1433G_RAT Loading...

14-3-3 protein gamma

Adapter protein implicated in the regulation of a large spectrum of both general and specialized signaling pathways. Binds to a large number of partners, usually by recognition of a phosphoserine or phosphothreonine motif. Binding generally results in the modulation of the activity of the binding partner. Promotes inactivation of WDR24 component of the GATOR2 complex by binding to phosphorylated WDR24. Participates in the positive regulation of NMDA glutamate receptor activity by promoting the L-glutamate secretion through interaction with BEST1. Reduces keratinocyte intercellular adhesion, via interacting with PKP1 and sequestering it in the cytoplasm, thereby reducing its incorporation into desmosomes. Plays a role in mitochondrial protein catabolic process (also named MALM) that promotes the degradation of damaged proteins inside mitochondria (By similarity).

AlphaFold DB (Q5RC20), UniProt , Accession P61983, Species RAT (Rattus norvegicus, Rat), Gene Ywhag, Length 247 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	54.8	Low	90.1	Very high	241 Å²	241	85.1 Å²	85.1	100%	1.187	41%	0.414	S	S	*	.				0	122.5	0	-147.1	165.8	-176	0	0	105.3	D3	M1-D3 PolarHBondContact O-N 3.38Å
2	V	71.6	Confident	90.8	Very high	94 Å²	94	83.5 Å²	83.5	57%	0.57	40%	0.4	S	S	*	.			trans	-71.4	123.4	177.5	-177.1	0	0	0	0	106.8	L7	V2-L7 HydrophobicContact CG1-CD1 3.47Å; V2-L7 VanDerWaalsContact CG1-CD1 3.47Å; V2-L7 HydrophobicContact CG1-CD2 3.79Å; V2-L7 HydrophobicContact CG1-CG 3.53Å
3	D	88.5	Confident	91.4	Very high	64 Å²	64	84.5 Å²	84.5	34%	0.342	41%	0.408	S	S	.	.			trans	-81.8	121.6	-177.7	-179.5	1.8	0	0	0	109.5	M1 E5 Q6 L7	M1-D3 PolarHBondContact O-N 3.38Å; D3-E5 PolarHBondContact O-N 3.43Å; D3-E5 WeakPolarHBondContact OD1-CB 3.5Å; D3-E5 PolarHBondContact OD1-N 3.14Å; D3-Q6 HydrophobicContact CB-CB 4.07Å; D3-Q6 HydrophobicContact CB-CG 3.83Å; D3-Q6 WeakPolarHBondContact O-CB 3.49Å; D3-Q6 PolarHBondContact O-N 3.06Å; D3-Q6 VanDerWaalsContact O-N 3.12Å; D3-Q6 PolarHBondContact OD2-NE2 3.35Å; D3-Q6 VanDerWaalsContact OD2-NE2 3.14Å; D3-L7 PolarHBondContact O-N 3.24Å; D3-L7 VanDerWaalsContact O-N 3.08Å
4	R	95.6	Very high	91.9	Very high	39 Å²	39	79.1 Å²	79.1	15%	0.147	38%	0.384	C	S	.	.	H	α-helix	trans	-53.8	-41.5	177.9	-176.1	-179.8	-178.1	122.6	-3	110.9	Q6 L7 V8 V30 L33 E35 P36 E41	R4-Q6 VanDerWaalsContact C-N 3.33Å; R4-Q6 PolarHBondContact O-N 3.29Å; R4-L7 PolarHBondContact O-N 3.28Å; R4-V8 HydrophobicContact CG-CG2 4.4Å; R4-V8 WeakPolarHBondContact O-CG2 3.43Å; R4-V8 PolarHBondContact O-N 3.31Å; R4-V30 HydrophobicContact CG-CG1 4.23Å; R4-L33 HydrophobicContact CB-CD1 3.7Å; R4-L33 HydrophobicContact CG-CD1 4.01Å; R4-E35 IonicContact CZ-OE2 2.84Å; R4-E35 IonicContact NH1-OE2 3.45Å; R4-E35 PolarHBondContact NH1-OE2 3.47Å; R4-P36 PolarHBondContact NH2-O 3.24Å; R4-E41 IonicContact CZ-OE1 4Å; R4-E41 IonicContact CZ-OE2 3.97Å; R4-E41 IonicContact NE-OE1 2.73Å; R4-E41 PolarHBondContact NE-OE1 3.12Å; R4-E41 IonicContact NE-OE2 3.77Å; R4-E41 IonicContact NH2-OE1 2.68Å; R4-E41 PolarHBondContact NH2-OE1 2.96Å; R4-E41 VanDerWaalsContact NH2-OE1 3.15Å; R4-E41 IonicContact NH2-OE2 2.83Å; R4-E41 PolarHBondContact NH2-OE2 3.22Å
5	E	95.6	Very high	92.3	Very high	146 Å²	146	78.4 Å²	78.4	68%	0.682	38%	0.38	S	S	*	.	H	α-helix	trans	-63.3	-41	-179.3	-171.1	175.7	178.4	0	0	111.2	D3 V8 Q9	D3-E5 PolarHBondContact O-N 3.43Å; D3-E5 WeakPolarHBondContact OD1-CB 3.5Å; D3-E5 PolarHBondContact OD1-N 3.14Å; E5-V8 PolarHBondContact O-N 3.06Å; E5-Q9 VanDerWaalsContact O-CB 3.29Å; E5-Q9 WeakPolarHBondContact O-CB 3.37Å; E5-Q9 PolarHBondContact O-N 2.8Å
6	Q	96.2	Very high	92.7	Very high	131 Å²	131	83.1 Å²	83.1	61%	0.612	40%	0.401	S	S	*	.	H	α-helix	trans	-66	-38.8	176.1	-68.4	173.6	28.8	0	0	112.4	D3 R4 K10	D3-Q6 HydrophobicContact CB-CB 4.07Å; D3-Q6 HydrophobicContact CB-CG 3.83Å; D3-Q6 WeakPolarHBondContact O-CB 3.49Å; D3-Q6 PolarHBondContact O-N 3.06Å; D3-Q6 VanDerWaalsContact O-N 3.12Å; D3-Q6 PolarHBondContact OD2-NE2 3.35Å; D3-Q6 VanDerWaalsContact OD2-NE2 3.14Å; R4-Q6 VanDerWaalsContact C-N 3.33Å; R4-Q6 PolarHBondContact O-N 3.29Å; Q6-K10 WeakPolarHBondContact O-CB 3.46Å; Q6-K10 PolarHBondContact O-N 2.73Å
7	L	97.2	Very high	93	Very high	16 Å²	16	82 Å²	82	8%	0.084	41%	0.409	C	S	.	.	H	α-helix	trans	-66.5	-45.2	176.6	-71.5	174	0	0	0	111.9	V2 D3 R4 Q9 K10 A11 N29 V30 L33	V2-L7 HydrophobicContact CG1-CD1 3.47Å; V2-L7 VanDerWaalsContact CG1-CD1 3.47Å; V2-L7 HydrophobicContact CG1-CD2 3.79Å; V2-L7 HydrophobicContact CG1-CG 3.53Å; D3-L7 PolarHBondContact O-N 3.24Å; D3-L7 VanDerWaalsContact O-N 3.08Å; R4-L7 PolarHBondContact O-N 3.28Å; L7-Q9 VanDerWaalsContact C-N 3.33Å; L7-Q9 PolarHBondContact O-N 2.94Å; L7-K10 WeakPolarHBondContact O-CB 3.33Å; L7-K10 PolarHBondContact O-N 2.95Å; L7-A11 PolarHBondContact O-N 3.18Å; L7-N29 HydrophobicContact CD1-CB 3.68Å; L7-N29 HydrophobicContact CD2-CB 3.9Å; L7-N29 HydrophobicContact CG-CB 4.43Å; L7-V30 HydrophobicContact CB-CG2 3.43Å; L7-V30 VanDerWaalsContact CB-CG2 3.43Å; L7-V30 HydrophobicContact CD1-CG2 3.99Å; L7-V30 HydrophobicContact CG-CG2 4.38Å; L7-L33 HydrophobicContact CD1-CD1 4.37Å
8	V	98	Very high	93.2	Very high	5 Å²	5	85.4 Å²	85.4	3%	0.03	42%	0.423	C	S	.	.	H	α-helix	trans	-63.1	-42.4	176.3	174.4	0	0	0	0	110.2	R4 E5 K10 A11 R12 V30 E41 L44	R4-V8 HydrophobicContact CG-CG2 4.4Å; R4-V8 WeakPolarHBondContact O-CG2 3.43Å; R4-V8 PolarHBondContact O-N 3.31Å; E5-V8 PolarHBondContact O-N 3.06Å; V8-K10 VanDerWaalsContact C-N 3.32Å; V8-K10 PolarHBondContact O-N 3.5Å; V8-A11 WeakPolarHBondContact O-CB 3.29Å; V8-A11 PolarHBondContact O-N 3.46Å; V8-A11 VanDerWaalsContact O-N 3.13Å; V8-R12 WeakPolarHBondContact O-CG 3.34Å; V8-R12 PolarHBondContact O-N 2.93Å; V8-V30 HydrophobicContact CG2-CG1 4.28Å; V8-V30 HydrophobicContact CG2-CG2 3.89Å; V8-E41 HydrophobicContact CG1-CG 4.45Å; V8-E41 HydrophobicContact CG2-CG 3.93Å; V8-E41 WeakPolarHBondContact CG2-OE1 3.44Å; V8-L44 HydrophobicContact CG1-CD1 3.94Å
9	Q	97.8	Very high	93.5	Very high	86 Å²	86	88.1 Å²	88.1	40%	0.402	43%	0.428	S	S	.	.	H	α-helix	trans	-62.8	-38.7	175.6	-171.7	59.7	19.3	0	0	112.2	E5 L7 A11 R12 L13	E5-Q9 VanDerWaalsContact O-CB 3.29Å; E5-Q9 WeakPolarHBondContact O-CB 3.37Å; E5-Q9 PolarHBondContact O-N 2.8Å; L7-Q9 VanDerWaalsContact C-N 3.33Å; L7-Q9 PolarHBondContact O-N 2.94Å; Q9-A11 VanDerWaalsContact C-N 3.34Å; Q9-R12 PolarHBondContact O-N 2.93Å; Q9-L13 WeakPolarHBondContact O-CG 3.36Å; Q9-L13 PolarHBondContact O-N 3.09Å
10	K	97.8	Very high	93.8	Very high	114 Å²	114	86.4 Å²	86.4	50%	0.496	42%	0.417	S	S	.	.	H	α-helix	trans	-62.1	-41.7	172.8	-175.2	-178.9	177.3	-174.5	0	111.5	Q6 L7 V8 L13 A14 A26	Q6-K10 WeakPolarHBondContact O-CB 3.46Å; Q6-K10 PolarHBondContact O-N 2.73Å; L7-K10 WeakPolarHBondContact O-CB 3.33Å; L7-K10 PolarHBondContact O-N 2.95Å; V8-K10 VanDerWaalsContact C-N 3.32Å; V8-K10 PolarHBondContact O-N 3.5Å; K10-L13 PolarHBondContact O-N 2.71Å; K10-A14 WeakPolarHBondContact O-CB 3.48Å; K10-A14 PolarHBondContact O-N 2.87Å; K10-A26 HydrophobicContact CB-CB 4.4Å; K10-A26 HydrophobicContact CD-CB 4.34Å; K10-A26 HydrophobicContact CG-CB 4.34Å
11	A	98.4	Very high	94	Very high	0 Å²	0	85.6 Å²	85.6	0%	0	42%	0.415	C	S	.	.	H	α-helix	trans	-62	-43.7	175.7	0	0	0	0	0	111.7	L7 V8 Q9 L13 A14 E15 M23 A26 M27	L7-A11 PolarHBondContact O-N 3.18Å; V8-A11 WeakPolarHBondContact O-CB 3.29Å; V8-A11 PolarHBondContact O-N 3.46Å; V8-A11 VanDerWaalsContact O-N 3.13Å; Q9-A11 VanDerWaalsContact C-N 3.34Å; A11-L13 PolarHBondContact O-N 3.15Å; A11-A14 PolarHBondContact O-N 2.81Å; A11-E15 PolarHBondContact O-N 3.13Å; A11-M23 HydrophobicContact CB-CG 4.12Å; A11-A26 HydrophobicContact CB-CB 3.99Å; A11-M27 HydrophobicContact CB-CG 3.79Å; A11-M27 HydrophobicContact CB-SD 3.58Å; A11-M27 VanDerWaalsContact CB-SD 3.58Å
12	R	98.3	Very high	96	Very high	66 Å²	66	77.4 Å²	77.4	25%	0.249	38%	0.376	C	S	.	.	H	α-helix	trans	-61.8	-42.1	175.5	-67.5	-178.3	-173	127.4	-3.5	112.7	V8 Q9 A14 E15 Q16 E40 L44	V8-R12 WeakPolarHBondContact O-CG 3.34Å; V8-R12 PolarHBondContact O-N 2.93Å; Q9-R12 PolarHBondContact O-N 2.93Å; R12-A14 VanDerWaalsContact C-N 3.34Å; R12-E15 PolarHBondContact O-N 3.22Å; R12-Q16 WeakPolarHBondContact O-CG 3.48Å; R12-Q16 PolarHBondContact O-N 3.09Å; R12-Q16 VanDerWaalsContact O-N 3.08Å; R12-E40 IonicContact CZ-OE1 2.95Å; R12-E40 IonicContact NE-OE1 3.09Å; R12-E40 PolarHBondContact NE-OE1 3.08Å; R12-E40 IonicContact NH2-OE1 3.2Å; R12-E40 PolarHBondContact NH2-OE1 3.22Å; R12-E40 IonicContact NH2-OE2 3.86Å; R12-E40 PolarHBondContact NH2-OE2 2.9Å; R12-E40 VanDerWaalsContact NH2-OE2 3.09Å; R12-L44 HydrophobicContact CG-CD1 4.17Å; R12-L44 HydrophobicContact CG-CD2 4.41Å
13	L	98.4	Very high	97.3	Very high	96 Å²	96	73 Å²	73	50%	0.503	35%	0.349	S	S	.	.	H	α-helix	trans	-64.7	-39.8	175.3	-71	171.7	0	0	0	111.7	Q9 K10 A11 Q16 A17	Q9-L13 WeakPolarHBondContact O-CG 3.36Å; Q9-L13 PolarHBondContact O-N 3.09Å; K10-L13 PolarHBondContact O-N 2.71Å; A11-L13 PolarHBondContact O-N 3.15Å; L13-Q16 PolarHBondContact O-N 2.95Å; L13-A17 WeakPolarHBondContact O-CB 3.27Å; L13-A17 PolarHBondContact O-N 2.74Å; L13-A17 VanDerWaalsContact O-N 3.14Å
14	A	98.5	Very high	97.8	Very high	9 Å²	9	70.2 Å²	70.2	7%	0.074	34%	0.336	C	S	.	.	H	α-helix	trans	-66.1	-39	176.2	0	0	0	0	0	112	K10 A11 R12 A17 E18 R19 D22 M23	K10-A14 WeakPolarHBondContact O-CB 3.48Å; K10-A14 PolarHBondContact O-N 2.87Å; A11-A14 PolarHBondContact O-N 2.81Å; R12-A14 VanDerWaalsContact C-N 3.34Å; A14-A17 CarbonylContact O-C 3.47Å; A14-A17 PolarHBondContact O-N 3.33Å; A14-E18 PolarHBondContact O-N 2.73Å; A14-R19 HydrophobicContact CB-CB 4.34Å; A14-R19 PolarHBondContact O-N 3.29Å; A14-D22 HydrophobicContact CB-CB 4.01Å; A14-M23 HydrophobicContact CB-CB 3.87Å
15	E	98.2	Very high	97.9	Very high	69 Å²	69	70.7 Å²	70.7	32%	0.322	35%	0.348	S	S	.	.	H	α-helix	trans	-59.4	-50	173.4	-176.6	-179.7	-150.1	0	0	111.6	A11 R12 A17 E18 M23 L44	A11-E15 PolarHBondContact O-N 3.13Å; R12-E15 PolarHBondContact O-N 3.22Å; E15-A17 PolarHBondContact O-N 3.36Å; E15-E18 PolarHBondContact O-N 3.29Å; E15-M23 HydrophobicContact CB-CE 3.88Å; E15-M23 HydrophobicContact CB-SD 3.9Å; E15-M23 HydrophobicContact CG-CE 4.1Å; E15-M23 HydrophobicContact CG-SD 4.33Å; E15-L44 WeakPolarHBondContact OE2-CD2 3.48Å
16	Q	97.8	Very high	98	Very high	154 Å²	154	63.8 Å²	63.8	72%	0.72	32%	0.315	S	S	*	.	H	α-helix	trans	-61.6	-27.4	178.1	-69.9	175.2	27.4	0	0	113.3	R12 L13	R12-Q16 WeakPolarHBondContact O-CG 3.48Å; R12-Q16 PolarHBondContact O-N 3.09Å; R12-Q16 VanDerWaalsContact O-N 3.08Å; L13-Q16 PolarHBondContact O-N 2.95Å
17	A	98	Very high	98.1	Very high	64 Å²	64	57.5 Å²	57.5	53%	0.529	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.4	5.2	176.1	0	0	0	0	0	113.3	L13 A14 E15 R19	L13-A17 WeakPolarHBondContact O-CB 3.27Å; L13-A17 PolarHBondContact O-N 2.74Å; L13-A17 VanDerWaalsContact O-N 3.14Å; A14-A17 CarbonylContact O-C 3.47Å; A14-A17 PolarHBondContact O-N 3.33Å; E15-A17 PolarHBondContact O-N 3.36Å; A17-R19 HydrophobicContact CB-CG 3.92Å; A17-R19 WeakPolarHBondContact O-CG 3.4Å; A17-R19 PolarHBondContact O-N 3.46Å; A17-R19 VanDerWaalsContact O-N 3.12Å
18	E	97.7	Very high	98.2	Very high	143 Å²	143	59.6 Å²	59.6	67%	0.668	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.1	29.2	-175.5	-56.8	-174	161.2	0	0	113.6	A14 E15 Y20	A14-E18 PolarHBondContact O-N 2.73Å; E15-E18 PolarHBondContact O-N 3.29Å; E18-Y20 HydrophobicContact CB-CE2 3.94Å; E18-Y20 WeakPolarHBondContact O-CD2 3.5Å; E18-Y20 PolarHBondContact O-N 2.92Å
19	R	98.3	Very high	98.2	Very high	136 Å²	136	62.8 Å²	62.8	51%	0.513	31%	0.312	S	S	.	.			trans	-93.7	66	179.5	-65.8	-109.1	65.4	-170.2	-3.8	110.1	A14 A17 D21 D22 M23	A14-R19 HydrophobicContact CB-CB 4.34Å; A14-R19 PolarHBondContact O-N 3.29Å; A17-R19 HydrophobicContact CB-CG 3.92Å; A17-R19 WeakPolarHBondContact O-CG 3.4Å; A17-R19 PolarHBondContact O-N 3.46Å; A17-R19 VanDerWaalsContact O-N 3.12Å; R19-D21 VanDerWaalsContact C-N 3.29Å; R19-D21 PolarHBondContact O-N 3.4Å; R19-D22 HydrophobicContact CB-CB 4.17Å; R19-D22 IonicContact NE-OD2 3.75Å; R19-D22 WeakPolarHBondContact O-CB 3.29Å; R19-D22 PolarHBondContact O-N 3.48Å; R19-M23 PolarHBondContact O-N 2.94Å
20	Y	98.4	Very high	98.2	Very high	55 Å²	55	58.7 Å²	58.7	22%	0.216	29%	0.293	C	S	.	.	H	α-helix	trans	-64.3	-27.3	-170.7	-57.4	-70.8	0	0	0	114.8	E18 M23 A24 V47 N51 V52	E18-Y20 HydrophobicContact CB-CE2 3.94Å; E18-Y20 WeakPolarHBondContact O-CD2 3.5Å; E18-Y20 PolarHBondContact O-N 2.92Å; Y20-M23 HydrophobicContact CD1-SD 4.03Å; Y20-M23 WeakPolarHBondContact O-CB 3.49Å; Y20-M23 PolarHBondContact O-N 3.27Å; Y20-A24 WeakPolarHBondContact O-CB 2.97Å; Y20-A24 PolarHBondContact O-N 3.09Å; Y20-V47 HydrophobicContact CE1-CG1 4.31Å; Y20-N51 HydrophobicContact CD1-CB 3.55Å; Y20-N51 HydrophobicContact CD2-CB 3.46Å; Y20-N51 VanDerWaalsContact CD2-CB 3.46Å; Y20-N51 HydrophobicContact CE1-CB 3.9Å; Y20-N51 WeakPolarHBondContact CE1-ND2 3.39Å; Y20-N51 HydrophobicContact CE2-CB 3.82Å; Y20-N51 HydrophobicContact CG-CB 3.3Å; Y20-V52 VanDerWaalsContact C-CG2 3.42Å; Y20-V52 WeakPolarHBondContact O-CG2 3.46Å
21	D	98.2	Very high	98.2	Very high	70 Å²	70	53.4 Å²	53.4	37%	0.374	27%	0.269	S	S	.	.	H	α-helix	trans	-65.3	-40.2	172	-61.6	-79.3	0	0	0	111.5	R19 M23 A24 A25 R56	R19-D21 VanDerWaalsContact C-N 3.29Å; R19-D21 PolarHBondContact O-N 3.4Å; D21-M23 VanDerWaalsContact C-N 3.34Å; D21-A24 PolarHBondContact O-N 2.79Å; D21-A25 WeakPolarHBondContact O-CB 3.2Å; D21-A25 PolarHBondContact O-N 3.38Å; D21-R56 IonicContact OD1-CZ 3.13Å; D21-R56 IonicContact OD1-NH1 2.7Å; D21-R56 PolarHBondContact OD1-NH1 3.32Å; D21-R56 IonicContact OD1-NH2 3.66Å; D21-R56 PolarHBondContact OD1-NH2 3.41Å
22	D	98.3	Very high	98.1	Very high	69 Å²	69	57 Å²	57	37%	0.369	29%	0.286	S	S	.	.	H	α-helix	trans	-68.8	-37.1	175.7	-65.1	-35.9	0	0	0	110.9	A14 R19 A25 A26	A14-D22 HydrophobicContact CB-CB 4.01Å; R19-D22 HydrophobicContact CB-CB 4.17Å; R19-D22 IonicContact NE-OD2 3.75Å; R19-D22 WeakPolarHBondContact O-CB 3.29Å; R19-D22 PolarHBondContact O-N 3.48Å; D22-A25 PolarHBondContact O-N 3.36Å; D22-A26 WeakPolarHBondContact O-CB 3.37Å; D22-A26 PolarHBondContact O-N 3.33Å
23	M	98.3	Very high	98	Very high	0 Å²	0	56.9 Å²	56.9	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-62.2	-46.2	174	-165.9	-170.4	-178.8	0	0	111.2	A11 A14 E15 R19 Y20 D21 A26 M27 L44 V47 A48	A11-M23 HydrophobicContact CB-CG 4.12Å; A14-M23 HydrophobicContact CB-CB 3.87Å; E15-M23 HydrophobicContact CB-CE 3.88Å; E15-M23 HydrophobicContact CB-SD 3.9Å; E15-M23 HydrophobicContact CG-CE 4.1Å; E15-M23 HydrophobicContact CG-SD 4.33Å; R19-M23 PolarHBondContact O-N 2.94Å; Y20-M23 HydrophobicContact CD1-SD 4.03Å; Y20-M23 WeakPolarHBondContact O-CB 3.49Å; Y20-M23 PolarHBondContact O-N 3.27Å; D21-M23 VanDerWaalsContact C-N 3.34Å; M23-A26 PolarHBondContact O-N 3.13Å; M23-M27 WeakPolarHBondContact O-CB 3.21Å; M23-M27 WeakPolarHBondContact O-CG 3.42Å; M23-M27 PolarHBondContact O-N 3.3Å; M23-L44 HydrophobicContact CE-CB 3.92Å; M23-L44 HydrophobicContact CE-CD2 3.48Å; M23-L44 VanDerWaalsContact CE-CD2 3.48Å; M23-L44 HydrophobicContact CE-CG 4.32Å; M23-L44 VanDerWaalsContact CE-O 3.23Å; M23-L44 WeakPolarHBondContact CE-O 3.44Å; M23-V47 HydrophobicContact CE-CB 4.13Å; M23-V47 HydrophobicContact CE-CG1 4.06Å; M23-V47 HydrophobicContact SD-CG1 4.25Å; M23-A48 HydrophobicContact CB-CB 3.94Å; M23-A48 HydrophobicContact CE-CB 4.28Å; M23-A48 HydrophobicContact CG-CB 3.62Å; M23-A48 HydrophobicContact SD-CB 3.61Å
24	A	98.5	Very high	97.9	Very high	7 Å²	7	56.4 Å²	56.4	6%	0.058	29%	0.288	C	S	.	.	H	α-helix	trans	-64.1	-43.6	178.2	0	0	0	0	0	111.2	Y20 D21 A26 M27 K28 A48 Y49 V52	Y20-A24 WeakPolarHBondContact O-CB 2.97Å; Y20-A24 PolarHBondContact O-N 3.09Å; D21-A24 PolarHBondContact O-N 2.79Å; A24-A26 VanDerWaalsContact C-N 3.34Å; A24-A26 PolarHBondContact O-N 3.39Å; A24-M27 PolarHBondContact O-N 2.98Å; A24-K28 WeakPolarHBondContact O-CB 3.5Å; A24-K28 PolarHBondContact O-N 3.49Å; A24-A48 HydrophobicContact CB-CB 4.15Å; A24-Y49 HydrophobicContact CB-CD1 4.42Å; A24-Y49 HydrophobicContact CB-CD2 4.28Å; A24-Y49 HydrophobicContact CB-CE1 4.24Å; A24-Y49 HydrophobicContact CB-CE2 4.07Å; A24-Y49 HydrophobicContact CB-CG 4.45Å; A24-V52 HydrophobicContact CB-CG2 4.19Å
25	A	98.2	Very high	97.6	Very high	49 Å²	49	61 Å²	61	41%	0.405	31%	0.309	S	S	.	.	H	α-helix	trans	-62	-39.9	175.8	0	0	0	0	0	112.6	D21 D22 N29	D21-A25 WeakPolarHBondContact O-CB 3.2Å; D21-A25 PolarHBondContact O-N 3.38Å; D22-A25 PolarHBondContact O-N 3.36Å; A25-N29 PolarHBondContact O-N 3.35Å; A25-N29 PolarHBondContact O-ND2 3.13Å; A25-N29 VanDerWaalsContact O-ND2 3.13Å
26	A	98.1	Very high	97.4	Very high	0 Å²	0	62 Å²	62	0%	0	32%	0.321	C	S	.	.	H	α-helix	trans	-66.3	-48.6	175.4	0	0	0	0	0	111.6	K10 A11 D22 M23 A24 K28 N29 V30	K10-A26 HydrophobicContact CB-CB 4.4Å; K10-A26 HydrophobicContact CD-CB 4.34Å; K10-A26 HydrophobicContact CG-CB 4.34Å; A11-A26 HydrophobicContact CB-CB 3.99Å; D22-A26 WeakPolarHBondContact O-CB 3.37Å; D22-A26 PolarHBondContact O-N 3.33Å; M23-A26 PolarHBondContact O-N 3.13Å; A24-A26 VanDerWaalsContact C-N 3.34Å; A24-A26 PolarHBondContact O-N 3.39Å; A26-K28 VanDerWaalsContact C-N 3.33Å; A26-K28 PolarHBondContact O-N 3.27Å; A26-N29 WeakPolarHBondContact O-CB 3.38Å; A26-N29 PolarHBondContact O-N 3.25Å; A26-V30 WeakPolarHBondContact O-CG2 3.2Å; A26-V30 PolarHBondContact O-N 3.43Å
27	M	98.4	Very high	97.4	Very high	0 Å²	0	55.3 Å²	55.3	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-69.6	-28.8	-178.9	-69.8	-51.9	-52.3	0	0	113.5	A11 M23 A24 V30 T31 E41 L44 L45	A11-M27 HydrophobicContact CB-CG 3.79Å; A11-M27 HydrophobicContact CB-SD 3.58Å; A11-M27 VanDerWaalsContact CB-SD 3.58Å; M23-M27 WeakPolarHBondContact O-CB 3.21Å; M23-M27 WeakPolarHBondContact O-CG 3.42Å; M23-M27 PolarHBondContact O-N 3.3Å; A24-M27 PolarHBondContact O-N 2.98Å; M27-V30 HydrophobicContact CE-CB 4.16Å; M27-V30 HydrophobicContact CE-CG1 4.2Å; M27-V30 HydrophobicContact CE-CG2 4.41Å; M27-V30 PolarHBondContact O-N 2.93Å; M27-V30 HydrophobicContact SD-CG2 4.27Å; M27-T31 WeakPolarHBondContact O-CB 3.47Å; M27-T31 PolarHBondContact O-N 2.99Å; M27-T31 PolarHBondContact O-OG1 3.17Å; M27-E41 HydrophobicContact CE-CB 4.1Å; M27-E41 WeakPolarHBondContact CE-O 3.28Å; M27-L44 HydrophobicContact CE-CB 4.16Å; M27-L44 HydrophobicContact CG-CB 4.2Å; M27-L44 HydrophobicContact SD-CB 3.84Å; M27-L44 HydrophobicContact SD-CD1 4.33Å; M27-L45 HydrophobicContact CB-CB 4.34Å; M27-L45 HydrophobicContact CB-CD1 3.74Å; M27-L45 HydrophobicContact CE-CB 4.17Å
28	K	98.4	Very high	97.3	Very high	59 Å²	59	54.9 Å²	54.9	26%	0.257	28%	0.283	S	S	.	.	H	α-helix	trans	-57.8	-52.3	167.4	173.7	164.9	-178.8	176	0	110.8	A24 A26 V30 T31 E32 D99 L103	A24-K28 WeakPolarHBondContact O-CB 3.5Å; A24-K28 PolarHBondContact O-N 3.49Å; A26-K28 VanDerWaalsContact C-N 3.33Å; A26-K28 PolarHBondContact O-N 3.27Å; K28-V30 VanDerWaalsContact C-N 3.29Å; K28-V30 PolarHBondContact O-N 3.41Å; K28-T31 WeakPolarHBondContact O-CB 3.46Å; K28-T31 PolarHBondContact O-N 3.32Å; K28-T31 VanDerWaalsContact O-N 3.09Å; K28-E32 WeakPolarHBondContact CE-OE1 3.4Å; K28-E32 HydrophobicContact CG-CG 4.42Å; K28-E32 IonicContact NZ-OE1 3.22Å; K28-E32 WeakPolarHBondContact O-CG 3.45Å; K28-E32 PolarHBondContact O-N 3.38Å; K28-D99 WeakPolarHBondContact CE-OD1 3.45Å; K28-D99 IonicContact NZ-OD1 3.35Å; K28-D99 PolarHBondContact NZ-OD1 2.99Å; K28-D99 IonicContact NZ-OD2 2.71Å; K28-L103 HydrophobicContact CB-CD1 4.05Å; K28-L103 HydrophobicContact CG-CD1 4.05Å; K28-L103 HydrophobicContact CG-CD2 4.12Å
29	N	97.9	Very high	97.1	Very high	73 Å²	73	52.4 Å²	52.4	39%	0.39	27%	0.274	S	S	.	.	H	α-helix	trans	-60.6	-37.9	177.9	-66.2	-33.3	0	0	0	112	L7 A25 A26 E32 L33	L7-N29 HydrophobicContact CD1-CB 3.68Å; L7-N29 HydrophobicContact CD2-CB 3.9Å; L7-N29 HydrophobicContact CG-CB 4.43Å; A25-N29 PolarHBondContact O-N 3.35Å; A25-N29 PolarHBondContact O-ND2 3.13Å; A25-N29 VanDerWaalsContact O-ND2 3.13Å; A26-N29 WeakPolarHBondContact O-CB 3.38Å; A26-N29 PolarHBondContact O-N 3.25Å; N29-E32 PolarHBondContact O-N 2.95Å; N29-L33 WeakPolarHBondContact O-CG 3.45Å; N29-L33 PolarHBondContact O-N 2.91Å
30	V	98.1	Very high	97	Very high	0 Å²	0	50.5 Å²	50.5	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-60.8	-46.1	174.3	175.5	0	0	0	0	110.8	R4 L7 V8 A26 M27 K28 E32 L33 L37	R4-V30 HydrophobicContact CG-CG1 4.23Å; L7-V30 HydrophobicContact CB-CG2 3.43Å; L7-V30 VanDerWaalsContact CB-CG2 3.43Å; L7-V30 HydrophobicContact CD1-CG2 3.99Å; L7-V30 HydrophobicContact CG-CG2 4.38Å; V8-V30 HydrophobicContact CG2-CG1 4.28Å; V8-V30 HydrophobicContact CG2-CG2 3.89Å; A26-V30 WeakPolarHBondContact O-CG2 3.2Å; A26-V30 PolarHBondContact O-N 3.43Å; M27-V30 HydrophobicContact CE-CB 4.16Å; M27-V30 HydrophobicContact CE-CG1 4.2Å; M27-V30 HydrophobicContact CE-CG2 4.41Å; M27-V30 PolarHBondContact O-N 2.93Å; M27-V30 HydrophobicContact SD-CG2 4.27Å; K28-V30 VanDerWaalsContact C-N 3.29Å; K28-V30 PolarHBondContact O-N 3.41Å; V30-E32 VanDerWaalsContact C-N 3.34Å; V30-E32 PolarHBondContact O-N 2.87Å; V30-L33 WeakPolarHBondContact O-CB 3.44Å; V30-L33 PolarHBondContact O-N 3.35Å; V30-L37 HydrophobicContact CG1-CD2 3.79Å
31	T	97.9	Very high	97	Very high	2 Å²	2	48.9 Å²	48.9	1%	0.012	27%	0.266	C	S	.	.	H	α-helix	trans	-65.8	-38.3	-178.5	-56.2	0	0	0	0	111.7	M27 K28 L33 N34 L103 Y107 L108	M27-T31 WeakPolarHBondContact O-CB 3.47Å; M27-T31 PolarHBondContact O-N 2.99Å; M27-T31 PolarHBondContact O-OG1 3.17Å; K28-T31 WeakPolarHBondContact O-CB 3.46Å; K28-T31 PolarHBondContact O-N 3.32Å; K28-T31 VanDerWaalsContact O-N 3.09Å; T31-L33 PolarHBondContact O-N 3.44Å; T31-N34 PolarHBondContact O-N 3.05Å; T31-L103 HydrophobicContact CG2-CB 4.13Å; T31-L103 HydrophobicContact CG2-CD2 4.02Å; T31-Y107 HydrophobicContact CG2-CG 4.37Å; T31-L108 HydrophobicContact CG2-CD1 3.98Å; T31-L108 HydrophobicContact CG2-CD2 3.79Å; T31-L108 HydrophobicContact CG2-CG 3.76Å
