A0A5K4FBK9_SCHMA Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A5K4FBK9, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 193 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	88.7	Confident	95.1	Very high	72 Å²	72	68.1 Å²	68.1	36%	0.355	33%	0.332	S	S	.	.				0	-65.7	0	-165.6	-171.1	-66.2	0	0	111.1	D3 E4 M5 K127 Y128 L131	M1-D3 PolarHBondContact O-N 2.87Å; M1-E4 WeakPolarHBondContact O-CB 3.36Å; M1-E4 PolarHBondContact O-N 2.85Å; M1-E4 VanDerWaalsContact O-N 3.11Å; M1-M5 HydrophobicContact CG-SD 3.95Å; M1-M5 WeakPolarHBondContact O-CG 3.31Å; M1-M5 PolarHBondContact O-N 3.11Å; M1-M5 HydrophobicContact SD-SD 4.49Å; M1-K127 HydrophobicContact CE-CB 3.75Å; M1-Y128 WeakPolarHBondContact CA-OH 3.31Å; M1-Y128 HydrophobicContact CB-CE1 4.37Å; M1-Y128 HydrophobicContact CG-CD1 3.86Å; M1-Y128 HydrophobicContact CG-CE1 3.36Å; M1-Y128 HydrophobicContact CG-CE2 4.47Å; M1-Y128 HydrophobicContact SD-CD1 4.43Å; M1-Y128 HydrophobicContact SD-CE1 4.47Å; M1-L131 HydrophobicContact CE-CD2 4.41Å; M1-L131 HydrophobicContact SD-CB 4.38Å; M1-L131 HydrophobicContact SD-CD2 4.42Å; M1-L131 HydrophobicContact SD-CG 4.34Å
2	F	93.1	Very high	95.2	Very high	35 Å²	35	71.9 Å²	71.9	15%	0.154	35%	0.354	C	S	.	.	H	α-helix	trans	-54	-50.2	-178	179.1	-119	0	0	0	113.9	E4 M5 K6 I34 V36 I106 I135 I139	F2-E4 VanDerWaalsContact C-N 3.28Å; F2-E4 PolarHBondContact O-N 3.02Å; F2-M5 WeakPolarHBondContact O-CB 2.88Å; F2-M5 PolarHBondContact O-N 2.76Å; F2-M5 VanDerWaalsContact O-N 3.11Å; F2-K6 HydrophobicContact CD1-CD 4.05Å; F2-K6 HydrophobicContact CE1-CD 3.5Å; F2-K6 VanDerWaalsContact CE1-CD 3.5Å; F2-K6 HydrophobicContact CE1-CG 4.38Å; F2-K6 HydrophobicContact CE2-CD 4.09Å; F2-K6 HydrophobicContact CE2-CG 4.16Å; F2-K6 HydrophobicContact CZ-CD 3.53Å; F2-K6 HydrophobicContact CZ-CG 4.1Å; F2-K6 PolarHBondContact O-N 3.48Å; F2-I34 HydrophobicContact CE2-CG2 4.11Å; F2-I34 HydrophobicContact CZ-CB 4.38Å; F2-I34 HydrophobicContact CZ-CG2 3.76Å; F2-V36 HydrophobicContact CD1-CB 4.32Å; F2-V36 HydrophobicContact CD1-CG2 3.93Å; F2-V36 HydrophobicContact CD2-CG2 3.53Å; F2-V36 HydrophobicContact CE1-CB 4.28Å; F2-V36 HydrophobicContact CE1-CG2 3.83Å; F2-V36 HydrophobicContact CE2-CG2 3.42Å; F2-V36 VanDerWaalsContact CE2-CG2 3.42Å; F2-V36 HydrophobicContact CG-CB 4.49Å; F2-V36 HydrophobicContact CG-CG2 3.77Å; F2-V36 HydrophobicContact CZ-CB 4.43Å; F2-V36 HydrophobicContact CZ-CG2 3.57Å; F2-I106 HydrophobicContact CE2-CD1 4.19Å; F2-I135 HydrophobicContact CD2-CG2 3.71Å; F2-I135 HydrophobicContact CE2-CG2 4.19Å; F2-I139 HydrophobicContact CD2-CD1 3.98Å; F2-I139 HydrophobicContact CE2-CD1 3.69Å; F2-I139 HydrophobicContact CE2-CG1 4.07Å
3	D	94.9	Very high	95.2	Very high	122 Å²	122	66.8 Å²	66.8	65%	0.652	33%	0.329	S	S	*	.	H	α-helix	trans	-62.2	-36.4	178.6	-61.4	-35.4	0	0	0	113	M1 K6 R7	M1-D3 PolarHBondContact O-N 2.87Å; D3-K6 PolarHBondContact O-N 3.17Å; D3-R7 WeakPolarHBondContact O-CB 3.3Å; D3-R7 PolarHBondContact O-N 3.11Å
4	E	94.8	Very high	95.2	Very high	74 Å²	74	65.9 Å²	65.9	35%	0.346	33%	0.333	S	S	.	.	H	α-helix	trans	-66.2	-40.8	176.1	174.6	160	-143.9	0	0	111.3	M1 F2 R7 K8 Y128	M1-E4 WeakPolarHBondContact O-CB 3.36Å; M1-E4 PolarHBondContact O-N 2.85Å; M1-E4 VanDerWaalsContact O-N 3.11Å; F2-E4 VanDerWaalsContact C-N 3.28Å; F2-E4 PolarHBondContact O-N 3.02Å; E4-R7 PolarHBondContact O-N 2.92Å; E4-R7 IonicContact OE1-NH2 3.23Å; E4-R7 PolarHBondContact OE1-NH2 2.98Å; E4-R7 VanDerWaalsContact OE1-NH2 3.16Å; E4-K8 HydrophobicContact CG-CG 4.46Å; E4-K8 WeakPolarHBondContact O-CB 3.49Å; E4-K8 VanDerWaalsContact O-CG 3.31Å; E4-K8 WeakPolarHBondContact O-CG 3.46Å; E4-K8 PolarHBondContact O-N 3.04Å; E4-Y128 PolarHBondContact OE2-OH 3.02Å
5	M	95.4	Very high	95.2	Very high	27 Å²	27	72.1 Å²	72.1	13%	0.133	36%	0.36	C	S	.	.	H	α-helix	trans	-63.4	-45.5	174.7	-65.5	166.2	62.4	0	0	111.5	M1 F2 R7 K8 L9 Y128 G132 I135 G136 I139	M1-M5 HydrophobicContact CG-SD 3.95Å; M1-M5 WeakPolarHBondContact O-CG 3.31Å; M1-M5 PolarHBondContact O-N 3.11Å; M1-M5 HydrophobicContact SD-SD 4.49Å; F2-M5 WeakPolarHBondContact O-CB 2.88Å; F2-M5 PolarHBondContact O-N 2.76Å; F2-M5 VanDerWaalsContact O-N 3.11Å; M5-R7 VanDerWaalsContact C-N 3.35Å; M5-R7 PolarHBondContact O-N 3.34Å; M5-K8 PolarHBondContact O-N 2.99Å; M5-L9 WeakPolarHBondContact O-CB 2.95Å; M5-L9 PolarHBondContact O-N 3.18Å; M5-Y128 HydrophobicContact CG-CE1 4.03Å; M5-Y128 HydrophobicContact SD-CE1 4.47Å; M5-G132 WeakPolarHBondContact CE-O 3.39Å; M5-I135 HydrophobicContact CE-CB 4.02Å; M5-I135 HydrophobicContact CE-CG2 3.93Å; M5-I135 HydrophobicContact SD-CG2 4.34Å; M5-G136 VanDerWaalsContact CE-N 3.28Å; M5-I139 HydrophobicContact CB-CD1 4.39Å; M5-I139 HydrophobicContact CE-CD1 4.14Å
6	K	95.9	Very high	94.9	Very high	35 Å²	35	68.5 Å²	68.5	15%	0.152	34%	0.341	C	S	.	.	H	α-helix	trans	-55.8	-50.4	174.2	-73.8	-179.6	61.4	163.2	0	110.8	F2 D3 K8 L9 T10 V31 S32 I34	F2-K6 HydrophobicContact CD1-CD 4.05Å; F2-K6 HydrophobicContact CE1-CD 3.5Å; F2-K6 VanDerWaalsContact CE1-CD 3.5Å; F2-K6 HydrophobicContact CE1-CG 4.38Å; F2-K6 HydrophobicContact CE2-CD 4.09Å; F2-K6 HydrophobicContact CE2-CG 4.16Å; F2-K6 HydrophobicContact CZ-CD 3.53Å; F2-K6 HydrophobicContact CZ-CG 4.1Å; F2-K6 PolarHBondContact O-N 3.48Å; D3-K6 PolarHBondContact O-N 3.17Å; K6-K8 PolarHBondContact O-N 3.31Å; K6-L9 PolarHBondContact O-N 3.06Å; K6-T10 PolarHBondContact O-N 2.03Å; K6-T10 PolarHBondContact O-OG1 2.97Å; K6-T10 VanDerWaalsContact O-OG1 3.1Å; K6-V31 HydrophobicContact CB-CG1 4.07Å; K6-V31 WeakPolarHBondContact CE-O 3.32Å; K6-V31 HydrophobicContact CG-CG1 4.18Å; K6-V31 PolarHBondContact NZ-O 3.42Å; K6-S32 PolarHBondContact NZ-O 2.9Å; K6-I34 PolarHBondContact NZ-O 3.07Å
7	R	96.8	Very high	94.6	Very high	157 Å²	157	71.3 Å²	71.3	59%	0.592	37%	0.369	S	S	*	.	H	α-helix	trans	-57.7	-46.3	178.3	-179.6	-177.4	64.6	-178.9	-0.5	112.1	D3 E4 M5 T10 G11	D3-R7 WeakPolarHBondContact O-CB 3.3Å; D3-R7 PolarHBondContact O-N 3.11Å; E4-R7 PolarHBondContact O-N 2.92Å; E4-R7 IonicContact OE1-NH2 3.23Å; E4-R7 PolarHBondContact OE1-NH2 2.98Å; E4-R7 VanDerWaalsContact OE1-NH2 3.16Å; M5-R7 VanDerWaalsContact C-N 3.35Å; M5-R7 PolarHBondContact O-N 3.34Å; R7-T10 PolarHBondContact O-N 3.17Å; R7-G11 PolarHBondContact O-N 3.42Å; R7-G11 VanDerWaalsContact O-N 3.12Å
8	K	96.4	Very high	94.3	Very high	130 Å²	130	71.2 Å²	71.2	57%	0.565	36%	0.363	S	S	*	.	H	α-helix	trans	-65.6	-44	179.6	-72.8	-66	-174.3	179.8	0	111.8	E4 M5 K6 T10 G11 L12	E4-K8 HydrophobicContact CG-CG 4.46Å; E4-K8 WeakPolarHBondContact O-CB 3.49Å; E4-K8 VanDerWaalsContact O-CG 3.31Å; E4-K8 WeakPolarHBondContact O-CG 3.46Å; E4-K8 PolarHBondContact O-N 3.04Å; M5-K8 PolarHBondContact O-N 2.99Å; K6-K8 PolarHBondContact O-N 3.31Å; K8-T10 PolarHBondContact O-N 2.82Å; K8-G11 PolarHBondContact O-N 3.33Å; K8-L12 WeakPolarHBondContact O-CG 3.33Å; K8-L12 PolarHBondContact O-N 3.03Å
9	L	96.2	Very high	93.9	Very high	22 Å²	22	68.6 Å²	68.6	12%	0.115	35%	0.352	C	S	.	.	H	α-helix	trans	-62.8	-42.6	176.9	-178.9	59.3	0	0	0	111.7	M5 K6 G11 L12 L13 V31 I139 I140 V143	M5-L9 WeakPolarHBondContact O-CB 2.95Å; M5-L9 PolarHBondContact O-N 3.18Å; K6-L9 PolarHBondContact O-N 3.06Å; L9-G11 VanDerWaalsContact C-N 3.29Å; L9-G11 PolarHBondContact O-N 2.95Å; L9-L12 PolarHBondContact O-N 3.38Å; L9-L12 VanDerWaalsContact O-N 3.14Å; L9-L13 HydrophobicContact CD1-CD1 4.34Å; L9-L13 HydrophobicContact CD1-CG 4.08Å; L9-L13 HydrophobicContact CG-CD1 3.98Å; L9-L13 HydrophobicContact CG-CG 4.21Å; L9-L13 WeakPolarHBondContact O-CB 3.47Å; L9-L13 WeakPolarHBondContact O-CG 3.35Å; L9-L13 PolarHBondContact O-N 3.42Å; L9-V31 HydrophobicContact CD2-CG2 3.71Å; L9-V31 HydrophobicContact CG-CG2 4.16Å; L9-I139 HydrophobicContact CD2-CG2 3.32Å; L9-I140 HydrophobicContact CD1-CD1 3.83Å; L9-I140 HydrophobicContact CD2-CD1 4.05Å; L9-V143 HydrophobicContact CD2-CG2 4.27Å
10	T	96.9	Very high	93.8	Very high	44 Å²	44	69 Å²	69	27%	0.27	36%	0.361	S	S	.	.	H	α-helix	trans	-55	-46.8	173.4	-64.9	0	0	0	0	111.3	K6 R7 K8 L12 L13 S14 I28	K6-T10 PolarHBondContact O-N 2.03Å; K6-T10 PolarHBondContact O-OG1 2.97Å; K6-T10 VanDerWaalsContact O-OG1 3.1Å; R7-T10 PolarHBondContact O-N 3.17Å; K8-T10 PolarHBondContact O-N 2.82Å; T10-L12 VanDerWaalsContact C-N 3.35Å; T10-L12 PolarHBondContact O-N 3.36Å; T10-L13 PolarHBondContact O-N 3.1Å; T10-S14 PolarHBondContact O-N 3.37Å; T10-S14 PolarHBondContact O-OG 3.34Å; T10-S14 VanDerWaalsContact O-OG 3.1Å; T10-I28 HydrophobicContact CG2-CG1 4.27Å; T10-I28 HydrophobicContact CG2-CG2 3.81Å
11	G	97.3	Very high	93.7	Very high	31 Å²	31	70.6 Å²	70.6	32%	0.32	37%	0.367	S	S	.	.	H	α-helix	trans	-59.1	-42.7	176.2	0	0	0	0	0	113.3	R7 K8 L9 S14 Q15	R7-G11 PolarHBondContact O-N 3.42Å; R7-G11 VanDerWaalsContact O-N 3.12Å; K8-G11 PolarHBondContact O-N 3.33Å; L9-G11 VanDerWaalsContact C-N 3.29Å; L9-G11 PolarHBondContact O-N 2.95Å; G11-S14 PolarHBondContact O-N 3.46Å; G11-Q15 WeakPolarHBondContact O-CG 3.46Å; G11-Q15 PolarHBondContact O-N 3.14Å
12	L	96.3	Very high	93.9	Very high	114 Å²	114	73.5 Å²	73.5	60%	0.597	38%	0.383	S	S	*	.	H	α-helix	trans	-66.4	-41.8	177.2	-67.8	170.7	0	0	0	112.2	K8 L9 T10 S14 Q15 R16	K8-L12 WeakPolarHBondContact O-CG 3.33Å; K8-L12 PolarHBondContact O-N 3.03Å; L9-L12 PolarHBondContact O-N 3.38Å; L9-L12 VanDerWaalsContact O-N 3.14Å; T10-L12 VanDerWaalsContact C-N 3.35Å; T10-L12 PolarHBondContact O-N 3.36Å; L12-S14 VanDerWaalsContact C-N 3.34Å; L12-S14 PolarHBondContact O-N 3.18Å; L12-Q15 PolarHBondContact O-N 3.47Å; L12-R16 PolarHBondContact O-N 2.91Å
13	L	95.2	Very high	93.8	Very high	5 Å²	5	73.3 Å²	73.3	3%	0.026	38%	0.384	C	S	.	.	H	α-helix	trans	-64.1	-38.1	178.4	-72.7	173.4	0	0	0	111.9	L9 T10 Q15 R16 K24 K27 I28 V31 V143 F144	L9-L13 HydrophobicContact CD1-CD1 4.34Å; L9-L13 HydrophobicContact CD1-CG 4.08Å; L9-L13 HydrophobicContact CG-CD1 3.98Å; L9-L13 HydrophobicContact CG-CG 4.21Å; L9-L13 WeakPolarHBondContact O-CB 3.47Å; L9-L13 WeakPolarHBondContact O-CG 3.35Å; L9-L13 PolarHBondContact O-N 3.42Å; T10-L13 PolarHBondContact O-N 3.1Å; L13-Q15 VanDerWaalsContact C-N 3.28Å; L13-Q15 PolarHBondContact O-N 3.3Å; L13-R16 WeakPolarHBondContact O-CG 3.49Å; L13-K24 WeakPolarHBondContact O-CG 3.38Å; L13-K27 HydrophobicContact CD1-CB 4.1Å; L13-K27 HydrophobicContact CD2-CB 4.35Å; L13-I28 HydrophobicContact CB-CD1 4.31Å; L13-I28 HydrophobicContact CB-CG1 3.82Å; L13-I28 HydrophobicContact CD1-CG1 4.19Å; L13-V31 HydrophobicContact CD1-CG2 3.71Å; L13-V143 HydrophobicContact CD1-CG1 4.33Å; L13-F144 HydrophobicContact CD2-CE2 4.48Å; L13-F144 HydrophobicContact CD2-CZ 3.81Å
14	S	95.4	Very high	93.7	Very high	55 Å²	55	68.8 Å²	68.8	39%	0.385	36%	0.359	S	S	.	.	H	α-helix	trans	-63.1	-36	175.8	-59	0	0	0	0	112.3	T10 G11 L12 K24 I28	T10-S14 PolarHBondContact O-N 3.37Å; T10-S14 PolarHBondContact O-OG 3.34Å; T10-S14 VanDerWaalsContact O-OG 3.1Å; G11-S14 PolarHBondContact O-N 3.46Å; L12-S14 VanDerWaalsContact C-N 3.34Å; L12-S14 PolarHBondContact O-N 3.18Å; S14-K24 PolarHBondContact O-NZ 3.29Å; S14-K24 VanDerWaalsContact O-NZ 3.16Å; S14-I28 WeakPolarHBondContact OG-CD1 3.28Å
15	Q	94.7	Very high	93.8	Very high	159 Å²	159	70 Å²	70	74%	0.743	36%	0.364	S	S	*	.	H	α-helix	trans	-87.1	-11.4	-174.3	-67.3	176.9	3.5	0	0	114.3	G11 L12 L13 S17	G11-Q15 WeakPolarHBondContact O-CG 3.46Å; G11-Q15 PolarHBondContact O-N 3.14Å; L12-Q15 PolarHBondContact O-N 3.47Å; L13-Q15 VanDerWaalsContact C-N 3.28Å; L13-Q15 PolarHBondContact O-N 3.3Å; Q15-S17 PolarHBondContact O-N 3.45Å
16	R	89.8	Confident	93.7	Very high	14 Å²	14	74.1 Å²	74.1	5%	0.053	38%	0.381	C	S	.	.			trans	-63.2	135.7	-174.8	78.3	-173.1	163.3	146.8	6	112.1	L12 L13 W18 S19 D23 K24	L12-R16 PolarHBondContact O-N 2.91Å; L13-R16 WeakPolarHBondContact O-CG 3.49Å; R16-W18 HydrophobicContact CB-CZ2 4.32Å; R16-W18 VanDerWaalsContact NH1-CZ3 3.35Å; R16-S19 VanDerWaalsContact CD-OG 3.31Å; R16-S19 WeakPolarHBondContact CD-OG 3.48Å; R16-S19 VanDerWaalsContact NE-CB 3.26Å; R16-S19 PolarHBondContact NE-OG 3.13Å; R16-S19 VanDerWaalsContact NE-OG 3.13Å; R16-S19 PolarHBondContact NH1-OG 3.1Å; R16-S19 VanDerWaalsContact NH2-CB 3.35Å; R16-D23 IonicContact CZ-OD2 2.63Å; R16-D23 VanDerWaalsContact CZ-OD2 3.23Å; R16-D23 IonicContact NH1-OD2 3.59Å; R16-D23 PolarHBondContact NH1-OD2 3.19Å; R16-D23 VanDerWaalsContact NH2-CG 3.26Å; R16-D23 PolarHBondContact NH2-O 3.24Å; R16-D23 IonicContact NH2-OD2 3Å; R16-D23 PolarHBondContact NH2-OD2 3.31Å; R16-K24 HydrophobicContact CG-CG 4.18Å; R16-K24 VanDerWaalsContact NH2-CA 3.26Å; R16-K24 WeakPolarHBondContact O-CE 3.39Å; R16-K24 PolarHBondContact O-NZ 2.95Å; R16-K24 VanDerWaalsContact O-NZ 3.07Å
17	S	90.4	Very high	93.5	Very high	116 Å²	116	72.5 Å²	72.5	81%	0.811	38%	0.375	S	S	*	.	S	Bend	trans	-87.4	-23.1	-179.3	53.6	0	0	0	0	113.8	Q15 S19	Q15-S17 PolarHBondContact O-N 3.45Å; S17-S19 VanDerWaalsContact C-N 3.3Å; S17-S19 PolarHBondContact O-N 3.46Å
