A0A3Q0KU64_SCHMA Loading...

GLOBIN domain-containing protein

AlphaFold DB , UniProt , Accession A0A3Q0KU64, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 285 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	41.3	Very low	41	Very low	253 Å²	253	150.2 Å²	150.2	100%	1.246	82%	0.815	S	S	*	*				0	116.6	0	-65.2	178.6	174.6	0	0	106.5
2	G	41.9	Very low	40.8	Very low	81 Å²	81	150.5 Å²	150.5	84%	0.835	80%	0.803	S	S	*	*			cis	-154.8	132.6	-12.2	0	0	0	0	0	104.1
3	S	37.3	Very low	40.2	Very low	110 Å²	110	150.2 Å²	150.2	77%	0.769	79%	0.794	S	S	*	*			trans	-77.4	131.9	179.6	45.2	0	0	0	0	110.8
4	E	47.8	Very low	40.2	Very low	205 Å²	205	150.1 Å²	150.1	96%	0.958	78%	0.783	S	S	*	*			trans	-115.5	104.7	157.4	-85.8	-173.5	148.8	0	0	109.7
5	Q	40.1	Very low	40.1	Very low	172 Å²	172	149.9 Å²	149.9	80%	0.804	77%	0.774	S	S	*	*			trans	-87.1	149.4	166.4	-88.4	173.2	-9.4	0	0	109.7
6	S	41.3	Very low	40	Very low	103 Å²	103	145.1 Å²	145.1	72%	0.72	76%	0.758	S	S	*	*			trans	84.6	115.2	144.2	-59	0	0	0	0	119.6
7	R	40.4	Very low	40	Very low	249 Å²	249	140 Å²	140	94%	0.94	74%	0.737	S	S	*	*				-158.7	115.6	112.6	-104.5	173.9	-175.7	176.5	2.7	111.1
8	P	36.9	Very low	40.3	Very low	117 Å²	117	135.1 Å²	135.1	76%	0.76	71%	0.711	S	S	*	*			trans	-99.7	135.7	168.7	33.4	-24.2	0	0	0	112.3
9	N	35.5	Very low	40.6	Very low	108 Å²	108	132.2 Å²	132.2	58%	0.578	70%	0.695	S	S	*	*				66.6	72.8	127.3	-144.4	13.1	0	0	0	119.8
10	N	43.6	Very low	40.4	Very low	132 Å²	132	132.5 Å²	132.5	71%	0.706	69%	0.686	S	S	*	*	S	Bend	trans	-102.1	2.2	166.7	-123.4	5	0	0	0	114.4
11	N	44.4	Very low	41	Very low	122 Å²	122	128.1 Å²	128.1	65%	0.652	66%	0.664	S	S	*	*	H	α-helix	trans	-88.7	-16.4	-174.9	-85.3	-6.2	0	0	0	114.8
12	K	38.5	Very low	41.5	Very low	154 Å²	154	116.4 Å²	116.4	67%	0.67	61%	0.607	S	S	*	*	H	α-helix	trans	-75.1	-37	-179.7	-73.2	-171.6	177.2	-175	0	113.1	S16	K12-S16 PolarHBondContact O-N 3.45Å
13	Q	33.4	Very low	42.1	Very low	147 Å²	147	115.5 Å²	115.5	69%	0.687	58%	0.581	S	S	*	*	H	α-helix	trans	-71.5	-35.1	-178.3	-76.3	-179.3	-22.8	0	0	113.3	S16 S17	Q13-S16 PolarHBondContact O-OG 3.27Å; Q13-S17 PolarHBondContact O-N 3Å
14	K	40.4	Very low	42.9	Very low	148 Å²	148	112.7 Å²	112.7	64%	0.643	56%	0.558	S	S	*	*	H	α-helix	trans	-63.2	-44.5	175.8	-87.5	-174	174.3	-174.7	0	111.8	S16 S17 I18	K14-S16 PolarHBondContact O-N 3.41Å; K14-S17 PolarHBondContact O-N 3.43Å; K14-S17 PolarHBondContact O-OG 2.91Å; K14-I18 WeakPolarHBondContact O-CG1 3.29Å; K14-I18 PolarHBondContact O-N 2.83Å
15	K	39.3	Very low	43.1	Very low	147 Å²	147	104 Å²	104	64%	0.639	52%	0.517	S	S	*	.	H	α-helix	trans	-61.3	-41.6	-179.7	-73.8	-172.5	176.7	-171.3	0	112.7	I18 I19	K15-I18 PolarHBondContact O-N 3.41Å; K15-I19 WeakPolarHBondContact O-CG1 3.34Å; K15-I19 PolarHBondContact O-N 3.01Å