32	E	97.1	Very high	96.9	Very high	76 Å²	76	46.1 Å²	46.1	36%	0.355	25%	0.25	S	S	.	.	H	α-helix	trans	-71.8	-9.6	178.3	-69.6	179.6	163.7	0	0	113.7	K28 N29 V30 N34 L103 Y107	K28-E32 WeakPolarHBondContact CE-OE1 3.4Å; K28-E32 HydrophobicContact CG-CG 4.42Å; K28-E32 IonicContact NZ-OE1 3.22Å; K28-E32 WeakPolarHBondContact O-CG 3.45Å; K28-E32 PolarHBondContact O-N 3.38Å; N29-E32 PolarHBondContact O-N 2.95Å; V30-E32 VanDerWaalsContact C-N 3.34Å; V30-E32 PolarHBondContact O-N 2.87Å; E32-N34 PolarHBondContact O-N 3.43Å; E32-L103 HydrophobicContact CG-CD2 3.85Å; E32-Y107 HydrophobicContact CB-CE1 4.43Å; E32-Y107 HydrophobicContact CG-CE1 4.42Å; E32-Y107 HydrophobicContact CG-CE2 4.01Å
33	L	95.9	Very high	96.8	Very high	64 Å²	64	46.5 Å²	46.5	34%	0.335	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.5	-9.9	165.7	-61.1	177.2	0	0	0	112.4	R4 L7 N29 V30 T31 E35	R4-L33 HydrophobicContact CB-CD1 3.7Å; R4-L33 HydrophobicContact CG-CD1 4.01Å; L7-L33 HydrophobicContact CD1-CD1 4.37Å; N29-L33 WeakPolarHBondContact O-CG 3.45Å; N29-L33 PolarHBondContact O-N 2.91Å; V30-L33 WeakPolarHBondContact O-CB 3.44Å; V30-L33 PolarHBondContact O-N 3.35Å; T31-L33 PolarHBondContact O-N 3.44Å; L33-E35 VanDerWaalsContact C-N 3.26Å; L33-E35 PolarHBondContact O-N 2.9Å
34	N	95	Very high	96.8	Very high	86 Å²	86	47 Å²	47	46%	0.46	25%	0.254	S	S	.	.			trans	59.5	35.6	173.5	-163.6	60.4	0	0	0	113.6	T31 E32 Y107 N111	T31-N34 PolarHBondContact O-N 3.05Å; E32-N34 PolarHBondContact O-N 3.43Å; N34-Y107 HydrophobicContact CB-CD1 4.04Å; N34-Y107 HydrophobicContact CB-CE1 4.45Å; N34-Y107 WeakPolarHBondContact OD1-CD1 3.44Å; N34-N111 PolarHBondContact OD1-ND2 3.17Å
35	E	93.4	Very high	96.8	Very high	106 Å²	106	46.6 Å²	46.6	50%	0.495	25%	0.252	S	S	.	.	S	Bend	trans	-116.9	143.2	174.1	-77.7	174.8	-179.8	0	0	109	R4 L33 L37	R4-E35 IonicContact CZ-OE2 2.84Å; R4-E35 IonicContact NH1-OE2 3.45Å; R4-E35 PolarHBondContact NH1-OE2 3.47Å; L33-E35 VanDerWaalsContact C-N 3.26Å; L33-E35 PolarHBondContact O-N 2.9Å; E35-L37 PolarHBondContact O-N 3.28Å
36	P	94.1	Very high	96.9	Very high	89 Å²	89	45.9 Å²	45.9	58%	0.578	24%	0.243	S	C	*	.	P	Polyproline II helix	trans	-51.5	136.7	177.9	-27.3	35.1	0	0	0	112.6	R4	R4-P36 PolarHBondContact NH2-O 3.24Å
37	L	97	Very high	96.9	Very high	13 Å²	13	48 Å²	48	7%	0.068	26%	0.256	C	S	.	.	P	Polyproline II helix	trans	-79	138.2	172.8	-57.3	-174.2	0	0	0	110.1	V30 E35 E41 R42 L45 L108	V30-L37 HydrophobicContact CG1-CD2 3.79Å; E35-L37 PolarHBondContact O-N 3.28Å; L37-E41 HydrophobicContact CB-CB 4.07Å; L37-E41 HydrophobicContact CD2-CB 4.25Å; L37-R42 HydrophobicContact CB-CB 4.33Å; L37-L45 HydrophobicContact CD1-CB 4.47Å; L37-L45 HydrophobicContact CD1-CD2 3.95Å; L37-L108 HydrophobicContact CD1-CD2 3.75Å; L37-L108 HydrophobicContact CG-CD2 3.81Å
38	S	95.9	Very high	96.9	Very high	55 Å²	55	48 Å²	48	39%	0.385	26%	0.256	S	S	.	.	P	Polyproline II helix	trans	-66.1	165.8	163.6	63.5	0	0	0	0	110.9	E40 E41 R42	S38-E40 PolarHBondContact O-N 3.41Å; S38-E41 WeakPolarHBondContact CB-OE2 2.97Å; S38-E41 PolarHBondContact N-OE2 3.25Å; S38-E41 PolarHBondContact O-N 2.88Å; S38-E41 VanDerWaalsContact OG-CD 3.22Å; S38-E41 VanDerWaalsContact OG-CG 3.27Å; S38-E41 WeakPolarHBondContact OG-CG 3.36Å; S38-E41 PolarHBondContact OG-N 2.9Å; S38-E41 PolarHBondContact OG-OE2 3.49Å; S38-R42 VanDerWaalsContact O-CB 3.28Å; S38-R42 WeakPolarHBondContact O-CB 3.47Å; S38-R42 PolarHBondContact O-N 2.92Å
39	N	93.6	Very high	96.9	Very high	91 Å²	91	45.3 Å²	45.3	49%	0.487	25%	0.245	S	C	.	.	H	α-helix	trans	-57.1	-38.1	176	-75	-15	0	0	0	112.3	R42 N43	N39-R42 PolarHBondContact OD1-NH2 3.42Å; N39-N43 WeakPolarHBondContact O-CB 3.22Å; N39-N43 PolarHBondContact O-N 3.11Å; N39-N43 PolarHBondContact O-ND2 3.41Å; N39-N43 PolarHBondContact O-OD1 3.28Å
40	E	95.8	Very high	96.9	Very high	97 Å²	97	48.2 Å²	48.2	45%	0.453	25%	0.254	S	S	.	.	H	α-helix	trans	-65.7	-50.1	177.1	-170	-170.3	165.3	0	0	111.3	R12 S38 R42 N43 L44	R12-E40 IonicContact CZ-OE1 2.95Å; R12-E40 IonicContact NE-OE1 3.09Å; R12-E40 PolarHBondContact NE-OE1 3.08Å; R12-E40 IonicContact NH2-OE1 3.2Å; R12-E40 PolarHBondContact NH2-OE1 3.22Å; R12-E40 IonicContact NH2-OE2 3.86Å; R12-E40 PolarHBondContact NH2-OE2 2.9Å; R12-E40 VanDerWaalsContact NH2-OE2 3.09Å; S38-E40 PolarHBondContact O-N 3.41Å; E40-R42 VanDerWaalsContact C-N 3.33Å; E40-R42 PolarHBondContact O-N 3.06Å; E40-N43 WeakPolarHBondContact O-CB 3.45Å; E40-N43 PolarHBondContact O-N 2.8Å; E40-N43 VanDerWaalsContact O-N 3.11Å; E40-L44 WeakPolarHBondContact O-CG 3.3Å; E40-L44 PolarHBondContact O-N 2.82Å
41	E	98	Very high	96.9	Very high	21 Å²	21	51 Å²	51	10%	0.098	27%	0.268	C	S	.	.	H	α-helix	trans	-64.7	-38.3	-179.3	-68.7	162.3	139.8	0	0	112.1	R4 V8 M27 L37 S38 N43 L44 L45	R4-E41 IonicContact CZ-OE1 4Å; R4-E41 IonicContact CZ-OE2 3.97Å; R4-E41 IonicContact NE-OE1 2.73Å; R4-E41 PolarHBondContact NE-OE1 3.12Å; R4-E41 IonicContact NE-OE2 3.77Å; R4-E41 IonicContact NH2-OE1 2.68Å; R4-E41 PolarHBondContact NH2-OE1 2.96Å; R4-E41 VanDerWaalsContact NH2-OE1 3.15Å; R4-E41 IonicContact NH2-OE2 2.83Å; R4-E41 PolarHBondContact NH2-OE2 3.22Å; V8-E41 HydrophobicContact CG1-CG 4.45Å; V8-E41 HydrophobicContact CG2-CG 3.93Å; V8-E41 WeakPolarHBondContact CG2-OE1 3.44Å; M27-E41 HydrophobicContact CE-CB 4.1Å; M27-E41 WeakPolarHBondContact CE-O 3.28Å; L37-E41 HydrophobicContact CB-CB 4.07Å; L37-E41 HydrophobicContact CD2-CB 4.25Å; S38-E41 WeakPolarHBondContact CB-OE2 2.97Å; S38-E41 PolarHBondContact N-OE2 3.25Å; S38-E41 PolarHBondContact O-N 2.88Å; S38-E41 VanDerWaalsContact OG-CD 3.22Å; S38-E41 VanDerWaalsContact OG-CG 3.27Å; S38-E41 WeakPolarHBondContact OG-CG 3.36Å; S38-E41 PolarHBondContact OG-N 2.9Å; S38-E41 PolarHBondContact OG-OE2 3.49Å; E41-N43 VanDerWaalsContact C-N 3.31Å; E41-N43 PolarHBondContact O-N 3.43Å; E41-L44 PolarHBondContact O-N 3.49Å; E41-L45 PolarHBondContact O-N 2.66Å
42	R	97.4	Very high	96.9	Very high	12 Å²	12	51.1 Å²	51.1	5%	0.045	27%	0.269	C	S	.	.	H	α-helix	trans	-59.7	-42.9	172.6	178.7	-175.9	76.3	-177.2	-4.8	111.3	L37 S38 N39 E40 L45 S46 F122 Y123	L37-R42 HydrophobicContact CB-CB 4.33Å; S38-R42 VanDerWaalsContact O-CB 3.28Å; S38-R42 WeakPolarHBondContact O-CB 3.47Å; S38-R42 PolarHBondContact O-N 2.92Å; N39-R42 PolarHBondContact OD1-NH2 3.42Å; E40-R42 VanDerWaalsContact C-N 3.33Å; E40-R42 PolarHBondContact O-N 3.06Å; R42-L45 PolarHBondContact O-N 3.03Å; R42-S46 WeakPolarHBondContact O-CB 3.34Å; R42-S46 PolarHBondContact O-N 2.92Å; R42-F122 VanDerWaalsContact CD-CG 3.48Å; R42-F122 HydrophobicContact CG-CD1 3.49Å; R42-F122 VanDerWaalsContact CG-CD1 3.49Å; R42-F122 HydrophobicContact CG-CD2 4.42Å; R42-F122 HydrophobicContact CG-CE1 3.3Å; R42-F122 HydrophobicContact CG-CE2 4.25Å; R42-F122 HydrophobicContact CG-CG 4.06Å; R42-F122 HydrophobicContact CG-CZ 3.71Å; R42-Y123 HydrophobicContact CG-CE1 3.71Å
43	N	96.4	Very high	97	Very high	76 Å²	76	47.5 Å²	47.5	41%	0.406	25%	0.252	S	S	.	.	H	α-helix	trans	-65.8	-42.4	176.4	-71.5	-9.8	0	0	0	111.2	N39 E40 E41 L45 S46 V47	N39-N43 WeakPolarHBondContact O-CB 3.22Å; N39-N43 PolarHBondContact O-N 3.11Å; N39-N43 PolarHBondContact O-ND2 3.41Å; N39-N43 PolarHBondContact O-OD1 3.28Å; E40-N43 WeakPolarHBondContact O-CB 3.45Å; E40-N43 PolarHBondContact O-N 2.8Å; E40-N43 VanDerWaalsContact O-N 3.11Å; E41-N43 VanDerWaalsContact C-N 3.31Å; E41-N43 PolarHBondContact O-N 3.43Å; N43-L45 PolarHBondContact O-N 3.06Å; N43-S46 WeakPolarHBondContact O-CB 3.29Å; N43-S46 PolarHBondContact O-N 3.11Å; N43-V47 WeakPolarHBondContact O-CG2 3.48Å; N43-V47 PolarHBondContact O-N 3.38Å
44	L	98.4	Very high	97.1	Very high	10 Å²	10	45.7 Å²	45.7	5%	0.052	25%	0.249	C	C	.	.	H	α-helix	trans	-59	-46.9	174.7	-70.1	171.7	0	0	0	111.7	V8 R12 E15 M23 M27 E40 E41 S46 V47 A48	V8-L44 HydrophobicContact CG1-CD1 3.94Å; R12-L44 HydrophobicContact CG-CD1 4.17Å; R12-L44 HydrophobicContact CG-CD2 4.41Å; E15-L44 WeakPolarHBondContact OE2-CD2 3.48Å; M23-L44 HydrophobicContact CE-CB 3.92Å; M23-L44 HydrophobicContact CE-CD2 3.48Å; M23-L44 VanDerWaalsContact CE-CD2 3.48Å; M23-L44 HydrophobicContact CE-CG 4.32Å; M23-L44 VanDerWaalsContact CE-O 3.23Å; M23-L44 WeakPolarHBondContact CE-O 3.44Å; M27-L44 HydrophobicContact CE-CB 4.16Å; M27-L44 HydrophobicContact CG-CB 4.2Å; M27-L44 HydrophobicContact SD-CB 3.84Å; M27-L44 HydrophobicContact SD-CD1 4.33Å; E40-L44 WeakPolarHBondContact O-CG 3.3Å; E40-L44 PolarHBondContact O-N 2.82Å; E41-L44 PolarHBondContact O-N 3.49Å; L44-S46 VanDerWaalsContact C-N 3.29Å; L44-S46 PolarHBondContact O-N 3.28Å; L44-V47 PolarHBondContact O-N 2.83Å; L44-A48 WeakPolarHBondContact O-CB 3.4Å; L44-A48 PolarHBondContact O-N 2.94Å
45	L	98.6	Very high	97.3	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-57.3	-44.7	175.6	-179.7	71.6	0	0	0	111.2	M27 L37 E41 R42 N43 Y49 L103 L108 M126	M27-L45 HydrophobicContact CB-CB 4.34Å; M27-L45 HydrophobicContact CB-CD1 3.74Å; M27-L45 HydrophobicContact CE-CB 4.17Å; L37-L45 HydrophobicContact CD1-CB 4.47Å; L37-L45 HydrophobicContact CD1-CD2 3.95Å; E41-L45 PolarHBondContact O-N 2.66Å; R42-L45 PolarHBondContact O-N 3.03Å; N43-L45 PolarHBondContact O-N 3.06Å; L45-Y49 HydrophobicContact CD1-CD2 3.68Å; L45-Y49 HydrophobicContact CD1-CE2 3.52Å; L45-Y49 HydrophobicContact CG-CD2 4.32Å; L45-Y49 PolarHBondContact O-N 3.18Å; L45-L103 HydrophobicContact CD1-CD1 4.46Å; L45-L108 HydrophobicContact CD2-CD1 3.54Å; L45-M126 HydrophobicContact CG-CE 4.36Å
46	S	98.2	Very high	97.5	Very high	33 Å²	33	41.4 Å²	41.4	23%	0.231	23%	0.233	C	C	.	.	H	α-helix	trans	-63.5	-49.2	179.2	-168.6	0	0	0	0	112.3	R42 N43 L44 A48 K50	R42-S46 WeakPolarHBondContact O-CB 3.34Å; R42-S46 PolarHBondContact O-N 2.92Å; N43-S46 WeakPolarHBondContact O-CB 3.29Å; N43-S46 PolarHBondContact O-N 3.11Å; L44-S46 VanDerWaalsContact C-N 3.29Å; L44-S46 PolarHBondContact O-N 3.28Å; S46-A48 VanDerWaalsContact C-N 3.34Å; S46-A48 PolarHBondContact O-N 2.79Å; S46-K50 WeakPolarHBondContact O-CB 3.41Å; S46-K50 PolarHBondContact O-N 3.08Å
47	V	98.3	Very high	97.7	Very high	45 Å²	45	38.6 Å²	38.6	27%	0.273	21%	0.211	S	C	.	.	H	α-helix	trans	-60.1	-43.8	178.5	169.7	0	0	0	0	111.1	Y20 M23 N43 L44 N51	Y20-V47 HydrophobicContact CE1-CG1 4.31Å; M23-V47 HydrophobicContact CE-CB 4.13Å; M23-V47 HydrophobicContact CE-CG1 4.06Å; M23-V47 HydrophobicContact SD-CG1 4.25Å; N43-V47 WeakPolarHBondContact O-CG2 3.48Å; N43-V47 PolarHBondContact O-N 3.38Å; L44-V47 PolarHBondContact O-N 2.83Å; V47-N51 PolarHBondContact O-N 3.49Å; V47-N51 VanDerWaalsContact O-N 3.13Å; V47-N51 PolarHBondContact O-ND2 3.02Å
48	A	98.6	Very high	97.8	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-56.8	-63.2	179.3	0	0	0	0	0	111.4	M23 A24 L44 S46 K50 N51 V52	M23-A48 HydrophobicContact CB-CB 3.94Å; M23-A48 HydrophobicContact CE-CB 4.28Å; M23-A48 HydrophobicContact CG-CB 3.62Å; M23-A48 HydrophobicContact SD-CB 3.61Å; A24-A48 HydrophobicContact CB-CB 4.15Å; L44-A48 WeakPolarHBondContact O-CB 3.4Å; L44-A48 PolarHBondContact O-N 2.94Å; S46-A48 VanDerWaalsContact C-N 3.34Å; S46-A48 PolarHBondContact O-N 2.79Å; A48-K50 VanDerWaalsContact C-N 3.34Å; A48-K50 PolarHBondContact O-N 3.35Å; A48-N51 PolarHBondContact O-N 2.9Å; A48-V52 VanDerWaalsContact O-CG2 3.3Å; A48-V52 WeakPolarHBondContact O-CG2 3.32Å; A48-V52 PolarHBondContact O-N 2.87Å; A48-V52 VanDerWaalsContact O-N 3.1Å
49	Y	98.7	Very high	97.9	Very high	3 Å²	3	41.4 Å²	41.4	1%	0.012	23%	0.231	C	C	.	.	H	α-helix	trans	-69.1	-31.9	-175.2	-78.9	-85.2	0	0	0	112.7	A24 L45 N51 V52 V53 V96 D99 V100 L103 Y130	A24-Y49 HydrophobicContact CB-CD1 4.42Å; A24-Y49 HydrophobicContact CB-CD2 4.28Å; A24-Y49 HydrophobicContact CB-CE1 4.24Å; A24-Y49 HydrophobicContact CB-CE2 4.07Å; A24-Y49 HydrophobicContact CB-CG 4.45Å; L45-Y49 HydrophobicContact CD1-CD2 3.68Å; L45-Y49 HydrophobicContact CD1-CE2 3.52Å; L45-Y49 HydrophobicContact CG-CD2 4.32Å; L45-Y49 PolarHBondContact O-N 3.18Å; Y49-N51 VanDerWaalsContact C-N 3.34Å; Y49-N51 PolarHBondContact O-N 3.45Å; Y49-V52 PolarHBondContact O-N 3.07Å; Y49-V53 WeakPolarHBondContact O-CB 3.4Å; Y49-V53 PolarHBondContact O-N 3.38Å; Y49-V96 HydrophobicContact CD1-CG1 3.79Å; Y49-V96 HydrophobicContact CE1-CG1 4.22Å; Y49-D99 HydrophobicContact CE1-CB 4.33Å; Y49-D99 PolarHBondContact OH-OD2 3.47Å; Y49-V100 HydrophobicContact CD1-CB 3.72Å; Y49-V100 HydrophobicContact CD1-CG1 4.35Å; Y49-V100 HydrophobicContact CD1-CG2 4.19Å; Y49-V100 HydrophobicContact CD2-CB 4.38Å; Y49-V100 HydrophobicContact CD2-CG2 4.04Å; Y49-V100 HydrophobicContact CE1-CB 3.86Å; Y49-V100 HydrophobicContact CE2-CG2 4.4Å; Y49-V100 HydrophobicContact CG-CB 3.99Å; Y49-V100 HydrophobicContact CG-CG2 3.93Å; Y49-L103 HydrophobicContact CE2-CD1 4.03Å; Y49-L103 WeakPolarHBondContact OH-CD1 3.44Å; Y49-Y130 WeakPolarHBondContact CB-OH 3.46Å
50	K	98.2	Very high	98.1	Very high	134 Å²	134	38.8 Å²	38.8	58%	0.583	22%	0.215	S	C	*	.	H	α-helix	trans	-59.5	-44.9	175.1	178.9	-177.4	175.1	-175.2	0	111.2	S46 A48 G54 Y130	S46-K50 WeakPolarHBondContact O-CB 3.41Å; S46-K50 PolarHBondContact O-N 3.08Å; A48-K50 VanDerWaalsContact C-N 3.34Å; A48-K50 PolarHBondContact O-N 3.35Å; K50-G54 WeakPolarHBondContact O-CA 3.45Å; K50-G54 PolarHBondContact O-N 3.23Å; K50-Y130 PolarHBondContact N-OH 3.14Å
51	N	98.4	Very high	98.2	Very high	58 Å²	58	39.1 Å²	39.1	31%	0.31	21%	0.212	S	C	.	.	H	α-helix	trans	-71.4	-42.2	179.3	-80	-72.8	0	0	0	112.1	Y20 V47 A48 Y49 V53 G54 A55	Y20-N51 HydrophobicContact CD1-CB 3.55Å; Y20-N51 HydrophobicContact CD2-CB 3.46Å; Y20-N51 VanDerWaalsContact CD2-CB 3.46Å; Y20-N51 HydrophobicContact CE1-CB 3.9Å; Y20-N51 WeakPolarHBondContact CE1-ND2 3.39Å; Y20-N51 HydrophobicContact CE2-CB 3.82Å; Y20-N51 HydrophobicContact CG-CB 3.3Å; V47-N51 PolarHBondContact O-N 3.49Å; V47-N51 VanDerWaalsContact O-N 3.13Å; V47-N51 PolarHBondContact O-ND2 3.02Å; A48-N51 PolarHBondContact O-N 2.9Å; Y49-N51 VanDerWaalsContact C-N 3.34Å; Y49-N51 PolarHBondContact O-N 3.45Å; N51-V53 PolarHBondContact O-N 3.39Å; N51-G54 PolarHBondContact O-N 3.23Å; N51-A55 PolarHBondContact O-N 3.01Å
52	V	98.6	Very high	98.2	Very high	5 Å²	5	42.4 Å²	42.4	3%	0.03	23%	0.233	C	C	.	.	H	α-helix	trans	-58.2	-50.3	177	174.1	0	0	0	0	110.9	Y20 A24 A48 Y49 R56 V96	Y20-V52 VanDerWaalsContact C-CG2 3.42Å; Y20-V52 WeakPolarHBondContact O-CG2 3.46Å; A24-V52 HydrophobicContact CB-CG2 4.19Å; A48-V52 VanDerWaalsContact O-CG2 3.3Å; A48-V52 WeakPolarHBondContact O-CG2 3.32Å; A48-V52 PolarHBondContact O-N 2.87Å; A48-V52 VanDerWaalsContact O-N 3.1Å; Y49-V52 PolarHBondContact O-N 3.07Å; V52-R56 WeakPolarHBondContact O-CD 3.23Å; V52-R56 PolarHBondContact O-NH1 3Å; V52-V96 HydrophobicContact CB-CG1 4.31Å; V52-V96 HydrophobicContact CG1-CB 4.3Å; V52-V96 HydrophobicContact CG1-CG1 3.55Å; V52-V96 HydrophobicContact CG1-CG2 3.75Å
53	V	98.5	Very high	98.2	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-70.9	-39	177.9	172.2	0	0	0	0	111.8	Y49 N51 A55 R56 R57 V96 Y130 Y133	Y49-V53 WeakPolarHBondContact O-CB 3.4Å; Y49-V53 PolarHBondContact O-N 3.38Å; N51-V53 PolarHBondContact O-N 3.39Å; V53-A55 VanDerWaalsContact C-N 3.33Å; V53-A55 PolarHBondContact O-N 3.39Å; V53-R56 PolarHBondContact O-N 3.29Å; V53-R56 VanDerWaalsContact O-N 3.14Å; V53-R57 HydrophobicContact CG1-CG 3.93Å; V53-R57 WeakPolarHBondContact O-CG 3.47Å; V53-R57 PolarHBondContact O-N 2.82Å; V53-V96 HydrophobicContact CG2-CB 3.96Å; V53-V96 HydrophobicContact CG2-CG1 3.32Å; V53-Y130 HydrophobicContact CB-CE1 4.13Å; V53-Y130 HydrophobicContact CG2-CD1 4.1Å; V53-Y130 HydrophobicContact CG2-CE1 3.6Å; V53-Y133 HydrophobicContact CG1-CD2 3.62Å; V53-Y133 HydrophobicContact CG1-CE2 4.27Å; V53-Y133 HydrophobicContact CG1-CG 4.06Å
54	G	98.1	Very high	98.2	Very high	25 Å²	25	40.4 Å²	40.4	26%	0.258	23%	0.225	S	C	.	.	H	α-helix	trans	-55.1	-45.7	177.8	0	0	0	0	0	112.9	K50 N51 R56 R57 S58	K50-G54 WeakPolarHBondContact O-CA 3.45Å; K50-G54 PolarHBondContact O-N 3.23Å; N51-G54 PolarHBondContact O-N 3.23Å; G54-R56 VanDerWaalsContact C-N 3.33Å; G54-R56 PolarHBondContact O-N 3.37Å; G54-R57 PolarHBondContact O-N 2.85Å; G54-S58 PolarHBondContact O-N 3.44Å; G54-S58 PolarHBondContact O-OG 3.38Å
55	A	98.2	Very high	98.1	Very high	53 Å²	53	42.1 Å²	42.1	44%	0.438	24%	0.238	S	C	.	.	H	α-helix	trans	-61.2	-40.3	177.5	0	0	0	0	0	112.9	N51 V53 S59	N51-A55 PolarHBondContact O-N 3.01Å; V53-A55 VanDerWaalsContact C-N 3.33Å; V53-A55 PolarHBondContact O-N 3.39Å; A55-S59 WeakPolarHBondContact O-CB 3.44Å; A55-S59 PolarHBondContact O-N 3.38Å; A55-S59 PolarHBondContact O-OG 2.88Å
56	R	98.4	Very high	98	Very high	49 Å²	49	45.4 Å²	45.4	19%	0.185	26%	0.255	C	S	.	.	H	α-helix	trans	-72.2	-40.1	179.5	-71.9	153.2	179.4	88.6	-8.6	111.6	D21 V52 V53 G54 S59 W60 I89 L93	D21-R56 IonicContact OD1-CZ 3.13Å; D21-R56 IonicContact OD1-NH1 2.7Å; D21-R56 PolarHBondContact OD1-NH1 3.32Å; D21-R56 IonicContact OD1-NH2 3.66Å; D21-R56 PolarHBondContact OD1-NH2 3.41Å; V52-R56 WeakPolarHBondContact O-CD 3.23Å; V52-R56 PolarHBondContact O-NH1 3Å; V53-R56 PolarHBondContact O-N 3.29Å; V53-R56 VanDerWaalsContact O-N 3.14Å; G54-R56 VanDerWaalsContact C-N 3.33Å; G54-R56 PolarHBondContact O-N 3.37Å; R56-S59 WeakPolarHBondContact O-CB 3.32Å; R56-S59 PolarHBondContact O-N 2.87Å; R56-W60 WeakPolarHBondContact O-CB 3.32Å; R56-W60 PolarHBondContact O-N 3.5Å; R56-I89 WeakPolarHBondContact O-CG2 3.38Å; R56-L93 HydrophobicContact CB-CB 4.28Å
57	R	98.1	Very high	97.8	Very high	31 Å²	31	44.9 Å²	44.9	12%	0.117	25%	0.249	C	C	.	.	H	α-helix	trans	-60.4	-46	172.6	-72.1	178.9	71.4	-138.7	9.1	112.2	V53 G54 S59 W60 R61 L93 Y133 E136	V53-R57 HydrophobicContact CG1-CG 3.93Å; V53-R57 WeakPolarHBondContact O-CG 3.47Å; V53-R57 PolarHBondContact O-N 2.82Å; G54-R57 PolarHBondContact O-N 2.85Å; R57-S59 VanDerWaalsContact C-N 3.32Å; R57-S59 PolarHBondContact O-N 3.19Å; R57-W60 WeakPolarHBondContact O-CB 3.48Å; R57-W60 PolarHBondContact O-N 2.62Å; R57-R61 WeakPolarHBondContact O-CG 3.35Å; R57-R61 PolarHBondContact O-N 2.94Å; R57-L93 HydrophobicContact CB-CD1 4.46Å; R57-L93 HydrophobicContact CG-CD1 3.51Å; R57-Y133 VanDerWaalsContact CZ-CD1 3.46Å; R57-E136 IonicContact CZ-OE2 2.61Å; R57-E136 IonicContact NE-OE2 2.77Å; R57-E136 PolarHBondContact NE-OE2 2.83Å; R57-E136 IonicContact NH2-OE1 2.66Å; R57-E136 IonicContact NH2-OE2 3.97Å; R57-E136 PolarHBondContact NH2-OE2 3.23Å
58	S	98.3	Very high	97.6	Very high	67 Å²	67	49.7 Å²	49.7	47%	0.469	27%	0.268	S	S	.	.	H	α-helix	trans	-60.1	-44.5	175.6	-65.1	0	0	0	0	111.5	G54 W60 R61 V62	G54-S58 PolarHBondContact O-N 3.44Å; G54-S58 PolarHBondContact O-OG 3.38Å; S58-W60 VanDerWaalsContact C-N 3.33Å; S58-W60 PolarHBondContact O-N 3.46Å; S58-R61 PolarHBondContact O-N 3.48Å; S58-V62 WeakPolarHBondContact O-CG2 3.13Å; S58-V62 PolarHBondContact O-N 3.12Å; S58-V62 VanDerWaalsContact O-N 3.16Å
59	S	98.5	Very high	97.3	Very high	59 Å²	59	56.2 Å²	56.2	41%	0.413	30%	0.297	S	S	.	.	H	α-helix	trans	-61.2	-42.7	175.9	-58.1	0	0	0	0	111.9	A55 R56 R57 V62 I63	A55-S59 WeakPolarHBondContact O-CB 3.44Å; A55-S59 PolarHBondContact O-N 3.38Å; A55-S59 PolarHBondContact O-OG 2.88Å; R56-S59 WeakPolarHBondContact O-CB 3.32Å; R56-S59 PolarHBondContact O-N 2.87Å; R57-S59 VanDerWaalsContact C-N 3.32Å; R57-S59 PolarHBondContact O-N 3.19Å; S59-V62 PolarHBondContact O-N 3.21Å; S59-I63 WeakPolarHBondContact O-CG2 3.38Å; S59-I63 PolarHBondContact O-N 3.1Å
60	W	98.5	Very high	97	Very high	37 Å²	37	56.2 Å²	56.2	14%	0.14	30%	0.297	C	S	.	.	H	α-helix	trans	-62.1	-46.5	177.9	-177.1	82.4	0	0	0	112.2	R56 R57 S58 V62 I63 S64 I89 E90 E136 V137	R56-W60 WeakPolarHBondContact O-CB 3.32Å; R56-W60 PolarHBondContact O-N 3.5Å; R57-W60 WeakPolarHBondContact O-CB 3.48Å; R57-W60 PolarHBondContact O-N 2.62Å; S58-W60 VanDerWaalsContact C-N 3.33Å; S58-W60 PolarHBondContact O-N 3.46Å; W60-V62 VanDerWaalsContact C-N 3.33Å; W60-V62 PolarHBondContact O-N 3.44Å; W60-I63 WeakPolarHBondContact O-CG2 3.17Å; W60-I63 PolarHBondContact O-N 3.36Å; W60-S64 WeakPolarHBondContact O-CB 3.28Å; W60-S64 PolarHBondContact O-N 3.04Å; W60-S64 PolarHBondContact O-OG 3.22Å; W60-I89 HydrophobicContact CB-CG2 3.78Å; W60-E90 VanDerWaalsContact CD1-CG 3.47Å; W60-E90 VanDerWaalsContact NE1-CG 3.3Å; W60-E90 PolarHBondContact NE1-OE1 3.46Å; W60-E136 HydrophobicContact CE3-CG 4.44Å; W60-E136 HydrophobicContact CH2-CG 4.34Å; W60-E136 WeakPolarHBondContact CH2-O 3.14Å; W60-E136 HydrophobicContact CZ3-CG 3.81Å; W60-V137 HydrophobicContact CD2-CG1 3.62Å; W60-V137 HydrophobicContact CE3-CG1 4.04Å; W60-V137 HydrophobicContact CG-CG1 3.96Å; W60-V137 HydrophobicContact CH2-CG1 4.34Å; W60-V137 HydrophobicContact CZ2-CB 4.19Å; W60-V137 HydrophobicContact CZ2-CG1 3.97Å; W60-V137 HydrophobicContact CZ3-CG1 4.38Å
61	R	98.1	Very high	96.5	Very high	104 Å²	104	52.7 Å²	52.7	39%	0.392	29%	0.289	S	S	.	.	H	α-helix	trans	-60.8	-42.4	178	-70.7	170.7	-178.9	175.4	-18	112.3	R57 S58 S65 E136	R57-R61 WeakPolarHBondContact O-CG 3.35Å; R57-R61 PolarHBondContact O-N 2.94Å; S58-R61 PolarHBondContact O-N 3.48Å; R61-S65 PolarHBondContact O-N 3.01Å; R61-E136 IonicContact CZ-OE1 2.69Å; R61-E136 IonicContact NE-OE1 3.95Å; R61-E136 PolarHBondContact NE-OE1 3.3Å; R61-E136 IonicContact NH2-OE1 2.74Å; R61-E136 PolarHBondContact NH2-OE1 3.09Å; R61-E136 IonicContact NH2-OE2 3.61Å
62	V	98.2	Very high	96	Very high	89 Å²	89	54.1 Å²	54.1	54%	0.539	31%	0.309	S	S	.	.	H	α-helix	trans	-63.3	-49.1	177.7	171.9	0	0	0	0	110.7	S58 S59 W60 S64 S65 I66	S58-V62 WeakPolarHBondContact O-CG2 3.13Å; S58-V62 PolarHBondContact O-N 3.12Å; S58-V62 VanDerWaalsContact O-N 3.16Å; S59-V62 PolarHBondContact O-N 3.21Å; W60-V62 VanDerWaalsContact C-N 3.33Å; W60-V62 PolarHBondContact O-N 3.44Å; V62-S64 PolarHBondContact O-N 3.36Å; V62-S65 PolarHBondContact O-N 3.1Å; V62-I66 HydrophobicContact CG1-CD1 3.92Å; V62-I66 WeakPolarHBondContact O-CG1 3.39Å; V62-I66 PolarHBondContact O-N 3.46Å
