerWaalsContact C-N 3.3Å; K28-S30 PolarHBondContact O-N 3.04Å; K28-L31 WeakPolarHBondContact O-CB 3.24Å; K28-L31 PolarHBondContact O-N 3.08Å; K28-L31 VanDerWaalsContact O-N 3.14Å; K28-V32 WeakPolarHBondContact O-CG2 3.27Å; K28-V32 PolarHBondContact O-N 3.2Å; K28-D70 WeakPolarHBondContact CB-OD1 3.28Å; K28-T71 WeakPolarHBondContact CE-O 3.44Å; K28-V94 HydrophobicContact CG-CB 3.97Å; K28-V94 HydrophobicContact CG-CG2 3.97Å
29	T	94.3	Very high	94.2	Very high	36 Å²	36	33 Å²	33	22%	0.221	18%	0.182	C	C	.	.	H	α-helix	trans	-58.6	-41.2	178.7	-52.1	0	0	0	0	111.9	G27 L31 V32 L33 T47 D70	G27-T29 PolarHBondContact O-N 3.26Å; T29-L31 PolarHBondContact O-N 2.69Å; T29-V32 PolarHBondContact O-N 3.44Å; T29-L33 HydrophobicContact CG2-CD1 3.97Å; T29-L33 HydrophobicContact CG2-CG 4.27Å; T29-L33 WeakPolarHBondContact O-CB 3.33Å; T29-L33 VanDerWaalsContact O-CG 3.32Å; T29-L33 WeakPolarHBondContact O-CG 3.24Å; T29-L33 PolarHBondContact O-N 3.04Å; T29-T47 PolarHBondContact OG1-OG1 3.26Å; T29-D70 WeakPolarHBondContact CA-OD2 3.38Å; T29-D70 VanDerWaalsContact CB-OD2 3.26Å; T29-D70 WeakPolarHBondContact CB-OD2 3.36Å; T29-D70 WeakPolarHBondContact CG2-OD2 3.46Å; T29-D70 PolarHBondContact N-OD1 3.12Å; T29-D70 PolarHBondContact OG1-OD1 2.98Å; T29-D70 PolarHBondContact OG1-OD2 2.96Å
30	S	95.5	Very high	94.1	Very high	34 Å²	34	36 Å²	36	24%	0.238	20%	0.196	C	C	.	.	H	α-helix	trans	-64.9	-37.6	178.1	-53.1	0	0	0	0	112.7	G27 K28 R34	G27-S30 PolarHBondContact O-N 3.37Å; K28-S30 VanDerWaalsContact C-N 3.3Å; K28-S30 PolarHBondContact O-N 3.04Å; S30-R34 WeakPolarHBondContact O-CB 3.18Å; S30-R34 PolarHBondContact O-N 2.66Å
31	L	96.8	Very high	93.7	Very high	1 Å²	1	39.5 Å²	39.5	1%	0.005	22%	0.215	C	C	.	.	H	α-helix	trans	-64.1	-44.9	173.7	-72.4	169.8	0	0	0	111.3	G27 K28 T29 R34 Y35 V94 V126 N128 A159 I165	G27-L31 WeakPolarHBondContact O-CG 3.24Å; G27-L31 PolarHBondContact O-N 2.92Å; K28-L31 WeakPolarHBondContact O-CB 3.24Å; K28-L31 PolarHBondContact O-N 3.08Å; K28-L31 VanDerWaalsContact O-N 3.14Å; T29-L31 PolarHBondContact O-N 2.69Å; L31-R34 PolarHBondContact O-N 2.97Å; L31-Y35 WeakPolarHBondContact O-CB 3.36Å; L31-Y35 PolarHBondContact O-N 3.32Å; L31-V94 HydrophobicContact CD1-CG1 3.84Å; L31-V94 HydrophobicContact CD1-CG2 3.96Å; L31-V126 HydrophobicContact CD1-CG1 4.28Å; L31-N128 HydrophobicContact CD1-CB 4.34Å; L31-A159 HydrophobicContact CD2-CB 4.08Å; L31-A159 HydrophobicContact CG-CB 4.35Å; L31-I165 HydrophobicContact CD2-CD1 3.73Å; L31-I165 HydrophobicContact CD2-CG1 3.69Å
32	V	95.3	Very high	93.2	Very high	2 Å²	2	44.8 Å²	44.8	1%	0.012	24%	0.243	C	C	.	.	H	α-helix	trans	-67.1	-45.8	-179.3	179.4	0	0	0	0	111.4	L20 K28 T29 R34 Y35 C36 L53 I68 D70	L20-V32 HydrophobicContact CD1-CG2 3.67Å; L20-V32 HydrophobicContact CD2-CG2 3.34Å; L20-V32 HydrophobicContact CG-CG2 4.13Å; K28-V32 WeakPolarHBondContact O-CG2 3.27Å; K28-V32 PolarHBondContact O-N 3.2Å; T29-V32 PolarHBondContact O-N 3.44Å; V32-R34 VanDerWaalsContact C-N 3.31Å; V32-R34 PolarHBondContact O-N 3.48Å; V32-Y35 PolarHBondContact O-N 3.41Å; V32-C36 WeakPolarHBondContact O-CB 3.44Å; V32-C36 PolarHBondContact O-N 3.3Å; V32-C36 PolarHBondContact O-SG 3.1Å; V32-L53 HydrophobicContact CG1-CB 4.34Å; V32-L53 HydrophobicContact CG1-CD1 3.75Å; V32-L53 HydrophobicContact CG1-CD2 4.08Å; V32-L53 HydrophobicContact CG1-CG 4.27Å; V32-I68 HydrophobicContact CG1-CG2 3.96Å; V32-I68 HydrophobicContact CG2-CG2 3.89Å; V32-D70 HydrophobicContact CG2-CB 4.28Å
33	L	94.4	Very high	92.6	Very high	54 Å²	54	52.3 Å²	52.3	28%	0.283	28%	0.275	S	S	.	.	H	α-helix	trans	-62.6	-39.8	175.6	-70.8	177.1	0	0	0	111.7	T29 E37 N38 K39	T29-L33 HydrophobicContact CG2-CD1 3.97Å; T29-L33 HydrophobicContact CG2-CG 4.27Å; T29-L33 WeakPolarHBondContact O-CB 3.33Å; T29-L33 VanDerWaalsContact O-CG 3.32Å; T29-L33 WeakPolarHBondContact O-CG 3.24Å; T29-L33 PolarHBondContact O-N 3.04Å; L33-E37 WeakPolarHBondContact O-CA 3.44Å; L33-E37 WeakPolarHBondContact O-CB 3.49Å; L33-E37 PolarHBondContact O-N 2.69Å; L33-N38 PolarHBondContact O-N 3.3Å; L33-K39 CarbonylContact C-O 3.59Å; L33-K39 PolarHBondContact O-N 2.79Å
34	R	96.1	Very high	91.5	Very high	39 Å²	39	58 Å²	58	15%	0.147	30%	0.301	C	S	.	.	H	α-helix	trans	-63.5	-44.8	176.1	178	58.9	79.5	-173.5	7.6	111	S30 L31 V32 N38 K39 A159 K160 N162 I165	S30-R34 WeakPolarHBondContact O-CB 3.18Å; S30-R34 PolarHBondContact O-N 2.66Å; L31-R34 PolarHBondContact O-N 2.97Å; V32-R34 VanDerWaalsContact C-N 3.31Å; V32-R34 PolarHBondContact O-N 3.48Å; R34-N38 PolarHBondContact NH1-O 2.93Å; R34-N38 PolarHBondContact NH1-OD1 3.42Å; R34-N38 WeakPolarHBondContact O-CA 3.44Å; R34-N38 PolarHBondContact O-N 3.12Å; R34-K39 VanDerWaalsContact CA-O 3.31Å; R34-K39 WeakPolarHBondContact CA-O 3.39Å; R34-K39 PolarHBondContact N-O 3.23Å; R34-A159 PolarHBondContact NE-O 3.38Å; R34-A159 PolarHBondContact NH2-O 2.9Å; R34-K160 PolarHBondContact NH2-O 3.27Å; R34-K160 VanDerWaalsContact NH2-O 3.14Å; R34-N162 WeakPolarHBondContact CD-OD1 3.16Å; R34-N162 HydrophobicContact CG-CB 4.2Å; R34-N162 WeakPolarHBondContact CG-OD1 3.37Å; R34-I165 HydrophobicContact CB-CD1 3.91Å; R34-I165 HydrophobicContact CG-CD1 3.4Å; R34-I165 VanDerWaalsContact CG-CD1 3.4Å
35	Y	96.6	Very high	90.9	Very high	10 Å²	10	62.8 Å²	62.8	4%	0.039	32%	0.32	C	S	.	.	H	α-helix	trans	-67.9	-44.9	179.6	-178.5	-124.3	0	0	0	113	L31 V32 K55 L57 L66 I68 I165 E166 F169	L31-Y35 WeakPolarHBondContact O-CB 3.36Å; L31-Y35 PolarHBondContact O-N 3.32Å; V32-Y35 PolarHBondContact O-N 3.41Å; Y35-K55 HydrophobicContact CD1-CD 3.92Å; Y35-K55 VanDerWaalsContact CD2-NZ 3.31Å; Y35-K55 HydrophobicContact CE1-CB 4.46Å; Y35-K55 HydrophobicContact CE1-CD 3.5Å; Y35-K55 HydrophobicContact CE1-CG 4.42Å; Y35-K55 HydrophobicContact CE2-CD 4.2Å; Y35-K55 HydrophobicContact CG-CD 4.46Å; Y35-K55 PolarHBondContact O-NZ 3.24Å; Y35-L57 WeakPolarHBondContact OH-CD1 3.43Å; Y35-L57 WeakPolarHBondContact OH-CD2 3.49Å; Y35-L66 HydrophobicContact CE1-CD2 4.14Å; Y35-I68 HydrophobicContact CD1-CD1 3.86Å; Y35-I68 HydrophobicContact CE1-CD1 3.95Å; Y35-I165 HydrophobicContact CD2-CG2 4.12Å; Y35-I165 HydrophobicContact CG-CG2 4.25Å; Y35-E166 VanDerWaalsContact CE2-OE2 3.3Å; Y35-E166 WeakPolarHBondContact CE2-OE2 3.32Å; Y35-F169 HydrophobicContact CD1-CB 4.35Å; Y35-F169 AromaticContact CD1-CD1 3.84Å; Y35-F169 HydrophobicContact CD1-CD1 3.84Å; Y35-F169 AromaticContact CD1-CD2 3.63Å; Y35-F169 HydrophobicContact CD1-CD2 3.63Å; Y35-F169 AromaticContact CD1-CE1 3.96Å; Y35-F169 HydrophobicContact CD1-CE1 3.96Å; Y35-F169 AromaticContact CD1-CE2 3.78Å; Y35-F169 HydrophobicContact CD1-CE2 3.78Å; Y35-F169 AromaticContact CD1-CG 3.68Å; Y35-F169 HydrophobicContact CD1-CG 3.68Å; Y35-F169 AromaticContact CD1-CZ 3.94Å; Y35-F169 HydrophobicContact CD1-CZ 3.94Å; Y35-F169 HydrophobicContact CD2-CB 4.19Å; Y35-F169 AromaticContact CD2-CD2 3.7Å; Y35-F169 HydrophobicContact CD2-CD2 3.7Å; Y35-F169 HydrophobicContact CD2-CE2 4.35Å; Y35-F169 HydrophobicContact CD2-CG 4.08Å; Y35-F169 HydrophobicContact CE1-CB 3.72Å; Y35-F169 AromaticContact CE1-CD1 3.55Å; Y35-F169 HydrophobicContact CE1-CD1 3.55Å; Y35-F169 AromaticContact CE1-CD2 3.9Å; Y35-F169 HydrophobicContact CE1-CD2 3.9Å; Y35-F169 HydrophobicContact CE1-CE1 4.08Å; Y35-F169 HydrophobicContact CE1-CE2 4.4Å; Y35-F169 AromaticContact CE1-CG 3.45Å; Y35-F169 HydrophobicContact CE1-CG 3.45Å; Y35-F169 VanDerWaalsContact CE1-CG 3.45Å; Y35-F169 HydrophobicContact CE1-CZ 4.48Å; Y35-F169 HydrophobicContact CE2-CB 3.58Å; Y35-F169 HydrophobicContact CE2-CD2 4.01Å; Y35-F169 AromaticContact CE2-CG 3.91Å; Y35-F169 HydrophobicContact CE2-CG 3.91Å; Y35-F169 AromaticContact CG-CD2 3.51Å; Y35-F169 HydrophobicContact CG-CD2 3.51Å; Y35-F169 AromaticContact CG-CE2 3.73Å; Y35-F169 HydrophobicContact CG-CE2 3.73Å; Y35-F169 AromaticContact CG-CG 3.97Å; Y35-F169 HydrophobicContact CG-CG 3.97Å; Y35-F169 HydrophobicContact CG-CZ 4.34Å; Y35-F169 AromaticContact CZ-CG 3.59Å; Y35-F169 WeakPolarHBondContact OH-CB 3.26Å
36	C	94.3	Very high	90.5	Very high	38 Å²	38	62.2 Å²	62.2	26%	0.257	31%	0.314	S	S	.	.	H	α-helix	trans	-83.2	-36.9	-173.1	-69.2	0	0	0	0	113.4	V32 L53	V32-C36 WeakPolarHBondContact O-CB 3.44Å; V32-C36 PolarHBondContact O-N 3.3Å; V32-C36 PolarHBondContact O-SG 3.1Å; C36-L53 HydrophobicContact CB-CD2 3.74Å
37	E	93.2	Very high	89.6	Confident	90 Å²	90	63.7 Å²	63.7	42%	0.421	32%	0.323	S	S	.	.	H	α-helix	trans	-121.9	-3.2	-170.2	-59.3	-174.2	-155.7	0	0	113.6	L33 K39	L33-E37 WeakPolarHBondContact O-CA 3.44Å; L33-E37 WeakPolarHBondContact O-CB 3.49Å; L33-E37 PolarHBondContact O-N 2.69Å; E37-K39 HydrophobicContact CB-CB 4.34Å; E37-K39 HydrophobicContact CB-CD 4.09Å; E37-K39 HydrophobicContact CB-CG 4.05Å; E37-K39 PolarHBondContact O-N 3.48Å; E37-K39 WeakPolarHBondContact OE2-CD 3.04Å; E37-K39 WeakPolarHBondContact OE2-CE 3.45Å; E37-K39 IonicContact OE2-NZ 2.74Å; E37-K39 PolarHBondContact OE2-NZ 3.41Å
38	N	93.6	Very high	88.5	Confident	103 Å²	103	69.5 Å²	69.5	55%	0.551	35%	0.351	S	S	*	.	S	Bend	trans	52.5	36.1	-170.4	-165.7	23.3	0	0	0	113.2	L33 R34	L33-N38 PolarHBondContact O-N 3.3Å; R34-N38 PolarHBondContact NH1-O 2.93Å; R34-N38 PolarHBondContact NH1-OD1 3.42Å; R34-N38 WeakPolarHBondContact O-CA 3.44Å; R34-N38 PolarHBondContact O-N 3.12Å
39	K	92.9	Very high	87.4	Confident	125 Å²	125	76.9 Å²	76.9	54%	0.543	39%	0.386	S	S	.	.			trans	-112.2	150.5	178.1	-68.7	179	-167.2	157.9	0	111.5	L33 R34 E37	L33-K39 CarbonylContact C-O 3.59Å; L33-K39 PolarHBondContact O-N 2.79Å; R34-K39 VanDerWaalsContact CA-O 3.31Å; R34-K39 WeakPolarHBondContact CA-O 3.39Å; R34-K39 PolarHBondContact N-O 3.23Å; E37-K39 HydrophobicContact CB-CB 4.34Å; E37-K39 HydrophobicContact CB-CD 4.09Å; E37-K39 HydrophobicContact CB-CG 4.05Å; E37-K39 PolarHBondContact O-N 3.48Å; E37-K39 WeakPolarHBondContact OE2-CD 3.04Å; E37-K39 WeakPolarHBondContact OE2-CE 3.45Å; E37-K39 IonicContact OE2-NZ 2.74Å; E37-K39 PolarHBondContact OE2-NZ 3.41Å
40	F	92	Very high	86.5	Confident	65 Å²	65	76.5 Å²	76.5	29%	0.285	39%	0.386	S	S	.	.			trans	-141.1	142.7	169.4	179.6	-99.6	0	0	0	109	D42 A159 K160	F40-D42 VanDerWaalsContact CE1-OD1 3.32Å; F40-D42 WeakPolarHBondContact CE1-OD1 3.21Å; F40-A159 HydrophobicContact CD2-CB 3.95Å; F40-A159 HydrophobicContact CE2-CB 3.88Å; F40-K160 HydrophobicContact CD1-CG 4.32Å; F40-K160 HydrophobicContact CE1-CB 3.95Å; F40-K160 HydrophobicContact CE1-CD 4.46Å; F40-K160 HydrophobicContact CE1-CG 3.76Å; F40-K160 HydrophobicContact CE2-CB 4.08Å; F40-K160 HydrophobicContact CZ-CB 3.72Å; F40-K160 HydrophobicContact CZ-CG 4.02Å
41	N	88.1	Confident	86	Confident	74 Å²	74	77 Å²	77	40%	0.396	39%	0.39	S	S	.	.			trans	-123.9	120.6	177.8	-174.2	-4.6	0	0	0	108	K43	N41-K43 PolarHBondContact O-N 2.85Å; N41-K43 VanDerWaalsContact OD1-CB 3.32Å; N41-K43 WeakPolarHBondContact OD1-CB 3.07Å; N41-K43 PolarHBondContact OD1-N 3.46Å
42	D	83.3	Confident	85.5	Confident	113 Å²	113	82.3 Å²	82.3	60%	0.604	41%	0.413	S	S	*	.	S	Bend	trans	-67.3	-18.2	176.1	-67.9	-70.5	0	0	0	112.3	F40 H44	F40-D42 VanDerWaalsContact CE1-OD1 3.32Å; F40-D42 WeakPolarHBondContact CE1-OD1 3.21Å; D42-H44 PolarHBondContact O-N 2.97Å
43	K	80.9	Confident	85.3	Confident	159 Å²	159	83.6 Å²	83.6	69%	0.691	42%	0.42	S	S	*	.	S	Bend	trans	-76.1	122.6	176.9	-60.7	-176.9	-179.5	-178.5	0	110	N41 I45	N41-K43 PolarHBondContact O-N 2.85Å; N41-K43 VanDerWaalsContact OD1-CB 3.32Å; N41-K43 WeakPolarHBondContact OD1-CB 3.07Å; N41-K43 PolarHBondContact OD1-N 3.46Å; K43-I45 VanDerWaalsContact C-N 3.3Å; K43-I45 HydrophobicContact CB-CG1 4.3Å; K43-I45 PolarHBondContact O-N 2.94Å
44	H	69.3	Low	85.3	Confident	152 Å²	152	84.9 Å²	84.9	70%	0.704	43%	0.43	S	S	*	.			trans	-70.4	84.2	171.1	-68.4	-76.2	0	0	0	110.8	D42	D42-H44 PolarHBondContact O-N 2.97Å
45	I	77.7	Confident	85.2	Confident	124 Å²	124	85.1 Å²	85.1	64%	0.636	43%	0.432	S	S	*	.			trans	-86.8	122.8	171.9	-57.5	175.7	0	0	0	107.8	K43 T47	K43-I45 VanDerWaalsContact C-N 3.3Å; K43-I45 HydrophobicContact CB-CG1 4.3Å; K43-I45 PolarHBondContact O-N 2.94Å; I45-T47 PolarHBondContact O-N 3.16Å
46	T	80.3	Confident	85.1	Confident	66 Å²	66	92.7 Å²	92.7	41%	0.405	47%	0.465	S	S	.	.			trans	-70.1	127.9	175.7	-65.8	0	0	0	0	110	L48	T46-L48 PolarHBondContact O-N 3.04Å; T46-L48 VanDerWaalsContact O-N 3.15Å
47	T	76	Confident	85.1	Confident	32 Å²	32	92.1 Å²	92.1	20%	0.196	46%	0.459	C	S	.	.			trans	-73.1	104.6	174.2	-51.9	0	0	0	0	109.4	T29 I45 Q49 A72	T29-T47 PolarHBondContact OG1-OG1 3.26Å; I45-T47 PolarHBondContact O-N 3.16Å; T47-Q49 WeakPolarHBondContact CG2-O 3.45Å; T47-A72 VanDerWaalsContact O-CB 3.29Å; T47-A72 WeakPolarHBondContact O-CB 3.11Å
48	L	72.5	Confident	85.1	Confident	135 Å²	135	93.5 Å²	93.5	71%	0.707	47%	0.47	S	S	*	.			trans	-77.2	-31.5	-178.5	-66.5	175.8	0	0	0	112.8	T46	T46-L48 PolarHBondContact O-N 3.04Å; T46-L48 VanDerWaalsContact O-N 3.15Å
49	Q	71.5	Confident	85	Confident	163 Å²	163	89 Å²	89	76%	0.762	45%	0.445	S	S	*	.	S	Bend	trans	-136.4	151.2	-177.5	-65.6	-176.7	-71.7	0	0	110.1	T47 S51	T47-Q49 WeakPolarHBondContact CG2-O 3.45Å; Q49-S51 PolarHBondContact O-N 2.84Å
50	A	76.8	Confident	84.8	Confident	28 Å²	28	89.6 Å²	89.6	23%	0.231	46%	0.46	C	S	.	.			trans	-60.8	136.3	171.9	0	0	0	0	0	110.3	D70 Y84	A50-D70 CarbonylContact C-O 3.57Å; A50-D70 WeakPolarHBondContact CA-O 3.48Å; A50-D70 WeakPolarHBondContact CB-O 3.33Å; A50-Y84 HydrophobicContact CB-CD1 3.85Å; A50-Y84 HydrophobicContact CB-CE1 3.28Å; A50-Y84 HydrophobicContact CB-CE2 4.26Å
51	S	83.8	Confident	84.6	Confident	44 Å²	44	89 Å²	89	31%	0.308	47%	0.472	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	148.9	175.6	76.2	0	0	0	0	110.8	Q49 D70	Q49-S51 PolarHBondContact O-N 2.84Å; S51-D70 PolarHBondContact N-O 3.42Å; S51-D70 PolarHBondContact O-N 3.41Å; S51-D70 WeakPolarHBondContact OG-CB 3.48Å; S51-D70 PolarHBondContact OG-OD2 2.58Å