18	W	88.5	Confident	93.5	Very high	69 Å²	69	66.2 Å²	66.2	26%	0.261	35%	0.352	S	S	.	.	S	Bend	trans	-90.7	28.4	-173.5	48.1	-96.5	0	0	0	113.5	R16 F144 P166 F167 Q170	R16-W18 HydrophobicContact CB-CZ2 4.32Å; R16-W18 VanDerWaalsContact NH1-CZ3 3.35Å; W18-F144 AromaticContact CH2-CE1 3.75Å; W18-F144 HydrophobicContact CH2-CE1 3.75Å; W18-F144 AromaticContact CH2-CZ 4Å; W18-F144 HydrophobicContact CH2-CZ 4Å; W18-F144 HydrophobicContact CZ3-CE1 4.15Å; W18-P166 HydrophobicContact CB-CB 4.06Å; W18-P166 WeakPolarHBondContact O-CB 3.39Å; W18-F167 HydrophobicContact CE3-CB 4.19Å; W18-F167 AromaticContact CE3-CD2 3.75Å; W18-F167 HydrophobicContact CE3-CD2 3.75Å; W18-F167 HydrophobicContact CE3-CG 4.44Å; W18-F167 AromaticContact CH2-CD2 3.94Å; W18-F167 HydrophobicContact CH2-CD2 3.94Å; W18-F167 HydrophobicContact CH2-CE2 4.11Å; W18-F167 HydrophobicContact CZ3-CB 4.33Å; W18-F167 AromaticContact CZ3-CD2 3.2Å; W18-F167 HydrophobicContact CZ3-CD2 3.2Å; W18-F167 AromaticContact CZ3-CE2 3.8Å; W18-F167 HydrophobicContact CZ3-CE2 3.8Å; W18-F167 HydrophobicContact CZ3-CG 4.12Å; W18-Q170 HydrophobicContact CB-CG 4.3Å; W18-Q170 HydrophobicContact CD2-CG 3.88Å; W18-Q170 HydrophobicContact CE3-CG 4.29Å; W18-Q170 HydrophobicContact CG-CG 3.86Å
19	S	87.7	Confident	93.4	Very high	23 Å²	23	62.5 Å²	62.5	16%	0.161	34%	0.343	C	S	.	.	S	Bend	trans	-151.3	147.9	179.5	-53.3	0	0	0	0	112.6	R16 S17	R16-S19 VanDerWaalsContact CD-OG 3.31Å; R16-S19 WeakPolarHBondContact CD-OG 3.48Å; R16-S19 VanDerWaalsContact NE-CB 3.26Å; R16-S19 PolarHBondContact NE-OG 3.13Å; R16-S19 VanDerWaalsContact NE-OG 3.13Å; R16-S19 PolarHBondContact NH1-OG 3.1Å; R16-S19 VanDerWaalsContact NH2-CB 3.35Å; S17-S19 VanDerWaalsContact C-N 3.3Å; S17-S19 PolarHBondContact O-N 3.46Å
20	S	90.7	Very high	93.3	Very high	75 Å²	75	63.2 Å²	63.2	52%	0.524	35%	0.348	S	S	.	.			trans	-64.7	157.1	172.6	64.7	0	0	0	0	111.2	D22 D23 K24	S20-D22 VanDerWaalsContact C-N 3.28Å; S20-D22 PolarHBondContact O-N 3.43Å; S20-D23 PolarHBondContact O-N 3.05Å; S20-D23 WeakPolarHBondContact OG-CB 3.48Å; S20-D23 PolarHBondContact OG-N 3.35Å; S20-K24 WeakPolarHBondContact O-CG 3.47Å; S20-K24 PolarHBondContact O-N 3.35Å
21	E	93.4	Very high	93.2	Very high	103 Å²	103	61.1 Å²	61.1	48%	0.481	34%	0.335	S	S	.	.	H	α-helix	trans	-61.5	-39.8	177.8	-165	55.2	-140.8	0	0	111.3	D23 K24 Q25	E21-D23 PolarHBondContact O-N 2.9Å; E21-K24 WeakPolarHBondContact O-CB 3.38Å; E21-K24 PolarHBondContact O-N 3.01Å; E21-K24 VanDerWaalsContact O-N 3.13Å; E21-K24 WeakPolarHBondContact OE2-CD 3.45Å; E21-K24 IonicContact OE2-NZ 3.37Å; E21-Q25 WeakPolarHBondContact O-CG 2.92Å; E21-Q25 PolarHBondContact O-N 3.47Å; E21-Q25 PolarHBondContact OE1-NE2 3.29Å
22	D	92.2	Very high	93.1	Very high	133 Å²	133	63.1 Å²	63.1	71%	0.711	34%	0.344	S	S	*	.	H	α-helix	trans	-59.8	-43.9	175.4	-65	-23	0	0	0	112.5	S20 K24 Q25 K26	S20-D22 VanDerWaalsContact C-N 3.28Å; S20-D22 PolarHBondContact O-N 3.43Å; D22-K24 VanDerWaalsContact C-N 3.34Å; D22-Q25 PolarHBondContact O-N 3.05Å; D22-K26 WeakPolarHBondContact O-CB 3.43Å; D22-K26 PolarHBondContact O-N 3.49Å
23	D	90.3	Very high	92.9	Very high	31 Å²	31	64.6 Å²	64.6	17%	0.166	35%	0.346	C	S	.	.	H	α-helix	trans	-65.5	-40.6	176.2	-172.6	51.9	0	0	0	110.1	R16 S20 E21 Q25 K26 K27	R16-D23 IonicContact CZ-OD2 2.63Å; R16-D23 VanDerWaalsContact CZ-OD2 3.23Å; R16-D23 IonicContact NH1-OD2 3.59Å; R16-D23 PolarHBondContact NH1-OD2 3.19Å; R16-D23 VanDerWaalsContact NH2-CG 3.26Å; R16-D23 PolarHBondContact NH2-O 3.24Å; R16-D23 IonicContact NH2-OD2 3Å; R16-D23 PolarHBondContact NH2-OD2 3.31Å; S20-D23 PolarHBondContact O-N 3.05Å; S20-D23 WeakPolarHBondContact OG-CB 3.48Å; S20-D23 PolarHBondContact OG-N 3.35Å; E21-D23 PolarHBondContact O-N 2.9Å; D23-Q25 PolarHBondContact O-N 3.03Å; D23-K26 PolarHBondContact O-N 3.25Å; D23-K27 WeakPolarHBondContact O-CB 3.35Å; D23-K27 WeakPolarHBondContact O-CG 3.47Å; D23-K27 PolarHBondContact O-N 3.4Å; D23-K27 WeakPolarHBondContact OD1-CE 3.42Å
24	K	94.1	Very high	92.9	Very high	27 Å²	27	64.4 Å²	64.4	12%	0.117	35%	0.345	C	S	.	.	H	α-helix	trans	-57.4	-49.6	175	-67	175.2	-173.1	-176.7	0	111.3	L13 S14 R16 S20 E21 D22 K26 K27 I28	L13-K24 WeakPolarHBondContact O-CG 3.38Å; S14-K24 PolarHBondContact O-NZ 3.29Å; S14-K24 VanDerWaalsContact O-NZ 3.16Å; R16-K24 HydrophobicContact CG-CG 4.18Å; R16-K24 VanDerWaalsContact NH2-CA 3.26Å; R16-K24 WeakPolarHBondContact O-CE 3.39Å; R16-K24 PolarHBondContact O-NZ 2.95Å; R16-K24 VanDerWaalsContact O-NZ 3.07Å; S20-K24 WeakPolarHBondContact O-CG 3.47Å; S20-K24 PolarHBondContact O-N 3.35Å; E21-K24 WeakPolarHBondContact O-CB 3.38Å; E21-K24 PolarHBondContact O-N 3.01Å; E21-K24 VanDerWaalsContact O-N 3.13Å; E21-K24 WeakPolarHBondContact OE2-CD 3.45Å; E21-K24 IonicContact OE2-NZ 3.37Å; D22-K24 VanDerWaalsContact C-N 3.34Å; K24-K26 PolarHBondContact O-N 3.26Å; K24-K27 PolarHBondContact O-N 2.95Å; K24-I28 WeakPolarHBondContact O-CB 3.35Å; K24-I28 WeakPolarHBondContact O-CD1 3.45Å; K24-I28 VanDerWaalsContact O-CG1 3.22Å; K24-I28 WeakPolarHBondContact O-CG1 3.49Å; K24-I28 PolarHBondContact O-N 3.26Å
25	Q	95.1	Very high	92.8	Very high	100 Å²	100	64 Å²	64	47%	0.467	34%	0.342	S	S	.	.	H	α-helix	trans	-64.3	-40.6	-179.6	-63.8	-54.4	-32.5	0	0	111.8	E21 D22 D23 K27 I28 S29	E21-Q25 WeakPolarHBondContact O-CG 2.92Å; E21-Q25 PolarHBondContact O-N 3.47Å; E21-Q25 PolarHBondContact OE1-NE2 3.29Å; D22-Q25 PolarHBondContact O-N 3.05Å; D23-Q25 PolarHBondContact O-N 3.03Å; Q25-K27 PolarHBondContact O-N 3.05Å; Q25-I28 PolarHBondContact O-N 3.3Å; Q25-S29 VanDerWaalsContact O-CB 3.28Å; Q25-S29 WeakPolarHBondContact O-CB 3.31Å; Q25-S29 PolarHBondContact O-N 3.13Å
26	K	93.5	Very high	92.6	Very high	113 Å²	113	58.7 Å²	58.7	49%	0.491	32%	0.321	S	S	.	.	H	α-helix	trans	-58.6	-48.2	173.7	-174.2	-173.4	177.1	-162.4	0	111.3	D22 D23 K24 S29 T30 D146	D22-K26 WeakPolarHBondContact O-CB 3.43Å; D22-K26 PolarHBondContact O-N 3.49Å; D23-K26 PolarHBondContact O-N 3.25Å; K24-K26 PolarHBondContact O-N 3.26Å; K26-S29 PolarHBondContact O-N 2.82Å; K26-T30 PolarHBondContact O-N 2.9Å; K26-T30 PolarHBondContact O-OG1 3.37Å; K26-D146 IonicContact NZ-OD2 3.16Å; K26-D146 PolarHBondContact NZ-OD2 2.9Å
27	K	93	Very high	92.5	Very high	2 Å²	2	60.8 Å²	60.8	1%	0.009	34%	0.337	C	S	.	.	H	α-helix	trans	-68	-40.6	-178.9	-63	-58.8	177.2	-173.7	0	112	L13 D23 K24 Q25 T30 V31 V143 D146	L13-K27 HydrophobicContact CD1-CB 4.1Å; L13-K27 HydrophobicContact CD2-CB 4.35Å; D23-K27 WeakPolarHBondContact O-CB 3.35Å; D23-K27 WeakPolarHBondContact O-CG 3.47Å; D23-K27 PolarHBondContact O-N 3.4Å; D23-K27 WeakPolarHBondContact OD1-CE 3.42Å; K24-K27 PolarHBondContact O-N 2.95Å; Q25-K27 PolarHBondContact O-N 3.05Å; K27-T30 WeakPolarHBondContact O-CB 3.08Å; K27-T30 PolarHBondContact O-N 2.63Å; K27-T30 VanDerWaalsContact O-N 3.14Å; K27-V31 WeakPolarHBondContact O-CG2 3.1Å; K27-V31 PolarHBondContact O-N 3.42Å; K27-V143 HydrophobicContact CB-CG1 3.94Å; K27-V143 HydrophobicContact CD-CG1 3.82Å; K27-V143 WeakPolarHBondContact CD-O 3.3Å; K27-V143 VanDerWaalsContact CE-O 3.32Å; K27-V143 WeakPolarHBondContact CE-O 3.22Å; K27-V143 HydrophobicContact CG-CG1 4.23Å; K27-V143 PolarHBondContact NZ-O 2.82Å; K27-D146 IonicContact NZ-OD2 2.95Å; K27-D146 PolarHBondContact NZ-OD2 3.44Å
28	I	95.9	Very high	92.2	Very high	25 Å²	25	58.8 Å²	58.8	13%	0.128	32%	0.316	C	S	.	.	H	α-helix	trans	-62.5	-43.1	173.9	-70.1	165.4	0	0	0	111.2	T10 L13 S14 K24 Q25 T30 V31 S32	T10-I28 HydrophobicContact CG2-CG1 4.27Å; T10-I28 HydrophobicContact CG2-CG2 3.81Å; L13-I28 HydrophobicContact CB-CD1 4.31Å; L13-I28 HydrophobicContact CB-CG1 3.82Å; L13-I28 HydrophobicContact CD1-CG1 4.19Å; S14-I28 WeakPolarHBondContact OG-CD1 3.28Å; K24-I28 WeakPolarHBondContact O-CB 3.35Å; K24-I28 WeakPolarHBondContact O-CD1 3.45Å; K24-I28 VanDerWaalsContact O-CG1 3.22Å; K24-I28 WeakPolarHBondContact O-CG1 3.49Å; K24-I28 PolarHBondContact O-N 3.26Å; Q25-I28 PolarHBondContact O-N 3.3Å; I28-T30 VanDerWaalsContact C-N 3.25Å; I28-T30 PolarHBondContact O-N 3Å; I28-V31 PolarHBondContact O-N 3.24Å; I28-S32 PolarHBondContact O-N 3.44Å
29	S	94.8	Very high	91.8	Very high	51 Å²	51	56 Å²	56	36%	0.357	31%	0.307	S	S	.	.	H	α-helix	trans	-63.2	-32.6	173.8	-173.7	0	0	0	0	112.3	Q25 K26 S32 K33	Q25-S29 VanDerWaalsContact O-CB 3.28Å; Q25-S29 WeakPolarHBondContact O-CB 3.31Å; Q25-S29 PolarHBondContact O-N 3.13Å; K26-S29 PolarHBondContact O-N 2.82Å; S29-S32 PolarHBondContact O-OG 2.89Å; S29-K33 WeakPolarHBondContact O-CG 3.39Å
30	T	93.7	Very high	91.2	Very high	38 Å²	38	57.7 Å²	57.7	23%	0.233	31%	0.314	C	S	.	.	H	α-helix	trans	-67.1	-49.9	173.4	-53.9	0	0	0	0	110	K26 K27 I28 S32 K33 I34 I142	K26-T30 PolarHBondContact O-N 2.9Å; K26-T30 PolarHBondContact O-OG1 3.37Å; K27-T30 WeakPolarHBondContact O-CB 3.08Å; K27-T30 PolarHBondContact O-N 2.63Å; K27-T30 VanDerWaalsContact O-N 3.14Å; I28-T30 VanDerWaalsContact C-N 3.25Å; I28-T30 PolarHBondContact O-N 3Å; T30-S32 VanDerWaalsContact C-N 3.27Å; T30-S32 PolarHBondContact O-N 3.25Å; T30-K33 PolarHBondContact O-N 3.13Å; T30-K33 VanDerWaalsContact O-N 3.12Å; T30-I34 WeakPolarHBondContact O-CG1 3.18Å; T30-I34 PolarHBondContact O-N 3.13Å; T30-I142 HydrophobicContact CG2-CG2 4Å
31	V	95.1	Very high	90.1	Very high	0 Å²	0	58.9 Å²	58.9	0%	0	32%	0.322	C	S	.	.	H	α-helix	trans	-53.8	-43.6	177.1	173.7	0	0	0	0	111.6	K6 L9 L13 K27 I28 K33 I34 V143	K6-V31 HydrophobicContact CB-CG1 4.07Å; K6-V31 WeakPolarHBondContact CE-O 3.32Å; K6-V31 HydrophobicContact CG-CG1 4.18Å; K6-V31 PolarHBondContact NZ-O 3.42Å; L9-V31 HydrophobicContact CD2-CG2 3.71Å; L9-V31 HydrophobicContact CG-CG2 4.16Å; L13-V31 HydrophobicContact CD1-CG2 3.71Å; K27-V31 WeakPolarHBondContact O-CG2 3.1Å; K27-V31 PolarHBondContact O-N 3.42Å; I28-V31 PolarHBondContact O-N 3.24Å; V31-K33 PolarHBondContact O-N 2.99Å; V31-I34 PolarHBondContact O-N 3.3Å; V31-V143 HydrophobicContact CG2-CG2 3.4Å; V31-V143 VanDerWaalsContact CG2-CG2 3.4Å
32	S	94.3	Very high	88.8	Confident	73 Å²	73	60.7 Å²	60.7	51%	0.51	33%	0.331	S	S	.	.	H	α-helix	trans	-62.5	-31.1	-176.7	69.7	0	0	0	0	113.1	K6 I28 S29 T30	K6-S32 PolarHBondContact NZ-O 2.9Å; I28-S32 PolarHBondContact O-N 3.44Å; S29-S32 PolarHBondContact O-OG 2.89Å; T30-S32 VanDerWaalsContact C-N 3.27Å; T30-S32 PolarHBondContact O-N 3.25Å
33	K	93.6	Very high	87.6	Confident	144 Å²	144	56.7 Å²	56.7	63%	0.626	31%	0.313	S	S	*	.	H	α-helix	trans	-80.5	-21.1	-179.7	-66.3	171.4	-174.9	175.8	0	114.3	S29 T30 V31 S35	S29-K33 WeakPolarHBondContact O-CG 3.39Å; T30-K33 PolarHBondContact O-N 3.13Å; T30-K33 VanDerWaalsContact O-N 3.12Å; V31-K33 PolarHBondContact O-N 2.99Å; K33-S35 PolarHBondContact O-N 2.87Å
34	I	94.3	Very high	86.2	Confident	2 Å²	2	56.7 Å²	56.7	1%	0.01	31%	0.313	C	S	.	.			trans	-60.3	131.4	179.8	-58.8	176.3	0	0	0	109.5	F2 K6 T30 V31 G104 I106 I139 I142 V143	F2-I34 HydrophobicContact CE2-CG2 4.11Å; F2-I34 HydrophobicContact CZ-CB 4.38Å; F2-I34 HydrophobicContact CZ-CG2 3.76Å; K6-I34 PolarHBondContact NZ-O 3.07Å; T30-I34 WeakPolarHBondContact O-CG1 3.18Å; T30-I34 PolarHBondContact O-N 3.13Å; V31-I34 PolarHBondContact O-N 3.3Å; I34-G104 WeakPolarHBondContact CA-O 3.22Å; I34-G104 WeakPolarHBondContact CG2-O 3.18Å; I34-I106 HydrophobicContact CG2-CD1 3.61Å; I34-I106 HydrophobicContact CG2-CG1 3.99Å; I34-I139 HydrophobicContact CD1-CB 4.41Å; I34-I139 HydrophobicContact CD1-CG2 3.85Å; I34-I139 HydrophobicContact CG2-CG1 4.41Å; I34-I142 HydrophobicContact CD1-CB 4.05Å; I34-I142 HydrophobicContact CD1-CD1 4.22Å; I34-I142 HydrophobicContact CD1-CG2 3.88Å; I34-I142 HydrophobicContact CG1-CD1 4.33Å; I34-I142 HydrophobicContact CG1-CG2 4Å; I34-I142 HydrophobicContact CG2-CD1 4.09Å; I34-V143 HydrophobicContact CD1-CG2 4.1Å
35	S	94.1	Very high	84.4	Confident	46 Å²	46	58.5 Å²	58.5	32%	0.322	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	163.7	176.3	66.6	0	0	0	0	110.2	K33 G104 T105 I106	K33-S35 PolarHBondContact O-N 2.87Å; S35-G104 PolarHBondContact N-O 3.25Å; S35-T105 WeakPolarHBondContact OG-CA 3.43Å; S35-T105 WeakPolarHBondContact OG-CG2 3.36Å; S35-T105 PolarHBondContact OG-OG1 3.3Å; S35-I106 PolarHBondContact O-N 3.04Å
36	V	90.6	Very high	82.4	Confident	48 Å²	48	61.9 Å²	61.9	29%	0.291	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	133.4	170.7	166.7	0	0	0	0	108.4	F2 I106 M108	F2-V36 HydrophobicContact CD1-CB 4.32Å; F2-V36 HydrophobicContact CD1-CG2 3.93Å; F2-V36 HydrophobicContact CD2-CG2 3.53Å; F2-V36 HydrophobicContact CE1-CB 4.28Å; F2-V36 HydrophobicContact CE1-CG2 3.83Å; F2-V36 HydrophobicContact CE2-CG2 3.42Å; F2-V36 VanDerWaalsContact CE2-CG2 3.42Å; F2-V36 HydrophobicContact CG-CB 4.49Å; F2-V36 HydrophobicContact CG-CG2 3.77Å; F2-V36 HydrophobicContact CZ-CB 4.43Å; F2-V36 HydrophobicContact CZ-CG2 3.57Å; V36-I106 CarbonylContact C-O 3.51Å; V36-I106 VanDerWaalsContact CA-O 3.24Å; V36-I106 WeakPolarHBondContact CA-O 3.16Å; V36-I106 HydrophobicContact CG2-CB 4.03Å; V36-I106 HydrophobicContact CG2-CD1 4.44Å; V36-I106 HydrophobicContact CG2-CG2 4.45Å; V36-M108 HydrophobicContact CG1-CG 4.06Å; V36-M108 HydrophobicContact CG1-SD 3.74Å
37	S	87.9	Confident	80.4	Confident	57 Å²	57	62.6 Å²	62.6	40%	0.399	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	138.4	171.5	-180	0	0	0	0	109.4	I106 V107 M108	S37-I106 PolarHBondContact N-O 3.1Å; S37-V107 WeakPolarHBondContact O-CA 3.47Å; S37-M108 WeakPolarHBondContact O-CG 3.22Å; S37-M108 PolarHBondContact O-N 3.16Å
38	I	84.1	Confident	78.3	Confident	74 Å²	74	68 Å²	68	38%	0.379	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	122.8	178.4	-60.2	165.4	0	0	0	107.2	M108 L113	I38-M108 CarbonylContact C-O 3.01Å; I38-M108 VanDerWaalsContact CA-O 3.28Å; I38-M108 WeakPolarHBondContact CA-O 3.39Å; I38-M108 HydrophobicContact CD1-CE 4.09Å; I38-M108 HydrophobicContact CG1-CE 3.84Å; I38-M108 HydrophobicContact CG1-CG 3.81Å; I38-M108 HydrophobicContact CG1-SD 4.09Å; I38-L113 HydrophobicContact CD1-CD1 4.23Å; I38-L113 HydrophobicContact CG2-CD1 4.24Å