63	I	97.9	Very high	95.3	Very high	18 Å²	18	59.1 Å²	59.1	9%	0.092	34%	0.336	C	S	.	.	H	α-helix	trans	-68	-36.3	-178.4	-164.8	67.5	0	0	0	112.1	S59 W60 S65 I66 E67 V82 Y85 R86 I89	S59-I63 WeakPolarHBondContact O-CG2 3.38Å; S59-I63 PolarHBondContact O-N 3.1Å; W60-I63 WeakPolarHBondContact O-CG2 3.17Å; W60-I63 PolarHBondContact O-N 3.36Å; I63-S65 VanDerWaalsContact C-N 3.33Å; I63-S65 PolarHBondContact O-N 2.99Å; I63-I66 HydrophobicContact CD1-CB 4.46Å; I63-I66 HydrophobicContact CD1-CD1 4.4Å; I63-I66 CarbonylContact O-C 3.58Å; I63-I66 PolarHBondContact O-N 2.96Å; I63-I66 VanDerWaalsContact O-N 3.15Å; I63-E67 PolarHBondContact O-N 2.93Å; I63-V82 HydrophobicContact CD1-CG1 3.74Å; I63-V82 HydrophobicContact CG1-CG1 3.91Å; I63-Y85 HydrophobicContact CD1-CD1 3.8Å; I63-Y85 HydrophobicContact CG1-CD1 3.95Å; I63-R86 HydrophobicContact CG1-CB 4.25Å; I63-R86 HydrophobicContact CG2-CB 3.78Å; I63-R86 HydrophobicContact CG2-CG 3.97Å; I63-I89 HydrophobicContact CB-CD1 4.39Å; I63-I89 HydrophobicContact CG2-CD1 3.86Å
64	S	96.4	Very high	94.6	Very high	28 Å²	28	61.7 Å²	61.7	20%	0.196	36%	0.362	C	S	.	.	H	α-helix	trans	-61.8	-40.6	173.7	-65.2	0	0	0	0	111.7	W60 V62 E67 Q68 R86	W60-S64 WeakPolarHBondContact O-CB 3.28Å; W60-S64 PolarHBondContact O-N 3.04Å; W60-S64 PolarHBondContact O-OG 3.22Å; V62-S64 PolarHBondContact O-N 3.36Å; S64-E67 PolarHBondContact O-N 3.44Å; S64-Q68 PolarHBondContact O-N 2.72Å; S64-R86 VanDerWaalsContact OG-CD 3.27Å; S64-R86 WeakPolarHBondContact OG-CD 3.26Å
65	S	96.1	Very high	94.2	Very high	46 Å²	46	64.4 Å²	64.4	32%	0.322	37%	0.371	S	S	.	.	H	α-helix	trans	-64.6	-38.7	173	-173.8	0	0	0	0	112.4	R61 V62 I63 Q68 K69	R61-S65 PolarHBondContact O-N 3.01Å; V62-S65 PolarHBondContact O-N 3.1Å; I63-S65 VanDerWaalsContact C-N 3.33Å; I63-S65 PolarHBondContact O-N 2.99Å; S65-Q68 PolarHBondContact O-N 3.46Å; S65-K69 WeakPolarHBondContact O-CG 3.21Å; S65-K69 PolarHBondContact O-N 3.47Å; S65-K69 VanDerWaalsContact O-N 3.14Å
66	I	96	Very high	93.9	Very high	70 Å²	70	69 Å²	69	36%	0.359	38%	0.383	S	S	.	.	H	α-helix	trans	-66.2	-38.9	174.9	-66.8	167.1	0	0	0	110.8	V62 I63 K69 T70 V82	V62-I66 HydrophobicContact CG1-CD1 3.92Å; V62-I66 WeakPolarHBondContact O-CG1 3.39Å; V62-I66 PolarHBondContact O-N 3.46Å; I63-I66 HydrophobicContact CD1-CB 4.46Å; I63-I66 HydrophobicContact CD1-CD1 4.4Å; I63-I66 CarbonylContact O-C 3.58Å; I63-I66 PolarHBondContact O-N 2.96Å; I63-I66 VanDerWaalsContact O-N 3.15Å; I66-K69 PolarHBondContact O-N 2.9Å; I66-T70 WeakPolarHBondContact O-CB 3.45Å; I66-T70 PolarHBondContact O-N 3.22Å; I66-T70 PolarHBondContact O-OG1 3.38Å; I66-V82 HydrophobicContact CB-CG1 4.46Å; I66-V82 HydrophobicContact CG2-CG1 4.09Å; I66-V82 HydrophobicContact CG2-CG2 3.96Å
67	E	94.5	Very high	93.7	Very high	21 Å²	21	74.3 Å²	74.3	10%	0.098	41%	0.408	C	S	.	.	H	α-helix	trans	-61.6	-46.8	177.1	-166	175.9	179.4	0	0	110.6	I63 S64 K69 T70 S71 V82 R83 R86	I63-E67 PolarHBondContact O-N 2.93Å; S64-E67 PolarHBondContact O-N 3.44Å; E67-K69 PolarHBondContact O-N 2.82Å; E67-T70 PolarHBondContact O-N 3.38Å; E67-S71 WeakPolarHBondContact O-CB 3.3Å; E67-S71 PolarHBondContact O-N 3.23Å; E67-S71 PolarHBondContact O-OG 2.64Å; E67-V82 HydrophobicContact CB-CG1 3.58Å; E67-V82 HydrophobicContact CG-CG1 4.08Å; E67-R83 WeakPolarHBondContact OE1-CB 3.44Å; E67-R83 IonicContact OE1-CZ 3.88Å; E67-R83 IonicContact OE1-NE 3.23Å; E67-R83 PolarHBondContact OE1-NE 2.92Å; E67-R83 VanDerWaalsContact OE1-NE 3.09Å; E67-R83 IonicContact OE1-NH2 3.09Å; E67-R86 IonicContact OE1-NH2 2.64Å; E67-R86 WeakPolarHBondContact OE2-CD 3.33Å; E67-R86 IonicContact OE2-CZ 3.92Å; E67-R86 IonicContact OE2-NE 2.75Å; E67-R86 PolarHBondContact OE2-NE 3.45Å; E67-R86 IonicContact OE2-NH2 3.02Å
68	Q	92.5	Very high	93.5	Very high	146 Å²	146	76.8 Å²	76.8	68%	0.682	42%	0.419	S	S	*	.	H	α-helix	trans	-58.7	-47	177.8	-170.7	-177.1	15.5	0	0	111.7	S64 S65 S71	S64-Q68 PolarHBondContact O-N 2.72Å; S65-Q68 PolarHBondContact O-N 3.46Å; Q68-S71 PolarHBondContact O-N 3.02Å
69	K	93.3	Very high	93.3	Very high	138 Å²	138	74.9 Å²	74.9	60%	0.6	40%	0.404	S	S	*	.	H	α-helix	trans	-66.7	-42.9	178.3	-69.5	171.5	-176	171.6	0	112.2	S65 I66 E67 S71 A72	S65-K69 WeakPolarHBondContact O-CG 3.21Å; S65-K69 PolarHBondContact O-N 3.47Å; S65-K69 VanDerWaalsContact O-N 3.14Å; I66-K69 PolarHBondContact O-N 2.9Å; E67-K69 PolarHBondContact O-N 2.82Å; K69-S71 VanDerWaalsContact C-N 3.28Å; K69-S71 PolarHBondContact O-N 2.88Å; K69-A72 WeakPolarHBondContact O-CB 3.48Å; K69-A72 PolarHBondContact O-N 2.93Å; K69-A72 VanDerWaalsContact O-N 3.15Å
70	T	92	Very high	93.2	Very high	3 Å²	3	78 Å²	78	2%	0.018	41%	0.412	C	S	.	.	H	α-helix	trans	-67.3	-31.8	-179.7	-58.9	0	0	0	0	111.9	I66 E67 A72 D73 K78 I79	I66-T70 WeakPolarHBondContact O-CB 3.45Å; I66-T70 PolarHBondContact O-N 3.22Å; I66-T70 PolarHBondContact O-OG1 3.38Å; E67-T70 PolarHBondContact O-N 3.38Å; T70-A72 PolarHBondContact O-N 3.38Å; T70-D73 WeakPolarHBondContact O-CB 3.45Å; T70-D73 PolarHBondContact O-N 3.13Å; T70-K78 HydrophobicContact CG2-CB 3.84Å; T70-K78 HydrophobicContact CG2-CD 3.61Å; T70-K78 HydrophobicContact CG2-CG 3.57Å; T70-K78 WeakPolarHBondContact OG1-CE 3.45Å; T70-I79 HydrophobicContact CG2-CG1 3.8Å
71	S	88.7	Confident	93.1	Very high	59 Å²	59	82.9 Å²	82.9	41%	0.413	44%	0.438	S	S	.	.	H	α-helix	trans	-62.2	-28.1	175	-59.9	0	0	0	0	112.3	E67 Q68 K69	E67-S71 WeakPolarHBondContact O-CB 3.3Å; E67-S71 PolarHBondContact O-N 3.23Å; E67-S71 PolarHBondContact O-OG 2.64Å; Q68-S71 PolarHBondContact O-N 3.02Å; K69-S71 VanDerWaalsContact C-N 3.28Å; K69-S71 PolarHBondContact O-N 2.88Å
72	A	87.8	Confident	93	Very high	89 Å²	89	78.6 Å²	78.6	74%	0.736	42%	0.423	S	S	*	.	H	α-helix	trans	-75.2	-24.6	174.1	0	0	0	0	0	113.4	K69 T70 G74	K69-A72 WeakPolarHBondContact O-CB 3.48Å; K69-A72 PolarHBondContact O-N 2.93Å; K69-A72 VanDerWaalsContact O-N 3.15Å; T70-A72 PolarHBondContact O-N 3.38Å; A72-G74 VanDerWaalsContact C-N 3.32Å; A72-G74 PolarHBondContact O-N 3.29Å
73	D	83.6	Confident	92.9	Very high	110 Å²	110	79.5 Å²	79.5	59%	0.588	42%	0.417	S	S	*	.	H	α-helix	trans	-77.1	-16	-179.8	-62.7	-23.5	0	0	0	113	T70 N75 K78	T70-D73 WeakPolarHBondContact O-CB 3.45Å; T70-D73 PolarHBondContact O-N 3.13Å; D73-N75 PolarHBondContact O-N 3.07Å; D73-K78 IonicContact OD2-NZ 3.54Å; D73-K78 PolarHBondContact OD2-NZ 3.1Å
74	G	83.5	Confident	92.9	Very high	54 Å²	54	81.4 Å²	81.4	56%	0.557	44%	0.435	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.5	5.8	-179.2	0	0	0	0	0	115.9	A72 E76	A72-G74 VanDerWaalsContact C-N 3.32Å; A72-G74 PolarHBondContact O-N 3.29Å; G74-E76 PolarHBondContact O-N 3.27Å; G74-E76 VanDerWaalsContact O-N 3.09Å
75	N	89.4	Confident	93	Very high	82 Å²	82	86.1 Å²	86.1	44%	0.439	45%	0.449	S	S	.	.			trans	-79.8	90.4	178.2	-175.6	-23.1	0	0	0	111.1	D73 K77 K78 I79	D73-N75 PolarHBondContact O-N 3.07Å; N75-K77 VanDerWaalsContact C-N 3.33Å; N75-K77 PolarHBondContact O-N 3.28Å; N75-K77 PolarHBondContact OD1-N 3.43Å; N75-K78 HydrophobicContact CB-CB 4Å; N75-K78 WeakPolarHBondContact O-CB 3.48Å; N75-K78 PolarHBondContact O-N 2.94Å; N75-K78 PolarHBondContact OD1-N 3.27Å; N75-I79 WeakPolarHBondContact O-CG1 3.28Å; N75-I79 PolarHBondContact O-N 3.36Å
76	E	92.5	Very high	93.1	Very high	148 Å²	148	86 Å²	86	69%	0.692	44%	0.442	S	S	*	.	H	α-helix	trans	-50.5	-45.9	-176.4	-66.5	179.6	170.6	0	0	113.8	G74 K78 I79 E80	G74-E76 PolarHBondContact O-N 3.27Å; G74-E76 VanDerWaalsContact O-N 3.09Å; E76-K78 VanDerWaalsContact C-N 3.32Å; E76-K78 PolarHBondContact O-N 3.41Å; E76-I79 WeakPolarHBondContact O-CB 3.28Å; E76-I79 PolarHBondContact O-N 3.12Å; E76-E80 WeakPolarHBondContact O-CG 3.31Å; E76-E80 PolarHBondContact O-N 3.21Å
77	K	93.6	Very high	93.2	Very high	161 Å²	161	86.4 Å²	86.4	70%	0.7	44%	0.442	S	S	*	.	H	α-helix	trans	-61.3	-41	178.9	-69.8	-176.6	179	179	0	112.1	N75 M81	N75-K77 VanDerWaalsContact C-N 3.33Å; N75-K77 PolarHBondContact O-N 3.28Å; N75-K77 PolarHBondContact OD1-N 3.43Å; K77-M81 VanDerWaalsContact O-CG 3.27Å; K77-M81 WeakPolarHBondContact O-CG 3.23Å; K77-M81 PolarHBondContact O-N 3.25Å; K77-M81 VanDerWaalsContact O-N 3.07Å
78	K	94.1	Very high	93.4	Very high	84 Å²	84	90.5 Å²	90.5	37%	0.365	46%	0.46	S	S	.	.	H	α-helix	trans	-69	-39.4	177.9	-167.2	-174.9	156.2	-162.7	0	110.5	T70 D73 N75 E76 M81 V82	T70-K78 HydrophobicContact CG2-CB 3.84Å; T70-K78 HydrophobicContact CG2-CD 3.61Å; T70-K78 HydrophobicContact CG2-CG 3.57Å; T70-K78 WeakPolarHBondContact OG1-CE 3.45Å; D73-K78 IonicContact OD2-NZ 3.54Å; D73-K78 PolarHBondContact OD2-NZ 3.1Å; N75-K78 HydrophobicContact CB-CB 4Å; N75-K78 WeakPolarHBondContact O-CB 3.48Å; N75-K78 PolarHBondContact O-N 2.94Å; N75-K78 PolarHBondContact OD1-N 3.27Å; E76-K78 VanDerWaalsContact C-N 3.32Å; E76-K78 PolarHBondContact O-N 3.41Å; K78-M81 PolarHBondContact O-N 3.42Å; K78-V82 VanDerWaalsContact O-CG2 3.25Å; K78-V82 WeakPolarHBondContact O-CG2 3.5Å; K78-V82 PolarHBondContact O-N 3.13Å
79	I	94.2	Very high	93.6	Very high	26 Å²	26	83.9 Å²	83.9	13%	0.133	43%	0.429	C	S	.	.	H	α-helix	trans	-59.6	-48.7	174.9	-63.9	167.4	0	0	0	110.3	T70 N75 E76 M81 V82 R83	T70-I79 HydrophobicContact CG2-CG1 3.8Å; N75-I79 WeakPolarHBondContact O-CG1 3.28Å; N75-I79 PolarHBondContact O-N 3.36Å; E76-I79 WeakPolarHBondContact O-CB 3.28Å; E76-I79 PolarHBondContact O-N 3.12Å; I79-M81 PolarHBondContact O-N 2.85Å; I79-V82 PolarHBondContact O-N 3.2Å; I79-R83 WeakPolarHBondContact O-CB 3.43Å; I79-R83 PolarHBondContact O-N 2.99Å
80	E	95.7	Very high	93.9	Very high	126 Å²	126	78.7 Å²	78.7	59%	0.589	41%	0.407	S	S	*	.	H	α-helix	trans	-59.9	-44.8	178	-73.1	178.5	174.6	0	0	112.3	E76 V82 R83 A84	E76-E80 WeakPolarHBondContact O-CG 3.31Å; E76-E80 PolarHBondContact O-N 3.21Å; E80-V82 PolarHBondContact O-N 3.25Å; E80-R83 PolarHBondContact O-N 3.16Å; E80-A84 WeakPolarHBondContact O-CB 3.32Å; E80-A84 PolarHBondContact O-N 2.96Å
81	M	96.6	Very high	94.2	Very high	139 Å²	139	85.3 Å²	85.3	69%	0.685	44%	0.435	S	S	*	.	H	α-helix	trans	-61.2	-44.5	177.5	-73.8	177.1	67.3	0	0	112.4	K77 K78 I79 Y85	K77-M81 VanDerWaalsContact O-CG 3.27Å; K77-M81 WeakPolarHBondContact O-CG 3.23Å; K77-M81 PolarHBondContact O-N 3.25Å; K77-M81 VanDerWaalsContact O-N 3.07Å; K78-M81 PolarHBondContact O-N 3.42Å; I79-M81 PolarHBondContact O-N 2.85Å; M81-Y85 PolarHBondContact O-N 2.75Å; M81-Y85 VanDerWaalsContact O-N 3.12Å
82	V	96.8	Very high	94.6	Very high	14 Å²	14	86.1 Å²	86.1	9%	0.085	43%	0.433	C	S	.	.	H	α-helix	trans	-67	-43.8	-180	172.7	0	0	0	0	110.6	I63 I66 E67 K78 I79 E80 Y85 R86	I63-V82 HydrophobicContact CD1-CG1 3.74Å; I63-V82 HydrophobicContact CG1-CG1 3.91Å; I66-V82 HydrophobicContact CB-CG1 4.46Å; I66-V82 HydrophobicContact CG2-CG1 4.09Å; I66-V82 HydrophobicContact CG2-CG2 3.96Å; E67-V82 HydrophobicContact CB-CG1 3.58Å; E67-V82 HydrophobicContact CG-CG1 4.08Å; K78-V82 VanDerWaalsContact O-CG2 3.25Å; K78-V82 WeakPolarHBondContact O-CG2 3.5Å; K78-V82 PolarHBondContact O-N 3.13Å; I79-V82 PolarHBondContact O-N 3.2Å; E80-V82 PolarHBondContact O-N 3.25Å; V82-Y85 PolarHBondContact O-N 3.45Å; V82-R86 PolarHBondContact O-N 2.61Å
83	R	96.5	Very high	95.1	Very high	108 Å²	108	81.9 Å²	81.9	41%	0.408	40%	0.398	S	S	.	.	H	α-helix	trans	-60.3	-48.4	176.3	-175.4	177.8	-62.3	160.5	2.3	112.1	E67 I79 E80 Y85 R86 E87	E67-R83 WeakPolarHBondContact OE1-CB 3.44Å; E67-R83 IonicContact OE1-CZ 3.88Å; E67-R83 IonicContact OE1-NE 3.23Å; E67-R83 PolarHBondContact OE1-NE 2.92Å; E67-R83 VanDerWaalsContact OE1-NE 3.09Å; E67-R83 IonicContact OE1-NH2 3.09Å; I79-R83 WeakPolarHBondContact O-CB 3.43Å; I79-R83 PolarHBondContact O-N 2.99Å; E80-R83 PolarHBondContact O-N 3.16Å; R83-Y85 PolarHBondContact O-N 3.4Å; R83-R86 WeakPolarHBondContact O-CB 3.39Å; R83-R86 PolarHBondContact O-N 2.92Å; R83-R86 VanDerWaalsContact O-N 3.14Å; R83-E87 WeakPolarHBondContact O-CG 3.41Å; R83-E87 PolarHBondContact O-N 3.3Å
84	A	97.7	Very high	95.8	Very high	57 Å²	57	79.5 Å²	79.5	47%	0.471	38%	0.383	S	S	.	.	H	α-helix	trans	-59.7	-35.8	178	0	0	0	0	0	111.9	E80 K88	E80-A84 WeakPolarHBondContact O-CB 3.32Å; E80-A84 PolarHBondContact O-N 2.96Å; A84-K88 PolarHBondContact O-N 3.17Å; A84-K88 VanDerWaalsContact O-N 3.07Å
85	Y	98.1	Very high	96.5	Very high	127 Å²	127	79.7 Å²	79.7	50%	0.498	38%	0.38	S	S	.	.	H	α-helix	trans	-72.7	-39	175.8	-162.7	-112.2	0	0	0	112.7	I63 M81 V82 R83 K88 I89	I63-Y85 HydrophobicContact CD1-CD1 3.8Å; I63-Y85 HydrophobicContact CG1-CD1 3.95Å; M81-Y85 PolarHBondContact O-N 2.75Å; M81-Y85 VanDerWaalsContact O-N 3.12Å; V82-Y85 PolarHBondContact O-N 3.45Å; R83-Y85 PolarHBondContact O-N 3.4Å; Y85-K88 HydrophobicContact CD2-CD 4.47Å; Y85-K88 HydrophobicContact CE2-CD 4.47Å; Y85-K88 WeakPolarHBondContact O-CB 3.47Å; Y85-K88 PolarHBondContact O-N 3.1Å; Y85-I89 HydrophobicContact CD1-CD1 3.85Å; Y85-I89 HydrophobicContact CE1-CD1 3.67Å; Y85-I89 HydrophobicContact CE1-CG1 4.46Å; Y85-I89 WeakPolarHBondContact O-CG1 3.43Å; Y85-I89 PolarHBondContact O-N 3.19Å; Y85-I89 VanDerWaalsContact O-N 3.12Å
86	R	97.8	Very high	97	Very high	43 Å²	43	76.8 Å²	76.8	16%	0.162	36%	0.364	C	S	.	.	H	α-helix	trans	-57.1	-51.7	171	-178.6	-176.7	56.6	87.7	2.6	110.9	I63 S64 E67 V82 R83 K88 I89 E90	I63-R86 HydrophobicContact CG1-CB 4.25Å; I63-R86 HydrophobicContact CG2-CB 3.78Å; I63-R86 HydrophobicContact CG2-CG 3.97Å; S64-R86 VanDerWaalsContact OG-CD 3.27Å; S64-R86 WeakPolarHBondContact OG-CD 3.26Å; E67-R86 IonicContact OE1-NH2 2.64Å; E67-R86 WeakPolarHBondContact OE2-CD 3.33Å; E67-R86 IonicContact OE2-CZ 3.92Å; E67-R86 IonicContact OE2-NE 2.75Å; E67-R86 PolarHBondContact OE2-NE 3.45Å; E67-R86 IonicContact OE2-NH2 3.02Å; V82-R86 PolarHBondContact O-N 2.61Å; R83-R86 WeakPolarHBondContact O-CB 3.39Å; R83-R86 PolarHBondContact O-N 2.92Å; R83-R86 VanDerWaalsContact O-N 3.14Å; R86-K88 VanDerWaalsContact C-N 3.26Å; R86-K88 PolarHBondContact O-N 3.4Å; R86-I89 PolarHBondContact O-N 2.83Å; R86-E90 HydrophobicContact CG-CG 4.48Å; R86-E90 IonicContact CZ-OE1 2.76Å; R86-E90 IonicContact NE-OE1 3.68Å; R86-E90 VanDerWaalsContact NH1-CD 3.33Å; R86-E90 IonicContact NH1-OE1 3.59Å; R86-E90 PolarHBondContact NH1-OE1 2.95Å; R86-E90 IonicContact NH1-OE2 3.17Å; R86-E90 PolarHBondContact NH1-OE2 3.13Å; R86-E90 WeakPolarHBondContact O-CG 3.37Å; R86-E90 PolarHBondContact O-N 3.01Å
87	E	97.6	Very high	97.3	Very high	79 Å²	79	69.7 Å²	69.7	37%	0.369	33%	0.332	S	S	.	.	H	α-helix	trans	-61.4	-33	179.7	-71.4	175.6	-169.4	0	0	112.9	R83 E90 K91	R83-E87 WeakPolarHBondContact O-CG 3.41Å; R83-E87 PolarHBondContact O-N 3.3Å; E87-E90 PolarHBondContact O-N 2.99Å; E87-K91 WeakPolarHBondContact O-CG 3.39Å; E87-K91 PolarHBondContact O-N 2.65Å; E87-K91 VanDerWaalsContact O-N 3.09Å
88	K	98.4	Very high	97.5	Very high	108 Å²	108	66 Å²	66	47%	0.47	32%	0.317	S	S	.	.	H	α-helix	trans	-62.4	-47.9	172	178.8	-178.2	170	-175.8	0	111.1	A84 Y85 R86 E90 K91 E92	A84-K88 PolarHBondContact O-N 3.17Å; A84-K88 VanDerWaalsContact O-N 3.07Å; Y85-K88 HydrophobicContact CD2-CD 4.47Å; Y85-K88 HydrophobicContact CE2-CD 4.47Å; Y85-K88 WeakPolarHBondContact O-CB 3.47Å; Y85-K88 PolarHBondContact O-N 3.1Å; R86-K88 VanDerWaalsContact C-N 3.26Å; R86-K88 PolarHBondContact O-N 3.4Å; K88-E90 VanDerWaalsContact C-N 3.3Å; K88-E90 PolarHBondContact O-N 2.93Å; K88-K91 PolarHBondContact O-N 3.18Å; K88-E92 WeakPolarHBondContact CE-OE1 3.3Å; K88-E92 IonicContact NZ-OE1 2.87Å; K88-E92 WeakPolarHBondContact O-CG 3.38Å; K88-E92 PolarHBondContact O-N 3.17Å
89	I	98.5	Very high	97.7	Very high	6 Å²	6	64.2 Å²	64.2	3%	0.031	31%	0.311	C	S	.	.	H	α-helix	trans	-63.2	-38.6	178.3	-66.5	162.6	0	0	0	110.7	R56 W60 I63 Y85 R86 K91 E92 L93	R56-I89 WeakPolarHBondContact O-CG2 3.38Å; W60-I89 HydrophobicContact CB-CG2 3.78Å; I63-I89 HydrophobicContact CB-CD1 4.39Å; I63-I89 HydrophobicContact CG2-CD1 3.86Å; Y85-I89 HydrophobicContact CD1-CD1 3.85Å; Y85-I89 HydrophobicContact CE1-CD1 3.67Å; Y85-I89 HydrophobicContact CE1-CG1 4.46Å; Y85-I89 WeakPolarHBondContact O-CG1 3.43Å; Y85-I89 PolarHBondContact O-N 3.19Å; Y85-I89 VanDerWaalsContact O-N 3.12Å; R86-I89 PolarHBondContact O-N 2.83Å; I89-K91 PolarHBondContact O-N 3.49Å; I89-E92 PolarHBondContact O-N 3.32Å; I89-L93 WeakPolarHBondContact O-CB 3.5Å; I89-L93 PolarHBondContact O-N 3.48Å
90	E	98.3	Very high	97.9	Very high	30 Å²	30	63 Å²	63	14%	0.14	31%	0.305	C	S	.	.	H	α-helix	trans	-59.7	-45.2	175.7	-69.8	174.4	172.9	0	0	112.1	W60 R86 E87 K88 E92 L93 E94 V137	W60-E90 VanDerWaalsContact CD1-CG 3.47Å; W60-E90 VanDerWaalsContact NE1-CG 3.3Å; W60-E90 PolarHBondContact NE1-OE1 3.46Å; R86-E90 HydrophobicContact CG-CG 4.48Å; R86-E90 IonicContact CZ-OE1 2.76Å; R86-E90 IonicContact NE-OE1 3.68Å; R86-E90 VanDerWaalsContact NH1-CD 3.33Å; R86-E90 IonicContact NH1-OE1 3.59Å; R86-E90 PolarHBondContact NH1-OE1 2.95Å; R86-E90 IonicContact NH1-OE2 3.17Å; R86-E90 PolarHBondContact NH1-OE2 3.13Å; R86-E90 WeakPolarHBondContact O-CG 3.37Å; R86-E90 PolarHBondContact O-N 3.01Å; E87-E90 PolarHBondContact O-N 2.99Å; K88-E90 VanDerWaalsContact C-N 3.3Å; K88-E90 PolarHBondContact O-N 2.93Å; E90-E92 VanDerWaalsContact C-N 3.34Å; E90-E92 PolarHBondContact O-N 3.36Å; E90-L93 PolarHBondContact O-N 3.46Å; E90-E94 VanDerWaalsContact O-CB 3.28Å; E90-E94 WeakPolarHBondContact O-CB 3.33Å; E90-E94 PolarHBondContact O-N 3.21Å; E90-V137 HydrophobicContact CG-CB 4.13Å
91	K	98.2	Very high	98	Very high	141 Å²	141	57.1 Å²	57.1	61%	0.613	28%	0.277	S	S	*	.	H	α-helix	trans	-63.3	-39.7	176.3	-71.4	171.9	-175.3	172.3	0	112.1	E87 K88 I89 A95	E87-K91 WeakPolarHBondContact O-CG 3.39Å; E87-K91 PolarHBondContact O-N 2.65Å; E87-K91 VanDerWaalsContact O-N 3.09Å; K88-K91 PolarHBondContact O-N 3.18Å; I89-K91 PolarHBondContact O-N 3.49Å; K91-A95 WeakPolarHBondContact O-CB 3.35Å; K91-A95 PolarHBondContact O-N 2.84Å
92	E	98.4	Very high	98.1	Very high	77 Å²	77	53 Å²	53	36%	0.36	26%	0.262	S	S	.	.	H	α-helix	trans	-66.7	-43.6	176.4	-70.9	173.3	-172.1	0	0	111.8	K88 I89 E90 A95 V96	K88-E92 WeakPolarHBondContact CE-OE1 3.3Å; K88-E92 IonicContact NZ-OE1 2.87Å; K88-E92 WeakPolarHBondContact O-CG 3.38Å; K88-E92 PolarHBondContact O-N 3.17Å; I89-E92 PolarHBondContact O-N 3.32Å; E90-E92 VanDerWaalsContact C-N 3.34Å; E90-E92 PolarHBondContact O-N 3.36Å; E92-A95 PolarHBondContact O-N 2.99Å; E92-V96 WeakPolarHBondContact O-CG2 3.22Å; E92-V96 PolarHBondContact O-N 2.85Å
93	L	98.3	Very high	98.2	Very high	0 Å²	0	52.4 Å²	52.4	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-62	-46.5	175.3	-177.5	155.5	0	0	0	110.8	R56 R57 I89 E90 V96 C97 L134 V137	R56-L93 HydrophobicContact CB-CB 4.28Å; R57-L93 HydrophobicContact CB-CD1 4.46Å; R57-L93 HydrophobicContact CG-CD1 3.51Å; I89-L93 WeakPolarHBondContact O-CB 3.5Å; I89-L93 PolarHBondContact O-N 3.48Å; E90-L93 PolarHBondContact O-N 3.46Å; L93-V96 PolarHBondContact O-N 3.39Å; L93-C97 PolarHBondContact O-N 3.05Å; L93-C97 PolarHBondContact O-SG 2.94Å; L93-L134 HydrophobicContact CD2-CD2 4.24Å; L93-V137 HydrophobicContact CD1-CG1 4.01Å; L93-V137 HydrophobicContact CD2-CG2 3.99Å
94	E	98.2	Very high	98.3	Very high	59 Å²	59	47.2 Å²	47.2	28%	0.276	24%	0.239	S	C	.	.	H	α-helix	trans	-60.6	-46.1	178.4	177	171.6	-162.8	0	0	111.4	E90 V96 C97 Q98 L134 K142	E90-E94 VanDerWaalsContact O-CB 3.28Å; E90-E94 WeakPolarHBondContact O-CB 3.33Å; E90-E94 PolarHBondContact O-N 3.21Å; E94-V96 VanDerWaalsContact C-N 3.31Å; E94-V96 PolarHBondContact O-N 3.29Å; E94-C97 PolarHBondContact O-N 3.41Å; E94-Q98 HydrophobicContact CG-CG 4.1Å; E94-Q98 WeakPolarHBondContact O-CB 3.3Å; E94-Q98 VanDerWaalsContact O-CG 3.29Å; E94-Q98 WeakPolarHBondContact O-CG 3.48Å; E94-Q98 PolarHBondContact O-N 3.37Å; E94-L134 HydrophobicContact CB-CD2 4.03Å; E94-L134 HydrophobicContact CG-CD2 4.02Å; E94-K142 WeakPolarHBondContact OE1-CE 3.36Å; E94-K142 IonicContact OE1-NZ 3.63Å; E94-K142 PolarHBondContact OE1-NZ 2.84Å; E94-K142 IonicContact OE2-NZ 3.93Å; E94-K142 PolarHBondContact OE2-NZ 2.85Å
95	A	98.4	Very high	98.3	Very high	59 Å²	59	47.1 Å²	47.1	49%	0.488	23%	0.231	S	C	.	.	H	α-helix	trans	-57.4	-44.4	178.1	0	0	0	0	0	111.9	K91 E92 Q98 D99	K91-A95 WeakPolarHBondContact O-CB 3.35Å; K91-A95 PolarHBondContact O-N 2.84Å; E92-A95 PolarHBondContact O-N 2.99Å; A95-Q98 PolarHBondContact O-N 3.39Å; A95-D99 WeakPolarHBondContact O-CB 3Å; A95-D99 PolarHBondContact O-N 3.3Å
96	V	98.4	Very high	98.3	Very high	20 Å²	20	44.7 Å²	44.7	12%	0.121	23%	0.226	C	C	.	.	H	α-helix	trans	-67.4	-41.8	178.1	179.1	0	0	0	0	111.4	Y49 V52 V53 E92 L93 E94 D99 V100	Y49-V96 HydrophobicContact CD1-CG1 3.79Å; Y49-V96 HydrophobicContact CE1-CG1 4.22Å; V52-V96 HydrophobicContact CB-CG1 4.31Å; V52-V96 HydrophobicContact CG1-CB 4.3Å; V52-V96 HydrophobicContact CG1-CG1 3.55Å; V52-V96 HydrophobicContact CG1-CG2 3.75Å; V53-V96 HydrophobicContact CG2-CB 3.96Å; V53-V96 HydrophobicContact CG2-CG1 3.32Å; E92-V96 WeakPolarHBondContact O-CG2 3.22Å; E92-V96 PolarHBondContact O-N 2.85Å; L93-V96 PolarHBondContact O-N 3.39Å; E94-V96 VanDerWaalsContact C-N 3.31Å; E94-V96 PolarHBondContact O-N 3.29Å; V96-D99 WeakPolarHBondContact O-CB 3.07Å; V96-D99 PolarHBondContact O-N 2.89Å; V96-V100 PolarHBondContact O-N 3.33Å
97	C	98.6	Very high	98.4	Very high	0 Å²	0	46 Å²	46	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-64.3	-42.7	177.4	-65.8	0	0	0	0	111.3	L93 E94 D99 V100 L101 Y130 L134	L93-C97 PolarHBondContact O-N 3.05Å; L93-C97 PolarHBondContact O-SG 2.94Å; E94-C97 PolarHBondContact O-N 3.41Å; C97-D99 VanDerWaalsContact C-N 3.31Å; C97-D99 PolarHBondContact O-N 2.94Å; C97-V100 WeakPolarHBondContact O-CG1 3.41Å; C97-V100 PolarHBondContact O-N 3.35Å; C97-L101 VanDerWaalsContact O-CB 3.31Å; C97-L101 WeakPolarHBondContact O-CB 3.4Å; C97-L101 WeakPolarHBondContact O-CD1 3.1Å; C97-L101 WeakPolarHBondContact O-CG 3.34Å; C97-L101 PolarHBondContact O-N 3.05Å; C97-Y130 HydrophobicContact CB-CD1 4.33Å; C97-L134 HydrophobicContact CB-CD1 3.97Å; C97-L134 HydrophobicContact CB-CD2 3.71Å; C97-L134 HydrophobicContact CB-CG 3.68Å