52	F	87.3	Confident	84.7	Confident	113 Å²	113	88.4 Å²	88.4	50%	0.496	47%	0.466	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	121.5	-178.2	173.8	-97.3	0	0	0	109.2	T54 A67 I68 W69	F52-T54 VanDerWaalsContact CE1-OG1 3.31Å; F52-T54 WeakPolarHBondContact CE1-OG1 3.39Å; F52-T54 WeakPolarHBondContact CZ-OG1 3.45Å; F52-A67 HydrophobicContact CE2-CB 3.61Å; F52-A67 HydrophobicContact CZ-CB 3.97Å; F52-I68 WeakPolarHBondContact CA-O 3.49Å; F52-W69 HydrophobicContact CD2-CD2 4.15Å; F52-W69 AromaticContact CD2-CE2 3.67Å; F52-W69 HydrophobicContact CD2-CG 4.45Å; F52-W69 AromaticContact CD2-CZ2 3.97Å; F52-W69 HydrophobicContact CD2-CZ2 3.97Å; F52-W69 AromaticContact CD2-NE1 3.65Å; F52-W69 HydrophobicContact CE2-CZ2 4.35Å; F52-W69 AromaticContact CE2-NE1 3.73Å
53	L	91.9	Very high	85.3	Confident	29 Å²	29	90.9 Å²	90.9	15%	0.152	47%	0.467	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	148	175.8	-70.6	91.7	0	0	0	110	V32 C36 I68	V32-L53 HydrophobicContact CG1-CB 4.34Å; V32-L53 HydrophobicContact CG1-CD1 3.75Å; V32-L53 HydrophobicContact CG1-CD2 4.08Å; V32-L53 HydrophobicContact CG1-CG 4.27Å; C36-L53 HydrophobicContact CB-CD2 3.74Å; L53-I68 PolarHBondContact N-O 2.93Å; L53-I68 PolarHBondContact O-N 3.09Å
54	T	93.5	Very high	86	Confident	81 Å²	81	83.3 Å²	83.3	50%	0.497	43%	0.434	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	132.4	174.7	-61.2	0	0	0	0	110.1	F52 L66	F52-T54 VanDerWaalsContact CE1-OG1 3.31Å; F52-T54 WeakPolarHBondContact CE1-OG1 3.39Å; F52-T54 WeakPolarHBondContact CZ-OG1 3.45Å; T54-L66 CarbonylContact C-O 3.52Å; T54-L66 VanDerWaalsContact CA-O 3.29Å; T54-L66 WeakPolarHBondContact CA-O 3.47Å
55	K	93.9	Very high	87.4	Confident	44 Å²	44	78.5 Å²	78.5	19%	0.191	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	131.5	172.2	-170.3	159.1	172.6	-175.4	0	110.5	Y35 L57 L66 E166	Y35-K55 HydrophobicContact CD1-CD 3.92Å; Y35-K55 VanDerWaalsContact CD2-NZ 3.31Å; Y35-K55 HydrophobicContact CE1-CB 4.46Å; Y35-K55 HydrophobicContact CE1-CD 3.5Å; Y35-K55 HydrophobicContact CE1-CG 4.42Å; Y35-K55 HydrophobicContact CE2-CD 4.2Å; Y35-K55 HydrophobicContact CG-CD 4.46Å; Y35-K55 PolarHBondContact O-NZ 3.24Å; K55-L57 HydrophobicContact CD-CD2 4.34Å; K55-L57 HydrophobicContact CG-CD2 4.08Å; K55-L57 HydrophobicContact CG-CG 4.45Å; K55-L66 PolarHBondContact N-O 2.8Å; K55-L66 WeakPolarHBondContact O-CB 3.32Å; K55-L66 PolarHBondContact O-N 3.45Å; K55-E166 IonicContact NZ-OE2 3.09Å
56	K	94.9	Very high	88.3	Confident	168 Å²	168	72.6 Å²	72.6	73%	0.73	38%	0.383	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.4	128.6	175.6	-62.7	-176	179.9	173.1	0	109.1	V64	K56-V64 CarbonylContact C-O 3.36Å; K56-V64 WeakPolarHBondContact CA-O 3.4Å
57	L	93.8	Very high	89.1	Confident	27 Å²	27	70.4 Å²	70.4	14%	0.141	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	153.2	-178.2	-54.6	162.4	0	0	0	109.5	Y35 K55 I59 V64 L66	Y35-L57 WeakPolarHBondContact OH-CD1 3.43Å; Y35-L57 WeakPolarHBondContact OH-CD2 3.49Å; K55-L57 HydrophobicContact CD-CD2 4.34Å; K55-L57 HydrophobicContact CG-CD2 4.08Å; K55-L57 HydrophobicContact CG-CG 4.45Å; L57-I59 HydrophobicContact CB-CG1 4.26Å; L57-V64 HydrophobicContact CB-CB 4.25Å; L57-V64 PolarHBondContact N-O 3.26Å; L57-V64 PolarHBondContact O-N 2.62Å; L57-L66 HydrophobicContact CD1-CD2 4.44Å
58	N	93.1	Very high	90	Very high	119 Å²	119	68.9 Å²	68.9	64%	0.636	36%	0.363	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-118.6	108.3	168	-175	16.6	0	0	0	108.3	G61 K62	N58-G61 VanDerWaalsContact OD1-CA 3.31Å; N58-G61 WeakPolarHBondContact OD1-CA 3.36Å; N58-G61 PolarHBondContact OD1-N 3.17Å; N58-K62 WeakPolarHBondContact CA-O 3.38Å; N58-K62 PolarHBondContact OD1-N 3.02Å; N58-K62 PolarHBondContact OD1-O 3.31Å
59	I	92.1	Very high	91	Very high	8 Å²	8	65.9 Å²	65.9	4%	0.041	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	109.6	-176.9	-55.3	178.8	0	0	0	107.5	L57 G61 K62 V64 L170 C173 K174 M177	L57-I59 HydrophobicContact CB-CG1 4.26Å; I59-G61 VanDerWaalsContact C-N 3.27Å; I59-G61 PolarHBondContact O-N 3.46Å; I59-K62 PolarHBondContact N-O 3.24Å; I59-K62 WeakPolarHBondContact O-CB 3.23Å; I59-K62 PolarHBondContact O-N 2.81Å; I59-V64 HydrophobicContact CD1-CG2 4.08Å; I59-V64 HydrophobicContact CG1-CG2 4.37Å; I59-L170 HydrophobicContact CD1-CD1 3.86Å; I59-L170 HydrophobicContact CG1-CD1 3.95Å; I59-L170 HydrophobicContact CG2-CD1 4.44Å; I59-C173 HydrophobicContact CD1-CB 3.44Å; I59-C173 VanDerWaalsContact CD1-CB 3.44Å; I59-K174 HydrophobicContact CG2-CG 3.92Å; I59-M177 HydrophobicContact CB-SD 4.14Å; I59-M177 HydrophobicContact CD1-SD 4.11Å; I59-M177 HydrophobicContact CG2-SD 4.29Å
60	T	87.5	Confident	91.9	Very high	137 Å²	137	58.1 Å²	58.1	84%	0.84	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.8	42.4	177.7	-39.3	0	0	0	0	112.6	K62	T60-K62 VanDerWaalsContact C-N 3.26Å; T60-K62 PolarHBondContact O-N 3.05Å
61	G	87.4	Confident	92.4	Very high	53 Å²	53	57.1 Å²	57.1	55%	0.546	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	78.2	0.1	-179.8	0	0	0	0	0	115.5	N58 I59	N58-G61 VanDerWaalsContact OD1-CA 3.31Å; N58-G61 WeakPolarHBondContact OD1-CA 3.36Å; N58-G61 PolarHBondContact OD1-N 3.17Å; I59-G61 VanDerWaalsContact C-N 3.27Å; I59-G61 PolarHBondContact O-N 3.46Å
62	K	92.1	Very high	92.1	Very high	61 Å²	61	55.9 Å²	55.9	27%	0.265	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	134	174.3	-65.8	165.1	173.7	178.2	0	109.5	Y14 N58 I59 T60 M177 Q181	Y14-K62 HydrophobicContact CD2-CB 4.33Å; Y14-K62 HydrophobicContact CE2-CB 4.08Å; Y14-K62 HydrophobicContact CE2-CD 3.82Å; Y14-K62 HydrophobicContact CE2-CG 4.17Å; N58-K62 WeakPolarHBondContact CA-O 3.38Å; N58-K62 PolarHBondContact OD1-N 3.02Å; N58-K62 PolarHBondContact OD1-O 3.31Å; I59-K62 PolarHBondContact N-O 3.24Å; I59-K62 WeakPolarHBondContact O-CB 3.23Å; I59-K62 PolarHBondContact O-N 2.81Å; T60-K62 VanDerWaalsContact C-N 3.26Å; T60-K62 PolarHBondContact O-N 3.05Å; K62-M177 HydrophobicContact CB-CE 3.61Å; K62-M177 HydrophobicContact CD-CE 3.32Å; K62-M177 HydrophobicContact CG-CE 4.09Å; K62-Q181 VanDerWaalsContact NZ-CD 3.32Å; K62-Q181 VanDerWaalsContact NZ-OE1 3.16Å
63	R	94.9	Very high	91.1	Very high	165 Å²	165	51.1 Å²	51.1	62%	0.623	27%	0.271	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.2	136.2	177.9	-66.3	179.7	178.3	-179.7	-0.6	109.4	R12 T13 Y14	R12-R63 PolarHBondContact O-N 3.39Å; R12-R63 VanDerWaalsContact O-N 3.09Å; T13-R63 CarbonylContact C-O 3.37Å; T13-R63 VanDerWaalsContact CA-O 3.31Å; T13-R63 WeakPolarHBondContact CA-O 3.44Å; T13-R63 HydrophobicContact CG2-CB 4.14Å; Y14-R63 PolarHBondContact N-O 3.49Å
64	V	96.7	Very high	89.7	Confident	1 Å²	1	52.1 Å²	52.1	1%	0.006	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	123	175.5	-179.8	0	0	0	0	109	Y14 F16 K56 L57 I59 M177	Y14-V64 CarbonylContact O-C 3.53Å; Y14-V64 WeakPolarHBondContact O-CA 3.31Å; F16-V64 HydrophobicContact CD2-CG1 3.7Å; F16-V64 HydrophobicContact CE2-CG1 4.15Å; K56-V64 CarbonylContact C-O 3.36Å; K56-V64 WeakPolarHBondContact CA-O 3.4Å; L57-V64 HydrophobicContact CB-CB 4.25Å; L57-V64 PolarHBondContact N-O 3.26Å; L57-V64 PolarHBondContact O-N 2.62Å; I59-V64 HydrophobicContact CD1-CG2 4.08Å; I59-V64 HydrophobicContact CG1-CG2 4.37Å; V64-M177 HydrophobicContact CG2-CE 4.39Å; V64-M177 HydrophobicContact CG2-CG 4.33Å; V64-M177 HydrophobicContact CG2-SD 3.58Å; V64-M177 VanDerWaalsContact CG2-SD 3.58Å
65	N	96.7	Very high	88	Confident	50 Å²	50	54 Å²	54	27%	0.267	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	106.4	167.9	-62.5	-37.6	0	0	0	107.7	T13 Y14 S15 F16	T13-N65 WeakPolarHBondContact CG2-ND2 3.4Å; Y14-N65 PolarHBondContact O-N 2.99Å; S15-N65 WeakPolarHBondContact CA-O 3.28Å; F16-N65 PolarHBondContact N-O 2.86Å
66	L	97.4	Very high	86.3	Confident	0 Å²	0	61.1 Å²	61.1	0%	0	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	113.9	-179.8	-173.3	68.2	0	0	0	109.8	F16 V18 Y35 T54 K55 L57 I68 F169 M176	F16-L66 HydrophobicContact CB-CD1 4.09Å; V18-L66 HydrophobicContact CB-CD1 4.27Å; V18-L66 HydrophobicContact CG2-CD1 3.64Å; Y35-L66 HydrophobicContact CE1-CD2 4.14Å; T54-L66 CarbonylContact C-O 3.52Å; T54-L66 VanDerWaalsContact CA-O 3.29Å; T54-L66 WeakPolarHBondContact CA-O 3.47Å; K55-L66 PolarHBondContact N-O 2.8Å; K55-L66 WeakPolarHBondContact O-CB 3.32Å; K55-L66 PolarHBondContact O-N 3.45Å; L57-L66 HydrophobicContact CD1-CD2 4.44Å; L66-I68 HydrophobicContact CD2-CD1 3.9Å; L66-I68 HydrophobicContact CD2-CG1 3.87Å; L66-I68 HydrophobicContact CG-CD1 4.36Å; L66-I68 HydrophobicContact CG-CG1 3.83Å; L66-F169 HydrophobicContact CD2-CD1 3.99Å; L66-M176 HydrophobicContact CD1-CE 4.02Å
67	A	96.6	Very high	84.7	Confident	21 Å²	21	56.9 Å²	56.9	17%	0.174	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	116.7	169.6	0	0	0	0	0	109.4	F16 K17 V18 F52	F16-A67 PolarHBondContact O-N 3.35Å; K17-A67 CarbonylContact C-O 3.56Å; K17-A67 WeakPolarHBondContact CA-O 3.49Å; V18-A67 PolarHBondContact N-O 3.39Å; F52-A67 HydrophobicContact CE2-CB 3.61Å; F52-A67 HydrophobicContact CZ-CB 3.97Å
68	I	95.8	Very high	83.4	Confident	0 Å²	0	60 Å²	60	0%	0	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	120.4	-175.7	-52.9	174.2	0	0	0	108.8	V18 L20 V32 Y35 F52 L53 L66 F169	V18-I68 WeakPolarHBondContact O-CA 3.33Å; L20-I68 HydrophobicContact CD1-CG2 3.42Å; L20-I68 VanDerWaalsContact CD1-CG2 3.42Å; V32-I68 HydrophobicContact CG1-CG2 3.96Å; V32-I68 HydrophobicContact CG2-CG2 3.89Å; Y35-I68 HydrophobicContact CD1-CD1 3.86Å; Y35-I68 HydrophobicContact CE1-CD1 3.95Å; F52-I68 WeakPolarHBondContact CA-O 3.49Å; L53-I68 PolarHBondContact N-O 2.93Å; L53-I68 PolarHBondContact O-N 3.09Å; L66-I68 HydrophobicContact CD2-CD1 3.9Å; L66-I68 HydrophobicContact CD2-CG1 3.87Å; L66-I68 HydrophobicContact CG-CD1 4.36Å; L66-I68 HydrophobicContact CG-CG1 3.83Å; I68-F169 HydrophobicContact CD1-CE1 4Å
69	W	93.4	Very high	81.8	Confident	71 Å²	71	58.6 Å²	58.6	27%	0.269	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	106.4	175.5	-70.1	76.5	0	0	0	109.3	V18 V19 L20 F52 Y84	V18-W69 PolarHBondContact O-N 3.44Å; V19-W69 HydrophobicContact CB-CB 4.35Å; V19-W69 HydrophobicContact CG2-CB 4.16Å; L20-W69 PolarHBondContact N-O 3.04Å; F52-W69 HydrophobicContact CD2-CD2 4.15Å; F52-W69 AromaticContact CD2-CE2 3.67Å; F52-W69 HydrophobicContact CD2-CG 4.45Å; F52-W69 AromaticContact CD2-CZ2 3.97Å; F52-W69 HydrophobicContact CD2-CZ2 3.97Å; F52-W69 AromaticContact CD2-NE1 3.65Å; F52-W69 HydrophobicContact CE2-CZ2 4.35Å; F52-W69 AromaticContact CE2-NE1 3.73Å; W69-Y84 AromaticContact CE3-CD1 3.85Å; W69-Y84 HydrophobicContact CE3-CD1 3.85Å; W69-Y84 HydrophobicContact CE3-CE1 4.46Å; W69-Y84 AromaticContact CZ3-CD1 3.96Å; W69-Y84 HydrophobicContact CZ3-CD1 3.96Å; W69-Y84 HydrophobicContact CZ3-CE1 4.29Å
70	D	91.1	Very high	80.5	Confident	0 Å²	0	61.4 Å²	61.4	0%	0	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	116.8	171	178.5	39.6	0	0	0	108.7	K28 T29 V32 A50 S51	K28-D70 WeakPolarHBondContact CB-OD1 3.28Å; T29-D70 WeakPolarHBondContact CA-OD2 3.38Å; T29-D70 VanDerWaalsContact CB-OD2 3.26Å; T29-D70 WeakPolarHBondContact CB-OD2 3.36Å; T29-D70 WeakPolarHBondContact CG2-OD2 3.46Å; T29-D70 PolarHBondContact N-OD1 3.12Å; T29-D70 PolarHBondContact OG1-OD1 2.98Å; T29-D70 PolarHBondContact OG1-OD2 2.96Å; V32-D70 HydrophobicContact CG2-CB 4.28Å; A50-D70 CarbonylContact C-O 3.57Å; A50-D70 WeakPolarHBondContact CA-O 3.48Å; A50-D70 WeakPolarHBondContact CB-O 3.33Å; S51-D70 PolarHBondContact N-O 3.42Å; S51-D70 PolarHBondContact O-N 3.41Å; S51-D70 WeakPolarHBondContact OG-CB 3.48Å; S51-D70 PolarHBondContact OG-OD2 2.58Å
71	T	86.3	Confident	79.8	Confident	8 Å²	8	55.1 Å²	55.1	5%	0.049	28%	0.282	C	S	.	.	P	Polyproline II helix	trans	-99.4	150.8	-176.2	66.3	0	0	0	0	111.7	V19 L20 L21 K28 G73 Y84	V19-T71 HydrophobicContact CG2-CG2 3.73Å; L20-T71 WeakPolarHBondContact O-CG2 3.41Å; L20-T71 PolarHBondContact O-OG1 3.02Å; L21-T71 HydrophobicContact CD2-CG2 4.1Å; K28-T71 WeakPolarHBondContact CE-O 3.44Å; T71-G73 PolarHBondContact O-N 3.03Å; T71-Y84 HydrophobicContact CG2-CD2 4.26Å; T71-Y84 HydrophobicContact CG2-CG 4.03Å
72	A	78.3	Confident	79.4	Confident	18 Å²	18	54.5 Å²	54.5	15%	0.149	27%	0.268	C	S	.	.	P	Polyproline II helix	trans	-64.5	124	167.7	0	0	0	0	0	108.9	T47 Q74 F77	T47-A72 VanDerWaalsContact O-CB 3.29Å; T47-A72 WeakPolarHBondContact O-CB 3.11Å; A72-Q74 PolarHBondContact O-N 3.47Å; A72-F77 HydrophobicContact CB-CD2 4.03Å
73	G	65.8	Low	78.8	Confident	12 Å²	12	56.4 Å²	56.4	12%	0.124	28%	0.28	C	S	.	.			trans	-77	7.3	179.5	0	0	0	0	0	115	G22 E23 G24 T71	G22-G73 VanDerWaalsContact O-CA 3.24Å; G22-G73 WeakPolarHBondContact O-CA 3.2Å; E23-G73 CarbonylContact C-O 3.55Å; G24-G73 PolarHBondContact N-O 3.3Å; T71-G73 PolarHBondContact O-N 3.03Å
74	Q	62.2	Low	78.2	Confident	50 Å²	50	51 Å²	51	23%	0.234	26%	0.26	C	S	.	.			trans	-81.7	124.5	-178.1	-65.7	-163.3	-3.5	0	0	110.5	A72 R76 F77	A72-Q74 PolarHBondContact O-N 3.47Å; Q74-R76 PolarHBondContact O-N 3.44Å; Q74-F77 HydrophobicContact CB-CD2 3.86Å; Q74-F77 HydrophobicContact CB-CE2 4.13Å; Q74-F77 PolarHBondContact O-N 3.32Å
75	E	57.8	Low	77.6	Confident	120 Å²	120	51.2 Å²	51.2	56%	0.561	26%	0.261	S	S	*	.	G	3₁₀ helix	trans	-49.9	-28.1	174.3	63.4	-132.3	158.7	0	0	114.6	F77 H78 K105	E75-F77 PolarHBondContact O-N 3.24Å; E75-F77 VanDerWaalsContact O-N 3.14Å; E75-H78 WeakPolarHBondContact O-CB 3.45Å; E75-H78 PolarHBondContact O-N 2.99Å; E75-K105 IonicContact OE2-NZ 3.68Å; E75-K105 PolarHBondContact OE2-NZ 3.43Å; E75-K105 VanDerWaalsContact OE2-NZ 3.09Å
76	R	58.8	Low	77.1	Confident	195 Å²	195	55 Å²	55	74%	0.736	27%	0.271	S	S	*	.	G	3₁₀ helix	trans	-62.4	-20.3	175.7	-64.8	-174	-66.2	-177.8	-1.4	113.5	Q74	Q74-R76 PolarHBondContact O-N 3.44Å
