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Trafficking protein particle complex subunit

Core component of the TRAPP complexes which has a function of guanine nucleotide exchange factor activity for Rab1 GTPase. Plays a role in vesicular transport from endoplasmic reticulum to Golgi and autophagy. May play a role in dendrite postsynaptic membrane trafficking.

AlphaFold DB , UniProt , Accession A0A060WG36, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene trappc4, Length 219 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	71.8	Confident	91.5	Very high	85 Å²	85	31.1 Å²	31.1	42%	0.419	15%	0.15	S	C	.	.				0	162	0	-64.6	123.3	98.6	0	0	108.5	R162 A213 N214	M1-R162 HydrophobicContact CE-CB 4.11Å; M1-R162 WeakPolarHBondContact CE-O 3.35Å; M1-A213 HydrophobicContact CB-CB 4.23Å; M1-A213 HydrophobicContact CE-CB 4.15Å; M1-A213 HydrophobicContact SD-CB 4.13Å; M1-N214 PolarHBondContact N-OD1 3.19Å; M1-N214 VanDerWaalsContact N-OD1 3.16Å
2	A	85.4	Confident	91.4	Very high	22 Å²	22	34.8 Å²	34.8	18%	0.182	19%	0.19	C	C	.	.			trans	-136.2	144.8	-168.7	0	0	0	0	0	112.6	F4 D160	A2-F4 HydrophobicContact CB-CD1 4.41Å; A2-F4 HydrophobicContact CB-CE1 4.08Å; A2-D160 PolarHBondContact O-N 2.83Å
3	I	91.8	Very high	91.4	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	125.6	164.8	-60.5	166.6	0	0	0	107	N21 V157 A159 Q163 I166 L169 L206 A209 E210	I3-N21 WeakPolarHBondContact O-CB 3.45Å; I3-N21 PolarHBondContact O-ND2 3.13Å; I3-V157 HydrophobicContact CG2-CG1 3.79Å; I3-A159 HydrophobicContact CG1-CB 4.48Å; I3-Q163 HydrophobicContact CG1-CG 4.41Å; I3-I166 HydrophobicContact CG1-CD1 4.4Å; I3-L169 HydrophobicContact CD1-CD2 3.56Å; I3-L206 HydrophobicContact CB-CD2 4.41Å; I3-L206 HydrophobicContact CD1-CD2 3.81Å; I3-L206 HydrophobicContact CG2-CD2 3.85Å; I3-A209 HydrophobicContact CD1-CB 3.73Å; I3-E210 HydrophobicContact CB-CG 4.48Å; I3-E210 HydrophobicContact CD1-CG 3.95Å; I3-E210 HydrophobicContact CG1-CG 4.11Å; I3-E210 PolarHBondContact N-OE1 2.64Å
4	F	92.2	Very high	91.5	Very high	35 Å²	35	31.8 Å²	31.8	15%	0.154	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	-52.3	-175.1	-57.8	-42.4	0	0	0	111.7	A2 N21 Y22 F142 L158 A159 D160	A2-F4 HydrophobicContact CB-CD1 4.41Å; A2-F4 HydrophobicContact CB-CE1 4.08Å; F4-N21 PolarHBondContact O-N 2.84Å; F4-Y22 AromaticContact CD1-CD1 3.81Å; F4-Y22 HydrophobicContact CD1-CD1 3.81Å; F4-Y22 AromaticContact CE1-CD1 3.97Å; F4-Y22 HydrophobicContact CE1-CD1 3.97Å; F4-Y22 HydrophobicContact CE1-CE1 4.48Å; F4-Y22 PolarHBondContact O-N 3.09Å; F4-F142 HydrophobicContact CD2-CB 3.86Å; F4-F142 HydrophobicContact CE2-CB 3.6Å; F4-L158 WeakPolarHBondContact CA-O 3.36Å; F4-L158 HydrophobicContact CB-CB 4.21Å; F4-L158 WeakPolarHBondContact CB-O 3.33Å; F4-L158 PolarHBondContact N-O 2.9Å; F4-A159 WeakPolarHBondContact CE2-O 3.48Å; F4-D160 HydrophobicContact CZ-CB 4.15Å
5	S	94.4	Very high	91.8	Very high	11 Å²	11	31.3 Å²	31.3	8%	0.077	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-162.8	160.3	-175.9	47.1	0	0	0	0	112.9	Y7 Y19 L158	S5-Y7 WeakPolarHBondContact OG-CE2 3.5Å; S5-Y19 CarbonylContact C-O 3.58Å; S5-Y19 WeakPolarHBondContact CA-O 3.25Å; S5-Y19 VanDerWaalsContact CB-O 3.31Å; S5-Y19 WeakPolarHBondContact CB-O 3.28Å; S5-L158 PolarHBondContact N-O 2.85Å; S5-L158 PolarHBondContact O-N 3.45Å; S5-L158 VanDerWaalsContact OG-CD1 3.31Å; S5-L158 WeakPolarHBondContact OG-CD1 3.42Å
6	V	96.1	Very high	91.9	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	135.3	178.3	-177	0	0	0	0	109	Q18 Y19 I156 V157 I173 L206	V6-Q18 CarbonylContact O-C 3.6Å; V6-Q18 WeakPolarHBondContact O-CA 3.26Å; V6-Y19 PolarHBondContact N-O 3.4Å; V6-Y19 PolarHBondContact O-N 3.45Å; V6-I156 CarbonylContact C-O 3.51Å; V6-I156 WeakPolarHBondContact CA-O 3.42Å; V6-V157 HydrophobicContact CG2-CG2 4.33Å; V6-I173 HydrophobicContact CG1-CD1 4.07Å; V6-L206 HydrophobicContact CG2-CD1 4.18Å; V6-L206 HydrophobicContact CG2-CD2 3.82Å
7	Y	96.8	Very high	92	Very high	25 Å²	25	29.1 Å²	29.1	10%	0.098	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	139.9	173.3	-58.9	-105.1	0	0	0	109.6	S5 L15 Q18 K108 I156 L158	S5-Y7 WeakPolarHBondContact OG-CE2 3.5Å; Y7-L15 HydrophobicContact CD1-CD1 3.73Å; Y7-L15 HydrophobicContact CD1-CD2 4.36Å; Y7-L15 HydrophobicContact CG-CD1 4.36Å; Y7-Q18 HydrophobicContact CD1-CB 4.08Å; Y7-Q18 HydrophobicContact CE1-CB 4.32Å; Y7-K108 HydrophobicContact CE1-CB 4.37Å; Y7-K108 HydrophobicContact CE1-CD 4.47Å; Y7-K108 HydrophobicContact CE1-CG 4.3Å; Y7-I156 PolarHBondContact N-O 3.41Å; Y7-I156 PolarHBondContact O-N 2.99Å; Y7-L158 HydrophobicContact CD2-CD1 3.8Å; Y7-L158 HydrophobicContact CE2-CD1 3.33Å
8	V	95.9	Very high	92.2	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	119.1	170.5	-169.2	0	0	0	0	108.2	I16 Y17 I153 K154 F155	V8-I16 HydrophobicContact CB-CG1 4.07Å; V8-I16 HydrophobicContact CG1-CD1 3.88Å; V8-I16 HydrophobicContact CG1-CG1 3.85Å; V8-I16 VanDerWaalsContact O-CG1 3.27Å; V8-I16 WeakPolarHBondContact O-CG1 3.37Å; V8-I16 PolarHBondContact O-N 3.33Å; V8-Y17 HydrophobicContact CG2-CD1 4.04Å; V8-Y17 HydrophobicContact CG2-CG 4.36Å; V8-Y17 PolarHBondContact N-O 3.48Å; V8-Y17 PolarHBondContact O-N 3.08Å; V8-I153 HydrophobicContact CG1-CG2 3.79Å; V8-K154 WeakPolarHBondContact CA-O 3.31Å; V8-F155 HydrophobicContact CB-CD1 4.45Å; V8-F155 HydrophobicContact CG1-CD1 3.89Å; V8-F155 HydrophobicContact CG1-CE1 3.72Å; V8-F155 HydrophobicContact CG2-CD1 3.88Å; V8-F155 HydrophobicContact CG2-CE1 4.16Å
9	V	96.1	Very high	92.3	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	131.1	-175.2	-173.3	0	0	0	0	108.9	G13 G14 L15 A112 K154 I156	V9-G13 VanDerWaalsContact CG1-C 3.45Å; V9-G13 WeakPolarHBondContact CG1-O 3.27Å; V9-G14 CarbonylContact C-O 3.47Å; V9-G14 WeakPolarHBondContact CA-O 3.22Å; V9-L15 HydrophobicContact CG2-CD1 4.26Å; V9-A112 HydrophobicContact CG2-CB 3.88Å; V9-K154 HydrophobicContact CB-CB 4.35Å; V9-K154 PolarHBondContact N-O 3.19Å; V9-K154 PolarHBondContact O-N 3.4Å; V9-I156 HydrophobicContact CG2-CD1 3.85Å
10	N	93.4	Very high	92.2	Very high	12 Å²	12	34.3 Å²	34.3	6%	0.064	18%	0.184	C	C	.	.			trans	-74.7	177.1	179.5	73.9	19.6	0	0	0	112	A12 G13 G14 I16 I153	N10-A12 PolarHBondContact O-N 3.29Å; N10-A12 WeakPolarHBondContact OD1-CA 3.32Å; N10-A12 WeakPolarHBondContact OD1-CB 3.16Å; N10-A12 PolarHBondContact OD1-N 2.9Å; N10-G13 PolarHBondContact O-N 3.21Å; N10-G13 VanDerWaalsContact O-N 3.1Å; N10-G13 PolarHBondContact OD1-N 3.39Å; N10-G14 PolarHBondContact N-O 2.79Å; N10-G14 WeakPolarHBondContact OD1-CA 3.45Å; N10-G14 PolarHBondContact OD1-N 3.39Å; N10-I16 HydrophobicContact CB-CD1 4.29Å; N10-I16 HydrophobicContact CB-CG2 3.95Å; N10-I153 HydrophobicContact CB-CD1 4.18Å
11	K	92.4	Very high	91.9	Very high	152 Å²	152	34.9 Å²	34.9	66%	0.661	19%	0.187	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.3	-26.7	179.3	-175.1	179.8	176.7	-177.2	0	113.2	H116	K11-H116 PolarHBondContact O-CE1 3.22Å
12	A	90.9	Very high	92.2	Very high	76 Å²	76	36.5 Å²	36.5	63%	0.628	19%	0.19	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88.3	1	178.9	0	0	0	0	0	113.7	N10 G14	N10-A12 PolarHBondContact O-N 3.29Å; N10-A12 WeakPolarHBondContact OD1-CA 3.32Å; N10-A12 WeakPolarHBondContact OD1-CB 3.16Å; N10-A12 PolarHBondContact OD1-N 2.9Å; A12-G14 VanDerWaalsContact C-N 3.35Å
13	G	90.9	Very high	91.3	Very high	3 Å²	3	38.8 Å²	38.8	3%	0.031	20%	0.201	C	C	.	.	S	Bend	trans	86.3	3.2	-176.5	0	0	0	0	0	114.6	V9 N10 S113 H116	V9-G13 VanDerWaalsContact CG1-C 3.45Å; V9-G13 WeakPolarHBondContact CG1-O 3.27Å; N10-G13 PolarHBondContact O-N 3.21Å; N10-G13 VanDerWaalsContact O-N 3.1Å; N10-G13 PolarHBondContact OD1-N 3.39Å; G13-S113 PolarHBondContact O-OG 2.98Å; G13-H116 VanDerWaalsContact CA-CG 3.5Å; G13-H116 WeakPolarHBondContact CA-ND1 3.25Å; G13-H116 PolarHBondContact N-ND1 2.83Å
14	G	93.4	Very high	90	Very high	24 Å²	24	41.6 Å²	41.6	25%	0.247	22%	0.219	C	C	.	.			trans	-75.5	134.1	175.2	0	0	0	0	0	112.3	V9 N10 A12 I16	V9-G14 CarbonylContact C-O 3.47Å; V9-G14 WeakPolarHBondContact CA-O 3.22Å; N10-G14 PolarHBondContact N-O 2.79Å; N10-G14 WeakPolarHBondContact OD1-CA 3.45Å; N10-G14 PolarHBondContact OD1-N 3.39Å; A12-G14 VanDerWaalsContact C-N 3.35Å; G14-I16 PolarHBondContact O-N 2.9Å
15	L	94.9	Very high	88.8	Confident	24 Å²	24	49.8 Å²	49.8	13%	0.126	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	114.5	174.3	-174.3	63.8	0	0	0	109.9	Y7 V9 Y17 Q18 K108 L109 A112	Y7-L15 HydrophobicContact CD1-CD1 3.73Å; Y7-L15 HydrophobicContact CD1-CD2 4.36Å; Y7-L15 HydrophobicContact CG-CD1 4.36Å; V9-L15 HydrophobicContact CG2-CD1 4.26Å; L15-Y17 VanDerWaalsContact CD1-O 3.24Å; L15-Y17 WeakPolarHBondContact CD1-O 3.46Å; L15-Q18 HydrophobicContact CD1-CB 4.28Å; L15-Q18 HydrophobicContact CD2-CB 4.04Å; L15-Q18 HydrophobicContact CD2-CG 4.2Å; L15-Q18 HydrophobicContact CG-CB 4.39Å; L15-K108 HydrophobicContact CD2-CB 3.92Å; L15-L109 HydrophobicContact CB-CD2 3.67Å; L15-L109 HydrophobicContact CB-CG 4.5Å; L15-A112 HydrophobicContact CB-CB 3.91Å; L15-A112 HydrophobicContact CD1-CB 4.03Å; L15-A112 HydrophobicContact CG-CB 4.4Å
16	I	93.6	Very high	87.6	Confident	5 Å²	5	51.9 Å²	51.9	3%	0.026	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	-15.6	-179.3	58.1	169.9	0	0	0	112.8	V8 N10 G14 Y177 P192 I193	V8-I16 HydrophobicContact CB-CG1 4.07Å; V8-I16 HydrophobicContact CG1-CD1 3.88Å; V8-I16 HydrophobicContact CG1-CG1 3.85Å; V8-I16 VanDerWaalsContact O-CG1 3.27Å; V8-I16 WeakPolarHBondContact O-CG1 3.37Å; V8-I16 PolarHBondContact O-N 3.33Å; N10-I16 HydrophobicContact CB-CD1 4.29Å; N10-I16 HydrophobicContact CB-CG2 3.95Å; G14-I16 PolarHBondContact O-N 2.9Å; I16-Y177 HydrophobicContact CD1-CE2 4.26Å; I16-P192 CarbonylContact O-C 3.55Å; I16-P192 WeakPolarHBondContact O-CA 3.18Å; I16-I193 HydrophobicContact CD1-CD1 4.46Å; I16-I193 PolarHBondContact O-N 3Å
17	Y	94.8	Very high	87	Confident	21 Å²	21	56.7 Å²	56.7	8%	0.082	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.6	145.7	171	-176.9	-92.3	0	0	0	111	V8 L15 I193 F198 D199 L202	V8-Y17 HydrophobicContact CG2-CD1 4.04Å; V8-Y17 HydrophobicContact CG2-CG 4.36Å; V8-Y17 PolarHBondContact N-O 3.48Å; V8-Y17 PolarHBondContact O-N 3.08Å; L15-Y17 VanDerWaalsContact CD1-O 3.24Å; L15-Y17 WeakPolarHBondContact CD1-O 3.46Å; Y17-I193 HydrophobicContact CD2-CB 4.14Å; Y17-F198 AromaticContact CD1-CE1 3.79Å; Y17-F198 HydrophobicContact CD1-CE1 3.79Å; Y17-F198 HydrophobicContact CD2-CD1 4.14Å; Y17-F198 AromaticContact CD2-CE1 3.85Å; Y17-F198 HydrophobicContact CD2-CE1 3.85Å; Y17-F198 AromaticContact CE1-CE1 3.81Å; Y17-F198 HydrophobicContact CE1-CE1 3.81Å; Y17-F198 AromaticContact CE2-CD1 3.93Å; Y17-F198 HydrophobicContact CE2-CD1 3.93Å; Y17-F198 AromaticContact CE2-CE1 3.87Å; Y17-F198 HydrophobicContact CE2-CE1 3.87Å; Y17-F198 AromaticContact CG-CE1 3.8Å; Y17-F198 HydrophobicContact CG-CE1 3.8Å; Y17-F198 AromaticContact CZ-CE1 3.82Å; Y17-D199 WeakPolarHBondContact CE2-OD1 3.43Å; Y17-D199 PolarHBondContact OH-OD1 2.83Å; Y17-L202 HydrophobicContact CD1-CD2 4.25Å; Y17-L202 HydrophobicContact CE1-CD2 3.25Å; Y17-L202 WeakPolarHBondContact OH-CD2 3.35Å
18	Q	94.3	Very high	86.7	Confident	68 Å²	68	56.1 Å²	56.1	32%	0.318	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.2	140.5	174.5	68.9	90.9	22.3	0	0	110.9	V6 Y7 L15 K108	V6-Q18 CarbonylContact O-C 3.6Å; V6-Q18 WeakPolarHBondContact O-CA 3.26Å; Y7-Q18 HydrophobicContact CD1-CB 4.08Å; Y7-Q18 HydrophobicContact CE1-CB 4.32Å; L15-Q18 HydrophobicContact CD1-CB 4.28Å; L15-Q18 HydrophobicContact CD2-CB 4.04Å; L15-Q18 HydrophobicContact CD2-CG 4.2Å; L15-Q18 HydrophobicContact CG-CB 4.39Å; Q18-K108 HydrophobicContact CG-CD 4.33Å
19	Y	93.9	Very high	86.6	Confident	59 Å²	59	60.7 Å²	60.7	23%	0.231	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	122.7	177.7	-178.2	-109.4	0	0	0	110.5	S5 V6 N21 K203 L206	S5-Y19 CarbonylContact C-O 3.58Å; S5-Y19 WeakPolarHBondContact CA-O 3.25Å; S5-Y19 VanDerWaalsContact CB-O 3.31Å; S5-Y19 WeakPolarHBondContact CB-O 3.28Å; V6-Y19 PolarHBondContact N-O 3.4Å; V6-Y19 PolarHBondContact O-N 3.45Å; Y19-N21 HydrophobicContact CD1-CB 4.18Å; Y19-N21 HydrophobicContact CE1-CB 3.82Å; Y19-K203 HydrophobicContact CE1-CG 4.3Å; Y19-L206 HydrophobicContact CD1-CD1 3.59Å; Y19-L206 HydrophobicContact CE1-CD1 3.6Å
20	D	91.1	Very high	86.5	Confident	63 Å²	63	63.2 Å²	63.2	34%	0.337	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	116.7	170.9	-61.1	-30.5	0	0	0	108.5	V23 K108	D20-V23 HydrophobicContact CB-CG2 4.18Å; D20-K108 VanDerWaalsContact CG-NZ 3.34Å; D20-K108 IonicContact OD1-NZ 2.77Å; D20-K108 PolarHBondContact OD1-NZ 2.97Å; D20-K108 IonicContact OD2-NZ 3.06Å; D20-K108 PolarHBondContact OD2-NZ 3.5Å
21	N	85.4	Confident	86.5	Confident	48 Å²	48	66.9 Å²	66.9	26%	0.257	35%	0.346	S	S	.	.	S	Bend	trans	-93	-41	-178.9	-176	63.5	0	0	0	111.4	I3 F4 Y19 L206 E210	I3-N21 WeakPolarHBondContact O-CB 3.45Å; I3-N21 PolarHBondContact O-ND2 3.13Å; F4-N21 PolarHBondContact O-N 2.84Å; Y19-N21 HydrophobicContact CD1-CB 4.18Å; Y19-N21 HydrophobicContact CE1-CB 3.82Å; N21-L206 HydrophobicContact CB-CD1 4.45Å; N21-E210 PolarHBondContact ND2-OE1 2.82Å
22	Y	77.7	Confident	86.7	Confident	118 Å²	118	60 Å²	60	46%	0.463	32%	0.316	S	S	.	.			trans	-136.7	123	175.3	-179.5	-99	0	0	0	110.9	F4 P24	F4-Y22 AromaticContact CD1-CD1 3.81Å; F4-Y22 HydrophobicContact CD1-CD1 3.81Å; F4-Y22 AromaticContact CE1-CD1 3.97Å; F4-Y22 HydrophobicContact CE1-CD1 3.97Å; F4-Y22 HydrophobicContact CE1-CE1 4.48Å; F4-Y22 PolarHBondContact O-N 3.09Å; Y22-P24 HydrophobicContact CD1-CB 4.49Å; Y22-P24 HydrophobicContact CD1-CG 3.93Å; Y22-P24 HydrophobicContact CE1-CB 3.76Å; Y22-P24 HydrophobicContact CE1-CG 3.65Å
23	V	67.9	Low	86.9	Confident	71 Å²	71	60.7 Å²	60.7	43%	0.43	32%	0.316	S	S	.	.			trans	-107.2	108.7	171.1	-175.9	0	0	0	0	107.8	D20 R25	D20-V23 HydrophobicContact CB-CG2 4.18Å; V23-R25 PolarHBondContact O-N 2.84Å
24	P	65	Low	87	Confident	58 Å²	58	66.6 Å²	66.6	38%	0.377	34%	0.338	S	S	.	.			trans	-60.6	120.5	177.8	-13.3	22.4	0	0	0	110.3	Y22 A26	Y22-P24 HydrophobicContact CD1-CB 4.49Å; Y22-P24 HydrophobicContact CD1-CG 3.93Å; Y22-P24 HydrophobicContact CE1-CB 3.76Å; Y22-P24 HydrophobicContact CE1-CG 3.65Å; P24-A26 PolarHBondContact O-N 2.79Å
25	R	65.2	Low	87	Confident	207 Å²	207	70 Å²	70	78%	0.781	36%	0.356	S	S	*	.			trans	-81.6	55.5	172.5	-65.2	-172.9	-175.3	-174	0.1	110.9	V23 E27	V23-R25 PolarHBondContact O-N 2.84Å; R25-E27 PolarHBondContact O-N 3.44Å
26	A	69.4	Low	86.9	Confident	56 Å²	56	70.5 Å²	70.5	46%	0.463	36%	0.359	S	S	.	.			trans	-74.8	80.5	170	0	0	0	0	0	108.2	P24 G99	P24-A26 PolarHBondContact O-N 2.79Å; A26-G99 WeakPolarHBondContact O-CA 3.39Å
27	E	84.9	Confident	86.7	Confident	101 Å²	101	73.9 Å²	73.9	47%	0.472	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	135.4	177.5	-65.2	176.3	-162.4	0	0	108.8	R25 L64 R97 F98	R25-E27 PolarHBondContact O-N 3.44Å; E27-L64 HydrophobicContact CG-CD1 3.9Å; E27-R97 HydrophobicContact CB-CG 4.36Å; E27-R97 WeakPolarHBondContact OE2-CD 3.47Å; E27-F98 CarbonylContact C-O 3.57Å; E27-F98 VanDerWaalsContact CA-O 3.31Å; E27-F98 WeakPolarHBondContact CA-O 3.45Å
28	A	90.3	Very high	86.6	Confident	13 Å²	13	73.4 Å²	73.4	11%	0.107	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	117.5	175.3	0	0	0	0	0	107.9	I57 R97 F98	A28-I57 HydrophobicContact CB-CG1 3.79Å; A28-R97 WeakPolarHBondContact O-CA 3.37Å; A28-F98 PolarHBondContact N-O 2.86Å; A28-F98 PolarHBondContact O-N 3.36Å
29	E	92.9	Very high	86.6	Confident	96 Å²	96	73.9 Å²	73.9	45%	0.449	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	129.8	174.8	-171.9	164.9	174.2	0	0	109.8	S95 I96 R97	E29-S95 WeakPolarHBondContact CG-OG 3.47Å; E29-S95 PolarHBondContact OE1-OG 2.84Å; E29-I96 WeakPolarHBondContact CA-O 3.47Å; E29-R97 HydrophobicContact CB-CB 4.21Å; E29-R97 HydrophobicContact CB-CG 4.08Å; E29-R97 HydrophobicContact CG-CB 4.19Å; E29-R97 IonicContact OE1-NH2 2.83Å; E29-R97 IonicContact OE2-CZ 3.67Å; E29-R97 VanDerWaalsContact OE2-CZ 3.27Å; E29-R97 IonicContact OE2-NE 2.94Å; E29-R97 PolarHBondContact OE2-NE 2.92Å; E29-R97 IonicContact OE2-NH2 2.82Å; E29-R97 PolarHBondContact OE2-NH2 3.3Å