98	Q	98.4	Very high	98.4	Very high	84 Å²	84	42.6 Å²	42.6	39%	0.393	22%	0.216	S	C	.	.	H	α-helix	trans	-66.7	-34.9	177.9	-68.4	-58.1	-23.7	0	0	112.3	E94 A95 S102	E94-Q98 HydrophobicContact CG-CG 4.1Å; E94-Q98 WeakPolarHBondContact O-CB 3.3Å; E94-Q98 VanDerWaalsContact O-CG 3.29Å; E94-Q98 WeakPolarHBondContact O-CG 3.48Å; E94-Q98 PolarHBondContact O-N 3.37Å; A95-Q98 PolarHBondContact O-N 3.39Å; Q98-S102 VanDerWaalsContact O-CB 3.3Å; Q98-S102 WeakPolarHBondContact O-CB 3.02Å; Q98-S102 PolarHBondContact O-N 3.4Å
99	D	98.3	Very high	98.4	Very high	46 Å²	46	38.7 Å²	38.7	25%	0.246	20%	0.2	C	C	.	.	H	α-helix	trans	-59.5	-51.1	175.6	-168.7	41.7	0	0	0	111.4	K28 Y49 A95 V96 C97 S102 L103	K28-D99 WeakPolarHBondContact CE-OD1 3.45Å; K28-D99 IonicContact NZ-OD1 3.35Å; K28-D99 PolarHBondContact NZ-OD1 2.99Å; K28-D99 IonicContact NZ-OD2 2.71Å; Y49-D99 HydrophobicContact CE1-CB 4.33Å; Y49-D99 PolarHBondContact OH-OD2 3.47Å; A95-D99 WeakPolarHBondContact O-CB 3Å; A95-D99 PolarHBondContact O-N 3.3Å; V96-D99 WeakPolarHBondContact O-CB 3.07Å; V96-D99 PolarHBondContact O-N 2.89Å; C97-D99 VanDerWaalsContact C-N 3.31Å; C97-D99 PolarHBondContact O-N 2.94Å; D99-S102 WeakPolarHBondContact O-CB 3.32Å; D99-S102 PolarHBondContact O-N 2.82Å; D99-L103 WeakPolarHBondContact O-CG 3.19Å; D99-L103 PolarHBondContact O-N 3.07Å; D99-L103 VanDerWaalsContact O-N 3.1Å
100	V	98.4	Very high	98.2	Very high	0 Å²	0	45.6 Å²	45.6	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-71.9	-35.7	179.8	68.8	0	0	0	0	113.1	Y49 V96 C97 S102 L103 L104 M126 Y130	Y49-V100 HydrophobicContact CD1-CB 3.72Å; Y49-V100 HydrophobicContact CD1-CG1 4.35Å; Y49-V100 HydrophobicContact CD1-CG2 4.19Å; Y49-V100 HydrophobicContact CD2-CB 4.38Å; Y49-V100 HydrophobicContact CD2-CG2 4.04Å; Y49-V100 HydrophobicContact CE1-CB 3.86Å; Y49-V100 HydrophobicContact CE2-CG2 4.4Å; Y49-V100 HydrophobicContact CG-CB 3.99Å; Y49-V100 HydrophobicContact CG-CG2 3.93Å; V96-V100 PolarHBondContact O-N 3.33Å; C97-V100 WeakPolarHBondContact O-CG1 3.41Å; C97-V100 PolarHBondContact O-N 3.35Å; V100-S102 VanDerWaalsContact C-N 3.29Å; V100-S102 PolarHBondContact O-N 3.47Å; V100-L103 PolarHBondContact O-N 2.92Å; V100-L104 HydrophobicContact CG2-CD1 4.28Å; V100-L104 HydrophobicContact CG2-CG 4.48Å; V100-L104 WeakPolarHBondContact O-CB 3.42Å; V100-L104 VanDerWaalsContact O-CG 3.23Å; V100-L104 WeakPolarHBondContact O-CG 3.48Å; V100-L104 PolarHBondContact O-N 3.23Å; V100-M126 HydrophobicContact CG2-CE 3.4Å; V100-M126 VanDerWaalsContact CG2-CE 3.4Å; V100-Y130 HydrophobicContact CB-CE2 4.45Å; V100-Y130 HydrophobicContact CG1-CD1 3.42Å; V100-Y130 VanDerWaalsContact CG1-CD1 3.42Å; V100-Y130 HydrophobicContact CG1-CD2 3.48Å; V100-Y130 VanDerWaalsContact CG1-CD2 3.48Å; V100-Y130 HydrophobicContact CG1-CE1 3.65Å; V100-Y130 HydrophobicContact CG1-CE2 3.74Å; V100-Y130 HydrophobicContact CG1-CG 3.37Å; V100-Y130 HydrophobicContact CG2-CD2 4.21Å; V100-Y130 HydrophobicContact CG2-CE2 3.9Å
101	L	98.8	Very high	98	Very high	2 Å²	2	47.4 Å²	47.4	1%	0.01	24%	0.241	C	C	.	.	H	α-helix	trans	-60.9	-40.8	173.4	-72.8	169.5	0	0	0	111.1	C97 L104 D105 K127 Y131 L134	C97-L101 VanDerWaalsContact O-CB 3.31Å; C97-L101 WeakPolarHBondContact O-CB 3.4Å; C97-L101 WeakPolarHBondContact O-CD1 3.1Å; C97-L101 WeakPolarHBondContact O-CG 3.34Å; C97-L101 PolarHBondContact O-N 3.05Å; L101-L104 PolarHBondContact O-N 3.27Å; L101-D105 WeakPolarHBondContact O-CB 3.34Å; L101-D105 PolarHBondContact O-N 3.49Å; L101-K127 HydrophobicContact CD2-CB 4.43Å; L101-K127 HydrophobicContact CD2-CG 3.77Å; L101-Y131 HydrophobicContact CD1-CD1 4.02Å; L101-Y131 HydrophobicContact CD1-CE1 3.71Å; L101-Y131 HydrophobicContact CD1-CE2 4.38Å; L101-Y131 HydrophobicContact CD1-CG 4.47Å; L101-Y131 HydrophobicContact CD2-CD2 3.88Å; L101-Y131 HydrophobicContact CD2-CE1 4.46Å; L101-Y131 HydrophobicContact CD2-CE2 3.64Å; L101-Y131 HydrophobicContact CD2-CG 4.38Å; L101-L134 HydrophobicContact CD1-CD1 3.7Å
102	S	98.6	Very high	97.9	Very high	53 Å²	53	41.8 Å²	41.8	37%	0.371	22%	0.219	S	C	.	.	H	α-helix	trans	-62.3	-41.7	173.7	-178.2	0	0	0	0	112	Q98 D99 V100 D105 N106	Q98-S102 VanDerWaalsContact O-CB 3.3Å; Q98-S102 WeakPolarHBondContact O-CB 3.02Å; Q98-S102 PolarHBondContact O-N 3.4Å; D99-S102 WeakPolarHBondContact O-CB 3.32Å; D99-S102 PolarHBondContact O-N 2.82Å; V100-S102 VanDerWaalsContact C-N 3.29Å; V100-S102 PolarHBondContact O-N 3.47Å; S102-D105 PolarHBondContact O-N 3.16Å; S102-N106 WeakPolarHBondContact O-CB 3.34Å; S102-N106 PolarHBondContact O-N 3.48Å; S102-N106 PolarHBondContact O-ND2 3.18Å; S102-N106 PolarHBondContact OG-ND2 2.79Å
103	L	98.7	Very high	97.6	Very high	1 Å²	1	40.5 Å²	40.5	1%	0.005	22%	0.218	C	C	.	.	H	α-helix	trans	-63.2	-44.7	176	-67.7	176.3	0	0	0	112.2	K28 T31 E32 L45 Y49 D99 V100 Y107 L108	K28-L103 HydrophobicContact CB-CD1 4.05Å; K28-L103 HydrophobicContact CG-CD1 4.05Å; K28-L103 HydrophobicContact CG-CD2 4.12Å; T31-L103 HydrophobicContact CG2-CB 4.13Å; T31-L103 HydrophobicContact CG2-CD2 4.02Å; E32-L103 HydrophobicContact CG-CD2 3.85Å; L45-L103 HydrophobicContact CD1-CD1 4.46Å; Y49-L103 HydrophobicContact CE2-CD1 4.03Å; Y49-L103 WeakPolarHBondContact OH-CD1 3.44Å; D99-L103 WeakPolarHBondContact O-CG 3.19Å; D99-L103 PolarHBondContact O-N 3.07Å; D99-L103 VanDerWaalsContact O-N 3.1Å; V100-L103 PolarHBondContact O-N 2.92Å; L103-Y107 HydrophobicContact CD2-CD2 4.02Å; L103-Y107 HydrophobicContact CD2-CE2 4.15Å; L103-Y107 PolarHBondContact O-N 2.94Å; L103-Y107 VanDerWaalsContact O-N 3.09Å; L103-L108 PolarHBondContact O-N 3.41Å
104	L	98.6	Very high	97.1	Very high	0 Å²	0	49.7 Å²	49.7	0%	0	26%	0.261	C	S	.	.	I	π-helix	trans	-59.8	-48.6	178	-69.7	165.9	0	0	0	111	V100 L101 L108 I109 Y123 M126 K127	V100-L104 HydrophobicContact CG2-CD1 4.28Å; V100-L104 HydrophobicContact CG2-CG 4.48Å; V100-L104 WeakPolarHBondContact O-CB 3.42Å; V100-L104 VanDerWaalsContact O-CG 3.23Å; V100-L104 WeakPolarHBondContact O-CG 3.48Å; V100-L104 PolarHBondContact O-N 3.23Å; L101-L104 PolarHBondContact O-N 3.27Å; L104-L108 HydrophobicContact CD2-CD1 3.95Å; L104-L108 PolarHBondContact O-N 2.84Å; L104-I109 HydrophobicContact CB-CD1 4.02Å; L104-I109 HydrophobicContact CB-CG1 4.46Å; L104-I109 WeakPolarHBondContact O-CB 3.41Å; L104-I109 WeakPolarHBondContact O-CG1 3.47Å; L104-I109 PolarHBondContact O-N 2.9Å; L104-Y123 HydrophobicContact CD2-CD1 3.85Å; L104-Y123 HydrophobicContact CD2-CG 4.14Å; L104-M126 HydrophobicContact CD1-CB 4.36Å; L104-M126 HydrophobicContact CD1-CG 4.16Å; L104-M126 HydrophobicContact CD2-CB 4.38Å; L104-M126 HydrophobicContact CD2-CG 4.41Å; L104-M126 HydrophobicContact CD2-SD 4.17Å; L104-K127 HydrophobicContact CD1-CB 4.03Å
105	D	98.3	Very high	96.8	Very high	54 Å²	54	52.4 Å²	52.4	29%	0.289	28%	0.282	S	S	.	.	I	π-helix	trans	-75.8	-37.6	-174.8	-75.2	-10	0	0	0	113.3	L101 S102 K110 K127	L101-D105 WeakPolarHBondContact O-CB 3.34Å; L101-D105 PolarHBondContact O-N 3.49Å; S102-D105 PolarHBondContact O-N 3.16Å; D105-K110 WeakPolarHBondContact O-CB 3.11Å; D105-K127 WeakPolarHBondContact OD1-CE 3.26Å; D105-K127 IonicContact OD1-NZ 2.73Å; D105-K127 PolarHBondContact OD1-NZ 3.31Å; D105-K127 IonicContact OD2-NZ 3.15Å; D105-K127 PolarHBondContact OD2-NZ 3.39Å
106	N	98	Very high	96.6	Very high	77 Å²	77	52.8 Å²	52.8	41%	0.412	27%	0.274	S	S	.	.	I	π-helix	trans	-90.4	-25.5	-172.1	-65.8	-47.2	0	0	0	114.1	S102	S102-N106 WeakPolarHBondContact O-CB 3.34Å; S102-N106 PolarHBondContact O-N 3.48Å; S102-N106 PolarHBondContact O-ND2 3.18Å; S102-N106 PolarHBondContact OG-ND2 2.79Å
107	Y	98	Very high	96.5	Very high	69 Å²	69	55.6 Å²	55.6	27%	0.271	28%	0.283	S	S	.	.	I	π-helix	trans	-128.4	-31.1	-170.5	-57.2	-87.4	0	0	0	114.5	T31 E32 N34 L103 N111	T31-Y107 HydrophobicContact CG2-CG 4.37Å; E32-Y107 HydrophobicContact CB-CE1 4.43Å; E32-Y107 HydrophobicContact CG-CE1 4.42Å; E32-Y107 HydrophobicContact CG-CE2 4.01Å; N34-Y107 HydrophobicContact CB-CD1 4.04Å; N34-Y107 HydrophobicContact CB-CE1 4.45Å; N34-Y107 WeakPolarHBondContact OD1-CD1 3.44Å; L103-Y107 HydrophobicContact CD2-CD2 4.02Å; L103-Y107 HydrophobicContact CD2-CE2 4.15Å; L103-Y107 PolarHBondContact O-N 2.94Å; L103-Y107 VanDerWaalsContact O-N 3.09Å; Y107-N111 WeakPolarHBondContact O-CB 3.29Å; Y107-N111 PolarHBondContact O-ND2 3.14Å
108	L	98.2	Very high	96.4	Very high	8 Å²	8	58.5 Å²	58.5	4%	0.042	30%	0.296	C	S	.	.	I	π-helix	trans	-100.7	-67	-171.1	-60	172.5	0	0	0	112	T31 L37 L45 L103 L104 K110 N111 C112 Y123	T31-L108 HydrophobicContact CG2-CD1 3.98Å; T31-L108 HydrophobicContact CG2-CD2 3.79Å; T31-L108 HydrophobicContact CG2-CG 3.76Å; L37-L108 HydrophobicContact CD1-CD2 3.75Å; L37-L108 HydrophobicContact CG-CD2 3.81Å; L45-L108 HydrophobicContact CD2-CD1 3.54Å; L103-L108 PolarHBondContact O-N 3.41Å; L104-L108 HydrophobicContact CD2-CD1 3.95Å; L104-L108 PolarHBondContact O-N 2.84Å; L108-K110 VanDerWaalsContact C-N 3.34Å; L108-K110 PolarHBondContact O-N 2.68Å; L108-N111 PolarHBondContact O-N 3.27Å; L108-C112 PolarHBondContact O-N 3.42Å; L108-C112 VanDerWaalsContact O-N 3.13Å; L108-C112 PolarHBondContact O-SG 3.32Å; L108-Y123 HydrophobicContact CB-CD1 4.11Å; L108-Y123 HydrophobicContact CB-CD2 3.8Å; L108-Y123 HydrophobicContact CB-CE1 4.17Å; L108-Y123 HydrophobicContact CB-CE2 3.88Å; L108-Y123 HydrophobicContact CB-CG 3.96Å; L108-Y123 HydrophobicContact CD1-CD1 3.96Å; L108-Y123 HydrophobicContact CD1-CE1 3.79Å; L108-Y123 HydrophobicContact CD2-CE1 4.22Å; L108-Y123 HydrophobicContact CD2-CE2 4.36Å; L108-Y123 HydrophobicContact CG-CE1 4.28Å
109	I	97.8	Very high	96.4	Very high	27 Å²	27	55.3 Å²	55.3	14%	0.138	28%	0.283	C	S	.	.	G	3₁₀ helix	trans	-61.5	-44.7	-179.2	-62.5	171.4	0	0	0	110.3	L104 N111 C112 Y123 L124 K127	L104-I109 HydrophobicContact CB-CD1 4.02Å; L104-I109 HydrophobicContact CB-CG1 4.46Å; L104-I109 WeakPolarHBondContact O-CB 3.41Å; L104-I109 WeakPolarHBondContact O-CG1 3.47Å; L104-I109 PolarHBondContact O-N 2.9Å; I109-N111 PolarHBondContact O-N 3.13Å; I109-C112 PolarHBondContact O-N 3.02Å; I109-Y123 HydrophobicContact CG1-CG 4.49Å; I109-L124 HydrophobicContact CD1-CD2 4.03Å; I109-L124 HydrophobicContact CD1-CG 4.41Å; I109-L124 HydrophobicContact CG2-CD2 4.43Å; I109-K127 HydrophobicContact CD1-CB 4.27Å; I109-K127 HydrophobicContact CD1-CD 3.8Å
110	K	95.1	Very high	96.3	Very high	151 Å²	151	56.1 Å²	56.1	66%	0.657	29%	0.285	S	S	*	.	G	3₁₀ helix	trans	-60.3	-31.5	-179.8	175.6	-179.2	176.2	-171.1	0	113.7	D105 L108	D105-K110 WeakPolarHBondContact O-CB 3.11Å; L108-K110 VanDerWaalsContact C-N 3.34Å; L108-K110 PolarHBondContact O-N 2.68Å
111	N	94.7	Very high	96.4	Very high	68 Å²	68	56.1 Å²	56.1	36%	0.364	29%	0.285	S	S	.	.	G	3₁₀ helix	trans	-102.8	1.5	-175.7	-64.2	-37.2	0	0	0	113.4	N34 Y107 L108 I109 S113	N34-N111 PolarHBondContact OD1-ND2 3.17Å; Y107-N111 WeakPolarHBondContact O-CB 3.29Å; Y107-N111 PolarHBondContact O-ND2 3.14Å; L108-N111 PolarHBondContact O-N 3.27Å; I109-N111 PolarHBondContact O-N 3.13Å; N111-S113 PolarHBondContact O-N 3.38Å
112	C	94.9	Very high	96.3	Very high	23 Å²	23	57.3 Å²	57.3	16%	0.155	29%	0.289	C	S	.	.			trans	-65.7	126.8	171	-78.6	0	0	0	0	110.3	L108 I109 K120	L108-C112 PolarHBondContact O-N 3.42Å; L108-C112 VanDerWaalsContact O-N 3.13Å; L108-C112 PolarHBondContact O-SG 3.32Å; I109-C112 PolarHBondContact O-N 3.02Å; C112-K120 HydrophobicContact CB-CB 4.22Å
113	S	92.6	Very high	96.3	Very high	50 Å²	50	55.1 Å²	55.1	35%	0.35	27%	0.273	S	S	.	.			trans	-71.8	161.8	167.9	66.8	0	0	0	0	111.3	N111 T115 Q116	N111-S113 PolarHBondContact O-N 3.38Å; S113-T115 PolarHBondContact O-N 2.98Å; S113-T115 VanDerWaalsContact O-N 3.17Å; S113-T115 PolarHBondContact OG-OG1 2.83Å; S113-Q116 PolarHBondContact O-N 2.82Å; S113-Q116 VanDerWaalsContact OG-CG 3.29Å; S113-Q116 WeakPolarHBondContact OG-CG 3.49Å; S113-Q116 PolarHBondContact OG-OE1 3.37Å
114	E	87.9	Confident	96.3	Very high	192 Å²	192	55.2 Å²	55.2	90%	0.897	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.2	-28.5	176.5	-65.4	179.3	172.5	0	0	112.8
115	T	92.3	Very high	96.4	Very high	116 Å²	116	57 Å²	57	71%	0.712	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.2	-11.9	177.2	53.4	0	0	0	0	114.1	S113 Y117	S113-T115 PolarHBondContact O-N 2.98Å; S113-T115 VanDerWaalsContact O-N 3.17Å; S113-T115 PolarHBondContact OG-OG1 2.83Å; T115-Y117 VanDerWaalsContact C-N 3.31Å; T115-Y117 WeakPolarHBondContact O-CD1 3.3Å; T115-Y117 PolarHBondContact O-N 3.34Å
116	Q	94.4	Very high	96.4	Very high	67 Å²	67	54.7 Å²	54.7	31%	0.313	27%	0.269	S	S	.	.			trans	-94.2	44.5	-178.7	-73.2	177.6	-44.7	0	0	112.1	S113 E118 S119 K120	S113-Q116 PolarHBondContact O-N 2.82Å; S113-Q116 VanDerWaalsContact OG-CG 3.29Å; S113-Q116 WeakPolarHBondContact OG-CG 3.49Å; S113-Q116 PolarHBondContact OG-OE1 3.37Å; Q116-E118 VanDerWaalsContact C-N 3.32Å; Q116-E118 PolarHBondContact O-N 3.06Å; Q116-S119 PolarHBondContact O-N 3.04Å; Q116-S119 VanDerWaalsContact O-N 3.11Å; Q116-K120 PolarHBondContact O-N 3.03Å
117	Y	96.2	Very high	96.4	Very high	79 Å²	79	52.9 Å²	52.9	31%	0.31	26%	0.258	S	S	.	.	H	α-helix	trans	-57	-40.2	-174.8	56.2	-94.1	0	0	0	112.9	T115 S119 K120 V121 H164 M165	T115-Y117 VanDerWaalsContact C-N 3.31Å; T115-Y117 WeakPolarHBondContact O-CD1 3.3Å; T115-Y117 PolarHBondContact O-N 3.34Å; Y117-S119 VanDerWaalsContact C-N 3.34Å; Y117-S119 PolarHBondContact O-N 3.44Å; Y117-K120 PolarHBondContact O-N 3.34Å; Y117-V121 WeakPolarHBondContact O-CB 3.4Å; Y117-V121 VanDerWaalsContact O-CG2 3.29Å; Y117-V121 WeakPolarHBondContact O-CG2 3.41Å; Y117-V121 PolarHBondContact O-N 3.34Å; Y117-H164 HydrophobicContact CD1-CB 4.08Å; Y117-H164 HydrophobicContact CD2-CB 3.57Å; Y117-H164 HydrophobicContact CE1-CB 4.45Å; Y117-H164 HydrophobicContact CE2-CB 3.99Å; Y117-H164 WeakPolarHBondContact CE2-O 3.49Å; Y117-H164 HydrophobicContact CG-CB 3.63Å; Y117-M165 HydrophobicContact CD2-CG 3.87Å; Y117-M165 HydrophobicContact CE2-CG 4.05Å
118	E	96.4	Very high	96.4	Very high	62 Å²	62	49.6 Å²	49.6	29%	0.29	25%	0.245	S	C	.	.	H	α-helix	trans	-60.3	-42.6	177.3	-69.9	-178.1	-167	0	0	112.7	Q116 F122 M165 H169 I171	Q116-E118 VanDerWaalsContact C-N 3.32Å; Q116-E118 PolarHBondContact O-N 3.06Å; E118-F122 VanDerWaalsContact O-CB 3.28Å; E118-F122 WeakPolarHBondContact O-CB 3.43Å; E118-F122 PolarHBondContact O-N 3.06Å; E118-M165 HydrophobicContact CG-CE 4.12Å; E118-H169 IonicContact OE1-NE2 3.91Å; E118-H169 PolarHBondContact OE1-NE2 2.82Å; E118-I171 HydrophobicContact CB-CD1 4.32Å
119	S	97.5	Very high	96.5	Very high	16 Å²	16	49.7 Å²	49.7	11%	0.112	25%	0.245	C	C	.	.	H	α-helix	trans	-67.9	-43.5	177	-70.6	0	0	0	0	110.7	Q116 Y117 V121 F122 Y123	Q116-S119 PolarHBondContact O-N 3.04Å; Q116-S119 VanDerWaalsContact O-N 3.11Å; Y117-S119 VanDerWaalsContact C-N 3.34Å; Y117-S119 PolarHBondContact O-N 3.44Å; S119-V121 PolarHBondContact O-N 2.93Å; S119-F122 WeakPolarHBondContact O-CB 3.41Å; S119-F122 PolarHBondContact O-N 3.16Å; S119-Y123 WeakPolarHBondContact O-CD2 3.47Å; S119-Y123 VanDerWaalsContact O-CG 3.23Å; S119-Y123 PolarHBondContact O-N 3.23Å
120	K	98	Very high	96.5	Very high	64 Å²	64	48.7 Å²	48.7	28%	0.278	24%	0.24	S	C	.	.	H	α-helix	trans	-60.4	-47.2	177.6	-170.9	171.3	176.7	-170.9	0	111.8	C112 Q116 Y117 Y123 L124 E156 I160	C112-K120 HydrophobicContact CB-CB 4.22Å; Q116-K120 PolarHBondContact O-N 3.03Å; Y117-K120 PolarHBondContact O-N 3.34Å; K120-Y123 PolarHBondContact O-N 3.42Å; K120-L124 HydrophobicContact CG-CD1 3.85Å; K120-L124 HydrophobicContact CG-CG 4.45Å; K120-L124 WeakPolarHBondContact O-CB 3.17Å; K120-L124 WeakPolarHBondContact O-CG 3.3Å; K120-L124 PolarHBondContact O-N 3.05Å; K120-E156 WeakPolarHBondContact CE-OE1 3.4Å; K120-E156 IonicContact NZ-OE1 2.65Å; K120-E156 PolarHBondContact NZ-OE1 3.28Å; K120-I160 HydrophobicContact CD-CD1 3.82Å; K120-I160 HydrophobicContact CG-CD1 4.14Å
121	V	98.5	Very high	96.7	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-62.2	-43.3	175.8	175	0	0	0	0	110.9	Y117 S119 Y123 L124 K125 A157 I160 M165 I171 L175	Y117-V121 WeakPolarHBondContact O-CB 3.4Å; Y117-V121 VanDerWaalsContact O-CG2 3.29Å; Y117-V121 WeakPolarHBondContact O-CG2 3.41Å; Y117-V121 PolarHBondContact O-N 3.34Å; S119-V121 PolarHBondContact O-N 2.93Å; V121-Y123 PolarHBondContact O-N 3.43Å; V121-L124 PolarHBondContact O-N 2.86Å; V121-K125 WeakPolarHBondContact O-CB 3.48Å; V121-K125 PolarHBondContact O-N 3.49Å; V121-A157 HydrophobicContact CG1-CB 4.35Å; V121-I160 HydrophobicContact CG2-CB 3.84Å; V121-I160 HydrophobicContact CG2-CG2 3.51Å; V121-M165 HydrophobicContact CB-SD 4.05Å; V121-M165 HydrophobicContact CG1-SD 4.04Å; V121-M165 HydrophobicContact CG2-SD 3.89Å; V121-I171 HydrophobicContact CB-CG2 4.31Å; V121-I171 HydrophobicContact CG1-CG2 3.74Å; V121-L175 HydrophobicContact CG1-CD2 4.06Å
122	F	98.4	Very high	96.9	Very high	26 Å²	26	40.5 Å²	40.5	11%	0.114	20%	0.2	C	C	.	.	H	α-helix	trans	-58.1	-48.5	176.6	-173.2	-78.6	0	0	0	111.9	R42 E118 S119 M126 I171	R42-F122 VanDerWaalsContact CD-CG 3.48Å; R42-F122 HydrophobicContact CG-CD1 3.49Å; R42-F122 VanDerWaalsContact CG-CD1 3.49Å; R42-F122 HydrophobicContact CG-CD2 4.42Å; R42-F122 HydrophobicContact CG-CE1 3.3Å; R42-F122 HydrophobicContact CG-CE2 4.25Å; R42-F122 HydrophobicContact CG-CG 4.06Å; R42-F122 HydrophobicContact CG-CZ 3.71Å; E118-F122 VanDerWaalsContact O-CB 3.28Å; E118-F122 WeakPolarHBondContact O-CB 3.43Å; E118-F122 PolarHBondContact O-N 3.06Å; S119-F122 WeakPolarHBondContact O-CB 3.41Å; S119-F122 PolarHBondContact O-N 3.16Å; F122-M126 HydrophobicContact CE1-SD 4.14Å; F122-M126 VanDerWaalsContact O-CB 3.3Å; F122-M126 WeakPolarHBondContact O-CB 3.4Å; F122-M126 PolarHBondContact O-N 3.15Å; F122-I171 HydrophobicContact CB-CD1 4.4Å; F122-I171 HydrophobicContact CB-CG2 4.42Å; F122-I171 HydrophobicContact CD2-CD1 4.11Å; F122-I171 HydrophobicContact CD2-CG1 4.25Å
123	Y	98.7	Very high	97.1	Very high	7 Å²	7	40.5 Å²	40.5	3%	0.027	20%	0.197	C	C	.	.	H	α-helix	trans	-70.8	-38.7	-178.5	-61	-43.5	0	0	0	112.7	R42 L104 L108 I109 S119 K120 V121 M126 K127	R42-Y123 HydrophobicContact CG-CE1 3.71Å; L104-Y123 HydrophobicContact CD2-CD1 3.85Å; L104-Y123 HydrophobicContact CD2-CG 4.14Å; L108-Y123 HydrophobicContact CB-CD1 4.11Å; L108-Y123 HydrophobicContact CB-CD2 3.8Å; L108-Y123 HydrophobicContact CB-CE1 4.17Å; L108-Y123 HydrophobicContact CB-CE2 3.88Å; L108-Y123 HydrophobicContact CB-CG 3.96Å; L108-Y123 HydrophobicContact CD1-CD1 3.96Å; L108-Y123 HydrophobicContact CD1-CE1 3.79Å; L108-Y123 HydrophobicContact CD2-CE1 4.22Å; L108-Y123 HydrophobicContact CD2-CE2 4.36Å; L108-Y123 HydrophobicContact CG-CE1 4.28Å; I109-Y123 HydrophobicContact CG1-CG 4.49Å; S119-Y123 WeakPolarHBondContact O-CD2 3.47Å; S119-Y123 VanDerWaalsContact O-CG 3.23Å; S119-Y123 PolarHBondContact O-N 3.23Å; K120-Y123 PolarHBondContact O-N 3.42Å; V121-Y123 PolarHBondContact O-N 3.43Å; Y123-M126 WeakPolarHBondContact O-CB 3.36Å; Y123-M126 PolarHBondContact O-N 2.84Å; Y123-K127 WeakPolarHBondContact O-CB 3.34Å; Y123-K127 PolarHBondContact O-N 2.7Å
124	L	98.8	Very high	97.3	Very high	3 Å²	3	38.2 Å²	38.2	2%	0.016	18%	0.18	C	C	.	.	H	α-helix	trans	-66.9	-42.7	175.3	-74.8	167.8	0	0	0	111.9	I109 K120 V121 M126 K127 G128 E156 A157 I160	I109-L124 HydrophobicContact CD1-CD2 4.03Å; I109-L124 HydrophobicContact CD1-CG 4.41Å; I109-L124 HydrophobicContact CG2-CD2 4.43Å; K120-L124 HydrophobicContact CG-CD1 3.85Å; K120-L124 HydrophobicContact CG-CG 4.45Å; K120-L124 WeakPolarHBondContact O-CB 3.17Å; K120-L124 WeakPolarHBondContact O-CG 3.3Å; K120-L124 PolarHBondContact O-N 3.05Å; V121-L124 PolarHBondContact O-N 2.86Å; L124-M126 VanDerWaalsContact C-N 3.27Å; L124-M126 PolarHBondContact O-N 3.41Å; L124-K127 WeakPolarHBondContact O-CB 3.49Å; L124-K127 PolarHBondContact O-N 2.85Å; L124-G128 PolarHBondContact O-N 2.88Å; L124-E156 HydrophobicContact CD1-CB 4.16Å; L124-E156 HydrophobicContact CD1-CG 3.74Å; L124-E156 HydrophobicContact CD2-CG 4.5Å; L124-A157 HydrophobicContact CB-CB 3.68Å; L124-A157 HydrophobicContact CD1-CB 4.47Å; L124-I160 HydrophobicContact CD1-CD1 3.81Å
125	K	98.7	Very high	97.8	Very high	37 Å²	37	29 Å²	29	16%	0.161	14%	0.138	C	C	.	.	H	α-helix	trans	-54.7	-48.2	170.7	176.8	-167.7	170.4	-67.3	0	110.6	V121 K127 G128 D129 Y154 G174 L175 N178	V121-K125 WeakPolarHBondContact O-CB 3.48Å; V121-K125 PolarHBondContact O-N 3.49Å; K125-K127 VanDerWaalsContact C-N 3.34Å; K125-K127 PolarHBondContact O-N 2.88Å; K125-G128 PolarHBondContact O-N 3.39Å; K125-D129 IonicContact NZ-OD2 2.71Å; K125-D129 PolarHBondContact NZ-OD2 3.07Å; K125-D129 PolarHBondContact O-N 3.41Å; K125-Y154 HydrophobicContact CG-CE1 4.47Å; K125-G174 WeakPolarHBondContact CE-O 3.1Å; K125-L175 HydrophobicContact CB-CD1 3.98Å; K125-L175 HydrophobicContact CD-CB 4.11Å; K125-L175 HydrophobicContact CG-CB 4.28Å; K125-L175 HydrophobicContact CG-CD1 3.99Å; K125-N178 PolarHBondContact NZ-ND2 3.17Å