16	S	38.1	Very low	43.8	Very low	74 Å²	74	96.4 Å²	96.4	52%	0.517	48%	0.483	S	S	.	.	H	α-helix	trans	-66	-37.8	177.9	53.2	0	0	0	0	112.9	K12 Q13 K14 I18 W20	K12-S16 PolarHBondContact O-N 3.45Å; Q13-S16 PolarHBondContact O-OG 3.27Å; K14-S16 PolarHBondContact O-N 3.41Å; S16-I18 PolarHBondContact O-N 2.99Å; S16-W20 PolarHBondContact O-N 3.15Å
17	S	40.2	Very low	44.6	Very low	58 Å²	58	96 Å²	96	41%	0.406	47%	0.468	S	S	.	.	H	α-helix	trans	-67.9	-34.1	179.5	62.9	0	0	0	0	113.5	Q13 K14 N21	Q13-S17 PolarHBondContact O-N 3Å; K14-S17 PolarHBondContact O-N 3.43Å; K14-S17 PolarHBondContact O-OG 2.91Å; S17-N21 WeakPolarHBondContact O-CB 3.49Å; S17-N21 PolarHBondContact O-N 3.36Å; S17-N21 VanDerWaalsContact O-N 3.1Å
18	I	45.1	Very low	45.3	Very low	52 Å²	52	90.7 Å²	90.7	27%	0.267	45%	0.452	S	S	.	.	H	α-helix	trans	-71.2	-46.7	-179.8	-65.8	165.9	0	0	0	109.7	K14 K15 S16 W20 N21 S22	K14-I18 WeakPolarHBondContact O-CG1 3.29Å; K14-I18 PolarHBondContact O-N 2.83Å; K15-I18 PolarHBondContact O-N 3.41Å; S16-I18 PolarHBondContact O-N 2.99Å; I18-W20 VanDerWaalsContact C-N 3.31Å; I18-W20 PolarHBondContact O-N 3.04Å; I18-N21 PolarHBondContact O-N 3.41Å; I18-S22 PolarHBondContact O-N 3.37Å; I18-S22 PolarHBondContact O-OG 3.32Å
19	I	45.8	Very low	46	Very low	80 Å²	80	85.9 Å²	85.9	41%	0.41	42%	0.421	S	S	.	.	H	α-helix	trans	-57.6	-45.3	177.5	-65.4	167.2	0	0	0	110.9	K15 S22 Q23	K15-I19 WeakPolarHBondContact O-CG1 3.34Å; K15-I19 PolarHBondContact O-N 3.01Å; I19-S22 PolarHBondContact O-N 3.25Å; I19-Q23 HydrophobicContact CG2-CG 4.47Å; I19-Q23 WeakPolarHBondContact O-CB 3.43Å; I19-Q23 VanDerWaalsContact O-CG 3.31Å; I19-Q23 WeakPolarHBondContact O-CG 3.38Å; I19-Q23 PolarHBondContact O-N 3.29Å
20	W	37.2	Very low	46.6	Very low	138 Å²	138	84.2 Å²	84.2	52%	0.523	41%	0.411	S	S	.	.	H	α-helix	trans	-65	-41.2	179.6	-165.2	77.8	0	0	0	112.5	S16 I18 Q23 N24 T68	S16-W20 PolarHBondContact O-N 3.15Å; I18-W20 VanDerWaalsContact C-N 3.31Å; I18-W20 PolarHBondContact O-N 3.04Å; W20-Q23 PolarHBondContact O-N 3.2Å; W20-N24 VanDerWaalsContact CE3-ND2 3.27Å; W20-N24 WeakPolarHBondContact CH2-ND2 3.48Å; W20-N24 WeakPolarHBondContact CZ2-ND2 3.26Å; W20-N24 WeakPolarHBondContact CZ3-ND2 3.43Å; W20-N24 WeakPolarHBondContact O-CB 3.43Å; W20-N24 PolarHBondContact O-N 3Å; W20-N24 PolarHBondContact O-ND2 2.54Å; W20-T68 HydrophobicContact CZ3-CG2 4.11Å
21	N	51.9	Low	46.8	Very low	40 Å²	40	81.7 Å²	81.7	21%	0.214	40%	0.401	C	S	.	.	H	α-helix	trans	-65.7	-43.1	176.3	-77.9	-10.1	0	0	0	112.1	S17 I18 N24 L25 T68	S17-N21 WeakPolarHBondContact O-CB 3.49Å; S17-N21 PolarHBondContact O-N 3.36Å; S17-N21 VanDerWaalsContact O-N 3.1Å; I18-N21 PolarHBondContact O-N 3.41Å; N21-N24 PolarHBondContact O-N 2.93Å; N21-L25 WeakPolarHBondContact O-CB 3.35Å; N21-L25 PolarHBondContact O-N 2.95Å; N21-T68 PolarHBondContact OD1-OG1 3.12Å