30	K	93.8	Very high	86.7	Confident	52 Å²	52	72.5 Å²	72.5	23%	0.226	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.5	146.4	-179.1	-171.4	176.8	176.5	-161.4	0	111.6	F32 D55 S95 I96	K30-F32 HydrophobicContact CB-CE2 3.79Å; K30-F32 HydrophobicContact CB-CZ 3.97Å; K30-F32 HydrophobicContact CD-CE1 4.4Å; K30-F32 HydrophobicContact CD-CZ 4.19Å; K30-F32 HydrophobicContact CG-CE2 4.31Å; K30-F32 HydrophobicContact CG-CZ 4.3Å; K30-F32 WeakPolarHBondContact O-CD2 3.3Å; K30-F32 WeakPolarHBondContact O-CE2 3.28Å; K30-D55 HydrophobicContact CD-CB 4.15Å; K30-D55 WeakPolarHBondContact CD-OD2 3.49Å; K30-D55 VanDerWaalsContact CE-OD2 3.25Å; K30-D55 WeakPolarHBondContact CE-OD2 3.45Å; K30-D55 IonicContact NZ-OD2 3.77Å; K30-D55 PolarHBondContact NZ-OD2 2.83Å; K30-S95 CarbonylContact O-C 3.55Å; K30-S95 WeakPolarHBondContact O-CA 3.23Å; K30-I96 PolarHBondContact N-O 3.03Å; K30-I96 PolarHBondContact O-N 2.93Å
31	T	94.9	Very high	86.8	Confident	90 Å²	90	74.4 Å²	74.4	55%	0.552	39%	0.385	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87.1	130.2	170.5	-47.8	0	0	0	0	111	P93 V94	T31-P93 HydrophobicContact CG2-CB 3.89Å; T31-V94 CarbonylContact C-O 3.58Å; T31-V94 WeakPolarHBondContact CA-O 3.33Å
32	F	94.8	Very high	87.2	Confident	7 Å²	7	75.4 Å²	75.4	3%	0.031	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	150.2	-179.5	-63	-93.4	0	0	0	111	K30 L36 D37 L38 I57 Y92 P93 V94 I96 F98	K30-F32 HydrophobicContact CB-CE2 3.79Å; K30-F32 HydrophobicContact CB-CZ 3.97Å; K30-F32 HydrophobicContact CD-CE1 4.4Å; K30-F32 HydrophobicContact CD-CZ 4.19Å; K30-F32 HydrophobicContact CG-CE2 4.31Å; K30-F32 HydrophobicContact CG-CZ 4.3Å; K30-F32 WeakPolarHBondContact O-CD2 3.3Å; K30-F32 WeakPolarHBondContact O-CE2 3.28Å; F32-L36 HydrophobicContact CB-CD1 3.7Å; F32-L36 HydrophobicContact CD1-CD1 3.74Å; F32-L36 HydrophobicContact CD1-CG 4.42Å; F32-L36 HydrophobicContact CD2-CD1 4.25Å; F32-L36 HydrophobicContact CE1-CD1 4.45Å; F32-L36 HydrophobicContact CG-CD1 3.62Å; F32-D37 VanDerWaalsContact CD1-OD1 3.27Å; F32-D37 WeakPolarHBondContact CD1-OD1 3.45Å; F32-D37 VanDerWaalsContact CE1-OD1 3.22Å; F32-D37 WeakPolarHBondContact CE1-OD1 3.49Å; F32-L38 HydrophobicContact CE1-CD1 3.99Å; F32-L38 HydrophobicContact CE1-CG 4.42Å; F32-L38 HydrophobicContact CZ-CD1 4.04Å; F32-I57 HydrophobicContact CE1-CD1 4.48Å; F32-I57 HydrophobicContact CE2-CD1 4.46Å; F32-I57 HydrophobicContact CZ-CD1 3.61Å; F32-Y92 HydrophobicContact CB-CE1 4.32Å; F32-Y92 WeakPolarHBondContact O-CD1 3.45Å; F32-P93 WeakPolarHBondContact O-CA 3.29Å; F32-V94 HydrophobicContact CB-CG1 4.17Å; F32-V94 PolarHBondContact N-O 2.81Å; F32-V94 PolarHBondContact O-N 3.03Å; F32-V94 VanDerWaalsContact O-N 3.08Å; F32-I96 HydrophobicContact CD2-CB 4.06Å; F32-I96 HydrophobicContact CD2-CD1 3.95Å; F32-I96 HydrophobicContact CD2-CG1 3.99Å; F32-I96 HydrophobicContact CE2-CB 3.91Å; F32-I96 HydrophobicContact CE2-CD1 4.37Å; F32-I96 HydrophobicContact CE2-CG1 4.34Å; F32-F98 AromaticContact CE2-CE2 3.81Å; F32-F98 HydrophobicContact CE2-CE2 3.81Å; F32-F98 AromaticContact CZ-CE2 3.83Å; F32-F98 HydrophobicContact CZ-CE2 3.83Å
33	S	95.5	Very high	87.7	Confident	91 Å²	91	74.6 Å²	74.6	64%	0.636	39%	0.39	S	S	*	.			trans	-104.2	164.8	167.7	-56.3	0	0	0	0	109.6	P35 Y92	S33-P35 CarbonylContact O-C 3.5Å; S33-P35 VanDerWaalsContact O-C 3.27Å; S33-P35 VanDerWaalsContact O-O 3.04Å; S33-Y92 WeakPolarHBondContact O-CE1 3.3Å
34	Y	94.3	Very high	88.4	Confident	126 Å²	126	75.7 Å²	75.7	49%	0.494	39%	0.393	S	S	.	.	S	Bend	trans	-81.9	139.1	176.1	-174.1	-92.7	0	0	0	111.1	K87 Y92	Y34-K87 WeakPolarHBondContact CE2-O 3.3Å; Y34-Y92 AromaticContact CD2-CD2 3.9Å; Y34-Y92 HydrophobicContact CD2-CD2 3.9Å; Y34-Y92 AromaticContact CD2-CE2 3.6Å; Y34-Y92 HydrophobicContact CD2-CE2 3.6Å; Y34-Y92 HydrophobicContact CE2-CE2 4.49Å; Y34-Y92 HydrophobicContact CG-CD2 4.37Å; Y34-Y92 HydrophobicContact CG-CE2 4.43Å; Y34-Y92 VanDerWaalsContact N-CD1 3.32Å
35	P	92.3	Very high	89.5	Confident	96 Å²	96	78.1 Å²	78.1	62%	0.623	40%	0.4	S	S	*	.	S	Bend	cis	-77.6	160.6	-10.8	33.8	-35.2	0	0	0	111.9	S33 D37	S33-P35 CarbonylContact O-C 3.5Å; S33-P35 VanDerWaalsContact O-C 3.27Å; S33-P35 VanDerWaalsContact O-O 3.04Å; P35-D37 PolarHBondContact O-N 3.42Å
36	L	92.2	Very high	90.7	Very high	34 Å²	34	70.5 Å²	70.5	18%	0.178	37%	0.372	C	S	.	.	P	Polyproline II helix	trans	-59.6	134.3	174.3	-154.1	80.2	0	0	0	110.5	F32 L38 L40 Y92 I96	F32-L36 HydrophobicContact CB-CD1 3.7Å; F32-L36 HydrophobicContact CD1-CD1 3.74Å; F32-L36 HydrophobicContact CD1-CG 4.42Å; F32-L36 HydrophobicContact CD2-CD1 4.25Å; F32-L36 HydrophobicContact CE1-CD1 4.45Å; F32-L36 HydrophobicContact CG-CD1 3.62Å; L36-L38 HydrophobicContact CD2-CB 3.96Å; L36-L38 HydrophobicContact CG-CB 4.32Å; L36-L38 PolarHBondContact O-N 3.36Å; L36-L40 HydrophobicContact CD2-CD1 3.7Å; L36-L40 HydrophobicContact CD2-CD2 4.39Å; L36-L40 HydrophobicContact CD2-CG 3.85Å; L36-Y92 HydrophobicContact CD1-CE1 4.35Å; L36-I96 HydrophobicContact CD1-CD1 3.89Å
37	D	90.2	Very high	91.9	Very high	77 Å²	77	67.9 Å²	67.9	41%	0.412	35%	0.35	S	S	.	.	S	Bend	trans	-82.8	3.7	176.7	60.8	-17.9	0	0	0	113.2	F32 P35 R54	F32-D37 VanDerWaalsContact CD1-OD1 3.27Å; F32-D37 WeakPolarHBondContact CD1-OD1 3.45Å; F32-D37 VanDerWaalsContact CE1-OD1 3.22Å; F32-D37 WeakPolarHBondContact CE1-OD1 3.49Å; P35-D37 PolarHBondContact O-N 3.42Å; D37-R54 IonicContact OD2-NH1 3.19Å; D37-R54 PolarHBondContact OD2-NH1 2.83Å
38	L	93.2	Very high	92.4	Very high	11 Å²	11	63.8 Å²	63.8	6%	0.058	33%	0.332	C	S	.	.	S	Bend	trans	-116.5	147.1	177.6	-59.4	173.8	0	0	0	110.3	F32 L36 L40 I57 F98	F32-L38 HydrophobicContact CE1-CD1 3.99Å; F32-L38 HydrophobicContact CE1-CG 4.42Å; F32-L38 HydrophobicContact CZ-CD1 4.04Å; L36-L38 HydrophobicContact CD2-CB 3.96Å; L36-L38 HydrophobicContact CG-CB 4.32Å; L36-L38 PolarHBondContact O-N 3.36Å; L38-L40 HydrophobicContact CB-CD2 4.37Å; L38-I57 HydrophobicContact CD1-CD1 4.03Å; L38-I57 HydrophobicContact CD1-CG2 3.9Å; L38-F98 HydrophobicContact CD1-CE2 3.95Å; L38-F98 HydrophobicContact CD1-CZ 3.96Å
39	V	94.3	Very high	92.6	Very high	77 Å²	77	63.2 Å²	63.2	47%	0.467	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	125.3	169.7	-169.4	0	0	0	0	108.2	S50 F51	V39-S50 VanDerWaalsContact CG1-OG 3.32Å; V39-S50 WeakPolarHBondContact CG1-OG 3.36Å; V39-S50 PolarHBondContact O-N 3.3Å; V39-S50 PolarHBondContact O-OG 3.14Å; V39-F51 HydrophobicContact CB-CB 3.86Å; V39-F51 HydrophobicContact CG2-CB 3.89Å; V39-F51 HydrophobicContact CG2-CD1 4.08Å; V39-F51 HydrophobicContact CG2-CG 4.45Å; V39-F51 PolarHBondContact N-O 3.16Å; V39-F51 PolarHBondContact O-N 3.17Å
40	L	94.8	Very high	92.6	Very high	31 Å²	31	60.5 Å²	60.5	16%	0.162	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	146.2	178.6	-53.6	-177.2	0	0	0	110.2	L36 L38 V47 V48 V49 L63 L86 F98	L36-L40 HydrophobicContact CD2-CD1 3.7Å; L36-L40 HydrophobicContact CD2-CD2 4.39Å; L36-L40 HydrophobicContact CD2-CG 3.85Å; L38-L40 HydrophobicContact CB-CD2 4.37Å; L40-V47 HydrophobicContact CB-CG1 3.8Å; L40-V47 HydrophobicContact CD1-CG1 3.92Å; L40-V47 HydrophobicContact CG-CG1 4.37Å; L40-V48 CarbonylContact C-O 3.27Å; L40-V48 WeakPolarHBondContact CA-O 3.13Å; L40-V49 HydrophobicContact CD2-CB 4.35Å; L40-V49 HydrophobicContact CD2-CG2 3.78Å; L40-L63 HydrophobicContact CD1-CD1 4.27Å; L40-L86 HydrophobicContact CD1-CD1 3.52Å; L40-F98 HydrophobicContact CD2-CE1 3.84Å; L40-F98 HydrophobicContact CD2-CZ 4.18Å
41	K	94.4	Very high	92.6	Very high	102 Å²	102	65.2 Å²	65.2	44%	0.443	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	156	172	72.4	-179.6	175.4	175.7	0	110.6	V47 V48	K41-V47 WeakPolarHBondContact O-CA 3.31Å; K41-V48 HydrophobicContact CD-CG2 4.49Å; K41-V48 HydrophobicContact CG-CG2 3.72Å; K41-V48 PolarHBondContact N-O 3.11Å; K41-V48 PolarHBondContact O-N 3.46Å
42	I	93.1	Very high	92.3	Very high	69 Å²	69	61.7 Å²	61.7	35%	0.354	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	130.9	167.4	-65.1	159	0	0	0	108.4	K46 V47 K74 I83	I42-K46 CarbonylContact C-O 3.51Å; I42-K46 WeakPolarHBondContact CA-O 3.47Å; I42-V47 HydrophobicContact CG1-CG2 4.15Å; I42-K74 HydrophobicContact CD1-CB 4.41Å; I42-K74 HydrophobicContact CD1-CD 4.2Å; I42-K74 HydrophobicContact CG1-CB 4.33Å; I42-K74 HydrophobicContact CG2-CD 4.39Å; I42-I83 HydrophobicContact CD1-CD1 3.79Å; I42-I83 HydrophobicContact CG1-CD1 3.68Å; I42-I83 HydrophobicContact CG1-CG1 4.5Å
43	H	88	Confident	92	Very high	102 Å²	102	67.6 Å²	67.6	47%	0.472	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	124.6	173	-171.1	58.8	0	0	0	108.3	E45 K46 V48	H43-E45 VanDerWaalsContact C-N 3.33Å; H43-E45 PolarHBondContact O-N 3.47Å; H43-K46 PolarHBondContact N-O 2.9Å; H43-K46 PolarHBondContact O-N 2.73Å; H43-K46 VanDerWaalsContact O-O 3.07Å; H43-V48 HydrophobicContact CB-CG2 3.68Å
44	D	83.6	Confident	91.6	Very high	93 Å²	93	69.7 Å²	69.7	50%	0.497	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	48	51.4	-177.5	-60.2	-23.1	0	0	0	113.4	K46	D44-K46 PolarHBondContact O-N 3.06Å
45	E	87.6	Confident	91.2	Very high	110 Å²	110	68.2 Å²	68.2	51%	0.514	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	60.5	12.6	-179.1	-61.9	-64	123.4	0	0	115.1	H43 G73 K74	H43-E45 VanDerWaalsContact C-N 3.33Å; H43-E45 PolarHBondContact O-N 3.47Å; E45-G73 CarbonylContact O-C 3.55Å; E45-G73 WeakPolarHBondContact O-CA 3.4Å; E45-K74 PolarHBondContact O-N 3.4Å; E45-K74 IonicContact OE1-NZ 3.81Å; E45-K74 PolarHBondContact OE1-NZ 3.44Å; E45-K74 VanDerWaalsContact OE1-NZ 3.15Å; E45-K74 WeakPolarHBondContact OE2-CD 3.13Å; E45-K74 WeakPolarHBondContact OE2-CE 3.47Å; E45-K74 IonicContact OE2-NZ 2.64Å; E45-K74 PolarHBondContact OE2-NZ 3.09Å
46	K	90.8	Very high	90.8	Very high	47 Å²	47	66.1 Å²	66.1	20%	0.204	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	146.8	176.1	-61.7	164	-170.9	165.5	0	109.9	I42 H43 D44 V48 A101 R102 E107	I42-K46 CarbonylContact C-O 3.51Å; I42-K46 WeakPolarHBondContact CA-O 3.47Å; H43-K46 PolarHBondContact N-O 2.9Å; H43-K46 PolarHBondContact O-N 2.73Å; H43-K46 VanDerWaalsContact O-O 3.07Å; D44-K46 PolarHBondContact O-N 3.06Å; K46-V48 HydrophobicContact CB-CG1 4.39Å; K46-A101 HydrophobicContact CD-CB 3.8Å; K46-R102 PolarHBondContact NZ-O 2.91Å; K46-E107 VanDerWaalsContact NZ-CD 3.31Å; K46-E107 IonicContact NZ-OE1 3.38Å; K46-E107 PolarHBondContact NZ-OE1 2.89Å; K46-E107 IonicContact NZ-OE2 3.15Å; K46-E107 PolarHBondContact NZ-OE2 2.8Å
47	V	94.5	Very high	90.8	Very high	1 Å²	1	64.7 Å²	64.7	1%	0.006	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	118.5	171	177.8	0	0	0	0	109	L40 K41 I42 A62 L63 K74 I82 I83	L40-V47 HydrophobicContact CB-CG1 3.8Å; L40-V47 HydrophobicContact CD1-CG1 3.92Å; L40-V47 HydrophobicContact CG-CG1 4.37Å; K41-V47 WeakPolarHBondContact O-CA 3.31Å; I42-V47 HydrophobicContact CG1-CG2 4.15Å; V47-A62 CarbonylContact O-C 3.57Å; V47-A62 VanDerWaalsContact O-CA 3.31Å; V47-A62 WeakPolarHBondContact O-CA 3.38Å; V47-L63 HydrophobicContact CB-CB 4.31Å; V47-L63 HydrophobicContact CG1-CB 4.42Å; V47-L63 PolarHBondContact O-N 3.19Å; V47-K74 HydrophobicContact CG2-CB 4.25Å; V47-I82 HydrophobicContact CB-CD1 4.47Å; V47-I82 HydrophobicContact CB-CG2 4.43Å; V47-I82 HydrophobicContact CG1-CG2 4.29Å; V47-I82 HydrophobicContact CG2-CB 4.02Å; V47-I82 HydrophobicContact CG2-CD1 4Å; V47-I82 HydrophobicContact CG2-CG2 4.11Å; V47-I83 HydrophobicContact CG2-CG1 4.45Å
48	V	94.4	Very high	90.8	Very high	15 Å²	15	67.5 Å²	67.5	9%	0.091	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	149.7	-176.8	-58.4	0	0	0	0	111.7	L40 K41 H43 K46 S50 H61 A62	L40-V48 CarbonylContact C-O 3.27Å; L40-V48 WeakPolarHBondContact CA-O 3.13Å; K41-V48 HydrophobicContact CD-CG2 4.49Å; K41-V48 HydrophobicContact CG-CG2 3.72Å; K41-V48 PolarHBondContact N-O 3.11Å; K41-V48 PolarHBondContact O-N 3.46Å; H43-V48 HydrophobicContact CB-CG2 3.68Å; K46-V48 HydrophobicContact CB-CG1 4.39Å; V48-S50 PolarHBondContact O-N 3.32Å; V48-H61 CarbonylContact C-O 3.58Å; V48-H61 VanDerWaalsContact CA-O 3.29Å; V48-H61 WeakPolarHBondContact CA-O 3.37Å; V48-A62 HydrophobicContact CG1-CB 4.12Å
49	V	94.7	Very high	90.6	Very high	1 Å²	1	70.3 Å²	70.3	1%	0.006	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.1	115.6	172.7	-178.5	0	0	0	0	108.9	L40 G52 I57 G60 H61 F98	L40-V49 HydrophobicContact CD2-CB 4.35Å; L40-V49 HydrophobicContact CD2-CG2 3.78Å; V49-G52 WeakPolarHBondContact CG1-O 3.46Å; V49-I57 HydrophobicContact CG2-CG2 3.84Å; V49-G60 PolarHBondContact O-N 3.19Å; V49-H61 HydrophobicContact CG2-CB 4.44Å; V49-H61 PolarHBondContact N-O 2.73Å; V49-F98 HydrophobicContact CG2-CD1 3.66Å; V49-F98 HydrophobicContact CG2-CE1 3.65Å; V49-F98 HydrophobicContact CG2-CG 4.48Å; V49-F98 HydrophobicContact CG2-CZ 4.46Å
50	S	93.9	Very high	90.4	Very high	38 Å²	38	69 Å²	69	27%	0.266	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	-30.6	176.4	61.4	0	0	0	0	112.7	V39 V48	V39-S50 VanDerWaalsContact CG1-OG 3.32Å; V39-S50 WeakPolarHBondContact CG1-OG 3.36Å; V39-S50 PolarHBondContact O-N 3.3Å; V39-S50 PolarHBondContact O-OG 3.14Å; V48-S50 PolarHBondContact O-N 3.32Å
51	F	93.2	Very high	90.2	Very high	151 Å²	151	68.1 Å²	68.1	66%	0.662	35%	0.352	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-151.9	148.9	178.8	-174.8	-95.4	0	0	0	111.4	V39	V39-F51 HydrophobicContact CB-CB 3.86Å; V39-F51 HydrophobicContact CG2-CB 3.89Å; V39-F51 HydrophobicContact CG2-CD1 4.08Å; V39-F51 HydrophobicContact CG2-CG 4.45Å; V39-F51 PolarHBondContact N-O 3.16Å; V39-F51 PolarHBondContact O-N 3.17Å
52	G	88.8	Confident	90.1	Very high	17 Å²	17	63.5 Å²	63.5	18%	0.175	33%	0.332	C	S	.	.			trans	96.1	137.7	-174.7	0	0	0	0	0	112.3	V49	V49-G52 WeakPolarHBondContact CG1-O 3.46Å
53	Q	89.1	Confident	90.2	Very high	131 Å²	131	60.5 Å²	60.5	61%	0.612	32%	0.317	S	S	*	.			trans	-141.2	125.6	174.9	-59.8	-168.7	-1.9	0	0	109	I57 V59	Q53-I57 VanDerWaalsContact CA-O 3.28Å; Q53-I57 WeakPolarHBondContact CA-O 3.21Å; Q53-V59 HydrophobicContact CG-CG2 3.95Å
54	R	85.8	Confident	90.4	Very high	135 Å²	135	57.7 Å²	57.7	51%	0.509	31%	0.305	S	S	.	.	B	Isolated β-bridge	trans	-162.3	146	-177.8	-157.7	-169.6	166.6	163	6.6	110.6	D37 G56 I57	D37-R54 IonicContact OD2-NH1 3.19Å; D37-R54 PolarHBondContact OD2-NH1 2.83Å; R54-G56 PolarHBondContact O-N 3.02Å; R54-G56 VanDerWaalsContact O-N 3.09Å; R54-I57 PolarHBondContact N-O 2.97Å; R54-I57 VanDerWaalsContact N-O 3.13Å; R54-I57 WeakPolarHBondContact O-CA 3.32Å; R54-I57 VanDerWaalsContact O-CB 3.26Å; R54-I57 WeakPolarHBondContact O-CB 3Å; R54-I57 PolarHBondContact O-N 2.89Å
55	D	85.9	Confident	90.9	Very high	95 Å²	95	53.2 Å²	53.2	51%	0.508	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.9	40.2	168.6	-51.4	-40	0	0	0	113.9	K30 I57	K30-D55 HydrophobicContact CD-CB 4.15Å; K30-D55 WeakPolarHBondContact CD-OD2 3.49Å; K30-D55 VanDerWaalsContact CE-OD2 3.25Å; K30-D55 WeakPolarHBondContact CE-OD2 3.45Å; K30-D55 IonicContact NZ-OD2 3.77Å; K30-D55 PolarHBondContact NZ-OD2 2.83Å; D55-I57 VanDerWaalsContact C-N 3.33Å; D55-I57 PolarHBondContact O-N 3.45Å
56	G	85.5	Confident	91.3	Very high	52 Å²	52	48.6 Å²	48.6	54%	0.536	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	86.6	-7.6	-179	0	0	0	0	0	115.4	R54 H61	R54-G56 PolarHBondContact O-N 3.02Å; R54-G56 VanDerWaalsContact O-N 3.09Å; G56-H61 PolarHBondContact O-CE1 2.8Å
57	I	91.1	Very high	91.5	Very high	4 Å²	4	50.1 Å²	50.1	2%	0.021	27%	0.27	C	S	.	.	B	Isolated β-bridge	trans	-82.3	127.8	174.2	-54.1	164.7	0	0	0	109	A28 F32 L38 V49 Q53 R54 D55 F98	A28-I57 HydrophobicContact CB-CG1 3.79Å; F32-I57 HydrophobicContact CE1-CD1 4.48Å; F32-I57 HydrophobicContact CE2-CD1 4.46Å; F32-I57 HydrophobicContact CZ-CD1 3.61Å; L38-I57 HydrophobicContact CD1-CD1 4.03Å; L38-I57 HydrophobicContact CD1-CG2 3.9Å; V49-I57 HydrophobicContact CG2-CG2 3.84Å; Q53-I57 VanDerWaalsContact CA-O 3.28Å; Q53-I57 WeakPolarHBondContact CA-O 3.21Å; R54-I57 PolarHBondContact N-O 2.97Å; R54-I57 VanDerWaalsContact N-O 3.13Å; R54-I57 WeakPolarHBondContact O-CA 3.32Å; R54-I57 VanDerWaalsContact O-CB 3.26Å; R54-I57 WeakPolarHBondContact O-CB 3Å; R54-I57 PolarHBondContact O-N 2.89Å; D55-I57 VanDerWaalsContact C-N 3.33Å; D55-I57 PolarHBondContact O-N 3.45Å; I57-F98 HydrophobicContact CD1-CD2 3.56Å; I57-F98 HydrophobicContact CD1-CE2 3.98Å; I57-F98 HydrophobicContact CD1-CG 4.4Å; I57-F98 HydrophobicContact CG1-CB 4.19Å; I57-F98 HydrophobicContact CG1-CD2 3.92Å; I57-F98 HydrophobicContact CG1-CG 4.33Å; I57-F98 HydrophobicContact CG2-CB 4.04Å; I57-F98 HydrophobicContact CG2-CD1 4.4Å; I57-F98 HydrophobicContact CG2-CD2 4.08Å; I57-F98 HydrophobicContact CG2-CG 3.92Å