126	M	98.7	Very high	98.1	Very high	6 Å²	6	25.2 Å²	25.2	3%	0.03	11%	0.112	C	C	.	.	H	α-helix	trans	-61.5	-42.4	178.7	-169.7	172.1	167.8	0	0	111.2	L45 V100 L104 F122 Y123 L124 G128 D129 Y130	L45-M126 HydrophobicContact CG-CE 4.36Å; V100-M126 HydrophobicContact CG2-CE 3.4Å; V100-M126 VanDerWaalsContact CG2-CE 3.4Å; L104-M126 HydrophobicContact CD1-CB 4.36Å; L104-M126 HydrophobicContact CD1-CG 4.16Å; L104-M126 HydrophobicContact CD2-CB 4.38Å; L104-M126 HydrophobicContact CD2-CG 4.41Å; L104-M126 HydrophobicContact CD2-SD 4.17Å; F122-M126 HydrophobicContact CE1-SD 4.14Å; F122-M126 VanDerWaalsContact O-CB 3.3Å; F122-M126 WeakPolarHBondContact O-CB 3.4Å; F122-M126 PolarHBondContact O-N 3.15Å; Y123-M126 WeakPolarHBondContact O-CB 3.36Å; Y123-M126 PolarHBondContact O-N 2.84Å; L124-M126 VanDerWaalsContact C-N 3.27Å; L124-M126 PolarHBondContact O-N 3.41Å; M126-G128 PolarHBondContact O-N 3.14Å; M126-D129 WeakPolarHBondContact O-CB 3.37Å; M126-D129 PolarHBondContact O-N 3.36Å; M126-D129 VanDerWaalsContact O-N 3.16Å; M126-Y130 HydrophobicContact CE-CE2 3.55Å; M126-Y130 HydrophobicContact CG-CD2 3.92Å; M126-Y130 HydrophobicContact CG-CE2 3.5Å; M126-Y130 VanDerWaalsContact CG-CE2 3.5Å; M126-Y130 WeakPolarHBondContact O-CD2 3.38Å; M126-Y130 PolarHBondContact O-N 3.26Å; M126-Y130 HydrophobicContact SD-CE2 4.39Å
127	K	98.9	Very high	98.2	Very high	40 Å²	40	22.8 Å²	22.8	17%	0.174	10%	0.101	C	C	.	.	H	α-helix	trans	-58.1	-46.6	173.7	-176.9	172.6	-177.4	167.8	0	111.8	L101 L104 D105 I109 Y123 L124 K125 D129 Y130 Y131 A153	L101-K127 HydrophobicContact CD2-CB 4.43Å; L101-K127 HydrophobicContact CD2-CG 3.77Å; L104-K127 HydrophobicContact CD1-CB 4.03Å; D105-K127 WeakPolarHBondContact OD1-CE 3.26Å; D105-K127 IonicContact OD1-NZ 2.73Å; D105-K127 PolarHBondContact OD1-NZ 3.31Å; D105-K127 IonicContact OD2-NZ 3.15Å; D105-K127 PolarHBondContact OD2-NZ 3.39Å; I109-K127 HydrophobicContact CD1-CB 4.27Å; I109-K127 HydrophobicContact CD1-CD 3.8Å; Y123-K127 WeakPolarHBondContact O-CB 3.34Å; Y123-K127 PolarHBondContact O-N 2.7Å; L124-K127 WeakPolarHBondContact O-CB 3.49Å; L124-K127 PolarHBondContact O-N 2.85Å; K125-K127 VanDerWaalsContact C-N 3.34Å; K125-K127 PolarHBondContact O-N 2.88Å; K127-D129 VanDerWaalsContact C-N 3.34Å; K127-D129 PolarHBondContact O-N 3.01Å; K127-Y130 PolarHBondContact O-N 3.44Å; K127-Y131 HydrophobicContact CD-CE2 4.28Å; K127-Y131 HydrophobicContact CG-CD2 3.91Å; K127-Y131 HydrophobicContact CG-CE2 3.71Å; K127-Y131 VanDerWaalsContact O-CD2 3.3Å; K127-Y131 WeakPolarHBondContact O-CD2 3.25Å; K127-Y131 PolarHBondContact O-N 3.19Å; K127-Y131 VanDerWaalsContact O-N 3.07Å; K127-A153 HydrophobicContact CB-CB 4.1Å; K127-A153 HydrophobicContact CD-CB 4.24Å; K127-A153 HydrophobicContact CG-CB 3.95Å
128	G	98.8	Very high	98.2	Very high	0 Å²	0	19.5 Å²	19.5	0%	0	9%	0.09	C	C	.	.	H	α-helix	trans	-57.3	-45.7	173	0	0	0	0	0	112.1	L124 K125 M126 Y130 Y131 R132 S150	L124-G128 PolarHBondContact O-N 2.88Å; K125-G128 PolarHBondContact O-N 3.39Å; M126-G128 PolarHBondContact O-N 3.14Å; G128-Y130 PolarHBondContact O-N 3.28Å; G128-Y131 PolarHBondContact O-N 2.84Å; G128-R132 WeakPolarHBondContact O-CB 3.39Å; G128-R132 PolarHBondContact O-N 3.36Å; G128-S150 PolarHBondContact O-OG 3.26Å; G128-S150 VanDerWaalsContact O-OG 3.11Å
129	D	98.8	Very high	98	Very high	10 Å²	10	21.9 Å²	21.9	5%	0.053	11%	0.11	C	C	.	.	H	α-helix	trans	-57.5	-46.2	177.4	-71.8	-39.1	0	0	0	112.7	K125 M126 K127 R132 Y133 Y154 N178	K125-D129 IonicContact NZ-OD2 2.71Å; K125-D129 PolarHBondContact NZ-OD2 3.07Å; K125-D129 PolarHBondContact O-N 3.41Å; M126-D129 WeakPolarHBondContact O-CB 3.37Å; M126-D129 PolarHBondContact O-N 3.36Å; M126-D129 VanDerWaalsContact O-N 3.16Å; K127-D129 VanDerWaalsContact C-N 3.34Å; K127-D129 PolarHBondContact O-N 3.01Å; D129-R132 WeakPolarHBondContact O-CB 3.27Å; D129-R132 PolarHBondContact O-N 3.48Å; D129-R132 IonicContact OD1-NE 3.36Å; D129-R132 IonicContact OD1-NH2 3.49Å; D129-R132 PolarHBondContact OD1-NH2 3.22Å; D129-Y133 HydrophobicContact CB-CE2 4.08Å; D129-Y133 WeakPolarHBondContact O-CD1 3.47Å; D129-Y133 WeakPolarHBondContact O-CD2 2.99Å; D129-Y133 WeakPolarHBondContact O-CE2 3.45Å; D129-Y133 PolarHBondContact O-N 2.59Å; D129-Y154 VanDerWaalsContact CA-OH 3.27Å; D129-Y154 WeakPolarHBondContact CA-OH 3.23Å; D129-Y154 PolarHBondContact N-OH 3.06Å; D129-Y154 PolarHBondContact OD1-OH 3.42Å; D129-N178 VanDerWaalsContact OD1-CB 3.29Å; D129-N178 WeakPolarHBondContact OD1-CB 3.25Å; D129-N178 PolarHBondContact OD1-ND2 3.01Å; D129-N178 PolarHBondContact OD2-ND2 3.48Å
130	Y	98.8	Very high	97.8	Very high	6 Å²	6	24.2 Å²	24.2	2%	0.024	14%	0.136	C	C	.	.	H	α-helix	trans	-72.4	-34	-179.4	-72.7	-75.9	0	0	0	113.3	Y49 K50 V53 C97 V100 M126 K127 G128 Y133 L134	Y49-Y130 WeakPolarHBondContact CB-OH 3.46Å; K50-Y130 PolarHBondContact N-OH 3.14Å; V53-Y130 HydrophobicContact CB-CE1 4.13Å; V53-Y130 HydrophobicContact CG2-CD1 4.1Å; V53-Y130 HydrophobicContact CG2-CE1 3.6Å; C97-Y130 HydrophobicContact CB-CD1 4.33Å; V100-Y130 HydrophobicContact CB-CE2 4.45Å; V100-Y130 HydrophobicContact CG1-CD1 3.42Å; V100-Y130 VanDerWaalsContact CG1-CD1 3.42Å; V100-Y130 HydrophobicContact CG1-CD2 3.48Å; V100-Y130 VanDerWaalsContact CG1-CD2 3.48Å; V100-Y130 HydrophobicContact CG1-CE1 3.65Å; V100-Y130 HydrophobicContact CG1-CE2 3.74Å; V100-Y130 HydrophobicContact CG1-CG 3.37Å; V100-Y130 HydrophobicContact CG2-CD2 4.21Å; V100-Y130 HydrophobicContact CG2-CE2 3.9Å; M126-Y130 HydrophobicContact CE-CE2 3.55Å; M126-Y130 HydrophobicContact CG-CD2 3.92Å; M126-Y130 HydrophobicContact CG-CE2 3.5Å; M126-Y130 VanDerWaalsContact CG-CE2 3.5Å; M126-Y130 WeakPolarHBondContact O-CD2 3.38Å; M126-Y130 PolarHBondContact O-N 3.26Å; M126-Y130 HydrophobicContact SD-CE2 4.39Å; K127-Y130 PolarHBondContact O-N 3.44Å; G128-Y130 PolarHBondContact O-N 3.28Å; Y130-Y133 AromaticContact CD1-CD2 3.79Å; Y130-Y133 HydrophobicContact CD1-CD2 3.79Å; Y130-Y133 HydrophobicContact CD1-CE2 4.19Å; Y130-Y133 HydrophobicContact CE1-CD2 4.13Å; Y130-Y133 HydrophobicContact CE1-CE2 4.18Å; Y130-Y133 HydrophobicContact CG-CD2 4.34Å; Y130-Y133 PolarHBondContact O-N 3.12Å; Y130-L134 WeakPolarHBondContact O-CG 3.45Å; Y130-L134 PolarHBondContact O-N 2.92Å
131	Y	98.8	Very high	97.6	Very high	33 Å²	33	29.1 Å²	29.1	13%	0.129	16%	0.16	C	C	.	.	H	α-helix	trans	-67.2	-37	169.5	-79.1	-59.7	0	0	0	112.6	L101 K127 G128 Y133 L134 A135 V146	L101-Y131 HydrophobicContact CD1-CD1 4.02Å; L101-Y131 HydrophobicContact CD1-CE1 3.71Å; L101-Y131 HydrophobicContact CD1-CE2 4.38Å; L101-Y131 HydrophobicContact CD1-CG 4.47Å; L101-Y131 HydrophobicContact CD2-CD2 3.88Å; L101-Y131 HydrophobicContact CD2-CE1 4.46Å; L101-Y131 HydrophobicContact CD2-CE2 3.64Å; L101-Y131 HydrophobicContact CD2-CG 4.38Å; K127-Y131 HydrophobicContact CD-CE2 4.28Å; K127-Y131 HydrophobicContact CG-CD2 3.91Å; K127-Y131 HydrophobicContact CG-CE2 3.71Å; K127-Y131 VanDerWaalsContact O-CD2 3.3Å; K127-Y131 WeakPolarHBondContact O-CD2 3.25Å; K127-Y131 PolarHBondContact O-N 3.19Å; K127-Y131 VanDerWaalsContact O-N 3.07Å; G128-Y131 PolarHBondContact O-N 2.84Å; Y131-Y133 VanDerWaalsContact C-N 3.34Å; Y131-Y133 PolarHBondContact O-N 3.24Å; Y131-L134 HydrophobicContact CD1-CD1 4.05Å; Y131-L134 HydrophobicContact CE1-CD1 4.45Å; Y131-L134 CarbonylContact O-C 3.6Å; Y131-L134 WeakPolarHBondContact O-CB 3.37Å; Y131-L134 PolarHBondContact O-N 3.37Å; Y131-A135 WeakPolarHBondContact O-CB 3.44Å; Y131-A135 PolarHBondContact O-N 3.21Å; Y131-V146 HydrophobicContact CD1-CB 4.16Å; Y131-V146 HydrophobicContact CD1-CG1 4.24Å
132	R	98.6	Very high	97.5	Very high	13 Å²	13	33.4 Å²	33.4	5%	0.049	18%	0.179	C	C	.	.	H	α-helix	trans	-59.8	-42.9	172	172.5	166.6	70.3	90.5	2.3	111.9	G128 D129 L134 A135 E136 Y154 F182 E185 I186	G128-R132 WeakPolarHBondContact O-CB 3.39Å; G128-R132 PolarHBondContact O-N 3.36Å; D129-R132 WeakPolarHBondContact O-CB 3.27Å; D129-R132 PolarHBondContact O-N 3.48Å; D129-R132 IonicContact OD1-NE 3.36Å; D129-R132 IonicContact OD1-NH2 3.49Å; D129-R132 PolarHBondContact OD1-NH2 3.22Å; R132-L134 VanDerWaalsContact C-N 3.34Å; R132-A135 WeakPolarHBondContact O-CB 3.38Å; R132-A135 PolarHBondContact O-N 2.79Å; R132-E136 PolarHBondContact O-N 3.14Å; R132-Y154 PolarHBondContact NE-OH 3.13Å; R132-Y154 VanDerWaalsContact NE-OH 3.1Å; R132-F182 HydrophobicContact CB-CD2 4.17Å; R132-F182 HydrophobicContact CG-CD2 4.23Å; R132-E185 IonicContact NH1-OE2 3.38Å; R132-I186 HydrophobicContact CG-CD1 4.32Å; R132-I186 HydrophobicContact CG-CG1 3.75Å
133	Y	98.5	Very high	97.4	Very high	23 Å²	23	36 Å²	36	9%	0.09	19%	0.187	C	C	.	.	H	α-helix	trans	-65.5	-37.2	175.4	-55.6	-31.7	0	0	0	112.4	V53 R57 D129 Y130 Y131	V53-Y133 HydrophobicContact CG1-CD2 3.62Å; V53-Y133 HydrophobicContact CG1-CE2 4.27Å; V53-Y133 HydrophobicContact CG1-CG 4.06Å; R57-Y133 VanDerWaalsContact CZ-CD1 3.46Å; D129-Y133 HydrophobicContact CB-CE2 4.08Å; D129-Y133 WeakPolarHBondContact O-CD1 3.47Å; D129-Y133 WeakPolarHBondContact O-CD2 2.99Å; D129-Y133 WeakPolarHBondContact O-CE2 3.45Å; D129-Y133 PolarHBondContact O-N 2.59Å; Y130-Y133 AromaticContact CD1-CD2 3.79Å; Y130-Y133 HydrophobicContact CD1-CD2 3.79Å; Y130-Y133 HydrophobicContact CD1-CE2 4.19Å; Y130-Y133 HydrophobicContact CE1-CD2 4.13Å; Y130-Y133 HydrophobicContact CE1-CE2 4.18Å; Y130-Y133 HydrophobicContact CG-CD2 4.34Å; Y130-Y133 PolarHBondContact O-N 3.12Å; Y131-Y133 VanDerWaalsContact C-N 3.34Å; Y131-Y133 PolarHBondContact O-N 3.24Å
134	L	98.6	Very high	97.3	Very high	2 Å²	2	38.6 Å²	38.6	1%	0.01	21%	0.21	C	C	.	.	H	α-helix	trans	-64.8	-40.6	171.1	-72.6	172	0	0	0	111.6	L93 E94 C97 L101 Y130 Y131 R132 E136 V137 A138 V146	L93-L134 HydrophobicContact CD2-CD2 4.24Å; E94-L134 HydrophobicContact CB-CD2 4.03Å; E94-L134 HydrophobicContact CG-CD2 4.02Å; C97-L134 HydrophobicContact CB-CD1 3.97Å; C97-L134 HydrophobicContact CB-CD2 3.71Å; C97-L134 HydrophobicContact CB-CG 3.68Å; L101-L134 HydrophobicContact CD1-CD1 3.7Å; Y130-L134 WeakPolarHBondContact O-CG 3.45Å; Y130-L134 PolarHBondContact O-N 2.92Å; Y131-L134 HydrophobicContact CD1-CD1 4.05Å; Y131-L134 HydrophobicContact CE1-CD1 4.45Å; Y131-L134 CarbonylContact O-C 3.6Å; Y131-L134 WeakPolarHBondContact O-CB 3.37Å; Y131-L134 PolarHBondContact O-N 3.37Å; R132-L134 VanDerWaalsContact C-N 3.34Å; L134-E136 VanDerWaalsContact C-N 3.32Å; L134-E136 PolarHBondContact O-N 3.49Å; L134-V137 WeakPolarHBondContact O-CG2 3.42Å; L134-V137 PolarHBondContact O-N 3.01Å; L134-A138 WeakPolarHBondContact O-CB 3.29Å; L134-A138 PolarHBondContact O-N 2.96Å; L134-V146 HydrophobicContact CB-CB 4.24Å; L134-V146 HydrophobicContact CB-CG1 4.1Å; L134-V146 HydrophobicContact CB-CG2 4.42Å; L134-V146 HydrophobicContact CD1-CG1 4.4Å
135	A	98.2	Very high	97.3	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-59.8	-43.4	178.6	0	0	0	0	0	111.3	Y131 R132 V137 A138 R143 V146 V147 I186	Y131-A135 WeakPolarHBondContact O-CB 3.44Å; Y131-A135 PolarHBondContact O-N 3.21Å; R132-A135 WeakPolarHBondContact O-CB 3.38Å; R132-A135 PolarHBondContact O-N 2.79Å; A135-V137 PolarHBondContact O-N 3.38Å; A135-V137 VanDerWaalsContact O-N 3.16Å; A135-A138 PolarHBondContact O-N 3.48Å; A135-R143 PolarHBondContact O-NH1 2.65Å; A135-V146 VanDerWaalsContact CA-CG2 3.44Å; A135-V146 HydrophobicContact CB-CG2 3.76Å; A135-V147 HydrophobicContact CB-CG2 3.84Å; A135-I186 HydrophobicContact CB-CD1 4.28Å; A135-I186 HydrophobicContact CB-CG1 4.5Å; A135-I186 HydrophobicContact CB-CG2 3.79Å
136	E	96.9	Very high	97.3	Very high	36 Å²	36	40.7 Å²	40.7	17%	0.168	23%	0.226	C	C	.	.	H	α-helix	trans	-51.2	-38	178	-176.4	176	-161.8	0	0	113.3	R57 W60 R61 R132 L134 I186	R57-E136 IonicContact CZ-OE2 2.61Å; R57-E136 IonicContact NE-OE2 2.77Å; R57-E136 PolarHBondContact NE-OE2 2.83Å; R57-E136 IonicContact NH2-OE1 2.66Å; R57-E136 IonicContact NH2-OE2 3.97Å; R57-E136 PolarHBondContact NH2-OE2 3.23Å; W60-E136 HydrophobicContact CE3-CG 4.44Å; W60-E136 HydrophobicContact CH2-CG 4.34Å; W60-E136 WeakPolarHBondContact CH2-O 3.14Å; W60-E136 HydrophobicContact CZ3-CG 3.81Å; R61-E136 IonicContact CZ-OE1 2.69Å; R61-E136 IonicContact NE-OE1 3.95Å; R61-E136 PolarHBondContact NE-OE1 3.3Å; R61-E136 IonicContact NH2-OE1 2.74Å; R61-E136 PolarHBondContact NH2-OE1 3.09Å; R61-E136 IonicContact NH2-OE2 3.61Å; R132-E136 PolarHBondContact O-N 3.14Å; L134-E136 VanDerWaalsContact C-N 3.32Å; L134-E136 PolarHBondContact O-N 3.49Å; E136-I186 HydrophobicContact CB-CD1 4.43Å
137	V	96.5	Very high	97.2	Very high	15 Å²	15	41.1 Å²	41.1	9%	0.091	23%	0.23	C	C	.	.	H	α-helix	trans	-102.7	-15.8	-177.3	-53.1	0	0	0	0	114.1	W60 E90 L93 L134 A135	W60-V137 HydrophobicContact CD2-CG1 3.62Å; W60-V137 HydrophobicContact CE3-CG1 4.04Å; W60-V137 HydrophobicContact CG-CG1 3.96Å; W60-V137 HydrophobicContact CH2-CG1 4.34Å; W60-V137 HydrophobicContact CZ2-CB 4.19Å; W60-V137 HydrophobicContact CZ2-CG1 3.97Å; W60-V137 HydrophobicContact CZ3-CG1 4.38Å; E90-V137 HydrophobicContact CG-CB 4.13Å; L93-V137 HydrophobicContact CD1-CG1 4.01Å; L93-V137 HydrophobicContact CD2-CG2 3.99Å; L134-V137 WeakPolarHBondContact O-CG2 3.42Å; L134-V137 PolarHBondContact O-N 3.01Å; A135-V137 PolarHBondContact O-N 3.38Å; A135-V137 VanDerWaalsContact O-N 3.16Å
138	A	96.4	Very high	97.2	Very high	10 Å²	10	46 Å²	46	8%	0.083	25%	0.253	C	S	.	.			trans	-75.8	149.5	-178.1	0	0	0	0	0	112.1	L134 A135 K142 R143 V146	L134-A138 WeakPolarHBondContact O-CB 3.29Å; L134-A138 PolarHBondContact O-N 2.96Å; A135-A138 PolarHBondContact O-N 3.48Å; A138-K142 HydrophobicContact CB-CD 4.48Å; A138-K142 HydrophobicContact CB-CG 4.09Å; A138-R143 HydrophobicContact CB-CB 4.03Å; A138-V146 HydrophobicContact CB-CG2 4.04Å
139	T	93.2	Very high	97.2	Very high	113 Å²	113	47.6 Å²	47.6	69%	0.693	26%	0.264	S	S	*	.			trans	-127.3	160.9	176.3	59.9	0	0	0	0	111	R143	T139-R143 PolarHBondContact O-N 3.31Å
140	G	93.6	Very high	97.2	Very high	64 Å²	64	47.1 Å²	47.1	66%	0.66	26%	0.262	S	S	*	.	H	α-helix	trans	58.4	-142.5	175.8	0	0	0	0	0	114.1	K142 R143 A144	G140-K142 VanDerWaalsContact C-N 3.29Å; G140-K142 PolarHBondContact O-N 3.11Å; G140-R143 WeakPolarHBondContact O-CB 3.45Å; G140-R143 PolarHBondContact O-N 3.48Å; G140-R143 VanDerWaalsContact O-N 3.09Å; G140-A144 PolarHBondContact O-N 2.79Å
141	E	94.2	Very high	97.2	Very high	167 Å²	167	49.3 Å²	49.3	78%	0.78	27%	0.272	S	S	*	.	H	α-helix	trans	-58.6	-39.1	-178.6	-174.5	179.3	-177	0	0	112.6	R143 A144 T145	E141-R143 PolarHBondContact O-N 2.85Å; E141-A144 WeakPolarHBondContact O-CB 3.38Å; E141-A144 PolarHBondContact O-N 3.1Å; E141-T145 PolarHBondContact O-N 2.91Å; E141-T145 VanDerWaalsContact O-N 3.13Å; E141-T145 PolarHBondContact O-OG1 3.43Å
142	K	94.8	Very high	97.2	Very high	91 Å²	91	54.9 Å²	54.9	40%	0.396	30%	0.297	S	S	.	.	H	α-helix	trans	-57	-39	176.7	-179.6	174.8	169.1	175.2	0	111.4	E94 A138 G140 T145 V146	E94-K142 WeakPolarHBondContact OE1-CE 3.36Å; E94-K142 IonicContact OE1-NZ 3.63Å; E94-K142 PolarHBondContact OE1-NZ 2.84Å; E94-K142 IonicContact OE2-NZ 3.93Å; E94-K142 PolarHBondContact OE2-NZ 2.85Å; A138-K142 HydrophobicContact CB-CD 4.48Å; A138-K142 HydrophobicContact CB-CG 4.09Å; G140-K142 VanDerWaalsContact C-N 3.29Å; G140-K142 PolarHBondContact O-N 3.11Å; K142-T145 PolarHBondContact O-N 3.25Å; K142-V146 WeakPolarHBondContact O-CG2 3.36Å; K142-V146 PolarHBondContact O-N 2.96Å; K142-V146 VanDerWaalsContact O-N 3.17Å
143	R	97.2	Very high	97.2	Very high	79 Å²	79	54.4 Å²	54.4	30%	0.298	30%	0.296	S	S	.	.	H	α-helix	trans	-61.5	-47.6	175.7	-173.8	178.5	167.4	89.8	-1.9	110.9	A135 A138 T139 G140 E141 T145 V146 V147 I186	A135-R143 PolarHBondContact O-NH1 2.65Å; A138-R143 HydrophobicContact CB-CB 4.03Å; T139-R143 PolarHBondContact O-N 3.31Å; G140-R143 WeakPolarHBondContact O-CB 3.45Å; G140-R143 PolarHBondContact O-N 3.48Å; G140-R143 VanDerWaalsContact O-N 3.09Å; E141-R143 PolarHBondContact O-N 2.85Å; R143-T145 VanDerWaalsContact C-N 3.32Å; R143-T145 PolarHBondContact O-N 3.46Å; R143-V146 VanDerWaalsContact O-CG2 3.25Å; R143-V146 WeakPolarHBondContact O-CG2 3.28Å; R143-V146 PolarHBondContact O-N 3.42Å; R143-V147 HydrophobicContact CG-CG2 4.03Å; R143-V147 WeakPolarHBondContact O-CB 3.39Å; R143-V147 WeakPolarHBondContact O-CG2 3.45Å; R143-V147 PolarHBondContact O-N 3.29Å; R143-I186 PolarHBondContact NH2-O 3.09Å
144	A	96.9	Very high	97.2	Very high	62 Å²	62	53.3 Å²	53.3	51%	0.512	29%	0.292	S	S	.	.	H	α-helix	trans	-57.3	-46	-179.5	0	0	0	0	0	111.8	G140 E141 V146 V147 E148	G140-A144 PolarHBondContact O-N 2.79Å; E141-A144 WeakPolarHBondContact O-CB 3.38Å; E141-A144 PolarHBondContact O-N 3.1Å; A144-V146 PolarHBondContact O-N 2.89Å; A144-V147 PolarHBondContact O-N 2.94Å; A144-E148 PolarHBondContact O-N 3.35Å
145	T	97.9	Very high	97.2	Very high	73 Å²	73	55.5 Å²	55.5	45%	0.448	31%	0.307	S	S	.	.	H	α-helix	trans	-63.2	-43.1	179.3	-52.4	0	0	0	0	113.3	E141 K142 R143 S149	E141-T145 PolarHBondContact O-N 2.91Å; E141-T145 VanDerWaalsContact O-N 3.13Å; E141-T145 PolarHBondContact O-OG1 3.43Å; K142-T145 PolarHBondContact O-N 3.25Å; R143-T145 VanDerWaalsContact C-N 3.32Å; R143-T145 PolarHBondContact O-N 3.46Å; T145-S149 WeakPolarHBondContact O-CB 3.4Å; T145-S149 PolarHBondContact O-N 3.17Å; T145-S149 PolarHBondContact O-OG 3.49Å
146	V	98	Very high	97.2	Very high	11 Å²	11	59 Å²	59	7%	0.067	32%	0.323	C	S	.	.	H	α-helix	trans	-73.2	-32	179.8	-60.8	0	0	0	0	112	Y131 L134 A135 A138 K142 R143 A144 S149 S150	Y131-V146 HydrophobicContact CD1-CB 4.16Å; Y131-V146 HydrophobicContact CD1-CG1 4.24Å; L134-V146 HydrophobicContact CB-CB 4.24Å; L134-V146 HydrophobicContact CB-CG1 4.1Å; L134-V146 HydrophobicContact CB-CG2 4.42Å; L134-V146 HydrophobicContact CD1-CG1 4.4Å; A135-V146 VanDerWaalsContact CA-CG2 3.44Å; A135-V146 HydrophobicContact CB-CG2 3.76Å; A138-V146 HydrophobicContact CB-CG2 4.04Å; K142-V146 WeakPolarHBondContact O-CG2 3.36Å; K142-V146 PolarHBondContact O-N 2.96Å; K142-V146 VanDerWaalsContact O-N 3.17Å; R143-V146 VanDerWaalsContact O-CG2 3.25Å; R143-V146 WeakPolarHBondContact O-CG2 3.28Å; R143-V146 PolarHBondContact O-N 3.42Å; A144-V146 PolarHBondContact O-N 2.89Å; V146-S149 PolarHBondContact O-N 2.72Å; V146-S150 WeakPolarHBondContact O-CB 3.3Å; V146-S150 PolarHBondContact O-N 3.35Å
147	V	98.5	Very high	97.3	Very high	16 Å²	16	57.2 Å²	57.2	10%	0.097	32%	0.315	C	S	.	.	H	α-helix	trans	-63.6	-47.9	173.5	170.8	0	0	0	0	110.7	A135 R143 A144 S149 S150 E151 F182 I186 Q187	A135-V147 HydrophobicContact CB-CG2 3.84Å; R143-V147 HydrophobicContact CG-CG2 4.03Å; R143-V147 WeakPolarHBondContact O-CB 3.39Å; R143-V147 WeakPolarHBondContact O-CG2 3.45Å; R143-V147 PolarHBondContact O-N 3.29Å; A144-V147 PolarHBondContact O-N 2.94Å; V147-S149 VanDerWaalsContact C-N 3.33Å; V147-S149 PolarHBondContact O-N 3.31Å; V147-S150 WeakPolarHBondContact O-CB 3.33Å; V147-S150 PolarHBondContact O-N 3.49Å; V147-E151 PolarHBondContact O-N 3.24Å; V147-F182 HydrophobicContact CG1-CE2 4.45Å; V147-F182 HydrophobicContact CG1-CZ 3.99Å; V147-I186 HydrophobicContact CG1-CG2 4.41Å; V147-I186 HydrophobicContact CG2-CG2 3.6Å; V147-Q187 VanDerWaalsContact CG1-NE2 3.3Å
148	E	98.4	Very high	97.4	Very high	142 Å²	142	58 Å²	58	66%	0.664	32%	0.318	S	S	*	.	H	α-helix	trans	-60.7	-42.6	176.3	-175.3	-176.8	179	0	0	111.7	A144 S150 E151 K152	A144-E148 PolarHBondContact O-N 3.35Å; E148-S150 VanDerWaalsContact C-N 3.33Å; E148-S150 PolarHBondContact O-N 3.13Å; E148-E151 PolarHBondContact O-N 3.03Å; E148-K152 WeakPolarHBondContact O-CB 3.37Å; E148-K152 PolarHBondContact O-N 3.37Å
149	S	98.6	Very high	97.5	Very high	34 Å²	34	62.2 Å²	62.2	24%	0.238	34%	0.336	C	S	.	.	H	α-helix	trans	-65	-37.3	178.1	-58.9	0	0	0	0	112.4	T145 V146 V147 A153	T145-S149 WeakPolarHBondContact O-CB 3.4Å; T145-S149 PolarHBondContact O-N 3.17Å; T145-S149 PolarHBondContact O-OG 3.49Å; V146-S149 PolarHBondContact O-N 2.72Å; V147-S149 VanDerWaalsContact C-N 3.33Å; V147-S149 PolarHBondContact O-N 3.31Å; S149-A153 WeakPolarHBondContact O-CB 3.25Å; S149-A153 PolarHBondContact O-N 2.95Å; S149-A153 VanDerWaalsContact O-N 3.13Å
150	S	98.8	Very high	97.8	Very high	0 Å²	0	58.1 Å²	58.1	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-64	-51.7	174.6	-173.2	0	0	0	0	111.4	G128 V146 V147 E148 K152 A153 Y154 F182	G128-S150 PolarHBondContact O-OG 3.26Å; G128-S150 VanDerWaalsContact O-OG 3.11Å; V146-S150 WeakPolarHBondContact O-CB 3.3Å; V146-S150 PolarHBondContact O-N 3.35Å; V147-S150 WeakPolarHBondContact O-CB 3.33Å; V147-S150 PolarHBondContact O-N 3.49Å; E148-S150 VanDerWaalsContact C-N 3.33Å; E148-S150 PolarHBondContact O-N 3.13Å; S150-K152 VanDerWaalsContact C-N 3.33Å; S150-K152 PolarHBondContact O-N 3.37Å; S150-A153 PolarHBondContact O-N 3.39Å; S150-Y154 VanDerWaalsContact O-CD2 3.25Å; S150-Y154 WeakPolarHBondContact O-CD2 3.43Å; S150-Y154 PolarHBondContact O-N 3.04Å; S150-Y154 WeakPolarHBondContact OG-CE2 3.2Å; S150-F182 VanDerWaalsContact CB-CE2 3.45Å; S150-F182 VanDerWaalsContact OG-CD2 3.23Å; S150-F182 WeakPolarHBondContact OG-CD2 3.27Å; S150-F182 WeakPolarHBondContact OG-CE2 3.33Å
151	E	98.7	Very high	98	Very high	51 Å²	51	55 Å²	55	24%	0.238	28%	0.278	C	S	.	.	H	α-helix	trans	-56.7	-47.6	177.9	179.1	69.7	-177.3	0	0	110.7	V147 E148 A153 Y154 S155 Y179 F182 Y183	V147-E151 PolarHBondContact O-N 3.24Å; E148-E151 PolarHBondContact O-N 3.03Å; E151-A153 VanDerWaalsContact C-N 3.34Å; E151-A153 PolarHBondContact O-N 3.41Å; E151-Y154 PolarHBondContact O-N 2.94Å; E151-S155 WeakPolarHBondContact O-CB 3.43Å; E151-S155 PolarHBondContact O-N 3.45Å; E151-Y179 PolarHBondContact OE1-OH 3.45Å; E151-Y179 WeakPolarHBondContact OE2-CE2 3.39Å; E151-Y179 PolarHBondContact OE2-OH 2.96Å; E151-F182 HydrophobicContact CB-CE1 4.16Å; E151-F182 HydrophobicContact CB-CZ 4.17Å; E151-F182 WeakPolarHBondContact OE2-CE1 3.25Å; E151-Y183 PolarHBondContact OE1-OH 3.21Å; E151-Y183 WeakPolarHBondContact OE2-CE1 3.2Å
152	K	98.8	Very high	98.1	Very high	150 Å²	150	51.6 Å²	51.6	65%	0.652	26%	0.26	S	S	*	.	H	α-helix	trans	-58.1	-46.2	179.5	-177.5	178.3	178.4	178.7	0	112	E148 S150 E156	E148-K152 WeakPolarHBondContact O-CB 3.37Å; E148-K152 PolarHBondContact O-N 3.37Å; S150-K152 VanDerWaalsContact C-N 3.33Å; S150-K152 PolarHBondContact O-N 3.37Å; K152-E156 WeakPolarHBondContact O-CB 3.34Å; K152-E156 PolarHBondContact O-N 2.84Å