77	F	61.8	Low	76.7	Confident	79 Å²	79	61 Å²	61	35%	0.346	30%	0.303	S	S	.	.	G	3₁₀ helix	trans	-100.6	9.9	176.9	-57.9	-62.2	0	0	0	113.3	A72 Q74 E75 A79 L80	A72-F77 HydrophobicContact CB-CD2 4.03Å; Q74-F77 HydrophobicContact CB-CD2 3.86Å; Q74-F77 HydrophobicContact CB-CE2 4.13Å; Q74-F77 PolarHBondContact O-N 3.32Å; E75-F77 PolarHBondContact O-N 3.24Å; E75-F77 VanDerWaalsContact O-N 3.14Å; F77-A79 PolarHBondContact O-N 3.43Å; F77-A79 VanDerWaalsContact O-N 3.15Å; F77-L80 HydrophobicContact CB-CD1 4.38Å; F77-L80 HydrophobicContact CD1-CD1 4.09Å; F77-L80 WeakPolarHBondContact O-CA 3.38Å; F77-L80 WeakPolarHBondContact O-CB 3.17Å; F77-L80 PolarHBondContact O-N 2.72Å
78	H	64.6	Low	76.6	Confident	92 Å²	92	60.4 Å²	60.4	43%	0.426	30%	0.298	S	S	.	.	G	3₁₀ helix	trans	-55.7	-33.6	-179.9	-173.9	80.5	0	0	0	112.9	E75 L80 G81 W109 E112	E75-H78 WeakPolarHBondContact O-CB 3.45Å; E75-H78 PolarHBondContact O-N 2.99Å; H78-L80 PolarHBondContact O-N 3.09Å; H78-L80 VanDerWaalsContact O-N 3.16Å; H78-G81 WeakPolarHBondContact O-CA 3.46Å; H78-G81 PolarHBondContact O-N 3.06Å; H78-W109 AromaticContact CE1-CH2 3.99Å; H78-W109 AromaticContact CE1-CZ3 3.99Å; H78-W109 AromaticContact ND1-CH2 3.36Å; H78-W109 WeakPolarHBondContact ND1-CH2 3.47Å; H78-W109 AromaticContact ND1-CZ2 3.99Å; H78-W109 AromaticContact ND1-CZ3 3.8Å; H78-E112 IonicContact CE1-OE1 2.78Å; H78-E112 IonicContact CE1-OE2 3.24Å; H78-E112 PolarHBondContact CE1-OE2 3.25Å; H78-E112 IonicContact ND1-OE2 2.77Å; H78-E112 IonicContact NE2-OE2 2.83Å
79	A	61.3	Low	76.6	Confident	90 Å²	90	63.6 Å²	63.6	74%	0.744	32%	0.315	S	S	*	.	G	3₁₀ helix	trans	-61.3	-22.4	174.2	0	0	0	0	0	114.1	F77	F77-A79 PolarHBondContact O-N 3.43Å; F77-A79 VanDerWaalsContact O-N 3.15Å
80	L	64.9	Low	76.8	Confident	66 Å²	66	60.2 Å²	60.2	35%	0.346	30%	0.303	S	S	.	.	G	3₁₀ helix	trans	-86.5	-9.2	174	-57.8	178.6	0	0	0	112.6	F77 H78 I83 Y84	F77-L80 HydrophobicContact CB-CD1 4.38Å; F77-L80 HydrophobicContact CD1-CD1 4.09Å; F77-L80 WeakPolarHBondContact O-CA 3.38Å; F77-L80 WeakPolarHBondContact O-CB 3.17Å; F77-L80 PolarHBondContact O-N 2.72Å; H78-L80 PolarHBondContact O-N 3.09Å; H78-L80 VanDerWaalsContact O-N 3.16Å; L80-I83 HydrophobicContact CD2-CD1 4.1Å; L80-I83 WeakPolarHBondContact O-CB 3.33Å; L80-I83 PolarHBondContact O-N 3.04Å; L80-Y84 HydrophobicContact CB-CD2 4.33Å; L80-Y84 HydrophobicContact CB-CE2 3.71Å; L80-Y84 VanDerWaalsContact O-CD2 3.32Å; L80-Y84 WeakPolarHBondContact O-CD2 3.28Å
81	G	71.8	Confident	77	Confident	5 Å²	5	60.2 Å²	60.2	5%	0.052	30%	0.303	C	S	.	.	H	α-helix	trans	-46.5	-54.5	179.9	0	0	0	0	0	113.4	H78 I83 Y84 Y85	H78-G81 WeakPolarHBondContact O-CA 3.46Å; H78-G81 PolarHBondContact O-N 3.06Å; G81-I83 PolarHBondContact O-N 3.23Å; G81-Y84 PolarHBondContact O-N 2.88Å; G81-Y85 VanDerWaalsContact C-CD1 3.45Å; G81-Y85 WeakPolarHBondContact O-CD1 3.34Å; G81-Y85 WeakPolarHBondContact O-CE1 3.3Å; G81-Y85 PolarHBondContact O-N 3.03Å
82	P	79.3	Confident	77.6	Confident	40 Å²	40	59.9 Å²	59.9	26%	0.26	30%	0.3	S	S	.	.	H	α-helix	trans	-55.3	-25.2	179.9	-25.4	30.7	0	0	0	115	Y85 R86	P82-Y85 VanDerWaalsContact CA-CZ 3.4Å; P82-Y85 WeakPolarHBondContact CA-OH 3.5Å; P82-Y85 WeakPolarHBondContact CG-OH 3.29Å; P82-R86 VanDerWaalsContact O-CB 3.25Å; P82-R86 WeakPolarHBondContact O-CB 3.26Å
83	I	80.5	Confident	78.5	Confident	101 Å²	101	59 Å²	59	52%	0.518	29%	0.293	S	S	.	.	H	α-helix	trans	-75.4	-35.6	178.8	-58.2	172.5	0	0	0	110.4	L80 G81	L80-I83 HydrophobicContact CD2-CD1 4.1Å; L80-I83 WeakPolarHBondContact O-CB 3.33Å; L80-I83 PolarHBondContact O-N 3.04Å; G81-I83 PolarHBondContact O-N 3.23Å
84	Y	81.4	Confident	80	Confident	53 Å²	53	58.5 Å²	58.5	21%	0.208	29%	0.287	C	S	.	.	H	α-helix	trans	-82.4	-45.9	-174.4	-63.8	-56.7	0	0	0	113.2	K17 A50 W69 T71 L80 G81	K17-Y84 WeakPolarHBondContact CE-O 3.17Å; K17-Y84 PolarHBondContact NZ-O 3.22Å; A50-Y84 HydrophobicContact CB-CD1 3.85Å; A50-Y84 HydrophobicContact CB-CE1 3.28Å; A50-Y84 HydrophobicContact CB-CE2 4.26Å; W69-Y84 AromaticContact CE3-CD1 3.85Å; W69-Y84 HydrophobicContact CE3-CD1 3.85Å; W69-Y84 HydrophobicContact CE3-CE1 4.46Å; W69-Y84 AromaticContact CZ3-CD1 3.96Å; W69-Y84 HydrophobicContact CZ3-CD1 3.96Å; W69-Y84 HydrophobicContact CZ3-CE1 4.29Å; T71-Y84 HydrophobicContact CG2-CD2 4.26Å; T71-Y84 HydrophobicContact CG2-CG 4.03Å; L80-Y84 HydrophobicContact CB-CD2 4.33Å; L80-Y84 HydrophobicContact CB-CE2 3.71Å; L80-Y84 VanDerWaalsContact O-CD2 3.32Å; L80-Y84 WeakPolarHBondContact O-CD2 3.28Å; G81-Y84 PolarHBondContact O-N 2.88Å
85	Y	83.3	Confident	81.8	Confident	4 Å²	4	56.1 Å²	56.1	2%	0.016	28%	0.276	C	S	.	.	H	α-helix	trans	-87.4	-11.5	-175.4	59.7	-112.5	0	0	0	114.5	L21 G81 P82 D87 S88 E112 L113 M116 L117	L21-Y85 HydrophobicContact CD1-CD1 4.41Å; G81-Y85 VanDerWaalsContact C-CD1 3.45Å; G81-Y85 WeakPolarHBondContact O-CD1 3.34Å; G81-Y85 WeakPolarHBondContact O-CE1 3.3Å; G81-Y85 PolarHBondContact O-N 3.03Å; P82-Y85 VanDerWaalsContact CA-CZ 3.4Å; P82-Y85 WeakPolarHBondContact CA-OH 3.5Å; P82-Y85 WeakPolarHBondContact CG-OH 3.29Å; Y85-D87 PolarHBondContact O-N 2.65Å; Y85-S88 VanDerWaalsContact C-OG 3.29Å; Y85-S88 WeakPolarHBondContact CA-OG 3.46Å; Y85-S88 VanDerWaalsContact O-CB 3.23Å; Y85-S88 WeakPolarHBondContact O-CB 3.36Å; Y85-S88 PolarHBondContact O-N 3.49Å; Y85-S88 VanDerWaalsContact O-N 3.11Å; Y85-S88 PolarHBondContact O-OG 3.2Å; Y85-E112 VanDerWaalsContact CE1-OE1 3.3Å; Y85-E112 WeakPolarHBondContact CE1-OE1 3.45Å; Y85-E112 PolarHBondContact OH-OE1 3.28Å; Y85-E112 VanDerWaalsContact OH-OE1 3.07Å; Y85-L113 HydrophobicContact CD1-CD2 4.2Å; Y85-L113 HydrophobicContact CD2-CD2 4.02Å; Y85-L113 HydrophobicContact CG-CD2 3.75Å; Y85-M116 HydrophobicContact CE2-CB 3.79Å; Y85-M116 HydrophobicContact CE2-CG 3.94Å; Y85-L117 HydrophobicContact CD2-CD1 4.2Å; Y85-L117 HydrophobicContact CD2-CG 4.43Å; Y85-L117 WeakPolarHBondContact O-CD1 3.36Å
86	R	87.6	Confident	83.7	Confident	130 Å²	130	50.9 Å²	50.9	49%	0.491	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.6	137.4	175.1	-176.5	-174.7	-65.3	131	0.9	111	K17 P82 S88	K17-R86 PolarHBondContact NZ-O 3.18Å; P82-R86 VanDerWaalsContact O-CB 3.25Å; P82-R86 WeakPolarHBondContact O-CB 3.26Å; R86-S88 PolarHBondContact O-N 3.45Å; R86-S88 VanDerWaalsContact O-N 3.16Å
87	D	88.8	Confident	85.6	Confident	125 Å²	125	41.6 Å²	41.6	67%	0.668	22%	0.217	S	C	*	.	T	Hydrogen-bonded Turn	trans	59.2	20.7	-179.7	-46.1	-39.8	0	0	0	114.5	Y85	Y85-D87 PolarHBondContact O-N 2.65Å
88	S	93.8	Very high	87.3	Confident	10 Å²	10	39.4 Å²	39.4	7%	0.07	21%	0.211	C	C	.	.			trans	-76.1	130.4	175.1	-55.5	0	0	0	0	110.5	K17 Y85 R86	K17-S88 WeakPolarHBondContact CE-OG 3.14Å; Y85-S88 VanDerWaalsContact C-OG 3.29Å; Y85-S88 WeakPolarHBondContact CA-OG 3.46Å; Y85-S88 VanDerWaalsContact O-CB 3.23Å; Y85-S88 WeakPolarHBondContact O-CB 3.36Å; Y85-S88 PolarHBondContact O-N 3.49Å; Y85-S88 VanDerWaalsContact O-N 3.11Å; Y85-S88 PolarHBondContact O-OG 3.2Å; R86-S88 PolarHBondContact O-N 3.45Å; R86-S88 VanDerWaalsContact O-N 3.16Å
89	N	96	Very high	88.9	Confident	67 Å²	67	37.7 Å²	37.7	36%	0.358	21%	0.205	S	C	.	.	S	Bend	trans	-76.6	-28.1	173.6	-54.6	105	0	0	0	111.5	F16 K17 C122 M176	F16-N89 WeakPolarHBondContact CA-OD1 3.38Å; F16-N89 HydrophobicContact CB-CB 4.36Å; F16-N89 HydrophobicContact CD1-CB 3.89Å; K17-N89 PolarHBondContact N-OD1 3.48Å; K17-N89 PolarHBondContact O-N 3Å; N89-C122 PolarHBondContact O-N 3.22Å; N89-M176 VanDerWaalsContact C-SD 3.59Å; N89-M176 HydrophobicContact CB-CG 4.3Å; N89-M176 HydrophobicContact CB-SD 3.55Å; N89-M176 VanDerWaalsContact CB-SD 3.55Å
90	G	96.7	Very high	90.6	Very high	0 Å²	0	39 Å²	39	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	157.3	176.9	0	0	0	0	0	113	K17 V18 V19 C122	K17-G90 PolarHBondContact O-N 3.41Å; V18-G90 VanDerWaalsContact CA-O 3.32Å; V18-G90 WeakPolarHBondContact CA-O 3.39Å; V19-G90 PolarHBondContact N-O 3.03Å; V19-G90 VanDerWaalsContact N-O 3.16Å; G90-C122 CarbonylContact C-O 3.55Å; G90-C122 WeakPolarHBondContact CA-O 3.46Å
91	A	96.8	Very high	92.1	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	139	172.1	0	0	0	0	0	111	V19 L113 I121 C122 L123 C124	V19-A91 HydrophobicContact CG1-CB 3.88Å; V19-A91 WeakPolarHBondContact O-CA 3.49Å; A91-L113 HydrophobicContact CB-CD1 3.51Å; A91-I121 HydrophobicContact CB-CD1 3.71Å; A91-I121 HydrophobicContact CB-CG1 4.4Å; A91-C122 PolarHBondContact N-O 3.05Å; A91-L123 HydrophobicContact CB-CD2 3.88Å; A91-C124 PolarHBondContact O-N 3.31Å
92	I	98.1	Very high	93.3	Very high	1 Å²	1	41.5 Å²	41.5	1%	0.005	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	110.8	173.6	-60.3	175	0	0	0	107	V18 V19 L20 L21 V94 V126 L168 F169 L172	V18-I92 HydrophobicContact CG1-CD1 3.79Å; V18-I92 HydrophobicContact CG1-CG1 3.84Å; V19-I92 PolarHBondContact O-N 3.39Å; L20-I92 WeakPolarHBondContact CA-O 3.31Å; L20-I92 HydrophobicContact CG-CB 4.13Å; L20-I92 HydrophobicContact CG-CG2 4.46Å; L21-I92 PolarHBondContact N-O 3.03Å; I92-V94 HydrophobicContact CG2-CG2 3.82Å; I92-V126 HydrophobicContact CG2-CB 4.36Å; I92-V126 HydrophobicContact CG2-CG2 3.51Å; I92-L168 HydrophobicContact CD1-CD2 4.4Å; I92-L168 HydrophobicContact CD1-CG 4.49Å; I92-L168 HydrophobicContact CG2-CD2 4.24Å; I92-F169 HydrophobicContact CD1-CD1 4.04Å; I92-F169 HydrophobicContact CD1-CE1 3.49Å; I92-F169 VanDerWaalsContact CD1-CE1 3.49Å; I92-F169 HydrophobicContact CD1-CE2 4.49Å; I92-F169 HydrophobicContact CD1-CZ 3.74Å; I92-L172 HydrophobicContact CD1-CD2 3.8Å; I92-L172 HydrophobicContact CG1-CD2 3.59Å
93	L	97.3	Very high	94.1	Very high	0 Å²	0	40 Å²	40	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	108.7	-179.6	-55.7	-179.4	0	0	0	108.9	L21 V106 W109 V110 L113 C124 I125 V126	L21-L93 HydrophobicContact CB-CD2 3.73Å; L21-L93 HydrophobicContact CD1-CD2 4.05Å; L21-L93 HydrophobicContact CG-CD2 4.39Å; L21-L93 WeakPolarHBondContact O-CA 3.17Å; L93-V106 HydrophobicContact CB-CG1 3.78Å; L93-V106 HydrophobicContact CB-CG2 4.16Å; L93-V106 HydrophobicContact CD1-CG1 4.14Å; L93-W109 HydrophobicContact CD1-CB 4.48Å; L93-W109 HydrophobicContact CD2-CB 3.87Å; L93-V110 HydrophobicContact CD1-CB 4.34Å; L93-V110 HydrophobicContact CD1-CG2 3.29Å; L93-L113 HydrophobicContact CD1-CD1 4.49Å; L93-L113 HydrophobicContact CD2-CD1 3.87Å; L93-C124 PolarHBondContact N-O 3.41Å; L93-I125 HydrophobicContact CB-CG1 4.42Å; L93-I125 HydrophobicContact CD1-CG1 4.44Å; L93-I125 CarbonylContact O-C 3.55Å; L93-I125 WeakPolarHBondContact O-CA 3.38Å; L93-V126 PolarHBondContact O-N 3.37Å
94	V	98.2	Very high	94.9	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	130.8	-171.6	-170.3	0	0	0	0	110.1	L20 L21 G22 V26 K28 L31 I92 V126 N128	L20-V94 HydrophobicContact CD2-CG2 4.48Å; L21-V94 PolarHBondContact O-N 3.26Å; G22-V94 WeakPolarHBondContact CA-O 3.33Å; V26-V94 HydrophobicContact CB-CG1 4.35Å; V26-V94 HydrophobicContact CG2-CB 4.01Å; V26-V94 HydrophobicContact CG2-CG1 3.92Å; K28-V94 HydrophobicContact CG-CB 3.97Å; K28-V94 HydrophobicContact CG-CG2 3.97Å; L31-V94 HydrophobicContact CD1-CG1 3.84Å; L31-V94 HydrophobicContact CD1-CG2 3.96Å; I92-V94 HydrophobicContact CG2-CG2 3.82Å; V94-V126 WeakPolarHBondContact CA-O 3.34Å; V94-V126 HydrophobicContact CG2-CB 4.34Å; V94-N128 HydrophobicContact CG1-CB 3.81Å
95	Y	98.3	Very high	95.5	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	163.4	166.8	72.4	-83.6	0	0	0	110	I97 S102 F103 V106 I125 V126 G127 N128 V138 A143 H154	Y95-I97 HydrophobicContact CE2-CG2 4.04Å; Y95-S102 WeakPolarHBondContact CB-OG 3.21Å; Y95-F103 AromaticContact CD1-CD2 3.74Å; Y95-F103 HydrophobicContact CD1-CD2 3.74Å; Y95-F103 HydrophobicContact CD1-CE2 4.39Å; Y95-F103 HydrophobicContact CD2-CB 3.94Å; Y95-F103 HydrophobicContact CD2-CD2 4.05Å; Y95-F103 HydrophobicContact CD2-CG 4.37Å; Y95-F103 AromaticContact CE1-CD2 3.85Å; Y95-F103 HydrophobicContact CE1-CD2 3.85Å; Y95-F103 HydrophobicContact CE1-CE2 4.16Å; Y95-F103 HydrophobicContact CE2-CD2 4.17Å; Y95-F103 HydrophobicContact CG-CB 4.12Å; Y95-F103 AromaticContact CG-CD2 3.84Å; Y95-F103 HydrophobicContact CG-CD2 3.84Å; Y95-F103 HydrophobicContact CG-CG 4.45Å; Y95-V106 HydrophobicContact CD1-CG2 4.5Å; Y95-I125 HydrophobicContact CD1-CG2 4.06Å; Y95-I125 HydrophobicContact CE1-CG2 3.83Å; Y95-V126 WeakPolarHBondContact CD1-O 3.34Å; Y95-V126 PolarHBondContact N-O 3.43Å; Y95-G127 VanDerWaalsContact CE1-N 3.29Å; Y95-N128 PolarHBondContact O-N 2.8Å; Y95-V138 HydrophobicContact CD2-CB 4.44Å; Y95-V138 HydrophobicContact CD2-CG1 4.36Å; Y95-V138 HydrophobicContact CD2-CG2 4.13Å; Y95-V138 HydrophobicContact CE2-CB 3.81Å; Y95-V138 HydrophobicContact CE2-CG1 3.61Å; Y95-V138 HydrophobicContact CE2-CG2 4.01Å; Y95-A143 WeakPolarHBondContact OH-CB 3.46Å; Y95-H154 AromaticContact CE1-NE2 3.64Å; Y95-H154 AromaticContact CZ-NE2 3.73Å; Y95-H154 PolarHBondContact OH-NE2 2.95Å
96	D	98.1	Very high	96.1	Very high	10 Å²	10	39.2 Å²	39.2	5%	0.053	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	127.3	173.2	179.7	0.3	0	0	0	109.2	V26 T98 D99 S102 K129	V26-D96 HydrophobicContact CB-CB 4.37Å; V26-D96 HydrophobicContact CG1-CB 4.29Å; D96-T98 PolarHBondContact O-N 3.48Å; D96-T98 VanDerWaalsContact O-N 3.12Å; D96-T98 PolarHBondContact OD1-N 3.29Å; D96-T98 VanDerWaalsContact OD1-N 3.1Å; D96-T98 PolarHBondContact OD1-OG1 2.97Å; D96-T98 PolarHBondContact OD2-OG1 3Å; D96-D99 HydrophobicContact CB-CB 4.08Å; D96-D99 PolarHBondContact O-N 2.82Å; D96-D99 VanDerWaalsContact O-O 3.13Å; D96-S102 PolarHBondContact N-OG 3.44Å; D96-S102 PolarHBondContact O-OG 3.29Å; D96-K129 WeakPolarHBondContact OD1-CD 3.46Å; D96-K129 WeakPolarHBondContact OD2-CD 3.33Å; D96-K129 WeakPolarHBondContact OD2-CE 3.4Å; D96-K129 IonicContact OD2-NZ 2.63Å; D96-K129 PolarHBondContact OD2-NZ 3.18Å