58	R	89.6	Confident	91.4	Very high	135 Å²	135	52.1 Å²	52.1	51%	0.509	29%	0.291	S	S	.	.			trans	-121.2	157.6	-179.7	-60.9	-176.4	-179.2	-169.3	0.6	111	G60 H61	R58-G60 PolarHBondContact O-N 2.87Å; R58-H61 PolarHBondContact N-ND1 2.74Å; R58-H61 VanDerWaalsContact O-CB 3.29Å; R58-H61 WeakPolarHBondContact O-CB 3.29Å; R58-H61 PolarHBondContact O-N 3.39Å
59	V	90.4	Very high	91.4	Very high	71 Å²	71	55.4 Å²	55.4	43%	0.43	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.8	134.9	170	174.9	0	0	0	0	109	Q53 H61	Q53-V59 HydrophobicContact CG-CG2 3.95Å; V59-H61 VanDerWaalsContact C-N 3.34Å
60	G	88.3	Confident	91.3	Very high	49 Å²	49	60.6 Å²	60.6	51%	0.505	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	87	-8.5	-174.5	0	0	0	0	0	114.9	V49 R58 A62	V49-G60 PolarHBondContact O-N 3.19Å; R58-G60 PolarHBondContact O-N 2.87Å; G60-A62 PolarHBondContact O-N 3.37Å
61	H	91.9	Very high	91.3	Very high	13 Å²	13	60 Å²	60	6%	0.06	33%	0.334	C	S	.	.	P	Polyproline II helix	trans	-63.6	135	167.3	-74.6	-169	0	0	0	109.7	V48 V49 G56 R58 V59 F98 G99	V48-H61 CarbonylContact C-O 3.58Å; V48-H61 VanDerWaalsContact CA-O 3.29Å; V48-H61 WeakPolarHBondContact CA-O 3.37Å; V49-H61 HydrophobicContact CG2-CB 4.44Å; V49-H61 PolarHBondContact N-O 2.73Å; G56-H61 PolarHBondContact O-CE1 2.8Å; R58-H61 PolarHBondContact N-ND1 2.74Å; R58-H61 VanDerWaalsContact O-CB 3.29Å; R58-H61 WeakPolarHBondContact O-CB 3.29Å; R58-H61 PolarHBondContact O-N 3.39Å; V59-H61 VanDerWaalsContact C-N 3.34Å; H61-F98 HydrophobicContact CB-CB 4.1Å; H61-G99 CarbonylContact C-O 3.59Å; H61-G99 WeakPolarHBondContact CA-O 3.48Å
62	A	92.9	Very high	91.2	Very high	4 Å²	4	58.9 Å²	58.9	3%	0.033	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	149.1	172	0	0	0	0	0	110.3	V47 V48 G60 L64 F98 G99 A101	V47-A62 CarbonylContact O-C 3.57Å; V47-A62 VanDerWaalsContact O-CA 3.31Å; V47-A62 WeakPolarHBondContact O-CA 3.38Å; V48-A62 HydrophobicContact CG1-CB 4.12Å; G60-A62 PolarHBondContact O-N 3.37Å; A62-L64 HydrophobicContact CB-CD2 4.41Å; A62-L64 PolarHBondContact O-N 2.91Å; A62-F98 CarbonylContact O-C 3.54Å; A62-F98 VanDerWaalsContact O-CA 3.3Å; A62-F98 WeakPolarHBondContact O-CA 3.48Å; A62-G99 PolarHBondContact N-O 3.19Å; A62-G99 PolarHBondContact O-N 3.34Å; A62-A101 HydrophobicContact CB-CB 3.66Å
63	L	93.9	Very high	91.2	Very high	7 Å²	7	59.4 Å²	59.4	4%	0.037	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.2	120.9	167.8	-164.3	154.1	0	0	0	108.3	L40 V47 I66 V71 I82 L86 I96 F98	L40-L63 HydrophobicContact CD1-CD1 4.27Å; V47-L63 HydrophobicContact CB-CB 4.31Å; V47-L63 HydrophobicContact CG1-CB 4.42Å; V47-L63 PolarHBondContact O-N 3.19Å; L63-I66 HydrophobicContact CD1-CD1 4.35Å; L63-I66 HydrophobicContact CD1-CG1 4.37Å; L63-I66 HydrophobicContact CD2-CD1 4.04Å; L63-I66 HydrophobicContact CD2-CG1 3.56Å; L63-V71 HydrophobicContact CD2-CB 4.29Å; L63-V71 HydrophobicContact CD2-CG1 3.53Å; L63-V71 HydrophobicContact CD2-CG2 3.8Å; L63-V71 VanDerWaalsContact O-CG2 3.28Å; L63-V71 WeakPolarHBondContact O-CG2 3.27Å; L63-I82 HydrophobicContact CD1-CG2 3.92Å; L63-I82 HydrophobicContact CD2-CD1 4.43Å; L63-L86 HydrophobicContact CD1-CD1 4.1Å; L63-I96 HydrophobicContact CD1-CD1 4.42Å; L63-I96 HydrophobicContact CD1-CG2 3.41Å; L63-I96 VanDerWaalsContact CD1-CG2 3.41Å; L63-I96 HydrophobicContact CD2-CG2 4.13Å; L63-I96 HydrophobicContact CG-CG2 3.44Å; L63-I96 VanDerWaalsContact CG-CG2 3.44Å; L63-F98 HydrophobicContact CB-CD1 4.31Å; L63-F98 HydrophobicContact CB-CE1 4.09Å; L63-F98 HydrophobicContact CD1-CE1 4.22Å; L63-F98 HydrophobicContact CD1-CZ 4.36Å; L63-F98 HydrophobicContact CG-CE1 4.25Å
64	L	93.3	Very high	91.4	Very high	42 Å²	42	55.1 Å²	55.1	22%	0.22	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	-39.3	-175.9	-56.9	-178.2	0	0	0	112.1	E27 A62 D70 V71 R97	E27-L64 HydrophobicContact CG-CD1 3.9Å; A62-L64 HydrophobicContact CB-CD2 4.41Å; A62-L64 PolarHBondContact O-N 2.91Å; L64-D70 WeakPolarHBondContact O-CA 2.93Å; L64-V71 WeakPolarHBondContact O-CG2 3.13Å; L64-V71 PolarHBondContact O-N 3.26Å; L64-R97 PolarHBondContact N-O 3.05Å
65	S	94.4	Very high	91.8	Very high	0 Å²	0	52.1 Å²	52.1	0%	0	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.2	155.1	179.6	69.9	0	0	0	0	112.3	V69 I96 R97	S65-V69 CarbonylContact C-O 3.54Å; S65-V69 WeakPolarHBondContact CA-O 3.29Å; S65-V69 WeakPolarHBondContact CB-O 3.37Å; S65-I96 WeakPolarHBondContact O-CA 3.42Å; S65-R97 PolarHBondContact N-O 2.94Å; S65-R97 PolarHBondContact O-N 3.03Å; S65-R97 WeakPolarHBondContact OG-CB 3.49Å
66	I	95.9	Very high	92.1	Very high	12 Å²	12	48.2 Å²	48.2	6%	0.062	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	127.6	174	-58.8	-176.4	0	0	0	108	L63 G68 V69 V71 T76 I82 Y85 V94 S95	L63-I66 HydrophobicContact CD1-CD1 4.35Å; L63-I66 HydrophobicContact CD1-CG1 4.37Å; L63-I66 HydrophobicContact CD2-CD1 4.04Å; L63-I66 HydrophobicContact CD2-CG1 3.56Å; I66-G68 PolarHBondContact O-N 3.04Å; I66-V69 PolarHBondContact N-O 2.82Å; I66-V69 PolarHBondContact O-N 2.7Å; I66-V71 HydrophobicContact CB-CG1 4.48Å; I66-V71 HydrophobicContact CD1-CG1 4.09Å; I66-V71 HydrophobicContact CG1-CG1 3.79Å; I66-T76 HydrophobicContact CD1-CG2 4.21Å; I66-I82 HydrophobicContact CD1-CG1 4.3Å; I66-I82 HydrophobicContact CD1-CG2 4.04Å; I66-Y85 HydrophobicContact CD1-CD1 4.19Å; I66-Y85 HydrophobicContact CD1-CE1 4.44Å; I66-Y85 HydrophobicContact CG2-CE1 3.81Å; I66-V94 HydrophobicContact CG2-CG2 3.4Å; I66-V94 VanDerWaalsContact CG2-CG2 3.4Å; I66-S95 CarbonylContact C-O 3.53Å; I66-S95 WeakPolarHBondContact CA-O 3.34Å
67	N	94.4	Very high	92.3	Very high	80 Å²	80	48.9 Å²	48.9	43%	0.428	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.5	37.8	-177.8	-63.8	-32.4	0	0	0	113.1	V69 S95	N67-V69 PolarHBondContact O-N 2.85Å; N67-S95 PolarHBondContact N-O 2.81Å; N67-S95 PolarHBondContact OD1-N 2.8Å
68	G	92.3	Very high	92.2	Very high	43 Å²	43	55.4 Å²	55.4	44%	0.443	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	78.8	-2.3	-177.9	0	0	0	0	0	115.1	I66	I66-G68 PolarHBondContact O-N 3.04Å
69	V	94.4	Very high	92.3	Very high	83 Å²	83	51.3 Å²	51.3	50%	0.503	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	123	178.5	-172.9	0	0	0	0	110.2	S65 I66 N67 A77	S65-V69 CarbonylContact C-O 3.54Å; S65-V69 WeakPolarHBondContact CA-O 3.29Å; S65-V69 WeakPolarHBondContact CB-O 3.37Å; I66-V69 PolarHBondContact N-O 2.82Å; I66-V69 PolarHBondContact O-N 2.7Å; N67-V69 PolarHBondContact O-N 2.85Å; V69-A77 HydrophobicContact CG1-CB 3.5Å; V69-A77 VanDerWaalsContact CG1-CB 3.5Å
70	D	93	Very high	92.4	Very high	110 Å²	110	53.8 Å²	53.8	59%	0.588	33%	0.33	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-61.3	139.1	-180	-68.9	-21.1	0	0	0	111.4	L64	L64-D70 WeakPolarHBondContact O-CA 2.93Å
71	V	93.5	Very high	92.7	Very high	27 Å²	27	54.8 Å²	54.8	16%	0.164	32%	0.321	C	S	.	.	P	Polyproline II helix	trans	-89.2	155.2	177.9	-59.1	0	0	0	0	111.6	L63 L64 I66 F75 I82	L63-V71 HydrophobicContact CD2-CB 4.29Å; L63-V71 HydrophobicContact CD2-CG1 3.53Å; L63-V71 HydrophobicContact CD2-CG2 3.8Å; L63-V71 VanDerWaalsContact O-CG2 3.28Å; L63-V71 WeakPolarHBondContact O-CG2 3.27Å; L64-V71 WeakPolarHBondContact O-CG2 3.13Å; L64-V71 PolarHBondContact O-N 3.26Å; I66-V71 HydrophobicContact CB-CG1 4.48Å; I66-V71 HydrophobicContact CD1-CG1 4.09Å; I66-V71 HydrophobicContact CG1-CG1 3.79Å; V71-F75 WeakPolarHBondContact CB-O 3.39Å; V71-I82 HydrophobicContact CB-CD1 3.76Å; V71-I82 HydrophobicContact CG1-CD1 3.88Å; V71-I82 HydrophobicContact CG1-CG1 4.38Å; V71-I82 HydrophobicContact CG2-CD1 3.9Å
72	N	91	Very high	92.9	Very high	126 Å²	126	54.1 Å²	54.1	67%	0.674	32%	0.318	S	S	*	.	B	Isolated β-bridge	trans	-107.4	90.7	175.8	-171.5	10.1	0	0	0	110.2	K74 F75	N72-K74 PolarHBondContact O-N 3.37Å; N72-F75 PolarHBondContact N-O 2.95Å; N72-F75 PolarHBondContact O-N 2.84Å
73	G	88.5	Confident	92.9	Very high	28 Å²	28	56 Å²	56	29%	0.289	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	63.4	-106.8	-178.7	0	0	0	0	0	111.8	E45	E45-G73 CarbonylContact O-C 3.55Å; E45-G73 WeakPolarHBondContact O-CA 3.4Å
74	K	93.2	Very high	92.9	Very high	42 Å²	42	61.6 Å²	61.6	18%	0.183	35%	0.353	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.2	1.3	177.6	70.4	-171.8	-179.3	-154.9	0	114.6	I42 E45 V47 N72 I82	I42-K74 HydrophobicContact CD1-CB 4.41Å; I42-K74 HydrophobicContact CD1-CD 4.2Å; I42-K74 HydrophobicContact CG1-CB 4.33Å; I42-K74 HydrophobicContact CG2-CD 4.39Å; E45-K74 PolarHBondContact O-N 3.4Å; E45-K74 IonicContact OE1-NZ 3.81Å; E45-K74 PolarHBondContact OE1-NZ 3.44Å; E45-K74 VanDerWaalsContact OE1-NZ 3.15Å; E45-K74 WeakPolarHBondContact OE2-CD 3.13Å; E45-K74 WeakPolarHBondContact OE2-CE 3.47Å; E45-K74 IonicContact OE2-NZ 2.64Å; E45-K74 PolarHBondContact OE2-NZ 3.09Å; V47-K74 HydrophobicContact CG2-CB 4.25Å; N72-K74 PolarHBondContact O-N 3.37Å; K74-I82 VanDerWaalsContact C-CD1 3.5Å; K74-I82 WeakPolarHBondContact O-CG1 3.19Å; K74-I82 PolarHBondContact O-N 2.77Å
75	F	94.7	Very high	92.9	Very high	72 Å²	72	61.5 Å²	61.5	32%	0.316	35%	0.35	S	S	.	.	B	Isolated β-bridge	trans	-112.9	146.9	-177.7	-57.1	-82.7	0	0	0	111.8	V71 N72 G79 K80 E81	V71-F75 WeakPolarHBondContact CB-O 3.39Å; N72-F75 PolarHBondContact N-O 2.95Å; N72-F75 PolarHBondContact O-N 2.84Å; F75-G79 WeakPolarHBondContact CD1-O 3.33Å; F75-K80 CarbonylContact C-O 3.51Å; F75-K80 VanDerWaalsContact CA-O 3.27Å; F75-K80 WeakPolarHBondContact CA-O 3.31Å; F75-E81 HydrophobicContact CD1-CG 3.88Å; F75-E81 HydrophobicContact CE1-CG 3.55Å; F75-E81 HydrophobicContact CZ-CG 4.47Å
76	T	92.8	Very high	92.9	Very high	12 Å²	12	62.1 Å²	62.1	7%	0.074	35%	0.354	C	S	.	.			trans	-67	168.1	166.1	67.8	0	0	0	0	110.2	I66 D78 G79 K80 I82 Y85	I66-T76 HydrophobicContact CD1-CG2 4.21Å; T76-D78 PolarHBondContact O-N 2.87Å; T76-D78 VanDerWaalsContact O-N 3.14Å; T76-D78 PolarHBondContact OG1-N 3.28Å; T76-G79 PolarHBondContact O-N 2.83Å; T76-K80 PolarHBondContact N-O 2.85Å; T76-K80 PolarHBondContact OG1-N 3Å; T76-K80 PolarHBondContact OG1-O 3.31Å; T76-I82 HydrophobicContact CG2-CG1 4.04Å; T76-Y85 HydrophobicContact CG2-CD1 4.48Å; T76-Y85 HydrophobicContact CG2-CD2 4.44Å; T76-Y85 HydrophobicContact CG2-CG 4.12Å
77	A	89.9	Confident	92.8	Very high	66 Å²	66	68.4 Å²	68.4	55%	0.545	38%	0.38	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.7	-26.5	174.4	0	0	0	0	0	113.1	V69 G79	V69-A77 HydrophobicContact CG1-CB 3.5Å; V69-A77 VanDerWaalsContact CG1-CB 3.5Å; A77-G79 VanDerWaalsContact C-N 3.28Å; A77-G79 PolarHBondContact O-N 2.87Å
78	D	89	Confident	92.8	Very high	141 Å²	141	68 Å²	68	75%	0.754	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85	4.9	177	-53.9	-40.5	0	0	0	113.5	T76 K80	T76-D78 PolarHBondContact O-N 2.87Å; T76-D78 VanDerWaalsContact O-N 3.14Å; T76-D78 PolarHBondContact OG1-N 3.28Å; D78-K80 VanDerWaalsContact C-N 3.32Å; D78-K80 PolarHBondContact O-N 3.01Å
79	G	90.5	Very high	93	Very high	50 Å²	50	69.1 Å²	69.1	52%	0.515	38%	0.379	S	S	.	.	S	Bend	trans	79	6.8	178.2	0	0	0	0	0	115.4	F75 T76 A77	F75-G79 WeakPolarHBondContact CD1-O 3.33Å; T76-G79 PolarHBondContact O-N 2.83Å; A77-G79 VanDerWaalsContact C-N 3.28Å; A77-G79 PolarHBondContact O-N 2.87Å
80	K	92.3	Very high	93	Very high	123 Å²	123	70.3 Å²	70.3	54%	0.535	39%	0.387	S	S	.	.			trans	-79.3	144.1	173.5	-65.5	-177.5	179.7	177.7	0	110.3	F75 T76 D78 I82	F75-K80 CarbonylContact C-O 3.51Å; F75-K80 VanDerWaalsContact CA-O 3.27Å; F75-K80 WeakPolarHBondContact CA-O 3.31Å; T76-K80 PolarHBondContact N-O 2.85Å; T76-K80 PolarHBondContact OG1-N 3Å; T76-K80 PolarHBondContact OG1-O 3.31Å; D78-K80 VanDerWaalsContact C-N 3.32Å; D78-K80 PolarHBondContact O-N 3.01Å; K80-I82 PolarHBondContact O-N 2.95Å
81	E	95.1	Very high	93	Very high	69 Å²	69	67 Å²	67	32%	0.322	37%	0.369	S	S	.	.	B	Isolated β-bridge	trans	-64	130.4	172.5	-73.3	-161.2	176.6	0	0	110.7	F75 I83 E84 Y85	F75-E81 HydrophobicContact CD1-CG 3.88Å; F75-E81 HydrophobicContact CE1-CG 3.55Å; F75-E81 HydrophobicContact CZ-CG 4.47Å; E81-I83 VanDerWaalsContact C-N 3.29Å; E81-I83 PolarHBondContact O-N 2.94Å; E81-E84 HydrophobicContact CB-CB 4.28Å; E81-E84 HydrophobicContact CB-CG 4.02Å; E81-E84 PolarHBondContact O-N 3.33Å; E81-E84 VanDerWaalsContact O-N 3.14Å; E81-Y85 PolarHBondContact O-N 3.43Å
82	I	95.2	Very high	93.1	Very high	0 Å²	0	67.1 Å²	67.1	0%	0	37%	0.367	C	S	.	.	H	α-helix	trans	-60.3	-40.3	-176.2	-68.9	165	0	0	0	111.2	V47 L63 I66 V71 K74 T76 K80 E84 Y85 L86	V47-I82 HydrophobicContact CB-CD1 4.47Å; V47-I82 HydrophobicContact CB-CG2 4.43Å; V47-I82 HydrophobicContact CG1-CG2 4.29Å; V47-I82 HydrophobicContact CG2-CB 4.02Å; V47-I82 HydrophobicContact CG2-CD1 4Å; V47-I82 HydrophobicContact CG2-CG2 4.11Å; L63-I82 HydrophobicContact CD1-CG2 3.92Å; L63-I82 HydrophobicContact CD2-CD1 4.43Å; I66-I82 HydrophobicContact CD1-CG1 4.3Å; I66-I82 HydrophobicContact CD1-CG2 4.04Å; V71-I82 HydrophobicContact CB-CD1 3.76Å; V71-I82 HydrophobicContact CG1-CD1 3.88Å; V71-I82 HydrophobicContact CG1-CG1 4.38Å; V71-I82 HydrophobicContact CG2-CD1 3.9Å; K74-I82 VanDerWaalsContact C-CD1 3.5Å; K74-I82 WeakPolarHBondContact O-CG1 3.19Å; K74-I82 PolarHBondContact O-N 2.77Å; T76-I82 HydrophobicContact CG2-CG1 4.04Å; K80-I82 PolarHBondContact O-N 2.95Å; I82-E84 VanDerWaalsContact C-N 3.3Å; I82-E84 PolarHBondContact O-N 2.83Å; I82-Y85 PolarHBondContact O-N 3.48Å; I82-L86 HydrophobicContact CG2-CD1 3.75Å; I82-L86 HydrophobicContact CG2-CG 4.26Å; I82-L86 WeakPolarHBondContact O-CB 3.5Å; I82-L86 VanDerWaalsContact O-CG 3.3Å; I82-L86 WeakPolarHBondContact O-CG 3.28Å; I82-L86 PolarHBondContact O-N 3.32Å
83	I	94.1	Very high	93.4	Very high	43 Å²	43	65.7 Å²	65.7	22%	0.221	37%	0.365	C	S	.	.	H	α-helix	trans	-64.4	-37.6	179.9	-67.6	-174.1	0	0	0	110.9	I42 V47 E81 K87	I42-I83 HydrophobicContact CD1-CD1 3.79Å; I42-I83 HydrophobicContact CG1-CD1 3.68Å; I42-I83 HydrophobicContact CG1-CG1 4.5Å; V47-I83 HydrophobicContact CG2-CG1 4.45Å; E81-I83 VanDerWaalsContact C-N 3.29Å; E81-I83 PolarHBondContact O-N 2.94Å; I83-K87 HydrophobicContact CG2-CD 4.41Å; I83-K87 VanDerWaalsContact O-CG 3.27Å; I83-K87 WeakPolarHBondContact O-CG 3.49Å; I83-K87 PolarHBondContact O-N 3.14Å
84	E	93.4	Very high	93.7	Very high	125 Å²	125	64.4 Å²	64.4	58%	0.584	35%	0.351	S	S	*	.	H	α-helix	trans	-70.7	-44.2	175.9	-62.7	-171.9	155	0	0	111.1	E81 I82 L86 K87	E81-E84 HydrophobicContact CB-CB 4.28Å; E81-E84 HydrophobicContact CB-CG 4.02Å; E81-E84 PolarHBondContact O-N 3.33Å; E81-E84 VanDerWaalsContact O-N 3.14Å; I82-E84 VanDerWaalsContact C-N 3.3Å; I82-E84 PolarHBondContact O-N 2.83Å; E84-L86 VanDerWaalsContact C-N 3.31Å; E84-L86 PolarHBondContact O-N 3.35Å; E84-K87 PolarHBondContact O-N 3.05Å; E84-K87 VanDerWaalsContact O-N 3.14Å
85	Y	94.1	Very high	93.8	Very high	39 Å²	39	63.4 Å²	63.4	15%	0.153	35%	0.349	C	S	.	.	H	α-helix	trans	-55.8	-44.3	176.4	179.9	-93.6	0	0	0	112.3	I66 T76 E81 I82 K87 D88 N91 V94	I66-Y85 HydrophobicContact CD1-CD1 4.19Å; I66-Y85 HydrophobicContact CD1-CE1 4.44Å; I66-Y85 HydrophobicContact CG2-CE1 3.81Å; T76-Y85 HydrophobicContact CG2-CD1 4.48Å; T76-Y85 HydrophobicContact CG2-CD2 4.44Å; T76-Y85 HydrophobicContact CG2-CG 4.12Å; E81-Y85 PolarHBondContact O-N 3.43Å; I82-Y85 PolarHBondContact O-N 3.48Å; Y85-K87 VanDerWaalsContact C-N 3.33Å; Y85-K87 PolarHBondContact O-N 3.33Å; Y85-D88 PolarHBondContact O-N 3.17Å; Y85-N91 HydrophobicContact CE1-CB 4Å; Y85-N91 HydrophobicContact CE2-CB 3.98Å; Y85-N91 VanDerWaalsContact CE2-CG 3.45Å; Y85-N91 PolarHBondContact O-ND2 3.19Å; Y85-V94 HydrophobicContact CE1-CG2 4.25Å
86	L	94.1	Very high	93.8	Very high	14 Å²	14	60 Å²	60	7%	0.073	33%	0.334	C	S	.	.	H	α-helix	trans	-77.4	-13.7	-179	-66.4	176.1	0	0	0	114.1	L40 L63 I82 E84 Y92 V94 I96	L40-L86 HydrophobicContact CD1-CD1 3.52Å; L63-L86 HydrophobicContact CD1-CD1 4.1Å; I82-L86 HydrophobicContact CG2-CD1 3.75Å; I82-L86 HydrophobicContact CG2-CG 4.26Å; I82-L86 WeakPolarHBondContact O-CB 3.5Å; I82-L86 VanDerWaalsContact O-CG 3.3Å; I82-L86 WeakPolarHBondContact O-CG 3.28Å; I82-L86 PolarHBondContact O-N 3.32Å; E84-L86 VanDerWaalsContact C-N 3.31Å; E84-L86 PolarHBondContact O-N 3.35Å; L86-Y92 VanDerWaalsContact O-CE2 3.3Å; L86-Y92 WeakPolarHBondContact O-CE2 3.43Å; L86-Y92 PolarHBondContact O-OH 2.91Å; L86-V94 HydrophobicContact CD2-CG1 4.18Å; L86-V94 HydrophobicContact CD2-CG2 4.46Å; L86-I96 HydrophobicContact CD1-CD1 4.26Å; L86-I96 HydrophobicContact CD2-CD1 3.75Å