153	A	98.8	Very high	98.2	Very high	4 Å²	4	54.4 Å²	54.4	3%	0.033	28%	0.275	C	S	.	.	H	α-helix	trans	-66.3	-43.4	-179	0	0	0	0	0	112.1	K127 S149 S150 E151 A157	K127-A153 HydrophobicContact CB-CB 4.1Å; K127-A153 HydrophobicContact CD-CB 4.24Å; K127-A153 HydrophobicContact CG-CB 3.95Å; S149-A153 WeakPolarHBondContact O-CB 3.25Å; S149-A153 PolarHBondContact O-N 2.95Å; S149-A153 VanDerWaalsContact O-N 3.13Å; S150-A153 PolarHBondContact O-N 3.39Å; E151-A153 VanDerWaalsContact C-N 3.34Å; E151-A153 PolarHBondContact O-N 3.41Å; A153-A157 WeakPolarHBondContact O-CB 3.02Å; A153-A157 PolarHBondContact O-N 3.04Å
154	Y	98.9	Very high	98.2	Very high	0 Å²	0	54.6 Å²	54.6	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-67.3	-42.6	176.5	-74.4	-53.7	0	0	0	112.6	K125 D129 R132 S150 E151 A157 H158 L175 N178 Y179 F182	K125-Y154 HydrophobicContact CG-CE1 4.47Å; D129-Y154 VanDerWaalsContact CA-OH 3.27Å; D129-Y154 WeakPolarHBondContact CA-OH 3.23Å; D129-Y154 PolarHBondContact N-OH 3.06Å; D129-Y154 PolarHBondContact OD1-OH 3.42Å; R132-Y154 PolarHBondContact NE-OH 3.13Å; R132-Y154 VanDerWaalsContact NE-OH 3.1Å; S150-Y154 VanDerWaalsContact O-CD2 3.25Å; S150-Y154 WeakPolarHBondContact O-CD2 3.43Å; S150-Y154 PolarHBondContact O-N 3.04Å; S150-Y154 WeakPolarHBondContact OG-CE2 3.2Å; E151-Y154 PolarHBondContact O-N 2.94Å; Y154-A157 WeakPolarHBondContact O-CB 3.45Å; Y154-A157 PolarHBondContact O-N 3.45Å; Y154-H158 VanDerWaalsContact O-CB 3.3Å; Y154-H158 WeakPolarHBondContact O-CB 3.36Å; Y154-H158 PolarHBondContact O-N 2.98Å; Y154-L175 HydrophobicContact CD1-CD1 3.65Å; Y154-L175 HydrophobicContact CE1-CD1 4.37Å; Y154-N178 HydrophobicContact CE1-CB 4.19Å; Y154-Y179 HydrophobicContact CD1-CD2 4.39Å; Y154-Y179 HydrophobicContact CD1-CG 4.3Å; Y154-Y179 AromaticContact CD2-CD2 3.59Å; Y154-Y179 HydrophobicContact CD2-CD2 3.59Å; Y154-Y179 AromaticContact CD2-CE2 3.97Å; Y154-Y179 HydrophobicContact CD2-CE2 3.97Å; Y154-Y179 HydrophobicContact CD2-CG 4.3Å; Y154-Y179 HydrophobicContact CE2-CD2 4.42Å; Y154-Y179 AromaticContact CG-CD2 3.56Å; Y154-Y179 HydrophobicContact CG-CD2 3.56Å; Y154-Y179 AromaticContact CG-CE2 3.98Å; Y154-Y179 HydrophobicContact CG-CE2 3.98Å; Y154-Y179 AromaticContact CG-CG 3.85Å; Y154-Y179 HydrophobicContact CG-CG 3.85Å; Y154-F182 HydrophobicContact CD2-CB 4.13Å; Y154-F182 HydrophobicContact CD2-CD1 4.38Å; Y154-F182 HydrophobicContact CD2-CG 4.07Å; Y154-F182 HydrophobicContact CE2-CB 3.67Å; Y154-F182 HydrophobicContact CE2-CD2 4.13Å; Y154-F182 AromaticContact CE2-CG 3.89Å; Y154-F182 HydrophobicContact CE2-CG 3.89Å
155	S	98.7	Very high	98.1	Very high	48 Å²	48	52.1 Å²	52.1	34%	0.336	26%	0.257	S	S	.	.	H	α-helix	trans	-61.7	-46.5	178	-172.9	0	0	0	0	111.5	E151 A157 H158 E159	E151-S155 WeakPolarHBondContact O-CB 3.43Å; E151-S155 PolarHBondContact O-N 3.45Å; S155-A157 PolarHBondContact O-N 2.82Å; S155-H158 WeakPolarHBondContact O-CB 3.36Å; S155-H158 PolarHBondContact O-N 3.38Å; S155-H158 VanDerWaalsContact O-N 3.14Å; S155-E159 PolarHBondContact O-N 3.35Å
156	E	98.5	Very high	98.1	Very high	72 Å²	72	53.8 Å²	53.8	34%	0.336	26%	0.26	S	S	.	.	H	α-helix	trans	-60.6	-43.8	174.9	-171.1	-175.9	163.7	0	0	111.6	K120 L124 K152 H158 I160	K120-E156 WeakPolarHBondContact CE-OE1 3.4Å; K120-E156 IonicContact NZ-OE1 2.65Å; K120-E156 PolarHBondContact NZ-OE1 3.28Å; L124-E156 HydrophobicContact CD1-CB 4.16Å; L124-E156 HydrophobicContact CD1-CG 3.74Å; L124-E156 HydrophobicContact CD2-CG 4.5Å; K152-E156 WeakPolarHBondContact O-CB 3.34Å; K152-E156 PolarHBondContact O-N 2.84Å; E156-H158 VanDerWaalsContact C-N 3.28Å; E156-H158 PolarHBondContact O-N 2.92Å; E156-I160 HydrophobicContact CG-CD1 4.06Å; E156-I160 WeakPolarHBondContact O-CD1 3.49Å; E156-I160 VanDerWaalsContact O-CG1 3.3Å; E156-I160 WeakPolarHBondContact O-CG1 3.48Å; E156-I160 PolarHBondContact O-N 3.01Å
157	A	98.7	Very high	98	Very high	0 Å²	0	54 Å²	54	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-60.9	-39.7	175.6	0	0	0	0	0	111.8	V121 L124 A153 Y154 S155 S161 L175	V121-A157 HydrophobicContact CG1-CB 4.35Å; L124-A157 HydrophobicContact CB-CB 3.68Å; L124-A157 HydrophobicContact CD1-CB 4.47Å; A153-A157 WeakPolarHBondContact O-CB 3.02Å; A153-A157 PolarHBondContact O-N 3.04Å; Y154-A157 WeakPolarHBondContact O-CB 3.45Å; Y154-A157 PolarHBondContact O-N 3.45Å; S155-A157 PolarHBondContact O-N 2.82Å; A157-S161 VanDerWaalsContact O-CB 3.26Å; A157-S161 WeakPolarHBondContact O-CB 3.42Å; A157-S161 PolarHBondContact O-N 3.47Å; A157-S161 PolarHBondContact O-OG 3.15Å; A157-L175 VanDerWaalsContact C-CD2 3.46Å; A157-L175 HydrophobicContact CB-CD1 3.82Å; A157-L175 HydrophobicContact CB-CD2 3.62Å; A157-L175 HydrophobicContact CB-CG 4.39Å
158	H	98.6	Very high	97.9	Very high	30 Å²	30	53.2 Å²	53.2	14%	0.139	26%	0.256	C	S	.	.	H	α-helix	trans	-66.9	-46.8	-175.2	-169.4	51.1	0	0	0	111.1	Y154 S155 E156 S161 K162 L175 Y179	Y154-H158 VanDerWaalsContact O-CB 3.3Å; Y154-H158 WeakPolarHBondContact O-CB 3.36Å; Y154-H158 PolarHBondContact O-N 2.98Å; S155-H158 WeakPolarHBondContact O-CB 3.36Å; S155-H158 PolarHBondContact O-N 3.38Å; S155-H158 VanDerWaalsContact O-N 3.14Å; E156-H158 VanDerWaalsContact C-N 3.28Å; E156-H158 PolarHBondContact O-N 2.92Å; H158-S161 PolarHBondContact O-N 2.94Å; H158-S161 PolarHBondContact O-OG 3.05Å; H158-K162 WeakPolarHBondContact CD2-CE 3.38Å; H158-K162 PolarHBondContact CD2-NZ 3.23Å; H158-K162 VanDerWaalsContact CD2-NZ 3.34Å; H158-K162 WeakPolarHBondContact NE2-CE 3.37Å; H158-K162 PolarHBondContact NE2-NZ 2.7Å; H158-K162 WeakPolarHBondContact O-CG 3.4Å; H158-K162 PolarHBondContact O-N 3.49Å; H158-L175 HydrophobicContact CB-CD2 4.25Å; H158-Y179 HydrophobicContact CB-CE1 4.34Å
159	E	98.3	Very high	97.8	Very high	100 Å²	100	48.4 Å²	48.4	47%	0.467	23%	0.234	S	C	.	.	H	α-helix	trans	-63.2	-45.6	178.7	-64.6	-52.7	116	0	0	111.9	S155 S161 K162 E163	S155-E159 PolarHBondContact O-N 3.35Å; E159-S161 VanDerWaalsContact C-N 3.3Å; E159-S161 PolarHBondContact O-N 3.12Å; E159-K162 PolarHBondContact O-N 3.32Å; E159-K162 IonicContact OE1-NZ 3.76Å; E159-K162 PolarHBondContact OE1-NZ 3.16Å; E159-E163 PolarHBondContact O-N 2.71Å
160	I	98.2	Very high	97.7	Very high	26 Å²	26	47.8 Å²	47.8	13%	0.133	23%	0.229	C	C	.	.	H	α-helix	trans	-61.3	-41.2	175.3	-62	167.5	0	0	0	110.8	K120 V121 L124 E156 E163 H164	K120-I160 HydrophobicContact CD-CD1 3.82Å; K120-I160 HydrophobicContact CG-CD1 4.14Å; V121-I160 HydrophobicContact CG2-CB 3.84Å; V121-I160 HydrophobicContact CG2-CG2 3.51Å; L124-I160 HydrophobicContact CD1-CD1 3.81Å; E156-I160 HydrophobicContact CG-CD1 4.06Å; E156-I160 WeakPolarHBondContact O-CD1 3.49Å; E156-I160 VanDerWaalsContact O-CG1 3.3Å; E156-I160 WeakPolarHBondContact O-CG1 3.48Å; E156-I160 PolarHBondContact O-N 3.01Å; I160-E163 PolarHBondContact O-N 2.93Å; I160-H164 PolarHBondContact O-CD2 2.81Å; I160-H164 PolarHBondContact O-N 2.86Å; I160-H164 VanDerWaalsContact O-N 3.13Å
161	S	98.1	Very high	97.7	Very high	0 Å²	0	48.8 Å²	48.8	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-68	-35.8	-178.8	78.4	0	0	0	0	113	A157 H158 E159 E163 M165	A157-S161 VanDerWaalsContact O-CB 3.26Å; A157-S161 WeakPolarHBondContact O-CB 3.42Å; A157-S161 PolarHBondContact O-N 3.47Å; A157-S161 PolarHBondContact O-OG 3.15Å; H158-S161 PolarHBondContact O-N 2.94Å; H158-S161 PolarHBondContact O-OG 3.05Å; E159-S161 VanDerWaalsContact C-N 3.3Å; E159-S161 PolarHBondContact O-N 3.12Å; S161-E163 VanDerWaalsContact C-N 3.34Å; S161-M165 WeakPolarHBondContact O-CA 3.38Å; S161-M165 VanDerWaalsContact O-CB 3.28Å; S161-M165 WeakPolarHBondContact O-CB 3.37Å; S161-M165 PolarHBondContact O-N 3.22Å
162	K	97.1	Very high	97.7	Very high	94 Å²	94	48.2 Å²	48.2	41%	0.409	23%	0.23	S	C	.	.	H	α-helix	trans	-65.3	-39.1	175.7	-77.1	173.3	-178.9	163.1	0	111.9	H158 E159	H158-K162 WeakPolarHBondContact CD2-CE 3.38Å; H158-K162 PolarHBondContact CD2-NZ 3.23Å; H158-K162 VanDerWaalsContact CD2-NZ 3.34Å; H158-K162 WeakPolarHBondContact NE2-CE 3.37Å; H158-K162 PolarHBondContact NE2-NZ 2.7Å; H158-K162 WeakPolarHBondContact O-CG 3.4Å; H158-K162 PolarHBondContact O-N 3.49Å; E159-K162 PolarHBondContact O-N 3.32Å; E159-K162 IonicContact OE1-NZ 3.76Å; E159-K162 PolarHBondContact OE1-NZ 3.16Å
163	E	96.5	Very high	97.7	Very high	150 Å²	150	41.2 Å²	41.2	70%	0.701	20%	0.199	S	C	*	.	H	α-helix	trans	-74.1	-38.9	-177.1	-170.8	177.5	165.4	0	0	112.6	E159 I160 S161	E159-E163 PolarHBondContact O-N 2.71Å; I160-E163 PolarHBondContact O-N 2.93Å; S161-E163 VanDerWaalsContact C-N 3.34Å
164	H	96.8	Very high	97.6	Very high	84 Å²	84	41.4 Å²	41.4	39%	0.389	20%	0.202	S	C	.	.	H	α-helix	trans	-117.3	-8.3	-166.5	-59.8	-59.7	0	0	0	115.9	Y117 I160	Y117-H164 HydrophobicContact CD1-CB 4.08Å; Y117-H164 HydrophobicContact CD2-CB 3.57Å; Y117-H164 HydrophobicContact CE1-CB 4.45Å; Y117-H164 HydrophobicContact CE2-CB 3.99Å; Y117-H164 WeakPolarHBondContact CE2-O 3.49Å; Y117-H164 HydrophobicContact CG-CB 3.63Å; I160-H164 PolarHBondContact O-CD2 2.81Å; I160-H164 PolarHBondContact O-N 2.86Å; I160-H164 VanDerWaalsContact O-N 3.13Å
165	M	96.1	Very high	97.6	Very high	9 Å²	9	41.4 Å²	41.4	4%	0.044	20%	0.202	C	C	.	.	S	Bend	trans	-124.8	138.2	-172	-50	178.7	66.8	0	0	111.3	Y117 E118 V121 S161 H169 I171 R172	Y117-M165 HydrophobicContact CD2-CG 3.87Å; Y117-M165 HydrophobicContact CE2-CG 4.05Å; E118-M165 HydrophobicContact CG-CE 4.12Å; V121-M165 HydrophobicContact CB-SD 4.05Å; V121-M165 HydrophobicContact CG1-SD 4.04Å; V121-M165 HydrophobicContact CG2-SD 3.89Å; S161-M165 WeakPolarHBondContact O-CA 3.38Å; S161-M165 VanDerWaalsContact O-CB 3.28Å; S161-M165 WeakPolarHBondContact O-CB 3.37Å; S161-M165 PolarHBondContact O-N 3.22Å; M165-H169 HydrophobicContact CB-CB 4.31Å; M165-H169 HydrophobicContact CE-CB 4.17Å; M165-H169 WeakPolarHBondContact CE-CE1 3.49Å; M165-H169 WeakPolarHBondContact CE-ND1 3.47Å; M165-I171 HydrophobicContact CE-CB 3.77Å; M165-I171 HydrophobicContact CE-CG2 4.06Å; M165-R172 HydrophobicContact CB-CB 4.34Å; M165-R172 HydrophobicContact CE-CB 4.46Å; M165-R172 PolarHBondContact O-NH1 3.26Å
166	Q	96.1	Very high	97.6	Very high	109 Å²	109	39.3 Å²	39.3	51%	0.509	19%	0.187	S	C	.	.			trans	-61.5	146.6	174.3	-71	178.9	-24.1	0	0	111.2	T168 H169 R172	Q166-T168 PolarHBondContact O-N 2.99Å; Q166-T168 VanDerWaalsContact O-N 3.13Å; Q166-H169 WeakPolarHBondContact O-CB 3.46Å; Q166-H169 PolarHBondContact O-N 3.4Å; Q166-R172 WeakPolarHBondContact O-CD 3.38Å
167	P	97.4	Very high	97.7	Very high	15 Å²	15	36.8 Å²	36.8	10%	0.097	18%	0.176	C	C	.	.	T	Hydrogen-bonded Turn	trans	-51.8	-32.8	174.7	-28.6	36.2	0	0	0	114.4	H169 L173 D203 E207	P167-H169 VanDerWaalsContact C-N 3.3Å; P167-H169 PolarHBondContact O-N 3.44Å; P167-L173 WeakPolarHBondContact O-CD2 3.5Å; P167-L173 WeakPolarHBondContact O-CG 3.25Å; P167-D203 HydrophobicContact CB-CB 3.85Å; P167-D203 HydrophobicContact CG-CB 4.26Å; P167-E207 WeakPolarHBondContact CD-OE2 3.45Å
168	T	96.6	Very high	97.6	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.3	-3.6	179.3	56	0	0	0	0	114	Q166 A204 E207 S219	Q166-T168 PolarHBondContact O-N 2.99Å; Q166-T168 VanDerWaalsContact O-N 3.13Å; T168-A204 HydrophobicContact CG2-CB 4.43Å; T168-A204 WeakPolarHBondContact CG2-O 3.29Å; T168-E207 HydrophobicContact CG2-CB 3.95Å; T168-S219 WeakPolarHBondContact O-CB 3.36Å; T168-S219 PolarHBondContact O-OG 3.46Å
169	H	96.3	Very high	97.7	Very high	40 Å²	40	37 Å²	37	19%	0.185	18%	0.178	C	C	.	.			trans	-67.7	127.9	-176.2	-171.5	-61.3	0	0	0	111.4	E118 M165 Q166 P167 I171 R172 L173	E118-H169 IonicContact OE1-NE2 3.91Å; E118-H169 PolarHBondContact OE1-NE2 2.82Å; M165-H169 HydrophobicContact CB-CB 4.31Å; M165-H169 HydrophobicContact CE-CB 4.17Å; M165-H169 WeakPolarHBondContact CE-CE1 3.49Å; M165-H169 WeakPolarHBondContact CE-ND1 3.47Å; Q166-H169 WeakPolarHBondContact O-CB 3.46Å; Q166-H169 PolarHBondContact O-N 3.4Å; P167-H169 VanDerWaalsContact C-N 3.3Å; P167-H169 PolarHBondContact O-N 3.44Å; H169-I171 PolarHBondContact ND1-N 2.91Å; H169-I171 VanDerWaalsContact ND1-N 3.12Å; H169-I171 PolarHBondContact O-N 3.36Å; H169-R172 HydrophobicContact CB-CB 4.26Å; H169-R172 PolarHBondContact O-N 2.83Å; H169-L173 PolarHBondContact O-N 3.47Å
170	P	96.7	Very high	97.7	Very high	22 Å²	22	32.2 Å²	32.2	14%	0.143	16%	0.156	C	C	.	.	H	α-helix	trans	-53.6	-43.4	-175.1	-26.1	29.6	0	0	0	114.8	L173 G174 D218 S219 I222	P170-L173 PolarHBondContact O-N 3.42Å; P170-G174 PolarHBondContact O-N 3.07Å; P170-D218 HydrophobicContact CB-CB 4.2Å; P170-D218 HydrophobicContact CG-CB 4.18Å; P170-S219 WeakPolarHBondContact CD-OG 3.25Å; P170-S219 WeakPolarHBondContact CG-OG 3.38Å; P170-I222 HydrophobicContact CB-CD1 4.19Å; P170-I222 VanDerWaalsContact O-CD1 3.32Å; P170-I222 WeakPolarHBondContact O-CD1 3.49Å
171	I	97.7	Very high	97.7	Very high	21 Å²	21	31.9 Å²	31.9	11%	0.108	16%	0.155	C	C	.	.	H	α-helix	trans	-62.5	-42.3	176.8	-61.7	173.7	0	0	0	112.2	E118 V121 F122 M165 H169 G174 L175	E118-I171 HydrophobicContact CB-CD1 4.32Å; V121-I171 HydrophobicContact CB-CG2 4.31Å; V121-I171 HydrophobicContact CG1-CG2 3.74Å; F122-I171 HydrophobicContact CB-CD1 4.4Å; F122-I171 HydrophobicContact CB-CG2 4.42Å; F122-I171 HydrophobicContact CD2-CD1 4.11Å; F122-I171 HydrophobicContact CD2-CG1 4.25Å; M165-I171 HydrophobicContact CE-CB 3.77Å; M165-I171 HydrophobicContact CE-CG2 4.06Å; H169-I171 PolarHBondContact ND1-N 2.91Å; H169-I171 VanDerWaalsContact ND1-N 3.12Å; H169-I171 PolarHBondContact O-N 3.36Å; I171-G174 PolarHBondContact O-N 3.29Å; I171-L175 WeakPolarHBondContact O-CB 3.31Å; I171-L175 PolarHBondContact O-N 2.74Å
172	R	98.1	Very high	97.7	Very high	39 Å²	39	31.9 Å²	31.9	15%	0.147	16%	0.155	C	C	.	.	H	α-helix	trans	-66.7	-44.6	178.8	178.1	174.8	169.3	178.3	-6.6	110.8	M165 Q166 H169 L175 A176 D203	M165-R172 HydrophobicContact CB-CB 4.34Å; M165-R172 HydrophobicContact CE-CB 4.46Å; M165-R172 PolarHBondContact O-NH1 3.26Å; Q166-R172 WeakPolarHBondContact O-CD 3.38Å; H169-R172 HydrophobicContact CB-CB 4.26Å; H169-R172 PolarHBondContact O-N 2.83Å; R172-L175 WeakPolarHBondContact O-CB 3.4Å; R172-L175 PolarHBondContact O-N 2.61Å; R172-A176 PolarHBondContact O-N 2.91Å; R172-D203 IonicContact NH2-OD2 3.96Å
173	L	98.5	Very high	97.8	Very high	2 Å²	2	29.2 Å²	29.2	1%	0.01	14%	0.143	C	C	.	.	H	α-helix	trans	-61.7	-44.7	174.3	-72.1	167.3	0	0	0	111.7	P167 H169 P170 L175 A176 L177 A204 I222 M223 L226	P167-L173 WeakPolarHBondContact O-CD2 3.5Å; P167-L173 WeakPolarHBondContact O-CG 3.25Å; H169-L173 PolarHBondContact O-N 3.47Å; P170-L173 PolarHBondContact O-N 3.42Å; L173-L175 VanDerWaalsContact C-N 3.27Å; L173-L175 PolarHBondContact O-N 3.16Å; L173-A176 PolarHBondContact O-N 3.27Å; L173-L177 PolarHBondContact O-N 3.43Å; L173-A204 HydrophobicContact CD1-CB 4.45Å; L173-A204 HydrophobicContact CD2-CB 3.65Å; L173-I222 HydrophobicContact CB-CB 4.17Å; L173-I222 HydrophobicContact CB-CD1 4.49Å; L173-I222 HydrophobicContact CB-CG2 3.61Å; L173-M223 HydrophobicContact CD1-CG 3.93Å; L173-M223 HydrophobicContact CD1-SD 4.36Å; L173-M223 HydrophobicContact CD2-CG 4.13Å; L173-L226 HydrophobicContact CD2-CD1 4.03Å
174	G	98.5	Very high	97.9	Very high	9 Å²	9	24.6 Å²	24.6	9%	0.093	12%	0.119	C	C	.	.	H	α-helix	trans	-64.3	-33	178.3	0	0	0	0	0	112.7	K125 P170 I171 N178	K125-G174 WeakPolarHBondContact CE-O 3.1Å; P170-G174 PolarHBondContact O-N 3.07Å; I171-G174 PolarHBondContact O-N 3.29Å; G174-N178 PolarHBondContact O-N 3.38Å; G174-N178 VanDerWaalsContact O-N 3.12Å
175	L	98.8	Very high	97.9	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-64	-51.2	171.2	169.3	63	0	0	0	110.9	V121 K125 Y154 A157 H158 I171 R172 L173 L177 N178 Y179	V121-L175 HydrophobicContact CG1-CD2 4.06Å; K125-L175 HydrophobicContact CB-CD1 3.98Å; K125-L175 HydrophobicContact CD-CB 4.11Å; K125-L175 HydrophobicContact CG-CB 4.28Å; K125-L175 HydrophobicContact CG-CD1 3.99Å; Y154-L175 HydrophobicContact CD1-CD1 3.65Å; Y154-L175 HydrophobicContact CE1-CD1 4.37Å; A157-L175 VanDerWaalsContact C-CD2 3.46Å; A157-L175 HydrophobicContact CB-CD1 3.82Å; A157-L175 HydrophobicContact CB-CD2 3.62Å; A157-L175 HydrophobicContact CB-CG 4.39Å; H158-L175 HydrophobicContact CB-CD2 4.25Å; I171-L175 WeakPolarHBondContact O-CB 3.31Å; I171-L175 PolarHBondContact O-N 2.74Å; R172-L175 WeakPolarHBondContact O-CB 3.4Å; R172-L175 PolarHBondContact O-N 2.61Å; L173-L175 VanDerWaalsContact C-N 3.27Å; L173-L175 PolarHBondContact O-N 3.16Å; L175-L177 VanDerWaalsContact C-N 3.3Å; L175-L177 PolarHBondContact O-N 3.05Å; L175-N178 PolarHBondContact O-N 3.18Å; L175-Y179 WeakPolarHBondContact O-CB 3.34Å; L175-Y179 PolarHBondContact O-N 2.84Å
176	A	98.8	Very high	97.9	Very high	3 Å²	3	25.7 Å²	25.7	3%	0.025	12%	0.124	C	C	.	.	H	α-helix	trans	-59.2	-41.5	178.4	0	0	0	0	0	112.2	R172 L173 Y179 S180 A200	R172-A176 PolarHBondContact O-N 2.91Å; L173-A176 PolarHBondContact O-N 3.27Å; A176-Y179 PolarHBondContact O-N 3.4Å; A176-S180 WeakPolarHBondContact O-CB 3.46Å; A176-S180 PolarHBondContact O-N 3.17Å; A176-S180 PolarHBondContact O-OG 3Å; A176-A200 HydrophobicContact CB-CB 3.41Å; A176-A200 VanDerWaalsContact CB-CB 3.41Å
177	L	98.8	Very high	98	Very high	19 Å²	19	24.3 Å²	24.3	10%	0.099	12%	0.118	C	C	.	.	H	α-helix	trans	-57.4	-51.8	174.8	177.4	64.9	0	0	0	111.7	L173 L175 S180 V181 I222 L225 L226 N229	L173-L177 PolarHBondContact O-N 3.43Å; L175-L177 VanDerWaalsContact C-N 3.3Å; L175-L177 PolarHBondContact O-N 3.05Å; L177-S180 PolarHBondContact O-OG 3.46Å; L177-V181 VanDerWaalsContact O-CG2 3.25Å; L177-V181 WeakPolarHBondContact O-CG2 3.39Å; L177-V181 PolarHBondContact O-N 3.21Å; L177-I222 HydrophobicContact CB-CG2 4.26Å; L177-I222 HydrophobicContact CD2-CG2 4.17Å; L177-L225 HydrophobicContact CD1-CB 4.05Å; L177-L225 HydrophobicContact CD2-CB 3.92Å; L177-L225 HydrophobicContact CD2-CD1 3.88Å; L177-L226 HydrophobicContact CB-CD2 3.94Å; L177-L226 HydrophobicContact CB-CG 4.22Å; L177-L226 HydrophobicContact CD1-CD2 4.01Å; L177-L226 HydrophobicContact CD1-CG 4.19Å; L177-N229 VanDerWaalsContact CD1-ND2 3.31Å; L177-N229 WeakPolarHBondContact CD1-ND2 3.39Å
178	N	98.7	Very high	97.9	Very high	30 Å²	30	30.3 Å²	30.3	16%	0.16	15%	0.149	C	C	.	.	H	α-helix	trans	-73	-33.3	-176.8	-76.3	12.9	0	0	0	112.9	K125 D129 Y154 G174 L175 V181 F182	K125-N178 PolarHBondContact NZ-ND2 3.17Å; D129-N178 VanDerWaalsContact OD1-CB 3.29Å; D129-N178 WeakPolarHBondContact OD1-CB 3.25Å; D129-N178 PolarHBondContact OD1-ND2 3.01Å; D129-N178 PolarHBondContact OD2-ND2 3.48Å; Y154-N178 HydrophobicContact CE1-CB 4.19Å; G174-N178 PolarHBondContact O-N 3.38Å; G174-N178 VanDerWaalsContact O-N 3.12Å; L175-N178 PolarHBondContact O-N 3.18Å; N178-V181 PolarHBondContact O-N 2.97Å; N178-F182 PolarHBondContact O-N 3.42Å
179	Y	98.8	Very high	98	Very high	5 Å²	5	30.8 Å²	30.8	2%	0.02	15%	0.153	C	C	.	.	H	α-helix	trans	-73.9	-36.9	179.7	-169.7	-166.2	0	0	0	112.1	E151 Y154 H158 L175 A176 V181 F182 Y183 L196	E151-Y179 PolarHBondContact OE1-OH 3.45Å; E151-Y179 WeakPolarHBondContact OE2-CE2 3.39Å; E151-Y179 PolarHBondContact OE2-OH 2.96Å; Y154-Y179 HydrophobicContact CD1-CD2 4.39Å; Y154-Y179 HydrophobicContact CD1-CG 4.3Å; Y154-Y179 AromaticContact CD2-CD2 3.59Å; Y154-Y179 HydrophobicContact CD2-CD2 3.59Å; Y154-Y179 AromaticContact CD2-CE2 3.97Å; Y154-Y179 HydrophobicContact CD2-CE2 3.97Å; Y154-Y179 HydrophobicContact CD2-CG 4.3Å; Y154-Y179 HydrophobicContact CE2-CD2 4.42Å; Y154-Y179 AromaticContact CG-CD2 3.56Å; Y154-Y179 HydrophobicContact CG-CD2 3.56Å; Y154-Y179 AromaticContact CG-CE2 3.98Å; Y154-Y179 HydrophobicContact CG-CE2 3.98Å; Y154-Y179 AromaticContact CG-CG 3.85Å; Y154-Y179 HydrophobicContact CG-CG 3.85Å; H158-Y179 HydrophobicContact CB-CE1 4.34Å; L175-Y179 WeakPolarHBondContact O-CB 3.34Å; L175-Y179 PolarHBondContact O-N 2.84Å; A176-Y179 PolarHBondContact O-N 3.4Å; Y179-V181 VanDerWaalsContact C-N 3.34Å; Y179-V181 PolarHBondContact O-N 3.05Å; Y179-F182 HydrophobicContact CD2-CB 4.27Å; Y179-F182 AromaticContact CD2-CD1 3.97Å; Y179-F182 HydrophobicContact CD2-CD1 3.97Å; Y179-F182 HydrophobicContact CD2-CG 4.48Å; Y179-F182 AromaticContact CE2-CD1 3.91Å; Y179-F182 HydrophobicContact CE2-CD1 3.91Å; Y179-F182 HydrophobicContact CE2-CE1 4.44Å; Y179-F182 VanDerWaalsContact O-CB 3.28Å; Y179-F182 WeakPolarHBondContact O-CB 3.32Å; Y179-F182 PolarHBondContact O-N 2.88Å; Y179-Y183 HydrophobicContact CD1-CE2 4.33Å; Y179-Y183 HydrophobicContact CD2-CD2 4.16Å; Y179-Y183 AromaticContact CD2-CE2 3.85Å; Y179-Y183 HydrophobicContact CD2-CE2 3.85Å; Y179-Y183 HydrophobicContact CE1-CE2 4.05Å; Y179-Y183 HydrophobicContact CE2-CD2 4.23Å; Y179-Y183 HydrophobicContact CE2-CE1 4.24Å; Y179-Y183 AromaticContact CE2-CE2 3.56Å; Y179-Y183 HydrophobicContact CE2-CE2 3.56Å; Y179-Y183 AromaticContact CE2-CZ 3.55Å; Y179-Y183 HydrophobicContact CG-CE2 4.25Å; Y179-Y183 AromaticContact CZ-CE2 3.69Å; Y179-Y183 AromaticContact CZ-CZ 3.6Å; Y179-Y183 WeakPolarHBondContact O-CD2 3.44Å; Y179-Y183 PolarHBondContact O-N 3.49Å; Y179-Y183 PolarHBondContact OH-OH 2.97Å; Y179-L196 HydrophobicContact CD1-CD2 3.5Å; Y179-L196 HydrophobicContact CE1-CD2 4.31Å; Y179-L196 HydrophobicContact CG-CD2 3.66Å
180	S	98.7	Very high	98	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-62.9	-41	170.5	54.7	0	0	0	0	111.9	A176 L177 F182 Y183 Y184 A193	A176-S180 WeakPolarHBondContact O-CB 3.46Å; A176-S180 PolarHBondContact O-N 3.17Å; A176-S180 PolarHBondContact O-OG 3Å; L177-S180 PolarHBondContact O-OG 3.46Å; S180-F182 VanDerWaalsContact C-N 3.28Å; S180-F182 PolarHBondContact O-N 2.67Å; S180-Y183 PolarHBondContact O-N 2.89Å; S180-Y184 PolarHBondContact O-N 3.03Å; S180-A193 WeakPolarHBondContact CB-O 3.41Å; S180-A193 VanDerWaalsContact O-CB 3.27Å; S180-A193 WeakPolarHBondContact O-CB 3.28Å