97	I	98.6	Very high	96.5	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	18%	0.179	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-18.4	-178	63.4	154.9	0	0	0	113.6	Y95 N128 K129 I130 R136 H137 V138	Y95-I97 HydrophobicContact CE2-CG2 4.04Å; I97-N128 WeakPolarHBondContact CG2-O 3.37Å; I97-N128 PolarHBondContact N-O 3.23Å; I97-N128 VanDerWaalsContact N-O 3.16Å; I97-K129 WeakPolarHBondContact CD1-O 3Å; I97-I130 HydrophobicContact CD1-CG2 4.45Å; I97-I130 HydrophobicContact CG2-CG2 4.32Å; I97-R136 HydrophobicContact CD1-CB 4.35Å; I97-R136 WeakPolarHBondContact O-CA 3.32Å; I97-H137 PolarHBondContact O-N 3.01Å; I97-V138 PolarHBondContact O-N 3.44Å; I97-V138 VanDerWaalsContact O-N 3.12Å
98	T	98.3	Very high	96.7	Very high	34 Å²	34	33.4 Å²	33.4	21%	0.209	17%	0.169	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.6	0.1	178.2	74.9	0	0	0	0	113	D96 L132 D135 H137	D96-T98 PolarHBondContact O-N 3.48Å; D96-T98 VanDerWaalsContact O-N 3.12Å; D96-T98 PolarHBondContact OD1-N 3.29Å; D96-T98 VanDerWaalsContact OD1-N 3.1Å; D96-T98 PolarHBondContact OD1-OG1 2.97Å; D96-T98 PolarHBondContact OD2-OG1 3Å; T98-L132 HydrophobicContact CG2-CB 3.78Å; T98-L132 HydrophobicContact CG2-CD1 4.15Å; T98-D135 WeakPolarHBondContact CA-O 3.24Å; T98-D135 VanDerWaalsContact CB-O 3.32Å; T98-D135 WeakPolarHBondContact CB-O 3.25Å; T98-D135 HydrophobicContact CG2-CB 4.02Å; T98-D135 WeakPolarHBondContact CG2-O 3.4Å; T98-H137 PolarHBondContact O-ND1 2.81Å
99	D	97.6	Very high	96.7	Very high	56 Å²	56	34.5 Å²	34.5	30%	0.299	17%	0.171	S	C	.	.			trans	-134.1	102.3	-173.7	179.5	-1.2	0	0	0	110.6	D96 D101 S102	D96-D99 HydrophobicContact CB-CB 4.08Å; D96-D99 PolarHBondContact O-N 2.82Å; D96-D99 VanDerWaalsContact O-O 3.13Å; D99-D101 PolarHBondContact O-N 2.93Å; D99-D101 WeakPolarHBondContact OD1-CB 3.16Å; D99-D101 PolarHBondContact OD1-N 2.9Å; D99-D101 VanDerWaalsContact OD1-N 3.09Å; D99-S102 WeakPolarHBondContact O-CB 3.15Å; D99-S102 PolarHBondContact O-N 3.48Å; D99-S102 PolarHBondContact O-OG 2.89Å; D99-S102 PolarHBondContact OD1-N 3.4Å
100	E	96.9	Very high	96.6	Very high	118 Å²	118	31.5 Å²	31.5	55%	0.551	16%	0.156	S	C	*	.	H	α-helix	trans	-65.1	-35.9	-179.3	-168.7	176.4	-171.5	0	0	112.8	S102 F103 E104 V138	E100-S102 PolarHBondContact O-N 2.93Å; E100-F103 WeakPolarHBondContact O-CB 3.5Å; E100-F103 PolarHBondContact O-N 2.87Å; E100-E104 PolarHBondContact O-N 3.22Å; E100-E104 VanDerWaalsContact O-N 3.11Å; E100-V138 HydrophobicContact CB-CG2 4.47Å
101	D	96.3	Very high	96.5	Very high	122 Å²	122	38.1 Å²	38.1	65%	0.652	18%	0.184	S	C	*	.	H	α-helix	trans	-62.3	-37.4	177.8	-72.6	-27.8	0	0	0	110.5	D99 F103 E104 K105	D99-D101 PolarHBondContact O-N 2.93Å; D99-D101 WeakPolarHBondContact OD1-CB 3.16Å; D99-D101 PolarHBondContact OD1-N 2.9Å; D99-D101 VanDerWaalsContact OD1-N 3.09Å; D101-F103 PolarHBondContact O-N 2.83Å; D101-E104 PolarHBondContact O-N 2.85Å; D101-K105 VanDerWaalsContact O-CG 3.25Å; D101-K105 WeakPolarHBondContact O-CG 3.21Å; D101-K105 PolarHBondContact O-N 3.36Å
102	S	96.8	Very high	96.2	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-61.9	-31.3	176	83.1	0	0	0	0	112.9	Y95 D96 D99 E100 V106	Y95-S102 WeakPolarHBondContact CB-OG 3.21Å; D96-S102 PolarHBondContact N-OG 3.44Å; D96-S102 PolarHBondContact O-OG 3.29Å; D99-S102 WeakPolarHBondContact O-CB 3.15Å; D99-S102 PolarHBondContact O-N 3.48Å; D99-S102 PolarHBondContact O-OG 2.89Å; D99-S102 PolarHBondContact OD1-N 3.4Å; E100-S102 PolarHBondContact O-N 2.93Å; S102-V106 PolarHBondContact O-N 3.49Å
103	F	97.9	Very high	95.9	Very high	9 Å²	9	39.8 Å²	39.8	4%	0.039	19%	0.192	C	C	.	.	H	α-helix	trans	-74.9	-40.1	175.2	-178.3	-117.8	0	0	0	111.8	Y95 E100 D101 K105 V106 K107 V138 A143 Y146	Y95-F103 AromaticContact CD1-CD2 3.74Å; Y95-F103 HydrophobicContact CD1-CD2 3.74Å; Y95-F103 HydrophobicContact CD1-CE2 4.39Å; Y95-F103 HydrophobicContact CD2-CB 3.94Å; Y95-F103 HydrophobicContact CD2-CD2 4.05Å; Y95-F103 HydrophobicContact CD2-CG 4.37Å; Y95-F103 AromaticContact CE1-CD2 3.85Å; Y95-F103 HydrophobicContact CE1-CD2 3.85Å; Y95-F103 HydrophobicContact CE1-CE2 4.16Å; Y95-F103 HydrophobicContact CE2-CD2 4.17Å; Y95-F103 HydrophobicContact CG-CB 4.12Å; Y95-F103 AromaticContact CG-CD2 3.84Å; Y95-F103 HydrophobicContact CG-CD2 3.84Å; Y95-F103 HydrophobicContact CG-CG 4.45Å; E100-F103 WeakPolarHBondContact O-CB 3.5Å; E100-F103 PolarHBondContact O-N 2.87Å; D101-F103 PolarHBondContact O-N 2.83Å; F103-K105 PolarHBondContact O-N 3.05Å; F103-V106 WeakPolarHBondContact O-CB 3.46Å; F103-V106 PolarHBondContact O-N 2.94Å; F103-K107 PolarHBondContact O-N 2.91Å; F103-V138 HydrophobicContact CB-CG1 4.21Å; F103-V138 HydrophobicContact CB-CG2 3.97Å; F103-V138 HydrophobicContact CD1-CG1 3.95Å; F103-V138 HydrophobicContact CD2-CG1 4.31Å; F103-V138 HydrophobicContact CE1-CG1 4.4Å; F103-V138 HydrophobicContact CG-CG1 3.9Å; F103-A143 HydrophobicContact CE2-CB 3.96Å; F103-A143 HydrophobicContact CZ-CB 4Å; F103-Y146 HydrophobicContact CE2-CD1 4.24Å; F103-Y146 AromaticContact CZ-CD1 3.9Å; F103-Y146 HydrophobicContact CZ-CD1 3.9Å; F103-Y146 HydrophobicContact CZ-CG 4.16Å
104	E	96.6	Very high	95.5	Very high	77 Å²	77	42.4 Å²	42.4	36%	0.36	20%	0.202	S	C	.	.	H	α-helix	trans	-59.6	-37.7	172.2	-70.4	-54.1	129.3	0	0	112	E100 D101 V106 K107 N108	E100-E104 PolarHBondContact O-N 3.22Å; E100-E104 VanDerWaalsContact O-N 3.11Å; D101-E104 PolarHBondContact O-N 2.85Å; E104-V106 VanDerWaalsContact C-N 3.32Å; E104-V106 PolarHBondContact O-N 2.85Å; E104-K107 WeakPolarHBondContact O-CB 3.35Å; E104-K107 PolarHBondContact O-N 3.05Å; E104-K107 VanDerWaalsContact O-N 3.1Å; E104-K107 WeakPolarHBondContact OE1-CE 3.43Å; E104-K107 IonicContact OE1-NZ 2.81Å; E104-K107 PolarHBondContact OE1-NZ 3.47Å; E104-K107 IonicContact OE2-NZ 2.69Å; E104-N108 PolarHBondContact O-N 2.93Å
105	K	94.1	Very high	95.1	Very high	64 Å²	64	51.1 Å²	51.1	28%	0.278	24%	0.24	S	C	.	.	H	α-helix	trans	-62.7	-37.6	173.9	-65.1	-75.2	-175.4	112.6	0	112.1	E23 E75 D101 F103 K107 N108 W109	E23-K105 HydrophobicContact CB-CB 4.4Å; E23-K105 HydrophobicContact CB-CG 4.39Å; E23-K105 HydrophobicContact CG-CG 4.45Å; E23-K105 WeakPolarHBondContact OE2-CD 3.44Å; E23-K105 WeakPolarHBondContact OE2-CE 3.45Å; E23-K105 WeakPolarHBondContact OE2-CG 3.18Å; E23-K105 IonicContact OE2-NZ 3.45Å; E23-K105 PolarHBondContact OE2-NZ 3.12Å; E75-K105 IonicContact OE2-NZ 3.68Å; E75-K105 PolarHBondContact OE2-NZ 3.43Å; E75-K105 VanDerWaalsContact OE2-NZ 3.09Å; D101-K105 VanDerWaalsContact O-CG 3.25Å; D101-K105 WeakPolarHBondContact O-CG 3.21Å; D101-K105 PolarHBondContact O-N 3.36Å; F103-K105 PolarHBondContact O-N 3.05Å; K105-K107 VanDerWaalsContact C-N 3.29Å; K105-K107 PolarHBondContact O-N 3.4Å; K105-N108 PolarHBondContact O-N 2.93Å; K105-W109 PolarHBondContact O-N 2.94Å
106	V	95.5	Very high	94.6	Very high	0 Å²	0	55.9 Å²	55.9	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-58.7	-41	172.3	162.9	0	0	0	0	111.3	L93 Y95 S102 F103 E104 N108 W109 V110 I125	L93-V106 HydrophobicContact CB-CG1 3.78Å; L93-V106 HydrophobicContact CB-CG2 4.16Å; L93-V106 HydrophobicContact CD1-CG1 4.14Å; Y95-V106 HydrophobicContact CD1-CG2 4.5Å; S102-V106 PolarHBondContact O-N 3.49Å; F103-V106 WeakPolarHBondContact O-CB 3.46Å; F103-V106 PolarHBondContact O-N 2.94Å; E104-V106 VanDerWaalsContact C-N 3.32Å; E104-V106 PolarHBondContact O-N 2.85Å; V106-N108 VanDerWaalsContact C-N 3.27Å; V106-N108 PolarHBondContact O-N 3.39Å; V106-W109 PolarHBondContact O-N 3.15Å; V106-W109 VanDerWaalsContact O-N 3.16Å; V106-V110 WeakPolarHBondContact O-CG2 3.23Å; V106-V110 PolarHBondContact O-N 2.79Å; V106-I125 HydrophobicContact CG1-CD1 4.1Å; V106-I125 HydrophobicContact CG1-CG1 4.14Å; V106-I125 HydrophobicContact CG1-CG2 4.15Å
107	K	95.9	Very high	94.1	Very high	48 Å²	48	57.4 Å²	57.4	21%	0.209	27%	0.271	C	S	.	.	H	α-helix	trans	-61.3	-37.9	177.9	-54.3	-174.4	-177.3	161.8	0	112.3	F103 E104 K105 V110 K111 Y146	F103-K107 PolarHBondContact O-N 2.91Å; E104-K107 WeakPolarHBondContact O-CB 3.35Å; E104-K107 PolarHBondContact O-N 3.05Å; E104-K107 VanDerWaalsContact O-N 3.1Å; E104-K107 WeakPolarHBondContact OE1-CE 3.43Å; E104-K107 IonicContact OE1-NZ 2.81Å; E104-K107 PolarHBondContact OE1-NZ 3.47Å; E104-K107 IonicContact OE2-NZ 2.69Å; K105-K107 VanDerWaalsContact C-N 3.29Å; K105-K107 PolarHBondContact O-N 3.4Å; K107-V110 PolarHBondContact O-N 3.04Å; K107-K111 WeakPolarHBondContact O-CG 3.08Å; K107-K111 PolarHBondContact O-N 2.8Å; K107-Y146 VanDerWaalsContact CA-OH 3.32Å; K107-Y146 WeakPolarHBondContact CA-OH 3.34Å; K107-Y146 HydrophobicContact CB-CE1 4.34Å; K107-Y146 HydrophobicContact CB-CE2 4.47Å; K107-Y146 HydrophobicContact CD-CD2 4.42Å; K107-Y146 HydrophobicContact CD-CE2 4.12Å; K107-Y146 HydrophobicContact CG-CD1 4.29Å; K107-Y146 HydrophobicContact CG-CE1 3.72Å; K107-Y146 HydrophobicContact CG-CE2 4.01Å
108	N	93.8	Very high	93.5	Very high	85 Å²	85	58.8 Å²	58.8	46%	0.455	29%	0.286	S	S	.	.	H	α-helix	trans	-66.8	-42.7	175.1	-65.3	-27.6	0	0	0	112	E104 K105 V106 V110 K111 E112	E104-N108 PolarHBondContact O-N 2.93Å; K105-N108 PolarHBondContact O-N 2.93Å; V106-N108 VanDerWaalsContact C-N 3.27Å; V106-N108 PolarHBondContact O-N 3.39Å; N108-V110 VanDerWaalsContact C-N 3.33Å; N108-V110 PolarHBondContact O-N 3.42Å; N108-K111 WeakPolarHBondContact O-CB 3.42Å; N108-K111 PolarHBondContact O-N 2.9Å; N108-E112 PolarHBondContact O-N 3.3Å
109	W	93.1	Very high	92.9	Very high	33 Å²	33	63.5 Å²	63.5	13%	0.125	31%	0.309	C	S	.	.	H	α-helix	trans	-61.6	-37.9	175.2	-72.8	118.2	0	0	0	112.9	L21 H78 L93 K105 V106 K111 E112 L113	L21-W109 HydrophobicContact CB-CD2 4.14Å; L21-W109 HydrophobicContact CB-CG 4.21Å; L21-W109 HydrophobicContact CD1-CD2 4.31Å; L21-W109 HydrophobicContact CD1-CE3 3.94Å; L21-W109 HydrophobicContact CD1-CZ3 4.46Å; L21-W109 HydrophobicContact CD2-CZ3 4.39Å; H78-W109 AromaticContact CE1-CH2 3.99Å; H78-W109 AromaticContact CE1-CZ3 3.99Å; H78-W109 AromaticContact ND1-CH2 3.36Å; H78-W109 WeakPolarHBondContact ND1-CH2 3.47Å; H78-W109 AromaticContact ND1-CZ2 3.99Å; H78-W109 AromaticContact ND1-CZ3 3.8Å; L93-W109 HydrophobicContact CD1-CB 4.48Å; L93-W109 HydrophobicContact CD2-CB 3.87Å; K105-W109 PolarHBondContact O-N 2.94Å; V106-W109 PolarHBondContact O-N 3.15Å; V106-W109 VanDerWaalsContact O-N 3.16Å; W109-K111 PolarHBondContact O-N 2.84Å; W109-E112 VanDerWaalsContact CE3-OE2 3.25Å; W109-E112 WeakPolarHBondContact CZ3-OE2 3.45Å; W109-E112 PolarHBondContact O-N 3.49Å; W109-L113 WeakPolarHBondContact O-CB 3.27Å; W109-L113 WeakPolarHBondContact O-CG 3.47Å; W109-L113 PolarHBondContact O-N 3.34Å
110	V	94.5	Very high	92.3	Very high	5 Å²	5	68 Å²	68	3%	0.03	33%	0.329	C	S	.	.	H	α-helix	trans	-57.6	-50.2	173.2	173.8	0	0	0	0	110.5	L93 V106 K107 N108 E112 L113 R114 L123 I125 Y146 V150	L93-V110 HydrophobicContact CD1-CB 4.34Å; L93-V110 HydrophobicContact CD1-CG2 3.29Å; V106-V110 WeakPolarHBondContact O-CG2 3.23Å; V106-V110 PolarHBondContact O-N 2.79Å; K107-V110 PolarHBondContact O-N 3.04Å; N108-V110 VanDerWaalsContact C-N 3.33Å; N108-V110 PolarHBondContact O-N 3.42Å; V110-E112 VanDerWaalsContact C-N 3.31Å; V110-E112 PolarHBondContact O-N 3.3Å; V110-L113 PolarHBondContact O-N 3.2Å; V110-R114 HydrophobicContact CG1-CG 4.29Å; V110-R114 WeakPolarHBondContact O-CB 3.49Å; V110-R114 VanDerWaalsContact O-CG 3.24Å; V110-R114 WeakPolarHBondContact O-CG 3.4Å; V110-R114 PolarHBondContact O-N 3.33Å; V110-L123 HydrophobicContact CG1-CD1 4.37Å; V110-I125 HydrophobicContact CG2-CD1 4.36Å; V110-Y146 HydrophobicContact CG2-CE1 4.26Å; V110-V150 HydrophobicContact CG1-CB 3.96Å; V110-V150 HydrophobicContact CG1-CG1 4.1Å; V110-V150 HydrophobicContact CG1-CG2 4.15Å; V110-V150 HydrophobicContact CG2-CG2 4.44Å
111	K	93.1	Very high	92	Very high	139 Å²	139	62.7 Å²	62.7	60%	0.604	30%	0.304	S	S	*	.	H	α-helix	trans	-59.3	-43.6	-179.6	-67	170.5	-174.2	168.8	0	111.5	K107 N108 W109 K115	K107-K111 WeakPolarHBondContact O-CG 3.08Å; K107-K111 PolarHBondContact O-N 2.8Å; N108-K111 WeakPolarHBondContact O-CB 3.42Å; N108-K111 PolarHBondContact O-N 2.9Å; W109-K111 PolarHBondContact O-N 2.84Å; K111-K115 WeakPolarHBondContact O-CB 3.44Å; K111-K115 PolarHBondContact O-N 3.05Å
112	E	90.9	Very high	92	Very high	34 Å²	34	57.3 Å²	57.3	16%	0.159	28%	0.276	C	S	.	.	H	α-helix	trans	-65.5	-48	179.3	-175.6	178.8	164.9	0	0	112.6	H78 Y85 N108 W109 V110 R114 K115 M116	H78-E112 IonicContact CE1-OE1 2.78Å; H78-E112 IonicContact CE1-OE2 3.24Å; H78-E112 PolarHBondContact CE1-OE2 3.25Å; H78-E112 IonicContact ND1-OE2 2.77Å; H78-E112 IonicContact NE2-OE2 2.83Å; Y85-E112 VanDerWaalsContact CE1-OE1 3.3Å; Y85-E112 WeakPolarHBondContact CE1-OE1 3.45Å; Y85-E112 PolarHBondContact OH-OE1 3.28Å; Y85-E112 VanDerWaalsContact OH-OE1 3.07Å; N108-E112 PolarHBondContact O-N 3.3Å; W109-E112 VanDerWaalsContact CE3-OE2 3.25Å; W109-E112 WeakPolarHBondContact CZ3-OE2 3.45Å; W109-E112 PolarHBondContact O-N 3.49Å; V110-E112 VanDerWaalsContact C-N 3.31Å; V110-E112 PolarHBondContact O-N 3.3Å; E112-R114 VanDerWaalsContact C-N 3.32Å; E112-R114 PolarHBondContact O-N 3.22Å; E112-K115 WeakPolarHBondContact O-CB 3.48Å; E112-K115 PolarHBondContact O-N 3.41Å; E112-M116 WeakPolarHBondContact O-CG 3.32Å; E112-M116 PolarHBondContact O-N 3.11Å
113	L	91.3	Very high	92	Very high	1 Å²	1	57.3 Å²	57.3	1%	0.005	28%	0.276	C	S	.	.	H	α-helix	trans	-60.5	-43.2	177.8	-74.9	177.3	0	0	0	111.6	L21 Y85 A91 L93 W109 V110 K115 M116 L117 I121 L123	L21-L113 HydrophobicContact CD1-CD1 3.98Å; L21-L113 HydrophobicContact CD1-CD2 3.95Å; L21-L113 HydrophobicContact CD1-CG 4.1Å; Y85-L113 HydrophobicContact CD1-CD2 4.2Å; Y85-L113 HydrophobicContact CD2-CD2 4.02Å; Y85-L113 HydrophobicContact CG-CD2 3.75Å; A91-L113 HydrophobicContact CB-CD1 3.51Å; L93-L113 HydrophobicContact CD1-CD1 4.49Å; L93-L113 HydrophobicContact CD2-CD1 3.87Å; W109-L113 WeakPolarHBondContact O-CB 3.27Å; W109-L113 WeakPolarHBondContact O-CG 3.47Å; W109-L113 PolarHBondContact O-N 3.34Å; V110-L113 PolarHBondContact O-N 3.2Å; L113-K115 VanDerWaalsContact C-N 3.34Å; L113-K115 PolarHBondContact O-N 2.94Å; L113-M116 PolarHBondContact O-N 3.07Å; L113-L117 HydrophobicContact CD2-CD1 4Å; L113-L117 WeakPolarHBondContact O-CB 3.33Å; L113-L117 PolarHBondContact O-N 2.99Å; L113-I121 HydrophobicContact CD2-CD1 4.42Å; L113-L123 HydrophobicContact CD1-CD2 3.83Å