22	S	52.8	Low	46.7	Very low	7 Å²	7	79.1 Å²	79.1	5%	0.049	39%	0.393	C	S	.	.	H	α-helix	trans	-64.7	-42.2	176.8	-62	0	0	0	0	112	I18 I19 N24 L25 V26	I18-S22 PolarHBondContact O-N 3.37Å; I18-S22 PolarHBondContact O-OG 3.32Å; I19-S22 PolarHBondContact O-N 3.25Å; S22-N24 VanDerWaalsContact C-N 3.34Å; S22-N24 PolarHBondContact O-N 3.3Å; S22-L25 WeakPolarHBondContact O-CB 3.4Å; S22-L25 PolarHBondContact O-N 3.07Å; S22-V26 VanDerWaalsContact O-CG2 3.29Å; S22-V26 WeakPolarHBondContact O-CG2 3.03Å; S22-V26 PolarHBondContact O-N 2.95Å
23	Q	53.7	Low	46.6	Very low	62 Å²	62	76 Å²	76	29%	0.29	38%	0.383	S	S	.	.	H	α-helix	trans	-58.7	-45.2	173.6	-77	176.9	-18.6	0	0	111.4	I19 W20 V26 K27 V221	I19-Q23 HydrophobicContact CG2-CG 4.47Å; I19-Q23 WeakPolarHBondContact O-CB 3.43Å; I19-Q23 VanDerWaalsContact O-CG 3.31Å; I19-Q23 WeakPolarHBondContact O-CG 3.38Å; I19-Q23 PolarHBondContact O-N 3.29Å; W20-Q23 PolarHBondContact O-N 3.2Å; Q23-V26 PolarHBondContact O-N 3.01Å; Q23-K27 VanDerWaalsContact O-CB 3.31Å; Q23-K27 WeakPolarHBondContact O-CB 3.41Å; Q23-K27 VanDerWaalsContact O-CG 3.29Å; Q23-K27 WeakPolarHBondContact O-CG 3.33Å; Q23-K27 PolarHBondContact O-N 3Å; Q23-V221 HydrophobicContact CG-CG1 3.89Å; Q23-V221 HydrophobicContact CG-CG2 4.19Å
24	N	54.6	Low	46.9	Very low	52 Å²	52	73.2 Å²	73.2	28%	0.278	37%	0.373	S	S	.	.	H	α-helix	trans	-65.7	-38.2	177	-80.9	-29.9	0	0	0	113	W20 N21 S22 K28	W20-N24 VanDerWaalsContact CE3-ND2 3.27Å; W20-N24 WeakPolarHBondContact CH2-ND2 3.48Å; W20-N24 WeakPolarHBondContact CZ2-ND2 3.26Å; W20-N24 WeakPolarHBondContact CZ3-ND2 3.43Å; W20-N24 WeakPolarHBondContact O-CB 3.43Å; W20-N24 PolarHBondContact O-N 3Å; W20-N24 PolarHBondContact O-ND2 2.54Å; N21-N24 PolarHBondContact O-N 2.93Å; S22-N24 VanDerWaalsContact C-N 3.34Å; S22-N24 PolarHBondContact O-N 3.3Å; N24-K28 VanDerWaalsContact O-CB 3.29Å; N24-K28 WeakPolarHBondContact O-CB 3.09Å; N24-K28 VanDerWaalsContact O-CG 3.27Å; N24-K28 WeakPolarHBondContact O-CG 3.26Å; N24-K28 PolarHBondContact O-N 2.96Å
25	L	52.4	Low	46.8	Very low	22 Å²	22	71.5 Å²	71.5	12%	0.115	37%	0.37	C	S	.	.	H	α-helix	trans	-61.6	-49.5	176.2	-124.4	150.7	0	0	0	111	N21 S22 K28 S29 N70 Y160	N21-L25 WeakPolarHBondContact O-CB 3.35Å; N21-L25 PolarHBondContact O-N 2.95Å; S22-L25 WeakPolarHBondContact O-CB 3.4Å; S22-L25 PolarHBondContact O-N 3.07Å; L25-K28 PolarHBondContact O-N 3.08Å; L25-S29 PolarHBondContact O-N 2.83Å; L25-S29 PolarHBondContact O-OG 3.2Å; L25-N70 VanDerWaalsContact CD1-CG 3.46Å; L25-N70 WeakPolarHBondContact CD1-ND2 3.3Å; L25-N70 WeakPolarHBondContact CD1-OD1 3.11Å; L25-N70 VanDerWaalsContact CG-ND2 3.31Å; L25-N70 WeakPolarHBondContact CG-ND2 3.19Å; L25-Y160 HydrophobicContact CD1-CD2 4.36Å; L25-Y160 HydrophobicContact CD1-CE2 4.4Å; L25-Y160 HydrophobicContact CD2-CD2 4.33Å; L25-Y160 HydrophobicContact CD2-CG 4.47Å