181	V	98.5	Very high	98	Very high	18 Å²	18	36.7 Å²	36.7	11%	0.109	18%	0.182	C	C	.	.	H	α-helix	trans	-61	-37.4	172.8	174	0	0	0	0	111.5	L177 N178 Y179 Y184 E185 W233	L177-V181 VanDerWaalsContact O-CG2 3.25Å; L177-V181 WeakPolarHBondContact O-CG2 3.39Å; L177-V181 PolarHBondContact O-N 3.21Å; N178-V181 PolarHBondContact O-N 2.97Å; Y179-V181 VanDerWaalsContact C-N 3.34Å; Y179-V181 PolarHBondContact O-N 3.05Å; V181-Y184 PolarHBondContact O-N 3.12Å; V181-E185 VanDerWaalsContact CG1-CD 3.44Å; V181-E185 HydrophobicContact CG1-CG 3.93Å; V181-E185 WeakPolarHBondContact CG1-OE2 3.27Å; V181-E185 WeakPolarHBondContact O-CB 3.39Å; V181-E185 PolarHBondContact O-N 2.92Å; V181-W233 HydrophobicContact CG2-CH2 3.99Å; V181-W233 HydrophobicContact CG2-CZ2 3.94Å
182	F	98.7	Very high	98	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-59.5	-49.5	172.6	170.8	-97.3	0	0	0	112	R132 V147 S150 E151 Y154 N178 Y179 S180 Y184 I186 Q187	R132-F182 HydrophobicContact CB-CD2 4.17Å; R132-F182 HydrophobicContact CG-CD2 4.23Å; V147-F182 HydrophobicContact CG1-CE2 4.45Å; V147-F182 HydrophobicContact CG1-CZ 3.99Å; S150-F182 VanDerWaalsContact CB-CE2 3.45Å; S150-F182 VanDerWaalsContact OG-CD2 3.23Å; S150-F182 WeakPolarHBondContact OG-CD2 3.27Å; S150-F182 WeakPolarHBondContact OG-CE2 3.33Å; E151-F182 HydrophobicContact CB-CE1 4.16Å; E151-F182 HydrophobicContact CB-CZ 4.17Å; E151-F182 WeakPolarHBondContact OE2-CE1 3.25Å; Y154-F182 HydrophobicContact CD2-CB 4.13Å; Y154-F182 HydrophobicContact CD2-CD1 4.38Å; Y154-F182 HydrophobicContact CD2-CG 4.07Å; Y154-F182 HydrophobicContact CE2-CB 3.67Å; Y154-F182 HydrophobicContact CE2-CD2 4.13Å; Y154-F182 AromaticContact CE2-CG 3.89Å; Y154-F182 HydrophobicContact CE2-CG 3.89Å; N178-F182 PolarHBondContact O-N 3.42Å; Y179-F182 HydrophobicContact CD2-CB 4.27Å; Y179-F182 AromaticContact CD2-CD1 3.97Å; Y179-F182 HydrophobicContact CD2-CD1 3.97Å; Y179-F182 HydrophobicContact CD2-CG 4.48Å; Y179-F182 AromaticContact CE2-CD1 3.91Å; Y179-F182 HydrophobicContact CE2-CD1 3.91Å; Y179-F182 HydrophobicContact CE2-CE1 4.44Å; Y179-F182 VanDerWaalsContact O-CB 3.28Å; Y179-F182 WeakPolarHBondContact O-CB 3.32Å; Y179-F182 PolarHBondContact O-N 2.88Å; S180-F182 VanDerWaalsContact C-N 3.28Å; S180-F182 PolarHBondContact O-N 2.67Å; F182-Y184 VanDerWaalsContact C-N 3.29Å; F182-Y184 PolarHBondContact O-N 3.4Å; F182-I186 HydrophobicContact CD2-CB 3.81Å; F182-I186 HydrophobicContact CD2-CG1 3.97Å; F182-I186 HydrophobicContact CD2-CG2 4.11Å; F182-I186 HydrophobicContact CE2-CB 3.87Å; F182-I186 HydrophobicContact CE2-CG1 4.36Å; F182-I186 HydrophobicContact CE2-CG2 3.65Å; F182-I186 HydrophobicContact CZ-CG2 4.37Å; F182-I186 WeakPolarHBondContact O-CA 3.48Å; F182-I186 WeakPolarHBondContact O-CB 3.15Å; F182-I186 PolarHBondContact O-N 3.26Å; F182-Q187 HydrophobicContact CD1-CG 4.08Å; F182-Q187 HydrophobicContact CE1-CG 3.31Å; F182-Q187 HydrophobicContact CE2-CG 4.49Å; F182-Q187 HydrophobicContact CZ-CG 3.6Å; F182-Q187 PolarHBondContact O-N 2.9Å
183	Y	98.6	Very high	98	Very high	39 Å²	39	38.6 Å²	38.6	15%	0.153	19%	0.192	C	C	.	.	H	α-helix	trans	-59	-43.2	177.8	-77.9	-52.9	0	0	0	111.6	E151 Y179 S180 Q187 N188 A189 Q192 L196	E151-Y183 PolarHBondContact OE1-OH 3.21Å; E151-Y183 WeakPolarHBondContact OE2-CE1 3.2Å; Y179-Y183 HydrophobicContact CD1-CE2 4.33Å; Y179-Y183 HydrophobicContact CD2-CD2 4.16Å; Y179-Y183 AromaticContact CD2-CE2 3.85Å; Y179-Y183 HydrophobicContact CD2-CE2 3.85Å; Y179-Y183 HydrophobicContact CE1-CE2 4.05Å; Y179-Y183 HydrophobicContact CE2-CD2 4.23Å; Y179-Y183 HydrophobicContact CE2-CE1 4.24Å; Y179-Y183 AromaticContact CE2-CE2 3.56Å; Y179-Y183 HydrophobicContact CE2-CE2 3.56Å; Y179-Y183 AromaticContact CE2-CZ 3.55Å; Y179-Y183 HydrophobicContact CG-CE2 4.25Å; Y179-Y183 AromaticContact CZ-CE2 3.69Å; Y179-Y183 AromaticContact CZ-CZ 3.6Å; Y179-Y183 WeakPolarHBondContact O-CD2 3.44Å; Y179-Y183 PolarHBondContact O-N 3.49Å; Y179-Y183 PolarHBondContact OH-OH 2.97Å; S180-Y183 PolarHBondContact O-N 2.89Å; Y183-Q187 HydrophobicContact CD1-CB 4.32Å; Y183-Q187 HydrophobicContact CD1-CG 4.19Å; Y183-Q187 CarbonylContact O-C 3.57Å; Y183-N188 PolarHBondContact O-N 2.82Å; Y183-N188 VanDerWaalsContact O-N 3.16Å; Y183-A189 HydrophobicContact CD1-CB 4.35Å; Y183-A189 PolarHBondContact O-N 2.71Å; Y183-Q192 HydrophobicContact CD1-CB 4.25Å; Y183-Q192 HydrophobicContact CD2-CB 4.31Å; Y183-Q192 HydrophobicContact CG-CB 4.09Å; Y183-L196 HydrophobicContact CD2-CD2 4.08Å; Y183-L196 HydrophobicContact CE2-CD2 4Å
184	Y	98.2	Very high	98	Very high	53 Å²	53	39.3 Å²	39.3	21%	0.208	20%	0.197	C	C	.	.	H	α-helix	trans	-67.3	-61.6	179.7	-164.9	-97.3	0	0	0	112.3	S180 V181 F182 N188 P190 A193 W233 D236	S180-Y184 PolarHBondContact O-N 3.03Å; V181-Y184 PolarHBondContact O-N 3.12Å; F182-Y184 VanDerWaalsContact C-N 3.29Å; F182-Y184 PolarHBondContact O-N 3.4Å; Y184-N188 WeakPolarHBondContact O-CA 3.37Å; Y184-N188 PolarHBondContact O-N 3.44Å; Y184-P190 HydrophobicContact CD2-CB 3.84Å; Y184-P190 HydrophobicContact CE2-CB 3.79Å; Y184-A193 HydrophobicContact CD2-CB 4.31Å; Y184-W233 AromaticContact CD1-CD1 3.74Å; Y184-W233 AromaticContact CD1-CE2 3.93Å; Y184-W233 HydrophobicContact CD1-CG 4.45Å; Y184-W233 HydrophobicContact CD1-CZ2 4.49Å; Y184-W233 AromaticContact CD1-NE1 3.36Å; Y184-W233 HydrophobicContact CD2-CB 4.06Å; Y184-W233 AromaticContact CD2-CD1 3.6Å; Y184-W233 AromaticContact CD2-CD2 3.74Å; Y184-W233 HydrophobicContact CD2-CD2 3.74Å; Y184-W233 AromaticContact CD2-CE2 3.9Å; Y184-W233 HydrophobicContact CD2-CE3 4.45Å; Y184-W233 AromaticContact CD2-CG 3.54Å; Y184-W233 HydrophobicContact CD2-CG 3.54Å; Y184-W233 AromaticContact CD2-NE1 3.8Å; Y184-W233 AromaticContact CE1-CD1 3.41Å; Y184-W233 VanDerWaalsContact CE1-CD1 3.41Å; Y184-W233 HydrophobicContact CE1-CG 4.3Å; Y184-W233 AromaticContact CE1-NE1 3.46Å; Y184-W233 HydrophobicContact CE2-CB 3.62Å; Y184-W233 AromaticContact CE2-CD1 3.3Å; Y184-W233 HydrophobicContact CE2-CD2 4.11Å; Y184-W233 AromaticContact CE2-CG 3.39Å; Y184-W233 HydrophobicContact CE2-CG 3.39Å; Y184-W233 AromaticContact CE2-NE1 3.92Å; Y184-W233 AromaticContact CG-CD1 3.82Å; Y184-W233 HydrophobicContact CG-CD2 4Å; Y184-W233 AromaticContact CG-CE2 3.65Å; Y184-W233 HydrophobicContact CG-CG 4.09Å; Y184-W233 HydrophobicContact CG-CZ2 4.15Å; Y184-W233 AromaticContact CG-NE1 3.53Å; Y184-W233 AromaticContact CZ-CD1 3.18Å; Y184-W233 AromaticContact CZ-CG 3.79Å; Y184-W233 AromaticContact CZ-NE1 3.74Å; Y184-D236 WeakPolarHBondContact OH-CB 3.44Å; Y184-D236 PolarHBondContact OH-OD2 3.15Å
185	E	96.5	Very high	98	Very high	100 Å²	100	45.2 Å²	45.2	47%	0.467	22%	0.222	S	C	.	.	H	α-helix	trans	-79.9	-28.5	-168.1	-63.5	-176.5	164.5	0	0	113.7	R132 V181	R132-E185 IonicContact NH1-OE2 3.38Å; V181-E185 VanDerWaalsContact CG1-CD 3.44Å; V181-E185 HydrophobicContact CG1-CG 3.93Å; V181-E185 WeakPolarHBondContact CG1-OE2 3.27Å; V181-E185 WeakPolarHBondContact O-CB 3.39Å; V181-E185 PolarHBondContact O-N 2.92Å
186	I	97.8	Very high	98	Very high	15 Å²	15	46 Å²	46	8%	0.077	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	-107.7	-47	-172.1	-57.7	-52.7	0	0	0	112.8	R132 A135 E136 R143 V147 F182	R132-I186 HydrophobicContact CG-CD1 4.32Å; R132-I186 HydrophobicContact CG-CG1 3.75Å; A135-I186 HydrophobicContact CB-CD1 4.28Å; A135-I186 HydrophobicContact CB-CG1 4.5Å; A135-I186 HydrophobicContact CB-CG2 3.79Å; E136-I186 HydrophobicContact CB-CD1 4.43Å; R143-I186 PolarHBondContact NH2-O 3.09Å; V147-I186 HydrophobicContact CG1-CG2 4.41Å; V147-I186 HydrophobicContact CG2-CG2 3.6Å; F182-I186 HydrophobicContact CD2-CB 3.81Å; F182-I186 HydrophobicContact CD2-CG1 3.97Å; F182-I186 HydrophobicContact CD2-CG2 4.11Å; F182-I186 HydrophobicContact CE2-CB 3.87Å; F182-I186 HydrophobicContact CE2-CG1 4.36Å; F182-I186 HydrophobicContact CE2-CG2 3.65Å; F182-I186 HydrophobicContact CZ-CG2 4.37Å; F182-I186 WeakPolarHBondContact O-CA 3.48Å; F182-I186 WeakPolarHBondContact O-CB 3.15Å; F182-I186 PolarHBondContact O-N 3.26Å
187	Q	97.3	Very high	97.9	Very high	80 Å²	80	45.9 Å²	45.9	37%	0.374	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.4	-10.2	180	-67	-77.8	19.9	0	0	112.9	V147 F182 Y183 A189	V147-Q187 VanDerWaalsContact CG1-NE2 3.3Å; F182-Q187 HydrophobicContact CD1-CG 4.08Å; F182-Q187 HydrophobicContact CE1-CG 3.31Å; F182-Q187 HydrophobicContact CE2-CG 4.49Å; F182-Q187 HydrophobicContact CZ-CG 3.6Å; F182-Q187 PolarHBondContact O-N 2.9Å; Y183-Q187 HydrophobicContact CD1-CB 4.32Å; Y183-Q187 HydrophobicContact CD1-CG 4.19Å; Y183-Q187 CarbonylContact O-C 3.57Å; Q187-A189 HydrophobicContact CB-CB 3.9Å; Q187-A189 PolarHBondContact O-N 3.42Å
188	N	96.4	Very high	97.9	Very high	141 Å²	141	50.3 Å²	50.3	75%	0.754	24%	0.243	S	C	*	.			trans	52.1	44.6	-173.5	-165.3	52.9	0	0	0	111.6	Y183 Y184 P190	Y183-N188 PolarHBondContact O-N 2.82Å; Y183-N188 VanDerWaalsContact O-N 3.16Å; Y184-N188 WeakPolarHBondContact O-CA 3.37Å; Y184-N188 PolarHBondContact O-N 3.44Å; N188-P190 VanDerWaalsContact O-CD 3.27Å; N188-P190 WeakPolarHBondContact O-CD 3.17Å
189	A	97.5	Very high	97.9	Very high	10 Å²	10	51.4 Å²	51.4	8%	0.083	25%	0.252	C	S	.	.			trans	-120.1	67.7	-172.2	0	0	0	0	0	109.9	Y183 Q187 E191 Q192 A193	Y183-A189 HydrophobicContact CD1-CB 4.35Å; Y183-A189 PolarHBondContact O-N 2.71Å; Q187-A189 HydrophobicContact CB-CB 3.9Å; Q187-A189 PolarHBondContact O-N 3.42Å; A189-E191 VanDerWaalsContact C-N 3.34Å; A189-E191 PolarHBondContact O-N 3.16Å; A189-Q192 HydrophobicContact CB-CB 4.3Å; A189-Q192 PolarHBondContact O-N 3.39Å; A189-A193 PolarHBondContact O-N 3.02Å
190	P	97	Very high	97.9	Very high	37 Å²	37	52 Å²	52	24%	0.24	26%	0.257	C	S	.	.	H	α-helix	trans	-68.2	-31.7	-169.4	29.8	-37.9	0	0	0	112.8	Y184 N188 A193 C194	Y184-P190 HydrophobicContact CD2-CB 3.84Å; Y184-P190 HydrophobicContact CE2-CB 3.79Å; N188-P190 VanDerWaalsContact O-CD 3.27Å; N188-P190 WeakPolarHBondContact O-CD 3.17Å; P190-A193 PolarHBondContact O-N 3.41Å; P190-C194 WeakPolarHBondContact O-CB 3.48Å; P190-C194 PolarHBondContact O-N 3.46Å; P190-C194 PolarHBondContact O-SG 3.41Å; P190-C194 VanDerWaalsContact O-SG 3.37Å
191	E	96.4	Very high	97.8	Very high	150 Å²	150	53.9 Å²	53.9	70%	0.701	27%	0.265	S	S	*	.	H	α-helix	trans	-61.6	-47.6	173.9	-66.3	-176.4	177	0	0	111.7	A189 C194 H195	A189-E191 VanDerWaalsContact C-N 3.34Å; A189-E191 PolarHBondContact O-N 3.16Å; E191-C194 PolarHBondContact O-N 2.99Å; E191-H195 VanDerWaalsContact O-CB 3.26Å; E191-H195 WeakPolarHBondContact O-CB 3.33Å; E191-H195 PolarHBondContact O-N 3.36Å
192	Q	97.7	Very high	97.8	Very high	100 Å²	100	56.3 Å²	56.3	47%	0.467	28%	0.278	S	S	.	.	H	α-helix	trans	-64.6	-40	176.4	-67	92.6	-38.8	0	0	111.7	Y183 A189 H195 L196	Y183-Q192 HydrophobicContact CD1-CB 4.25Å; Y183-Q192 HydrophobicContact CD2-CB 4.31Å; Y183-Q192 HydrophobicContact CG-CB 4.09Å; A189-Q192 HydrophobicContact CB-CB 4.3Å; A189-Q192 PolarHBondContact O-N 3.39Å; Q192-H195 PolarHBondContact O-N 2.96Å; Q192-L196 WeakPolarHBondContact O-CB 3.36Å; Q192-L196 PolarHBondContact O-N 3.5Å
193	A	98.2	Very high	97.8	Very high	0 Å²	0	59.4 Å²	59.4	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-59.7	-51.5	176.2	0	0	0	0	0	111.5	S180 Y184 A189 P190 L196 A197 W233	S180-A193 WeakPolarHBondContact CB-O 3.41Å; S180-A193 VanDerWaalsContact O-CB 3.27Å; S180-A193 WeakPolarHBondContact O-CB 3.28Å; Y184-A193 HydrophobicContact CD2-CB 4.31Å; A189-A193 PolarHBondContact O-N 3.02Å; P190-A193 PolarHBondContact O-N 3.41Å; A193-L196 PolarHBondContact O-N 2.85Å; A193-A197 WeakPolarHBondContact O-CB 3.42Å; A193-A197 PolarHBondContact O-N 2.97Å; A193-W233 HydrophobicContact CB-CE3 4.23Å; A193-W233 HydrophobicContact CB-CZ3 4.09Å
194	C	98.1	Very high	97.7	Very high	16 Å²	16	57.5 Å²	57.5	11%	0.108	29%	0.287	C	S	.	.	H	α-helix	trans	-64.2	-42.5	178.4	-73.2	0	0	0	0	111.8	P190 E191 K198 L230	P190-C194 WeakPolarHBondContact O-CB 3.48Å; P190-C194 PolarHBondContact O-N 3.46Å; P190-C194 PolarHBondContact O-SG 3.41Å; P190-C194 VanDerWaalsContact O-SG 3.37Å; E191-C194 PolarHBondContact O-N 2.99Å; C194-K198 WeakPolarHBondContact O-CB 3.38Å; C194-K198 PolarHBondContact O-N 3.27Å; C194-L230 HydrophobicContact CB-CD2 4.18Å; C194-L230 WeakPolarHBondContact O-CD2 3.38Å
195	H	98	Very high	97.6	Very high	133 Å²	133	59 Å²	59	62%	0.616	30%	0.297	S	S	*	.	H	α-helix	trans	-59	-50.8	177.1	-178.7	66	0	0	0	111.3	E191 Q192 K198 T199	E191-H195 VanDerWaalsContact O-CB 3.26Å; E191-H195 WeakPolarHBondContact O-CB 3.33Å; E191-H195 PolarHBondContact O-N 3.36Å; Q192-H195 PolarHBondContact O-N 2.96Å; H195-K198 PolarHBondContact O-N 3.23Å; H195-T199 WeakPolarHBondContact O-CB 3.21Å; H195-T199 PolarHBondContact O-N 2.9Å; H195-T199 PolarHBondContact O-OG1 3.14Å; H195-T199 VanDerWaalsContact O-OG1 3.12Å
196	L	98.5	Very high	97.6	Very high	17 Å²	17	58.2 Å²	58.2	9%	0.089	31%	0.309	C	S	.	.	H	α-helix	trans	-62.2	-47.6	-179.9	178.6	62.8	0	0	0	112.3	Y179 Y183 Q192 A193 A200	Y179-L196 HydrophobicContact CD1-CD2 3.5Å; Y179-L196 HydrophobicContact CE1-CD2 4.31Å; Y179-L196 HydrophobicContact CG-CD2 3.66Å; Y183-L196 HydrophobicContact CD2-CD2 4.08Å; Y183-L196 HydrophobicContact CE2-CD2 4Å; Q192-L196 WeakPolarHBondContact O-CB 3.36Å; Q192-L196 PolarHBondContact O-N 3.5Å; A193-L196 PolarHBondContact O-N 2.85Å; L196-A200 WeakPolarHBondContact O-CB 3.34Å; L196-A200 PolarHBondContact O-N 3.32Å
197	A	98.4	Very high	97.5	Very high	0 Å²	0	61.1 Å²	61.1	0%	0	32%	0.322	C	S	.	.	H	α-helix	trans	-64.4	-41.2	-180	0	0	0	0	0	111.8	A193 A200 F201 L226 L230 W233	A193-A197 WeakPolarHBondContact O-CB 3.42Å; A193-A197 PolarHBondContact O-N 2.97Å; A197-A200 PolarHBondContact O-N 3.36Å; A197-F201 WeakPolarHBondContact O-CB 3.4Å; A197-F201 PolarHBondContact O-N 3Å; A197-L226 HydrophobicContact CB-CD2 3.86Å; A197-L230 HydrophobicContact CB-CD1 4.33Å; A197-L230 HydrophobicContact CB-CD2 3.82Å; A197-L230 HydrophobicContact CB-CG 3.93Å; A197-W233 HydrophobicContact CB-CZ3 4.25Å
198	K	98.1	Very high	97.3	Very high	112 Å²	112	59.1 Å²	59.1	49%	0.487	31%	0.313	S	S	.	.	H	α-helix	trans	-66.5	-46.8	178.5	-176.9	167.8	-175.9	-61.6	0	111.7	C194 H195 A200 F201 D202 L230	C194-K198 WeakPolarHBondContact O-CB 3.38Å; C194-K198 PolarHBondContact O-N 3.27Å; H195-K198 PolarHBondContact O-N 3.23Å; K198-A200 VanDerWaalsContact C-N 3.33Å; K198-A200 PolarHBondContact O-N 3.12Å; K198-F201 PolarHBondContact O-N 2.77Å; K198-D202 WeakPolarHBondContact CG-OD2 3.49Å; K198-D202 IonicContact NZ-OD2 3.94Å; K198-D202 PolarHBondContact NZ-OD2 2.92Å; K198-D202 WeakPolarHBondContact O-CB 3.46Å; K198-D202 VanDerWaalsContact O-CG 3.25Å; K198-D202 PolarHBondContact O-N 3.28Å; K198-L230 HydrophobicContact CB-CD1 4.18Å; K198-L230 HydrophobicContact CB-CD2 4.06Å
199	T	98.5	Very high	97	Very high	54 Å²	54	60.5 Å²	60.5	33%	0.331	32%	0.321	S	S	.	.	H	α-helix	trans	-58.3	-46.3	175.5	-65.9	0	0	0	0	111.2	H195 F201 D202 D203	H195-T199 WeakPolarHBondContact O-CB 3.21Å; H195-T199 PolarHBondContact O-N 2.9Å; H195-T199 PolarHBondContact O-OG1 3.14Å; H195-T199 VanDerWaalsContact O-OG1 3.12Å; T199-F201 VanDerWaalsContact C-N 3.33Å; T199-F201 PolarHBondContact O-N 2.76Å; T199-D202 PolarHBondContact O-N 2.98Å; T199-D203 VanDerWaalsContact O-CB 3.3Å; T199-D203 WeakPolarHBondContact O-CB 3.35Å; T199-D203 PolarHBondContact O-N 3.43Å
200	A	98.4	Very high	96.6	Very high	16 Å²	16	64 Å²	64	13%	0.132	34%	0.341	C	S	.	.	H	α-helix	trans	-63.6	-38.7	179.2	0	0	0	0	0	112.8	A176 L196 A197 K198 A204 L226	A176-A200 HydrophobicContact CB-CB 3.41Å; A176-A200 VanDerWaalsContact CB-CB 3.41Å; L196-A200 WeakPolarHBondContact O-CB 3.34Å; L196-A200 PolarHBondContact O-N 3.32Å; A197-A200 PolarHBondContact O-N 3.36Å; K198-A200 VanDerWaalsContact C-N 3.33Å; K198-A200 PolarHBondContact O-N 3.12Å; A200-A204 VanDerWaalsContact O-CB 3.27Å; A200-A204 WeakPolarHBondContact O-CB 3.34Å; A200-A204 PolarHBondContact O-N 2.88Å; A200-A204 VanDerWaalsContact O-N 3.14Å; A200-L226 HydrophobicContact CB-CD1 4.32Å
201	F	98.1	Very high	96.2	Very high	40 Å²	40	63.4 Å²	63.4	18%	0.175	34%	0.336	C	S	.	.	H	α-helix	trans	-67.7	-49.3	176.2	-175.9	-91	0	0	0	111.9	A197 K198 T199 A204 I205 M223 L226 R227	A197-F201 WeakPolarHBondContact O-CB 3.4Å; A197-F201 PolarHBondContact O-N 3Å; K198-F201 PolarHBondContact O-N 2.77Å; T199-F201 VanDerWaalsContact C-N 3.33Å; T199-F201 PolarHBondContact O-N 2.76Å; F201-A204 PolarHBondContact O-N 2.92Å; F201-I205 HydrophobicContact CD1-CG1 3.92Å; F201-I205 HydrophobicContact CE1-CD1 4.12Å; F201-I205 HydrophobicContact CE1-CG1 3.55Å; F201-I205 HydrophobicContact CE2-CD1 4.5Å; F201-I205 HydrophobicContact CE2-CG1 4.38Å; F201-I205 HydrophobicContact CG-CG1 4.49Å; F201-I205 HydrophobicContact CZ-CD1 3.9Å; F201-I205 HydrophobicContact CZ-CG1 3.8Å; F201-I205 WeakPolarHBondContact O-CB 3.47Å; F201-I205 VanDerWaalsContact O-CG1 3.29Å; F201-I205 WeakPolarHBondContact O-CG1 3.37Å; F201-I205 PolarHBondContact O-N 3.39Å; F201-M223 HydrophobicContact CD2-CB 4.14Å; F201-M223 WeakPolarHBondContact CD2-O 3.45Å; F201-M223 HydrophobicContact CE2-CB 4.09Å; F201-M223 WeakPolarHBondContact CE2-O 3.46Å; F201-L226 HydrophobicContact CD2-CB 4.44Å; F201-R227 HydrophobicContact CD2-CB 4.3Å; F201-R227 HydrophobicContact CE2-CB 3.88Å; F201-R227 HydrophobicContact CE2-CG 4.46Å; F201-R227 HydrophobicContact CZ-CB 4.38Å; F201-R227 HydrophobicContact CZ-CG 4.47Å
202	D	98.1	Very high	95.7	Very high	70 Å²	70	60.3 Å²	60.3	37%	0.374	32%	0.324	S	S	.	.	H	α-helix	trans	-62	-44.9	-179.1	-70.2	-15.2	0	0	0	110.8	K198 T199 A204 I205 A206	K198-D202 WeakPolarHBondContact CG-OD2 3.49Å; K198-D202 IonicContact NZ-OD2 3.94Å; K198-D202 PolarHBondContact NZ-OD2 2.92Å; K198-D202 WeakPolarHBondContact O-CB 3.46Å; K198-D202 VanDerWaalsContact O-CG 3.25Å; K198-D202 PolarHBondContact O-N 3.28Å; T199-D202 PolarHBondContact O-N 2.98Å; D202-A204 PolarHBondContact O-N 2.69Å; D202-I205 PolarHBondContact O-N 2.85Å; D202-A206 PolarHBondContact O-N 3.46Å
203	D	97.8	Very high	95.2	Very high	64 Å²	64	64.3 Å²	64.3	34%	0.342	34%	0.343	S	S	.	.	H	α-helix	trans	-62.2	-42.8	176.7	-68.7	-11.3	0	0	0	111.6	P167 R172 T199 A206 E207	P167-D203 HydrophobicContact CB-CB 3.85Å; P167-D203 HydrophobicContact CG-CB 4.26Å; R172-D203 IonicContact NH2-OD2 3.96Å; T199-D203 VanDerWaalsContact O-CB 3.3Å; T199-D203 WeakPolarHBondContact O-CB 3.35Å; T199-D203 PolarHBondContact O-N 3.43Å; D203-A206 PolarHBondContact O-N 3.46Å; D203-E207 PolarHBondContact O-N 2.9Å
204	A	97.2	Very high	94.7	Very high	0 Å²	0	71.5 Å²	71.5	0%	0	38%	0.381	C	S	.	.	H	α-helix	trans	-70.9	-35.5	179.3	0	0	0	0	0	112.8	T168 L173 A200 F201 D202 A206 E207 L208 M223	T168-A204 HydrophobicContact CG2-CB 4.43Å; T168-A204 WeakPolarHBondContact CG2-O 3.29Å; L173-A204 HydrophobicContact CD1-CB 4.45Å; L173-A204 HydrophobicContact CD2-CB 3.65Å; A200-A204 VanDerWaalsContact O-CB 3.27Å; A200-A204 WeakPolarHBondContact O-CB 3.34Å; A200-A204 PolarHBondContact O-N 2.88Å; A200-A204 VanDerWaalsContact O-N 3.14Å; F201-A204 PolarHBondContact O-N 2.92Å; D202-A204 PolarHBondContact O-N 2.69Å; A204-A206 VanDerWaalsContact C-N 3.33Å; A204-E207 PolarHBondContact O-N 3.47Å; A204-L208 WeakPolarHBondContact O-CA 3.34Å; A204-L208 PolarHBondContact O-N 2.98Å; A204-M223 HydrophobicContact CB-CE 3.77Å; A204-M223 HydrophobicContact CB-CG 4.23Å; A204-M223 HydrophobicContact CB-SD 3.9Å
205	I	96.6	Very high	94.4	Very high	83 Å²	83	72.2 Å²	72.2	43%	0.426	39%	0.387	S	S	.	.	H	α-helix	trans	-62.9	-42.1	173.4	-74.7	-70.3	0	0	0	110.7	F201 D202 E207 L208 M223	F201-I205 HydrophobicContact CD1-CG1 3.92Å; F201-I205 HydrophobicContact CE1-CD1 4.12Å; F201-I205 HydrophobicContact CE1-CG1 3.55Å; F201-I205 HydrophobicContact CE2-CD1 4.5Å; F201-I205 HydrophobicContact CE2-CG1 4.38Å; F201-I205 HydrophobicContact CG-CG1 4.49Å; F201-I205 HydrophobicContact CZ-CD1 3.9Å; F201-I205 HydrophobicContact CZ-CG1 3.8Å; F201-I205 WeakPolarHBondContact O-CB 3.47Å; F201-I205 VanDerWaalsContact O-CG1 3.29Å; F201-I205 WeakPolarHBondContact O-CG1 3.37Å; F201-I205 PolarHBondContact O-N 3.39Å; D202-I205 PolarHBondContact O-N 2.85Å; I205-E207 PolarHBondContact O-N 2.74Å; I205-L208 HydrophobicContact CD1-CD2 4.44Å; I205-L208 PolarHBondContact O-N 3.16Å; I205-M223 HydrophobicContact CB-CE 4.43Å; I205-M223 HydrophobicContact CD1-CE 3.43Å; I205-M223 VanDerWaalsContact CD1-CE 3.43Å; I205-M223 HydrophobicContact CG1-CE 3.6Å
206	A	96.6	Very high	94.1	Very high	85 Å²	85	71.7 Å²	71.7	70%	0.702	38%	0.38	S	S	*	.	H	α-helix	trans	-62.7	-27.5	-179.6	0	0	0	0	0	113.4	D202 D203 A204	D202-A206 PolarHBondContact O-N 3.46Å; D203-A206 PolarHBondContact O-N 3.46Å; A204-A206 VanDerWaalsContact C-N 3.33Å
207	E	95.4	Very high	93.9	Very high	76 Å²	76	78.6 Å²	78.6	36%	0.355	41%	0.409	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110.6	9.4	-179.3	-67.1	-169.9	-154.8	0	0	113.7	P167 T168 D203 A204 I205 D209 T210	P167-E207 WeakPolarHBondContact CD-OE2 3.45Å; T168-E207 HydrophobicContact CG2-CB 3.95Å; D203-E207 PolarHBondContact O-N 2.9Å; A204-E207 PolarHBondContact O-N 3.47Å; I205-E207 PolarHBondContact O-N 2.74Å; E207-D209 PolarHBondContact O-N 3Å; E207-D209 VanDerWaalsContact O-N 3.17Å; E207-T210 WeakPolarHBondContact O-CB 3.27Å; E207-T210 PolarHBondContact O-N 3.3Å; E207-T210 PolarHBondContact O-OG1 2.86Å
208	L	92.3	Very high	93.7	Very high	38 Å²	38	82.8 Å²	82.8	20%	0.199	43%	0.432	C	S	.	.	G	3₁₀ helix	trans	-59.5	-34	-172.4	-171.7	62.5	0	0	0	113.1	A204 I205 T210 L211 T220 M223	A204-L208 WeakPolarHBondContact O-CA 3.34Å; A204-L208 PolarHBondContact O-N 2.98Å; I205-L208 HydrophobicContact CD1-CD2 4.44Å; I205-L208 PolarHBondContact O-N 3.16Å; L208-T210 PolarHBondContact O-N 3.4Å; L208-L211 HydrophobicContact CD1-CD2 3.95Å; L208-L211 VanDerWaalsContact O-CB 3.22Å; L208-L211 WeakPolarHBondContact O-CB 3.36Å; L208-L211 PolarHBondContact O-N 3.34Å; L208-L211 VanDerWaalsContact O-N 3.16Å; L208-T220 HydrophobicContact CD1-CG2 4.24Å; L208-M223 HydrophobicContact CD1-CE 4.27Å; L208-M223 HydrophobicContact CD1-SD 3.99Å
209	D	91.2	Very high	93.7	Very high	170 Å²	170	77.5 Å²	77.5	91%	0.909	41%	0.409	S	S	*	.	G	3₁₀ helix	trans	-65.9	-14.9	178.4	-67.9	-23.9	0	0	0	113.4	E207	E207-D209 PolarHBondContact O-N 3Å; E207-D209 VanDerWaalsContact O-N 3.17Å