87	K	93.9	Very high	93.9	Very high	143 Å²	143	62.1 Å²	62.1	62%	0.622	34%	0.341	S	S	*	.	H	α-helix	trans	-79.7	-23.6	173.8	-81.1	172.1	-179.1	176.8	0	112.9	Y34 I83 E84 Y85	Y34-K87 WeakPolarHBondContact CE2-O 3.3Å; I83-K87 HydrophobicContact CG2-CD 4.41Å; I83-K87 VanDerWaalsContact O-CG 3.27Å; I83-K87 WeakPolarHBondContact O-CG 3.49Å; I83-K87 PolarHBondContact O-N 3.14Å; E84-K87 PolarHBondContact O-N 3.05Å; E84-K87 VanDerWaalsContact O-N 3.14Å; Y85-K87 VanDerWaalsContact C-N 3.33Å; Y85-K87 PolarHBondContact O-N 3.33Å
88	D	94.5	Very high	94.1	Very high	71 Å²	71	59 Å²	59	38%	0.38	32%	0.315	S	S	.	.			trans	-82.9	115.9	179.7	-179.4	-6.4	0	0	0	110.7	Y85 T90 N91 Y92	Y85-D88 PolarHBondContact O-N 3.17Å; D88-T90 PolarHBondContact O-N 3.3Å; D88-T90 WeakPolarHBondContact OD1-CB 3.46Å; D88-T90 WeakPolarHBondContact OD1-CG2 3.44Å; D88-T90 PolarHBondContact OD1-N 3.47Å; D88-T90 PolarHBondContact OD1-OG1 3.32Å; D88-T90 PolarHBondContact OD2-OG1 3.44Å; D88-T90 VanDerWaalsContact OD2-OG1 3.11Å; D88-N91 WeakPolarHBondContact CB-ND2 3.19Å; D88-N91 PolarHBondContact O-N 2.95Å; D88-Y92 WeakPolarHBondContact O-CD2 3.31Å
89	S	95	Very high	94.1	Very high	68 Å²	68	52.3 Å²	52.3	48%	0.476	28%	0.279	S	S	.	.	G	3₁₀ helix	trans	-62.7	-21.3	-179.4	53.8	0	0	0	0	114	N91 Y92	S89-N91 PolarHBondContact O-N 3.29Å; S89-Y92 PolarHBondContact O-N 2.96Å
90	T	95.9	Very high	93.8	Very high	108 Å²	108	57.3 Å²	57.3	66%	0.663	28%	0.283	S	S	*	.	G	3₁₀ helix	trans	-72.8	-18.1	-179	66.4	0	0	0	0	113.2	D88 Y92	D88-T90 PolarHBondContact O-N 3.3Å; D88-T90 WeakPolarHBondContact OD1-CB 3.46Å; D88-T90 WeakPolarHBondContact OD1-CG2 3.44Å; D88-T90 PolarHBondContact OD1-N 3.47Å; D88-T90 PolarHBondContact OD1-OG1 3.32Å; D88-T90 PolarHBondContact OD2-OG1 3.44Å; D88-T90 VanDerWaalsContact OD2-OG1 3.11Å; T90-Y92 VanDerWaalsContact C-N 3.26Å; T90-Y92 PolarHBondContact O-N 2.77Å
91	N	93.4	Very high	93.3	Very high	39 Å²	39	53.1 Å²	53.1	21%	0.209	27%	0.271	C	S	.	.	G	3₁₀ helix	trans	-82.6	-0.7	178	-65.5	-42.4	0	0	0	113.5	Y85 D88 S89	Y85-N91 HydrophobicContact CE1-CB 4Å; Y85-N91 HydrophobicContact CE2-CB 3.98Å; Y85-N91 VanDerWaalsContact CE2-CG 3.45Å; Y85-N91 PolarHBondContact O-ND2 3.19Å; D88-N91 WeakPolarHBondContact CB-ND2 3.19Å; D88-N91 PolarHBondContact O-N 2.95Å; S89-N91 PolarHBondContact O-N 3.29Å
92	Y	95.5	Very high	92.7	Very high	31 Å²	31	59 Å²	59	12%	0.122	29%	0.29	C	S	.	.			trans	-99.1	149.4	-179.3	-71	-101.6	0	0	0	111.5	F32 S33 Y34 L36 L86 D88 S89 T90 V94	F32-Y92 HydrophobicContact CB-CE1 4.32Å; F32-Y92 WeakPolarHBondContact O-CD1 3.45Å; S33-Y92 WeakPolarHBondContact O-CE1 3.3Å; Y34-Y92 AromaticContact CD2-CD2 3.9Å; Y34-Y92 HydrophobicContact CD2-CD2 3.9Å; Y34-Y92 AromaticContact CD2-CE2 3.6Å; Y34-Y92 HydrophobicContact CD2-CE2 3.6Å; Y34-Y92 HydrophobicContact CE2-CE2 4.49Å; Y34-Y92 HydrophobicContact CG-CD2 4.37Å; Y34-Y92 HydrophobicContact CG-CE2 4.43Å; Y34-Y92 VanDerWaalsContact N-CD1 3.32Å; L36-Y92 HydrophobicContact CD1-CE1 4.35Å; L86-Y92 VanDerWaalsContact O-CE2 3.3Å; L86-Y92 WeakPolarHBondContact O-CE2 3.43Å; L86-Y92 PolarHBondContact O-OH 2.91Å; D88-Y92 WeakPolarHBondContact O-CD2 3.31Å; S89-Y92 PolarHBondContact O-N 2.96Å; T90-Y92 VanDerWaalsContact C-N 3.26Å; T90-Y92 PolarHBondContact O-N 2.77Å; Y92-V94 HydrophobicContact CD1-CB 4.41Å; Y92-V94 HydrophobicContact CD1-CG1 3.62Å; Y92-V94 HydrophobicContact CE1-CG1 3.48Å; Y92-V94 VanDerWaalsContact CE1-CG1 3.48Å; Y92-V94 HydrophobicContact CG-CG1 4.36Å
93	P	95.4	Very high	92.2	Very high	96 Å²	96	62.7 Å²	62.7	62%	0.623	31%	0.309	S	S	*	.	S	Bend	cis	-72.5	145.7	2	30.3	-35.3	0	0	0	113	T31 F32	T31-P93 HydrophobicContact CG2-CB 3.89Å; F32-P93 WeakPolarHBondContact O-CA 3.29Å
94	V	95.4	Very high	91.9	Very high	0 Å²	0	63.2 Å²	63.2	0%	0	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	128.5	-175.8	65.4	0	0	0	0	110.7	T31 F32 I66 Y85 L86 Y92 I96	T31-V94 CarbonylContact C-O 3.58Å; T31-V94 WeakPolarHBondContact CA-O 3.33Å; F32-V94 HydrophobicContact CB-CG1 4.17Å; F32-V94 PolarHBondContact N-O 2.81Å; F32-V94 PolarHBondContact O-N 3.03Å; F32-V94 VanDerWaalsContact O-N 3.08Å; I66-V94 HydrophobicContact CG2-CG2 3.4Å; I66-V94 VanDerWaalsContact CG2-CG2 3.4Å; Y85-V94 HydrophobicContact CE1-CG2 4.25Å; L86-V94 HydrophobicContact CD2-CG1 4.18Å; L86-V94 HydrophobicContact CD2-CG2 4.46Å; Y92-V94 HydrophobicContact CD1-CB 4.41Å; Y92-V94 HydrophobicContact CD1-CG1 3.62Å; Y92-V94 HydrophobicContact CE1-CG1 3.48Å; Y92-V94 VanDerWaalsContact CE1-CG1 3.48Å; Y92-V94 HydrophobicContact CG-CG1 4.36Å; V94-I96 HydrophobicContact CG1-CD1 3.96Å; V94-I96 HydrophobicContact CG1-CG1 4.05Å; V94-I96 HydrophobicContact CG2-CG1 4.01Å
95	S	95.6	Very high	91.7	Very high	21 Å²	21	61.3 Å²	61.3	15%	0.147	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	128.4	169.1	-166.2	0	0	0	0	109.3	E29 K30 I66 N67	E29-S95 WeakPolarHBondContact CG-OG 3.47Å; E29-S95 PolarHBondContact OE1-OG 2.84Å; K30-S95 CarbonylContact O-C 3.55Å; K30-S95 WeakPolarHBondContact O-CA 3.23Å; I66-S95 CarbonylContact C-O 3.53Å; I66-S95 WeakPolarHBondContact CA-O 3.34Å; N67-S95 PolarHBondContact N-O 2.81Å; N67-S95 PolarHBondContact OD1-N 2.8Å
96	I	95.3	Very high	91.5	Very high	0 Å²	0	65.4 Å²	65.4	0%	0	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	128.8	178.2	-52.2	176.7	0	0	0	108.9	E29 K30 F32 L36 L63 S65 L86 V94 F98	E29-I96 WeakPolarHBondContact CA-O 3.47Å; K30-I96 PolarHBondContact N-O 3.03Å; K30-I96 PolarHBondContact O-N 2.93Å; F32-I96 HydrophobicContact CD2-CB 4.06Å; F32-I96 HydrophobicContact CD2-CD1 3.95Å; F32-I96 HydrophobicContact CD2-CG1 3.99Å; F32-I96 HydrophobicContact CE2-CB 3.91Å; F32-I96 HydrophobicContact CE2-CD1 4.37Å; F32-I96 HydrophobicContact CE2-CG1 4.34Å; L36-I96 HydrophobicContact CD1-CD1 3.89Å; L63-I96 HydrophobicContact CD1-CD1 4.42Å; L63-I96 HydrophobicContact CD1-CG2 3.41Å; L63-I96 VanDerWaalsContact CD1-CG2 3.41Å; L63-I96 HydrophobicContact CD2-CG2 4.13Å; L63-I96 HydrophobicContact CG-CG2 3.44Å; L63-I96 VanDerWaalsContact CG-CG2 3.44Å; S65-I96 WeakPolarHBondContact O-CA 3.42Å; L86-I96 HydrophobicContact CD1-CD1 4.26Å; L86-I96 HydrophobicContact CD2-CD1 3.75Å; V94-I96 HydrophobicContact CG1-CD1 3.96Å; V94-I96 HydrophobicContact CG1-CG1 4.05Å; V94-I96 HydrophobicContact CG2-CG1 4.01Å; I96-F98 HydrophobicContact CB-CD2 4.37Å; I96-F98 HydrophobicContact CB-CE2 3.74Å; I96-F98 HydrophobicContact CB-CZ 4.21Å; I96-F98 HydrophobicContact CD1-CZ 4.42Å; I96-F98 HydrophobicContact CG2-CD2 3.88Å; I96-F98 HydrophobicContact CG2-CE1 4.1Å; I96-F98 HydrophobicContact CG2-CE2 3.35Å; I96-F98 HydrophobicContact CG2-CG 4.47Å; I96-F98 HydrophobicContact CG2-CZ 3.48Å; I96-F98 VanDerWaalsContact CG2-CZ 3.48Å
97	R	93.9	Very high	91.3	Very high	58 Å²	58	66.1 Å²	66.1	22%	0.219	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	122.4	171.3	-165.4	-179.8	-56.3	143.7	4.2	109.8	E27 A28 E29 L64 S65	E27-R97 HydrophobicContact CB-CG 4.36Å; E27-R97 WeakPolarHBondContact OE2-CD 3.47Å; A28-R97 WeakPolarHBondContact O-CA 3.37Å; E29-R97 HydrophobicContact CB-CB 4.21Å; E29-R97 HydrophobicContact CB-CG 4.08Å; E29-R97 HydrophobicContact CG-CB 4.19Å; E29-R97 IonicContact OE1-NH2 2.83Å; E29-R97 IonicContact OE2-CZ 3.67Å; E29-R97 VanDerWaalsContact OE2-CZ 3.27Å; E29-R97 IonicContact OE2-NE 2.94Å; E29-R97 PolarHBondContact OE2-NE 2.92Å; E29-R97 IonicContact OE2-NH2 2.82Å; E29-R97 PolarHBondContact OE2-NH2 3.3Å; L64-R97 PolarHBondContact N-O 3.05Å; S65-R97 PolarHBondContact N-O 2.94Å; S65-R97 PolarHBondContact O-N 3.03Å; S65-R97 WeakPolarHBondContact OG-CB 3.49Å
98	F	93.5	Very high	91.2	Very high	0 Å²	0	60 Å²	60	0%	0	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	146.2	173.9	-66.6	-84.6	0	0	0	110.4	E27 A28 F32 L38 L40 V49 I57 H61 A62 L63 I96	E27-F98 CarbonylContact C-O 3.57Å; E27-F98 VanDerWaalsContact CA-O 3.31Å; E27-F98 WeakPolarHBondContact CA-O 3.45Å; A28-F98 PolarHBondContact N-O 2.86Å; A28-F98 PolarHBondContact O-N 3.36Å; F32-F98 AromaticContact CE2-CE2 3.81Å; F32-F98 HydrophobicContact CE2-CE2 3.81Å; F32-F98 AromaticContact CZ-CE2 3.83Å; F32-F98 HydrophobicContact CZ-CE2 3.83Å; L38-F98 HydrophobicContact CD1-CE2 3.95Å; L38-F98 HydrophobicContact CD1-CZ 3.96Å; L40-F98 HydrophobicContact CD2-CE1 3.84Å; L40-F98 HydrophobicContact CD2-CZ 4.18Å; V49-F98 HydrophobicContact CG2-CD1 3.66Å; V49-F98 HydrophobicContact CG2-CE1 3.65Å; V49-F98 HydrophobicContact CG2-CG 4.48Å; V49-F98 HydrophobicContact CG2-CZ 4.46Å; I57-F98 HydrophobicContact CD1-CD2 3.56Å; I57-F98 HydrophobicContact CD1-CE2 3.98Å; I57-F98 HydrophobicContact CD1-CG 4.4Å; I57-F98 HydrophobicContact CG1-CB 4.19Å; I57-F98 HydrophobicContact CG1-CD2 3.92Å; I57-F98 HydrophobicContact CG1-CG 4.33Å; I57-F98 HydrophobicContact CG2-CB 4.04Å; I57-F98 HydrophobicContact CG2-CD1 4.4Å; I57-F98 HydrophobicContact CG2-CD2 4.08Å; I57-F98 HydrophobicContact CG2-CG 3.92Å; H61-F98 HydrophobicContact CB-CB 4.1Å; A62-F98 CarbonylContact O-C 3.54Å; A62-F98 VanDerWaalsContact O-CA 3.3Å; A62-F98 WeakPolarHBondContact O-CA 3.48Å; L63-F98 HydrophobicContact CB-CD1 4.31Å; L63-F98 HydrophobicContact CB-CE1 4.09Å; L63-F98 HydrophobicContact CD1-CE1 4.22Å; L63-F98 HydrophobicContact CD1-CZ 4.36Å; L63-F98 HydrophobicContact CG-CE1 4.25Å; I96-F98 HydrophobicContact CB-CD2 4.37Å; I96-F98 HydrophobicContact CB-CE2 3.74Å; I96-F98 HydrophobicContact CB-CZ 4.21Å; I96-F98 HydrophobicContact CD1-CZ 4.42Å; I96-F98 HydrophobicContact CG2-CD2 3.88Å; I96-F98 HydrophobicContact CG2-CE1 4.1Å; I96-F98 HydrophobicContact CG2-CE2 3.35Å; I96-F98 HydrophobicContact CG2-CG 4.47Å; I96-F98 HydrophobicContact CG2-CZ 3.48Å; I96-F98 VanDerWaalsContact CG2-CZ 3.48Å
99	G	90.6	Very high	91.1	Very high	0 Å²	0	60.1 Å²	60.1	0%	0	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-167.9	-177.3	172.4	0	0	0	0	0	112	A26 H61 A62 A101	A26-G99 WeakPolarHBondContact O-CA 3.39Å; H61-G99 CarbonylContact C-O 3.59Å; H61-G99 WeakPolarHBondContact CA-O 3.48Å; A62-G99 PolarHBondContact N-O 3.19Å; A62-G99 PolarHBondContact O-N 3.34Å; G99-A101 PolarHBondContact O-N 3.29Å
100	R	84.2	Confident	91	Very high	156 Å²	156	61.5 Å²	61.5	59%	0.589	32%	0.318	S	S	*	.	P	Polyproline II helix	trans	-71.5	120.2	172	-77.3	-170	172.4	-170.5	-2	109.6
101	A	81.4	Confident	90.8	Very high	34 Å²	34	59.9 Å²	59.9	28%	0.281	31%	0.305	S	S	.	.	P	Polyproline II helix	trans	-60	140.1	171.1	0	0	0	0	0	110.2	K46 A62 G99	K46-A101 HydrophobicContact CD-CB 3.8Å; A62-A101 HydrophobicContact CB-CB 3.66Å; G99-A101 PolarHBondContact O-N 3.29Å
102	R	81.9	Confident	90.9	Very high	194 Å²	194	58.3 Å²	58.3	73%	0.732	30%	0.298	S	S	*	.	P	Polyproline II helix	trans	-66.1	140.6	168.3	-65.4	-173.6	-179.2	-175.9	2.3	109.3	K46	K46-R102 PolarHBondContact NZ-O 2.91Å
103	L	85.3	Confident	90.8	Very high	77 Å²	77	59.3 Å²	59.3	40%	0.403	31%	0.309	S	S	.	.	P	Polyproline II helix	trans	-73.5	127.2	172.6	-62.4	173.2	0	0	0	109.1	E107 K108 L111	L103-E107 HydrophobicContact CB-CB 4.38Å; L103-E107 HydrophobicContact CD2-CB 4.18Å; L103-K108 HydrophobicContact CB-CG 3.89Å; L103-K108 HydrophobicContact CD1-CG 4.44Å; L103-L111 HydrophobicContact CD1-CD1 3.76Å; L103-L111 HydrophobicContact CD2-CD1 4.15Å
104	S	87.8	Confident	90.8	Very high	53 Å²	53	59.5 Å²	59.5	37%	0.371	30%	0.303	S	S	.	.	P	Polyproline II helix	trans	-67.4	163.2	168.5	66.8	0	0	0	0	111	N106 E107 K108	S104-N106 PolarHBondContact O-N 3.3Å; S104-E107 VanDerWaalsContact CB-OE2 3.22Å; S104-E107 WeakPolarHBondContact CB-OE2 3.43Å; S104-E107 PolarHBondContact N-OE2 3Å; S104-E107 PolarHBondContact O-N 2.88Å; S104-E107 VanDerWaalsContact OG-CG 3.32Å; S104-E107 WeakPolarHBondContact OG-CG 3.49Å; S104-E107 PolarHBondContact OG-N 3.02Å; S104-E107 PolarHBondContact OG-OE2 3.41Å; S104-K108 WeakPolarHBondContact O-CG 3.48Å; S104-K108 PolarHBondContact O-N 3.28Å
105	S	88.3	Confident	90.8	Very high	86 Å²	86	60.3 Å²	60.3	60%	0.601	31%	0.307	S	S	*	.	H	α-helix	trans	-57.3	-37.7	176.1	-53.8	0	0	0	0	112.3	K108 L109	S105-K108 PolarHBondContact O-N 3.42Å; S105-L109 WeakPolarHBondContact O-CG 3.27Å; S105-L109 PolarHBondContact O-N 2.9Å
106	N	89.8	Confident	90.8	Very high	125 Å²	125	61.4 Å²	61.4	67%	0.668	31%	0.309	S	S	*	.	H	α-helix	trans	-70.3	-42.3	178.9	-68.2	-15.3	0	0	0	111.9	S104 K108 L109 M110	S104-N106 PolarHBondContact O-N 3.3Å; N106-K108 VanDerWaalsContact C-N 3.29Å; N106-K108 PolarHBondContact O-N 3.43Å; N106-L109 PolarHBondContact O-N 3.02Å; N106-M110 WeakPolarHBondContact O-CB 3.49Å; N106-M110 PolarHBondContact O-N 2.76Å
107	E	89.8	Confident	90.8	Very high	29 Å²	29	64.6 Å²	64.6	14%	0.136	33%	0.332	C	S	.	.	H	α-helix	trans	-60.2	-41	174	-73.8	161.6	129	0	0	110.6	K46 L103 S104 M110 L111	K46-E107 VanDerWaalsContact NZ-CD 3.31Å; K46-E107 IonicContact NZ-OE1 3.38Å; K46-E107 PolarHBondContact NZ-OE1 2.89Å; K46-E107 IonicContact NZ-OE2 3.15Å; K46-E107 PolarHBondContact NZ-OE2 2.8Å; L103-E107 HydrophobicContact CB-CB 4.38Å; L103-E107 HydrophobicContact CD2-CB 4.18Å; S104-E107 VanDerWaalsContact CB-OE2 3.22Å; S104-E107 WeakPolarHBondContact CB-OE2 3.43Å; S104-E107 PolarHBondContact N-OE2 3Å; S104-E107 PolarHBondContact O-N 2.88Å; S104-E107 VanDerWaalsContact OG-CG 3.32Å; S104-E107 WeakPolarHBondContact OG-CG 3.49Å; S104-E107 PolarHBondContact OG-N 3.02Å; S104-E107 PolarHBondContact OG-OE2 3.41Å; E107-M110 PolarHBondContact O-N 2.84Å; E107-L111 WeakPolarHBondContact O-CB 3.32Å; E107-L111 VanDerWaalsContact O-CG 3.24Å; E107-L111 WeakPolarHBondContact O-CG 3.48Å; E107-L111 PolarHBondContact O-N 2.94Å
108	K	92.4	Very high	90.9	Very high	13 Å²	13	66 Å²	66	6%	0.057	34%	0.343	C	S	.	.	H	α-helix	trans	-64.3	-42.5	176.2	-69	178.5	-180	-173.3	0	112.7	Y7 L15 Q18 D20 L103 S104 S105 N106 L111 A112	Y7-K108 HydrophobicContact CE1-CB 4.37Å; Y7-K108 HydrophobicContact CE1-CD 4.47Å; Y7-K108 HydrophobicContact CE1-CG 4.3Å; L15-K108 HydrophobicContact CD2-CB 3.92Å; Q18-K108 HydrophobicContact CG-CD 4.33Å; D20-K108 VanDerWaalsContact CG-NZ 3.34Å; D20-K108 IonicContact OD1-NZ 2.77Å; D20-K108 PolarHBondContact OD1-NZ 2.97Å; D20-K108 IonicContact OD2-NZ 3.06Å; D20-K108 PolarHBondContact OD2-NZ 3.5Å; L103-K108 HydrophobicContact CB-CG 3.89Å; L103-K108 HydrophobicContact CD1-CG 4.44Å; S104-K108 WeakPolarHBondContact O-CG 3.48Å; S104-K108 PolarHBondContact O-N 3.28Å; S105-K108 PolarHBondContact O-N 3.42Å; N106-K108 VanDerWaalsContact C-N 3.29Å; N106-K108 PolarHBondContact O-N 3.43Å; K108-L111 PolarHBondContact O-N 3.14Å; K108-A112 WeakPolarHBondContact O-CB 3.3Å; K108-A112 PolarHBondContact O-N 3Å
109	L	91.9	Very high	91	Very high	74 Å²	74	66.7 Å²	66.7	39%	0.387	35%	0.346	S	S	.	.	H	α-helix	trans	-60.1	-47	174.8	-78.6	162.3	0	0	0	111.5	L15 S105 N106 A112 S113	L15-L109 HydrophobicContact CB-CD2 3.67Å; L15-L109 HydrophobicContact CB-CG 4.5Å; S105-L109 WeakPolarHBondContact O-CG 3.27Å; S105-L109 PolarHBondContact O-N 2.9Å; N106-L109 PolarHBondContact O-N 3.02Å; L109-A112 PolarHBondContact O-N 3.47Å; L109-S113 PolarHBondContact O-N 2.85Å; L109-S113 PolarHBondContact O-OG 3.32Å
110	M	92.8	Very high	91.2	Very high	97 Å²	97	68.5 Å²	68.5	48%	0.478	36%	0.361	S	S	.	.	H	α-helix	trans	-59.6	-50.2	176.9	-178.9	-175.4	69.2	0	0	111.3	N106 E107 A112 S113 M114	N106-M110 WeakPolarHBondContact O-CB 3.49Å; N106-M110 PolarHBondContact O-N 2.76Å; E107-M110 PolarHBondContact O-N 2.84Å; M110-A112 VanDerWaalsContact C-N 3.35Å; M110-A112 PolarHBondContact O-N 2.79Å; M110-S113 WeakPolarHBondContact O-CB 3.45Å; M110-S113 PolarHBondContact O-N 3.14Å; M110-S113 VanDerWaalsContact O-N 3.12Å; M110-M114 HydrophobicContact CE-SD 4.49Å; M110-M114 HydrophobicContact CG-CG 4.42Å; M110-M114 HydrophobicContact CG-SD 4.01Å; M110-M114 VanDerWaalsContact O-CG 3.32Å; M110-M114 WeakPolarHBondContact O-CG 3.46Å; M110-M114 PolarHBondContact O-N 3.33Å
111	L	93.4	Very high	91.7	Very high	74 Å²	74	64.8 Å²	64.8	39%	0.387	35%	0.352	S	S	.	.	H	α-helix	trans	-61.9	-39.9	-179.9	-72	170.2	0	0	0	112.6	L103 E107 K108 S113 M114 F115	L103-L111 HydrophobicContact CD1-CD1 3.76Å; L103-L111 HydrophobicContact CD2-CD1 4.15Å; E107-L111 WeakPolarHBondContact O-CB 3.32Å; E107-L111 VanDerWaalsContact O-CG 3.24Å; E107-L111 WeakPolarHBondContact O-CG 3.48Å; E107-L111 PolarHBondContact O-N 2.94Å; K108-L111 PolarHBondContact O-N 3.14Å; L111-S113 VanDerWaalsContact C-N 3.31Å; L111-S113 PolarHBondContact O-N 3.45Å; L111-M114 HydrophobicContact CD2-SD 4.39Å; L111-M114 PolarHBondContact O-N 3.18Å; L111-F115 WeakPolarHBondContact O-CB 3.24Å; L111-F115 PolarHBondContact O-N 2.88Å