39	I	79.3	Confident	76.1	Confident	11 Å²	11	73.9 Å²	73.9	6%	0.056	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	122.4	169.4	-54.6	172.1	0	0	0	107.7	L44 L89 V107 M108 S110	I39-L44 HydrophobicContact CG2-CD1 4.12Å; I39-L44 HydrophobicContact CG2-CD2 3.85Å; I39-L44 HydrophobicContact CG2-CG 3.8Å; I39-L89 HydrophobicContact CD1-CD2 3.61Å; I39-L89 HydrophobicContact CG1-CD2 4.28Å; I39-V107 HydrophobicContact CD1-CG1 3.43Å; I39-V107 VanDerWaalsContact CD1-CG1 3.43Å; I39-V107 HydrophobicContact CG1-CG1 3.45Å; I39-V107 VanDerWaalsContact CG1-CG1 3.45Å; I39-M108 PolarHBondContact N-O 3.44Å; I39-S110 PolarHBondContact O-N 3.38Å
40	D	74.6	Confident	73.9	Confident	58 Å²	58	77.4 Å²	77.4	31%	0.31	42%	0.416	S	S	.	.			trans	-125.2	-173.4	173.2	62.8	11.5	0	0	0	110.8	E42 S43 L44	D40-E42 VanDerWaalsContact C-N 3.29Å; D40-E42 PolarHBondContact O-N 3.47Å; D40-E42 PolarHBondContact OD1-N 2.87Å; D40-E42 VanDerWaalsContact OD1-N 3.14Å; D40-S43 PolarHBondContact N-OG 3.32Å; D40-S43 PolarHBondContact O-OG 3.3Å; D40-S43 WeakPolarHBondContact OD1-CB 3.49Å; D40-S43 PolarHBondContact OD1-N 3.01Å; D40-S43 PolarHBondContact OD1-OG 3.22Å; D40-L44 WeakPolarHBondContact O-CD1 3.43Å; D40-L44 VanDerWaalsContact O-CG 3.24Å; D40-L44 WeakPolarHBondContact O-CG 3.39Å; D40-L44 PolarHBondContact O-N 3.22Å
41	S	68.2	Low	71.9	Confident	100 Å²	100	79.6 Å²	79.6	70%	0.699	42%	0.42	S	S	*	.	H	α-helix	trans	-65.4	-32.8	178.5	47.7	0	0	0	0	113.2	L44 S45	S41-L44 PolarHBondContact O-N 3.21Å; S41-S45 PolarHBondContact O-N 3.18Å
42	E	67.1	Low	69.9	Low	141 Å²	141	84.3 Å²	84.3	66%	0.659	45%	0.445	S	S	*	.	H	α-helix	trans	-71.6	-48	-175.9	-169.9	170.2	-170.3	0	0	110.7	D40 L44 S45 E46	D40-E42 VanDerWaalsContact C-N 3.29Å; D40-E42 PolarHBondContact O-N 3.47Å; D40-E42 PolarHBondContact OD1-N 2.87Å; D40-E42 VanDerWaalsContact OD1-N 3.14Å; E42-L44 PolarHBondContact O-N 3.41Å; E42-L44 VanDerWaalsContact O-N 3.16Å; E42-S45 WeakPolarHBondContact O-CB 3.37Å; E42-S45 PolarHBondContact O-N 3.01Å; E42-S45 PolarHBondContact O-OG 3.45Å; E42-E46 PolarHBondContact O-N 3.34Å
43	S	65.7	Low	67.9	Low	49 Å²	49	84.3 Å²	84.3	34%	0.343	44%	0.438	S	S	.	.	H	α-helix	trans	-61.4	-21.6	173.5	51.1	0	0	0	0	114.2	D40	D40-S43 PolarHBondContact N-OG 3.32Å; D40-S43 PolarHBondContact O-OG 3.3Å; D40-S43 WeakPolarHBondContact OD1-CB 3.49Å; D40-S43 PolarHBondContact OD1-N 3.01Å; D40-S43 PolarHBondContact OD1-OG 3.22Å
44	L	61.9	Low	65.9	Low	31 Å²	31	79.5 Å²	79.5	16%	0.162	42%	0.419	C	S	.	.	H	α-helix	trans	-83.2	-37	171.8	-65.9	165.4	0	0	0	111.6	I39 D40 S41 E42 E46 K47 Y48	I39-L44 HydrophobicContact CG2-CD1 4.12Å; I39-L44 HydrophobicContact CG2-CD2 3.85Å; I39-L44 HydrophobicContact CG2-CG 3.8Å; D40-L44 WeakPolarHBondContact O-CD1 3.43Å; D40-L44 VanDerWaalsContact O-CG 3.24Å; D40-L44 WeakPolarHBondContact O-CG 3.39Å; D40-L44 PolarHBondContact O-N 3.22Å; S41-L44 PolarHBondContact O-N 3.21Å; E42-L44 PolarHBondContact O-N 3.41Å; E42-L44 VanDerWaalsContact O-N 3.16Å; L44-E46 VanDerWaalsContact C-N 3.32Å; L44-E46 PolarHBondContact O-N 2.88Å; L44-K47 PolarHBondContact O-N 3.24Å; L44-K47 VanDerWaalsContact O-N 3.11Å; L44-Y48 HydrophobicContact CB-CE2 3.94Å; L44-Y48 WeakPolarHBondContact O-CD2 3.42Å
45	S	55.9	Low	64.2	Low	66 Å²	66	84.8 Å²	84.8	46%	0.462	45%	0.447	S	S	.	.	H	α-helix	trans	-58.1	-38.7	-177.1	73.1	0	0	0	0	113.4	S41 E42 K47 Y48	S41-S45 PolarHBondContact O-N 3.18Å; E42-S45 WeakPolarHBondContact O-CB 3.37Å; E42-S45 PolarHBondContact O-N 3.01Å; E42-S45 PolarHBondContact O-OG 3.45Å; S45-K47 PolarHBondContact O-N 3.48Å; S45-Y48 PolarHBondContact O-N 2.95Å
46	E	52.3	Low	62.9	Low	171 Å²	171	89.7 Å²	89.7	80%	0.799	47%	0.465	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.8	-15.4	178.4	-72.3	-173	154.4	0	0	114.5	E42 L44	E42-E46 PolarHBondContact O-N 3.34Å; L44-E46 VanDerWaalsContact C-N 3.32Å; L44-E46 PolarHBondContact O-N 2.88Å
47	K	53	Low	62	Low	128 Å²	128	89.4 Å²	89.4	56%	0.557	46%	0.461	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.5	-0.5	177.8	-84.3	-174.7	176.3	-178.2	0	114.1	L44 S45 D49 L89	L44-K47 PolarHBondContact O-N 3.24Å; L44-K47 VanDerWaalsContact O-N 3.11Å; S45-K47 PolarHBondContact O-N 3.48Å; K47-D49 PolarHBondContact O-N 3.37Å; K47-L89 HydrophobicContact CD-CD1 4.23Å
48	Y	48.3	Very low	61.4	Low	114 Å²	114	95.1 Å²	95.1	45%	0.447	48%	0.482	S	S	.	.	G	3₁₀ helix	trans	-75.3	-21.3	-172.7	-94.4	-81.2	0	0	0	114.9	L44 S45 N50 R51	L44-Y48 HydrophobicContact CB-CE2 3.94Å; L44-Y48 WeakPolarHBondContact O-CD2 3.42Å; S45-Y48 PolarHBondContact O-N 2.95Å; Y48-N50 PolarHBondContact O-N 3.39Å; Y48-R51 HydrophobicContact CD1-CB 4.12Å; Y48-R51 PolarHBondContact O-N 2.8Å
49	D	48.9	Very low	61.3	Low	150 Å²	150	96.5 Å²	96.5	80%	0.802	49%	0.489	S	S	*	.	G	3₁₀ helix	trans	-59	-21	-179.4	-73	-9	0	0	0	113.5	K47	K47-D49 PolarHBondContact O-N 3.37Å
50	N	49.9	Very low	61.5	Low	125 Å²	125	98.4 Å²	98.4	67%	0.668	50%	0.503	S	S	*	.	G	3₁₀ helix	trans	-100.3	-1.1	176.9	-93.5	-15.9	0	0	0	114.8	Y48	Y48-N50 PolarHBondContact O-N 3.39Å
51	R	51.7	Low	62.2	Low	84 Å²	84	105 Å²	105	32%	0.317	53%	0.529	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.9	-7.4	-179.1	-87.5	-171.1	172.3	175.9	1.7	114.5	Y48 I53 I54	Y48-R51 HydrophobicContact CD1-CB 4.12Å; Y48-R51 PolarHBondContact O-N 2.8Å; R51-I53 PolarHBondContact O-N 3.34Å; R51-I54 PolarHBondContact O-N 2.87Å
52	D	51.9	Low	63.3	Low	98 Å²	98	107.2 Å²	107.2	52%	0.524	53%	0.533	S	S	.	.	H	α-helix	trans	-59.5	-16.6	172.1	-77.1	-14	0	0	0	112.6	I54 L55 E56	D52-I54 PolarHBondContact O-N 2.91Å; D52-L55 CarbonylContact O-C 3.57Å; D52-L55 WeakPolarHBondContact O-CA 3.4Å; D52-L55 PolarHBondContact O-N 3.48Å; D52-E56 PolarHBondContact O-N 3.45Å
53	I	52.3	Low	64.5	Low	73 Å²	73	103.7 Å²	103.7	37%	0.374	52%	0.519	S	S	.	.	H	α-helix	trans	-57.2	-32.9	170.8	-57.2	174.2	0	0	0	112.3	R51 L55 A74	R51-I53 PolarHBondContact O-N 3.34Å; I53-L55 VanDerWaalsContact C-N 3.28Å; I53-A74 HydrophobicContact CG2-CB 4.45Å
54	I	51.8	Low	65.6	Low	44 Å²	44	109.7 Å²	109.7	23%	0.226	54%	0.535	C	S	.	.	H	α-helix	trans	-69.6	-32	174.9	-57.9	174.9	0	0	0	110.5	R51 D52 A74	R51-I54 PolarHBondContact O-N 2.87Å; D52-I54 PolarHBondContact O-N 2.91Å; I54-A74 HydrophobicContact CB-CB 4.09Å; I54-A74 HydrophobicContact CG1-CB 3.63Å; I54-A74 HydrophobicContact CG2-CB 4.47Å
55	L	58.4	Low	67	Low	113 Å²	113	116.3 Å²	116.3	59%	0.592	56%	0.563	S	S	*	*	H	α-helix	trans	-89.2	-7.9	-179.3	-60.9	175.6	0	0	0	113.5	D52 I53 N57 I59	D52-L55 CarbonylContact O-C 3.57Å; D52-L55 WeakPolarHBondContact O-CA 3.4Å; D52-L55 PolarHBondContact O-N 3.48Å; I53-L55 VanDerWaalsContact C-N 3.28Å; L55-N57 PolarHBondContact O-N 3.47Å; L55-I59 HydrophobicContact CD2-CD1 4.34Å
56	E	68.1	Low	68.5	Low	148 Å²	148	115.5 Å²	115.5	69%	0.692	56%	0.555	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.4	-26	172.8	-77.7	-179.2	-175.2	0	0	112.2	D52	D52-E56 PolarHBondContact O-N 3.45Å
57	N	70.9	Confident	70.1	Confident	42 Å²	42	108.7 Å²	108.7	23%	0.225	52%	0.524	C	S	.	.	S	Bend	trans	-97.6	121.8	173	-58.6	-79.1	0	0	0	109.5	L55 I59 Y70	L55-N57 PolarHBondContact O-N 3.47Å; N57-I59 PolarHBondContact O-N 3.24Å; N57-Y70 HydrophobicContact CB-CD1 4.04Å; N57-Y70 HydrophobicContact CB-CD2 3.65Å; N57-Y70 HydrophobicContact CB-CE1 4.49Å; N57-Y70 HydrophobicContact CB-CE2 4.1Å; N57-Y70 HydrophobicContact CB-CG 3.62Å
58	E	74.9	Confident	71.7	Confident	177 Å²	177	104 Å²	104	83%	0.827	51%	0.51	S	S	*	.	P	Polyproline II helix	trans	-58.6	122.6	-179.3	-159.9	176.1	-162.3	0	0	110.8	S60	E58-S60 PolarHBondContact O-N 2.82Å
59	I	81.6	Confident	73.5	Confident	103 Å²	103	105.1 Å²	105.1	53%	0.528	51%	0.514	S	S	.	.	P	Polyproline II helix	trans	-78.3	118	178.5	-62.4	-171.5	0	0	0	108.5	L55 N57 N67	L55-I59 HydrophobicContact CD2-CD1 4.34Å; N57-I59 PolarHBondContact O-N 3.24Å; I59-N67 WeakPolarHBondContact CG2-ND2 3.44Å
60	S	84.2	Confident	75.2	Confident	51 Å²	51	101.6 Å²	101.6	36%	0.357	49%	0.49	S	S	.	.	P	Polyproline II helix	trans	-87.3	119	176.7	177.3	0	0	0	0	110.3	E58 D62 N63 N67	E58-S60 PolarHBondContact O-N 2.82Å; S60-D62 PolarHBondContact O-N 3.26Å; S60-D62 VanDerWaalsContact O-N 3.07Å; S60-N63 PolarHBondContact O-N 2.91Å; S60-N67 PolarHBondContact N-OD1 3.49Å; S60-N67 PolarHBondContact O-ND2 2.74Å; S60-N67 PolarHBondContact O-OD1 3.47Å
61	K	88.7	Confident	76.6	Confident	197 Å²	197	98 Å²	98	86%	0.857	47%	0.474	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55	-30.3	179.5	-170.9	-177.7	176.4	-174.9	0	113.1
62	D	92.7	Very high	77.9	Confident	147 Å²	147	100.9 Å²	100.9	79%	0.786	49%	0.492	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.4	1.3	-170.2	-54.3	-39	0	0	0	113.3	S60	S60-D62 PolarHBondContact O-N 3.26Å; S60-D62 VanDerWaalsContact O-N 3.07Å
63	N	90.4	Very high	79.2	Confident	66 Å²	66	101.2 Å²	101.2	35%	0.353	49%	0.489	S	S	.	.			trans	-131.3	84.3	-177.1	-162.2	-27.8	0	0	0	113.2	S60 F65 V66 N67	S60-N63 PolarHBondContact O-N 2.91Å; N63-F65 VanDerWaalsContact C-N 3.33Å; N63-F65 PolarHBondContact O-N 2.85Å; N63-F65 PolarHBondContact OD1-N 3.24Å; N63-V66 HydrophobicContact CB-CB 4.22Å; N63-V66 HydrophobicContact CB-CG2 4.45Å; N63-V66 VanDerWaalsContact CG-CG2 3.49Å; N63-V66 VanDerWaalsContact ND2-CG2 3.29Å; N63-V66 WeakPolarHBondContact ND2-CG2 3.33Å; N63-V66 PolarHBondContact O-N 2.89Å; N63-V66 WeakPolarHBondContact OD1-CG2 3.33Å; N63-V66 PolarHBondContact OD1-N 2.92Å; N63-V66 VanDerWaalsContact OD1-N 3.1Å; N63-N67 PolarHBondContact O-N 3.36Å; N63-N67 VanDerWaalsContact O-N 3.16Å; N63-N67 PolarHBondContact O-ND2 3.44Å; N63-N67 PolarHBondContact O-OD1 3.17Å
64	Y	90.1	Very high	80.3	Confident	176 Å²	176	98.2 Å²	98.2	69%	0.69	47%	0.474	S	S	*	.	H	α-helix	trans	-55.8	-43.2	176.9	174.9	-98.5	0	0	0	113.3	V66 N67 A68	Y64-V66 PolarHBondContact O-N 3.41Å; Y64-N67 PolarHBondContact O-N 3.23Å; Y64-A68 HydrophobicContact CE1-CB 4.39Å; Y64-A68 WeakPolarHBondContact O-CB 3.41Å; Y64-A68 PolarHBondContact O-N 3.14Å
65	F	90.3	Very high	81.3	Confident	169 Å²	169	98.5 Å²	98.5	74%	0.741	48%	0.476	S	S	*	.	H	α-helix	trans	-64.3	-43.4	-175.7	-81.9	-79.4	0	0	0	112.1	N63 A68 Y69	N63-F65 VanDerWaalsContact C-N 3.33Å; N63-F65 PolarHBondContact O-N 2.85Å; N63-F65 PolarHBondContact OD1-N 3.24Å; F65-A68 PolarHBondContact O-N 3.4Å; F65-Y69 PolarHBondContact O-N 3.35Å
66	V	88.1	Confident	82.1	Confident	49 Å²	49	99 Å²	99	30%	0.297	47%	0.474	S	S	.	.	H	α-helix	trans	-64.2	-43.4	176.3	169	0	0	0	0	110.7	N63 Y64 A68 Y69 Y70	N63-V66 HydrophobicContact CB-CB 4.22Å; N63-V66 HydrophobicContact CB-CG2 4.45Å; N63-V66 VanDerWaalsContact CG-CG2 3.49Å; N63-V66 VanDerWaalsContact ND2-CG2 3.29Å; N63-V66 WeakPolarHBondContact ND2-CG2 3.33Å; N63-V66 PolarHBondContact O-N 2.89Å; N63-V66 WeakPolarHBondContact OD1-CG2 3.33Å; N63-V66 PolarHBondContact OD1-N 2.92Å; N63-V66 VanDerWaalsContact OD1-N 3.1Å; Y64-V66 PolarHBondContact O-N 3.41Å; V66-A68 VanDerWaalsContact C-N 3.34Å; V66-A68 PolarHBondContact O-N 2.92Å; V66-Y69 PolarHBondContact O-N 2.96Å; V66-Y70 HydrophobicContact CG1-CD2 3.65Å; V66-Y70 HydrophobicContact CG1-CE2 3.23Å; V66-Y70 WeakPolarHBondContact O-CD2 3.23Å; V66-Y70 PolarHBondContact O-N 3.48Å
67	N	86.7	Confident	82.2	Confident	28 Å²	28	95.7 Å²	95.7	15%	0.15	47%	0.465	C	S	.	.	H	α-helix	trans	-62.3	-41.2	177.1	-61.9	-16.8	0	0	0	112.3	I59 S60 N63 Y64 Y70 S71	I59-N67 WeakPolarHBondContact CG2-ND2 3.44Å; S60-N67 PolarHBondContact N-OD1 3.49Å; S60-N67 PolarHBondContact O-ND2 2.74Å; S60-N67 PolarHBondContact O-OD1 3.47Å; N63-N67 PolarHBondContact O-N 3.36Å; N63-N67 VanDerWaalsContact O-N 3.16Å; N63-N67 PolarHBondContact O-ND2 3.44Å; N63-N67 PolarHBondContact O-OD1 3.17Å; Y64-N67 PolarHBondContact O-N 3.23Å; N67-Y70 PolarHBondContact O-N 3.24Å; N67-S71 WeakPolarHBondContact O-CB 3.42Å; N67-S71 PolarHBondContact O-N 2.92Å; N67-S71 PolarHBondContact O-OG 3.03Å
68	A	85.8	Confident	81.9	Confident	31 Å²	31	96.2 Å²	96.2	26%	0.256	47%	0.466	S	S	.	.	H	α-helix	trans	-65.6	-41.2	177.6	0	0	0	0	0	111.6	Y64 F65 V66 S71 Q72	Y64-A68 HydrophobicContact CE1-CB 4.39Å; Y64-A68 WeakPolarHBondContact O-CB 3.41Å; Y64-A68 PolarHBondContact O-N 3.14Å; F65-A68 PolarHBondContact O-N 3.4Å; V66-A68 VanDerWaalsContact C-N 3.34Å; V66-A68 PolarHBondContact O-N 2.92Å; A68-S71 PolarHBondContact O-N 3.42Å; A68-Q72 PolarHBondContact O-N 3.17Å
69	Y	86.1	Confident	81.3	Confident	137 Å²	137	91.1 Å²	91.1	54%	0.537	45%	0.45	S	S	.	.	H	α-helix	trans	-61.1	-48.3	174	170.8	-99.5	0	0	0	111.7	F65 V66 S71 Q72 K73	F65-Y69 PolarHBondContact O-N 3.35Å; V66-Y69 PolarHBondContact O-N 2.96Å; Y69-S71 VanDerWaalsContact C-N 3.34Å; Y69-S71 PolarHBondContact O-N 2.91Å; Y69-Q72 PolarHBondContact O-N 3.25Å; Y69-K73 HydrophobicContact CE1-CD 4.06Å; Y69-K73 WeakPolarHBondContact O-CB 3.34Å; Y69-K73 PolarHBondContact O-N 3.02Å
70	Y	83.7	Confident	80.5	Confident	76 Å²	76	91.7 Å²	91.7	30%	0.298	45%	0.454	S	S	.	.	H	α-helix	trans	-65.3	-37.1	178.4	-68.9	-36.3	0	0	0	112.9	N57 V66 N67 Q72 K73 A74	N57-Y70 HydrophobicContact CB-CD1 4.04Å; N57-Y70 HydrophobicContact CB-CD2 3.65Å; N57-Y70 HydrophobicContact CB-CE1 4.49Å; N57-Y70 HydrophobicContact CB-CE2 4.1Å; N57-Y70 HydrophobicContact CB-CG 3.62Å; V66-Y70 HydrophobicContact CG1-CD2 3.65Å; V66-Y70 HydrophobicContact CG1-CE2 3.23Å; V66-Y70 WeakPolarHBondContact O-CD2 3.23Å; V66-Y70 PolarHBondContact O-N 3.48Å; N67-Y70 PolarHBondContact O-N 3.24Å; Y70-Q72 PolarHBondContact O-N 2.95Å; Y70-K73 HydrophobicContact CD1-CD 4.47Å; Y70-K73 PolarHBondContact O-N 2.84Å; Y70-A74 WeakPolarHBondContact O-CB 3.49Å; Y70-A74 PolarHBondContact O-N 3.29Å