26	V	54.7	Low	46.8	Very low	12 Å²	12	67.4 Å²	67.4	7%	0.073	36%	0.36	C	S	.	.	H	α-helix	trans	-69.1	-43.6	-178.8	-179.8	0	0	0	0	110.5	S22 Q23 K28 S29 I30 A164 V221 I225	S22-V26 VanDerWaalsContact O-CG2 3.29Å; S22-V26 WeakPolarHBondContact O-CG2 3.03Å; S22-V26 PolarHBondContact O-N 2.95Å; Q23-V26 PolarHBondContact O-N 3.01Å; V26-K28 VanDerWaalsContact C-N 3.31Å; V26-K28 PolarHBondContact O-N 2.99Å; V26-S29 PolarHBondContact O-N 2.96Å; V26-I30 HydrophobicContact CG1-CD1 3.77Å; V26-I30 HydrophobicContact CG1-CG1 4.35Å; V26-I30 VanDerWaalsContact O-CG1 3.28Å; V26-I30 WeakPolarHBondContact O-CG1 3Å; V26-I30 PolarHBondContact O-N 3.23Å; V26-A164 HydrophobicContact CB-CB 4.39Å; V26-A164 HydrophobicContact CG1-CB 3.8Å; V26-A164 HydrophobicContact CG2-CB 3.57Å; V26-V221 HydrophobicContact CG2-CG1 4.26Å; V26-I225 HydrophobicContact CB-CD1 3.85Å; V26-I225 HydrophobicContact CG1-CD1 3.35Å
27	K	57.8	Low	47	Very low	94 Å²	94	70.3 Å²	70.3	41%	0.409	36%	0.363	S	S	.	.	H	α-helix	trans	-59.1	-40.5	174.5	-73.6	-174.5	179.2	-165.5	0	111.6	Q23 I30 T31 E228	Q23-K27 VanDerWaalsContact O-CB 3.31Å; Q23-K27 WeakPolarHBondContact O-CB 3.41Å; Q23-K27 VanDerWaalsContact O-CG 3.29Å; Q23-K27 WeakPolarHBondContact O-CG 3.33Å; Q23-K27 PolarHBondContact O-N 3Å; K27-I30 PolarHBondContact O-N 2.55Å; K27-T31 WeakPolarHBondContact O-CG2 3.43Å; K27-T31 PolarHBondContact O-N 2.71Å; K27-T31 PolarHBondContact O-OG1 2.76Å; K27-T31 VanDerWaalsContact O-OG1 3.13Å; K27-E228 IonicContact NZ-OE1 3.36Å; K27-E228 IonicContact NZ-OE2 3.92Å; K27-E228 PolarHBondContact NZ-OE2 3.36Å
28	K	56.1	Low	46.9	Very low	138 Å²	138	73 Å²	73	60%	0.6	37%	0.372	S	S	*	.	H	α-helix	trans	-68.2	-39.1	175.3	-77.7	178.5	179.7	179.7	0	113.6	N24 L25 V26 T31 S32	N24-K28 VanDerWaalsContact O-CB 3.29Å; N24-K28 WeakPolarHBondContact O-CB 3.09Å; N24-K28 VanDerWaalsContact O-CG 3.27Å; N24-K28 WeakPolarHBondContact O-CG 3.26Å; N24-K28 PolarHBondContact O-N 2.96Å; L25-K28 PolarHBondContact O-N 3.08Å; V26-K28 VanDerWaalsContact C-N 3.31Å; V26-K28 PolarHBondContact O-N 2.99Å; K28-T31 WeakPolarHBondContact CA-OG1 3.49Å; K28-T31 PolarHBondContact O-OG1 3.48Å; K28-S32 WeakPolarHBondContact O-CB 3.45Å; K28-S32 PolarHBondContact O-N 3.1Å
29	S	50.6	Low	46.5	Very low	16 Å²	16	80.5 Å²	80.5	11%	0.112	40%	0.397	C	S	.	.	H	α-helix	trans	-67.1	-38.7	175.1	-76.2	0	0	0	0	111.6	L25 V26 S32 L33 E161	L25-S29 PolarHBondContact O-N 2.83Å; L25-S29 PolarHBondContact O-OG 3.2Å; V26-S29 PolarHBondContact O-N 2.96Å; S29-S32 WeakPolarHBondContact O-CB 3.36Å; S29-S32 PolarHBondContact O-N 3Å; S29-L33 WeakPolarHBondContact O-CD1 3.4Å; S29-L33 PolarHBondContact O-N 3.42Å; S29-L33 VanDerWaalsContact O-N 3.08Å; S29-E161 WeakPolarHBondContact CB-OE1 3.48Å; S29-E161 PolarHBondContact OG-OE1 3.4Å