112	A	94.1	Very high	92.4	Very high	6 Å²	6	64.6 Å²	64.6	5%	0.05	35%	0.353	C	S	.	.	H	α-helix	trans	-61	-41.3	174	0	0	0	0	0	112	V9 L15 K108 L109 M110 F115 H116	V9-A112 HydrophobicContact CG2-CB 3.88Å; L15-A112 HydrophobicContact CB-CB 3.91Å; L15-A112 HydrophobicContact CD1-CB 4.03Å; L15-A112 HydrophobicContact CG-CB 4.4Å; K108-A112 WeakPolarHBondContact O-CB 3.3Å; K108-A112 PolarHBondContact O-N 3Å; L109-A112 PolarHBondContact O-N 3.47Å; M110-A112 VanDerWaalsContact C-N 3.35Å; M110-A112 PolarHBondContact O-N 2.79Å; A112-F115 PolarHBondContact O-N 2.9Å; A112-H116 PolarHBondContact O-N 2.7Å
113	S	93.8	Very high	92.9	Very high	53 Å²	53	57.6 Å²	57.6	37%	0.371	33%	0.334	S	S	.	.	H	α-helix	trans	-69.7	-39.7	178.7	-54.8	0	0	0	0	111.4	G13 L109 M110 L111 H116 S117	G13-S113 PolarHBondContact O-OG 2.98Å; L109-S113 PolarHBondContact O-N 2.85Å; L109-S113 PolarHBondContact O-OG 3.32Å; M110-S113 WeakPolarHBondContact O-CB 3.45Å; M110-S113 PolarHBondContact O-N 3.14Å; M110-S113 VanDerWaalsContact O-N 3.12Å; L111-S113 VanDerWaalsContact C-N 3.31Å; L111-S113 PolarHBondContact O-N 3.45Å; S113-H116 WeakPolarHBondContact O-CB 3.45Å; S113-H116 PolarHBondContact O-N 2.94Å; S113-S117 PolarHBondContact O-N 3.05Å; S113-S117 PolarHBondContact O-OG 2.74Å
114	M	95.5	Very high	93.3	Very high	99 Å²	99	61.5 Å²	61.5	49%	0.488	35%	0.351	S	S	.	.	H	α-helix	trans	-62.5	-45.5	173.8	-70.8	175.4	70.5	0	0	111.4	M110 L111 H116 S117 L118	M110-M114 HydrophobicContact CE-SD 4.49Å; M110-M114 HydrophobicContact CG-CG 4.42Å; M110-M114 HydrophobicContact CG-SD 4.01Å; M110-M114 VanDerWaalsContact O-CG 3.32Å; M110-M114 WeakPolarHBondContact O-CG 3.46Å; M110-M114 PolarHBondContact O-N 3.33Å; L111-M114 HydrophobicContact CD2-SD 4.39Å; L111-M114 PolarHBondContact O-N 3.18Å; M114-H116 VanDerWaalsContact C-N 3.28Å; M114-H116 PolarHBondContact O-N 3.4Å; M114-S117 PolarHBondContact O-N 2.85Å; M114-L118 WeakPolarHBondContact O-CG 3.31Å; M114-L118 PolarHBondContact O-N 3.15Å
115	F	96.3	Very high	93.6	Very high	17 Å²	17	65.5 Å²	65.5	8%	0.075	37%	0.367	C	S	.	.	H	α-helix	trans	-61.3	-38.1	176.6	-178.1	-94.3	0	0	0	111.7	L111 A112 S117 L118 F119 I134 L144 C146 I156	L111-F115 WeakPolarHBondContact O-CB 3.24Å; L111-F115 PolarHBondContact O-N 2.88Å; A112-F115 PolarHBondContact O-N 2.9Å; F115-S117 VanDerWaalsContact C-N 3.32Å; F115-S117 PolarHBondContact O-N 2.72Å; F115-L118 PolarHBondContact O-N 2.94Å; F115-F119 HydrophobicContact CE1-CB 4.35Å; F115-F119 HydrophobicContact CE1-CD2 4.37Å; F115-F119 VanDerWaalsContact O-CB 3.31Å; F115-F119 WeakPolarHBondContact O-CB 3.36Å; F115-F119 PolarHBondContact O-N 3.38Å; F115-I134 HydrophobicContact CE2-CG2 4.3Å; F115-I134 HydrophobicContact CZ-CB 4.42Å; F115-I134 HydrophobicContact CZ-CG2 4.43Å; F115-L144 HydrophobicContact CD2-CD1 4.18Å; F115-L144 HydrophobicContact CD2-CD2 4.47Å; F115-L144 HydrophobicContact CE2-CD1 4.04Å; F115-L144 HydrophobicContact CE2-CD2 3.57Å; F115-L144 HydrophobicContact CZ-CD2 3.73Å; F115-C146 HydrophobicContact CE1-CB 4.05Å; F115-C146 HydrophobicContact CZ-CB 3.74Å; F115-I156 HydrophobicContact CD1-CD1 3.35Å; F115-I156 HydrophobicContact CD1-CG1 4.31Å; F115-I156 HydrophobicContact CE1-CD1 3.55Å; F115-I156 HydrophobicContact CE1-CG1 4Å; F115-I156 HydrophobicContact CG-CD1 4.11Å; F115-I156 HydrophobicContact CZ-CD1 4.43Å
116	H	94.1	Very high	93.9	Very high	44 Å²	44	63.1 Å²	63.1	20%	0.204	35%	0.35	C	S	.	.	H	α-helix	trans	-56.8	-45.5	174.8	-179.3	93.5	0	0	0	112.1	K11 G13 A112 S113 M114 F119 A120 K154	K11-H116 PolarHBondContact O-CE1 3.22Å; G13-H116 VanDerWaalsContact CA-CG 3.5Å; G13-H116 WeakPolarHBondContact CA-ND1 3.25Å; G13-H116 PolarHBondContact N-ND1 2.83Å; A112-H116 PolarHBondContact O-N 2.7Å; S113-H116 WeakPolarHBondContact O-CB 3.45Å; S113-H116 PolarHBondContact O-N 2.94Å; M114-H116 VanDerWaalsContact C-N 3.28Å; M114-H116 PolarHBondContact O-N 3.4Å; H116-F119 PolarHBondContact O-N 3.12Å; H116-A120 PolarHBondContact O-N 2.83Å; H116-K154 PolarHBondContact CE1-NZ 2.91Å; H116-K154 PolarHBondContact ND1-NZ 3.39Å
117	S	95.8	Very high	94.2	Very high	67 Å²	67	62.9 Å²	62.9	47%	0.469	36%	0.355	S	S	.	.	H	α-helix	trans	-65.8	-44.9	175.9	-59.9	0	0	0	0	112	S113 M114 F115 F119 A120 I121	S113-S117 PolarHBondContact O-N 3.05Å; S113-S117 PolarHBondContact O-OG 2.74Å; M114-S117 PolarHBondContact O-N 2.85Å; F115-S117 VanDerWaalsContact C-N 3.32Å; F115-S117 PolarHBondContact O-N 2.72Å; S117-F119 VanDerWaalsContact C-N 3.3Å; S117-F119 PolarHBondContact O-N 3.48Å; S117-A120 PolarHBondContact O-N 3.03Å; S117-I121 VanDerWaalsContact O-CG1 3.28Å; S117-I121 WeakPolarHBondContact O-CG1 3.32Å; S117-I121 PolarHBondContact O-N 3.39Å
118	L	96.1	Very high	94.4	Very high	87 Å²	87	68.3 Å²	68.3	46%	0.455	38%	0.381	S	S	.	.	H	α-helix	trans	-60.1	-40.9	177.3	-71	174.3	0	0	0	112	M114 F115 A120 I121 G122 I134	M114-L118 WeakPolarHBondContact O-CG 3.31Å; M114-L118 PolarHBondContact O-N 3.15Å; F115-L118 PolarHBondContact O-N 2.94Å; L118-A120 VanDerWaalsContact C-N 3.34Å; L118-A120 PolarHBondContact O-N 3.45Å; L118-I121 PolarHBondContact O-N 2.83Å; L118-G122 PolarHBondContact O-N 2.84Å; L118-I134 HydrophobicContact CB-CD1 3.97Å; L118-I134 WeakPolarHBondContact O-CD1 3.41Å
119	F	95.9	Very high	94.2	Very high	15 Å²	15	74.9 Å²	74.9	7%	0.066	42%	0.422	C	S	.	.	H	α-helix	trans	-57.4	-46.6	175.7	178.8	-84.2	0	0	0	111.5	F115 H116 S117 G122 S123 G133 I134 Q148 K154	F115-F119 HydrophobicContact CE1-CB 4.35Å; F115-F119 HydrophobicContact CE1-CD2 4.37Å; F115-F119 VanDerWaalsContact O-CB 3.31Å; F115-F119 WeakPolarHBondContact O-CB 3.36Å; F115-F119 PolarHBondContact O-N 3.38Å; H116-F119 PolarHBondContact O-N 3.12Å; S117-F119 VanDerWaalsContact C-N 3.3Å; S117-F119 PolarHBondContact O-N 3.48Å; F119-G122 PolarHBondContact O-N 2.84Å; F119-S123 PolarHBondContact O-N 2.64Å; F119-G133 VanDerWaalsContact CZ-CA 3.45Å; F119-G133 VanDerWaalsContact O-CA 3.25Å; F119-G133 WeakPolarHBondContact O-CA 3.46Å; F119-I134 HydrophobicContact CD2-CB 4.32Å; F119-I134 VanDerWaalsContact CD2-N 3.28Å; F119-I134 VanDerWaalsContact CD2-O 3.29Å; F119-I134 WeakPolarHBondContact CD2-O 3.22Å; F119-I134 WeakPolarHBondContact CE2-O 3.27Å; F119-Q148 HydrophobicContact CZ-CB 4.1Å; F119-Q148 HydrophobicContact CZ-CG 4.48Å; F119-K154 HydrophobicContact CD1-CD 4.48Å; F119-K154 HydrophobicContact CD2-CD 4.36Å; F119-K154 HydrophobicContact CG-CD 4.27Å
120	A	94.4	Very high	94	Very high	38 Å²	38	75.2 Å²	75.2	31%	0.314	44%	0.443	S	S	.	.	H	α-helix	trans	-68.6	-42.3	179.2	0	0	0	0	0	112.2	H116 S117 L118 G122 S123 Q124	H116-A120 PolarHBondContact O-N 2.83Å; S117-A120 PolarHBondContact O-N 3.03Å; L118-A120 VanDerWaalsContact C-N 3.34Å; L118-A120 PolarHBondContact O-N 3.45Å; A120-G122 VanDerWaalsContact C-N 3.3Å; A120-G122 PolarHBondContact O-N 3.38Å; A120-S123 PolarHBondContact O-N 3.42Å; A120-Q124 WeakPolarHBondContact O-CG 3.19Å; A120-Q124 PolarHBondContact O-N 2.93Å
121	I	95.8	Very high	93.9	Very high	78 Å²	78	72.7 Å²	72.7	40%	0.4	44%	0.435	S	S	.	.	H	α-helix	trans	-59.5	-43.4	175.7	-68.8	165	0	0	0	110.4	S117 L118 S123 Q124 L125	S117-I121 VanDerWaalsContact O-CG1 3.28Å; S117-I121 WeakPolarHBondContact O-CG1 3.32Å; S117-I121 PolarHBondContact O-N 3.39Å; L118-I121 PolarHBondContact O-N 2.83Å; I121-S123 VanDerWaalsContact C-N 3.29Å; I121-S123 PolarHBondContact O-N 3.2Å; I121-Q124 PolarHBondContact O-N 3.16Å; I121-L125 HydrophobicContact CG2-CD1 3.53Å; I121-L125 HydrophobicContact CG2-CG 4.06Å; I121-L125 WeakPolarHBondContact O-CB 3.47Å; I121-L125 WeakPolarHBondContact O-CG 3.1Å; I121-L125 PolarHBondContact O-N 2.96Å
122	G	94.5	Very high	93.7	Very high	30 Å²	30	71.6 Å²	71.6	31%	0.309	43%	0.433	S	S	.	.	H	α-helix	trans	-58.7	-39.2	177.3	0	0	0	0	0	113.1	L118 F119 A120 S126	L118-G122 PolarHBondContact O-N 2.84Å; F119-G122 PolarHBondContact O-N 2.84Å; A120-G122 VanDerWaalsContact C-N 3.3Å; A120-G122 PolarHBondContact O-N 3.38Å; G122-S126 PolarHBondContact O-N 3.39Å
123	S	93.4	Very high	93.6	Very high	48 Å²	48	71.8 Å²	71.8	34%	0.336	44%	0.436	S	S	.	.	H	α-helix	trans	-70.6	-42	174.7	-177.8	0	0	0	0	112.1	F119 A120 I121 S126 S131	F119-S123 PolarHBondContact O-N 2.64Å; A120-S123 PolarHBondContact O-N 3.42Å; I121-S123 VanDerWaalsContact C-N 3.29Å; I121-S123 PolarHBondContact O-N 3.2Å; S123-S126 WeakPolarHBondContact O-CB 3.47Å; S123-S126 PolarHBondContact O-N 3.14Å; S123-S131 PolarHBondContact OG-O 3.39Å; S123-S131 VanDerWaalsContact OG-O 3.08Å
124	Q	92.8	Very high	93.7	Very high	159 Å²	159	71.1 Å²	71.1	74%	0.743	43%	0.428	S	S	*	.	H	α-helix	trans	-69.8	-34.9	-178.1	-73.2	179.5	2	0	0	113.9	A120 I121 S126	A120-Q124 WeakPolarHBondContact O-CG 3.19Å; A120-Q124 PolarHBondContact O-N 2.93Å; I121-Q124 PolarHBondContact O-N 3.16Å; Q124-S126 VanDerWaalsContact C-N 3.28Å
125	L	95.3	Very high	93.7	Very high	137 Å²	137	72.1 Å²	72.1	72%	0.717	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87	1.1	178.5	-65.7	-179.1	0	0	0	112.9	I121	I121-L125 HydrophobicContact CG2-CD1 3.53Å; I121-L125 HydrophobicContact CG2-CG 4.06Å; I121-L125 WeakPolarHBondContact O-CB 3.47Å; I121-L125 WeakPolarHBondContact O-CG 3.1Å; I121-L125 PolarHBondContact O-N 2.96Å
126	S	94.5	Very high	93.7	Very high	35 Å²	35	76 Å²	76	25%	0.245	45%	0.451	C	S	.	.			trans	-66.8	133	-178.1	-169	0	0	0	0	111	G122 S123 Q124 E128 S131	G122-S126 PolarHBondContact O-N 3.39Å; S123-S126 WeakPolarHBondContact O-CB 3.47Å; S123-S126 PolarHBondContact O-N 3.14Å; Q124-S126 VanDerWaalsContact C-N 3.28Å; S126-E128 PolarHBondContact O-N 3.06Å; S126-S131 VanDerWaalsContact CB-OG 3.26Å; S126-S131 WeakPolarHBondContact CB-OG 3.41Å; S126-S131 WeakPolarHBondContact OG-CB 3.44Å; S126-S131 PolarHBondContact OG-OG 3.43Å
127	P	94.9	Very high	93.8	Very high	120 Å²	120	77 Å²	77	78%	0.779	46%	0.457	S	S	*	.	S	Bend	trans	-74.7	-15.3	176.2	30.7	-34.4	0	0	0	112.9
128	E	94	Very high	93.7	Very high	144 Å²	144	79 Å²	79	67%	0.673	46%	0.459	S	S	*	.	S	Bend	trans	-103.3	141.4	-174.7	-66.6	-61	146.7	0	0	112.3	S126	S126-E128 PolarHBondContact O-N 3.06Å
129	V	89.6	Confident	93.5	Very high	151 Å²	151	76.9 Å²	76.9	92%	0.915	45%	0.45	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.9	137	178.9	-173.2	0	0	0	0	110.1	S131	V129-S131 VanDerWaalsContact C-N 3.31Å
130	G	86.9	Confident	93.1	Very high	80 Å²	80	82.8 Å²	82.8	83%	0.825	48%	0.482	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.8	14.5	179.6	0	0	0	0	0	114	S132	G130-S132 PolarHBondContact O-N 3.42Å
131	S	89.9	Confident	92.7	Very high	44 Å²	44	85.5 Å²	85.5	31%	0.308	49%	0.489	S	S	.	.			trans	-62.5	129.8	173.4	-171.9	0	0	0	0	111.9	S123 S126 V129	S123-S131 PolarHBondContact OG-O 3.39Å; S123-S131 VanDerWaalsContact OG-O 3.08Å; S126-S131 VanDerWaalsContact CB-OG 3.26Å; S126-S131 WeakPolarHBondContact CB-OG 3.41Å; S126-S131 WeakPolarHBondContact OG-CB 3.44Å; S126-S131 PolarHBondContact OG-OG 3.43Å; V129-S131 VanDerWaalsContact C-N 3.31Å
132	S	90	Very high	92.5	Very high	51 Å²	51	84.6 Å²	84.6	36%	0.357	48%	0.483	S	S	.	.			trans	-70.4	179.1	164.3	57.1	0	0	0	0	110.6	G130 E135	G130-S132 PolarHBondContact O-N 3.42Å; S132-E135 WeakPolarHBondContact CB-OE1 3.18Å; S132-E135 PolarHBondContact OG-OE1 3.5Å
133	G	92.7	Very high	92.5	Very high	10 Å²	10	84.7 Å²	84.7	10%	0.103	48%	0.475	C	S	.	.	S	Bend	trans	-76.9	-163.4	168.3	0	0	0	0	0	112.1	F119 E135	F119-G133 VanDerWaalsContact CZ-CA 3.45Å; F119-G133 VanDerWaalsContact O-CA 3.25Å; F119-G133 WeakPolarHBondContact O-CA 3.46Å; G133-E135 PolarHBondContact O-N 3Å; G133-E135 VanDerWaalsContact O-N 3.07Å
134	I	95.9	Very high	92.7	Very high	40 Å²	40	83.3 Å²	83.3	21%	0.205	46%	0.463	C	S	.	.			trans	-65.8	110.3	-179.6	-58.7	171.8	0	0	0	110.3	F115 L118 F119 L137 C146	F115-I134 HydrophobicContact CE2-CG2 4.3Å; F115-I134 HydrophobicContact CZ-CB 4.42Å; F115-I134 HydrophobicContact CZ-CG2 4.43Å; L118-I134 HydrophobicContact CB-CD1 3.97Å; L118-I134 WeakPolarHBondContact O-CD1 3.41Å; F119-I134 HydrophobicContact CD2-CB 4.32Å; F119-I134 VanDerWaalsContact CD2-N 3.28Å; F119-I134 VanDerWaalsContact CD2-O 3.29Å; F119-I134 WeakPolarHBondContact CD2-O 3.22Å; F119-I134 WeakPolarHBondContact CE2-O 3.27Å; I134-L137 HydrophobicContact CG2-CB 4.3Å; I134-C146 WeakPolarHBondContact O-CB 3.4Å
135	E	95.5	Very high	92.9	Very high	119 Å²	119	76.9 Å²	76.9	56%	0.556	43%	0.433	S	S	*	.			trans	-91	-29.1	173.8	-67.8	-177.3	-178.4	0	0	112.6	S132 G133 H145 C146	S132-E135 WeakPolarHBondContact CB-OE1 3.18Å; S132-E135 PolarHBondContact OG-OE1 3.5Å; G133-E135 PolarHBondContact O-N 3Å; G133-E135 VanDerWaalsContact O-N 3.07Å; E135-H145 CarbonylContact O-C 3.52Å; E135-H145 WeakPolarHBondContact O-CA 3.36Å; E135-C146 PolarHBondContact O-N 3.19Å
136	M	95.7	Very high	93	Very high	100 Å²	100	70.7 Å²	70.7	49%	0.493	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.2	136	-179.9	-171.4	-103.9	-71	0	0	111.1	E138 K143 L144	M136-E138 HydrophobicContact SD-CB 3.93Å; M136-K143 HydrophobicContact CG-CD 3.99Å; M136-K143 HydrophobicContact CG-CG 3.86Å; M136-K143 HydrophobicContact SD-CD 3.97Å; M136-K143 HydrophobicContact SD-CG 4.03Å; M136-L144 CarbonylContact C-O 3.58Å; M136-L144 VanDerWaalsContact CA-O 3.3Å; M136-L144 WeakPolarHBondContact CA-O 3.37Å
137	L	96.4	Very high	93.1	Very high	63 Å²	63	72.1 Å²	72.1	33%	0.33	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	116.4	173.4	-174.5	166.6	0	0	0	108.3	I134 T139 F142 L144	I134-L137 HydrophobicContact CG2-CB 4.3Å; L137-T139 HydrophobicContact CD2-CG2 3.8Å; L137-F142 HydrophobicContact CD2-CE2 4.5Å; L137-L144 HydrophobicContact CB-CB 4.27Å; L137-L144 PolarHBondContact N-O 3.48Å; L137-L144 PolarHBondContact O-N 3.43Å
138	E	94	Very high	93.2	Very high	110 Å²	110	70.1 Å²	70.1	51%	0.514	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	139.1	-178.1	-175.8	160.8	-146.5	0	0	111.5	M136 K143	M136-E138 HydrophobicContact SD-CB 3.93Å; E138-K143 HydrophobicContact CB-CG 4.45Å; E138-K143 WeakPolarHBondContact OE1-CE 3Å; E138-K143 IonicContact OE1-NZ 3.88Å; E138-K143 PolarHBondContact OE1-NZ 3.36Å; E138-K143 WeakPolarHBondContact OE2-CE 3.31Å; E138-K143 IonicContact OE2-NZ 2.74Å
139	T	91.3	Very high	93.2	Very high	42 Å²	42	63.7 Å²	63.7	26%	0.258	35%	0.354	S	S	.	.			trans	-127.9	175	170.6	69.9	0	0	0	0	109.1	L137 M141 F142	L137-T139 HydrophobicContact CD2-CG2 3.8Å; T139-M141 PolarHBondContact O-N 3.45Å; T139-M141 PolarHBondContact OG1-N 2.86Å; T139-F142 WeakPolarHBondContact CA-O 3.34Å; T139-F142 HydrophobicContact CG2-CD1 4.33Å; T139-F142 HydrophobicContact CG2-CE1 3.83Å; T139-F142 HydrophobicContact CG2-CE2 4.04Å; T139-F142 HydrophobicContact CG2-CZ 3.67Å; T139-F142 PolarHBondContact N-O 3.41Å; T139-F142 WeakPolarHBondContact OG1-CD1 3.49Å; T139-F142 WeakPolarHBondContact OG1-CG 3.49Å; T139-F142 PolarHBondContact OG1-N 3.35Å; T139-F142 PolarHBondContact OG1-O 3.21Å
140	D	87.1	Confident	93.2	Very high	139 Å²	139	65.5 Å²	65.5	74%	0.743	36%	0.358	S	S	*	.	S	Bend	trans	-62.1	-30.3	174	61.4	-34.3	0	0	0	113.4
141	M	85.8	Confident	93.4	Very high	95 Å²	95	66.2 Å²	66.2	47%	0.468	35%	0.346	S	S	.	.	S	Bend	trans	-108.6	-24.1	-172.9	-61.8	-61.7	-68.9	0	0	114.4	T139	T139-M141 PolarHBondContact O-N 3.45Å; T139-M141 PolarHBondContact OG1-N 2.86Å
142	F	92.1	Very high	93.4	Very high	59 Å²	59	64.3 Å²	64.3	26%	0.259	33%	0.334	S	S	.	.			trans	-150.9	158	-178.2	74.5	-96.9	0	0	0	112.2	F4 L137 T139 L144 L158 A159	F4-F142 HydrophobicContact CD2-CB 3.86Å; F4-F142 HydrophobicContact CE2-CB 3.6Å; L137-F142 HydrophobicContact CD2-CE2 4.5Å; T139-F142 WeakPolarHBondContact CA-O 3.34Å; T139-F142 HydrophobicContact CG2-CD1 4.33Å; T139-F142 HydrophobicContact CG2-CE1 3.83Å; T139-F142 HydrophobicContact CG2-CE2 4.04Å; T139-F142 HydrophobicContact CG2-CZ 3.67Å; T139-F142 PolarHBondContact N-O 3.41Å; T139-F142 WeakPolarHBondContact OG1-CD1 3.49Å; T139-F142 WeakPolarHBondContact OG1-CG 3.49Å; T139-F142 PolarHBondContact OG1-N 3.35Å; T139-F142 PolarHBondContact OG1-O 3.21Å; F142-L144 HydrophobicContact CD2-CB 4.41Å; F142-L144 HydrophobicContact CE2-CB 4.1Å; F142-L158 HydrophobicContact CD2-CD2 3.31Å; F142-L158 HydrophobicContact CE2-CD2 3.33Å; F142-L158 HydrophobicContact CG-CD2 4.08Å; F142-L158 HydrophobicContact CZ-CD2 4.11Å; F142-A159 CarbonylContact C-O 3.04Å; F142-A159 VanDerWaalsContact CA-O 3.29Å; F142-A159 WeakPolarHBondContact CA-O 3.43Å