71	S	80	Confident	79.4	Confident	48 Å²	48	92 Å²	92	34%	0.336	46%	0.459	S	S	.	.	H	α-helix	trans	-58.7	-48.2	172.9	-58.5	0	0	0	0	111.1	N67 A68 Y69 A74 D75	N67-S71 WeakPolarHBondContact O-CB 3.42Å; N67-S71 PolarHBondContact O-N 2.92Å; N67-S71 PolarHBondContact O-OG 3.03Å; A68-S71 PolarHBondContact O-N 3.42Å; Y69-S71 VanDerWaalsContact C-N 3.34Å; Y69-S71 PolarHBondContact O-N 2.91Å; S71-A74 PolarHBondContact O-N 3.14Å; S71-D75 WeakPolarHBondContact O-CB 3.34Å; S71-D75 PolarHBondContact O-N 3.37Å
72	Q	79.5	Confident	77.4	Confident	145 Å²	145	91.5 Å²	91.5	68%	0.678	46%	0.46	S	S	*	.	H	α-helix	trans	-64.5	-41	175.9	-74.5	-174	30.9	0	0	112.6	A68 Y69 Y70 A74 D75 F76	A68-Q72 PolarHBondContact O-N 3.17Å; Y69-Q72 PolarHBondContact O-N 3.25Å; Y70-Q72 PolarHBondContact O-N 2.95Å; Q72-A74 VanDerWaalsContact C-N 3.3Å; Q72-A74 PolarHBondContact O-N 3.41Å; Q72-D75 PolarHBondContact O-N 2.94Å; Q72-F76 WeakPolarHBondContact O-CB 3.43Å; Q72-F76 PolarHBondContact O-N 3.48Å
73	K	79.6	Confident	75.3	Confident	106 Å²	106	87.8 Å²	87.8	46%	0.461	44%	0.443	S	S	.	.	H	α-helix	trans	-62.5	-38.6	179.5	-175.1	-175.3	174.6	-170	0	111.6	Y69 Y70 P77	Y69-K73 HydrophobicContact CE1-CD 4.06Å; Y69-K73 WeakPolarHBondContact O-CB 3.34Å; Y69-K73 PolarHBondContact O-N 3.02Å; Y70-K73 HydrophobicContact CD1-CD 4.47Å; Y70-K73 PolarHBondContact O-N 2.84Å; K73-P77 WeakPolarHBondContact O-CD 3.46Å
74	A	74.6	Confident	72.8	Confident	9 Å²	9	90.3 Å²	90.3	7%	0.074	46%	0.463	C	S	.	.	H	α-helix	trans	-75.4	-35.4	177	0	0	0	0	0	112.4	I53 I54 Y70 S71 Q72 F76	I53-A74 HydrophobicContact CG2-CB 4.45Å; I54-A74 HydrophobicContact CB-CB 4.09Å; I54-A74 HydrophobicContact CG1-CB 3.63Å; I54-A74 HydrophobicContact CG2-CB 4.47Å; Y70-A74 WeakPolarHBondContact O-CB 3.49Å; Y70-A74 PolarHBondContact O-N 3.29Å; S71-A74 PolarHBondContact O-N 3.14Å; Q72-A74 VanDerWaalsContact C-N 3.3Å; Q72-A74 PolarHBondContact O-N 3.41Å; A74-F76 VanDerWaalsContact C-N 3.33Å
75	D	72	Confident	70.3	Confident	50 Å²	50	89.7 Å²	89.7	27%	0.267	47%	0.466	S	S	.	.	H	α-helix	trans	-69.8	-28.9	175.3	-77.4	-11.7	0	0	0	112.3	S71 Q72 Q78 S79	S71-D75 WeakPolarHBondContact O-CB 3.34Å; S71-D75 PolarHBondContact O-N 3.37Å; Q72-D75 PolarHBondContact O-N 2.94Å; D75-Q78 VanDerWaalsContact O-CB 3.27Å; D75-Q78 WeakPolarHBondContact O-CB 3.45Å; D75-Q78 PolarHBondContact O-N 3.42Å; D75-S79 PolarHBondContact O-N 3.03Å
76	F	75.2	Confident	67.7	Low	125 Å²	125	82 Å²	82	55%	0.548	44%	0.435	S	S	.	.	H	α-helix	trans	-63.6	-51.1	-170.6	-178.2	-100.9	0	0	0	114.8	Q72 A74 Q78 S79 L80	Q72-F76 WeakPolarHBondContact O-CB 3.43Å; Q72-F76 PolarHBondContact O-N 3.48Å; A74-F76 VanDerWaalsContact C-N 3.33Å; F76-Q78 PolarHBondContact O-N 3.1Å; F76-S79 WeakPolarHBondContact O-CB 3.09Å; F76-S79 PolarHBondContact O-N 3.12Å; F76-S79 PolarHBondContact O-OG 3.21Å; F76-L80 HydrophobicContact CD1-CD1 3.93Å; F76-L80 HydrophobicContact CE1-CD1 3.32Å; F76-L80 HydrophobicContact CE1-CG 4.17Å; F76-L80 HydrophobicContact CE2-CD1 4.4Å; F76-L80 HydrophobicContact CE2-CG 4.47Å; F76-L80 HydrophobicContact CZ-CD1 3.6Å; F76-L80 HydrophobicContact CZ-CD2 4.37Å; F76-L80 HydrophobicContact CZ-CG 4.13Å; F76-L80 PolarHBondContact O-N 3.16Å; F76-L80 VanDerWaalsContact O-N 3.16Å
77	P	70.4	Confident	65.4	Low	78 Å²	78	87.4 Å²	87.4	51%	0.506	45%	0.451	S	S	.	.	H	α-helix	trans	-57.7	-37	174.9	-22.5	31.8	0	0	0	112	K73 S79 L80 A81	K73-P77 WeakPolarHBondContact O-CD 3.46Å; P77-S79 VanDerWaalsContact C-N 3.32Å; P77-S79 PolarHBondContact O-N 3.13Å; P77-L80 PolarHBondContact O-N 3.18Å; P77-A81 PolarHBondContact O-N 3.03Å
78	Q	64.5	Low	63.6	Low	52 Å²	52	90.7 Å²	90.7	24%	0.243	46%	0.464	C	S	.	.	H	α-helix	trans	-62.9	-40.8	177.1	-123.8	179.9	56.1	0	0	110.7	D75 F76 L80 A81 F88	D75-Q78 VanDerWaalsContact O-CB 3.27Å; D75-Q78 WeakPolarHBondContact O-CB 3.45Å; D75-Q78 PolarHBondContact O-N 3.42Å; F76-Q78 PolarHBondContact O-N 3.1Å; Q78-L80 VanDerWaalsContact C-N 3.28Å; Q78-L80 PolarHBondContact O-N 3.41Å; Q78-A81 PolarHBondContact O-N 3.25Å; Q78-F88 HydrophobicContact CB-CE1 4.33Å; Q78-F88 HydrophobicContact CB-CZ 3.74Å; Q78-F88 HydrophobicContact CG-CZ 4.11Å; Q78-F88 WeakPolarHBondContact O-CE2 3.12Å; Q78-F88 VanDerWaalsContact O-CZ 3.22Å; Q78-F88 WeakPolarHBondContact O-CZ 2.82Å
79	S	63.6	Low	62	Low	71 Å²	71	91.8 Å²	91.8	50%	0.497	47%	0.465	S	S	.	.	H	α-helix	trans	-67.3	-24.4	175.4	77.3	0	0	0	0	114.5	D75 F76 P77	D75-S79 PolarHBondContact O-N 3.03Å; F76-S79 WeakPolarHBondContact O-CB 3.09Å; F76-S79 PolarHBondContact O-N 3.12Å; F76-S79 PolarHBondContact O-OG 3.21Å; P77-S79 VanDerWaalsContact C-N 3.32Å; P77-S79 PolarHBondContact O-N 3.13Å
80	L	65.4	Low	60.2	Low	114 Å²	114	87 Å²	87	60%	0.597	45%	0.451	S	S	*	.	H	α-helix	trans	-91.8	-23	179.5	-69.3	179.6	0	0	0	113.5	F76 P77 Q78 E82	F76-L80 HydrophobicContact CD1-CD1 3.93Å; F76-L80 HydrophobicContact CE1-CD1 3.32Å; F76-L80 HydrophobicContact CE1-CG 4.17Å; F76-L80 HydrophobicContact CE2-CD1 4.4Å; F76-L80 HydrophobicContact CE2-CG 4.47Å; F76-L80 HydrophobicContact CZ-CD1 3.6Å; F76-L80 HydrophobicContact CZ-CD2 4.37Å; F76-L80 HydrophobicContact CZ-CG 4.13Å; F76-L80 PolarHBondContact O-N 3.16Å; F76-L80 VanDerWaalsContact O-N 3.16Å; P77-L80 PolarHBondContact O-N 3.18Å; Q78-L80 VanDerWaalsContact C-N 3.28Å; Q78-L80 PolarHBondContact O-N 3.41Å; L80-E82 PolarHBondContact O-N 2.77Å; L80-E82 VanDerWaalsContact O-N 3.13Å
81	A	59.1	Low	58.7	Low	57 Å²	57	91.9 Å²	91.9	47%	0.471	47%	0.469	S	S	.	.	S	Bend	trans	-59.2	120.2	173.3	0	0	0	0	0	107.9	P77 Q78 V83	P77-A81 PolarHBondContact O-N 3.03Å; Q78-A81 PolarHBondContact O-N 3.25Å; A81-V83 VanDerWaalsContact C-N 3.31Å; A81-V83 WeakPolarHBondContact O-CG2 3.16Å; A81-V83 PolarHBondContact O-N 2.64Å
82	E	46.9	Very low	57.4	Low	188 Å²	188	91.3 Å²	91.3	88%	0.879	47%	0.465	S	S	*	.			trans	-53.3	100.4	172.5	-74.5	-176.7	165	0	0	107.3	L80 P84	L80-E82 PolarHBondContact O-N 2.77Å; L80-E82 VanDerWaalsContact O-N 3.13Å; E82-P84 WeakPolarHBondContact O-CD 3.41Å
83	V	48.5	Very low	56.1	Low	69 Å²	69	91.9 Å²	91.9	42%	0.418	47%	0.465	S	S	.	.			trans	-66.7	116.7	-176.3	-158.5	0	0	0	0	105.8	A81 Q85 G86 F88	A81-V83 VanDerWaalsContact C-N 3.31Å; A81-V83 WeakPolarHBondContact O-CG2 3.16Å; A81-V83 PolarHBondContact O-N 2.64Å; V83-Q85 VanDerWaalsContact C-N 3.34Å; V83-Q85 PolarHBondContact O-N 3.49Å; V83-G86 WeakPolarHBondContact CB-O 3.38Å; V83-G86 WeakPolarHBondContact CG1-O 3.38Å; V83-F88 HydrophobicContact CG2-CD2 4.16Å; V83-F88 HydrophobicContact CG2-CE2 4.14Å
84	P	39.8	Very low	55.4	Low	119 Å²	119	89.4 Å²	89.4	77%	0.773	46%	0.46	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.6	100.2	-178.2	-15.6	29.8	0	0	0	107.2	E82 G86	E82-P84 WeakPolarHBondContact O-CD 3.41Å; P84-G86 PolarHBondContact O-N 2.96Å
85	Q	35.7	Very low	55.4	Low	162 Å²	162	94.1 Å²	94.1	76%	0.757	48%	0.478	S	S	*	.	T	Hydrogen-bonded Turn	trans	43.9	57	176.6	-67.1	-170.2	-17.3	0	0	115.1	V83	V83-Q85 VanDerWaalsContact C-N 3.34Å; V83-Q85 PolarHBondContact O-N 3.49Å
86	G	36.9	Very low	55.7	Low	9 Å²	9	96.6 Å²	96.6	9%	0.093	49%	0.491	C	S	.	.			trans	-169.3	120.5	176.1	0	0	0	0	0	112.1	V83 P84 Y100	V83-G86 WeakPolarHBondContact CB-O 3.38Å; V83-G86 WeakPolarHBondContact CG1-O 3.38Å; P84-G86 PolarHBondContact O-N 2.96Å; G86-Y100 WeakPolarHBondContact CA-OH 3.47Å
87	Y	40.5	Very low	56.3	Low	161 Å²	161	91 Å²	91	63%	0.631	47%	0.467	S	S	*	.			trans	-57.9	151.4	173.6	-73.3	-105.7	0	0	0	109.8	L89 Y100	Y87-L89 PolarHBondContact O-N 2.79Å; Y87-Y100 WeakPolarHBondContact CD2-O 3.31Å; Y87-Y100 WeakPolarHBondContact O-CE2 3.46Å
88	F	47.7	Very low	56.8	Low	98 Å²	98	89.1 Å²	89.1	43%	0.43	45%	0.45	S	S	.	.			trans	-45.4	116.5	167.6	-105.5	-96.3	0	0	0	108.6	Q78 V83 P90	Q78-F88 HydrophobicContact CB-CE1 4.33Å; Q78-F88 HydrophobicContact CB-CZ 3.74Å; Q78-F88 HydrophobicContact CG-CZ 4.11Å; Q78-F88 WeakPolarHBondContact O-CE2 3.12Å; Q78-F88 VanDerWaalsContact O-CZ 3.22Å; Q78-F88 WeakPolarHBondContact O-CZ 2.82Å; V83-F88 HydrophobicContact CG2-CD2 4.16Å; V83-F88 HydrophobicContact CG2-CE2 4.14Å; F88-P90 WeakPolarHBondContact O-CD 3.37Å
89	L	51.5	Low	57.5	Low	53 Å²	53	88.8 Å²	88.8	28%	0.277	45%	0.452	S	S	.	.			trans	-55.1	111.9	172.3	-76.2	157.9	0	0	0	105.4	I39 K47 Y87 R91 Y98 Y100	I39-L89 HydrophobicContact CD1-CD2 3.61Å; I39-L89 HydrophobicContact CG1-CD2 4.28Å; K47-L89 HydrophobicContact CD-CD1 4.23Å; Y87-L89 PolarHBondContact O-N 2.79Å; L89-R91 PolarHBondContact O-N 3.26Å; L89-Y98 WeakPolarHBondContact CD2-OH 3.43Å; L89-Y100 HydrophobicContact CD2-CD2 4.43Å; L89-Y100 HydrophobicContact CD2-CE2 4.21Å; L89-Y100 HydrophobicContact CG-CE2 4.28Å
90	P	49.8	Very low	57.9	Low	38 Å²	38	87.7 Å²	87.7	25%	0.247	44%	0.437	C	S	.	.			trans	-57.4	142.5	176.7	24	-25.3	0	0	0	107.1	F88 S92 T94 Y98	F88-P90 WeakPolarHBondContact O-CD 3.37Å; P90-S92 PolarHBondContact O-N 3.21Å; P90-T94 HydrophobicContact CB-CG2 3.98Å; P90-Y98 VanDerWaalsContact CD-CE1 3.47Å; P90-Y98 WeakPolarHBondContact CD-OH 3.2Å; P90-Y98 HydrophobicContact CG-CD1 3.67Å; P90-Y98 HydrophobicContact CG-CE1 3.15Å; P90-Y98 HydrophobicContact CG-CE2 4.09Å; P90-Y98 HydrophobicContact CG-CG 4.34Å; P90-Y98 VanDerWaalsContact CG-CZ 3.42Å
91	R	51.5	Low	58.2	Low	178 Å²	178	83.8 Å²	83.8	67%	0.672	42%	0.417	S	S	*	.			trans	-47.2	134.3	179.3	-64.6	-177.6	-124.6	-129.3	-5	108.1	L89 F93 T94	L89-R91 PolarHBondContact O-N 3.26Å; R91-F93 HydrophobicContact CB-CD2 4.32Å; R91-F93 PolarHBondContact O-N 2.82Å; R91-T94 PolarHBondContact O-N 2.89Å; R91-T94 VanDerWaalsContact O-N 3.08Å; R91-T94 PolarHBondContact O-OG1 3.16Å
92	S	51.7	Low	58.7	Low	35 Å²	35	89 Å²	89	25%	0.245	44%	0.437	C	S	.	.	T	Hydrogen-bonded Turn	trans	-51	-6.1	-172.1	47.2	0	0	0	0	116.7	P90 S109	P90-S92 PolarHBondContact O-N 3.21Å; S92-S109 WeakPolarHBondContact O-CB 3.46Å
93	F	53.5	Low	59.8	Low	157 Å²	157	86.9 Å²	86.9	69%	0.689	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.6	2.9	176.8	-52.1	-72.6	0	0	0	114.4	R91 F95	R91-F93 HydrophobicContact CB-CD2 4.32Å; R91-F93 PolarHBondContact O-N 2.82Å; F93-F95 VanDerWaalsContact O-CD2 3.3Å; F93-F95 WeakPolarHBondContact O-CD2 3.08Å; F93-F95 WeakPolarHBondContact O-CE2 3.44Å; F93-F95 PolarHBondContact O-N 3.17Å
94	T	64.3	Low	61.6	Low	55 Å²	55	83.7 Å²	83.7	34%	0.337	41%	0.405	S	S	.	.			trans	-76.4	113.2	172.6	46.8	0	0	0	0	110.9	P90 R91 L96 S109	P90-T94 HydrophobicContact CB-CG2 3.98Å; R91-T94 PolarHBondContact O-N 2.89Å; R91-T94 VanDerWaalsContact O-N 3.08Å; R91-T94 PolarHBondContact O-OG1 3.16Å; T94-L96 PolarHBondContact O-N 3.06Å; T94-S109 WeakPolarHBondContact O-CB 3.46Å; T94-S109 PolarHBondContact O-OG 2.92Å
95	F	74.4	Confident	63.9	Low	107 Å²	107	79 Å²	79	47%	0.469	38%	0.375	S	S	.	.			trans	-84	31.1	175.4	-60.3	-82.8	0	0	0	112.9	F93 L112 F117	F93-F95 VanDerWaalsContact O-CD2 3.3Å; F93-F95 WeakPolarHBondContact O-CD2 3.08Å; F93-F95 WeakPolarHBondContact O-CE2 3.44Å; F93-F95 PolarHBondContact O-N 3.17Å; F95-L112 HydrophobicContact CB-CD2 4.45Å; F95-L112 VanDerWaalsContact O-CD2 3.23Å; F95-L112 WeakPolarHBondContact O-CD2 3.45Å; F95-F117 HydrophobicContact CB-CE2 4.1Å; F95-F117 HydrophobicContact CB-CZ 4.12Å; F95-F117 AromaticContact CD1-CE2 3.97Å; F95-F117 HydrophobicContact CD1-CE2 3.97Å; F95-F117 HydrophobicContact CG-CE2 4.29Å
96	L	79.2	Confident	66.4	Low	103 Å²	103	71.3 Å²	71.3	54%	0.539	34%	0.339	S	S	.	.	S	Bend	trans	-134.4	130.1	177.6	-71.8	174.1	0	0	0	108.8	T94 L134	T94-L96 PolarHBondContact O-N 3.06Å; L96-L134 HydrophobicContact CD2-CD2 4.06Å
97	P	86.5	Confident	68.8	Low	6 Å²	6	71.1 Å²	71.1	4%	0.039	34%	0.336	C	S	.	.			trans	-69.7	148.7	172.9	31.3	-33.2	0	0	0	109.6	I106 V107 M108 L112 L134 Q138	P97-I106 HydrophobicContact CB-CG2 4Å; P97-V107 CarbonylContact C-O 3.37Å; P97-V107 WeakPolarHBondContact CA-O 3.47Å; P97-M108 HydrophobicContact CB-CB 4.2Å; P97-L112 HydrophobicContact CB-CD1 4.46Å; P97-L112 HydrophobicContact CG-CD1 4.48Å; P97-L134 HydrophobicContact CG-CB 3.98Å; P97-Q138 HydrophobicContact CB-CG 4.04Å; P97-Q138 HydrophobicContact CG-CG 3.91Å; P97-Q138 PolarHBondContact O-NE2 3.36Å
98	Y	81.5	Confident	71	Confident	40 Å²	40	63.8 Å²	63.8	16%	0.157	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	163.2	178.9	67.5	-82.3	0	0	0	110.3	L89 P90 Y100 I106 V107	L89-Y98 WeakPolarHBondContact CD2-OH 3.43Å; P90-Y98 VanDerWaalsContact CD-CE1 3.47Å; P90-Y98 WeakPolarHBondContact CD-OH 3.2Å; P90-Y98 HydrophobicContact CG-CD1 3.67Å; P90-Y98 HydrophobicContact CG-CE1 3.15Å; P90-Y98 HydrophobicContact CG-CE2 4.09Å; P90-Y98 HydrophobicContact CG-CG 4.34Å; P90-Y98 VanDerWaalsContact CG-CZ 3.42Å; Y98-Y100 HydrophobicContact CE2-CD2 4.31Å; Y98-I106 CarbonylContact O-C 3.35Å; Y98-I106 WeakPolarHBondContact O-CA 3.44Å; Y98-V107 HydrophobicContact CD1-CB 4.36Å; Y98-V107 HydrophobicContact CE1-CB 3.69Å; Y98-V107 HydrophobicContact CE1-CG1 3.78Å; Y98-V107 HydrophobicContact CE2-CB 4.02Å; Y98-V107 HydrophobicContact CE2-CG2 4.38Å; Y98-V107 VanDerWaalsContact CZ-CB 3.47Å; Y98-V107 PolarHBondContact N-O 3.25Å; Y98-V107 PolarHBondContact O-N 2.91Å; Y98-V107 WeakPolarHBondContact OH-CB 3.42Å; Y98-V107 WeakPolarHBondContact OH-CG1 3.48Å