210	T	87.8	Confident	93.6	Very high	84 Å²	84	77 Å²	77	52%	0.515	41%	0.406	S	S	.	.	G	3₁₀ helix	trans	-88.6	-7.9	178.3	71.9	0	0	0	0	113.3	E207 L208	E207-T210 WeakPolarHBondContact O-CB 3.27Å; E207-T210 PolarHBondContact O-N 3.3Å; E207-T210 PolarHBondContact O-OG1 2.86Å; L208-T210 PolarHBondContact O-N 3.4Å
211	L	88	Confident	93.5	Very high	23 Å²	23	81 Å²	81	12%	0.12	43%	0.425	C	S	.	.			trans	-73	131.8	-171.2	-170.5	56.3	0	0	0	111.6	L208 Y216	L208-L211 HydrophobicContact CD1-CD2 3.95Å; L208-L211 VanDerWaalsContact O-CB 3.22Å; L208-L211 WeakPolarHBondContact O-CB 3.36Å; L208-L211 PolarHBondContact O-N 3.34Å; L208-L211 VanDerWaalsContact O-N 3.16Å; L211-Y216 HydrophobicContact CB-CD2 4.44Å; L211-Y216 HydrophobicContact CD2-CD2 3.94Å; L211-Y216 HydrophobicContact CD2-CG 4.43Å; L211-Y216 HydrophobicContact CG-CD2 4.29Å
212	N	87.6	Confident	93.5	Very high	86 Å²	86	80.5 Å²	80.5	46%	0.46	42%	0.423	S	S	.	.			trans	-73.3	157.7	175.5	63.1	49	0	0	0	112.1	D214 S215 Y216	N212-D214 VanDerWaalsContact C-N 3.26Å; N212-D214 PolarHBondContact O-N 3.05Å; N212-D214 PolarHBondContact OD1-N 3.3Å; N212-S215 PolarHBondContact O-N 3.36Å; N212-S215 VanDerWaalsContact OD1-CB 3.32Å; N212-S215 WeakPolarHBondContact OD1-CB 3.49Å; N212-S215 PolarHBondContact OD1-N 3.07Å; N212-S215 PolarHBondContact OD1-OG 3.32Å; N212-S215 VanDerWaalsContact OD1-OG 3.1Å; N212-Y216 WeakPolarHBondContact O-CB 3.36Å; N212-Y216 PolarHBondContact O-N 3Å; N212-Y216 VanDerWaalsContact O-N 3.1Å
213	E	87.3	Confident	93.5	Very high	183 Å²	183	77.5 Å²	77.5	86%	0.855	41%	0.407	S	S	*	.	H	α-helix	trans	-59.4	-36	-178.7	-67.7	-175.3	175.3	0	0	112.8	S215 Y216	E213-S215 PolarHBondContact O-N 3.27Å; E213-Y216 PolarHBondContact O-N 3.49Å
214	D	87.7	Confident	93.5	Very high	152 Å²	152	77.5 Å²	77.5	81%	0.813	41%	0.405	S	S	*	.	H	α-helix	trans	-65.1	-36.4	-176.5	-66.4	-28.7	0	0	0	112.8	N212	N212-D214 VanDerWaalsContact C-N 3.26Å; N212-D214 PolarHBondContact O-N 3.05Å; N212-D214 PolarHBondContact OD1-N 3.3Å
215	S	90.3	Very high	93.6	Very high	31 Å²	31	81 Å²	81	22%	0.217	42%	0.424	C	S	.	.	H	α-helix	trans	-96.4	-12.8	-178.9	-55.9	0	0	0	0	113.3	N212 E213 K217 D218 S219	N212-S215 PolarHBondContact O-N 3.36Å; N212-S215 VanDerWaalsContact OD1-CB 3.32Å; N212-S215 WeakPolarHBondContact OD1-CB 3.49Å; N212-S215 PolarHBondContact OD1-N 3.07Å; N212-S215 PolarHBondContact OD1-OG 3.32Å; N212-S215 VanDerWaalsContact OD1-OG 3.1Å; E213-S215 PolarHBondContact O-N 3.27Å; S215-K217 VanDerWaalsContact C-N 3.34Å; S215-K217 PolarHBondContact O-N 3.49Å; S215-D218 PolarHBondContact O-N 3.29Å; S215-S219 PolarHBondContact O-N 3.01Å; S215-S219 PolarHBondContact O-OG 3.05Å
216	Y	92.2	Very high	93.7	Very high	121 Å²	121	77.1 Å²	77.1	48%	0.475	40%	0.403	S	S	.	.	H	α-helix	trans	-53.5	-48.5	-171.5	-170.7	-89.9	0	0	0	112.9	L211 N212 E213 T220	L211-Y216 HydrophobicContact CB-CD2 4.44Å; L211-Y216 HydrophobicContact CD2-CD2 3.94Å; L211-Y216 HydrophobicContact CD2-CG 4.43Å; L211-Y216 HydrophobicContact CG-CD2 4.29Å; N212-Y216 WeakPolarHBondContact O-CB 3.36Å; N212-Y216 PolarHBondContact O-N 3Å; N212-Y216 VanDerWaalsContact O-N 3.1Å; E213-Y216 PolarHBondContact O-N 3.49Å; Y216-T220 HydrophobicContact CD1-CG2 4.17Å; Y216-T220 HydrophobicContact CE1-CG2 3.85Å; Y216-T220 HydrophobicContact CE2-CG2 4.27Å; Y216-T220 WeakPolarHBondContact O-CB 3.32Å; Y216-T220 VanDerWaalsContact O-CG2 3.26Å; Y216-T220 WeakPolarHBondContact O-CG2 3.22Å; Y216-T220 PolarHBondContact O-N 3.05Å; Y216-T220 PolarHBondContact O-OG1 2.91Å
217	K	94.4	Very high	93.8	Very high	163 Å²	163	78.6 Å²	78.6	71%	0.709	39%	0.391	S	S	*	.	H	α-helix	trans	-64.3	-43.4	-177.8	-175.7	-177.3	175	-172.8	0	112.4	S215 T220 L221	S215-K217 VanDerWaalsContact C-N 3.34Å; S215-K217 PolarHBondContact O-N 3.49Å; K217-T220 PolarHBondContact O-OG1 3.4Å; K217-L221 WeakPolarHBondContact O-CB 3.39Å; K217-L221 PolarHBondContact O-N 2.81Å; K217-L221 VanDerWaalsContact O-N 3.16Å
218	D	94.9	Very high	93.9	Very high	88 Å²	88	78.2 Å²	78.2	47%	0.471	39%	0.391	S	S	.	.	H	α-helix	trans	-72.8	-44.9	-176.2	-71.9	-14.9	0	0	0	111	P170 S215 L221 I222	P170-D218 HydrophobicContact CB-CB 4.2Å; P170-D218 HydrophobicContact CG-CB 4.18Å; S215-D218 PolarHBondContact O-N 3.29Å; D218-L221 PolarHBondContact O-N 3.1Å; D218-I222 WeakPolarHBondContact O-CD1 3.26Å; D218-I222 VanDerWaalsContact O-CG1 3.25Å; D218-I222 WeakPolarHBondContact O-CG1 3.1Å; D218-I222 PolarHBondContact O-N 3.48Å
219	S	96.5	Very high	94.1	Very high	0 Å²	0	78 Å²	78	0%	0	39%	0.39	C	S	.	.	H	α-helix	trans	-63.6	-45.8	178.3	-60	0	0	0	0	112.1	T168 P170 S215 L221 I222 M223	T168-S219 WeakPolarHBondContact O-CB 3.36Å; T168-S219 PolarHBondContact O-OG 3.46Å; P170-S219 WeakPolarHBondContact CD-OG 3.25Å; P170-S219 WeakPolarHBondContact CG-OG 3.38Å; S215-S219 PolarHBondContact O-N 3.01Å; S215-S219 PolarHBondContact O-OG 3.05Å; S219-L221 VanDerWaalsContact C-N 3.33Å; S219-L221 PolarHBondContact O-N 2.76Å; S219-I222 PolarHBondContact O-N 3.26Å; S219-I222 VanDerWaalsContact O-N 3.15Å; S219-M223 VanDerWaalsContact O-CG 3.25Å; S219-M223 WeakPolarHBondContact O-CG 3.27Å; S219-M223 PolarHBondContact O-N 3.15Å
220	T	96.7	Very high	94.4	Very high	44 Å²	44	71.1 Å²	71.1	27%	0.27	35%	0.353	S	S	.	.	H	α-helix	trans	-65.2	-36.3	180	52.8	0	0	0	0	112.2	L208 Y216 K217 M223 Q224	L208-T220 HydrophobicContact CD1-CG2 4.24Å; Y216-T220 HydrophobicContact CD1-CG2 4.17Å; Y216-T220 HydrophobicContact CE1-CG2 3.85Å; Y216-T220 HydrophobicContact CE2-CG2 4.27Å; Y216-T220 WeakPolarHBondContact O-CB 3.32Å; Y216-T220 VanDerWaalsContact O-CG2 3.26Å; Y216-T220 WeakPolarHBondContact O-CG2 3.22Å; Y216-T220 PolarHBondContact O-N 3.05Å; Y216-T220 PolarHBondContact O-OG1 2.91Å; K217-T220 PolarHBondContact O-OG1 3.4Å; T220-M223 PolarHBondContact O-N 2.71Å; T220-Q224 WeakPolarHBondContact O-CB 3.37Å; T220-Q224 PolarHBondContact O-N 3.06Å
221	L	97.5	Very high	94.8	Very high	101 Å²	101	71.2 Å²	71.2	53%	0.529	35%	0.354	S	S	.	.	H	α-helix	trans	-61.8	-43.1	171.9	178.3	62.4	0	0	0	111.7	K217 D218 S219 Q224 L225	K217-L221 WeakPolarHBondContact O-CB 3.39Å; K217-L221 PolarHBondContact O-N 2.81Å; K217-L221 VanDerWaalsContact O-N 3.16Å; D218-L221 PolarHBondContact O-N 3.1Å; S219-L221 VanDerWaalsContact C-N 3.33Å; S219-L221 PolarHBondContact O-N 2.76Å; L221-Q224 WeakPolarHBondContact O-CB 3.27Å; L221-Q224 PolarHBondContact O-N 3.22Å; L221-L225 WeakPolarHBondContact O-CG 3.5Å; L221-L225 PolarHBondContact O-N 3.36Å; L221-L225 VanDerWaalsContact O-N 3.13Å
222	I	98.1	Very high	95.1	Very high	28 Å²	28	74.4 Å²	74.4	14%	0.144	37%	0.371	C	S	.	.	H	α-helix	trans	-69.6	-40.3	178.9	-62	163.6	0	0	0	111.2	P170 L173 L177 D218 S219 Q224 L225 L226	P170-I222 HydrophobicContact CB-CD1 4.19Å; P170-I222 VanDerWaalsContact O-CD1 3.32Å; P170-I222 WeakPolarHBondContact O-CD1 3.49Å; L173-I222 HydrophobicContact CB-CB 4.17Å; L173-I222 HydrophobicContact CB-CD1 4.49Å; L173-I222 HydrophobicContact CB-CG2 3.61Å; L177-I222 HydrophobicContact CB-CG2 4.26Å; L177-I222 HydrophobicContact CD2-CG2 4.17Å; D218-I222 WeakPolarHBondContact O-CD1 3.26Å; D218-I222 VanDerWaalsContact O-CG1 3.25Å; D218-I222 WeakPolarHBondContact O-CG1 3.1Å; D218-I222 PolarHBondContact O-N 3.48Å; S219-I222 PolarHBondContact O-N 3.26Å; S219-I222 VanDerWaalsContact O-N 3.15Å; I222-Q224 VanDerWaalsContact C-N 3.27Å; I222-Q224 PolarHBondContact O-N 3.2Å; I222-L225 WeakPolarHBondContact O-CB 3.45Å; I222-L225 PolarHBondContact O-N 3.21Å; I222-L225 VanDerWaalsContact O-N 3.16Å; I222-L226 HydrophobicContact CG2-CD1 4.49Å; I222-L226 PolarHBondContact O-N 3.34Å
223	M	98.1	Very high	95.5	Very high	7 Å²	7	70.7 Å²	70.7	3%	0.034	35%	0.35	C	S	.	.	H	α-helix	trans	-60.2	-39.3	174.3	-69.7	169.4	72.7	0	0	111.6	L173 F201 A204 I205 L208 S219 T220 L226 R227	L173-M223 HydrophobicContact CD1-CG 3.93Å; L173-M223 HydrophobicContact CD1-SD 4.36Å; L173-M223 HydrophobicContact CD2-CG 4.13Å; F201-M223 HydrophobicContact CD2-CB 4.14Å; F201-M223 WeakPolarHBondContact CD2-O 3.45Å; F201-M223 HydrophobicContact CE2-CB 4.09Å; F201-M223 WeakPolarHBondContact CE2-O 3.46Å; A204-M223 HydrophobicContact CB-CE 3.77Å; A204-M223 HydrophobicContact CB-CG 4.23Å; A204-M223 HydrophobicContact CB-SD 3.9Å; I205-M223 HydrophobicContact CB-CE 4.43Å; I205-M223 HydrophobicContact CD1-CE 3.43Å; I205-M223 VanDerWaalsContact CD1-CE 3.43Å; I205-M223 HydrophobicContact CG1-CE 3.6Å; L208-M223 HydrophobicContact CD1-CE 4.27Å; L208-M223 HydrophobicContact CD1-SD 3.99Å; S219-M223 VanDerWaalsContact O-CG 3.25Å; S219-M223 WeakPolarHBondContact O-CG 3.27Å; S219-M223 PolarHBondContact O-N 3.15Å; T220-M223 PolarHBondContact O-N 2.71Å; M223-L226 WeakPolarHBondContact O-CB 3.49Å; M223-L226 PolarHBondContact O-N 3.46Å; M223-R227 PolarHBondContact O-N 2.64Å
224	Q	98.1	Very high	95.7	Very high	64 Å²	64	64.5 Å²	64.5	30%	0.299	33%	0.325	S	S	.	.	H	α-helix	trans	-59.8	-46.3	173.4	176	56.6	39.6	0	0	111.5	T220 L221 I222 L226 R227 D228	T220-Q224 WeakPolarHBondContact O-CB 3.37Å; T220-Q224 PolarHBondContact O-N 3.06Å; L221-Q224 WeakPolarHBondContact O-CB 3.27Å; L221-Q224 PolarHBondContact O-N 3.22Å; I222-Q224 VanDerWaalsContact C-N 3.27Å; I222-Q224 PolarHBondContact O-N 3.2Å; Q224-L226 PolarHBondContact O-N 2.9Å; Q224-R227 WeakPolarHBondContact O-CB 3.48Å; Q224-R227 PolarHBondContact O-N 3.17Å; Q224-D228 PolarHBondContact NE2-OD1 3.43Å; Q224-D228 PolarHBondContact NE2-OD2 2.73Å; Q224-D228 PolarHBondContact O-N 3.37Å
225	L	98.5	Very high	95.7	Very high	75 Å²	75	59.5 Å²	59.5	39%	0.393	30%	0.302	S	S	.	.	H	α-helix	trans	-63.5	-39.4	176.7	-66.1	171.5	0	0	0	112.7	L177 L221 I222 D228 N229	L177-L225 HydrophobicContact CD1-CB 4.05Å; L177-L225 HydrophobicContact CD2-CB 3.92Å; L177-L225 HydrophobicContact CD2-CD1 3.88Å; L221-L225 WeakPolarHBondContact O-CG 3.5Å; L221-L225 PolarHBondContact O-N 3.36Å; L221-L225 VanDerWaalsContact O-N 3.13Å; I222-L225 WeakPolarHBondContact O-CB 3.45Å; I222-L225 PolarHBondContact O-N 3.21Å; I222-L225 VanDerWaalsContact O-N 3.16Å; L225-D228 PolarHBondContact O-N 3.23Å; L225-N229 PolarHBondContact O-N 2.84Å
226	L	98.5	Very high	95.3	Very high	0 Å²	0	60.7 Å²	60.7	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-59.5	-46.4	173.9	-78.7	167.4	0	0	0	111.3	L173 L177 A197 A200 F201 I222 M223 Q224 D228 N229 L230	L173-L226 HydrophobicContact CD2-CD1 4.03Å; L177-L226 HydrophobicContact CB-CD2 3.94Å; L177-L226 HydrophobicContact CB-CG 4.22Å; L177-L226 HydrophobicContact CD1-CD2 4.01Å; L177-L226 HydrophobicContact CD1-CG 4.19Å; A197-L226 HydrophobicContact CB-CD2 3.86Å; A200-L226 HydrophobicContact CB-CD1 4.32Å; F201-L226 HydrophobicContact CD2-CB 4.44Å; I222-L226 HydrophobicContact CG2-CD1 4.49Å; I222-L226 PolarHBondContact O-N 3.34Å; M223-L226 WeakPolarHBondContact O-CB 3.49Å; M223-L226 PolarHBondContact O-N 3.46Å; Q224-L226 PolarHBondContact O-N 2.9Å; L226-D228 PolarHBondContact O-N 3.21Å; L226-N229 PolarHBondContact O-N 3.34Å; L226-L230 WeakPolarHBondContact O-CG 3.38Å; L226-L230 PolarHBondContact O-N 3.41Å
227	R	97.8	Very high	94.6	Very high	116 Å²	116	57.9 Å²	57.9	44%	0.438	30%	0.297	S	S	.	.	H	α-helix	trans	-62.5	-41.6	177.3	-170.2	-171.1	74.4	-164.5	3.9	112.3	F201 M223 Q224 L230 T231	F201-R227 HydrophobicContact CD2-CB 4.3Å; F201-R227 HydrophobicContact CE2-CB 3.88Å; F201-R227 HydrophobicContact CE2-CG 4.46Å; F201-R227 HydrophobicContact CZ-CB 4.38Å; F201-R227 HydrophobicContact CZ-CG 4.47Å; M223-R227 PolarHBondContact O-N 2.64Å; Q224-R227 WeakPolarHBondContact O-CB 3.48Å; Q224-R227 PolarHBondContact O-N 3.17Å; R227-L230 PolarHBondContact O-N 2.96Å; R227-T231 PolarHBondContact O-N 3.09Å; R227-T231 PolarHBondContact O-OG1 3.25Å
228	D	98	Very high	93.5	Very high	68 Å²	68	56.7 Å²	56.7	36%	0.364	29%	0.294	S	S	.	.	H	α-helix	trans	-66.4	-40.9	-179.8	-65.1	-14	0	0	0	110.9	Q224 L225 L226 T231 L232	Q224-D228 PolarHBondContact NE2-OD1 3.43Å; Q224-D228 PolarHBondContact NE2-OD2 2.73Å; Q224-D228 PolarHBondContact O-N 3.37Å; L225-D228 PolarHBondContact O-N 3.23Å; L226-D228 PolarHBondContact O-N 3.21Å; D228-T231 PolarHBondContact O-N 3.02Å; D228-L232 PolarHBondContact O-N 3.36Å
229	N	97.1	Very high	92.4	Very high	35 Å²	35	58.4 Å²	58.4	19%	0.187	30%	0.303	C	S	.	.	H	α-helix	trans	-61.7	-46.4	172.4	-79.1	0.1	0	0	0	112.3	L177 L225 L226 T231 L232 W233	L177-N229 VanDerWaalsContact CD1-ND2 3.31Å; L177-N229 WeakPolarHBondContact CD1-ND2 3.39Å; L225-N229 PolarHBondContact O-N 2.84Å; L226-N229 PolarHBondContact O-N 3.34Å; N229-T231 VanDerWaalsContact C-N 3.26Å; N229-T231 PolarHBondContact O-N 3.45Å; N229-L232 PolarHBondContact O-N 3.09Å; N229-W233 HydrophobicContact CB-CD2 4.2Å; N229-W233 HydrophobicContact CB-CE3 4.09Å; N229-W233 HydrophobicContact CB-CH2 3.67Å; N229-W233 HydrophobicContact CB-CZ2 3.77Å; N229-W233 HydrophobicContact CB-CZ3 3.82Å; N229-W233 WeakPolarHBondContact O-CB 3.21Å; N229-W233 VanDerWaalsContact O-CD2 3.27Å; N229-W233 PolarHBondContact O-N 3.09Å
230	L	97.2	Very high	90.7	Very high	25 Å²	25	65 Å²	65	13%	0.131	34%	0.338	C	S	.	.	H	α-helix	trans	-57.5	-41.1	176	-75.7	167.5	0	0	0	111.8	C194 A197 K198 L226 R227 T234	C194-L230 HydrophobicContact CB-CD2 4.18Å; C194-L230 WeakPolarHBondContact O-CD2 3.38Å; A197-L230 HydrophobicContact CB-CD1 4.33Å; A197-L230 HydrophobicContact CB-CD2 3.82Å; A197-L230 HydrophobicContact CB-CG 3.93Å; K198-L230 HydrophobicContact CB-CD1 4.18Å; K198-L230 HydrophobicContact CB-CD2 4.06Å; L226-L230 WeakPolarHBondContact O-CG 3.38Å; L226-L230 PolarHBondContact O-N 3.41Å; R227-L230 PolarHBondContact O-N 2.96Å; L230-T234 WeakPolarHBondContact O-CB 3.45Å; L230-T234 VanDerWaalsContact O-CG2 3.22Å; L230-T234 WeakPolarHBondContact O-CG2 3.39Å; L230-T234 PolarHBondContact O-N 3.29Å; L230-T234 PolarHBondContact O-OG1 2.73Å
231	T	96.4	Very high	88.8	Confident	86 Å²	86	69.7 Å²	69.7	53%	0.528	36%	0.362	S	S	.	.	H	α-helix	trans	-64	-45.5	178.4	-54	0	0	0	0	111	R227 D228 N229 T234 S235	R227-T231 PolarHBondContact O-N 3.09Å; R227-T231 PolarHBondContact O-OG1 3.25Å; D228-T231 PolarHBondContact O-N 3.02Å; N229-T231 VanDerWaalsContact C-N 3.26Å; N229-T231 PolarHBondContact O-N 3.45Å; T231-T234 PolarHBondContact O-OG1 3.47Å; T231-S235 PolarHBondContact O-N 3.14Å; T231-S235 PolarHBondContact O-OG 3.5Å
232	L	95	Very high	86.4	Confident	90 Å²	90	67.8 Å²	67.8	47%	0.471	37%	0.366	S	S	.	.	H	α-helix	trans	-63.7	-48.3	178.7	-179.2	66.4	0	0	0	112.3	D228 N229 T234 S235 D236	D228-L232 PolarHBondContact O-N 3.36Å; N229-L232 PolarHBondContact O-N 3.09Å; L232-T234 PolarHBondContact O-N 3.32Å; L232-S235 PolarHBondContact O-N 3.05Å; L232-S235 PolarHBondContact O-OG 3.45Å; L232-D236 PolarHBondContact O-N 3.24Å; L232-D236 VanDerWaalsContact O-N 3.1Å
233	W	95.7	Very high	83.5	Confident	8 Å²	8	69.4 Å²	69.4	3%	0.03	39%	0.39	C	S	.	.	H	α-helix	trans	-73.3	-30.1	-174.5	-58.5	-25.9	0	0	0	112.9	V181 Y184 A193 A197 N229 Q237	V181-W233 HydrophobicContact CG2-CH2 3.99Å; V181-W233 HydrophobicContact CG2-CZ2 3.94Å; Y184-W233 AromaticContact CD1-CD1 3.74Å; Y184-W233 AromaticContact CD1-CE2 3.93Å; Y184-W233 HydrophobicContact CD1-CG 4.45Å; Y184-W233 HydrophobicContact CD1-CZ2 4.49Å; Y184-W233 AromaticContact CD1-NE1 3.36Å; Y184-W233 HydrophobicContact CD2-CB 4.06Å; Y184-W233 AromaticContact CD2-CD1 3.6Å; Y184-W233 AromaticContact CD2-CD2 3.74Å; Y184-W233 HydrophobicContact CD2-CD2 3.74Å; Y184-W233 AromaticContact CD2-CE2 3.9Å; Y184-W233 HydrophobicContact CD2-CE3 4.45Å; Y184-W233 AromaticContact CD2-CG 3.54Å; Y184-W233 HydrophobicContact CD2-CG 3.54Å; Y184-W233 AromaticContact CD2-NE1 3.8Å; Y184-W233 AromaticContact CE1-CD1 3.41Å; Y184-W233 VanDerWaalsContact CE1-CD1 3.41Å; Y184-W233 HydrophobicContact CE1-CG 4.3Å; Y184-W233 AromaticContact CE1-NE1 3.46Å; Y184-W233 HydrophobicContact CE2-CB 3.62Å; Y184-W233 AromaticContact CE2-CD1 3.3Å; Y184-W233 HydrophobicContact CE2-CD2 4.11Å; Y184-W233 AromaticContact CE2-CG 3.39Å; Y184-W233 HydrophobicContact CE2-CG 3.39Å; Y184-W233 AromaticContact CE2-NE1 3.92Å; Y184-W233 AromaticContact CG-CD1 3.82Å; Y184-W233 HydrophobicContact CG-CD2 4Å; Y184-W233 AromaticContact CG-CE2 3.65Å; Y184-W233 HydrophobicContact CG-CG 4.09Å; Y184-W233 HydrophobicContact CG-CZ2 4.15Å; Y184-W233 AromaticContact CG-NE1 3.53Å; Y184-W233 AromaticContact CZ-CD1 3.18Å; Y184-W233 AromaticContact CZ-CG 3.79Å; Y184-W233 AromaticContact CZ-NE1 3.74Å; A193-W233 HydrophobicContact CB-CE3 4.23Å; A193-W233 HydrophobicContact CB-CZ3 4.09Å; A197-W233 HydrophobicContact CB-CZ3 4.25Å; N229-W233 HydrophobicContact CB-CD2 4.2Å; N229-W233 HydrophobicContact CB-CE3 4.09Å; N229-W233 HydrophobicContact CB-CH2 3.67Å; N229-W233 HydrophobicContact CB-CZ2 3.77Å; N229-W233 HydrophobicContact CB-CZ3 3.82Å; N229-W233 WeakPolarHBondContact O-CB 3.21Å; N229-W233 VanDerWaalsContact O-CD2 3.27Å; N229-W233 PolarHBondContact O-N 3.09Å; W233-Q237 WeakPolarHBondContact O-CG 3.42Å; W233-Q237 PolarHBondContact O-N 3.05Å
234	T	91	Very high	80.8	Confident	53 Å²	53	78.6 Å²	78.6	33%	0.325	43%	0.433	S	S	.	.	H	α-helix	trans	-76.9	-25.8	175.3	54.1	0	0	0	0	113	L230 T231 L232 Q238	L230-T234 WeakPolarHBondContact O-CB 3.45Å; L230-T234 VanDerWaalsContact O-CG2 3.22Å; L230-T234 WeakPolarHBondContact O-CG2 3.39Å; L230-T234 PolarHBondContact O-N 3.29Å; L230-T234 PolarHBondContact O-OG1 2.73Å; T231-T234 PolarHBondContact O-OG1 3.47Å; L232-T234 PolarHBondContact O-N 3.32Å; T234-Q238 WeakPolarHBondContact O-CG 3.38Å; T234-Q238 PolarHBondContact O-N 3.22Å; T234-Q238 PolarHBondContact O-NE2 3.43Å
235	S	88.3	Confident	77.8	Confident	47 Å²	47	78 Å²	78	33%	0.329	44%	0.444	S	S	.	.	H	α-helix	trans	-71.9	-42.5	168.7	54	0	0	0	0	112.1	T231 L232 Q237 Q238 D239	T231-S235 PolarHBondContact O-N 3.14Å; T231-S235 PolarHBondContact O-OG 3.5Å; L232-S235 PolarHBondContact O-N 3.05Å; L232-S235 PolarHBondContact O-OG 3.45Å; S235-Q237 VanDerWaalsContact C-N 3.27Å; S235-Q237 PolarHBondContact O-N 2.88Å; S235-Q238 PolarHBondContact O-N 3.08Å; S235-D239 PolarHBondContact O-N 3.36Å; S235-D239 VanDerWaalsContact O-N 3.09Å
236	D	80.5	Confident	74.5	Confident	56 Å²	56	82 Å²	82	30%	0.299	47%	0.465	S	S	.	.	H	α-helix	trans	-59.4	-39.6	178.8	-70.2	-4.5	0	0	0	111.2	Y184 L232 Q238 D239 D240	Y184-D236 WeakPolarHBondContact OH-CB 3.44Å; Y184-D236 PolarHBondContact OH-OD2 3.15Å; L232-D236 PolarHBondContact O-N 3.24Å; L232-D236 VanDerWaalsContact O-N 3.1Å; D236-Q238 PolarHBondContact O-N 3.45Å; D236-D239 PolarHBondContact O-N 3.49Å; D236-D240 PolarHBondContact O-N 3.14Å; D236-D240 VanDerWaalsContact O-N 3.08Å
237	Q	77.4	Confident	71.6	Confident	61 Å²	61	93.4 Å²	93.4	29%	0.285	53%	0.527	S	S	.	.	H	α-helix	trans	-63.5	-35.7	174.9	-74.3	177.4	-18.3	0	0	113.6	W233 S235 D241	W233-Q237 WeakPolarHBondContact O-CG 3.42Å; W233-Q237 PolarHBondContact O-N 3.05Å; S235-Q237 VanDerWaalsContact C-N 3.27Å; S235-Q237 PolarHBondContact O-N 2.88Å; Q237-D241 PolarHBondContact O-N 3.41Å; Q237-D241 VanDerWaalsContact O-N 3.14Å
238	Q	72.9	Confident	70.3	Confident	139 Å²	139	92.3 Å²	92.3	65%	0.65	53%	0.531	S	S	*	.	H	α-helix	trans	-73.2	-33.5	178.4	-71.6	172.4	33.2	0	0	112	T234 S235 D236 G242	T234-Q238 WeakPolarHBondContact O-CG 3.38Å; T234-Q238 PolarHBondContact O-N 3.22Å; T234-Q238 PolarHBondContact O-NE2 3.43Å; S235-Q238 PolarHBondContact O-N 3.08Å; D236-Q238 PolarHBondContact O-N 3.45Å; Q238-G242 PolarHBondContact O-N 3.49Å
239	D	70.7	Confident	68.9	Low	123 Å²	123	93.6 Å²	93.6	66%	0.658	54%	0.54	S	S	*	.	H	α-helix	trans	-71.8	-37.4	176.8	-74.6	-19.5	0	0	0	111.6	S235 D236 G242	S235-D239 PolarHBondContact O-N 3.36Å; S235-D239 VanDerWaalsContact O-N 3.09Å; D236-D239 PolarHBondContact O-N 3.49Å; D239-G242 PolarHBondContact O-N 3.06Å
240	D	60.3	Low	67.3	Low	139 Å²	139	96.8 Å²	96.8	74%	0.743	56%	0.559	S	S	*	*	H	α-helix	trans	-68.3	-41.2	174.9	-82.4	-16	0	0	0	112.2	D236 G242 G243	D236-D240 PolarHBondContact O-N 3.14Å; D236-D240 VanDerWaalsContact O-N 3.08Å; D240-G242 VanDerWaalsContact C-N 3.3Å; D240-G242 PolarHBondContact O-N 3.48Å; D240-G243 PolarHBondContact O-N 3.46Å
241	D	58.3	Low	65.5	Low	143 Å²	143	101.1 Å²	101.1	77%	0.765	59%	0.585	S	S	*	*	H	α-helix	trans	-71.3	-23.8	175.6	-79	-18.2	0	0	0	112.8	Q237 G243	Q237-D241 PolarHBondContact O-N 3.41Å; Q237-D241 VanDerWaalsContact O-N 3.14Å; D241-G243 VanDerWaalsContact C-N 3.3Å; D241-G243 PolarHBondContact O-N 3.06Å
242	G	46.1	Very low	63.6	Low	60 Å²	60	102 Å²	102	62%	0.619	59%	0.588	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.9	-5.3	178.4	0	0	0	0	0	115.1	Q238 D239 D240	Q238-G242 PolarHBondContact O-N 3.49Å; D239-G242 PolarHBondContact O-N 3.06Å; D240-G242 VanDerWaalsContact C-N 3.3Å; D240-G242 PolarHBondContact O-N 3.48Å
243	G	38.4	Very low	61.5	Low	62 Å²	62	102.8 Å²	102.8	64%	0.639	60%	0.596	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.8	-13.6	-176.4	0	0	0	0	0	116	D240 D241 G245	D240-G243 PolarHBondContact O-N 3.46Å; D241-G243 VanDerWaalsContact C-N 3.3Å; D241-G243 PolarHBondContact O-N 3.06Å; G243-G245 VanDerWaalsContact C-N 3.28Å; G243-G245 PolarHBondContact O-N 3.46Å
244	E	39.9	Very low	59.1	Low	201 Å²	201	109.6 Å²	109.6	94%	0.939	64%	0.636	S	S	*	*			trans	-85.7	67.8	174.5	-69.8	-164.9	166.9	0	0	111.4
245	G	37	Very low	56.6	Low	51 Å²	51	113.9 Å²	113.9	53%	0.526	66%	0.66	S	S	.	*			trans	-163.8	56.5	-178.9	0	0	0	0	0	114.3	G243	G243-G245 VanDerWaalsContact C-N 3.28Å; G243-G245 PolarHBondContact O-N 3.46Å
246	N	29.2	Very low	54	Low	159 Å²	159	119.5 Å²	119.5	85%	0.85	69%	0.688	S	S	*	*			trans	174.7	125.5	139.9	-88.7	-32.8	0	0	0	112.6
247	N	37.2	Very low	51.6	Low	240 Å²	240	125.3 Å²	125.3	100%	1.283	72%	0.723	S	S	*	*			trans	87.8	0	171.2	-66.9	-12	0	0	0	118.3

Retrieved 247 of 247 residues in 304.5 ms (Link to these results)

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