143	K	95.1	Very high	93.6	Very high	32 Å²	32	62.1 Å²	62.1	14%	0.139	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	129.8	167.8	-171.3	173.1	-77.4	157.8	0	109.2	M136 E138 H145 L158 A159 P161	M136-K143 HydrophobicContact CG-CD 3.99Å; M136-K143 HydrophobicContact CG-CG 3.86Å; M136-K143 HydrophobicContact SD-CD 3.97Å; M136-K143 HydrophobicContact SD-CG 4.03Å; E138-K143 HydrophobicContact CB-CG 4.45Å; E138-K143 WeakPolarHBondContact OE1-CE 3Å; E138-K143 IonicContact OE1-NZ 3.88Å; E138-K143 PolarHBondContact OE1-NZ 3.36Å; E138-K143 WeakPolarHBondContact OE2-CE 3.31Å; E138-K143 IonicContact OE2-NZ 2.74Å; K143-H145 WeakPolarHBondContact CD-NE2 3.29Å; K143-H145 VanDerWaalsContact CG-NE2 3.34Å; K143-H145 WeakPolarHBondContact CG-NE2 3.5Å; K143-L158 WeakPolarHBondContact O-CA 3.32Å; K143-A159 PolarHBondContact N-O 3.29Å; K143-A159 PolarHBondContact O-N 3.12Å; K143-P161 PolarHBondContact NZ-O 2.89Å
144	L	97.1	Very high	93.8	Very high	19 Å²	19	61.8 Å²	61.8	10%	0.099	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	125.3	173.9	179.3	161.7	0	0	0	107.7	F115 M136 L137 F142 C146 I156 V157 L158	F115-L144 HydrophobicContact CD2-CD1 4.18Å; F115-L144 HydrophobicContact CD2-CD2 4.47Å; F115-L144 HydrophobicContact CE2-CD1 4.04Å; F115-L144 HydrophobicContact CE2-CD2 3.57Å; F115-L144 HydrophobicContact CZ-CD2 3.73Å; M136-L144 CarbonylContact C-O 3.58Å; M136-L144 VanDerWaalsContact CA-O 3.3Å; M136-L144 WeakPolarHBondContact CA-O 3.37Å; L137-L144 HydrophobicContact CB-CB 4.27Å; L137-L144 PolarHBondContact N-O 3.48Å; L137-L144 PolarHBondContact O-N 3.43Å; F142-L144 HydrophobicContact CD2-CB 4.41Å; F142-L144 HydrophobicContact CE2-CB 4.1Å; L144-C146 HydrophobicContact CD2-CB 4.25Å; L144-I156 HydrophobicContact CD1-CG2 3.85Å; L144-I156 HydrophobicContact CD2-CG2 3.73Å; L144-I156 HydrophobicContact CG-CG2 3.56Å; L144-V157 WeakPolarHBondContact CA-O 3.26Å; L144-L158 HydrophobicContact CB-CD2 4Å; L144-L158 HydrophobicContact CB-CG 4.37Å; L144-L158 HydrophobicContact CD1-CD2 4.19Å; L144-L158 HydrophobicContact CD1-CG 4.46Å; L144-L158 HydrophobicContact CG-CD2 4.35Å; L144-L158 HydrophobicContact CG-CG 4.39Å
145	H	97.3	Very high	93.9	Very high	25 Å²	25	59.9 Å²	59.9	12%	0.116	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	138	173.4	-62.1	-105.4	0	0	0	109.6	E135 K143 I156 V157 I166 L170	E135-H145 CarbonylContact O-C 3.52Å; E135-H145 WeakPolarHBondContact O-CA 3.36Å; K143-H145 WeakPolarHBondContact CD-NE2 3.29Å; K143-H145 VanDerWaalsContact CG-NE2 3.34Å; K143-H145 WeakPolarHBondContact CG-NE2 3.5Å; H145-I156 CarbonylContact O-C 3.53Å; H145-I156 VanDerWaalsContact O-CA 3.25Å; H145-I156 WeakPolarHBondContact O-CA 3.41Å; H145-V157 PolarHBondContact N-O 3.46Å; H145-V157 PolarHBondContact O-N 3.38Å; H145-I166 HydrophobicContact CB-CG2 3.52Å; H145-I166 VanDerWaalsContact CG-CG2 3.4Å; H145-L170 HydrophobicContact CB-CD1 3.77Å
146	C	97.4	Very high	94	Very high	6 Å²	6	54.5 Å²	54.5	4%	0.041	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	125.2	-178.7	175.1	0	0	0	0	110.9	F115 I134 E135 L144 F155 I156	F115-C146 HydrophobicContact CE1-CB 4.05Å; F115-C146 HydrophobicContact CZ-CB 3.74Å; I134-C146 WeakPolarHBondContact O-CB 3.4Å; E135-C146 PolarHBondContact O-N 3.19Å; L144-C146 HydrophobicContact CD2-CB 4.25Å; C146-F155 CarbonylContact C-O 3.56Å; C146-F155 WeakPolarHBondContact CA-O 3.46Å; C146-I156 HydrophobicContact CB-CG1 4.32Å
147	F	97	Very high	94	Very high	65 Å²	65	49.8 Å²	49.8	29%	0.285	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	121.1	171.4	174.1	-114.8	0	0	0	110	T149 K154 F155 L170 Y174	F147-T149 HydrophobicContact CE1-CG2 4.27Å; F147-K154 WeakPolarHBondContact O-CA 3.25Å; F147-F155 AromaticContact CD1-CD2 3.81Å; F147-F155 HydrophobicContact CD1-CD2 3.81Å; F147-F155 HydrophobicContact CD1-CE2 4.45Å; F147-F155 HydrophobicContact CE1-CD2 4.44Å; F147-F155 PolarHBondContact N-O 3.44Å; F147-F155 PolarHBondContact O-N 3.45Å; F147-L170 HydrophobicContact CB-CB 3.95Å; F147-L170 HydrophobicContact CB-CD1 4Å; F147-L170 HydrophobicContact CB-CD2 4.13Å; F147-L170 HydrophobicContact CB-CG 4.25Å; F147-Y174 HydrophobicContact CE1-CD1 4.04Å; F147-Y174 AromaticContact CE1-CG 3.97Å; F147-Y174 HydrophobicContact CE1-CG 3.97Å
148	Q	95.9	Very high	94	Very high	79 Å²	79	48 Å²	48	37%	0.369	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	130.8	175.6	-171.6	-175.5	18	0	0	110.9	F119 I153 K154	F119-Q148 HydrophobicContact CZ-CB 4.1Å; F119-Q148 HydrophobicContact CZ-CG 4.48Å; Q148-I153 CarbonylContact C-O 3.58Å; Q148-I153 WeakPolarHBondContact CA-O 3.29Å; Q148-K154 HydrophobicContact CB-CG 4.25Å; Q148-K154 HydrophobicContact CG-CG 4.06Å
149	T	93.8	Very high	94	Very high	9 Å²	9	42.7 Å²	42.7	6%	0.055	22%	0.221	C	C	.	.			trans	-78.3	164.3	172.7	67.3	0	0	0	0	112	F147 T151 G152 I153 F155 Y174	F147-T149 HydrophobicContact CE1-CG2 4.27Å; T149-T151 PolarHBondContact O-N 3.07Å; T149-T151 PolarHBondContact OG1-N 3.45Å; T149-T151 PolarHBondContact OG1-OG1 3.26Å; T149-G152 WeakPolarHBondContact O-CA 3.38Å; T149-G152 PolarHBondContact O-N 2.82Å; T149-G152 PolarHBondContact OG1-N 3.4Å; T149-I153 HydrophobicContact CG2-CB 4.31Å; T149-I153 PolarHBondContact N-O 2.64Å; T149-I153 PolarHBondContact OG1-N 3.5Å; T149-I153 PolarHBondContact OG1-O 2.95Å; T149-F155 HydrophobicContact CG2-CD2 4.22Å; T149-F155 HydrophobicContact CG2-CE2 3.5Å; T149-F155 VanDerWaalsContact CG2-CE2 3.5Å; T149-F155 HydrophobicContact CG2-CZ 4.43Å; T149-Y174 HydrophobicContact CG2-CD2 3.63Å; T149-Y174 HydrophobicContact CG2-CE2 3.64Å; T149-Y174 HydrophobicContact CG2-CG 4.33Å
150	L	90.8	Very high	94	Very high	189 Å²	189	42 Å²	42	99%	0.99	22%	0.216	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.3	-28.6	171.5	-60.8	177.7	0	0	0	113.1	G152	L150-G152 VanDerWaalsContact C-N 3.27Å
151	T	90	Very high	94.2	Very high	94 Å²	94	36.7 Å²	36.7	58%	0.577	19%	0.189	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81	-5.9	175.8	55.4	0	0	0	0	113.3	T149	T149-T151 PolarHBondContact O-N 3.07Å; T149-T151 PolarHBondContact OG1-N 3.45Å; T149-T151 PolarHBondContact OG1-OG1 3.26Å
152	G	91.6	Very high	94.4	Very high	5 Å²	5	40.7 Å²	40.7	5%	0.052	20%	0.199	C	C	.	.	S	Bend	trans	91.3	6.1	175.3	0	0	0	0	0	115.6	T149 L150	T149-G152 WeakPolarHBondContact O-CA 3.38Å; T149-G152 PolarHBondContact O-N 2.82Å; T149-G152 PolarHBondContact OG1-N 3.4Å; L150-G152 VanDerWaalsContact C-N 3.27Å
153	I	93.9	Very high	94.2	Very high	4 Å²	4	38.3 Å²	38.3	2%	0.021	19%	0.189	C	C	.	.			trans	-72.7	138.7	172.5	-53.4	-60.2	0	0	0	108.8	V8 N10 Q148 T149 F155 Y177	V8-I153 HydrophobicContact CG1-CG2 3.79Å; N10-I153 HydrophobicContact CB-CD1 4.18Å; Q148-I153 CarbonylContact C-O 3.58Å; Q148-I153 WeakPolarHBondContact CA-O 3.29Å; T149-I153 HydrophobicContact CG2-CB 4.31Å; T149-I153 PolarHBondContact N-O 2.64Å; T149-I153 PolarHBondContact OG1-N 3.5Å; T149-I153 PolarHBondContact OG1-O 2.95Å; I153-F155 HydrophobicContact CG2-CE1 4.41Å; I153-F155 HydrophobicContact CG2-CE2 4.33Å; I153-F155 HydrophobicContact CG2-CZ 4.06Å; I153-Y177 HydrophobicContact CG1-CE1 4.36Å
154	K	96.4	Very high	93.9	Very high	4 Å²	4	39.4 Å²	39.4	2%	0.017	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115	127.5	-179.7	-61	-179.4	-178	69.9	0	110.2	V8 V9 H116 F119 F147 Q148	V8-K154 WeakPolarHBondContact CA-O 3.31Å; V9-K154 HydrophobicContact CB-CB 4.35Å; V9-K154 PolarHBondContact N-O 3.19Å; V9-K154 PolarHBondContact O-N 3.4Å; H116-K154 PolarHBondContact CE1-NZ 2.91Å; H116-K154 PolarHBondContact ND1-NZ 3.39Å; F119-K154 HydrophobicContact CD1-CD 4.48Å; F119-K154 HydrophobicContact CD2-CD 4.36Å; F119-K154 HydrophobicContact CG-CD 4.27Å; F147-K154 WeakPolarHBondContact O-CA 3.25Å; Q148-K154 HydrophobicContact CB-CG 4.25Å; Q148-K154 HydrophobicContact CG-CG 4.06Å
155	F	97.1	Very high	93.6	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	121.8	170.2	-57.9	-78.2	0	0	0	108.3	V8 C146 F147 T149 I153 L170 I173 Y174 Y177	V8-F155 HydrophobicContact CB-CD1 4.45Å; V8-F155 HydrophobicContact CG1-CD1 3.89Å; V8-F155 HydrophobicContact CG1-CE1 3.72Å; V8-F155 HydrophobicContact CG2-CD1 3.88Å; V8-F155 HydrophobicContact CG2-CE1 4.16Å; C146-F155 CarbonylContact C-O 3.56Å; C146-F155 WeakPolarHBondContact CA-O 3.46Å; F147-F155 AromaticContact CD1-CD2 3.81Å; F147-F155 HydrophobicContact CD1-CD2 3.81Å; F147-F155 HydrophobicContact CD1-CE2 4.45Å; F147-F155 HydrophobicContact CE1-CD2 4.44Å; F147-F155 PolarHBondContact N-O 3.44Å; F147-F155 PolarHBondContact O-N 3.45Å; T149-F155 HydrophobicContact CG2-CD2 4.22Å; T149-F155 HydrophobicContact CG2-CE2 3.5Å; T149-F155 VanDerWaalsContact CG2-CE2 3.5Å; T149-F155 HydrophobicContact CG2-CZ 4.43Å; I153-F155 HydrophobicContact CG2-CE1 4.41Å; I153-F155 HydrophobicContact CG2-CE2 4.33Å; I153-F155 HydrophobicContact CG2-CZ 4.06Å; F155-L170 HydrophobicContact CB-CD2 3.81Å; F155-L170 WeakPolarHBondContact O-CD2 3.27Å; F155-I173 HydrophobicContact CD1-CB 4.46Å; F155-I173 HydrophobicContact CD1-CG2 3.46Å; F155-I173 VanDerWaalsContact CD1-CG2 3.46Å; F155-I173 HydrophobicContact CE1-CG2 3.88Å; F155-I173 HydrophobicContact CG-CG2 4.2Å; F155-Y174 AromaticContact CE2-CD2 3.69Å; F155-Y174 HydrophobicContact CE2-CD2 3.69Å; F155-Y174 HydrophobicContact CE2-CG 4.11Å; F155-Y174 HydrophobicContact CZ-CD2 4.01Å; F155-Y177 HydrophobicContact CE1-CD2 4.18Å; F155-Y177 AromaticContact CE1-CG 3.9Å; F155-Y177 HydrophobicContact CE1-CG 3.9Å; F155-Y177 AromaticContact CZ-CD1 3.82Å; F155-Y177 HydrophobicContact CZ-CD1 3.82Å; F155-Y177 HydrophobicContact CZ-CD2 4.26Å; F155-Y177 AromaticContact CZ-CG 3.63Å; F155-Y177 HydrophobicContact CZ-CG 3.63Å
156	I	97.7	Very high	93.4	Very high	6 Å²	6	39.7 Å²	39.7	3%	0.031	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	128.6	-176	-55.7	166.8	0	0	0	108.2	V6 Y7 V9 F115 L144 H145 C146	V6-I156 CarbonylContact C-O 3.51Å; V6-I156 WeakPolarHBondContact CA-O 3.42Å; Y7-I156 PolarHBondContact N-O 3.41Å; Y7-I156 PolarHBondContact O-N 2.99Å; V9-I156 HydrophobicContact CG2-CD1 3.85Å; F115-I156 HydrophobicContact CD1-CD1 3.35Å; F115-I156 HydrophobicContact CD1-CG1 4.31Å; F115-I156 HydrophobicContact CE1-CD1 3.55Å; F115-I156 HydrophobicContact CE1-CG1 4Å; F115-I156 HydrophobicContact CG-CD1 4.11Å; F115-I156 HydrophobicContact CZ-CD1 4.43Å; L144-I156 HydrophobicContact CD1-CG2 3.85Å; L144-I156 HydrophobicContact CD2-CG2 3.73Å; L144-I156 HydrophobicContact CG-CG2 3.56Å; H145-I156 CarbonylContact O-C 3.53Å; H145-I156 VanDerWaalsContact O-CA 3.25Å; H145-I156 WeakPolarHBondContact O-CA 3.41Å; C146-I156 HydrophobicContact CB-CG1 4.32Å
157	V	96.9	Very high	93.2	Very high	0 Å²	0	44 Å²	44	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	127.3	176.3	176.6	0	0	0	0	108.8	I3 V6 L144 H145 I166 L169 L170 I173	I3-V157 HydrophobicContact CG2-CG1 3.79Å; V6-V157 HydrophobicContact CG2-CG2 4.33Å; L144-V157 WeakPolarHBondContact CA-O 3.26Å; H145-V157 PolarHBondContact N-O 3.46Å; H145-V157 PolarHBondContact O-N 3.38Å; V157-I166 HydrophobicContact CB-CG2 4.13Å; V157-I166 HydrophobicContact CG1-CD1 4.21Å; V157-I166 HydrophobicContact CG1-CG2 4.2Å; V157-L169 HydrophobicContact CG1-CD2 4.17Å; V157-L169 HydrophobicContact CG2-CD2 4.34Å; V157-L170 HydrophobicContact CB-CD2 4.35Å; V157-L170 HydrophobicContact CG2-CD2 3.63Å; V157-L170 HydrophobicContact CG2-CG 4.26Å; V157-I173 HydrophobicContact CG2-CD1 3.84Å
158	L	95.3	Very high	93	Very high	25 Å²	25	43.9 Å²	43.9	13%	0.131	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	128.2	170.7	-72.5	131.7	0	0	0	108.9	F4 S5 Y7 F142 K143 L144	F4-L158 WeakPolarHBondContact CA-O 3.36Å; F4-L158 HydrophobicContact CB-CB 4.21Å; F4-L158 WeakPolarHBondContact CB-O 3.33Å; F4-L158 PolarHBondContact N-O 2.9Å; S5-L158 PolarHBondContact N-O 2.85Å; S5-L158 PolarHBondContact O-N 3.45Å; S5-L158 VanDerWaalsContact OG-CD1 3.31Å; S5-L158 WeakPolarHBondContact OG-CD1 3.42Å; Y7-L158 HydrophobicContact CD2-CD1 3.8Å; Y7-L158 HydrophobicContact CE2-CD1 3.33Å; F142-L158 HydrophobicContact CD2-CD2 3.31Å; F142-L158 HydrophobicContact CE2-CD2 3.33Å; F142-L158 HydrophobicContact CG-CD2 4.08Å; F142-L158 HydrophobicContact CZ-CD2 4.11Å; K143-L158 WeakPolarHBondContact O-CA 3.32Å; L144-L158 HydrophobicContact CB-CD2 4Å; L144-L158 HydrophobicContact CB-CG 4.37Å; L144-L158 HydrophobicContact CD1-CD2 4.19Å; L144-L158 HydrophobicContact CD1-CG 4.46Å; L144-L158 HydrophobicContact CG-CD2 4.35Å; L144-L158 HydrophobicContact CG-CG 4.39Å
159	A	93.9	Very high	93	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.4	169	-178.7	0	0	0	0	0	112.3	I3 F4 F142 K143 Q163 I166	I3-A159 HydrophobicContact CG1-CB 4.48Å; F4-A159 WeakPolarHBondContact CE2-O 3.48Å; F142-A159 CarbonylContact C-O 3.04Å; F142-A159 VanDerWaalsContact CA-O 3.29Å; F142-A159 WeakPolarHBondContact CA-O 3.43Å; K143-A159 PolarHBondContact N-O 3.29Å; K143-A159 PolarHBondContact O-N 3.12Å; A159-Q163 HydrophobicContact CB-CB 3.83Å; A159-Q163 HydrophobicContact CB-CG 3.9Å; A159-I166 HydrophobicContact CB-CD1 3.98Å; A159-I166 HydrophobicContact CB-CG1 4.46Å
160	D	91.8	Very high	93.1	Very high	26 Å²	26	40.3 Å²	40.3	14%	0.139	23%	0.23	C	C	.	.			trans	-56.5	138.8	168.3	-176.8	-64.7	0	0	0	109.3	A2 F4 R162 Q163	A2-D160 PolarHBondContact O-N 2.83Å; F4-D160 HydrophobicContact CZ-CB 4.15Å; D160-R162 PolarHBondContact O-N 2.85Å; D160-R162 VanDerWaalsContact OD1-CB 3.28Å; D160-R162 WeakPolarHBondContact OD1-CB 3.44Å; D160-R162 IonicContact OD1-CZ 2.64Å; D160-R162 PolarHBondContact OD1-N 2.87Å; D160-R162 IonicContact OD1-NE 3.97Å; D160-R162 PolarHBondContact OD1-NE 3.27Å; D160-R162 VanDerWaalsContact OD1-NE 3.09Å; D160-R162 IonicContact OD1-NH2 2.79Å; D160-R162 IonicContact OD2-CZ 3.27Å; D160-R162 IonicContact OD2-NE 3.92Å; D160-R162 IonicContact OD2-NH2 2.86Å; D160-R162 PolarHBondContact OD2-NH2 3.41Å; D160-Q163 WeakPolarHBondContact O-CB 3.45Å; D160-Q163 PolarHBondContact O-N 3Å
161	P	91.2	Very high	93.4	Very high	28 Å²	28	38.6 Å²	38.6	18%	0.182	21%	0.211	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.5	-23.7	-177.8	-26.2	35.5	0	0	0	114.9	K143	K143-P161 PolarHBondContact NZ-O 2.89Å
162	R	90.1	Very high	93.6	Very high	179 Å²	179	38.8 Å²	38.8	68%	0.675	20%	0.203	S	C	*	.	T	Hydrogen-bonded Turn	trans	-86.1	-11.6	178.2	-58.4	171.9	-68.9	-178.1	-1.8	113.1	M1 D160 S164	M1-R162 HydrophobicContact CE-CB 4.11Å; M1-R162 WeakPolarHBondContact CE-O 3.35Å; D160-R162 PolarHBondContact O-N 2.85Å; D160-R162 VanDerWaalsContact OD1-CB 3.28Å; D160-R162 WeakPolarHBondContact OD1-CB 3.44Å; D160-R162 IonicContact OD1-CZ 2.64Å; D160-R162 PolarHBondContact OD1-N 2.87Å; D160-R162 IonicContact OD1-NE 3.97Å; D160-R162 PolarHBondContact OD1-NE 3.27Å; D160-R162 VanDerWaalsContact OD1-NE 3.09Å; D160-R162 IonicContact OD1-NH2 2.79Å; D160-R162 IonicContact OD2-CZ 3.27Å; D160-R162 IonicContact OD2-NE 3.92Å; D160-R162 IonicContact OD2-NH2 2.86Å; D160-R162 PolarHBondContact OD2-NH2 3.41Å; R162-S164 PolarHBondContact O-N 3.01Å
163	Q	88.4	Confident	93.8	Very high	9 Å²	9	38.5 Å²	38.5	4%	0.042	20%	0.201	C	C	.	.			trans	-61.9	122.7	179.1	-177.8	67.9	15.9	0	0	110.1	I3 A159 D160 I166 A209 A213	I3-Q163 HydrophobicContact CG1-CG 4.41Å; A159-Q163 HydrophobicContact CB-CB 3.83Å; A159-Q163 HydrophobicContact CB-CG 3.9Å; D160-Q163 WeakPolarHBondContact O-CB 3.45Å; D160-Q163 PolarHBondContact O-N 3Å; Q163-I166 HydrophobicContact CB-CD1 4.46Å; Q163-I166 HydrophobicContact CG-CD1 3.49Å; Q163-I166 VanDerWaalsContact CG-CD1 3.49Å; Q163-I166 HydrophobicContact CG-CG1 4.01Å; Q163-A209 PolarHBondContact NE2-O 3.42Å; Q163-A213 HydrophobicContact CG-CB 4.48Å
164	S	88.4	Confident	93.9	Very high	56 Å²	56	42.6 Å²	42.6	39%	0.392	22%	0.217	S	C	.	.			trans	-98.8	170	175.7	62.8	0	0	0	0	111.3	R162 I166	R162-S164 PolarHBondContact O-N 3.01Å; S164-I166 VanDerWaalsContact C-N 3.3Å; S164-I166 PolarHBondContact O-N 3.24Å
165	G	90.3	Very high	93.8	Very high	46 Å²	46	47.1 Å²	47.1	47%	0.474	24%	0.238	S	C	.	.			trans	74.5	12.1	175.2	0	0	0	0	0	115.7	D167 A168 L169	G165-D167 VanDerWaalsContact C-N 3.32Å; G165-D167 PolarHBondContact O-N 2.93Å; G165-A168 PolarHBondContact O-N 3.39Å; G165-L169 PolarHBondContact O-N 3.19Å