30	I	47.4	Very low	46.2	Very low	73 Å²	73	84 Å²	84	37%	0.374	41%	0.412	S	S	.	.	H	α-helix	trans	-65.2	-45.6	175.9	-66.8	167.8	0	0	0	111.2	V26 K27 S32 L33 N34 I225	V26-I30 HydrophobicContact CG1-CD1 3.77Å; V26-I30 HydrophobicContact CG1-CG1 4.35Å; V26-I30 VanDerWaalsContact O-CG1 3.28Å; V26-I30 WeakPolarHBondContact O-CG1 3Å; V26-I30 PolarHBondContact O-N 3.23Å; K27-I30 PolarHBondContact O-N 2.55Å; I30-S32 VanDerWaalsContact C-N 3.31Å; I30-S32 PolarHBondContact O-N 3.41Å; I30-L33 PolarHBondContact O-N 3.18Å; I30-L33 VanDerWaalsContact O-N 3.16Å; I30-N34 PolarHBondContact O-N 3.16Å; I30-I225 HydrophobicContact CD1-CG2 4.29Å
31	T	48.7	Very low	46.4	Very low	79 Å²	79	84.4 Å²	84.4	49%	0.485	43%	0.425	S	S	.	.	H	α-helix	trans	-64.1	-36.2	177	51.7	0	0	0	0	112.4	K27 K28 L33 N34 N35	K27-T31 WeakPolarHBondContact O-CG2 3.43Å; K27-T31 PolarHBondContact O-N 2.71Å; K27-T31 PolarHBondContact O-OG1 2.76Å; K27-T31 VanDerWaalsContact O-OG1 3.13Å; K28-T31 WeakPolarHBondContact CA-OG1 3.49Å; K28-T31 PolarHBondContact O-OG1 3.48Å; T31-L33 PolarHBondContact O-N 3.5Å; T31-N34 PolarHBondContact O-N 3.36Å; T31-N35 PolarHBondContact O-N 3.05Å
32	S	41.5	Very low	45.8	Very low	69 Å²	69	86.9 Å²	86.9	48%	0.483	45%	0.445	S	S	.	.	H	α-helix	trans	-58.8	-43.4	171.3	170.8	0	0	0	0	112.6	K28 S29 I30 S36	K28-S32 WeakPolarHBondContact O-CB 3.45Å; K28-S32 PolarHBondContact O-N 3.1Å; S29-S32 WeakPolarHBondContact O-CB 3.36Å; S29-S32 PolarHBondContact O-N 3Å; I30-S32 VanDerWaalsContact C-N 3.31Å; I30-S32 PolarHBondContact O-N 3.41Å; S32-S36 PolarHBondContact O-N 3.41Å; S32-S36 PolarHBondContact O-OG 3.07Å
33	L	38.1	Very low	45	Very low	88 Å²	88	93 Å²	93	46%	0.461	48%	0.477	S	S	.	.	H	α-helix	trans	-70	-35.1	178.7	-95.1	90	0	0	0	112.9	S29 I30 T31 S36 K37	S29-L33 WeakPolarHBondContact O-CD1 3.4Å; S29-L33 PolarHBondContact O-N 3.42Å; S29-L33 VanDerWaalsContact O-N 3.08Å; I30-L33 PolarHBondContact O-N 3.18Å; I30-L33 VanDerWaalsContact O-N 3.16Å; T31-L33 PolarHBondContact O-N 3.5Å; L33-S36 PolarHBondContact O-OG 3.16Å; L33-K37 PolarHBondContact O-N 3.25Å
34	N	39	Very low	44.3	Very low	89 Å²	89	97.1 Å²	97.1	48%	0.476	50%	0.501	S	S	.	.	H	α-helix	trans	-70.7	-39.3	177.8	-72.5	-10.8	0	0	0	111.4	I30 T31 S36 K37 L38	I30-N34 PolarHBondContact O-N 3.16Å; T31-N34 PolarHBondContact O-N 3.36Å; N34-S36 PolarHBondContact O-N 2.88Å; N34-K37 PolarHBondContact O-N 2.99Å; N34-L38 WeakPolarHBondContact O-CB 3.37Å; N34-L38 WeakPolarHBondContact O-CG 3.17Å; N34-L38 PolarHBondContact O-N 2.84Å
35	N	38.9	Very low	43.6	Very low	112 Å²	112	101.5 Å²	101.5	60%	0.599	53%	0.525	S	S	*	.	H	α-helix	trans	-66.6	-32.9	175.4	-81	-9.5	0	0	0	113.1	T31 R39	T31-N35 PolarHBondContact O-N 3.05Å; N35-R39 WeakPolarHBondContact O-CB 3.24Å; N35-R39 PolarHBondContact O-N 3.49Å