99	T	80.3	Confident	72.6	Confident	44 Å²	44	59.2 Å²	59.2	27%	0.27	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	128.8	175.7	-54.4	0	0	0	0	109.2	D101 T105 Q138 I142	T99-D101 WeakPolarHBondContact CG2-O 3.15Å; T99-T105 WeakPolarHBondContact CA-O 3.45Å; T99-Q138 PolarHBondContact OG1-OE1 3.12Å; T99-I142 HydrophobicContact CG2-CD1 3.93Å; T99-I142 HydrophobicContact CG2-CG1 3.86Å
100	Y	71.3	Confident	74.1	Confident	49 Å²	49	58.9 Å²	58.9	19%	0.192	29%	0.29	C	S	.	.			trans	-94.5	-26.4	-173.7	174.2	-97.5	0	0	0	114.3	G86 Y87 L89 Y98 T105 V107	G86-Y100 WeakPolarHBondContact CA-OH 3.47Å; Y87-Y100 WeakPolarHBondContact CD2-O 3.31Å; Y87-Y100 WeakPolarHBondContact O-CE2 3.46Å; L89-Y100 HydrophobicContact CD2-CD2 4.43Å; L89-Y100 HydrophobicContact CD2-CE2 4.21Å; L89-Y100 HydrophobicContact CG-CE2 4.28Å; Y98-Y100 HydrophobicContact CE2-CD2 4.31Å; Y100-T105 PolarHBondContact N-O 2.89Å; Y100-V107 HydrophobicContact CG-CG2 4.2Å
101	D	71	Confident	75.6	Confident	32 Å²	32	57.9 Å²	57.9	17%	0.171	29%	0.286	C	S	.	.	S	Bend	trans	-147.4	168.6	-173.7	60.6	22.1	0	0	0	112	T99 K103 G104 T105	T99-D101 WeakPolarHBondContact CG2-O 3.15Å; D101-K103 PolarHBondContact O-N 2.87Å; D101-K103 VanDerWaalsContact O-N 3.17Å; D101-K103 WeakPolarHBondContact OD1-CA 3.06Å; D101-K103 WeakPolarHBondContact OD1-CB 3.33Å; D101-K103 PolarHBondContact OD1-N 3.42Å; D101-G104 PolarHBondContact O-N 3.34Å; D101-G104 VanDerWaalsContact O-N 3.16Å; D101-G104 PolarHBondContact OD1-N 3.32Å; D101-T105 WeakPolarHBondContact OD1-CB 3.27Å; D101-T105 PolarHBondContact OD1-N 3.24Å; D101-T105 PolarHBondContact OD1-OG1 3.41Å; D101-T105 WeakPolarHBondContact OD2-CB 3.21Å; D101-T105 PolarHBondContact OD2-OG1 3.38Å
102	D	69.2	Low	77.3	Confident	167 Å²	167	49.4 Å²	49.4	89%	0.893	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.7	-10.8	173.4	-59.6	-24.7	0	0	0	112.5	G104	D102-G104 VanDerWaalsContact C-N 3.29Å
103	K	72	Confident	78.9	Confident	143 Å²	143	50.7 Å²	50.7	62%	0.622	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82	-11.5	176.8	-59	177.1	-177.7	168.5	0	112	D101	D101-K103 PolarHBondContact O-N 2.87Å; D101-K103 VanDerWaalsContact O-N 3.17Å; D101-K103 WeakPolarHBondContact OD1-CA 3.06Å; D101-K103 WeakPolarHBondContact OD1-CB 3.33Å; D101-K103 PolarHBondContact OD1-N 3.42Å
104	G	84.6	Confident	80.5	Confident	1 Å²	1	48.7 Å²	48.7	1%	0.01	25%	0.25	C	S	.	.			trans	84.8	31.8	179.2	0	0	0	0	0	113.5	I34 S35 D101 D102 I106	I34-G104 WeakPolarHBondContact CA-O 3.22Å; I34-G104 WeakPolarHBondContact CG2-O 3.18Å; S35-G104 PolarHBondContact N-O 3.25Å; D101-G104 PolarHBondContact O-N 3.34Å; D101-G104 VanDerWaalsContact O-N 3.16Å; D101-G104 PolarHBondContact OD1-N 3.32Å; D102-G104 VanDerWaalsContact C-N 3.29Å; G104-I106 PolarHBondContact O-N 2.93Å
105	T	88.7	Confident	81.7	Confident	22 Å²	22	49.4 Å²	49.4	14%	0.135	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	113.8	171.6	-57.2	0	0	0	0	109.7	S35 T99 Y100 D101 V107	S35-T105 WeakPolarHBondContact OG-CA 3.43Å; S35-T105 WeakPolarHBondContact OG-CG2 3.36Å; S35-T105 PolarHBondContact OG-OG1 3.3Å; T99-T105 WeakPolarHBondContact CA-O 3.45Å; Y100-T105 PolarHBondContact N-O 2.89Å; D101-T105 WeakPolarHBondContact OD1-CB 3.27Å; D101-T105 PolarHBondContact OD1-N 3.24Å; D101-T105 PolarHBondContact OD1-OG1 3.41Å; D101-T105 WeakPolarHBondContact OD2-CB 3.21Å; D101-T105 PolarHBondContact OD2-OG1 3.38Å; T105-V107 HydrophobicContact CG2-CG2 4.06Å
106	I	89	Confident	82.3	Confident	0 Å²	0	48.1 Å²	48.1	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	119.8	173.8	-58.9	168.5	0	0	0	108.2	F2 I34 S35 V36 S37 P97 Y98 G104 I135 Q138 I139 I142	F2-I106 HydrophobicContact CE2-CD1 4.19Å; I34-I106 HydrophobicContact CG2-CD1 3.61Å; I34-I106 HydrophobicContact CG2-CG1 3.99Å; S35-I106 PolarHBondContact O-N 3.04Å; V36-I106 CarbonylContact C-O 3.51Å; V36-I106 VanDerWaalsContact CA-O 3.24Å; V36-I106 WeakPolarHBondContact CA-O 3.16Å; V36-I106 HydrophobicContact CG2-CB 4.03Å; V36-I106 HydrophobicContact CG2-CD1 4.44Å; V36-I106 HydrophobicContact CG2-CG2 4.45Å; S37-I106 PolarHBondContact N-O 3.1Å; P97-I106 HydrophobicContact CB-CG2 4Å; Y98-I106 CarbonylContact O-C 3.35Å; Y98-I106 WeakPolarHBondContact O-CA 3.44Å; G104-I106 PolarHBondContact O-N 2.93Å; I106-I135 HydrophobicContact CD1-CG2 4.49Å; I106-Q138 HydrophobicContact CD1-CB 3.73Å; I106-Q138 HydrophobicContact CG1-CB 3.87Å; I106-Q138 HydrophobicContact CG2-CB 4.01Å; I106-Q138 HydrophobicContact CG2-CG 4.11Å; I106-I139 HydrophobicContact CD1-CG1 3.6Å; I106-I142 HydrophobicContact CD1-CD1 4.13Å; I106-I142 HydrophobicContact CG1-CD1 3.69Å
107	V	85.9	Confident	82.7	Confident	4 Å²	4	45.6 Å²	45.6	2%	0.024	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	134	178.2	-175.3	0	0	0	0	109.8	S37 I39 P97 Y98 Y100 T105	S37-V107 WeakPolarHBondContact O-CA 3.47Å; I39-V107 HydrophobicContact CD1-CG1 3.43Å; I39-V107 VanDerWaalsContact CD1-CG1 3.43Å; I39-V107 HydrophobicContact CG1-CG1 3.45Å; I39-V107 VanDerWaalsContact CG1-CG1 3.45Å; P97-V107 CarbonylContact C-O 3.37Å; P97-V107 WeakPolarHBondContact CA-O 3.47Å; Y98-V107 HydrophobicContact CD1-CB 4.36Å; Y98-V107 HydrophobicContact CE1-CB 3.69Å; Y98-V107 HydrophobicContact CE1-CG1 3.78Å; Y98-V107 HydrophobicContact CE2-CB 4.02Å; Y98-V107 HydrophobicContact CE2-CG2 4.38Å; Y98-V107 VanDerWaalsContact CZ-CB 3.47Å; Y98-V107 PolarHBondContact N-O 3.25Å; Y98-V107 PolarHBondContact O-N 2.91Å; Y98-V107 WeakPolarHBondContact OH-CB 3.42Å; Y98-V107 WeakPolarHBondContact OH-CG1 3.48Å; Y100-V107 HydrophobicContact CG-CG2 4.2Å; T105-V107 HydrophobicContact CG2-CG2 4.06Å
108	M	86.3	Confident	82.9	Confident	7 Å²	7	47 Å²	47	3%	0.034	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	142.2	179.2	45.7	-178.7	-86.5	0	0	110.3	V36 S37 I38 I39 P97 L112 L113 I135	V36-M108 HydrophobicContact CG1-CG 4.06Å; V36-M108 HydrophobicContact CG1-SD 3.74Å; S37-M108 WeakPolarHBondContact O-CG 3.22Å; S37-M108 PolarHBondContact O-N 3.16Å; I38-M108 CarbonylContact C-O 3.01Å; I38-M108 VanDerWaalsContact CA-O 3.28Å; I38-M108 WeakPolarHBondContact CA-O 3.39Å; I38-M108 HydrophobicContact CD1-CE 4.09Å; I38-M108 HydrophobicContact CG1-CE 3.84Å; I38-M108 HydrophobicContact CG1-CG 3.81Å; I38-M108 HydrophobicContact CG1-SD 4.09Å; I39-M108 PolarHBondContact N-O 3.44Å; P97-M108 HydrophobicContact CB-CB 4.2Å; M108-L112 HydrophobicContact CB-CD1 3.95Å; M108-L113 HydrophobicContact CE-CD1 4.48Å; M108-L113 HydrophobicContact CE-CD2 3.48Å; M108-L113 VanDerWaalsContact CE-CD2 3.48Å; M108-L113 HydrophobicContact CE-CG 4.03Å; M108-I135 HydrophobicContact SD-CD1 4.34Å
109	S	83	Confident	83.4	Confident	3 Å²	3	47.7 Å²	47.7	2%	0.021	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	149.5	171.3	62.8	0	0	0	0	110.7	S92 T94 G111 L112	S92-S109 WeakPolarHBondContact O-CB 3.46Å; T94-S109 WeakPolarHBondContact O-CB 3.46Å; T94-S109 PolarHBondContact O-OG 2.92Å; S109-G111 PolarHBondContact O-N 3.49Å; S109-G111 VanDerWaalsContact O-N 3.12Å; S109-L112 WeakPolarHBondContact O-CB 3.22Å; S109-L112 PolarHBondContact O-N 3.47Å
110	S	82.8	Confident	83.9	Confident	46 Å²	46	50 Å²	50	32%	0.322	28%	0.281	S	S	.	.	G	3₁₀ helix	trans	-58.2	-21.8	171.4	61.2	0	0	0	0	112.7	I39 L112 L113 H114	I39-S110 PolarHBondContact O-N 3.38Å; S110-L112 PolarHBondContact O-N 3.42Å; S110-L113 WeakPolarHBondContact O-CA 3.08Å; S110-L113 VanDerWaalsContact O-CB 3.28Å; S110-L113 WeakPolarHBondContact O-CB 3.19Å; S110-L113 PolarHBondContact O-N 3.45Å; S110-H114 PolarHBondContact O-CD2 3.1Å
111	G	81.4	Confident	85	Confident	16 Å²	16	52.3 Å²	52.3	17%	0.165	30%	0.304	C	S	.	.	G	3₁₀ helix	trans	-56.1	-28.6	172.2	0	0	0	0	0	114.1	S109 L113 H114	S109-G111 PolarHBondContact O-N 3.49Å; S109-G111 VanDerWaalsContact O-N 3.12Å; G111-L113 PolarHBondContact O-N 3.32Å; G111-H114 PolarHBondContact O-N 3.41Å
112	L	87	Confident	86.2	Confident	1 Å²	1	53.3 Å²	53.3	1%	0.005	31%	0.305	C	S	.	.	G	3₁₀ helix	trans	-73.2	-9.8	174	-77.5	169.7	0	0	0	113.9	F95 P97 M108 S109 S110 F117 L131 L134	F95-L112 HydrophobicContact CB-CD2 4.45Å; F95-L112 VanDerWaalsContact O-CD2 3.23Å; F95-L112 WeakPolarHBondContact O-CD2 3.45Å; P97-L112 HydrophobicContact CB-CD1 4.46Å; P97-L112 HydrophobicContact CG-CD1 4.48Å; M108-L112 HydrophobicContact CB-CD1 3.95Å; S109-L112 WeakPolarHBondContact O-CB 3.22Å; S109-L112 PolarHBondContact O-N 3.47Å; S110-L112 PolarHBondContact O-N 3.42Å; L112-F117 HydrophobicContact CD2-CB 4.15Å; L112-F117 HydrophobicContact CD2-CD1 3.81Å; L112-F117 HydrophobicContact CD2-CD2 3.87Å; L112-F117 HydrophobicContact CD2-CE1 4.14Å; L112-F117 HydrophobicContact CD2-CE2 4.2Å; L112-F117 HydrophobicContact CD2-CG 3.66Å; L112-F117 HydrophobicContact CD2-CZ 4.32Å; L112-F117 VanDerWaalsContact O-CB 3.22Å; L112-F117 WeakPolarHBondContact O-CB 3.43Å; L112-L131 HydrophobicContact CB-CD1 4.42Å; L112-L134 HydrophobicContact CD2-CD1 3.78Å
113	L	86	Confident	87.4	Confident	62 Å²	62	48 Å²	48	33%	0.325	28%	0.281	S	S	.	.	G	3₁₀ helix	trans	-91.5	14.3	176.5	-55.6	178.6	0	0	0	112.5	I38 M108 S110 G111 L118 L131	I38-L113 HydrophobicContact CD1-CD1 4.23Å; I38-L113 HydrophobicContact CG2-CD1 4.24Å; M108-L113 HydrophobicContact CE-CD1 4.48Å; M108-L113 HydrophobicContact CE-CD2 3.48Å; M108-L113 VanDerWaalsContact CE-CD2 3.48Å; M108-L113 HydrophobicContact CE-CG 4.03Å; S110-L113 WeakPolarHBondContact O-CA 3.08Å; S110-L113 VanDerWaalsContact O-CB 3.28Å; S110-L113 WeakPolarHBondContact O-CB 3.19Å; S110-L113 PolarHBondContact O-N 3.45Å; G111-L113 PolarHBondContact O-N 3.32Å; L113-L118 HydrophobicContact CB-CD2 4.24Å; L113-L118 HydrophobicContact CD2-CD2 3.67Å; L113-L131 HydrophobicContact CD2-CD2 4.28Å
114	H	85.9	Confident	88.4	Confident	114 Å²	114	47 Å²	47	53%	0.528	28%	0.28	S	S	.	.	S	Bend	trans	-121.8	161.1	177.1	-66.8	-78.1	0	0	0	111.8	S110 G111 F117 L118	S110-H114 PolarHBondContact O-CD2 3.1Å; G111-H114 PolarHBondContact O-N 3.41Å; H114-F117 WeakPolarHBondContact O-CA 3.24Å; H114-F117 WeakPolarHBondContact O-CB 3.44Å; H114-F117 PolarHBondContact O-N 3.36Å; H114-L118 CarbonylContact C-O 3.57Å; H114-L118 WeakPolarHBondContact CA-O 3.19Å; H114-L118 PolarHBondContact O-N 2.89Å
115	P	89	Confident	88.9	Confident	71 Å²	71	51.6 Å²	51.6	46%	0.461	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.6	144	172.7	-25.1	35.2	0	0	0	111.5	F117 L118 N119	P115-F117 VanDerWaalsContact C-N 3.34Å; P115-L118 VanDerWaalsContact CD-O 3.25Å; P115-L118 WeakPolarHBondContact CD-O 3.42Å; P115-N119 HydrophobicContact CG-CB 4.08Å; P115-N119 WeakPolarHBondContact CG-ND2 3.34Å
116	P	87.8	Confident	89.2	Confident	79 Å²	79	54.9 Å²	54.9	51%	0.513	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	cis	-83.4	-0	5.5	34.8	-37	0	0	0	114.4	I130	P116-I130 VanDerWaalsContact O-CD1 3.23Å; P116-I130 WeakPolarHBondContact O-CD1 3.49Å
117	F	88.5	Confident	89.5	Confident	50 Å²	50	56.3 Å²	56.3	22%	0.219	33%	0.332	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.3	-39.1	-171.4	-53.9	-71.4	0	0	0	113.3	F95 L112 H114 P115 I130 L134	F95-F117 HydrophobicContact CB-CE2 4.1Å; F95-F117 HydrophobicContact CB-CZ 4.12Å; F95-F117 AromaticContact CD1-CE2 3.97Å; F95-F117 HydrophobicContact CD1-CE2 3.97Å; F95-F117 HydrophobicContact CG-CE2 4.29Å; L112-F117 HydrophobicContact CD2-CB 4.15Å; L112-F117 HydrophobicContact CD2-CD1 3.81Å; L112-F117 HydrophobicContact CD2-CD2 3.87Å; L112-F117 HydrophobicContact CD2-CE1 4.14Å; L112-F117 HydrophobicContact CD2-CE2 4.2Å; L112-F117 HydrophobicContact CD2-CG 3.66Å; L112-F117 HydrophobicContact CD2-CZ 4.32Å; L112-F117 VanDerWaalsContact O-CB 3.22Å; L112-F117 WeakPolarHBondContact O-CB 3.43Å; H114-F117 WeakPolarHBondContact O-CA 3.24Å; H114-F117 WeakPolarHBondContact O-CB 3.44Å; H114-F117 PolarHBondContact O-N 3.36Å; P115-F117 VanDerWaalsContact C-N 3.34Å; F117-I130 HydrophobicContact CB-CG2 4.38Å; F117-I130 HydrophobicContact CD1-CG2 3.95Å; F117-L134 HydrophobicContact CD1-CD1 4.02Å; F117-L134 HydrophobicContact CE1-CD1 4.47Å
118	L	89.7	Confident	89.8	Confident	37 Å²	37	59.6 Å²	59.6	19%	0.194	35%	0.345	C	S	.	.			trans	-148.2	130	178.9	-172.1	66.3	0	0	0	111	L113 H114 P115 K127 L131	L113-L118 HydrophobicContact CB-CD2 4.24Å; L113-L118 HydrophobicContact CD2-CD2 3.67Å; H114-L118 CarbonylContact C-O 3.57Å; H114-L118 WeakPolarHBondContact CA-O 3.19Å; H114-L118 PolarHBondContact O-N 2.89Å; P115-L118 VanDerWaalsContact CD-O 3.25Å; P115-L118 WeakPolarHBondContact CD-O 3.42Å; L118-K127 HydrophobicContact CD1-CB 4.35Å; L118-K127 HydrophobicContact CD1-CD 4.21Å; L118-K127 HydrophobicContact CD1-CG 3.81Å; L118-L131 HydrophobicContact CD1-CD2 4.21Å; L118-L131 HydrophobicContact CD2-CD2 4.05Å; L118-L131 HydrophobicContact CG-CD2 4.5Å
119	N	92.2	Very high	90.2	Very high	54 Å²	54	61.6 Å²	61.6	29%	0.289	37%	0.367	S	S	.	.			trans	-132.3	146	167.7	-163.7	-45.2	0	0	0	109.1	P115 S121 Y122 K127	P115-N119 HydrophobicContact CG-CB 4.08Å; P115-N119 WeakPolarHBondContact CG-ND2 3.34Å; N119-S121 PolarHBondContact O-N 3.24Å; N119-S121 PolarHBondContact OD1-N 3.49Å; N119-S121 PolarHBondContact OD1-OG 2.88Å; N119-S121 VanDerWaalsContact OD1-OG 3.06Å; N119-Y122 HydrophobicContact CB-CD1 3.6Å; N119-Y122 HydrophobicContact CB-CD2 3.71Å; N119-Y122 HydrophobicContact CB-CE1 3.62Å; N119-Y122 HydrophobicContact CB-CE2 3.72Å; N119-Y122 HydrophobicContact CB-CG 3.64Å; N119-Y122 WeakPolarHBondContact O-CB 3.35Å; N119-Y122 PolarHBondContact O-N 2.85Å; N119-K127 WeakPolarHBondContact O-CE 3.23Å