166	I	93.9	Very high	93.7	Very high	4 Å²	4	47.5 Å²	47.5	2%	0.021	24%	0.24	C	C	.	.	H	α-helix	trans	-64.3	-34.6	-179.4	-60.2	-58.3	0	0	0	112.5	I3 H145 V157 A159 Q163 S164 A168 L169 L170	I3-I166 HydrophobicContact CG1-CD1 4.4Å; H145-I166 HydrophobicContact CB-CG2 3.52Å; H145-I166 VanDerWaalsContact CG-CG2 3.4Å; V157-I166 HydrophobicContact CB-CG2 4.13Å; V157-I166 HydrophobicContact CG1-CD1 4.21Å; V157-I166 HydrophobicContact CG1-CG2 4.2Å; A159-I166 HydrophobicContact CB-CD1 3.98Å; A159-I166 HydrophobicContact CB-CG1 4.46Å; Q163-I166 HydrophobicContact CB-CD1 4.46Å; Q163-I166 HydrophobicContact CG-CD1 3.49Å; Q163-I166 VanDerWaalsContact CG-CD1 3.49Å; Q163-I166 HydrophobicContact CG-CG1 4.01Å; S164-I166 VanDerWaalsContact C-N 3.3Å; S164-I166 PolarHBondContact O-N 3.24Å; I166-A168 VanDerWaalsContact C-N 3.31Å; I166-A168 PolarHBondContact O-N 3.44Å; I166-L169 HydrophobicContact CD1-CD2 4.31Å; I166-L169 WeakPolarHBondContact O-CB 3.42Å; I166-L169 PolarHBondContact O-N 3.5Å; I166-L169 VanDerWaalsContact O-N 3.16Å; I166-L170 HydrophobicContact CG2-CD1 4.02Å; I166-L170 HydrophobicContact CG2-CG 4.2Å; I166-L170 WeakPolarHBondContact O-CG 3.25Å; I166-L170 PolarHBondContact O-N 3.28Å
167	D	92.3	Very high	93.4	Very high	97 Å²	97	47.3 Å²	47.3	52%	0.519	24%	0.239	S	C	.	.	H	α-helix	trans	-63.8	-37.4	177.9	-59.2	-28.9	0	0	0	112.3	G165 L170 R171	G165-D167 VanDerWaalsContact C-N 3.32Å; G165-D167 PolarHBondContact O-N 2.93Å; D167-L170 PolarHBondContact O-N 3.18Å; D167-R171 WeakPolarHBondContact O-CG 3.41Å; D167-R171 PolarHBondContact O-N 3.03Å; D167-R171 VanDerWaalsContact O-N 3.12Å
168	A	94.1	Very high	93.1	Very high	62 Å²	62	48.7 Å²	48.7	51%	0.512	25%	0.249	S	C	.	.	H	α-helix	trans	-67.3	-40.8	175.1	0	0	0	0	0	110.9	G165 I166 R171 K172	G165-A168 PolarHBondContact O-N 3.39Å; I166-A168 VanDerWaalsContact C-N 3.31Å; I166-A168 PolarHBondContact O-N 3.44Å; A168-R171 PolarHBondContact O-N 3.49Å; A168-K172 WeakPolarHBondContact O-CB 3.39Å; A168-K172 PolarHBondContact O-N 3.01Å
169	L	95.6	Very high	92.8	Very high	7 Å²	7	51 Å²	51	4%	0.037	26%	0.261	C	S	.	.	H	α-helix	trans	-61.6	-46.6	173.8	174.9	64.4	0	0	0	111.6	I3 V157 G165 I166 R171 K172 I173 A205 L206 A209	I3-L169 HydrophobicContact CD1-CD2 3.56Å; V157-L169 HydrophobicContact CG1-CD2 4.17Å; V157-L169 HydrophobicContact CG2-CD2 4.34Å; G165-L169 PolarHBondContact O-N 3.19Å; I166-L169 HydrophobicContact CD1-CD2 4.31Å; I166-L169 WeakPolarHBondContact O-CB 3.42Å; I166-L169 PolarHBondContact O-N 3.5Å; I166-L169 VanDerWaalsContact O-N 3.16Å; L169-R171 VanDerWaalsContact C-N 3.33Å; L169-R171 PolarHBondContact O-N 3.36Å; L169-K172 CarbonylContact O-C 3.59Å; L169-K172 WeakPolarHBondContact O-CA 3.33Å; L169-K172 WeakPolarHBondContact O-CB 3.24Å; L169-K172 PolarHBondContact O-N 2.85Å; L169-I173 HydrophobicContact CD1-CD1 4.09Å; L169-I173 HydrophobicContact CD1-CG1 4.12Å; L169-I173 HydrophobicContact CG-CD1 3.9Å; L169-I173 HydrophobicContact CG-CG1 4.35Å; L169-I173 VanDerWaalsContact O-CG1 3.27Å; L169-I173 WeakPolarHBondContact O-CG1 3.41Å; L169-I173 PolarHBondContact O-N 2.89Å; L169-A205 HydrophobicContact CD1-CB 4.1Å; L169-L206 HydrophobicContact CD1-CD2 4.25Å; L169-L206 HydrophobicContact CD2-CD2 3.92Å; L169-A209 HydrophobicContact CB-CB 4.19Å; L169-A209 HydrophobicContact CD1-CB 4.05Å; L169-A209 HydrophobicContact CD2-CB 3.97Å; L169-A209 HydrophobicContact CG-CB 4.3Å
170	L	96.5	Very high	92.2	Very high	5 Å²	5	53.3 Å²	53.3	3%	0.026	27%	0.271	C	S	.	.	H	α-helix	trans	-58.6	-43.8	178.3	-76.6	168.1	0	0	0	112	H145 F147 F155 V157 I166 D167 K172 I173 Y174	H145-L170 HydrophobicContact CB-CD1 3.77Å; F147-L170 HydrophobicContact CB-CB 3.95Å; F147-L170 HydrophobicContact CB-CD1 4Å; F147-L170 HydrophobicContact CB-CD2 4.13Å; F147-L170 HydrophobicContact CB-CG 4.25Å; F155-L170 HydrophobicContact CB-CD2 3.81Å; F155-L170 WeakPolarHBondContact O-CD2 3.27Å; V157-L170 HydrophobicContact CB-CD2 4.35Å; V157-L170 HydrophobicContact CG2-CD2 3.63Å; V157-L170 HydrophobicContact CG2-CG 4.26Å; I166-L170 HydrophobicContact CG2-CD1 4.02Å; I166-L170 HydrophobicContact CG2-CG 4.2Å; I166-L170 WeakPolarHBondContact O-CG 3.25Å; I166-L170 PolarHBondContact O-N 3.28Å; D167-L170 PolarHBondContact O-N 3.18Å; L170-K172 VanDerWaalsContact C-N 3.33Å; L170-K172 PolarHBondContact O-N 3.22Å; L170-I173 PolarHBondContact O-N 2.77Å; L170-Y174 PolarHBondContact O-N 3.06Å
171	R	95.3	Very high	91.4	Very high	154 Å²	154	52.2 Å²	52.2	58%	0.581	27%	0.266	S	S	*	.	H	α-helix	trans	-62.1	-41	172.9	-69.9	-178.5	-172.9	115.6	2	111.7	D167 A168 L169 I173 Y174 E175	D167-R171 WeakPolarHBondContact O-CG 3.41Å; D167-R171 PolarHBondContact O-N 3.03Å; D167-R171 VanDerWaalsContact O-N 3.12Å; A168-R171 PolarHBondContact O-N 3.49Å; L169-R171 VanDerWaalsContact C-N 3.33Å; L169-R171 PolarHBondContact O-N 3.36Å; R171-I173 PolarHBondContact O-N 3.04Å; R171-Y174 WeakPolarHBondContact O-CB 3.48Å; R171-Y174 PolarHBondContact O-N 3.43Å; R171-E175 PolarHBondContact O-N 3.26Å
172	K	95.9	Very high	90.6	Very high	97 Å²	97	55.7 Å²	55.7	42%	0.422	28%	0.282	S	S	.	.	H	α-helix	trans	-64.7	-40.4	177.7	-170.6	58.4	-179	174.8	0	112.5	A168 L169 L170 Y174 E175 I176 A205	A168-K172 WeakPolarHBondContact O-CB 3.39Å; A168-K172 PolarHBondContact O-N 3.01Å; L169-K172 CarbonylContact O-C 3.59Å; L169-K172 WeakPolarHBondContact O-CA 3.33Å; L169-K172 WeakPolarHBondContact O-CB 3.24Å; L169-K172 PolarHBondContact O-N 2.85Å; L170-K172 VanDerWaalsContact C-N 3.33Å; L170-K172 PolarHBondContact O-N 3.22Å; K172-Y174 VanDerWaalsContact C-N 3.28Å; K172-Y174 PolarHBondContact O-N 2.98Å; K172-E175 VanDerWaalsContact CD-OE2 3.25Å; K172-E175 WeakPolarHBondContact CD-OE2 3.4Å; K172-E175 IonicContact NZ-OE2 2.66Å; K172-E175 PolarHBondContact NZ-OE2 2.89Å; K172-E175 WeakPolarHBondContact O-CB 3.26Å; K172-E175 PolarHBondContact O-N 2.87Å; K172-I176 HydrophobicContact CG-CD1 4.17Å; K172-I176 VanDerWaalsContact O-CG1 3.27Å; K172-I176 WeakPolarHBondContact O-CG1 3.35Å; K172-I176 PolarHBondContact O-N 3.39Å; K172-A205 HydrophobicContact CG-CB 4.01Å
173	I	95.8	Very high	90.1	Very high	0 Å²	0	54.1 Å²	54.1	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-62	-39.6	174.4	-63.8	169.9	0	0	0	110.1	V6 F155 V157 L169 L170 R171 I176 Y177 L202	V6-I173 HydrophobicContact CG1-CD1 4.07Å; F155-I173 HydrophobicContact CD1-CB 4.46Å; F155-I173 HydrophobicContact CD1-CG2 3.46Å; F155-I173 VanDerWaalsContact CD1-CG2 3.46Å; F155-I173 HydrophobicContact CE1-CG2 3.88Å; F155-I173 HydrophobicContact CG-CG2 4.2Å; V157-I173 HydrophobicContact CG2-CD1 3.84Å; L169-I173 HydrophobicContact CD1-CD1 4.09Å; L169-I173 HydrophobicContact CD1-CG1 4.12Å; L169-I173 HydrophobicContact CG-CD1 3.9Å; L169-I173 HydrophobicContact CG-CG1 4.35Å; L169-I173 VanDerWaalsContact O-CG1 3.27Å; L169-I173 WeakPolarHBondContact O-CG1 3.41Å; L169-I173 PolarHBondContact O-N 2.89Å; L170-I173 PolarHBondContact O-N 2.77Å; R171-I173 PolarHBondContact O-N 3.04Å; I173-I176 PolarHBondContact O-N 3.44Å; I173-Y177 WeakPolarHBondContact O-CB 3.47Å; I173-Y177 PolarHBondContact O-N 2.93Å; I173-L202 HydrophobicContact CD1-CD1 3.94Å; I173-L202 HydrophobicContact CG1-CD1 3.6Å; I173-L202 HydrophobicContact CG2-CD1 4.26Å
174	Y	95.4	Very high	89.6	Confident	90 Å²	90	57.2 Å²	57.2	35%	0.353	30%	0.297	S	S	.	.	H	α-helix	trans	-64.5	-39.7	175.3	173.4	-128	0	0	0	113.3	F147 T149 F155 L170 R171 K172 Y177 S178	F147-Y174 HydrophobicContact CE1-CD1 4.04Å; F147-Y174 AromaticContact CE1-CG 3.97Å; F147-Y174 HydrophobicContact CE1-CG 3.97Å; T149-Y174 HydrophobicContact CG2-CD2 3.63Å; T149-Y174 HydrophobicContact CG2-CE2 3.64Å; T149-Y174 HydrophobicContact CG2-CG 4.33Å; F155-Y174 AromaticContact CE2-CD2 3.69Å; F155-Y174 HydrophobicContact CE2-CD2 3.69Å; F155-Y174 HydrophobicContact CE2-CG 4.11Å; F155-Y174 HydrophobicContact CZ-CD2 4.01Å; L170-Y174 PolarHBondContact O-N 3.06Å; R171-Y174 WeakPolarHBondContact O-CB 3.48Å; R171-Y174 PolarHBondContact O-N 3.43Å; K172-Y174 VanDerWaalsContact C-N 3.28Å; K172-Y174 PolarHBondContact O-N 2.98Å; Y174-Y177 PolarHBondContact O-N 3.37Å; Y174-S178 VanDerWaalsContact CE2-OG 3.27Å; Y174-S178 WeakPolarHBondContact CE2-OG 3.42Å; Y174-S178 WeakPolarHBondContact O-CB 3.04Å; Y174-S178 PolarHBondContact O-N 3.49Å; Y174-S178 PolarHBondContact O-OG 3.31Å
175	E	94.6	Very high	89	Confident	98 Å²	98	59.9 Å²	59.9	46%	0.458	31%	0.313	S	S	.	.	H	α-helix	trans	-59.5	-49.5	172.2	-69.7	175.9	-178.3	0	0	111.2	R171 K172 Y177 S178 D179	R171-E175 PolarHBondContact O-N 3.26Å; K172-E175 VanDerWaalsContact CD-OE2 3.25Å; K172-E175 WeakPolarHBondContact CD-OE2 3.4Å; K172-E175 IonicContact NZ-OE2 2.66Å; K172-E175 PolarHBondContact NZ-OE2 2.89Å; K172-E175 WeakPolarHBondContact O-CB 3.26Å; K172-E175 PolarHBondContact O-N 2.87Å; E175-Y177 VanDerWaalsContact C-N 3.31Å; E175-Y177 PolarHBondContact O-N 3.19Å; E175-S178 WeakPolarHBondContact O-CB 3.33Å; E175-S178 PolarHBondContact O-N 3.24Å; E175-S178 VanDerWaalsContact O-N 3.15Å; E175-D179 PolarHBondContact O-N 3.25Å
176	I	94.1	Very high	88.3	Confident	8 Å²	8	66.7 Å²	66.7	4%	0.041	33%	0.33	C	S	.	.	H	α-helix	trans	-59.8	-43.5	178.6	-64.7	165.3	0	0	0	110.1	K172 I173 D179 F180 F198 N201 A205	K172-I176 HydrophobicContact CG-CD1 4.17Å; K172-I176 VanDerWaalsContact O-CG1 3.27Å; K172-I176 WeakPolarHBondContact O-CG1 3.35Å; K172-I176 PolarHBondContact O-N 3.39Å; I173-I176 PolarHBondContact O-N 3.44Å; I176-D179 PolarHBondContact O-N 3.08Å; I176-F180 HydrophobicContact CG2-CD2 3.71Å; I176-F180 HydrophobicContact CG2-CE2 3.92Å; I176-F180 WeakPolarHBondContact O-CD2 3.28Å; I176-F180 PolarHBondContact O-N 2.97Å; I176-F180 VanDerWaalsContact O-N 3.1Å; I176-F198 HydrophobicContact CG2-CD2 3.59Å; I176-F198 HydrophobicContact CG2-CE2 3.85Å; I176-F198 HydrophobicContact CG2-CG 4.3Å; I176-N201 HydrophobicContact CD1-CB 4.08Å; I176-N201 HydrophobicContact CG1-CB 4.18Å; I176-N201 HydrophobicContact CG2-CB 3.9Å; I176-A205 HydrophobicContact CD1-CB 3.97Å
177	Y	92.3	Very high	87.5	Confident	3 Å²	3	68.7 Å²	68.7	1%	0.012	34%	0.338	C	S	.	.	H	α-helix	trans	-60.7	-46.2	175.4	177.1	-96.6	0	0	0	112	I16 I153 F155 I173 Y174 E175 D179 F180 A181 I193 F198	I16-Y177 HydrophobicContact CD1-CE2 4.26Å; I153-Y177 HydrophobicContact CG1-CE1 4.36Å; F155-Y177 HydrophobicContact CE1-CD2 4.18Å; F155-Y177 AromaticContact CE1-CG 3.9Å; F155-Y177 HydrophobicContact CE1-CG 3.9Å; F155-Y177 AromaticContact CZ-CD1 3.82Å; F155-Y177 HydrophobicContact CZ-CD1 3.82Å; F155-Y177 HydrophobicContact CZ-CD2 4.26Å; F155-Y177 AromaticContact CZ-CG 3.63Å; F155-Y177 HydrophobicContact CZ-CG 3.63Å; I173-Y177 WeakPolarHBondContact O-CB 3.47Å; I173-Y177 PolarHBondContact O-N 2.93Å; Y174-Y177 PolarHBondContact O-N 3.37Å; E175-Y177 VanDerWaalsContact C-N 3.31Å; E175-Y177 PolarHBondContact O-N 3.19Å; Y177-D179 VanDerWaalsContact C-N 3.27Å; Y177-D179 PolarHBondContact O-N 3.44Å; Y177-F180 PolarHBondContact O-N 3.25Å; Y177-A181 HydrophobicContact CD1-CB 4.35Å; Y177-A181 HydrophobicContact CD2-CB 3.71Å; Y177-A181 HydrophobicContact CE1-CB 4.13Å; Y177-A181 HydrophobicContact CE2-CB 3.44Å; Y177-A181 VanDerWaalsContact CE2-CB 3.44Å; Y177-A181 HydrophobicContact CG-CB 4.17Å; Y177-A181 WeakPolarHBondContact O-CA 3.4Å; Y177-A181 WeakPolarHBondContact O-CB 3.39Å; Y177-A181 PolarHBondContact O-N 3.5Å; Y177-I193 HydrophobicContact CD2-CD1 3.64Å; Y177-I193 HydrophobicContact CE2-CD1 3.7Å; Y177-I193 HydrophobicContact CE2-CG1 4.49Å; Y177-F198 HydrophobicContact CD2-CE2 4.44Å
178	S	90.1	Very high	87	Confident	29 Å²	29	66.9 Å²	66.9	20%	0.203	33%	0.333	C	S	.	.	I	π-helix	trans	-60.1	-39.5	178.6	-60.6	0	0	0	0	111.8	Y174 E175 L182	Y174-S178 VanDerWaalsContact CE2-OG 3.27Å; Y174-S178 WeakPolarHBondContact CE2-OG 3.42Å; Y174-S178 WeakPolarHBondContact O-CB 3.04Å; Y174-S178 PolarHBondContact O-N 3.49Å; Y174-S178 PolarHBondContact O-OG 3.31Å; E175-S178 WeakPolarHBondContact O-CB 3.33Å; E175-S178 PolarHBondContact O-N 3.24Å; E175-S178 VanDerWaalsContact O-N 3.15Å; S178-L182 WeakPolarHBondContact O-CB 3.49Å; S178-L182 PolarHBondContact O-N 3.24Å
179	D	88	Confident	86.2	Confident	73 Å²	73	68 Å²	68	39%	0.39	33%	0.33	S	S	.	.	I	π-helix	trans	-70.5	-37.6	-179.9	-79.7	-27.1	0	0	0	113.7	E175 I176 Y177 K183	E175-D179 PolarHBondContact O-N 3.25Å; I176-D179 PolarHBondContact O-N 3.08Å; Y177-D179 VanDerWaalsContact C-N 3.27Å; Y177-D179 PolarHBondContact O-N 3.44Å; D179-K183 VanDerWaalsContact O-CB 3.24Å; D179-K183 WeakPolarHBondContact O-CB 3.39Å; D179-K183 VanDerWaalsContact O-CD 3.26Å; D179-K183 WeakPolarHBondContact O-CD 3.48Å; D179-K183 WeakPolarHBondContact O-CG 3.14Å; D179-K183 WeakPolarHBondContact OD1-CE 3.46Å; D179-K183 IonicContact OD1-NZ 3.09Å; D179-K183 PolarHBondContact OD1-NZ 3.04Å
180	F	81.4	Confident	85.4	Confident	48 Å²	48	74.5 Å²	74.5	21%	0.211	36%	0.36	C	S	.	.	I	π-helix	trans	-103.4	-28.9	-172.5	-63.9	-65.1	0	0	0	114.5	I176 Y177 L197 F198 N201	I176-F180 HydrophobicContact CG2-CD2 3.71Å; I176-F180 HydrophobicContact CG2-CE2 3.92Å; I176-F180 WeakPolarHBondContact O-CD2 3.28Å; I176-F180 PolarHBondContact O-N 2.97Å; I176-F180 VanDerWaalsContact O-N 3.1Å; Y177-F180 PolarHBondContact O-N 3.25Å; F180-L197 HydrophobicContact CD1-CB 3.79Å; F180-L197 HydrophobicContact CD1-CD1 4.4Å; F180-L197 HydrophobicContact CE1-CB 3.38Å; F180-L197 HydrophobicContact CE1-CD1 3.82Å; F180-L197 HydrophobicContact CE1-CG 4.24Å; F180-L197 HydrophobicContact CZ-CB 3.82Å; F180-F198 HydrophobicContact CB-CB 4.08Å; F180-F198 HydrophobicContact CB-CD2 4.32Å; F180-F198 HydrophobicContact CD2-CB 4.18Å; F180-F198 HydrophobicContact CD2-CD2 4.37Å; F180-F198 HydrophobicContact CG-CB 4.27Å; F180-N201 HydrophobicContact CE2-CB 4.16Å; F180-N201 WeakPolarHBondContact CE2-ND2 3.4Å; F180-N201 WeakPolarHBondContact CZ-ND2 3.47Å
181	A	74.9	Confident	84.9	Confident	4 Å²	4	79.4 Å²	79.4	3%	0.033	38%	0.384	C	S	.	.	I	π-helix	trans	-88.1	-43.2	178	0	0	0	0	0	112	Y177 Y187	Y177-A181 HydrophobicContact CD1-CB 4.35Å; Y177-A181 HydrophobicContact CD2-CB 3.71Å; Y177-A181 HydrophobicContact CE1-CB 4.13Å; Y177-A181 HydrophobicContact CE2-CB 3.44Å; Y177-A181 VanDerWaalsContact CE2-CB 3.44Å; Y177-A181 HydrophobicContact CG-CB 4.17Å; Y177-A181 WeakPolarHBondContact O-CA 3.4Å; Y177-A181 WeakPolarHBondContact O-CB 3.39Å; Y177-A181 PolarHBondContact O-N 3.5Å; A181-Y187 HydrophobicContact CB-CD1 3.92Å; A181-Y187 HydrophobicContact CB-CE1 3.78Å; A181-Y187 WeakPolarHBondContact O-CD1 3.27Å
182	L	75.8	Confident	84.5	Confident	101 Å²	101	74.8 Å²	74.8	53%	0.529	37%	0.374	S	S	.	.	I	π-helix	trans	-87.9	-23.2	-173.8	-55.9	178.6	0	0	0	113.8	S178 N184 L189	S178-L182 WeakPolarHBondContact O-CB 3.49Å; S178-L182 PolarHBondContact O-N 3.24Å; L182-N184 PolarHBondContact O-N 3.3Å; L182-L189 HydrophobicContact CD2-CD2 4.34Å
183	K	79.9	Confident	84.1	Confident	145 Å²	145	70.7 Å²	70.7	63%	0.63	36%	0.356	S	S	*	.	S	Bend	trans	-76.8	-8.8	173.2	-62.1	-173.8	-173	160.6	0	113.3	D179 P185	D179-K183 VanDerWaalsContact O-CB 3.24Å; D179-K183 WeakPolarHBondContact O-CB 3.39Å; D179-K183 VanDerWaalsContact O-CD 3.26Å; D179-K183 WeakPolarHBondContact O-CD 3.48Å; D179-K183 WeakPolarHBondContact O-CG 3.14Å; D179-K183 WeakPolarHBondContact OD1-CE 3.46Å; D179-K183 IonicContact OD1-NZ 3.09Å; D179-K183 PolarHBondContact OD1-NZ 3.04Å; K183-P185 WeakPolarHBondContact O-CD 3.27Å
184	N	76.6	Confident	83.6	Confident	75 Å²	75	80.6 Å²	80.6	40%	0.401	39%	0.394	S	S	.	.			trans	-93.3	101.6	173.5	-174.6	-11.2	0	0	0	109.6	L182 F186 Y187	L182-N184 PolarHBondContact O-N 3.3Å; N184-F186 PolarHBondContact O-N 3.07Å; N184-F186 PolarHBondContact OD1-N 3.33Å; N184-Y187 WeakPolarHBondContact O-CB 3.39Å; N184-Y187 PolarHBondContact O-N 2.87Å
185	P	75.6	Confident	83.2	Confident	111 Å²	111	78.4 Å²	78.4	72%	0.721	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.4	-12.5	-174.7	26.8	-35	0	0	0	114	K183	K183-P185 WeakPolarHBondContact O-CD 3.27Å
186	F	75.8	Confident	82.9	Confident	189 Å²	189	80.5 Å²	80.5	83%	0.829	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.9	2.2	177.8	-55.5	-74	0	0	0	113	N184 S188	N184-F186 PolarHBondContact O-N 3.07Å; N184-F186 PolarHBondContact OD1-N 3.33Å; F186-S188 PolarHBondContact O-N 2.89Å
187	Y	77.8	Confident	82.7	Confident	46 Å²	46	84.5 Å²	84.5	18%	0.18	42%	0.422	C	S	.	.			trans	-77.5	119.3	-179.1	-176.1	-108	0	0	0	110.9	A181 N184 M191 I193	A181-Y187 HydrophobicContact CB-CD1 3.92Å; A181-Y187 HydrophobicContact CB-CE1 3.78Å; A181-Y187 WeakPolarHBondContact O-CD1 3.27Å; N184-Y187 WeakPolarHBondContact O-CB 3.39Å; N184-Y187 PolarHBondContact O-N 2.87Å; Y187-M191 PolarHBondContact OH-O 2.84Å; Y187-I193 WeakPolarHBondContact OH-CG1 3.19Å
188	S	81.2	Confident	82.7	Confident	60 Å²	60	84.3 Å²	84.3	42%	0.42	42%	0.421	S	S	.	.			trans	-83.6	130.1	170	177.5	0	0	0	0	109.9	F186 E190 M191	F186-S188 PolarHBondContact O-N 2.89Å; S188-E190 PolarHBondContact O-N 3.41Å; S188-E190 VanDerWaalsContact O-N 3.09Å; S188-M191 WeakPolarHBondContact O-CB 3.11Å; S188-M191 PolarHBondContact O-N 2.83Å