114	R	90.4	Very high	92	Very high	56 Å²	56	56.9 Å²	56.9	21%	0.211	27%	0.274	C	S	.	.	H	α-helix	trans	-63.4	-39.9	176.8	-69.8	-66	-168.8	-155.1	6.5	111.9	V110 E112 M116 G118 N119 V150	V110-R114 HydrophobicContact CG1-CG 4.29Å; V110-R114 WeakPolarHBondContact O-CB 3.49Å; V110-R114 VanDerWaalsContact O-CG 3.24Å; V110-R114 WeakPolarHBondContact O-CG 3.4Å; V110-R114 PolarHBondContact O-N 3.33Å; E112-R114 VanDerWaalsContact C-N 3.32Å; E112-R114 PolarHBondContact O-N 3.22Å; R114-M116 VanDerWaalsContact C-N 3.3Å; R114-M116 PolarHBondContact O-N 3.1Å; R114-G118 WeakPolarHBondContact CD-O 3.3Å; R114-G118 VanDerWaalsContact O-CA 3.24Å; R114-G118 WeakPolarHBondContact O-CA 3.4Å; R114-G118 PolarHBondContact O-N 3.43Å; R114-N119 WeakPolarHBondContact CD-OD1 3.25Å; R114-N119 VanDerWaalsContact NH1-CA 3.29Å; R114-N119 PolarHBondContact NH1-O 3.16Å; R114-V150 PolarHBondContact NH2-O 2.85Å
115	K	89.9	Confident	92.1	Very high	182 Å²	182	53.2 Å²	53.2	79%	0.791	26%	0.257	S	S	*	.	H	α-helix	trans	-63	-37	176.3	-177.7	179.9	177.4	-177.1	0	112.3	K111 E112 L113	K111-K115 WeakPolarHBondContact O-CB 3.44Å; K111-K115 PolarHBondContact O-N 3.05Å; E112-K115 WeakPolarHBondContact O-CB 3.48Å; E112-K115 PolarHBondContact O-N 3.41Å; L113-K115 VanDerWaalsContact C-N 3.34Å; L113-K115 PolarHBondContact O-N 2.94Å
116	M	86.8	Confident	92.4	Very high	101 Å²	101	50.2 Å²	50.2	50%	0.498	24%	0.244	S	C	.	.	H	α-helix	trans	-94.3	-36.1	-171.7	-66.7	-64.5	-63	0	0	114.2	Y85 E112 L113 R114	Y85-M116 HydrophobicContact CE2-CB 3.79Å; Y85-M116 HydrophobicContact CE2-CG 3.94Å; E112-M116 WeakPolarHBondContact O-CG 3.32Å; E112-M116 PolarHBondContact O-N 3.11Å; L113-M116 PolarHBondContact O-N 3.07Å; R114-M116 VanDerWaalsContact C-N 3.3Å; R114-M116 PolarHBondContact O-N 3.1Å
117	L	87.5	Confident	92.5	Very high	41 Å²	41	50.2 Å²	50.2	22%	0.215	24%	0.244	C	C	.	.	H	α-helix	trans	-117.1	-1.6	-172.5	-55.1	178	0	0	0	112.9	Y85 L113 I121	Y85-L117 HydrophobicContact CD2-CD1 4.2Å; Y85-L117 HydrophobicContact CD2-CG 4.43Å; Y85-L117 WeakPolarHBondContact O-CD1 3.36Å; L113-L117 HydrophobicContact CD2-CD1 4Å; L113-L117 WeakPolarHBondContact O-CB 3.33Å; L113-L117 PolarHBondContact O-N 2.99Å; L117-I121 HydrophobicContact CB-CG2 4.36Å; L117-I121 HydrophobicContact CD1-CD1 3.55Å
118	G	86.4	Confident	92.6	Very high	30 Å²	30	48.1 Å²	48.1	31%	0.309	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	67.1	-153.3	-178.4	0	0	0	0	0	113.4	R114	R114-G118 WeakPolarHBondContact CD-O 3.3Å; R114-G118 VanDerWaalsContact O-CA 3.24Å; R114-G118 WeakPolarHBondContact O-CA 3.4Å; R114-G118 PolarHBondContact O-N 3.43Å
119	N	85.2	Confident	92.8	Very high	132 Å²	132	45.8 Å²	45.8	71%	0.706	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	-89.7	-4.6	-174.3	-72.4	-14.4	0	0	0	114.5	R114	R114-N119 WeakPolarHBondContact CD-OD1 3.25Å; R114-N119 VanDerWaalsContact NH1-CA 3.29Å; R114-N119 PolarHBondContact NH1-O 3.16Å
120	E	84.6	Confident	93.1	Very high	150 Å²	150	46.1 Å²	46.1	70%	0.701	23%	0.225	S	C	*	.			trans	-78	-22	-171.6	-60.7	-177.9	131.7	0	0	113.2	C122	E120-C122 PolarHBondContact O-N 3.12Å
121	I	92.1	Very high	93.3	Very high	8 Å²	8	48.3 Å²	48.3	4%	0.041	24%	0.236	C	C	.	.	S	Bend	trans	-69.9	129.5	179.3	-173.5	164.6	0	0	0	112	A91 L113 L117 L123	A91-I121 HydrophobicContact CB-CD1 3.71Å; A91-I121 HydrophobicContact CB-CG1 4.4Å; L113-I121 HydrophobicContact CD2-CD1 4.42Å; L117-I121 HydrophobicContact CB-CG2 4.36Å; L117-I121 HydrophobicContact CD1-CD1 3.55Å; I121-L123 HydrophobicContact CD1-CD2 4.39Å; I121-L123 HydrophobicContact CG1-CD2 4.12Å; I121-L123 HydrophobicContact CG2-CD2 3.8Å; I121-L123 HydrophobicContact CG2-CG 4.23Å; I121-L123 PolarHBondContact O-N 3.01Å
122	C	95.7	Very high	93.5	Very high	9 Å²	9	44.6 Å²	44.6	6%	0.061	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.9	109.6	173	-74	0	0	0	0	110.5	N89 G90 A91 E120 L172 M176	N89-C122 PolarHBondContact O-N 3.22Å; G90-C122 CarbonylContact C-O 3.55Å; G90-C122 WeakPolarHBondContact CA-O 3.46Å; A91-C122 PolarHBondContact N-O 3.05Å; E120-C122 PolarHBondContact O-N 3.12Å; C122-L172 HydrophobicContact CB-CD1 3.73Å; C122-M176 HydrophobicContact CB-CG 3.83Å
123	L	96.9	Very high	93.8	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	135.6	180	-59.7	-176.1	0	0	0	112.2	A91 V110 L113 I121 A152 K153 R175	A91-L123 HydrophobicContact CB-CD2 3.88Å; V110-L123 HydrophobicContact CG1-CD1 4.37Å; L113-L123 HydrophobicContact CD1-CD2 3.83Å; I121-L123 HydrophobicContact CD1-CD2 4.39Å; I121-L123 HydrophobicContact CG1-CD2 4.12Å; I121-L123 HydrophobicContact CG2-CD2 3.8Å; I121-L123 HydrophobicContact CG2-CG 4.23Å; I121-L123 PolarHBondContact O-N 3.01Å; L123-A152 HydrophobicContact CB-CB 3.7Å; L123-A152 WeakPolarHBondContact O-CA 3.4Å; L123-K153 PolarHBondContact O-N 3.42Å; L123-R175 PolarHBondContact O-NH1 3.17Å
124	C	98.5	Very high	94.1	Very high	0 Å²	0	57 Å²	57	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	131.7	163.9	-67.1	0	0	0	0	109.4	A91 L93 K153 Y155 L168	A91-C124 PolarHBondContact O-N 3.31Å; L93-C124 PolarHBondContact N-O 3.41Å; C124-K153 CarbonylContact C-O 3.49Å; C124-K153 VanDerWaalsContact CA-O 3.26Å; C124-K153 WeakPolarHBondContact CA-O 3.33Å; C124-Y155 HydrophobicContact CB-CD2 4.24Å; C124-Y155 HydrophobicContact CB-CE2 4.33Å; C124-L168 HydrophobicContact CB-CD1 3.79Å
125	I	98.6	Very high	94.4	Very high	0 Å²	0	58.8 Å²	58.8	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	135.1	169.2	-65.7	-178.9	0	0	0	107.7	L93 Y95 V106 V110 Y146 A147 V150 A152 K153 H154 Y155	L93-I125 HydrophobicContact CB-CG1 4.42Å; L93-I125 HydrophobicContact CD1-CG1 4.44Å; L93-I125 CarbonylContact O-C 3.55Å; L93-I125 WeakPolarHBondContact O-CA 3.38Å; Y95-I125 HydrophobicContact CD1-CG2 4.06Å; Y95-I125 HydrophobicContact CE1-CG2 3.83Å; V106-I125 HydrophobicContact CG1-CD1 4.1Å; V106-I125 HydrophobicContact CG1-CG1 4.14Å; V106-I125 HydrophobicContact CG1-CG2 4.15Å; V110-I125 HydrophobicContact CG2-CD1 4.36Å; I125-Y146 HydrophobicContact CD1-CD1 3.7Å; I125-Y146 HydrophobicContact CD1-CE1 3.66Å; I125-A147 HydrophobicContact CB-CB 4.3Å; I125-A147 HydrophobicContact CD1-CB 3.98Å; I125-A147 HydrophobicContact CG1-CB 4.47Å; I125-V150 HydrophobicContact CD1-CG2 4.25Å; I125-A152 HydrophobicContact CD1-CB 4.17Å; I125-A152 HydrophobicContact CG1-CB 3.99Å; I125-K153 PolarHBondContact N-O 3.27Å; I125-H154 CarbonylContact O-C 3.57Å; I125-H154 VanDerWaalsContact O-CA 3.28Å; I125-H154 WeakPolarHBondContact O-CA 3.17Å; I125-Y155 PolarHBondContact O-N 2.98Å
126	V	98.8	Very high	94.9	Very high	0 Å²	0	52.7 Å²	52.7	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	113.3	-171.4	-177.9	0	0	0	0	110.5	L31 I92 L93 V94 Y95 N128 Y155 T157 L168	L31-V126 HydrophobicContact CD1-CG1 4.28Å; I92-V126 HydrophobicContact CG2-CB 4.36Å; I92-V126 HydrophobicContact CG2-CG2 3.51Å; L93-V126 PolarHBondContact O-N 3.37Å; V94-V126 WeakPolarHBondContact CA-O 3.34Å; V94-V126 HydrophobicContact CG2-CB 4.34Å; Y95-V126 WeakPolarHBondContact CD1-O 3.34Å; Y95-V126 PolarHBondContact N-O 3.43Å; V126-N128 PolarHBondContact O-N 2.84Å; V126-Y155 CarbonylContact C-O 3.57Å; V126-Y155 WeakPolarHBondContact CA-O 3.17Å; V126-T157 HydrophobicContact CG1-CG2 3.66Å; V126-T157 WeakPolarHBondContact CG1-OG1 3.3Å; V126-L168 HydrophobicContact CG1-CD2 4.33Å; V126-L168 HydrophobicContact CG2-CD1 3.75Å; V126-L168 HydrophobicContact CG2-CD2 3.71Å; V126-L168 HydrophobicContact CG2-CG 4.4Å
127	G	98.7	Very high	95.4	Very high	0 Å²	0	54 Å²	54	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	106.6	165.3	0	0	0	0	0	109.2	Y95 Y155 T157	Y95-G127 VanDerWaalsContact CE1-N 3.29Å; G127-Y155 PolarHBondContact N-O 3.32Å; G127-T157 PolarHBondContact O-N 2.83Å; G127-T157 PolarHBondContact O-OG1 3.04Å
128	N	98.6	Very high	95.9	Very high	4 Å²	4	52.2 Å²	52.2	2%	0.021	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	166.2	178.7	-172.6	34.3	0	0	0	111.3	V26 L31 V94 Y95 I97 V126 T157 A159	V26-N128 PolarHBondContact O-ND2 3.45Å; L31-N128 HydrophobicContact CD1-CB 4.34Å; V94-N128 HydrophobicContact CG1-CB 3.81Å; Y95-N128 PolarHBondContact O-N 2.8Å; I97-N128 WeakPolarHBondContact CG2-O 3.37Å; I97-N128 PolarHBondContact N-O 3.23Å; I97-N128 VanDerWaalsContact N-O 3.16Å; V126-N128 PolarHBondContact O-N 2.84Å; N128-T157 CarbonylContact C-O 3.43Å; N128-T157 VanDerWaalsContact CA-O 3.29Å; N128-T157 WeakPolarHBondContact CA-O 3.36Å; N128-T157 PolarHBondContact OD1-O 2.94Å; N128-T157 PolarHBondContact OD1-OG1 2.85Å; N128-A159 PolarHBondContact OD1-N 2.79Å
129	K	98.1	Very high	96.4	Very high	36 Å²	36	52.7 Å²	52.7	16%	0.157	26%	0.26	C	S	.	.			trans	68.1	34.6	-178.5	-44.2	-168.5	-163.2	168.6	0	114	C25 D96 I97 D131 L132 T157	C25-K129 PolarHBondContact O-NZ 3.11Å; D96-K129 WeakPolarHBondContact OD1-CD 3.46Å; D96-K129 WeakPolarHBondContact OD2-CD 3.33Å; D96-K129 WeakPolarHBondContact OD2-CE 3.4Å; D96-K129 IonicContact OD2-NZ 2.63Å; D96-K129 PolarHBondContact OD2-NZ 3.18Å; I97-K129 WeakPolarHBondContact CD1-O 3Å; K129-D131 WeakPolarHBondContact CA-OD1 3.47Å; K129-D131 PolarHBondContact O-N 2.72Å; K129-L132 HydrophobicContact CB-CD1 4.25Å; K129-L132 HydrophobicContact CD-CD1 4.31Å; K129-L132 WeakPolarHBondContact O-CB 3.45Å; K129-L132 PolarHBondContact O-N 3.42Å; K129-T157 PolarHBondContact N-O 2.95Å
130	I	98.5	Very high	97	Very high	41 Å²	41	48.1 Å²	48.1	21%	0.21	24%	0.237	C	C	.	.	G	3₁₀ helix	trans	-62.2	-7.7	174.7	70.7	177.6	0	0	0	114.5	I97 L132 H156 T157 K163	I97-I130 HydrophobicContact CD1-CG2 4.45Å; I97-I130 HydrophobicContact CG2-CG2 4.32Å; I130-L132 PolarHBondContact O-N 2.72Å; I130-H156 HydrophobicContact CD1-CB 4.17Å; I130-H156 HydrophobicContact CG2-CB 4Å; I130-T157 WeakPolarHBondContact CG1-O 3.48Å; I130-T157 PolarHBondContact N-O 3.16Å; I130-T157 VanDerWaalsContact N-O 3.13Å; I130-K163 HydrophobicContact CD1-CB 4.39Å
131	D	98.1	Very high	97.7	Very high	51 Å²	51	47.2 Å²	47.2	27%	0.273	23%	0.233	S	C	.	.	G	3₁₀ helix	trans	-67.8	-15.4	166.4	54.7	-75.7	0	0	0	113.8	K129 S158 K160 L161	K129-D131 WeakPolarHBondContact CA-OD1 3.47Å; K129-D131 PolarHBondContact O-N 2.72Å; D131-S158 VanDerWaalsContact OD1-CB 3.32Å; D131-S158 WeakPolarHBondContact OD1-CB 3.48Å; D131-S158 PolarHBondContact OD1-OG 3.38Å; D131-K160 WeakPolarHBondContact OD2-CD 3.37Å; D131-L161 HydrophobicContact CB-CD1 3.56Å; D131-L161 HydrophobicContact CB-CG 3.79Å
132	L	97.5	Very high	97.9	Very high	61 Å²	61	52.1 Å²	52.1	32%	0.319	26%	0.259	S	S	.	.	G	3₁₀ helix	trans	-104.8	31.5	176.9	-56.1	179.4	0	0	0	112.2	T98 K129 I130 K134 D135	T98-L132 HydrophobicContact CG2-CB 3.78Å; T98-L132 HydrophobicContact CG2-CD1 4.15Å; K129-L132 HydrophobicContact CB-CD1 4.25Å; K129-L132 HydrophobicContact CD-CD1 4.31Å; K129-L132 WeakPolarHBondContact O-CB 3.45Å; K129-L132 PolarHBondContact O-N 3.42Å; I130-L132 PolarHBondContact O-N 2.72Å; L132-K134 PolarHBondContact O-N 3.49Å; L132-D135 PolarHBondContact O-N 2.82Å
133	D	97.3	Very high	98	Very high	91 Å²	91	51.7 Å²	51.7	49%	0.487	26%	0.256	S	S	.	.	G	3₁₀ helix	trans	-57.4	-25.5	-174.2	-163.4	65.6	0	0	0	114.2	D135 R136	D133-D135 PolarHBondContact O-N 2.89Å; D133-R136 WeakPolarHBondContact O-CB 3.42Å; D133-R136 PolarHBondContact O-N 3.16Å; D133-R136 IonicContact OD1-CZ 3.99Å; D133-R136 VanDerWaalsContact OD1-CZ 3.24Å; D133-R136 IonicContact OD1-NE 3.84Å; D133-R136 PolarHBondContact OD1-NE 2.81Å; D133-R136 IonicContact OD1-NH2 3.8Å; D133-R136 PolarHBondContact OD1-NH2 2.77Å
134	K	97.8	Very high	98.1	Very high	204 Å²	204	55.8 Å²	55.8	89%	0.887	28%	0.275	S	S	*	.	G	3₁₀ helix	trans	-66.1	-25.4	174.8	-64.8	-175.7	-179.6	-178.1	0	113.8	L132	L132-K134 PolarHBondContact O-N 3.49Å
135	D	97.8	Very high	98.1	Very high	94 Å²	94	59.2 Å²	59.2	50%	0.503	30%	0.299	S	S	.	.	G	3₁₀ helix	trans	-105.4	19.9	-179	-53.9	-50.8	0	0	0	111	T98 L132 D133 H137	T98-D135 WeakPolarHBondContact CA-O 3.24Å; T98-D135 VanDerWaalsContact CB-O 3.32Å; T98-D135 WeakPolarHBondContact CB-O 3.25Å; T98-D135 HydrophobicContact CG2-CB 4.02Å; T98-D135 WeakPolarHBondContact CG2-O 3.4Å; L132-D135 PolarHBondContact O-N 2.82Å; D133-D135 PolarHBondContact O-N 2.89Å; D135-H137 PolarHBondContact O-N 3.15Å
136	R	98.4	Very high	98.1	Very high	54 Å²	54	61.2 Å²	61.2	20%	0.204	31%	0.307	C	S	.	.			trans	-64.9	129.4	-178.8	175.7	-179.2	-69.4	-84.7	3.2	110.9	I97 D133 V138	I97-R136 HydrophobicContact CD1-CB 4.35Å; I97-R136 WeakPolarHBondContact O-CA 3.32Å; D133-R136 WeakPolarHBondContact O-CB 3.42Å; D133-R136 PolarHBondContact O-N 3.16Å; D133-R136 IonicContact OD1-CZ 3.99Å; D133-R136 VanDerWaalsContact OD1-CZ 3.24Å; D133-R136 IonicContact OD1-NE 3.84Å; D133-R136 PolarHBondContact OD1-NE 2.81Å; D133-R136 IonicContact OD1-NH2 3.8Å; D133-R136 PolarHBondContact OD1-NH2 2.77Å; R136-V138 WeakPolarHBondContact CD-O 3.43Å; R136-V138 WeakPolarHBondContact CG-O 3.38Å; R136-V138 PolarHBondContact NH1-O 2.85Å
137	H	98.2	Very high	98.1	Very high	127 Å²	127	61.3 Å²	61.3	59%	0.588	31%	0.308	S	S	*	.			trans	-115	-10.9	171.7	-62.8	156.2	0	0	0	113	I97 T98 D135	I97-H137 PolarHBondContact O-N 3.01Å; T98-H137 PolarHBondContact O-ND1 2.81Å; D135-H137 PolarHBondContact O-N 3.15Å