120	A	90	Very high	90.7	Very high	93 Å²	93	64.5 Å²	64.5	77%	0.769	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.6	-40.9	172.1	0	0	0	0	0	111.7	Y122 K127	A120-Y122 VanDerWaalsContact C-N 3.3Å; A120-Y122 PolarHBondContact O-N 3.28Å; A120-K127 PolarHBondContact O-NZ 3.44Å
121	S	95.3	Very high	91.1	Very high	97 Å²	97	62.9 Å²	62.9	68%	0.678	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.5	-14.6	-178	63	0	0	0	0	114.8	N119	N119-S121 PolarHBondContact O-N 3.24Å; N119-S121 PolarHBondContact OD1-N 3.49Å; N119-S121 PolarHBondContact OD1-OG 2.88Å; N119-S121 VanDerWaalsContact OD1-OG 3.06Å
122	Y	95.1	Very high	91.6	Very high	52 Å²	52	62.3 Å²	62.3	20%	0.204	36%	0.364	C	S	.	.	S	Bend	trans	-64.9	140.8	178.5	-70.2	-8.7	0	0	0	111.5	N119 A120 E126 K127	N119-Y122 HydrophobicContact CB-CD1 3.6Å; N119-Y122 HydrophobicContact CB-CD2 3.71Å; N119-Y122 HydrophobicContact CB-CE1 3.62Å; N119-Y122 HydrophobicContact CB-CE2 3.72Å; N119-Y122 HydrophobicContact CB-CG 3.64Å; N119-Y122 WeakPolarHBondContact O-CB 3.35Å; N119-Y122 PolarHBondContact O-N 2.85Å; A120-Y122 VanDerWaalsContact C-N 3.3Å; A120-Y122 PolarHBondContact O-N 3.28Å; Y122-E126 HydrophobicContact CD2-CB 4.37Å; Y122-E126 HydrophobicContact CG-CB 4.19Å; Y122-K127 WeakPolarHBondContact O-CE 3.45Å; Y122-K127 PolarHBondContact O-NZ 2.91Å
123	S	95.6	Very high	91.9	Very high	56 Å²	56	69.8 Å²	69.8	39%	0.392	39%	0.392	S	S	.	.			trans	-59.2	160.2	168.5	67.7	0	0	0	0	110.9	S125 E126 K127	S123-S125 PolarHBondContact O-N 2.92Å; S123-E126 VanDerWaalsContact CB-OE2 3.28Å; S123-E126 WeakPolarHBondContact CB-OE2 2.97Å; S123-E126 PolarHBondContact N-OE2 2.91Å; S123-E126 PolarHBondContact O-N 3.23Å; S123-E126 WeakPolarHBondContact OG-CG 3.4Å; S123-E126 PolarHBondContact OG-N 3.46Å; S123-E126 PolarHBondContact OG-OE2 3.48Å; S123-K127 WeakPolarHBondContact O-CG 3.37Å; S123-K127 PolarHBondContact O-N 3.26Å; S123-K127 VanDerWaalsContact O-N 3.08Å
124	M	93.6	Very high	92.2	Very high	122 Å²	122	67.4 Å²	67.4	60%	0.601	38%	0.38	S	S	*	.	H	α-helix	trans	-60.7	-35.2	175.7	-72.6	-61.5	146.8	0	0	111.8	E126 K127 Y128	M124-E126 PolarHBondContact O-N 2.83Å; M124-K127 HydrophobicContact CE-CD 4.08Å; M124-K127 PolarHBondContact O-N 3.27Å; M124-K127 HydrophobicContact SD-CD 4.13Å; M124-Y128 HydrophobicContact CB-CD2 4.49Å; M124-Y128 WeakPolarHBondContact O-CB 3.47Å; M124-Y128 VanDerWaalsContact O-CD2 3.31Å; M124-Y128 WeakPolarHBondContact O-CD2 3.13Å; M124-Y128 PolarHBondContact O-N 3.31Å
125	S	94.6	Very high	92.5	Very high	98 Å²	98	62.4 Å²	62.4	69%	0.685	36%	0.357	S	S	*	.	H	α-helix	trans	-60.1	-43.9	176.5	-54.6	0	0	0	0	112.1	S123 G129	S123-S125 PolarHBondContact O-N 2.92Å; S125-G129 WeakPolarHBondContact O-CA 3.46Å; S125-G129 PolarHBondContact O-N 3.01Å
126	E	95	Very high	92.7	Very high	90 Å²	90	59.9 Å²	59.9	42%	0.421	34%	0.343	S	S	.	.	H	α-helix	trans	-66.1	-44.6	176.6	-72.8	162.5	120.2	0	0	111.5	Y122 S123 M124 Y128 G129 I130	Y122-E126 HydrophobicContact CD2-CB 4.37Å; Y122-E126 HydrophobicContact CG-CB 4.19Å; S123-E126 VanDerWaalsContact CB-OE2 3.28Å; S123-E126 WeakPolarHBondContact CB-OE2 2.97Å; S123-E126 PolarHBondContact N-OE2 2.91Å; S123-E126 PolarHBondContact O-N 3.23Å; S123-E126 WeakPolarHBondContact OG-CG 3.4Å; S123-E126 PolarHBondContact OG-N 3.46Å; S123-E126 PolarHBondContact OG-OE2 3.48Å; M124-E126 PolarHBondContact O-N 2.83Å; E126-Y128 PolarHBondContact O-N 3.49Å; E126-G129 PolarHBondContact O-N 2.95Å; E126-I130 PolarHBondContact O-N 2.81Å
127	K	94.1	Very high	92.9	Very high	30 Å²	30	62.9 Å²	62.9	13%	0.13	34%	0.344	C	S	.	.	H	α-helix	trans	-59.9	-45.6	178.1	-67.8	175.2	171.2	147.5	0	111.8	M1 L118 N119 A120 Y122 S123 M124 L131 G132	M1-K127 HydrophobicContact CE-CB 3.75Å; L118-K127 HydrophobicContact CD1-CB 4.35Å; L118-K127 HydrophobicContact CD1-CD 4.21Å; L118-K127 HydrophobicContact CD1-CG 3.81Å; N119-K127 WeakPolarHBondContact O-CE 3.23Å; A120-K127 PolarHBondContact O-NZ 3.44Å; Y122-K127 WeakPolarHBondContact O-CE 3.45Å; Y122-K127 PolarHBondContact O-NZ 2.91Å; S123-K127 WeakPolarHBondContact O-CG 3.37Å; S123-K127 PolarHBondContact O-N 3.26Å; S123-K127 VanDerWaalsContact O-N 3.08Å; M124-K127 HydrophobicContact CE-CD 4.08Å; M124-K127 PolarHBondContact O-N 3.27Å; M124-K127 HydrophobicContact SD-CD 4.13Å; K127-L131 PolarHBondContact O-N 3.16Å; K127-L131 VanDerWaalsContact O-N 3.17Å; K127-G132 PolarHBondContact O-N 3.41Å; K127-G132 VanDerWaalsContact O-N 3.11Å
128	Y	93.8	Very high	93	Very high	74 Å²	74	61.8 Å²	61.8	29%	0.29	34%	0.34	S	S	.	.	I	π-helix	trans	-71.1	-34.3	175.7	-85.8	-75	0	0	0	112.7	M1 E4 M5 M124 E126 G132 W133	M1-Y128 WeakPolarHBondContact CA-OH 3.31Å; M1-Y128 HydrophobicContact CB-CE1 4.37Å; M1-Y128 HydrophobicContact CG-CD1 3.86Å; M1-Y128 HydrophobicContact CG-CE1 3.36Å; M1-Y128 HydrophobicContact CG-CE2 4.47Å; M1-Y128 HydrophobicContact SD-CD1 4.43Å; M1-Y128 HydrophobicContact SD-CE1 4.47Å; E4-Y128 PolarHBondContact OE2-OH 3.02Å; M5-Y128 HydrophobicContact CG-CE1 4.03Å; M5-Y128 HydrophobicContact SD-CE1 4.47Å; M124-Y128 HydrophobicContact CB-CD2 4.49Å; M124-Y128 WeakPolarHBondContact O-CB 3.47Å; M124-Y128 VanDerWaalsContact O-CD2 3.31Å; M124-Y128 WeakPolarHBondContact O-CD2 3.13Å; M124-Y128 PolarHBondContact O-N 3.31Å; E126-Y128 PolarHBondContact O-N 3.49Å; Y128-G132 CarbonylContact O-C 3.52Å; Y128-G132 WeakPolarHBondContact O-CA 3.46Å; Y128-G132 PolarHBondContact O-N 2.79Å; Y128-W133 PolarHBondContact O-N 2.83Å
129	G	93.8	Very high	93.1	Very high	48 Å²	48	60.2 Å²	60.2	50%	0.495	33%	0.332	S	S	.	.	I	π-helix	trans	-67.2	-35.5	-179.3	0	0	0	0	0	113.5	S125 E126 W133	S125-G129 WeakPolarHBondContact O-CA 3.46Å; S125-G129 PolarHBondContact O-N 3.01Å; E126-G129 PolarHBondContact O-N 2.95Å; G129-W133 WeakPolarHBondContact O-CB 3.45Å
130	I	92.5	Very high	93.1	Very high	65 Å²	65	61.3 Å²	61.3	33%	0.333	34%	0.337	S	S	.	.	I	π-helix	trans	-99.5	-71.9	-178.8	-52.9	172.3	0	0	0	110.7	P116 F117 E126 G132 W133 L134	P116-I130 VanDerWaalsContact O-CD1 3.23Å; P116-I130 WeakPolarHBondContact O-CD1 3.49Å; F117-I130 HydrophobicContact CB-CG2 4.38Å; F117-I130 HydrophobicContact CD1-CG2 3.95Å; E126-I130 PolarHBondContact O-N 2.81Å; I130-G132 PolarHBondContact O-N 2.83Å; I130-W133 PolarHBondContact O-N 2.77Å; I130-L134 WeakPolarHBondContact O-CG 3.29Å; I130-L134 PolarHBondContact O-N 2.97Å
131	L	91.7	Very high	93	Very high	11 Å²	11	59.8 Å²	59.8	6%	0.058	32%	0.321	C	S	.	.	I	π-helix	trans	-67.3	-40.7	-176.1	-174.2	63.1	0	0	0	111.5	M1 L112 L113 L118 K127 W133 L134 I135	M1-L131 HydrophobicContact CE-CD2 4.41Å; M1-L131 HydrophobicContact SD-CB 4.38Å; M1-L131 HydrophobicContact SD-CD2 4.42Å; M1-L131 HydrophobicContact SD-CG 4.34Å; L112-L131 HydrophobicContact CB-CD1 4.42Å; L113-L131 HydrophobicContact CD2-CD2 4.28Å; L118-L131 HydrophobicContact CD1-CD2 4.21Å; L118-L131 HydrophobicContact CD2-CD2 4.05Å; L118-L131 HydrophobicContact CG-CD2 4.5Å; K127-L131 PolarHBondContact O-N 3.16Å; K127-L131 VanDerWaalsContact O-N 3.17Å; L131-W133 VanDerWaalsContact C-N 3.31Å; L131-W133 PolarHBondContact O-N 3.28Å; L131-L134 PolarHBondContact O-N 2.97Å; L131-I135 HydrophobicContact CD1-CD1 4.15Å; L131-I135 HydrophobicContact CD1-CG1 4.41Å; L131-I135 HydrophobicContact CG-CD1 3.93Å; L131-I135 WeakPolarHBondContact O-CG1 3.5Å; L131-I135 PolarHBondContact O-N 3.38Å
132	G	93	Very high	92.7	Very high	5 Å²	5	56.6 Å²	56.6	5%	0.052	30%	0.296	C	S	.	.	I	π-helix	trans	-61.2	-37.9	174.4	0	0	0	0	0	112.6	M5 K127 Y128 I130 G136	M5-G132 WeakPolarHBondContact CE-O 3.39Å; K127-G132 PolarHBondContact O-N 3.41Å; K127-G132 VanDerWaalsContact O-N 3.11Å; Y128-G132 CarbonylContact O-C 3.52Å; Y128-G132 WeakPolarHBondContact O-CA 3.46Å; Y128-G132 PolarHBondContact O-N 2.79Å; I130-G132 PolarHBondContact O-N 2.83Å; G132-G136 WeakPolarHBondContact O-CA 3.38Å; G132-G136 PolarHBondContact O-N 3.11Å
133	W	93.4	Very high	92.6	Very high	157 Å²	157	54.1 Å²	54.1	60%	0.595	29%	0.286	S	S	*	.	H	α-helix	trans	-66.2	-45	174.8	-177.5	90.3	0	0	0	112.2	Y128 G129 I130 L131 I135 G136 R137	Y128-W133 PolarHBondContact O-N 2.83Å; G129-W133 WeakPolarHBondContact O-CB 3.45Å; I130-W133 PolarHBondContact O-N 2.77Å; L131-W133 VanDerWaalsContact C-N 3.31Å; L131-W133 PolarHBondContact O-N 3.28Å; W133-I135 PolarHBondContact O-N 3.4Å; W133-G136 PolarHBondContact O-N 2.92Å; W133-R137 WeakPolarHBondContact O-CB 3.28Å; W133-R137 PolarHBondContact O-N 3.31Å
134	L	92.2	Very high	92.2	Very high	13 Å²	13	53.3 Å²	53.3	7%	0.068	28%	0.276	C	S	.	.	H	α-helix	trans	-60.3	-47.7	179.1	-74.1	171.9	0	0	0	112.2	L96 P97 L112 F117 I130 L131	L96-L134 HydrophobicContact CD2-CD2 4.06Å; P97-L134 HydrophobicContact CG-CB 3.98Å; L112-L134 HydrophobicContact CD2-CD1 3.78Å; F117-L134 HydrophobicContact CD1-CD1 4.02Å; F117-L134 HydrophobicContact CE1-CD1 4.47Å; I130-L134 WeakPolarHBondContact O-CG 3.29Å; I130-L134 PolarHBondContact O-N 2.97Å; L131-L134 PolarHBondContact O-N 2.97Å
135	I	91.4	Very high	91.3	Very high	8 Å²	8	48.8 Å²	48.8	4%	0.041	26%	0.26	C	S	.	.	H	α-helix	trans	-66.4	-42.3	176.4	-65.1	170.9	0	0	0	110	F2 M5 I106 M108 L131 W133 R137 Q138 I139	F2-I135 HydrophobicContact CD2-CG2 3.71Å; F2-I135 HydrophobicContact CE2-CG2 4.19Å; M5-I135 HydrophobicContact CE-CB 4.02Å; M5-I135 HydrophobicContact CE-CG2 3.93Å; M5-I135 HydrophobicContact SD-CG2 4.34Å; I106-I135 HydrophobicContact CD1-CG2 4.49Å; M108-I135 HydrophobicContact SD-CD1 4.34Å; L131-I135 HydrophobicContact CD1-CD1 4.15Å; L131-I135 HydrophobicContact CD1-CG1 4.41Å; L131-I135 HydrophobicContact CG-CD1 3.93Å; L131-I135 WeakPolarHBondContact O-CG1 3.5Å; L131-I135 PolarHBondContact O-N 3.38Å; W133-I135 PolarHBondContact O-N 3.4Å; I135-R137 VanDerWaalsContact C-N 3.31Å; I135-R137 PolarHBondContact O-N 3.41Å; I135-Q138 PolarHBondContact O-N 3.11Å; I135-Q138 VanDerWaalsContact O-N 3.1Å; I135-I139 HydrophobicContact CG2-CD1 3.99Å; I135-I139 HydrophobicContact CG2-CG1 4.35Å; I135-I139 WeakPolarHBondContact O-CG1 3.4Å; I135-I139 PolarHBondContact O-N 3.29Å
136	G	93.4	Very high	89.7	Confident	18 Å²	18	48.5 Å²	48.5	19%	0.186	25%	0.251	C	S	.	.	H	α-helix	trans	-61.5	-39.9	-177.5	0	0	0	0	0	112.2	M5 G132 W133 Q138 I139 I140	M5-G136 VanDerWaalsContact CE-N 3.28Å; G132-G136 WeakPolarHBondContact O-CA 3.38Å; G132-G136 PolarHBondContact O-N 3.11Å; W133-G136 PolarHBondContact O-N 2.92Å; G136-Q138 VanDerWaalsContact C-N 3.33Å; G136-Q138 PolarHBondContact O-N 3Å; G136-I139 PolarHBondContact O-N 3.42Å; G136-I140 WeakPolarHBondContact O-CG1 3.34Å; G136-I140 PolarHBondContact O-N 2.97Å
137	R	91.4	Very high	87.7	Confident	142 Å²	142	49 Å²	49	54%	0.536	25%	0.25	S	C	.	.	H	α-helix	trans	-57.2	-45	173.6	-178.7	-179.2	172.3	-157.1	-3.1	112	W133 I135 I140 S141	W133-R137 WeakPolarHBondContact O-CB 3.28Å; W133-R137 PolarHBondContact O-N 3.31Å; I135-R137 VanDerWaalsContact C-N 3.31Å; I135-R137 PolarHBondContact O-N 3.41Å; R137-I140 PolarHBondContact O-N 3.16Å; R137-S141 WeakPolarHBondContact O-CB 3.44Å; R137-S141 PolarHBondContact O-N 3.24Å
138	Q	90.8	Very high	85.3	Confident	27 Å²	27	54 Å²	54	13%	0.126	27%	0.273	C	S	.	.	H	α-helix	trans	-66.1	-44.1	178.7	-62.5	-59.1	-39.6	0	0	111.4	P97 T99 I106 I135 G136 I140 S141 I142	P97-Q138 HydrophobicContact CB-CG 4.04Å; P97-Q138 HydrophobicContact CG-CG 3.91Å; P97-Q138 PolarHBondContact O-NE2 3.36Å; T99-Q138 PolarHBondContact OG1-OE1 3.12Å; I106-Q138 HydrophobicContact CD1-CB 3.73Å; I106-Q138 HydrophobicContact CG1-CB 3.87Å; I106-Q138 HydrophobicContact CG2-CB 4.01Å; I106-Q138 HydrophobicContact CG2-CG 4.11Å; I135-Q138 PolarHBondContact O-N 3.11Å; I135-Q138 VanDerWaalsContact O-N 3.1Å; G136-Q138 VanDerWaalsContact C-N 3.33Å; G136-Q138 PolarHBondContact O-N 3Å; Q138-I140 PolarHBondContact O-N 3.04Å; Q138-S141 WeakPolarHBondContact O-CB 3.4Å; Q138-S141 PolarHBondContact O-N 3.05Å; Q138-I142 WeakPolarHBondContact O-CG1 3.42Å; Q138-I142 PolarHBondContact O-N 3.33Å
139	I	93	Very high	82.7	Confident	4 Å²	4	55.6 Å²	55.6	2%	0.021	30%	0.296	C	S	.	.	H	α-helix	trans	-56.4	-50.4	175.9	-64	173.3	0	0	0	110.6	F2 M5 L9 I34 I106 I135 G136 S141 I142 V143	F2-I139 HydrophobicContact CD2-CD1 3.98Å; F2-I139 HydrophobicContact CE2-CD1 3.69Å; F2-I139 HydrophobicContact CE2-CG1 4.07Å; M5-I139 HydrophobicContact CB-CD1 4.39Å; M5-I139 HydrophobicContact CE-CD1 4.14Å; L9-I139 HydrophobicContact CD2-CG2 3.32Å; I34-I139 HydrophobicContact CD1-CB 4.41Å; I34-I139 HydrophobicContact CD1-CG2 3.85Å; I34-I139 HydrophobicContact CG2-CG1 4.41Å; I106-I139 HydrophobicContact CD1-CG1 3.6Å; I135-I139 HydrophobicContact CG2-CD1 3.99Å; I135-I139 HydrophobicContact CG2-CG1 4.35Å; I135-I139 WeakPolarHBondContact O-CG1 3.4Å; I135-I139 PolarHBondContact O-N 3.29Å; G136-I139 PolarHBondContact O-N 3.42Å; I139-S141 VanDerWaalsContact C-N 3.31Å; I139-S141 PolarHBondContact O-N 3.5Å; I139-I142 PolarHBondContact O-N 3.11Å; I139-V143 HydrophobicContact CG2-CG2 4.34Å; I139-V143 VanDerWaalsContact O-CG2 3.23Å; I139-V143 WeakPolarHBondContact O-CG2 3.43Å; I139-V143 PolarHBondContact O-N 3.04Å
140	I	91.4	Very high	80.1	Confident	78 Å²	78	62.7 Å²	62.7	40%	0.4	31%	0.313	S	S	.	.	H	α-helix	trans	-62.1	-40.1	179.2	-67.5	-61.7	0	0	0	111.1	L9 G136 R137 Q138 I142 V143 F144	L9-I140 HydrophobicContact CD1-CD1 3.83Å; L9-I140 HydrophobicContact CD2-CD1 4.05Å; G136-I140 WeakPolarHBondContact O-CG1 3.34Å; G136-I140 PolarHBondContact O-N 2.97Å; R137-I140 PolarHBondContact O-N 3.16Å; Q138-I140 PolarHBondContact O-N 3.04Å; I140-I142 PolarHBondContact O-N 3.17Å; I140-V143 PolarHBondContact O-N 3.21Å; I140-F144 HydrophobicContact CD1-CD2 4.46Å; I140-F144 HydrophobicContact CD1-CE2 4.1Å; I140-F144 HydrophobicContact CG2-CD2 3.94Å; I140-F144 WeakPolarHBondContact O-CD2 3.39Å; I140-F144 PolarHBondContact O-N 3.44Å