189	L	78.8	Confident	82.8	Confident	86 Å²	86	85.3 Å²	85.3	45%	0.45	42%	0.424	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-16.6	-178.3	-60.4	176.5	0	0	0	113.7	L182	L182-L189 HydrophobicContact CD2-CD2 4.34Å
190	E	78.7	Confident	83.1	Confident	143 Å²	143	87.5 Å²	87.5	67%	0.668	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.3	-12.1	178.5	-62.2	-174.2	167.8	0	0	112.9	S188	S188-E190 PolarHBondContact O-N 3.41Å; S188-E190 VanDerWaalsContact O-N 3.09Å
191	M	84.3	Confident	83.7	Confident	107 Å²	107	88.7 Å²	88.7	53%	0.527	44%	0.441	S	S	.	.	S	Bend	trans	-90	147.9	-176.6	-67.1	-63.9	-69.3	0	0	111.6	Y187 S188 I193	Y187-M191 PolarHBondContact OH-O 2.84Å; S188-M191 WeakPolarHBondContact O-CB 3.11Å; S188-M191 PolarHBondContact O-N 2.83Å; M191-I193 PolarHBondContact O-N 3.37Å
192	P	87.4	Confident	84.6	Confident	57 Å²	57	88.5 Å²	88.5	37%	0.37	44%	0.439	S	S	.	.	P	Polyproline II helix	trans	-58.3	139.9	175.7	-24.6	33.7	0	0	0	112.7	I16 R194	I16-P192 CarbonylContact O-C 3.55Å; I16-P192 WeakPolarHBondContact O-CA 3.18Å; P192-R194 PolarHBondContact O-N 2.83Å
193	I	87.3	Confident	85.5	Confident	11 Å²	11	88 Å²	88	6%	0.056	43%	0.432	C	S	.	.	P	Polyproline II helix	trans	-70.9	116.1	171.1	-53.6	171.7	0	0	0	107.3	I16 Y17 Y177 Y187 M191 C195 F198	I16-I193 HydrophobicContact CD1-CD1 4.46Å; I16-I193 PolarHBondContact O-N 3Å; Y17-I193 HydrophobicContact CD2-CB 4.14Å; Y177-I193 HydrophobicContact CD2-CD1 3.64Å; Y177-I193 HydrophobicContact CE2-CD1 3.7Å; Y177-I193 HydrophobicContact CE2-CG1 4.49Å; Y187-I193 WeakPolarHBondContact OH-CG1 3.19Å; M191-I193 PolarHBondContact O-N 3.37Å; I193-C195 HydrophobicContact CG2-CB 4.35Å; I193-F198 HydrophobicContact CD1-CE1 4.27Å; I193-F198 HydrophobicContact CD1-CE2 4.29Å; I193-F198 HydrophobicContact CD1-CZ 4.07Å; I193-F198 HydrophobicContact CG2-CB 4.06Å; I193-F198 HydrophobicContact CG2-CD1 3.85Å; I193-F198 HydrophobicContact CG2-CD2 4.34Å; I193-F198 HydrophobicContact CG2-CE1 4.41Å; I193-F198 HydrophobicContact CG2-CG 3.82Å
194	R	85.7	Confident	86.2	Confident	208 Å²	208	82.4 Å²	82.4	79%	0.785	42%	0.416	S	S	*	.			trans	-117.5	14.2	177.3	-62.6	-176.5	179.9	-179.4	0.1	112.8	P192 E196	P192-R194 PolarHBondContact O-N 2.83Å; R194-E196 PolarHBondContact O-N 3.27Å
195	C	87.1	Confident	87	Confident	44 Å²	44	79.3 Å²	79.3	30%	0.297	40%	0.401	S	S	.	.			trans	-75.3	115.2	-177.6	-176.7	0	0	0	0	109.7	I193 L197 F198 D199	I193-C195 HydrophobicContact CG2-CB 4.35Å; C195-L197 PolarHBondContact O-N 2.9Å; C195-F198 HydrophobicContact CB-CB 4.02Å; C195-F198 VanDerWaalsContact O-CB 3.27Å; C195-F198 WeakPolarHBondContact O-CB 3.25Å; C195-F198 PolarHBondContact O-N 2.9Å; C195-D199 PolarHBondContact O-N 2.84Å
196	E	88.9	Confident	87.9	Confident	143 Å²	143	74 Å²	74	67%	0.668	37%	0.367	S	S	*	.	H	α-helix	trans	-60.4	-32.6	-179.8	-62.7	-177.4	176.5	0	0	112.9	R194 F198 D199 Q200	R194-E196 PolarHBondContact O-N 3.27Å; E196-F198 VanDerWaalsContact C-N 3.29Å; E196-F198 PolarHBondContact O-N 3.39Å; E196-D199 PolarHBondContact O-N 3.32Å; E196-Q200 WeakPolarHBondContact O-CG 3.36Å; E196-Q200 PolarHBondContact O-N 3.1Å
197	L	89.8	Confident	88.6	Confident	91 Å²	91	70.3 Å²	70.3	48%	0.476	35%	0.352	S	S	.	.	H	α-helix	trans	-66.4	-33.1	176	-64.2	174.9	0	0	0	111.9	F180 C195 N201	F180-L197 HydrophobicContact CD1-CB 3.79Å; F180-L197 HydrophobicContact CD1-CD1 4.4Å; F180-L197 HydrophobicContact CE1-CB 3.38Å; F180-L197 HydrophobicContact CE1-CD1 3.82Å; F180-L197 HydrophobicContact CE1-CG 4.24Å; F180-L197 HydrophobicContact CZ-CB 3.82Å; C195-L197 PolarHBondContact O-N 2.9Å; L197-N201 WeakPolarHBondContact O-CB 3.27Å; L197-N201 PolarHBondContact O-N 2.97Å; L197-N201 PolarHBondContact O-ND2 3.15Å
198	F	91.8	Very high	89.2	Confident	0 Å²	0	73.8 Å²	73.8	0%	0	37%	0.373	C	S	.	.	H	α-helix	trans	-62.6	-48.1	172.8	178.7	-89.3	0	0	0	110	Y17 I176 Y177 F180 I193 C195 E196 Q200 N201 L202	Y17-F198 AromaticContact CD1-CE1 3.79Å; Y17-F198 HydrophobicContact CD1-CE1 3.79Å; Y17-F198 HydrophobicContact CD2-CD1 4.14Å; Y17-F198 AromaticContact CD2-CE1 3.85Å; Y17-F198 HydrophobicContact CD2-CE1 3.85Å; Y17-F198 AromaticContact CE1-CE1 3.81Å; Y17-F198 HydrophobicContact CE1-CE1 3.81Å; Y17-F198 AromaticContact CE2-CD1 3.93Å; Y17-F198 HydrophobicContact CE2-CD1 3.93Å; Y17-F198 AromaticContact CE2-CE1 3.87Å; Y17-F198 HydrophobicContact CE2-CE1 3.87Å; Y17-F198 AromaticContact CG-CE1 3.8Å; Y17-F198 HydrophobicContact CG-CE1 3.8Å; Y17-F198 AromaticContact CZ-CE1 3.82Å; I176-F198 HydrophobicContact CG2-CD2 3.59Å; I176-F198 HydrophobicContact CG2-CE2 3.85Å; I176-F198 HydrophobicContact CG2-CG 4.3Å; Y177-F198 HydrophobicContact CD2-CE2 4.44Å; F180-F198 HydrophobicContact CB-CB 4.08Å; F180-F198 HydrophobicContact CB-CD2 4.32Å; F180-F198 HydrophobicContact CD2-CB 4.18Å; F180-F198 HydrophobicContact CD2-CD2 4.37Å; F180-F198 HydrophobicContact CG-CB 4.27Å; I193-F198 HydrophobicContact CD1-CE1 4.27Å; I193-F198 HydrophobicContact CD1-CE2 4.29Å; I193-F198 HydrophobicContact CD1-CZ 4.07Å; I193-F198 HydrophobicContact CG2-CB 4.06Å; I193-F198 HydrophobicContact CG2-CD1 3.85Å; I193-F198 HydrophobicContact CG2-CD2 4.34Å; I193-F198 HydrophobicContact CG2-CE1 4.41Å; I193-F198 HydrophobicContact CG2-CG 3.82Å; C195-F198 HydrophobicContact CB-CB 4.02Å; C195-F198 VanDerWaalsContact O-CB 3.27Å; C195-F198 WeakPolarHBondContact O-CB 3.25Å; C195-F198 PolarHBondContact O-N 2.9Å; E196-F198 VanDerWaalsContact C-N 3.29Å; E196-F198 PolarHBondContact O-N 3.39Å; F198-Q200 PolarHBondContact O-N 3.39Å; F198-N201 PolarHBondContact O-N 2.9Å; F198-L202 HydrophobicContact CE1-CD2 4.16Å; F198-L202 VanDerWaalsContact O-CB 3.26Å; F198-L202 WeakPolarHBondContact O-CB 3.47Å; F198-L202 PolarHBondContact O-N 2.83Å
199	D	91.8	Very high	89.6	Confident	49 Å²	49	71.6 Å²	71.6	26%	0.262	36%	0.358	S	S	.	.	H	α-helix	trans	-60.9	-43.9	179.9	-66.2	3	0	0	0	112.1	Y17 C195 E196 K203	Y17-D199 WeakPolarHBondContact CE2-OD1 3.43Å; Y17-D199 PolarHBondContact OH-OD1 2.83Å; C195-D199 PolarHBondContact O-N 2.84Å; E196-D199 PolarHBondContact O-N 3.32Å; D199-K203 VanDerWaalsContact O-CG 3.29Å; D199-K203 WeakPolarHBondContact O-CG 3.47Å; D199-K203 PolarHBondContact O-N 3.46Å
200	Q	93.9	Very high	90	Very high	120 Å²	120	69.9 Å²	69.9	56%	0.561	35%	0.347	S	S	*	.	H	α-helix	trans	-64.3	-47.9	179.4	-71.7	175.2	14.3	0	0	111.7	E196 F198 L202 K203 G204	E196-Q200 WeakPolarHBondContact O-CG 3.36Å; E196-Q200 PolarHBondContact O-N 3.1Å; F198-Q200 PolarHBondContact O-N 3.39Å; Q200-L202 VanDerWaalsContact C-N 3.34Å; Q200-L202 PolarHBondContact O-N 3.36Å; Q200-K203 PolarHBondContact O-N 3Å; Q200-G204 PolarHBondContact O-N 2.77Å
201	N	94.6	Very high	90.3	Very high	73 Å²	73	69 Å²	69	39%	0.39	34%	0.342	S	S	.	.	H	α-helix	trans	-67.8	-35.9	179.3	-77	-72.1	0	0	0	112.1	I176 F180 L197 F198 G204 A205	I176-N201 HydrophobicContact CD1-CB 4.08Å; I176-N201 HydrophobicContact CG1-CB 4.18Å; I176-N201 HydrophobicContact CG2-CB 3.9Å; F180-N201 HydrophobicContact CE2-CB 4.16Å; F180-N201 WeakPolarHBondContact CE2-ND2 3.4Å; F180-N201 WeakPolarHBondContact CZ-ND2 3.47Å; L197-N201 WeakPolarHBondContact O-CB 3.27Å; L197-N201 PolarHBondContact O-N 2.97Å; L197-N201 PolarHBondContact O-ND2 3.15Å; F198-N201 PolarHBondContact O-N 2.9Å; N201-G204 PolarHBondContact O-N 3.23Å; N201-A205 WeakPolarHBondContact O-CB 3.5Å; N201-A205 PolarHBondContact O-N 3.19Å
202	L	94.8	Very high	89.9	Confident	0 Å²	0	66.6 Å²	66.6	0%	0	34%	0.338	C	S	.	.	H	α-helix	trans	-62.3	-48	174.7	179.7	66.9	0	0	0	111.1	Y17 I173 F198 Q200 G204 A205 L206	Y17-L202 HydrophobicContact CD1-CD2 4.25Å; Y17-L202 HydrophobicContact CE1-CD2 3.25Å; Y17-L202 WeakPolarHBondContact OH-CD2 3.35Å; I173-L202 HydrophobicContact CD1-CD1 3.94Å; I173-L202 HydrophobicContact CG1-CD1 3.6Å; I173-L202 HydrophobicContact CG2-CD1 4.26Å; F198-L202 HydrophobicContact CE1-CD2 4.16Å; F198-L202 VanDerWaalsContact O-CB 3.26Å; F198-L202 WeakPolarHBondContact O-CB 3.47Å; F198-L202 PolarHBondContact O-N 2.83Å; Q200-L202 VanDerWaalsContact C-N 3.34Å; Q200-L202 PolarHBondContact O-N 3.36Å; L202-G204 VanDerWaalsContact C-N 3.32Å; L202-G204 PolarHBondContact O-N 3.33Å; L202-A205 WeakPolarHBondContact O-CB 3.38Å; L202-A205 PolarHBondContact O-N 2.89Å; L202-A205 VanDerWaalsContact O-N 3.14Å; L202-L206 HydrophobicContact CG-CD1 4.2Å; L202-L206 WeakPolarHBondContact O-CG 3.47Å; L202-L206 PolarHBondContact O-N 3.22Å
203	K	93.9	Very high	88.7	Confident	89 Å²	89	63.9 Å²	63.9	39%	0.387	32%	0.321	S	S	.	.	H	α-helix	trans	-58.1	-45.2	176.7	-74.5	172.5	-177.1	175.3	0	111.6	Y19 D199 Q200 A205 L206 E207	Y19-K203 HydrophobicContact CE1-CG 4.3Å; D199-K203 VanDerWaalsContact O-CG 3.29Å; D199-K203 WeakPolarHBondContact O-CG 3.47Å; D199-K203 PolarHBondContact O-N 3.46Å; Q200-K203 PolarHBondContact O-N 3Å; K203-A205 VanDerWaalsContact C-N 3.32Å; K203-A205 PolarHBondContact O-N 3.03Å; K203-L206 WeakPolarHBondContact O-CB 3.16Å; K203-L206 PolarHBondContact O-N 3.04Å; K203-E207 WeakPolarHBondContact O-CG 3.15Å; K203-E207 PolarHBondContact O-N 2.85Å
204	G	94.1	Very high	87.4	Confident	28 Å²	28	68.1 Å²	68.1	29%	0.289	34%	0.343	S	S	.	.	H	α-helix	trans	-59.6	-41	175.1	0	0	0	0	0	113	Q200 N201 L202 E207 I208	Q200-G204 PolarHBondContact O-N 2.77Å; N201-G204 PolarHBondContact O-N 3.23Å; L202-G204 VanDerWaalsContact C-N 3.32Å; L202-G204 PolarHBondContact O-N 3.33Å; G204-E207 PolarHBondContact O-N 3.38Å; G204-I208 VanDerWaalsContact O-CG1 3.32Å; G204-I208 WeakPolarHBondContact O-CG1 3.26Å; G204-I208 PolarHBondContact O-N 3.07Å
205	A	94.4	Very high	85.9	Confident	10 Å²	10	66.5 Å²	66.5	8%	0.083	34%	0.342	C	S	.	.	H	α-helix	trans	-65.6	-38.8	176.1	0	0	0	0	0	112.6	L169 K172 I176 N201 L202 K203 I208 A209	L169-A205 HydrophobicContact CD1-CB 4.1Å; K172-A205 HydrophobicContact CG-CB 4.01Å; I176-A205 HydrophobicContact CD1-CB 3.97Å; N201-A205 WeakPolarHBondContact O-CB 3.5Å; N201-A205 PolarHBondContact O-N 3.19Å; L202-A205 WeakPolarHBondContact O-CB 3.38Å; L202-A205 PolarHBondContact O-N 2.89Å; L202-A205 VanDerWaalsContact O-N 3.14Å; K203-A205 VanDerWaalsContact C-N 3.32Å; K203-A205 PolarHBondContact O-N 3.03Å; A205-I208 PolarHBondContact O-N 2.87Å; A205-A209 WeakPolarHBondContact O-CB 3.21Å; A205-A209 PolarHBondContact O-N 3.29Å
206	L	93.3	Very high	84	Confident	0 Å²	0	65.5 Å²	65.5	0%	0	34%	0.34	C	S	.	.	H	α-helix	trans	-63.3	-46.4	175.6	-69.4	172.1	0	0	0	111.5	I3 V6 Y19 N21 L169 L202 K203 I208 A209 E210	I3-L206 HydrophobicContact CB-CD2 4.41Å; I3-L206 HydrophobicContact CD1-CD2 3.81Å; I3-L206 HydrophobicContact CG2-CD2 3.85Å; V6-L206 HydrophobicContact CG2-CD1 4.18Å; V6-L206 HydrophobicContact CG2-CD2 3.82Å; Y19-L206 HydrophobicContact CD1-CD1 3.59Å; Y19-L206 HydrophobicContact CE1-CD1 3.6Å; N21-L206 HydrophobicContact CB-CD1 4.45Å; L169-L206 HydrophobicContact CD1-CD2 4.25Å; L169-L206 HydrophobicContact CD2-CD2 3.92Å; L202-L206 HydrophobicContact CG-CD1 4.2Å; L202-L206 WeakPolarHBondContact O-CG 3.47Å; L202-L206 PolarHBondContact O-N 3.22Å; K203-L206 WeakPolarHBondContact O-CB 3.16Å; K203-L206 PolarHBondContact O-N 3.04Å; L206-I208 VanDerWaalsContact C-N 3.28Å; L206-I208 PolarHBondContact O-N 3.1Å; L206-A209 PolarHBondContact O-N 2.82Å; L206-A209 VanDerWaalsContact O-N 3.14Å; L206-E210 WeakPolarHBondContact O-CG 3.24Å; L206-E210 PolarHBondContact O-N 3.35Å
207	E	91.4	Very high	81.7	Confident	112 Å²	112	65.7 Å²	65.7	52%	0.523	35%	0.354	S	S	.	.	H	α-helix	trans	-59.4	-38.9	177.4	-72.1	179.6	-168.1	0	0	112.6	K203 G204 K211	K203-E207 WeakPolarHBondContact O-CG 3.15Å; K203-E207 PolarHBondContact O-N 2.85Å; G204-E207 PolarHBondContact O-N 3.38Å; E207-K211 VanDerWaalsContact O-CG 3.31Å; E207-K211 WeakPolarHBondContact O-CG 3.36Å; E207-K211 PolarHBondContact O-N 3.36Å
208	I	90.8	Very high	79.9	Confident	119 Å²	119	65.1 Å²	65.1	61%	0.61	37%	0.369	S	S	*	.	H	α-helix	trans	-66.8	-44.5	176.3	-67.1	165.9	0	0	0	110.4	G204 A205 L206 E210 K211 A212	G204-I208 VanDerWaalsContact O-CG1 3.32Å; G204-I208 WeakPolarHBondContact O-CG1 3.26Å; G204-I208 PolarHBondContact O-N 3.07Å; A205-I208 PolarHBondContact O-N 2.87Å; L206-I208 VanDerWaalsContact C-N 3.28Å; L206-I208 PolarHBondContact O-N 3.1Å; I208-E210 PolarHBondContact O-N 3.41Å; I208-K211 PolarHBondContact O-N 2.64Å; I208-A212 WeakPolarHBondContact O-CB 3.45Å; I208-A212 PolarHBondContact O-N 3.48Å
209	A	89.9	Confident	77.5	Confident	13 Å²	13	73.2 Å²	73.2	11%	0.107	43%	0.426	C	S	.	.	H	α-helix	trans	-65.7	-37.1	-179.7	0	0	0	0	0	112.6	I3 Q163 L169 A205 L206 A212 A213	I3-A209 HydrophobicContact CD1-CB 3.73Å; Q163-A209 PolarHBondContact NE2-O 3.42Å; L169-A209 HydrophobicContact CB-CB 4.19Å; L169-A209 HydrophobicContact CD1-CB 4.05Å; L169-A209 HydrophobicContact CD2-CB 3.97Å; L169-A209 HydrophobicContact CG-CB 4.3Å; A205-A209 WeakPolarHBondContact O-CB 3.21Å; A205-A209 PolarHBondContact O-N 3.29Å; L206-A209 PolarHBondContact O-N 2.82Å; L206-A209 VanDerWaalsContact O-N 3.14Å; A209-A212 PolarHBondContact O-N 3.29Å; A209-A213 PolarHBondContact O-N 2.66Å
210	E	87.5	Confident	76.8	Confident	50 Å²	50	74.4 Å²	74.4	23%	0.234	43%	0.434	C	S	.	.	H	α-helix	trans	-64.8	-41.2	173.8	-72.2	-171.5	151.2	0	0	112.1	I3 N21 L206 I208 A213	I3-E210 HydrophobicContact CB-CG 4.48Å; I3-E210 HydrophobicContact CD1-CG 3.95Å; I3-E210 HydrophobicContact CG1-CG 4.11Å; I3-E210 PolarHBondContact N-OE1 2.64Å; N21-E210 PolarHBondContact ND2-OE1 2.82Å; L206-E210 WeakPolarHBondContact O-CG 3.24Å; L206-E210 PolarHBondContact O-N 3.35Å; I208-E210 PolarHBondContact O-N 3.41Å; E210-A213 PolarHBondContact O-N 3.09Å
211	K	84.6	Confident	75.9	Confident	126 Å²	126	72 Å²	72	55%	0.548	43%	0.427	S	S	.	.	H	α-helix	trans	-64.7	-42.9	175.8	-72.8	170	-174.5	167.8	0	111.7	E207 I208 A213 N214 F215	E207-K211 VanDerWaalsContact O-CG 3.31Å; E207-K211 WeakPolarHBondContact O-CG 3.36Å; E207-K211 PolarHBondContact O-N 3.36Å; I208-K211 PolarHBondContact O-N 2.64Å; K211-A213 VanDerWaalsContact C-N 3.25Å; K211-A213 PolarHBondContact O-N 3.01Å; K211-N214 PolarHBondContact O-N 3.05Å; K211-F215 WeakPolarHBondContact O-CD2 3.2Å; K211-F215 WeakPolarHBondContact O-CE2 3.5Å
212	A	74.3	Confident	74.8	Confident	55 Å²	55	71.9 Å²	71.9	46%	0.455	43%	0.429	S	S	.	.	H	α-helix	trans	-60.5	-33.6	-179.1	0	0	0	0	0	112.9	I208 A209 F215	I208-A212 WeakPolarHBondContact O-CB 3.45Å; I208-A212 PolarHBondContact O-N 3.48Å; A209-A212 PolarHBondContact O-N 3.29Å; A212-F215 PolarHBondContact O-N 3.02Å
213	A	64.1	Low	73.7	Confident	1 Å²	1	76.2 Å²	76.2	1%	0.008	46%	0.455	C	S	.	.	H	α-helix	trans	-72.3	-26.7	178.8	0	0	0	0	0	114.2	M1 Q163 A209 E210 K211 F215 G216	M1-A213 HydrophobicContact CB-CB 4.23Å; M1-A213 HydrophobicContact CE-CB 4.15Å; M1-A213 HydrophobicContact SD-CB 4.13Å; Q163-A213 HydrophobicContact CG-CB 4.48Å; A209-A213 PolarHBondContact O-N 2.66Å; E210-A213 PolarHBondContact O-N 3.09Å; K211-A213 VanDerWaalsContact C-N 3.25Å; K211-A213 PolarHBondContact O-N 3.01Å; A213-F215 PolarHBondContact O-N 3.43Å; A213-G216 PolarHBondContact O-N 3.39Å
214	N	57.9	Low	72.4	Confident	99 Å²	99	75.4 Å²	75.4	53%	0.529	46%	0.459	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.6	-4.2	176.7	-70.4	-15.6	0	0	0	113.5	M1 K211	M1-N214 PolarHBondContact N-OD1 3.19Å; M1-N214 VanDerWaalsContact N-OD1 3.16Å; K211-N214 PolarHBondContact O-N 3.05Å
215	F	54.3	Low	71	Confident	174 Å²	174	78.5 Å²	78.5	76%	0.763	47%	0.47	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.8	10.8	176.9	-62.7	-78.2	0	0	0	113.6	K211 A212 A213	K211-F215 WeakPolarHBondContact O-CD2 3.2Å; K211-F215 WeakPolarHBondContact O-CE2 3.5Å; A212-F215 PolarHBondContact O-N 3.02Å; A213-F215 PolarHBondContact O-N 3.43Å
216	G	47.3	Very low	69.3	Low	23 Å²	23	83.4 Å²	83.4	24%	0.237	50%	0.498	C	S	.	.	S	Bend	trans	-68.1	154.1	174.3	0	0	0	0	0	112.8	A213 G218	A213-G216 PolarHBondContact O-N 3.39Å; G216-G218 PolarHBondContact O-N 3.2Å
217	P	41.7	Very low	67.4	Low	148 Å²	148	89.8 Å²	89.8	96%	0.961	54%	0.536	S	S	*	.	S	Bend	trans	-70.1	98.4	-170	30.2	-32.8	0	0	0	110
218	G	51.8	Low	65.4	Low	78 Å²	78	88 Å²	88	80%	0.804	54%	0.537	S	S	*	.			trans	169.2	9.3	-177.7	0	0	0	0	0	114.5	G216	G216-G218 PolarHBondContact O-N 3.2Å
219	S	40.9	Very low	63.1	Low	170 Å²	170	85.2 Å²	85.2	100%	1.189	53%	0.53	S	S	*	.			trans	-88.8	0	159.6	43.1	0	0	0	0	111.5

Retrieved 219 of 219 residues in 61.3 ms (Link to these results)

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