138	V	97.9	Very high	98	Very high	5 Å²	5	68.8 Å²	68.8	3%	0.03	34%	0.343	C	S	.	.	S	Bend	trans	-106.9	116.9	175.1	-174.1	0	0	0	0	110.4	Y95 I97 E100 F103 R136 A143	Y95-V138 HydrophobicContact CD2-CB 4.44Å; Y95-V138 HydrophobicContact CD2-CG1 4.36Å; Y95-V138 HydrophobicContact CD2-CG2 4.13Å; Y95-V138 HydrophobicContact CE2-CB 3.81Å; Y95-V138 HydrophobicContact CE2-CG1 3.61Å; Y95-V138 HydrophobicContact CE2-CG2 4.01Å; I97-V138 PolarHBondContact O-N 3.44Å; I97-V138 VanDerWaalsContact O-N 3.12Å; E100-V138 HydrophobicContact CB-CG2 4.47Å; F103-V138 HydrophobicContact CB-CG1 4.21Å; F103-V138 HydrophobicContact CB-CG2 3.97Å; F103-V138 HydrophobicContact CD1-CG1 3.95Å; F103-V138 HydrophobicContact CD2-CG1 4.31Å; F103-V138 HydrophobicContact CE1-CG1 4.4Å; F103-V138 HydrophobicContact CG-CG1 3.9Å; R136-V138 WeakPolarHBondContact CD-O 3.43Å; R136-V138 WeakPolarHBondContact CG-O 3.38Å; R136-V138 PolarHBondContact NH1-O 2.85Å; V138-A143 HydrophobicContact CG1-CB 4.21Å
139	S	97.8	Very high	98	Very high	39 Å²	39	72.8 Å²	72.8	27%	0.273	37%	0.371	S	S	.	.			trans	-56.6	140.3	174.9	157.2	0	0	0	0	111.1	E141 D142 A143	S139-E141 PolarHBondContact OG-N 2.83Å; S139-E141 PolarHBondContact OG-OE2 3.3Å; S139-D142 PolarHBondContact OG-N 2.89Å; S139-D142 VanDerWaalsContact OG-N 3.12Å; S139-A143 WeakPolarHBondContact O-CB 3.27Å; S139-A143 PolarHBondContact O-N 3.25Å
140	V	97.8	Very high	97.9	Very high	37 Å²	37	72.5 Å²	72.5	22%	0.224	37%	0.372	C	S	.	.	H	α-helix	trans	-66	-47.8	175.6	170.5	0	0	0	0	109.6	D142 A143 E144	V140-D142 PolarHBondContact O-N 2.89Å; V140-A143 PolarHBondContact O-N 3.05Å; V140-E144 HydrophobicContact CG1-CG 4.38Å; V140-E144 WeakPolarHBondContact CG1-OE1 3.42Å; V140-E144 WeakPolarHBondContact O-CB 3.44Å; V140-E144 WeakPolarHBondContact O-CG 3.17Å; V140-E144 PolarHBondContact O-N 3.49Å
141	E	98.1	Very high	97.8	Very high	131 Å²	131	72.8 Å²	72.8	61%	0.612	39%	0.385	S	S	*	.	H	α-helix	trans	-61.6	-45.4	-177.6	-59	75.2	-164.7	0	0	111.2	S139 A143 E144 S145	S139-E141 PolarHBondContact OG-N 2.83Å; S139-E141 PolarHBondContact OG-OE2 3.3Å; E141-A143 PolarHBondContact O-N 2.66Å; E141-E144 PolarHBondContact O-N 3.09Å; E141-S145 WeakPolarHBondContact O-CB 3.46Å; E141-S145 PolarHBondContact O-N 3.16Å
142	D	96.9	Very high	97.7	Very high	110 Å²	110	70.9 Å²	70.9	59%	0.588	38%	0.377	S	S	*	.	H	α-helix	trans	-65	-40.8	179	-71	-20.4	0	0	0	111.7	S139 V140 Y146	S139-D142 PolarHBondContact OG-N 2.89Å; S139-D142 VanDerWaalsContact OG-N 3.12Å; V140-D142 PolarHBondContact O-N 2.89Å; D142-Y146 VanDerWaalsContact O-CB 3.27Å; D142-Y146 WeakPolarHBondContact O-CB 3.32Å; D142-Y146 PolarHBondContact O-N 3.01Å
143	A	98.2	Very high	97.8	Very high	0 Å²	0	71.9 Å²	71.9	0%	0	38%	0.379	C	S	.	.	H	α-helix	trans	-69.3	-39.6	179.7	0	0	0	0	0	112.6	Y95 F103 V138 S139 V140 E141 A147	Y95-A143 WeakPolarHBondContact OH-CB 3.46Å; F103-A143 HydrophobicContact CE2-CB 3.96Å; F103-A143 HydrophobicContact CZ-CB 4Å; V138-A143 HydrophobicContact CG1-CB 4.21Å; S139-A143 WeakPolarHBondContact O-CB 3.27Å; S139-A143 PolarHBondContact O-N 3.25Å; V140-A143 PolarHBondContact O-N 3.05Å; E141-A143 PolarHBondContact O-N 2.66Å; A143-A147 WeakPolarHBondContact O-CB 3.45Å; A143-A147 PolarHBondContact O-N 2.95Å
144	E	98.5	Very high	97.8	Very high	86 Å²	86	68.8 Å²	68.8	40%	0.402	36%	0.361	S	S	.	.	H	α-helix	trans	-68.5	-46.5	175.9	-73	177.7	179.8	0	0	111.5	V140 E141 Y146 A147 E148 H154 H156	V140-E144 HydrophobicContact CG1-CG 4.38Å; V140-E144 WeakPolarHBondContact CG1-OE1 3.42Å; V140-E144 WeakPolarHBondContact O-CB 3.44Å; V140-E144 WeakPolarHBondContact O-CG 3.17Å; V140-E144 PolarHBondContact O-N 3.49Å; E141-E144 PolarHBondContact O-N 3.09Å; E144-Y146 VanDerWaalsContact C-N 3.32Å; E144-Y146 PolarHBondContact O-N 3.23Å; E144-A147 WeakPolarHBondContact O-CB 3.29Å; E144-A147 PolarHBondContact O-N 3.33Å; E144-A147 VanDerWaalsContact O-N 3.16Å; E144-E148 PolarHBondContact O-N 3.3Å; E144-H154 HydrophobicContact CG-CB 4.04Å; E144-H156 IonicContact OE1-CD2 3.7Å; E144-H156 IonicContact OE1-CE1 2.58Å; E144-H156 IonicContact OE1-NE2 3.88Å; E144-H156 PolarHBondContact OE1-NE2 2.78Å
145	S	98.5	Very high	97.9	Very high	73 Å²	73	59.5 Å²	59.5	51%	0.51	32%	0.32	S	S	.	.	H	α-helix	trans	-60.1	-43.3	176.7	-174.2	0	0	0	0	111.5	E141 E148 S149	E141-S145 WeakPolarHBondContact O-CB 3.46Å; E141-S145 PolarHBondContact O-N 3.16Å; S145-E148 PolarHBondContact O-N 3Å; S145-S149 WeakPolarHBondContact O-CB 3.37Å; S145-S149 PolarHBondContact O-N 3.22Å
146	Y	98.4	Very high	97.9	Very high	42 Å²	42	57.4 Å²	57.4	17%	0.165	31%	0.308	C	S	.	.	H	α-helix	trans	-61.7	-45.9	174.7	176.9	-105.4	0	0	0	111.8	F103 K107 V110 I125 D142 E144 E148 S149 V150	F103-Y146 HydrophobicContact CE2-CD1 4.24Å; F103-Y146 AromaticContact CZ-CD1 3.9Å; F103-Y146 HydrophobicContact CZ-CD1 3.9Å; F103-Y146 HydrophobicContact CZ-CG 4.16Å; K107-Y146 VanDerWaalsContact CA-OH 3.32Å; K107-Y146 WeakPolarHBondContact CA-OH 3.34Å; K107-Y146 HydrophobicContact CB-CE1 4.34Å; K107-Y146 HydrophobicContact CB-CE2 4.47Å; K107-Y146 HydrophobicContact CD-CD2 4.42Å; K107-Y146 HydrophobicContact CD-CE2 4.12Å; K107-Y146 HydrophobicContact CG-CD1 4.29Å; K107-Y146 HydrophobicContact CG-CE1 3.72Å; K107-Y146 HydrophobicContact CG-CE2 4.01Å; V110-Y146 HydrophobicContact CG2-CE1 4.26Å; I125-Y146 HydrophobicContact CD1-CD1 3.7Å; I125-Y146 HydrophobicContact CD1-CE1 3.66Å; D142-Y146 VanDerWaalsContact O-CB 3.27Å; D142-Y146 WeakPolarHBondContact O-CB 3.32Å; D142-Y146 PolarHBondContact O-N 3.01Å; E144-Y146 VanDerWaalsContact C-N 3.32Å; E144-Y146 PolarHBondContact O-N 3.23Å; Y146-E148 VanDerWaalsContact C-N 3.33Å; Y146-E148 PolarHBondContact O-N 2.92Å; Y146-S149 PolarHBondContact O-N 3.31Å; Y146-S149 PolarHBondContact O-OG 3.12Å; Y146-V150 HydrophobicContact CD2-CG1 4.38Å; Y146-V150 HydrophobicContact CE1-CG1 4.37Å; Y146-V150 HydrophobicContact CE1-CG2 4.34Å; Y146-V150 HydrophobicContact CE2-CG1 3.72Å; Y146-V150 PolarHBondContact O-N 3.16Å
147	A	98.3	Very high	97.9	Very high	1 Å²	1	54.9 Å²	54.9	1%	0.008	30%	0.298	C	S	.	.	H	α-helix	trans	-58.2	-45.3	178.8	0	0	0	0	0	111.9	I125 A143 E144 S149 V150 G151 A152 H154	I125-A147 HydrophobicContact CB-CB 4.3Å; I125-A147 HydrophobicContact CD1-CB 3.98Å; I125-A147 HydrophobicContact CG1-CB 4.47Å; A143-A147 WeakPolarHBondContact O-CB 3.45Å; A143-A147 PolarHBondContact O-N 2.95Å; E144-A147 WeakPolarHBondContact O-CB 3.29Å; E144-A147 PolarHBondContact O-N 3.33Å; E144-A147 VanDerWaalsContact O-N 3.16Å; A147-S149 PolarHBondContact O-N 3.1Å; A147-V150 WeakPolarHBondContact O-CG2 3.48Å; A147-V150 PolarHBondContact O-N 2.89Å; A147-G151 PolarHBondContact O-N 3.3Å; A147-A152 CarbonylContact C-O 3.39Å; A147-A152 HydrophobicContact CB-CB 4.31Å; A147-A152 WeakPolarHBondContact O-CA 3.3Å; A147-A152 PolarHBondContact O-N 2.89Å; A147-A152 VanDerWaalsContact O-O 3.08Å; A147-H154 HydrophobicContact CB-CB 3.81Å
148	E	98.1	Very high	97.9	Very high	157 Å²	157	48.8 Å²	48.8	73%	0.734	27%	0.27	S	S	*	.	H	α-helix	trans	-59.8	-46.2	175.7	-173.8	173.1	-160.8	0	0	111.5	E144 S145 Y146 V150 G151	E144-E148 PolarHBondContact O-N 3.3Å; S145-E148 PolarHBondContact O-N 3Å; Y146-E148 VanDerWaalsContact C-N 3.33Å; Y146-E148 PolarHBondContact O-N 2.92Å; E148-V150 PolarHBondContact O-N 2.62Å; E148-V150 VanDerWaalsContact O-N 3.1Å; E148-G151 PolarHBondContact O-N 3.37Å
149	S	97.6	Very high	97.9	Very high	88 Å²	88	48.7 Å²	48.7	62%	0.615	27%	0.27	S	S	*	.	H	α-helix	trans	-59.3	-26.1	-179.2	79.7	0	0	0	0	114.1	S145 Y146 A147	S145-S149 WeakPolarHBondContact O-CB 3.37Å; S145-S149 PolarHBondContact O-N 3.22Å; Y146-S149 PolarHBondContact O-N 3.31Å; Y146-S149 PolarHBondContact O-OG 3.12Å; A147-S149 PolarHBondContact O-N 3.1Å
150	V	96.4	Very high	97.9	Very high	31 Å²	31	51.6 Å²	51.6	19%	0.188	28%	0.277	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103.7	6.6	179.5	-56.6	0	0	0	0	113.5	V110 R114 I125 Y146 A147 E148 A152	V110-V150 HydrophobicContact CG1-CB 3.96Å; V110-V150 HydrophobicContact CG1-CG1 4.1Å; V110-V150 HydrophobicContact CG1-CG2 4.15Å; V110-V150 HydrophobicContact CG2-CG2 4.44Å; R114-V150 PolarHBondContact NH2-O 2.85Å; I125-V150 HydrophobicContact CD1-CG2 4.25Å; Y146-V150 HydrophobicContact CD2-CG1 4.38Å; Y146-V150 HydrophobicContact CE1-CG1 4.37Å; Y146-V150 HydrophobicContact CE1-CG2 4.34Å; Y146-V150 HydrophobicContact CE2-CG1 3.72Å; Y146-V150 PolarHBondContact O-N 3.16Å; A147-V150 WeakPolarHBondContact O-CG2 3.48Å; A147-V150 PolarHBondContact O-N 2.89Å; E148-V150 PolarHBondContact O-N 2.62Å; E148-V150 VanDerWaalsContact O-N 3.1Å; V150-A152 VanDerWaalsContact C-N 3.3Å; V150-A152 HydrophobicContact CG2-CB 3.88Å; V150-A152 PolarHBondContact O-N 3.02Å
151	G	95.8	Very high	97.9	Very high	47 Å²	47	54.1 Å²	54.1	49%	0.485	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	67.9	28.2	-178.1	0	0	0	0	0	113.7	A147 E148	A147-G151 PolarHBondContact O-N 3.3Å; E148-G151 PolarHBondContact O-N 3.37Å
152	A	97.4	Very high	97.9	Very high	11 Å²	11	51.6 Å²	51.6	9%	0.091	28%	0.28	C	S	.	.	P	Polyproline II helix	trans	-99.3	159	171.8	0	0	0	0	0	110.5	L123 I125 A147 V150	L123-A152 HydrophobicContact CB-CB 3.7Å; L123-A152 WeakPolarHBondContact O-CA 3.4Å; I125-A152 HydrophobicContact CD1-CB 4.17Å; I125-A152 HydrophobicContact CG1-CB 3.99Å; A147-A152 CarbonylContact C-O 3.39Å; A147-A152 HydrophobicContact CB-CB 4.31Å; A147-A152 WeakPolarHBondContact O-CA 3.3Å; A147-A152 PolarHBondContact O-N 2.89Å; A147-A152 VanDerWaalsContact O-O 3.08Å; V150-A152 VanDerWaalsContact C-N 3.3Å; V150-A152 HydrophobicContact CG2-CB 3.88Å; V150-A152 PolarHBondContact O-N 3.02Å
153	K	98.1	Very high	97.9	Very high	82 Å²	82	52 Å²	52	36%	0.357	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	133.5	168.6	-169.7	160.8	172.1	-174.5	0	109.3	L123 C124 I125 Y155 D171	L123-K153 PolarHBondContact O-N 3.42Å; C124-K153 CarbonylContact C-O 3.49Å; C124-K153 VanDerWaalsContact CA-O 3.26Å; C124-K153 WeakPolarHBondContact CA-O 3.33Å; I125-K153 PolarHBondContact N-O 3.27Å; K153-Y155 HydrophobicContact CB-CE2 4Å; K153-Y155 HydrophobicContact CD-CE2 4.13Å; K153-Y155 WeakPolarHBondContact CD-OH 3.29Å; K153-Y155 WeakPolarHBondContact CE-OH 3.15Å; K153-Y155 HydrophobicContact CG-CE2 3.73Å; K153-Y155 PolarHBondContact NZ-OH 3.41Å; K153-D171 VanDerWaalsContact NZ-CG 3.34Å; K153-D171 IonicContact NZ-OD1 2.66Å; K153-D171 PolarHBondContact NZ-OD1 2.85Å; K153-D171 IonicContact NZ-OD2 2.9Å; K153-D171 PolarHBondContact NZ-OD2 3.13Å
154	H	98.6	Very high	97.9	Very high	25 Å²	25	53.1 Å²	53.1	12%	0.116	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	144.8	177.5	-169.1	-76.1	0	0	0	111.2	Y95 I125 E144 A147 H156	Y95-H154 AromaticContact CE1-NE2 3.64Å; Y95-H154 AromaticContact CZ-NE2 3.73Å; Y95-H154 PolarHBondContact OH-NE2 2.95Å; I125-H154 CarbonylContact O-C 3.57Å; I125-H154 VanDerWaalsContact O-CA 3.28Å; I125-H154 WeakPolarHBondContact O-CA 3.17Å; E144-H154 HydrophobicContact CG-CB 4.04Å; A147-H154 HydrophobicContact CB-CB 3.81Å; H154-H156 AromaticContact CE1-CD2 3.92Å; H154-H156 AromaticContact CE1-CE1 3.29Å; H154-H156 PolarHBondContact CE1-CE1 2.85Å; H154-H156 AromaticContact CE1-ND1 3.64Å; H154-H156 AromaticContact CE1-NE2 3.48Å; H154-H156 PolarHBondContact CE1-NE2 2.82Å; H154-H156 AromaticContact ND1-CD2 3.73Å; H154-H156 AromaticContact ND1-CE1 3.76Å; H154-H156 AromaticContact ND1-NE2 3.44Å; H154-H156 PolarHBondContact ND1-NE2 2.85Å
155	Y	98.8	Very high	97.9	Very high	9 Å²	9	49 Å²	49	4%	0.035	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136	142.6	172.1	-68.8	-84.9	0	0	0	111.9	C124 I125 V126 G127 K153 E167 L168 D171	C124-Y155 HydrophobicContact CB-CD2 4.24Å; C124-Y155 HydrophobicContact CB-CE2 4.33Å; I125-Y155 PolarHBondContact O-N 2.98Å; V126-Y155 CarbonylContact C-O 3.57Å; V126-Y155 WeakPolarHBondContact CA-O 3.17Å; G127-Y155 PolarHBondContact N-O 3.32Å; K153-Y155 HydrophobicContact CB-CE2 4Å; K153-Y155 HydrophobicContact CD-CE2 4.13Å; K153-Y155 WeakPolarHBondContact CD-OH 3.29Å; K153-Y155 WeakPolarHBondContact CE-OH 3.15Å; K153-Y155 HydrophobicContact CG-CE2 3.73Å; K153-Y155 PolarHBondContact NZ-OH 3.41Å; Y155-E167 HydrophobicContact CE1-CG 4.13Å; Y155-L168 HydrophobicContact CD1-CB 4.13Å; Y155-L168 HydrophobicContact CD2-CB 4.39Å; Y155-L168 HydrophobicContact CD2-CD1 3.36Å; Y155-L168 HydrophobicContact CD2-CG 4.46Å; Y155-L168 HydrophobicContact CE2-CD1 3.81Å; Y155-L168 HydrophobicContact CG-CB 4.04Å; Y155-L168 HydrophobicContact CG-CD1 3.8Å; Y155-L168 HydrophobicContact CG-CG 4.49Å; Y155-D171 WeakPolarHBondContact OH-CB 3.35Å; Y155-D171 PolarHBondContact OH-OD2 3.34Å
156	H	98.4	Very high	97.8	Very high	51 Å²	51	50.4 Å²	50.4	24%	0.236	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	121.5	172.9	-66	-80.3	0	0	0	109.4	I130 E144 H154	I130-H156 HydrophobicContact CD1-CB 4.17Å; I130-H156 HydrophobicContact CG2-CB 4Å; E144-H156 IonicContact OE1-CD2 3.7Å; E144-H156 IonicContact OE1-CE1 2.58Å; E144-H156 IonicContact OE1-NE2 3.88Å; E144-H156 PolarHBondContact OE1-NE2 2.78Å; H154-H156 AromaticContact CE1-CD2 3.92Å; H154-H156 AromaticContact CE1-CE1 3.29Å; H154-H156 PolarHBondContact CE1-CE1 2.85Å; H154-H156 AromaticContact CE1-ND1 3.64Å; H154-H156 AromaticContact CE1-NE2 3.48Å; H154-H156 PolarHBondContact CE1-NE2 2.82Å; H154-H156 AromaticContact ND1-CD2 3.73Å; H154-H156 AromaticContact ND1-CE1 3.76Å; H154-H156 AromaticContact ND1-NE2 3.44Å; H154-H156 PolarHBondContact ND1-NE2 2.85Å
157	T	98.8	Very high	97.8	Very high	0 Å²	0	54.3 Å²	54.3	0%	0	29%	0.287	C	S	.	.			trans	-133.5	152.4	-173.1	63.3	0	0	0	0	113.6	V126 G127 N128 K129 I130 K163 I165 L168	V126-T157 HydrophobicContact CG1-CG2 3.66Å; V126-T157 WeakPolarHBondContact CG1-OG1 3.3Å; G127-T157 PolarHBondContact O-N 2.83Å; G127-T157 PolarHBondContact O-OG1 3.04Å; N128-T157 CarbonylContact C-O 3.43Å; N128-T157 VanDerWaalsContact CA-O 3.29Å; N128-T157 WeakPolarHBondContact CA-O 3.36Å; N128-T157 PolarHBondContact OD1-O 2.94Å; N128-T157 PolarHBondContact OD1-OG1 2.85Å; K129-T157 PolarHBondContact N-O 2.95Å; I130-T157 WeakPolarHBondContact CG1-O 3.48Å; I130-T157 PolarHBondContact N-O 3.16Å; I130-T157 VanDerWaalsContact N-O 3.13Å; T157-K163 VanDerWaalsContact CA-O 3.27Å; T157-K163 WeakPolarHBondContact CA-O 3.07Å; T157-I165 HydrophobicContact CG2-CG1 4.49Å; T157-L168 HydrophobicContact CG2-CD2 4.28Å