141	S	87.7	Confident	77.5	Confident	61 Å²	61	65.9 Å²	65.9	43%	0.427	33%	0.326	S	S	.	.	H	α-helix	trans	-60.8	-43.2	175.6	-165.5	0	0	0	0	112.3	R137 Q138 I139 G145	R137-S141 WeakPolarHBondContact O-CB 3.44Å; R137-S141 PolarHBondContact O-N 3.24Å; Q138-S141 WeakPolarHBondContact O-CB 3.4Å; Q138-S141 PolarHBondContact O-N 3.05Å; I139-S141 VanDerWaalsContact C-N 3.31Å; I139-S141 PolarHBondContact O-N 3.5Å; S141-G145 WeakPolarHBondContact O-CA 3.43Å; S141-G145 PolarHBondContact O-N 2.94Å
142	I	90.2	Very high	74.9	Confident	30 Å²	30	73 Å²	73	15%	0.154	36%	0.359	C	S	.	.	H	α-helix	trans	-65.7	-45.1	177.4	-67	159.8	0	0	0	110.5	T30 I34 T99 I106 Q138 I139 I140	T30-I142 HydrophobicContact CG2-CG2 4Å; I34-I142 HydrophobicContact CD1-CB 4.05Å; I34-I142 HydrophobicContact CD1-CD1 4.22Å; I34-I142 HydrophobicContact CD1-CG2 3.88Å; I34-I142 HydrophobicContact CG1-CD1 4.33Å; I34-I142 HydrophobicContact CG1-CG2 4Å; I34-I142 HydrophobicContact CG2-CD1 4.09Å; T99-I142 HydrophobicContact CG2-CD1 3.93Å; T99-I142 HydrophobicContact CG2-CG1 3.86Å; I106-I142 HydrophobicContact CD1-CD1 4.13Å; I106-I142 HydrophobicContact CG1-CD1 3.69Å; Q138-I142 WeakPolarHBondContact O-CG1 3.42Å; Q138-I142 PolarHBondContact O-N 3.33Å; I139-I142 PolarHBondContact O-N 3.11Å; I140-I142 PolarHBondContact O-N 3.17Å
143	V	91	Very high	72.4	Confident	0 Å²	0	79.4 Å²	79.4	0%	0	40%	0.398	C	S	.	.	H	α-helix	trans	-66.2	-43.1	-176.6	174.1	0	0	0	0	111.3	L9 L13 K27 V31 I34 I139 I140	L9-V143 HydrophobicContact CD2-CG2 4.27Å; L13-V143 HydrophobicContact CD1-CG1 4.33Å; K27-V143 HydrophobicContact CB-CG1 3.94Å; K27-V143 HydrophobicContact CD-CG1 3.82Å; K27-V143 WeakPolarHBondContact CD-O 3.3Å; K27-V143 VanDerWaalsContact CE-O 3.32Å; K27-V143 WeakPolarHBondContact CE-O 3.22Å; K27-V143 HydrophobicContact CG-CG1 4.23Å; K27-V143 PolarHBondContact NZ-O 2.82Å; V31-V143 HydrophobicContact CG2-CG2 3.4Å; V31-V143 VanDerWaalsContact CG2-CG2 3.4Å; I34-V143 HydrophobicContact CD1-CG2 4.1Å; I139-V143 HydrophobicContact CG2-CG2 4.34Å; I139-V143 VanDerWaalsContact O-CG2 3.23Å; I139-V143 WeakPolarHBondContact O-CG2 3.43Å; I139-V143 PolarHBondContact O-N 3.04Å; I140-V143 PolarHBondContact O-N 3.21Å
144	F	87.4	Confident	69.8	Low	39 Å²	39	77.2 Å²	77.2	17%	0.171	39%	0.394	C	S	.	.	H	α-helix	trans	-104.4	2	-174.2	-63.4	-79.9	0	0	0	114.4	L13 W18 I140 D146 Y147 F167	L13-F144 HydrophobicContact CD2-CE2 4.48Å; L13-F144 HydrophobicContact CD2-CZ 3.81Å; W18-F144 AromaticContact CH2-CE1 3.75Å; W18-F144 HydrophobicContact CH2-CE1 3.75Å; W18-F144 AromaticContact CH2-CZ 4Å; W18-F144 HydrophobicContact CH2-CZ 4Å; W18-F144 HydrophobicContact CZ3-CE1 4.15Å; I140-F144 HydrophobicContact CD1-CD2 4.46Å; I140-F144 HydrophobicContact CD1-CE2 4.1Å; I140-F144 HydrophobicContact CG2-CD2 3.94Å; I140-F144 WeakPolarHBondContact O-CD2 3.39Å; I140-F144 PolarHBondContact O-N 3.44Å; F144-D146 VanDerWaalsContact C-N 3.29Å; F144-D146 PolarHBondContact O-N 3.43Å; F144-Y147 PolarHBondContact O-N 2.9Å; F144-F167 HydrophobicContact CB-CZ 4.26Å; F144-F167 AromaticContact CD1-CE2 3.64Å; F144-F167 HydrophobicContact CD1-CE2 3.64Å; F144-F167 AromaticContact CD1-CZ 3.61Å; F144-F167 HydrophobicContact CD1-CZ 3.61Å; F144-F167 AromaticContact CE1-CE2 3.95Å; F144-F167 HydrophobicContact CE1-CE2 3.95Å; F144-F167 HydrophobicContact CE1-CZ 4.38Å; F144-F167 HydrophobicContact CG-CZ 4.26Å
145	G	76.4	Confident	67.8	Low	27 Å²	27	87.8 Å²	87.8	28%	0.278	44%	0.435	S	S	.	.	G	3₁₀ helix	trans	-64.4	-23.6	-173.3	0	0	0	0	0	115.8	S141 Y147 Q148	S141-G145 WeakPolarHBondContact O-CA 3.43Å; S141-G145 PolarHBondContact O-N 2.94Å; G145-Y147 PolarHBondContact O-N 3.42Å; G145-Q148 PolarHBondContact O-N 3.1Å
146	D	60.7	Low	66	Low	92 Å²	92	92.4 Å²	92.4	49%	0.492	46%	0.456	S	S	.	.	G	3₁₀ helix	trans	-50.5	-23.2	176.4	-75.9	-16	0	0	0	113.5	K26 K27 F144	K26-D146 IonicContact NZ-OD2 3.16Å; K26-D146 PolarHBondContact NZ-OD2 2.9Å; K27-D146 IonicContact NZ-OD2 2.95Å; K27-D146 PolarHBondContact NZ-OD2 3.44Å; F144-D146 VanDerWaalsContact C-N 3.29Å; F144-D146 PolarHBondContact O-N 3.43Å
147	Y	52.1	Low	64.2	Low	99 Å²	99	94.1 Å²	94.1	39%	0.388	46%	0.464	S	S	.	.	G	3₁₀ helix	trans	-87.8	-14.5	-178.7	-71	-89	0	0	0	114.7	F144 G145 F167	F144-Y147 PolarHBondContact O-N 2.9Å; G145-Y147 PolarHBondContact O-N 3.42Å; Y147-F167 HydrophobicContact CD1-CD1 4.03Å; Y147-F167 HydrophobicContact CD1-CE1 4.03Å; Y147-F167 AromaticContact CD2-CD1 3.81Å; Y147-F167 HydrophobicContact CD2-CD1 3.81Å; Y147-F167 AromaticContact CD2-CE1 3.29Å; Y147-F167 HydrophobicContact CD2-CE1 3.29Å; Y147-F167 HydrophobicContact CD2-CZ 4.22Å; Y147-F167 AromaticContact CE1-CD1 3.77Å; Y147-F167 HydrophobicContact CE1-CD1 3.77Å; Y147-F167 HydrophobicContact CE1-CE1 4.18Å; Y147-F167 AromaticContact CE2-CD1 3.51Å; Y147-F167 HydrophobicContact CE2-CD1 3.51Å; Y147-F167 AromaticContact CE2-CE1 3.45Å; Y147-F167 HydrophobicContact CE2-CE1 3.45Å; Y147-F167 VanDerWaalsContact CE2-CE1 3.45Å; Y147-F167 HydrophobicContact CE2-CZ 4.43Å; Y147-F167 HydrophobicContact CG-CD1 4.05Å; Y147-F167 AromaticContact CG-CE1 3.59Å; Y147-F167 HydrophobicContact CG-CE1 3.59Å; Y147-F167 AromaticContact CZ-CD1 3.49Å; Y147-F167 VanDerWaalsContact CZ-CD1 3.49Å; Y147-F167 AromaticContact CZ-CE1 3.9Å
148	Q	44.5	Very low	62.7	Low	135 Å²	135	94.6 Å²	94.6	63%	0.631	47%	0.47	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.4	-20.8	180	-75.5	-161.8	-5.3	0	0	113.9	G145 K150	G145-Q148 PolarHBondContact O-N 3.1Å; Q148-K150 PolarHBondContact O-N 3.48Å
149	S	39.3	Very low	61.6	Low	109 Å²	109	96.3 Å²	96.3	76%	0.762	48%	0.484	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.5	-14.8	-170.7	-165.6	0	0	0	0	114.3
150	K	39.2	Very low	60.2	Low	196 Å²	196	101.9 Å²	101.9	85%	0.852	51%	0.51	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.8	-17.9	-174.5	-78.1	-172	175	-177.9	0	116.3	Q148	Q148-K150 PolarHBondContact O-N 3.48Å
151	E	37.5	Very low	58.6	Low	132 Å²	132	104.2 Å²	104.2	62%	0.617	53%	0.53	S	S	*	.			trans	-145.4	41.5	-172	-67.6	-169.6	160	0	0	115	T153 Q154	E151-T153 PolarHBondContact O-N 3.42Å; E151-Q154 PolarHBondContact O-N 3.38Å; E151-Q154 VanDerWaalsContact O-N 3.11Å
152	Q	37.1	Very low	57.2	Low	161 Å²	161	105.8 Å²	105.8	75%	0.752	55%	0.547	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.2	4.4	175.2	-85.8	-171	-5.2	0	0	115.6
153	T	39.9	Very low	55.7	Low	140 Å²	140	109.9 Å²	109.9	86%	0.859	57%	0.574	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.7	-9.1	169.3	50.2	0	0	0	0	114	E151	E151-T153 PolarHBondContact O-N 3.42Å
154	Q	39.9	Very low	54.4	Low	110 Å²	110	111.8 Å²	111.8	51%	0.514	59%	0.587	S	S	.	*			trans	-133.4	112.6	171.9	-85.3	-177.6	-5.6	0	0	111	E151 Q156	E151-Q154 PolarHBondContact O-N 3.38Å; E151-Q154 VanDerWaalsContact O-N 3.11Å; Q154-Q156 PolarHBondContact O-N 2.87Å
155	Y	48.9	Very low	54	Low	236 Å²	236	112.8 Å²	112.8	93%	0.925	60%	0.597	S	S	*	*	S	Bend	trans	-66.5	5.5	178.7	-99.6	-87.3	0	0	0	114.8
156	Q	54	Low	54.4	Low	104 Å²	104	115.3 Å²	115.3	49%	0.486	61%	0.608	S	S	.	*	S	Bend	trans	-131.3	125.5	178.5	-63.7	-152.7	-7.1	0	0	110.2	Q154 K158 N179	Q154-Q156 PolarHBondContact O-N 2.87Å; Q156-K158 PolarHBondContact O-N 3.16Å; Q156-N179 PolarHBondContact NE2-ND2 3.46Å; Q156-N179 PolarHBondContact NE2-OD1 2.77Å; Q156-N179 PolarHBondContact OE1-ND2 3.31Å
157	P	55	Low	55.4	Low	55 Å²	55	111.8 Å²	111.8	36%	0.357	59%	0.589	S	S	.	*			trans	-56.7	125	164.7	23.4	-29.1	0	0	0	107.6	C159	P157-C159 VanDerWaalsContact C-N 3.28Å; P157-C159 PolarHBondContact O-N 2.82Å; P157-C159 PolarHBondContact O-SG 3.28Å
158	K	59.8	Low	56.8	Low	151 Å²	151	110.6 Å²	110.6	66%	0.657	59%	0.587	S	S	*	*			trans	-67.5	95.2	168.7	-85.6	-175.1	178.7	-179	0	107.7	Q156 E160	Q156-K158 PolarHBondContact O-N 3.16Å; K158-E160 PolarHBondContact O-N 3.26Å
159	C	68.8	Low	58.7	Low	63 Å²	63	107.3 Å²	107.3	43%	0.426	58%	0.576	S	S	.	*			trans	-75.9	68.3	178.6	-63.3	0	0	0	0	110.4	P157 C172	P157-C159 VanDerWaalsContact C-N 3.28Å; P157-C159 PolarHBondContact O-N 2.82Å; P157-C159 PolarHBondContact O-SG 3.28Å; C159-C172 WeakPolarHBondContact CA-SG 3.48Å; C159-C172 HydrophobicContact CB-CB 3.74Å; C159-C172 WeakPolarHBondContact CB-SG 3.48Å; C159-C172 WeakPolarHBondContact SG-CA 3.31Å; C159-C172 WeakPolarHBondContact SG-CB 3.23Å; C159-C172 CovalentContact SG-SG 2.03Å; C159-C172 PolarHBondContact SG-SG 3.23Å
160	E	63.9	Low	60.9	Low	121 Å²	121	106 Å²	106	57%	0.565	56%	0.558	S	S	*	*			trans	-85.6	124.7	169.7	-76.3	-174.9	-170.8	0	0	109.6	K158 A162	K158-E160 PolarHBondContact O-N 3.26Å; E160-A162 PolarHBondContact O-N 2.95Å; E160-A162 VanDerWaalsContact O-N 3.11Å
161	P	58	Low	63	Low	127 Å²	127	99.6 Å²	99.6	83%	0.825	53%	0.532	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.9	-12.3	-168.1	24.1	-32.8	0	0	0	114.7
162	A	58.5	Low	65.3	Low	95 Å²	95	94.4 Å²	94.4	79%	0.785	51%	0.51	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.1	-15	-170.3	0	0	0	0	0	114.9	E160	E160-A162 PolarHBondContact O-N 2.95Å; E160-A162 VanDerWaalsContact O-N 3.11Å
163	T	57	Low	67.6	Low	115 Å²	115	91 Å²	91	71%	0.706	50%	0.503	S	S	*	.	T	Hydrogen-bonded Turn	trans	-130.5	1	-171.9	49.4	0	0	0	0	114.6	T165	T163-T165 PolarHBondContact O-N 3.35Å
164	S	65.5	Low	69.8	Low	40 Å²	40	88.7 Å²	88.7	28%	0.28	49%	0.485	S	S	.	.			trans	-75.7	127.5	-175.8	67.6	0	0	0	0	112.1	E168 T169	S164-E168 VanDerWaalsContact CA-OE2 3.31Å; S164-E168 WeakPolarHBondContact CA-OE2 3.24Å; S164-T169 PolarHBondContact OG-OG1 3.45Å; S164-T169 VanDerWaalsContact OG-OG1 3.06Å
165	T	78.7	Confident	71.8	Confident	61 Å²	61	84.3 Å²	84.3	37%	0.374	47%	0.467	S	S	.	.			trans	-57.9	156.5	164.3	61.3	0	0	0	0	110.7	T163 F167 E168 T169	T163-T165 PolarHBondContact O-N 3.35Å; T165-F167 PolarHBondContact O-N 2.69Å; T165-E168 PolarHBondContact N-OE2 2.6Å; T165-E168 WeakPolarHBondContact O-CB 3.37Å; T165-E168 PolarHBondContact O-N 3.12Å; T165-E168 VanDerWaalsContact OG1-CD 3.25Å; T165-E168 VanDerWaalsContact OG1-CG 3.31Å; T165-E168 WeakPolarHBondContact OG1-CG 3.34Å; T165-E168 PolarHBondContact OG1-N 3.06Å; T165-E168 PolarHBondContact OG1-OE2 2.9Å; T165-T169 PolarHBondContact O-N 3.36Å; T165-T169 PolarHBondContact O-OG1 3.08Å
166	P	83.7	Confident	73.4	Confident	80 Å²	80	75 Å²	75	52%	0.519	44%	0.443	S	S	.	.	H	α-helix	trans	-54.7	-30.3	179.3	-28.2	35.3	0	0	0	114.2	W18 Q170	W18-P166 HydrophobicContact CB-CB 4.06Å; W18-P166 WeakPolarHBondContact O-CB 3.39Å; P166-Q170 WeakPolarHBondContact O-CG 3.36Å; P166-Q170 PolarHBondContact O-N 3.31Å
167	F	82.3	Confident	74.8	Confident	18 Å²	18	76.5 Å²	76.5	8%	0.079	45%	0.45	C	S	.	.	H	α-helix	trans	-72.7	-44.6	174.7	179.1	-118.7	0	0	0	112.5	W18 F144 Y147 T165 T169 Q170 L171	W18-F167 HydrophobicContact CE3-CB 4.19Å; W18-F167 AromaticContact CE3-CD2 3.75Å; W18-F167 HydrophobicContact CE3-CD2 3.75Å; W18-F167 HydrophobicContact CE3-CG 4.44Å; W18-F167 AromaticContact CH2-CD2 3.94Å; W18-F167 HydrophobicContact CH2-CD2 3.94Å; W18-F167 HydrophobicContact CH2-CE2 4.11Å; W18-F167 HydrophobicContact CZ3-CB 4.33Å; W18-F167 AromaticContact CZ3-CD2 3.2Å; W18-F167 HydrophobicContact CZ3-CD2 3.2Å; W18-F167 AromaticContact CZ3-CE2 3.8Å; W18-F167 HydrophobicContact CZ3-CE2 3.8Å; W18-F167 HydrophobicContact CZ3-CG 4.12Å; F144-F167 HydrophobicContact CB-CZ 4.26Å; F144-F167 AromaticContact CD1-CE2 3.64Å; F144-F167 HydrophobicContact CD1-CE2 3.64Å; F144-F167 AromaticContact CD1-CZ 3.61Å; F144-F167 HydrophobicContact CD1-CZ 3.61Å; F144-F167 AromaticContact CE1-CE2 3.95Å; F144-F167 HydrophobicContact CE1-CE2 3.95Å; F144-F167 HydrophobicContact CE1-CZ 4.38Å; F144-F167 HydrophobicContact CG-CZ 4.26Å; Y147-F167 HydrophobicContact CD1-CD1 4.03Å; Y147-F167 HydrophobicContact CD1-CE1 4.03Å; Y147-F167 AromaticContact CD2-CD1 3.81Å; Y147-F167 HydrophobicContact CD2-CD1 3.81Å; Y147-F167 AromaticContact CD2-CE1 3.29Å; Y147-F167 HydrophobicContact CD2-CE1 3.29Å; Y147-F167 HydrophobicContact CD2-CZ 4.22Å; Y147-F167 AromaticContact CE1-CD1 3.77Å; Y147-F167 HydrophobicContact CE1-CD1 3.77Å; Y147-F167 HydrophobicContact CE1-CE1 4.18Å; Y147-F167 AromaticContact CE2-CD1 3.51Å; Y147-F167 HydrophobicContact CE2-CD1 3.51Å; Y147-F167 AromaticContact CE2-CE1 3.45Å; Y147-F167 HydrophobicContact CE2-CE1 3.45Å; Y147-F167 VanDerWaalsContact CE2-CE1 3.45Å; Y147-F167 HydrophobicContact CE2-CZ 4.43Å; Y147-F167 HydrophobicContact CG-CD1 4.05Å; Y147-F167 AromaticContact CG-CE1 3.59Å; Y147-F167 HydrophobicContact CG-CE1 3.59Å; Y147-F167 AromaticContact CZ-CD1 3.49Å; Y147-F167 VanDerWaalsContact CZ-CD1 3.49Å; Y147-F167 AromaticContact CZ-CE1 3.9Å; T165-F167 PolarHBondContact O-N 2.69Å; F167-T169 PolarHBondContact O-N 2.89Å; F167-Q170 WeakPolarHBondContact O-CA 3.28Å; F167-Q170 WeakPolarHBondContact O-CB 3.05Å; F167-Q170 PolarHBondContact O-N 3.08Å; F167-L171 HydrophobicContact CD1-CD1 4.05Å; F167-L171 HydrophobicContact CD1-CG 4.46Å; F167-L171 HydrophobicContact CE1-CD1 3.55Å; F167-L171 HydrophobicContact CE1-CD2 4.42Å; F167-L171 HydrophobicContact CE1-CG 4.04Å; F167-L171 HydrophobicContact CE2-CD2 4.33Å; F167-L171 HydrophobicContact CE2-CG 4.33Å; F167-L171 HydrophobicContact CZ-CD1 3.95Å; F167-L171 HydrophobicContact CZ-CD2 3.96Å; F167-L171 HydrophobicContact CZ-CG 4Å; F167-L171 PolarHBondContact O-N 2.68Å