36	S	38.3	Very low	43.1	Very low	60 Å²	60	107.3 Å²	107.3	42%	0.42	56%	0.556	S	S	.	*	H	α-helix	trans	-71.3	-38.4	174.9	58.9	0	0	0	0	112.4	S32 L33 N34 R39 E40	S32-S36 PolarHBondContact O-N 3.41Å; S32-S36 PolarHBondContact O-OG 3.07Å; L33-S36 PolarHBondContact O-OG 3.16Å; N34-S36 PolarHBondContact O-N 2.88Å; S36-R39 PolarHBondContact O-N 3.02Å; S36-E40 PolarHBondContact O-N 2.62Å
37	K	43.1	Very low	42.3	Very low	135 Å²	135	111.7 Å²	111.7	59%	0.587	59%	0.587	S	S	*	*	H	α-helix	trans	-71	-36.7	177.5	-78	-177	178	179.4	0	113.5	L33 N34 R39 E40 N41	L33-K37 PolarHBondContact O-N 3.25Å; N34-K37 PolarHBondContact O-N 2.99Å; K37-R39 VanDerWaalsContact C-N 3.27Å; K37-R39 PolarHBondContact O-N 3.08Å; K37-E40 PolarHBondContact O-N 2.78Å; K37-N41 PolarHBondContact O-N 3.07Å
38	L	38	Very low	41.5	Very low	114 Å²	114	114.9 Å²	114.9	60%	0.597	61%	0.609	S	S	*	*	H	α-helix	trans	-67.3	-31.4	174.6	-75.7	164.5	0	0	0	111.8	N34 S42	N34-L38 WeakPolarHBondContact O-CB 3.37Å; N34-L38 WeakPolarHBondContact O-CG 3.17Å; N34-L38 PolarHBondContact O-N 2.84Å; L38-S42 PolarHBondContact O-OG 3.21Å
39	R	36.2	Very low	40.6	Very low	210 Å²	210	113.9 Å²	113.9	79%	0.792	62%	0.616	S	S	*	*	H	α-helix	trans	-79	-23.8	179.8	-146.7	173.8	-179.1	-157.1	-1.2	113.6	N35 S36 K37	N35-R39 WeakPolarHBondContact O-CB 3.24Å; N35-R39 PolarHBondContact O-N 3.49Å; S36-R39 PolarHBondContact O-N 3.02Å; K37-R39 VanDerWaalsContact C-N 3.27Å; K37-R39 PolarHBondContact O-N 3.08Å
40	E	40.2	Very low	40.2	Very low	153 Å²	153	120.7 Å²	120.7	72%	0.715	65%	0.651	S	S	*	*	H	α-helix	trans	-80.6	-22.2	173.1	-76.7	-179.6	163.4	0	0	113.2	S36 K37	S36-E40 PolarHBondContact O-N 2.62Å; K37-E40 PolarHBondContact O-N 2.78Å
41	N	40.7	Very low	39.8	Very low	148 Å²	148	121.7 Å²	121.7	79%	0.791	66%	0.662	S	S	*	*	S	Bend	trans	-96.3	7.2	-180	-77.5	-10	0	0	0	115	K37	K37-N41 PolarHBondContact O-N 3.07Å
42	S	39.6	Very low	39.4	Very low	91 Å²	91	125.1 Å²	125.1	64%	0.636	68%	0.678	S	S	*	*			trans	-113	14.8	-174.7	-54.3	0	0	0	0	114.7	L38	L38-S42 PolarHBondContact O-OG 3.21Å
43	N	34.8	Very low	39.6	Very low	137 Å²	137	131 Å²	131	73%	0.733	70%	0.698	S	S	*	*			trans	-101.8	82.1	177.9	-78.2	-19.1	0	0	0	110.5
44	D	39.5	Very low	39.4	Very low	148 Å²	148	134.2 Å²	134.2	79%	0.791	72%	0.715	S	S	*	*			trans	-158.6	126	151.6	-98.4	-26.4	0	0	0	111.3
45	N	41.1	Very low	39.8	Very low	144 Å²	144	138.4 Å²	138.4	77%	0.77	73%	0.732	S	S	*	*			trans	82.6	100.6	154.3	-60.5	-38.4	0	0	0	121.3
46	N	40.5	Very low	39.6	Very low	144 Å²	144	140.3 Å²	140.3	77%	0.77	74%	0.742	S	S	*	*				93.6	97.4	120.5	-120.4	-4.1	0	0	0	120.8
47	S	37.4	Very low	39.6	Very low	104 Å²	104	144.3 Å²	144.3	73%	0.727	76%	0.764	S	S	*	*				37.6	107.5	122.5	-38.5	0	0	0	0	119.8