158	S	98.5	Very high	97.8	Very high	0 Å²	0	54.2 Å²	54.2	0%	0	29%	0.287	C	S	.	.	B	Isolated β-bridge	trans	-134.2	110.5	165.1	171.4	0	0	0	0	108.8	D131 K160 L161 N162 K163	D131-S158 VanDerWaalsContact OD1-CB 3.32Å; D131-S158 WeakPolarHBondContact OD1-CB 3.48Å; D131-S158 PolarHBondContact OD1-OG 3.38Å; S158-K160 PolarHBondContact O-N 2.57Å; S158-K160 PolarHBondContact OG-N 2.88Å; S158-L161 PolarHBondContact OG-N 3.04Å; S158-N162 VanDerWaalsContact O-CA 3.3Å; S158-N162 WeakPolarHBondContact O-CA 3.32Å; S158-N162 PolarHBondContact O-N 2.96Å; S158-K163 PolarHBondContact N-O 2.78Å; S158-K163 PolarHBondContact O-N 3.38Å
159	A	97.7	Very high	97.8	Very high	3 Å²	3	46.8 Å²	46.8	3%	0.025	25%	0.252	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.4	-36.1	169.1	0	0	0	0	0	112.2	L31 R34 F40 N128	L31-A159 HydrophobicContact CD2-CB 4.08Å; L31-A159 HydrophobicContact CG-CB 4.35Å; R34-A159 PolarHBondContact NE-O 3.38Å; R34-A159 PolarHBondContact NH2-O 2.9Å; F40-A159 HydrophobicContact CD2-CB 3.95Å; F40-A159 HydrophobicContact CE2-CB 3.88Å; N128-A159 PolarHBondContact OD1-N 2.79Å
160	K	96.9	Very high	97.8	Very high	99 Å²	99	45.3 Å²	45.3	43%	0.43	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.2	-54	179.8	-171.7	178.5	-170	173.9	0	111.4	R34 F40 D131 S158 N162	R34-K160 PolarHBondContact NH2-O 3.27Å; R34-K160 VanDerWaalsContact NH2-O 3.14Å; F40-K160 HydrophobicContact CD1-CG 4.32Å; F40-K160 HydrophobicContact CE1-CB 3.95Å; F40-K160 HydrophobicContact CE1-CD 4.46Å; F40-K160 HydrophobicContact CE1-CG 3.76Å; F40-K160 HydrophobicContact CE2-CB 4.08Å; F40-K160 HydrophobicContact CZ-CB 3.72Å; F40-K160 HydrophobicContact CZ-CG 4.02Å; D131-K160 WeakPolarHBondContact OD2-CD 3.37Å; S158-K160 PolarHBondContact O-N 2.57Å; S158-K160 PolarHBondContact OG-N 2.88Å; K160-N162 VanDerWaalsContact C-N 3.33Å
161	L	97.6	Very high	97.8	Very high	90 Å²	90	45.4 Å²	45.4	47%	0.471	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.3	-1.4	-177.4	-58.3	-176.5	0	0	0	114	D131 S158 K163	D131-L161 HydrophobicContact CB-CD1 3.56Å; D131-L161 HydrophobicContact CB-CG 3.79Å; S158-L161 PolarHBondContact OG-N 3.04Å; L161-K163 VanDerWaalsContact C-N 3.33Å; L161-K163 HydrophobicContact CB-CD 4.19Å; L161-K163 HydrophobicContact CB-CG 3.96Å; L161-K163 HydrophobicContact CD1-CD 4.28Å; L161-K163 PolarHBondContact O-N 2.94Å
162	N	97.8	Very high	97.9	Very high	78 Å²	78	43.2 Å²	43.2	42%	0.417	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	54.7	44.2	-173.5	-166.8	31.6	0	0	0	113.3	R34 S158 K160	R34-N162 WeakPolarHBondContact CD-OD1 3.16Å; R34-N162 HydrophobicContact CG-CB 4.2Å; R34-N162 WeakPolarHBondContact CG-OD1 3.37Å; S158-N162 VanDerWaalsContact O-CA 3.3Å; S158-N162 WeakPolarHBondContact O-CA 3.32Å; S158-N162 PolarHBondContact O-N 2.96Å; K160-N162 VanDerWaalsContact C-N 3.33Å
163	K	98.5	Very high	97.9	Very high	118 Å²	118	42.7 Å²	42.7	51%	0.513	21%	0.209	S	C	.	.	B	Isolated β-bridge	trans	-105.6	137.9	-179.1	-70.1	-172.9	175.8	-176.1	0	111.5	I130 T157 S158 L161 I165	I130-K163 HydrophobicContact CD1-CB 4.39Å; T157-K163 VanDerWaalsContact CA-O 3.27Å; T157-K163 WeakPolarHBondContact CA-O 3.07Å; S158-K163 PolarHBondContact N-O 2.78Å; S158-K163 PolarHBondContact O-N 3.38Å; L161-K163 VanDerWaalsContact C-N 3.33Å; L161-K163 HydrophobicContact CB-CD 4.19Å; L161-K163 HydrophobicContact CB-CG 3.96Å; L161-K163 HydrophobicContact CD1-CD 4.28Å; L161-K163 PolarHBondContact O-N 2.94Å; K163-I165 PolarHBondContact O-N 3.27Å; K163-I165 VanDerWaalsContact O-N 3.15Å
164	G	98	Very high	97.9	Very high	24 Å²	24	42.8 Å²	42.8	25%	0.247	21%	0.209	C	C	.	.	S	Bend	trans	73.7	-7.2	174.6	0	0	0	0	0	116.1	L168	G164-L168 VanDerWaalsContact O-CB 3.3Å; G164-L168 WeakPolarHBondContact O-CB 3.11Å; G164-L168 PolarHBondContact O-N 2.89Å
165	I	98.1	Very high	97.8	Very high	1 Å²	1	44.2 Å²	44.2	1%	0.005	21%	0.214	C	C	.	.	H	α-helix	trans	-73.9	-49.1	-171.2	-60.7	171.7	0	0	0	111.8	L31 R34 Y35 T157 K163 E167 L168 F169	L31-I165 HydrophobicContact CD2-CD1 3.73Å; L31-I165 HydrophobicContact CD2-CG1 3.69Å; R34-I165 HydrophobicContact CB-CD1 3.91Å; R34-I165 HydrophobicContact CG-CD1 3.4Å; R34-I165 VanDerWaalsContact CG-CD1 3.4Å; Y35-I165 HydrophobicContact CD2-CG2 4.12Å; Y35-I165 HydrophobicContact CG-CG2 4.25Å; T157-I165 HydrophobicContact CG2-CG1 4.49Å; K163-I165 PolarHBondContact O-N 3.27Å; K163-I165 VanDerWaalsContact O-N 3.15Å; I165-E167 VanDerWaalsContact C-N 3.29Å; I165-E167 PolarHBondContact O-N 2.84Å; I165-L168 WeakPolarHBondContact O-CB 3.49Å; I165-L168 PolarHBondContact O-N 3.09Å; I165-F169 HydrophobicContact CG2-CD2 3.89Å; I165-F169 HydrophobicContact CG2-CE2 3.95Å; I165-F169 WeakPolarHBondContact O-CD2 3.42Å; I165-F169 PolarHBondContact O-N 2.78Å; I165-F169 VanDerWaalsContact O-N 3.12Å
166	E	96.9	Very high	97.7	Very high	101 Å²	101	44 Å²	44	47%	0.472	21%	0.213	S	C	.	.	H	α-helix	trans	-62.5	-41.1	179.8	-170.1	64.1	-154.8	0	0	111	Y35 K55 F169 L170	Y35-E166 VanDerWaalsContact CE2-OE2 3.3Å; Y35-E166 WeakPolarHBondContact CE2-OE2 3.32Å; K55-E166 IonicContact NZ-OE2 3.09Å; E166-F169 PolarHBondContact O-N 3.14Å; E166-L170 WeakPolarHBondContact O-CB 3.44Å; E166-L170 PolarHBondContact O-N 3.05Å
167	E	97.8	Very high	97.5	Very high	124 Å²	124	42 Å²	42	58%	0.579	20%	0.204	S	C	*	.	H	α-helix	trans	-60.2	-50.4	176.4	-173.6	-176.3	171.8	0	0	111.8	Y155 I165 F169 L170 D171	Y155-E167 HydrophobicContact CE1-CG 4.13Å; I165-E167 VanDerWaalsContact C-N 3.29Å; I165-E167 PolarHBondContact O-N 2.84Å; E167-F169 PolarHBondContact O-N 3.03Å; E167-L170 PolarHBondContact O-N 2.72Å; E167-D171 WeakPolarHBondContact O-CB 3.47Å; E167-D171 PolarHBondContact O-N 3.5Å
168	L	98.4	Very high	97.3	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-51.5	-54.8	176.4	163.6	66	0	0	0	111.8	I92 C124 V126 Y155 T157 G164 I165 L172	I92-L168 HydrophobicContact CD1-CD2 4.4Å; I92-L168 HydrophobicContact CD1-CG 4.49Å; I92-L168 HydrophobicContact CG2-CD2 4.24Å; C124-L168 HydrophobicContact CB-CD1 3.79Å; V126-L168 HydrophobicContact CG1-CD2 4.33Å; V126-L168 HydrophobicContact CG2-CD1 3.75Å; V126-L168 HydrophobicContact CG2-CD2 3.71Å; V126-L168 HydrophobicContact CG2-CG 4.4Å; Y155-L168 HydrophobicContact CD1-CB 4.13Å; Y155-L168 HydrophobicContact CD2-CB 4.39Å; Y155-L168 HydrophobicContact CD2-CD1 3.36Å; Y155-L168 HydrophobicContact CD2-CG 4.46Å; Y155-L168 HydrophobicContact CE2-CD1 3.81Å; Y155-L168 HydrophobicContact CG-CB 4.04Å; Y155-L168 HydrophobicContact CG-CD1 3.8Å; Y155-L168 HydrophobicContact CG-CG 4.49Å; T157-L168 HydrophobicContact CG2-CD2 4.28Å; G164-L168 VanDerWaalsContact O-CB 3.3Å; G164-L168 WeakPolarHBondContact O-CB 3.11Å; G164-L168 PolarHBondContact O-N 2.89Å; I165-L168 WeakPolarHBondContact O-CB 3.49Å; I165-L168 PolarHBondContact O-N 3.09Å; L168-L172 VanDerWaalsContact O-CB 3.29Å; L168-L172 WeakPolarHBondContact O-CB 3.42Å; L168-L172 PolarHBondContact O-N 2.63Å
169	F	97.9	Very high	97	Very high	1 Å²	1	50.3 Å²	50.3	0%	0.004	25%	0.246	C	C	.	.	H	α-helix	trans	-72	-36.8	-175	-80.6	-80.4	0	0	0	112.4	Y35 L66 I68 I92 I165 E166 E167 C173	Y35-F169 HydrophobicContact CD1-CB 4.35Å; Y35-F169 AromaticContact CD1-CD1 3.84Å; Y35-F169 HydrophobicContact CD1-CD1 3.84Å; Y35-F169 AromaticContact CD1-CD2 3.63Å; Y35-F169 HydrophobicContact CD1-CD2 3.63Å; Y35-F169 AromaticContact CD1-CE1 3.96Å; Y35-F169 HydrophobicContact CD1-CE1 3.96Å; Y35-F169 AromaticContact CD1-CE2 3.78Å; Y35-F169 HydrophobicContact CD1-CE2 3.78Å; Y35-F169 AromaticContact CD1-CG 3.68Å; Y35-F169 HydrophobicContact CD1-CG 3.68Å; Y35-F169 AromaticContact CD1-CZ 3.94Å; Y35-F169 HydrophobicContact CD1-CZ 3.94Å; Y35-F169 HydrophobicContact CD2-CB 4.19Å; Y35-F169 AromaticContact CD2-CD2 3.7Å; Y35-F169 HydrophobicContact CD2-CD2 3.7Å; Y35-F169 HydrophobicContact CD2-CE2 4.35Å; Y35-F169 HydrophobicContact CD2-CG 4.08Å; Y35-F169 HydrophobicContact CE1-CB 3.72Å; Y35-F169 AromaticContact CE1-CD1 3.55Å; Y35-F169 HydrophobicContact CE1-CD1 3.55Å; Y35-F169 AromaticContact CE1-CD2 3.9Å; Y35-F169 HydrophobicContact CE1-CD2 3.9Å; Y35-F169 HydrophobicContact CE1-CE1 4.08Å; Y35-F169 HydrophobicContact CE1-CE2 4.4Å; Y35-F169 AromaticContact CE1-CG 3.45Å; Y35-F169 HydrophobicContact CE1-CG 3.45Å; Y35-F169 VanDerWaalsContact CE1-CG 3.45Å; Y35-F169 HydrophobicContact CE1-CZ 4.48Å; Y35-F169 HydrophobicContact CE2-CB 3.58Å; Y35-F169 HydrophobicContact CE2-CD2 4.01Å; Y35-F169 AromaticContact CE2-CG 3.91Å; Y35-F169 HydrophobicContact CE2-CG 3.91Å; Y35-F169 AromaticContact CG-CD2 3.51Å; Y35-F169 HydrophobicContact CG-CD2 3.51Å; Y35-F169 AromaticContact CG-CE2 3.73Å; Y35-F169 HydrophobicContact CG-CE2 3.73Å; Y35-F169 AromaticContact CG-CG 3.97Å; Y35-F169 HydrophobicContact CG-CG 3.97Å; Y35-F169 HydrophobicContact CG-CZ 4.34Å; Y35-F169 AromaticContact CZ-CG 3.59Å; Y35-F169 WeakPolarHBondContact OH-CB 3.26Å; L66-F169 HydrophobicContact CD2-CD1 3.99Å; I68-F169 HydrophobicContact CD1-CE1 4Å; I92-F169 HydrophobicContact CD1-CD1 4.04Å; I92-F169 HydrophobicContact CD1-CE1 3.49Å; I92-F169 VanDerWaalsContact CD1-CE1 3.49Å; I92-F169 HydrophobicContact CD1-CE2 4.49Å; I92-F169 HydrophobicContact CD1-CZ 3.74Å; I165-F169 HydrophobicContact CG2-CD2 3.89Å; I165-F169 HydrophobicContact CG2-CE2 3.95Å; I165-F169 WeakPolarHBondContact O-CD2 3.42Å; I165-F169 PolarHBondContact O-N 2.78Å; I165-F169 VanDerWaalsContact O-N 3.12Å; E166-F169 PolarHBondContact O-N 3.14Å; E167-F169 PolarHBondContact O-N 3.03Å; F169-C173 WeakPolarHBondContact O-CB 3.38Å; F169-C173 PolarHBondContact O-N 3.23Å; F169-C173 PolarHBondContact O-SG 3.15Å
170	L	97.1	Very high	96.8	Very high	56 Å²	56	51 Å²	51	29%	0.293	25%	0.252	S	S	.	.	H	α-helix	trans	-65.9	-46.6	178.3	-180	63.7	0	0	0	111.5	I59 E166 E167 C173 K174	I59-L170 HydrophobicContact CD1-CD1 3.86Å; I59-L170 HydrophobicContact CG1-CD1 3.95Å; I59-L170 HydrophobicContact CG2-CD1 4.44Å; E166-L170 WeakPolarHBondContact O-CB 3.44Å; E166-L170 PolarHBondContact O-N 3.05Å; E167-L170 PolarHBondContact O-N 2.72Å; L170-C173 PolarHBondContact O-N 2.89Å; L170-K174 HydrophobicContact CG-CD 4.49Å; L170-K174 WeakPolarHBondContact O-CG 3.32Å; L170-K174 PolarHBondContact O-N 2.76Å
171	D	97.7	Very high	96.5	Very high	33 Å²	33	48.1 Å²	48.1	18%	0.176	24%	0.24	C	C	.	.	H	α-helix	trans	-65.8	-43.6	178.1	-179.4	93.9	0	0	0	111.7	K153 Y155 E167 C173 K174 R175	K153-D171 VanDerWaalsContact NZ-CG 3.34Å; K153-D171 IonicContact NZ-OD1 2.66Å; K153-D171 PolarHBondContact NZ-OD1 2.85Å; K153-D171 IonicContact NZ-OD2 2.9Å; K153-D171 PolarHBondContact NZ-OD2 3.13Å; Y155-D171 WeakPolarHBondContact OH-CB 3.35Å; Y155-D171 PolarHBondContact OH-OD2 3.34Å; E167-D171 WeakPolarHBondContact O-CB 3.47Å; E167-D171 PolarHBondContact O-N 3.5Å; D171-C173 VanDerWaalsContact C-N 3.3Å; D171-C173 PolarHBondContact O-N 2.86Å; D171-K174 WeakPolarHBondContact O-CB 3.46Å; D171-K174 PolarHBondContact O-N 2.93Å; D171-K174 VanDerWaalsContact O-N 3.09Å; D171-R175 WeakPolarHBondContact O-CG 3.42Å; D171-R175 PolarHBondContact O-N 3.21Å; D171-R175 WeakPolarHBondContact OD2-CD 3.31Å
172	L	97.9	Very high	96.2	Very high	1 Å²	1	46.6 Å²	46.6	1%	0.005	24%	0.24	C	C	.	.	H	α-helix	trans	-57.3	-44.6	175	178.3	57.9	0	0	0	111.3	V18 I92 C122 L168 K174 R175 M176	V18-L172 HydrophobicContact CG1-CD2 3.86Å; V18-L172 HydrophobicContact CG2-CD2 3.84Å; V18-L172 HydrophobicContact CG2-CG 4.43Å; I92-L172 HydrophobicContact CD1-CD2 3.8Å; I92-L172 HydrophobicContact CG1-CD2 3.59Å; C122-L172 HydrophobicContact CB-CD1 3.73Å; L168-L172 VanDerWaalsContact O-CB 3.29Å; L168-L172 WeakPolarHBondContact O-CB 3.42Å; L168-L172 PolarHBondContact O-N 2.63Å; L172-K174 PolarHBondContact O-N 3.05Å; L172-R175 PolarHBondContact O-N 2.94Å; L172-M176 HydrophobicContact CD1-CG 4.3Å; L172-M176 HydrophobicContact CD1-SD 4.37Å; L172-M176 HydrophobicContact CG-CE 4.05Å; L172-M176 HydrophobicContact CG-SD 4.43Å; L172-M176 WeakPolarHBondContact O-CG 3.45Å; L172-M176 PolarHBondContact O-N 3.46Å
173	C	97.3	Very high	95.8	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-60.8	-43.7	175.3	-70.2	0	0	0	0	112.2	I59 F169 L170 D171 M176 M177	I59-C173 HydrophobicContact CD1-CB 3.44Å; I59-C173 VanDerWaalsContact CD1-CB 3.44Å; F169-C173 WeakPolarHBondContact O-CB 3.38Å; F169-C173 PolarHBondContact O-N 3.23Å; F169-C173 PolarHBondContact O-SG 3.15Å; L170-C173 PolarHBondContact O-N 2.89Å; D171-C173 VanDerWaalsContact C-N 3.3Å; D171-C173 PolarHBondContact O-N 2.86Å; C173-M176 PolarHBondContact O-N 2.6Å; C173-M177 VanDerWaalsContact O-CG 3.23Å; C173-M177 WeakPolarHBondContact O-CG 3.21Å; C173-M177 PolarHBondContact O-N 3.35Å
174	K	96.8	Very high	95.2	Very high	85 Å²	85	44.5 Å²	44.5	37%	0.37	23%	0.23	S	C	.	.	H	α-helix	trans	-60.9	-47	177.9	-73.3	171.5	-179.8	175.1	0	111.8	I59 L170 D171 L172 M176 M177 E178	I59-K174 HydrophobicContact CG2-CG 3.92Å; L170-K174 HydrophobicContact CG-CD 4.49Å; L170-K174 WeakPolarHBondContact O-CG 3.32Å; L170-K174 PolarHBondContact O-N 2.76Å; D171-K174 WeakPolarHBondContact O-CB 3.46Å; D171-K174 PolarHBondContact O-N 2.93Å; D171-K174 VanDerWaalsContact O-N 3.09Å; L172-K174 PolarHBondContact O-N 3.05Å; K174-M176 PolarHBondContact O-N 3.49Å; K174-M177 WeakPolarHBondContact O-CB 3.15Å; K174-M177 PolarHBondContact O-N 3.29Å; K174-M177 VanDerWaalsContact O-N 3.12Å; K174-E178 WeakPolarHBondContact O-CG 3.29Å; K174-E178 PolarHBondContact O-N 3.07Å
175	R	96.4	Very high	94.8	Very high	54 Å²	54	51.9 Å²	51.9	20%	0.204	25%	0.25	C	S	.	.	H	α-helix	trans	-61.5	-41.4	178.4	-69.9	173.1	63.5	-152.6	1.3	112.5	L123 D171 L172 E178 T179	L123-R175 PolarHBondContact O-NH1 3.17Å; D171-R175 WeakPolarHBondContact O-CG 3.42Å; D171-R175 PolarHBondContact O-N 3.21Å; D171-R175 WeakPolarHBondContact OD2-CD 3.31Å; L172-R175 PolarHBondContact O-N 2.94Å; R175-E178 PolarHBondContact O-N 3.14Å; R175-T179 PolarHBondContact O-N 2.84Å; R175-T179 PolarHBondContact O-OG1 3.46Å