168	E	80.7	Confident	76.1	Confident	74 Å²	74	79.1 Å²	79.1	35%	0.346	46%	0.459	S	S	.	.	H	α-helix	trans	-59.3	-36.3	174.3	-75.5	162.3	169.3	0	0	111.4	S164 T165 Q170 L171 C172	S164-E168 VanDerWaalsContact CA-OE2 3.31Å; S164-E168 WeakPolarHBondContact CA-OE2 3.24Å; T165-E168 PolarHBondContact N-OE2 2.6Å; T165-E168 WeakPolarHBondContact O-CB 3.37Å; T165-E168 PolarHBondContact O-N 3.12Å; T165-E168 VanDerWaalsContact OG1-CD 3.25Å; T165-E168 VanDerWaalsContact OG1-CG 3.31Å; T165-E168 WeakPolarHBondContact OG1-CG 3.34Å; T165-E168 PolarHBondContact OG1-N 3.06Å; T165-E168 PolarHBondContact OG1-OE2 2.9Å; E168-Q170 VanDerWaalsContact C-N 3.29Å; E168-Q170 PolarHBondContact O-N 3.19Å; E168-L171 PolarHBondContact O-N 3.32Å; E168-C172 WeakPolarHBondContact O-CB 3.49Å; E168-C172 PolarHBondContact O-N 3.17Å; E168-C172 PolarHBondContact O-SG 2.88Å; E168-C172 VanDerWaalsContact O-SG 3.38Å
169	T	84.1	Confident	76.9	Confident	66 Å²	66	74 Å²	74	41%	0.405	44%	0.439	S	S	.	.	H	α-helix	trans	-59	-39.5	172.2	-47.4	0	0	0	0	112	S164 T165 F167 C172 C173	S164-T169 PolarHBondContact OG-OG1 3.45Å; S164-T169 VanDerWaalsContact OG-OG1 3.06Å; T165-T169 PolarHBondContact O-N 3.36Å; T165-T169 PolarHBondContact O-OG1 3.08Å; F167-T169 PolarHBondContact O-N 2.89Å; T169-C172 PolarHBondContact O-N 3.46Å; T169-C173 PolarHBondContact O-N 2.88Å; T169-C173 VanDerWaalsContact O-N 3.14Å
170	Q	87	Confident	77.3	Confident	82 Å²	82	74 Å²	74	38%	0.383	44%	0.44	S	S	.	.	H	α-helix	trans	-66	-43.2	174.7	-56.7	-51.9	-54.8	0	0	111.7	W18 P166 F167 E168 C172 C173 L174	W18-Q170 HydrophobicContact CB-CG 4.3Å; W18-Q170 HydrophobicContact CD2-CG 3.88Å; W18-Q170 HydrophobicContact CE3-CG 4.29Å; W18-Q170 HydrophobicContact CG-CG 3.86Å; P166-Q170 WeakPolarHBondContact O-CG 3.36Å; P166-Q170 PolarHBondContact O-N 3.31Å; F167-Q170 WeakPolarHBondContact O-CA 3.28Å; F167-Q170 WeakPolarHBondContact O-CB 3.05Å; F167-Q170 PolarHBondContact O-N 3.08Å; E168-Q170 VanDerWaalsContact C-N 3.29Å; E168-Q170 PolarHBondContact O-N 3.19Å; Q170-C172 VanDerWaalsContact C-N 3.3Å; Q170-C172 PolarHBondContact O-N 3.23Å; Q170-C173 WeakPolarHBondContact O-CB 3.25Å; Q170-C173 PolarHBondContact O-N 3.23Å; Q170-L174 PolarHBondContact O-N 2.99Å
171	L	83.7	Confident	77.6	Confident	61 Å²	61	69.8 Å²	69.8	32%	0.319	43%	0.429	S	S	.	.	H	α-helix	trans	-63.4	-37.7	177.1	-67.3	-179.5	0	0	0	112	F167 E168 L174 S175	F167-L171 HydrophobicContact CD1-CD1 4.05Å; F167-L171 HydrophobicContact CD1-CG 4.46Å; F167-L171 HydrophobicContact CE1-CD1 3.55Å; F167-L171 HydrophobicContact CE1-CD2 4.42Å; F167-L171 HydrophobicContact CE1-CG 4.04Å; F167-L171 HydrophobicContact CE2-CD2 4.33Å; F167-L171 HydrophobicContact CE2-CG 4.33Å; F167-L171 HydrophobicContact CZ-CD1 3.95Å; F167-L171 HydrophobicContact CZ-CD2 3.96Å; F167-L171 HydrophobicContact CZ-CG 4Å; F167-L171 PolarHBondContact O-N 2.68Å; E168-L171 PolarHBondContact O-N 3.32Å; L171-L174 PolarHBondContact O-N 3.04Å; L171-S175 WeakPolarHBondContact O-CB 3.49Å; L171-S175 PolarHBondContact O-N 3.49Å
172	C	83.9	Confident	78	Confident	23 Å²	23	67.6 Å²	67.6	16%	0.155	41%	0.409	C	S	.	.	H	α-helix	trans	-64.3	-41.2	176.8	-82.3	0	0	0	0	112.9	C159 E168 T169 Q170 L174 S175 G176	C159-C172 WeakPolarHBondContact CA-SG 3.48Å; C159-C172 HydrophobicContact CB-CB 3.74Å; C159-C172 WeakPolarHBondContact CB-SG 3.48Å; C159-C172 WeakPolarHBondContact SG-CA 3.31Å; C159-C172 WeakPolarHBondContact SG-CB 3.23Å; C159-C172 CovalentContact SG-SG 2.03Å; C159-C172 PolarHBondContact SG-SG 3.23Å; E168-C172 WeakPolarHBondContact O-CB 3.49Å; E168-C172 PolarHBondContact O-N 3.17Å; E168-C172 PolarHBondContact O-SG 2.88Å; E168-C172 VanDerWaalsContact O-SG 3.38Å; T169-C172 PolarHBondContact O-N 3.46Å; Q170-C172 VanDerWaalsContact C-N 3.3Å; Q170-C172 PolarHBondContact O-N 3.23Å; C172-L174 VanDerWaalsContact C-N 3.34Å; C172-L174 PolarHBondContact O-N 3.28Å; C172-S175 PolarHBondContact O-N 3.31Å; C172-G176 PolarHBondContact O-N 2.67Å
173	C	86.7	Confident	78	Confident	88 Å²	88	67.1 Å²	67.1	60%	0.595	40%	0.396	S	S	*	.	H	α-helix	trans	-57.8	-47.9	172.9	-175.2	0	0	0	0	111.3	T169 Q170 S175 G176 Q177	T169-C173 PolarHBondContact O-N 2.88Å; T169-C173 VanDerWaalsContact O-N 3.14Å; Q170-C173 WeakPolarHBondContact O-CB 3.25Å; Q170-C173 PolarHBondContact O-N 3.23Å; C173-S175 PolarHBondContact O-N 3.22Å; C173-G176 PolarHBondContact O-N 3.41Å; C173-Q177 PolarHBondContact O-N 3.16Å
174	L	85.4	Confident	78.1	Confident	93 Å²	93	68.4 Å²	68.4	49%	0.487	40%	0.395	S	S	.	.	H	α-helix	trans	-61.7	-43	176.8	-75.6	162.7	0	0	0	112.3	Q170 L171 C172 Q177 I178	Q170-L174 PolarHBondContact O-N 2.99Å; L171-L174 PolarHBondContact O-N 3.04Å; C172-L174 VanDerWaalsContact C-N 3.34Å; C172-L174 PolarHBondContact O-N 3.28Å; L174-Q177 PolarHBondContact O-N 2.93Å; L174-I178 WeakPolarHBondContact O-CG1 3.38Å; L174-I178 PolarHBondContact O-N 2.99Å
175	S	82.8	Confident	77.9	Confident	18 Å²	18	74.3 Å²	74.3	13%	0.126	42%	0.415	C	S	.	.	H	α-helix	trans	-62.3	-44.4	177.6	-176.1	0	0	0	0	111.7	L171 C172 C173 Q177 I178 N179	L171-S175 WeakPolarHBondContact O-CB 3.49Å; L171-S175 PolarHBondContact O-N 3.49Å; C172-S175 PolarHBondContact O-N 3.31Å; C173-S175 PolarHBondContact O-N 3.22Å; S175-Q177 VanDerWaalsContact C-N 3.34Å; S175-Q177 PolarHBondContact O-N 3.4Å; S175-I178 PolarHBondContact O-N 3.17Å; S175-N179 WeakPolarHBondContact O-CB 3.16Å; S175-N179 VanDerWaalsContact O-CG 3.26Å; S175-N179 PolarHBondContact O-N 3.11Å; S175-N179 PolarHBondContact O-ND2 3.26Å; S175-N179 PolarHBondContact OG-ND2 3.07Å
176	G	82.9	Confident	77	Confident	41 Å²	41	77.2 Å²	77.2	42%	0.423	42%	0.424	S	S	.	.	H	α-helix	trans	-60	-42	175.4	0	0	0	0	0	112.8	C172 C173 N179 S180	C172-G176 PolarHBondContact O-N 2.67Å; C173-G176 PolarHBondContact O-N 3.41Å; G176-N179 PolarHBondContact O-N 3.24Å; G176-S180 WeakPolarHBondContact O-CB 2.98Å; G176-S180 PolarHBondContact O-N 2.74Å; G176-S180 PolarHBondContact O-OG 3.36Å; G176-S180 VanDerWaalsContact O-OG 3.05Å
177	Q	83.1	Confident	75.7	Confident	135 Å²	135	76.9 Å²	76.9	63%	0.631	42%	0.421	S	S	*	.	H	α-helix	trans	-62.1	-44.6	175.3	-172.8	-178.1	-1.2	0	0	112.1	C173 L174 S175 S180 G181	C173-Q177 PolarHBondContact O-N 3.16Å; L174-Q177 PolarHBondContact O-N 2.93Å; S175-Q177 VanDerWaalsContact C-N 3.34Å; S175-Q177 PolarHBondContact O-N 3.4Å; Q177-S180 PolarHBondContact O-OG 3.39Å; Q177-G181 PolarHBondContact O-N 2.94Å
178	I	81.7	Confident	74.3	Confident	109 Å²	109	84.2 Å²	84.2	56%	0.559	45%	0.449	S	S	*	.	H	α-helix	trans	-65.8	-46.6	179.2	-67.8	166.5	0	0	0	110.8	L174 S175 S180 G181 I182	L174-I178 WeakPolarHBondContact O-CG1 3.38Å; L174-I178 PolarHBondContact O-N 2.99Å; S175-I178 PolarHBondContact O-N 3.17Å; I178-S180 PolarHBondContact O-N 2.85Å; I178-G181 PolarHBondContact O-N 3.42Å; I178-I182 HydrophobicContact CG2-CD1 4.19Å; I178-I182 PolarHBondContact O-N 3.44Å
179	N	76.1	Confident	73.1	Confident	44 Å²	44	88.4 Å²	88.4	24%	0.235	47%	0.467	C	S	.	.	H	α-helix	trans	-65	-40.4	-176.8	-72.2	-20.7	0	0	0	112.3	Q156 S175 G176 G181 I182 V183	Q156-N179 PolarHBondContact NE2-ND2 3.46Å; Q156-N179 PolarHBondContact NE2-OD1 2.77Å; Q156-N179 PolarHBondContact OE1-ND2 3.31Å; S175-N179 WeakPolarHBondContact O-CB 3.16Å; S175-N179 VanDerWaalsContact O-CG 3.26Å; S175-N179 PolarHBondContact O-N 3.11Å; S175-N179 PolarHBondContact O-ND2 3.26Å; S175-N179 PolarHBondContact OG-ND2 3.07Å; G176-N179 PolarHBondContact O-N 3.24Å; N179-G181 VanDerWaalsContact C-N 3.27Å; N179-G181 PolarHBondContact O-N 2.98Å; N179-I182 PolarHBondContact O-N 2.89Å; N179-I182 VanDerWaalsContact O-N 3.13Å; N179-V183 WeakPolarHBondContact O-CG2 3.36Å; N179-V183 PolarHBondContact O-N 2.67Å; N179-V183 VanDerWaalsContact O-N 3.1Å
180	S	77.8	Confident	71.7	Confident	63 Å²	63	92.3 Å²	92.3	44%	0.441	48%	0.48	S	S	.	.	H	α-helix	trans	-60.7	-36.3	175.4	57.8	0	0	0	0	112.9	G176 Q177 I178 Q184	G176-S180 WeakPolarHBondContact O-CB 2.98Å; G176-S180 PolarHBondContact O-N 2.74Å; G176-S180 PolarHBondContact O-OG 3.36Å; G176-S180 VanDerWaalsContact O-OG 3.05Å; Q177-S180 PolarHBondContact O-OG 3.39Å; I178-S180 PolarHBondContact O-N 2.85Å; S180-Q184 WeakPolarHBondContact O-CG 3.47Å; S180-Q184 PolarHBondContact O-N 3.35Å
181	G	70.4	Confident	70.2	Confident	32 Å²	32	93.8 Å²	93.8	33%	0.33	50%	0.495	S	S	.	.	H	α-helix	trans	-69.5	-29.7	175.1	0	0	0	0	0	113.9	Q177 I178 N179 K185	Q177-G181 PolarHBondContact O-N 2.94Å; I178-G181 PolarHBondContact O-N 3.42Å; N179-G181 VanDerWaalsContact C-N 3.27Å; N179-G181 PolarHBondContact O-N 2.98Å; G181-K185 PolarHBondContact O-N 3.38Å
182	I	65.7	Low	68.8	Low	82 Å²	82	97.2 Å²	97.2	42%	0.421	51%	0.513	S	S	.	.	H	α-helix	trans	-69.7	-49.9	174.9	-65.6	169.3	0	0	0	109.9	I178 N179 Q184 K185 E186	I178-I182 HydrophobicContact CG2-CD1 4.19Å; I178-I182 PolarHBondContact O-N 3.44Å; N179-I182 PolarHBondContact O-N 2.89Å; N179-I182 VanDerWaalsContact O-N 3.13Å; I182-Q184 VanDerWaalsContact C-N 3.29Å; I182-Q184 PolarHBondContact O-N 3.25Å; I182-K185 WeakPolarHBondContact O-CB 3.28Å; I182-K185 PolarHBondContact O-N 3.42Å; I182-E186 PolarHBondContact O-N 3.36Å
183	V	59	Low	66.9	Low	84 Å²	84	104.5 Å²	104.5	51%	0.509	56%	0.557	S	S	.	*	H	α-helix	trans	-56.9	-44	-179.9	175.4	0	0	0	0	111	N179 K185 E186 T187	N179-V183 WeakPolarHBondContact O-CG2 3.36Å; N179-V183 PolarHBondContact O-N 2.67Å; N179-V183 VanDerWaalsContact O-N 3.1Å; V183-K185 VanDerWaalsContact C-N 3.28Å; V183-K185 PolarHBondContact O-N 2.87Å; V183-E186 PolarHBondContact O-N 3.02Å; V183-E186 VanDerWaalsContact O-N 3.13Å; V183-T187 PolarHBondContact O-N 3.38Å; V183-T187 PolarHBondContact O-OG1 2.75Å
184	Q	58.7	Low	65.9	Low	143 Å²	143	105.4 Å²	105.4	67%	0.668	56%	0.555	S	S	*	*	H	α-helix	trans	-60.2	-35	177.3	-74.9	-178.7	-1.6	0	0	113.6	S180 I182 Y188	S180-Q184 WeakPolarHBondContact O-CG 3.47Å; S180-Q184 PolarHBondContact O-N 3.35Å; I182-Q184 VanDerWaalsContact C-N 3.29Å; I182-Q184 PolarHBondContact O-N 3.25Å; Q184-Y188 PolarHBondContact O-N 3.48Å
185	K	60.5	Low	64.9	Low	164 Å²	164	106 Å²	106	71%	0.713	56%	0.559	S	S	*	*	H	α-helix	trans	-71.8	-31.3	176.9	-79.9	-177.8	177.2	177.9	0	112.8	G181 I182 V183	G181-K185 PolarHBondContact O-N 3.38Å; I182-K185 WeakPolarHBondContact O-CB 3.28Å; I182-K185 PolarHBondContact O-N 3.42Å; V183-K185 VanDerWaalsContact C-N 3.28Å; V183-K185 PolarHBondContact O-N 2.87Å
186	E	60.2	Low	63.9	Low	121 Å²	121	110.9 Å²	110.9	57%	0.565	58%	0.583	S	S	*	*	H	α-helix	trans	-73.8	-45.2	177.2	-70.3	178.8	166.8	0	0	111	I182 V183 Y188 K189 E190	I182-E186 PolarHBondContact O-N 3.36Å; V183-E186 PolarHBondContact O-N 3.02Å; V183-E186 VanDerWaalsContact O-N 3.13Å; E186-Y188 VanDerWaalsContact C-N 3.28Å; E186-Y188 PolarHBondContact O-N 2.92Å; E186-K189 WeakPolarHBondContact O-CB 3.46Å; E186-K189 PolarHBondContact O-N 2.83Å; E186-E190 PolarHBondContact O-N 2.99Å
187	T	56.3	Low	62.8	Low	74 Å²	74	115 Å²	115	45%	0.454	59%	0.592	S	S	.	*	H	α-helix	trans	-60.5	-38.4	177.2	-39.2	0	0	0	0	112	V183 K189 E190 T191	V183-T187 PolarHBondContact O-N 3.38Å; V183-T187 PolarHBondContact O-OG1 2.75Å; T187-K189 VanDerWaalsContact C-N 3.26Å; T187-K189 PolarHBondContact O-N 3.04Å; T187-E190 PolarHBondContact O-N 2.66Å; T187-T191 PolarHBondContact O-N 2.84Å; T187-T191 PolarHBondContact O-OG1 3.14Å
188	Y	52.6	Low	61.5	Low	171 Å²	171	113.8 Å²	113.8	67%	0.671	59%	0.59	S	S	*	*	H	α-helix	trans	-65.8	-27.5	177.7	-150.4	-90.5	0	0	0	113.1	Q184 E186 L192	Q184-Y188 PolarHBondContact O-N 3.48Å; E186-Y188 VanDerWaalsContact C-N 3.28Å; E186-Y188 PolarHBondContact O-N 2.92Å; Y188-L192 HydrophobicContact CD1-CD1 3.79Å; Y188-L192 HydrophobicContact CE1-CD1 3.72Å
189	K	55.7	Low	60.2	Low	163 Å²	163	114.1 Å²	114.1	71%	0.709	59%	0.592	S	S	*	*	H	α-helix	trans	-74.8	-35.9	175.1	-79.8	-177.5	174.5	-178	0	112.4	E186 T187 T191 L192	E186-K189 WeakPolarHBondContact O-CB 3.46Å; E186-K189 PolarHBondContact O-N 2.83Å; T187-K189 VanDerWaalsContact C-N 3.26Å; T187-K189 PolarHBondContact O-N 3.04Å; K189-T191 VanDerWaalsContact C-N 3.32Å; K189-L192 PolarHBondContact O-N 3.06Å
190	E	56	Low	59.1	Low	148 Å²	148	119.1 Å²	119.1	69%	0.692	62%	0.617	S	S	*	*	H	α-helix	trans	-72.9	-23.3	178.5	-70.2	-178.1	158.9	0	0	113	E186 T187 L192 T193	E186-E190 PolarHBondContact O-N 2.99Å; T187-E190 PolarHBondContact O-N 2.66Å; E190-L192 VanDerWaalsContact C-N 3.33Å; E190-T193 PolarHBondContact O-OG1 3.01Å
191	T	54.4	Low	57.6	Low	112 Å²	112	123.4 Å²	123.4	69%	0.687	63%	0.631	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.2	-5.7	178.8	-18.7	0	0	0	0	113.6	T187 K189	T187-T191 PolarHBondContact O-N 2.84Å; T187-T191 PolarHBondContact O-OG1 3.14Å; K189-T191 VanDerWaalsContact C-N 3.32Å
192	L	54.5	Low	56.6	Low	134 Å²	134	131 Å²	131	70%	0.702	66%	0.656	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107.5	4.3	-178.4	-84.5	164.7	0	0	0	113.5	Y188 K189 E190	Y188-L192 HydrophobicContact CD1-CD1 3.79Å; Y188-L192 HydrophobicContact CE1-CD1 3.72Å; K189-L192 PolarHBondContact O-N 3.06Å; E190-L192 VanDerWaalsContact C-N 3.33Å
193	T	45.3	Very low	55.7	Low	176 Å²	176	135.5 Å²	135.5	100%	1.08	68%	0.677	S	S	*	*			trans	-108.7	0	171	43.8	0	0	0	0	110.7	E190	E190-T193 PolarHBondContact O-OG1 3.01Å

Retrieved 193 of 193 residues in 308.5 ms (Link to these results)

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