48	N	42.7	Very low	39.2	Very low	161 Å²	161	145.8 Å²	145.8	86%	0.861	77%	0.773	S	S	*	*				176.2	137.8	109	-142.2	7.1	0	0	0	110.9
49	P	36.5	Very low	38.8	Very low	116 Å²	116	146.9 Å²	146.9	75%	0.753	78%	0.78	S	S	*	*			trans	-97.3	138.4	178	34.3	-24.8	0	0	0	111.7
50	N	42.6	Very low	38.8	Very low	159 Å²	159	144.2 Å²	144.2	85%	0.85	78%	0.781	S	S	*	*			trans	-138	127.1	162.5	-156.9	22.8	0	0	0	109.7
51	P	37.8	Very low	38.4	Very low	94 Å²	94	145.1 Å²	145.1	61%	0.61	79%	0.791	S	S	*	*			trans	-89.5	162	-179.9	35.9	-30.2	0	0	0	111
52	N	41.7	Very low	38.3	Very low	152 Å²	152	144.8 Å²	144.8	81%	0.813	79%	0.787	S	S	*	*			trans	100.3	95.8	171.4	-50.3	-23.6	0	0	0	114.8
53	Q	44.4	Very low	37.8	Very low	192 Å²	192	145.7 Å²	145.7	90%	0.897	79%	0.785	S	S	*	*			trans	-161.2	111.6	130.2	-111.5	169.2	-1.1	0	0	110.2
54	D	35.4	Very low	37.7	Very low	156 Å²	156	144.7 Å²	144.7	83%	0.834	79%	0.789	S	S	*	*			trans	-60.6	127.6	161.3	-73.7	-44.6	0	0	0	109.2
55	H	46.7	Very low	37.2	Very low	176 Å²	176	144.7 Å²	144.7	82%	0.815	78%	0.784	S	S	*	*			trans	-152.1	124.2	146.7	-99.8	-59.7	0	0	0	111
56	N	35.4	Very low	36.6	Very low	152 Å²	152	143 Å²	143	81%	0.813	78%	0.784	S	S	*	*			trans	-43.4	136.9	172.6	-57.8	-39.1	0	0	0	113.2
57	T	37.9	Very low	36.2	Very low	144 Å²	144	143 Å²	143	88%	0.883	78%	0.782	S	S	*	*			trans	-148.9	122.3	144.1	-22.2	0	0	0	0	110
58	E	34	Very low	36.2	Very low	166 Å²	166	141.2 Å²	141.2	78%	0.776	77%	0.767	S	S	*	*			trans	-63	150.5	-178.8	-73.3	167.2	127.4	0	0	113.1
59	N	29.7	Very low	36.3	Very low	138 Å²	138	141.8 Å²	141.8	74%	0.738	77%	0.765	S	S	*	*			trans	45.5	108.4	140.9	-62.6	-29.7	0	0	0	118.2
60	D	36.1	Very low	37.7	Very low	153 Å²	153	140.9 Å²	140.9	82%	0.818	75%	0.753	S	S	*	*			trans	-148.9	95.2	132.6	-91.2	-33.6	0	0	0	110.9	I62	D60-I62 VanDerWaalsContact C-N 3.31Å; D60-I62 HydrophobicContact CB-CG1 4.47Å; D60-I62 PolarHBondContact O-N 3.3Å
61	N	31.1	Very low	39.3	Very low	172 Å²	172	139.1 Å²	139.1	92%	0.92	74%	0.738	S	S	*	*			trans	-71.7	84.2	166.6	-116.9	-14.9	0	0	0	108.1	N63	N61-N63 PolarHBondContact O-N 2.9Å
62	I	38.6	Very low	41.7	Very low	141 Å²	141	136.1 Å²	136.1	72%	0.723	72%	0.719	S	S	*	*			trans	-81.8	98.9	171.1	-63.9	177.4	0	0	0	109	D60 S64	D60-I62 VanDerWaalsContact C-N 3.31Å; D60-I62 HydrophobicContact CB-CG1 4.47Å; D60-I62 PolarHBondContact O-N 3.3Å; I62-S64 PolarHBondContact O-N 3.34Å
63	N	30.6	Very low	44.1	Very low	111 Å²	111	128.9 Å²	128.9	59%	0.594	68%	0.681	S	S	*	*			trans	-42.9	97.6	165.1	-168.5	21.3	0	0	0	111.6	N61 Q65	N61-N63 PolarHBondContact O-N 2.9Å; N63-Q65 VanDerWaalsContact ND2-CD 3.27Å; N63-Q65 PolarHBondContact ND2-OE1 3.09Å; N63-Q65 PolarHBondContact O-N 3.27Å; N63-Q65 WeakPolarHBondContact OD1-CG 3.39Å