176	M	96.4	Very high	94.3	Very high	4 Å²	4	55.2 Å²	55.2	2%	0.02	28%	0.278	C	S	.	.	H	α-helix	trans	-65.5	-38	174	-68.8	-175.1	-58.3	0	0	112	F16 V18 L66 N89 C122 L172 C173 K174 T179 A180	F16-M176 HydrophobicContact CB-CE 3.67Å; F16-M176 HydrophobicContact CB-SD 4.04Å; F16-M176 HydrophobicContact CD1-CB 3.97Å; F16-M176 HydrophobicContact CD1-SD 4.35Å; F16-M176 HydrophobicContact CD2-CB 4.17Å; F16-M176 HydrophobicContact CD2-CE 3.9Å; F16-M176 HydrophobicContact CE1-CB 3.84Å; F16-M176 HydrophobicContact CE2-CB 4.07Å; F16-M176 HydrophobicContact CG-CB 4.13Å; F16-M176 HydrophobicContact CG-CE 3.8Å; F16-M176 HydrophobicContact CG-SD 4.12Å; F16-M176 HydrophobicContact CZ-CB 3.9Å; V18-M176 HydrophobicContact CG2-CE 3.66Å; V18-M176 HydrophobicContact CG2-SD 3.85Å; L66-M176 HydrophobicContact CD1-CE 4.02Å; N89-M176 VanDerWaalsContact C-SD 3.59Å; N89-M176 HydrophobicContact CB-CG 4.3Å; N89-M176 HydrophobicContact CB-SD 3.55Å; N89-M176 VanDerWaalsContact CB-SD 3.55Å; C122-M176 HydrophobicContact CB-CG 3.83Å; L172-M176 HydrophobicContact CD1-CG 4.3Å; L172-M176 HydrophobicContact CD1-SD 4.37Å; L172-M176 HydrophobicContact CG-CE 4.05Å; L172-M176 HydrophobicContact CG-SD 4.43Å; L172-M176 WeakPolarHBondContact O-CG 3.45Å; L172-M176 PolarHBondContact O-N 3.46Å; C173-M176 PolarHBondContact O-N 2.6Å; K174-M176 PolarHBondContact O-N 3.49Å; M176-T179 PolarHBondContact O-N 2.9Å; M176-A180 WeakPolarHBondContact O-CB 3.31Å; M176-A180 PolarHBondContact O-N 2.94Å
177	M	95.2	Very high	93.5	Very high	10 Å²	10	57.8 Å²	57.8	5%	0.049	29%	0.288	C	S	.	.	H	α-helix	trans	-65.3	-37.8	174.8	-71.1	172.5	67.7	0	0	113.2	Y14 F16 I59 K62 V64 C173 K174 Q181	Y14-M177 HydrophobicContact CD1-CG 4.4Å; Y14-M177 HydrophobicContact CD2-CE 3.99Å; Y14-M177 HydrophobicContact CD2-CG 4.35Å; Y14-M177 HydrophobicContact CE2-CE 3.85Å; Y14-M177 HydrophobicContact CG-CG 4.23Å; F16-M177 HydrophobicContact CE2-CB 4.46Å; F16-M177 HydrophobicContact CE2-CG 3.49Å; F16-M177 VanDerWaalsContact CE2-CG 3.49Å; F16-M177 HydrophobicContact CZ-CB 4.4Å; F16-M177 HydrophobicContact CZ-CG 3.83Å; I59-M177 HydrophobicContact CB-SD 4.14Å; I59-M177 HydrophobicContact CD1-SD 4.11Å; I59-M177 HydrophobicContact CG2-SD 4.29Å; K62-M177 HydrophobicContact CB-CE 3.61Å; K62-M177 HydrophobicContact CD-CE 3.32Å; K62-M177 HydrophobicContact CG-CE 4.09Å; V64-M177 HydrophobicContact CG2-CE 4.39Å; V64-M177 HydrophobicContact CG2-CG 4.33Å; V64-M177 HydrophobicContact CG2-SD 3.58Å; V64-M177 VanDerWaalsContact CG2-SD 3.58Å; C173-M177 VanDerWaalsContact O-CG 3.23Å; C173-M177 WeakPolarHBondContact O-CG 3.21Å; C173-M177 PolarHBondContact O-N 3.35Å; K174-M177 WeakPolarHBondContact O-CB 3.15Å; K174-M177 PolarHBondContact O-N 3.29Å; K174-M177 VanDerWaalsContact O-N 3.12Å; M177-Q181 WeakPolarHBondContact O-CB 3.33Å; M177-Q181 WeakPolarHBondContact O-CG 3.43Å; M177-Q181 PolarHBondContact O-N 3.33Å; M177-Q181 VanDerWaalsContact O-N 3.08Å; M177-Q181 PolarHBondContact O-NE2 2.77Å
178	E	93.9	Very high	92	Very high	124 Å²	124	54.3 Å²	54.3	58%	0.579	29%	0.285	S	S	*	.	H	α-helix	trans	-65.8	-45	176	-73.7	167	-173.9	0	0	110.8	K174 R175 Q181 A182	K174-E178 WeakPolarHBondContact O-CG 3.29Å; K174-E178 PolarHBondContact O-N 3.07Å; R175-E178 PolarHBondContact O-N 3.14Å; E178-Q181 PolarHBondContact O-N 3.32Å; E178-A182 WeakPolarHBondContact O-CB 3.39Å; E178-A182 PolarHBondContact O-N 3.14Å
179	T	92.8	Very high	90.1	Very high	50 Å²	50	61.2 Å²	61.2	31%	0.307	32%	0.322	S	S	.	.	H	α-helix	trans	-59	-51.2	176.3	-53.9	0	0	0	0	111.1	R175 M176 Q181 A182 E183	R175-T179 PolarHBondContact O-N 2.84Å; R175-T179 PolarHBondContact O-OG1 3.46Å; M176-T179 PolarHBondContact O-N 2.9Å; T179-Q181 VanDerWaalsContact C-N 3.3Å; T179-Q181 PolarHBondContact O-N 3.44Å; T179-A182 PolarHBondContact O-N 3.42Å; T179-A182 VanDerWaalsContact O-N 3.11Å; T179-E183 PolarHBondContact O-N 3.05Å
180	A	92.5	Very high	87.9	Confident	18 Å²	18	64.1 Å²	64.1	15%	0.149	35%	0.352	C	S	.	.	H	α-helix	trans	-59.3	-39.5	177.7	0	0	0	0	0	112.7	Y14 F16 M176 E184	Y14-A180 HydrophobicContact CD1-CB 4.31Å; Y14-A180 HydrophobicContact CE1-CB 4.14Å; F16-A180 HydrophobicContact CE1-CB 4.29Å; F16-A180 HydrophobicContact CZ-CB 4.4Å; M176-A180 WeakPolarHBondContact O-CB 3.31Å; M176-A180 PolarHBondContact O-N 2.94Å; A180-E184 VanDerWaalsContact O-CG 3.24Å; A180-E184 WeakPolarHBondContact O-CG 3.16Å; A180-E184 PolarHBondContact O-N 3.28Å
181	Q	91.9	Very high	85.7	Confident	39 Å²	39	65.8 Å²	65.8	18%	0.182	37%	0.374	C	S	.	.	H	α-helix	trans	-68.3	-36.7	176.8	-75.9	167.4	60	0	0	112.6	Y14 K62 M177 E178 T179 R185	Y14-Q181 HydrophobicContact CE1-CG 4.45Å; Y14-Q181 VanDerWaalsContact OH-CG 3.28Å; Y14-Q181 WeakPolarHBondContact OH-CG 3.32Å; Y14-Q181 PolarHBondContact OH-NE2 2.87Å; K62-Q181 VanDerWaalsContact NZ-CD 3.32Å; K62-Q181 VanDerWaalsContact NZ-OE1 3.16Å; M177-Q181 WeakPolarHBondContact O-CB 3.33Å; M177-Q181 WeakPolarHBondContact O-CG 3.43Å; M177-Q181 PolarHBondContact O-N 3.33Å; M177-Q181 VanDerWaalsContact O-N 3.08Å; M177-Q181 PolarHBondContact O-NE2 2.77Å; E178-Q181 PolarHBondContact O-N 3.32Å; T179-Q181 VanDerWaalsContact C-N 3.3Å; T179-Q181 PolarHBondContact O-N 3.44Å; Q181-R185 VanDerWaalsContact O-CG 3.28Å; Q181-R185 WeakPolarHBondContact O-CG 3.32Å; Q181-R185 PolarHBondContact O-N 2.88Å; Q181-R185 VanDerWaalsContact O-N 3.15Å
182	A	90.8	Very high	83.5	Confident	57 Å²	57	69.5 Å²	69.5	47%	0.471	40%	0.403	S	S	.	.	H	α-helix	trans	-66.4	-44.6	177.3	0	0	0	0	0	111.3	E178 T179 E184 R185 A186	E178-A182 WeakPolarHBondContact O-CB 3.39Å; E178-A182 PolarHBondContact O-N 3.14Å; T179-A182 PolarHBondContact O-N 3.42Å; T179-A182 VanDerWaalsContact O-N 3.11Å; A182-E184 VanDerWaalsContact C-N 3.32Å; A182-E184 PolarHBondContact O-N 2.93Å; A182-R185 PolarHBondContact O-N 3.29Å; A182-A186 PolarHBondContact O-N 3.03Å
183	E	88.6	Confident	81.3	Confident	78 Å²	78	78.5 Å²	78.5	36%	0.364	45%	0.445	S	S	.	.	H	α-helix	trans	-59.5	-41.7	176.8	-72.8	177	-153.4	0	0	112.7	T179 A186 K187	T179-E183 PolarHBondContact O-N 3.05Å; E183-A186 PolarHBondContact O-N 3.03Å; E183-K187 WeakPolarHBondContact O-CG 3.4Å; E183-K187 PolarHBondContact O-N 2.92Å; E183-K187 IonicContact OE2-NZ 3.95Å
184	E	87.6	Confident	78.9	Confident	74 Å²	74	84.1 Å²	84.1	35%	0.346	48%	0.484	S	S	.	.	H	α-helix	trans	-67.4	-39.6	178.1	-71.5	168.5	-175.3	0	0	112.7	R12 A180 A182 A186 K187 G188	R12-E184 VanDerWaalsContact CZ-CD 3.5Å; R12-E184 IonicContact CZ-OE1 3.69Å; R12-E184 VanDerWaalsContact CZ-OE1 3.3Å; R12-E184 IonicContact CZ-OE2 2.8Å; R12-E184 IonicContact NE-OE1 2.65Å; R12-E184 IonicContact NH1-OE1 2.94Å; R12-E184 IonicContact NH1-OE2 4Å; R12-E184 PolarHBondContact NH1-OE2 3.46Å; R12-E184 IonicContact NH2-OE1 3.84Å; R12-E184 PolarHBondContact NH2-OE1 3.26Å; R12-E184 IonicContact NH2-OE2 3.3Å; R12-E184 PolarHBondContact NH2-OE2 3.45Å; A180-E184 VanDerWaalsContact O-CG 3.24Å; A180-E184 WeakPolarHBondContact O-CG 3.16Å; A180-E184 PolarHBondContact O-N 3.28Å; A182-E184 VanDerWaalsContact C-N 3.32Å; A182-E184 PolarHBondContact O-N 2.93Å; E184-A186 VanDerWaalsContact C-N 3.32Å; E184-K187 PolarHBondContact O-N 3.15Å; E184-G188 PolarHBondContact O-N 3.45Å
185	R	88.9	Confident	76.6	Confident	179 Å²	179	85 Å²	85	68%	0.675	51%	0.507	S	S	*	.	H	α-helix	trans	-63.2	-41.1	174.7	-72.4	171.7	-175.9	-175.1	2.6	111.1	Q181 A182 G188 N189	Q181-R185 VanDerWaalsContact O-CG 3.28Å; Q181-R185 WeakPolarHBondContact O-CG 3.32Å; Q181-R185 PolarHBondContact O-N 2.88Å; Q181-R185 VanDerWaalsContact O-N 3.15Å; A182-R185 PolarHBondContact O-N 3.29Å; R185-G188 PolarHBondContact O-N 3.31Å; R185-N189 PolarHBondContact O-N 2.74Å; R185-N189 VanDerWaalsContact O-N 3.16Å
186	A	86.9	Confident	74.5	Confident	72 Å²	72	87.9 Å²	87.9	60%	0.595	54%	0.535	S	S	*	.	H	α-helix	trans	-63.1	-42.4	176.1	0	0	0	0	0	111.8	A182 E183 E184	A182-A186 PolarHBondContact O-N 3.03Å; E183-A186 PolarHBondContact O-N 3.03Å; E184-A186 VanDerWaalsContact C-N 3.32Å
187	K	81.3	Confident	72.2	Confident	154 Å²	154	94.4 Å²	94.4	67%	0.67	57%	0.57	S	S	*	*	H	α-helix	trans	-70	-35.1	176.8	-70.5	167.9	-177.6	165.9	0	112.7	E183 E184 G190	E183-K187 WeakPolarHBondContact O-CG 3.4Å; E183-K187 PolarHBondContact O-N 2.92Å; E183-K187 IonicContact OE2-NZ 3.95Å; E184-K187 PolarHBondContact O-N 3.15Å; K187-G190 PolarHBondContact O-N 3.41Å
188	G	66.7	Low	69.8	Low	51 Å²	51	105.9 Å²	105.9	53%	0.526	61%	0.613	S	S	.	*	H	α-helix	trans	-69.9	-31.7	178.8	0	0	0	0	0	114.5	E184 R185 G190	E184-G188 PolarHBondContact O-N 3.45Å; R185-G188 PolarHBondContact O-N 3.31Å; G188-G190 VanDerWaalsContact C-N 3.31Å; G188-G190 PolarHBondContact O-N 2.88Å
189	N	57.9	Low	67.4	Low	146 Å²	146	111 Å²	111	78%	0.781	63%	0.627	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.9	-11.4	177.3	-82.9	10.5	0	0	0	114	R185	R185-N189 PolarHBondContact O-N 2.74Å; R185-N189 VanDerWaalsContact O-N 3.16Å
190	G	51.3	Low	64.9	Low	62 Å²	62	112.2 Å²	112.2	64%	0.639	65%	0.649	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.9	-11.5	177.8	0	0	0	0	0	115.1	K187 G188	K187-G190 PolarHBondContact O-N 3.41Å; G188-G190 VanDerWaalsContact C-N 3.31Å; G188-G190 PolarHBondContact O-N 2.88Å
191	A	51.7	Low	62.5	Low	91 Å²	91	117.7 Å²	117.7	75%	0.752	68%	0.681	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.6	-0.5	-174.1	0	0	0	0	0	114.7
192	S	51.3	Low	59.9	Low	110 Å²	110	124.5 Å²	124.5	77%	0.769	71%	0.712	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.7	3.6	-178.4	-160	0	0	0	0	115.5
193	Q	50.9	Low	57.6	Low	191 Å²	191	129.3 Å²	129.3	89%	0.893	73%	0.729	S	S	*	*	S	Bend	trans	-126.3	65.6	173.5	-73.2	-172.5	-2.2	0	0	111.9
194	S	47.1	Very low	55.7	Low	118 Å²	118	131.6 Å²	131.6	83%	0.825	75%	0.748	S	S	*	*			trans	-152	25.5	158.5	-174.4	0	0	0	0	113.2
195	A	49.1	Very low	53.5	Low	102 Å²	102	135.6 Å²	135.6	84%	0.843	77%	0.771	S	S	*	*			trans	-111.5	63.2	174.5	0	0	0	0	0	111
196	S	52.5	Low	51.5	Low	115 Å²	115	134.9 Å²	134.9	80%	0.804	78%	0.781	S	S	*	*	S	Bend	trans	-172.3	136.7	142.8	55.5	0	0	0	0	109
197	N	47.3	Very low	49.8	Very low	142 Å²	142	139.7 Å²	139.7	76%	0.759	79%	0.791	S	S	*	*			trans	90.7	62.7	170.4	-131.9	43.8	0	0	0	118.1
198	R	44.7	Very low	48	Very low	250 Å²	250	138.3 Å²	138.3	94%	0.943	80%	0.798	S	S	*	*			trans	-129.1	107.5	133.8	-73.9	-168.7	-159.8	166.4	8.2	110.2
199	R	43.7	Very low	47	Very low	233 Å²	233	144.8 Å²	144.8	88%	0.879	81%	0.814	S	S	*	*			trans	-56.3	138.8	163.9	-70.9	176.2	175.9	175.6	-2.8	108.7
200	G	40.8	Very low	46.3	Very low	74 Å²	74	142.6 Å²	142.6	76%	0.763	82%	0.816	S	S	*	*			trans	-65.3	154	-171.1	0	0	0	0	0	114.9
201	V	42.1	Very low	46.3	Very low	134 Å²	134	146.1 Å²	146.1	81%	0.812	83%	0.826	S	S	*	*			trans	-134.2	113.9	151.4	174.1	0	0	0	0	105.2
202	Q	35.9	Very low	46.2	Very low	182 Å²	182	148 Å²	148	85%	0.85	83%	0.83	S	S	*	*	P	Polyproline II helix	trans	-73.6	126	168.3	-75.7	178.3	-35.6	0	0	107.6
203	I	43.8	Very low	46	Very low	158 Å²	158	147.9 Å²	147.9	81%	0.81	84%	0.836	S	S	*	*	P	Polyproline II helix	trans	-85.9	119	166.8	-60.4	170.5	0	0	0	105.4
204	V	47.6	Very low	45.5	Very low	126 Å²	126	142.6 Å²	142.6	76%	0.764	83%	0.832	S	S	*	*	P	Polyproline II helix	trans	-86.2	124.1	176.3	-163.3	0	0	0	0	106.4
205	D	41.7	Very low	45.3	Very low	157 Å²	157	140.6 Å²	140.6	84%	0.84	83%	0.831	S	S	*	*	P	Polyproline II helix	trans	-69.9	127.5	171.8	-81.5	-64.4	0	0	0	109.6
206	D	47.3	Very low	44.9	Very low	164 Å²	164	141.6 Å²	141.6	88%	0.877	83%	0.83	S	S	*	*	P	Polyproline II helix	trans	-88.7	117.8	179.8	-145.5	-105.3	0	0	0	109.3
207	E	50.5	Low	44.4	Very low	173 Å²	173	141.8 Å²	141.8	81%	0.808	83%	0.83	S	S	*	*	P	Polyproline II helix	trans	-85.3	133.3	178.1	-163	-179.4	145.6	0	0	110	Q209	E207-Q209 PolarHBondContact O-N 2.93Å
208	P	45.3	Very low	44.5	Very low	125 Å²	125	140.1 Å²	140.1	81%	0.812	83%	0.83	S	S	*	*	P	Polyproline II helix	trans	-76	117.1	-174.3	27	-31.2	0	0	0	112.6
209	Q	43.7	Very low	44.6	Very low	188 Å²	188	134.1 Å²	134.1	88%	0.879	83%	0.826	S	S	*	*	P	Polyproline II helix	trans	-72.9	132.8	173	-86.3	-173.6	-19.7	0	0	113	E207	E207-Q209 PolarHBondContact O-N 2.93Å
210	A	45	Very low	44.4	Very low	99 Å²	99	130.4 Å²	130.4	82%	0.818	86%	0.86	S	S	*	*	P	Polyproline II helix	trans	-66.7	135.4	172.3	0	0	0	0	0	112.8
211	T	51.5	Low	44.6	Very low	137 Å²	137	133.2 Å²	133.2	84%	0.84	87%	0.865	S	S	*	*	P	Polyproline II helix	trans	-84.5	139.4	168.3	45.1	0	0	0	0	111.5
212	P	48.8	Very low	44.7	Very low	130 Å²	130	133.2 Å²	133.2	84%	0.844	87%	0.868	S	S	*	*	P	Polyproline II helix	trans	-83.5	157.5	-178.2	33.2	-32.7	0	0	0	113.5
213	A	46.3	Very low	45.2	Very low	108 Å²	108	130.4 Å²	130.4	89%	0.893	87%	0.869	S	S	*	*	P	Polyproline II helix	trans	-75.7	154.4	-178	0	0	0	0	0	114.5
214	G	40.2	Very low	45.3	Very low	79 Å²	79	128.8 Å²	128.8	81%	0.814	87%	0.872	S	S	*	*			trans	172.7	95.5	160.4	0	0	0	0	0	116.9
215	G	42.9	Very low	45.1	Very low	77 Å²	77	129 Å²	129	79%	0.794	88%	0.879	S	S	*	*				92.6	107.6	123.8	0	0	0	0	0	122.6
216	C	42.4	Very low	45.4	Very low	122 Å²	122	127.1 Å²	127.1	82%	0.824	88%	0.881	S	S	*	*				60.5	123.2	127.5	-147.6	0	0	0	0	122.4
217	C	41.8	Very low	45.2	Very low	120 Å²	120	124.5 Å²	124.5	81%	0.811	88%	0.882	S	S	*	*				174.1	144.5	108.5	-88.7	0	0	0	0	113
218	S	47.8	Very low	44.8	Very low	107 Å²	107	120.8 Å²	120.8	75%	0.748	89%	0.887	S	S	*	*			trans	-70.9	163.4	-178.9	47.6	0	0	0	0	115.3
219	S	47.8	Very low	44.8	Very low	123 Å²	123	120.4 Å²	120.4	86%	0.86	89%	0.894	S	S	*	*				144.2	133	124.7	-53.4	0	0	0	0	111.9
220	G	39.2	Very low	44.9	Very low	155 Å²	155	114.3 Å²	114.3	100%	1.598	90%	0.895	S	S	*	*			trans	131.3	0	160.9	0	0	0	0	0	114.6

Retrieved 220 of 220 residues in 164.3 ms (Link to these results)

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