64	S	32.2	Very low	46.5	Very low	116 Å²	116	124.5 Å²	124.5	81%	0.811	66%	0.656	S	S	*	*			trans	-71.8	76.5	169.1	-80.7	0	0	0	0	110.1	I62	I62-S64 PolarHBondContact O-N 3.34Å
65	Q	29.1	Very low	49.3	Very low	147 Å²	147	122.6 Å²	122.6	69%	0.687	64%	0.642	S	S	*	*			trans	-100.6	114.4	169.5	-82.7	176.1	-12.4	0	0	110.4	N63	N63-Q65 VanDerWaalsContact ND2-CD 3.27Å; N63-Q65 PolarHBondContact ND2-OE1 3.09Å; N63-Q65 PolarHBondContact O-N 3.27Å; N63-Q65 WeakPolarHBondContact OD1-CG 3.39Å
66	S	28.1	Very low	51.6	Low	109 Å²	109	116 Å²	116	76%	0.762	61%	0.613	S	S	*	*			trans	70.2	77.5	167	72.2	0	0	0	0	118.1	T68	S66-T68 PolarHBondContact O-N 3.32Å
67	I	33.1	Very low	54.5	Low	143 Å²	143	109.5 Å²	109.5	73%	0.733	58%	0.577	S	S	*	*			trans	-70.7	105.2	152.9	-62.2	172.4	0	0	0	106.4	E69	I67-E69 PolarHBondContact O-N 3.4Å; I67-E69 VanDerWaalsContact O-N 3.1Å
68	T	37.4	Very low	57.3	Low	67 Å²	67	105.2 Å²	105.2	41%	0.411	55%	0.553	S	S	.	*			trans	-53.8	112.9	169.9	45.6	0	0	0	0	109.3	W20 N21 S66 N70	W20-T68 HydrophobicContact CZ3-CG2 4.11Å; N21-T68 PolarHBondContact OD1-OG1 3.12Å; S66-T68 PolarHBondContact O-N 3.32Å; T68-N70 PolarHBondContact O-N 2.68Å
69	E	44.8	Very low	60.3	Low	174 Å²	174	102.7 Å²	102.7	81%	0.813	55%	0.545	S	S	*	.			trans	-51.9	121.3	176.5	-74.3	179.3	163.6	0	0	110	I67 K71	I67-E69 PolarHBondContact O-N 3.4Å; I67-E69 VanDerWaalsContact O-N 3.1Å; E69-K71 PolarHBondContact O-N 2.9Å
70	N	64.5	Low	63.5	Low	97 Å²	97	101.3 Å²	101.3	52%	0.519	54%	0.537	S	S	.	.			trans	-71.4	101.4	179.4	-174.3	1.4	0	0	0	109	L25 T68 S72	L25-N70 VanDerWaalsContact CD1-CG 3.46Å; L25-N70 WeakPolarHBondContact CD1-ND2 3.3Å; L25-N70 WeakPolarHBondContact CD1-OD1 3.11Å; L25-N70 VanDerWaalsContact CG-ND2 3.31Å; L25-N70 WeakPolarHBondContact CG-ND2 3.19Å; T68-N70 PolarHBondContact O-N 2.68Å; N70-S72 PolarHBondContact O-N 3.2Å
71	K	76	Confident	66.5	Low	122 Å²	122	96.1 Å²	96.1	53%	0.53	51%	0.508	S	S	.	.			trans	-67.5	130.1	179	-67.8	-174.1	179.5	-175	0	110.3	E69 Q75 L76	E69-K71 PolarHBondContact O-N 2.9Å; K71-Q75 VanDerWaalsContact CA-OE1 3.24Å; K71-Q75 HydrophobicContact CB-CB 4.24Å; K71-L76 HydrophobicContact CB-CD2 4.36Å
72	S	88.5	Confident	69.7	Low	31 Å²	31	88.2 Å²	88.2	22%	0.217	47%	0.465	C	S	.	.			trans	-63.6	155.8	170	73.6	0	0	0	0	110.2	N70 R74 Q75	N70-S72 PolarHBondContact O-N 3.2Å; S72-R74 PolarHBondContact O-N 3.01Å; S72-Q75 WeakPolarHBondContact O-CB 3.49Å; S72-Q75 PolarHBondContact O-N 2.63Å; S72-Q75 WeakPolarHBondContact OG-CG 3.42Å
73	F	93.2	Very high	72.5	Confident	0 Å²	0	86.6 Å²	86.6	0%	0	46%	0.458	C	S	.	.	G	3₁₀ helix	trans	-55.9	-40.2	179.3	-168.8	-103.9	0	0	0	111.1	Q75 L76 F77 A148 A151 L152 S156 L159 V211 E214 I218	F73-Q75 VanDerWaalsContact C-N 3.29Å; F73-Q75 PolarHBondContact O-N 3.16Å; F73-L76 HydrophobicContact CD2-CD1 4.22Å; F73-L76 WeakPolarHBondContact O-CB 3.16Å; F73-L76 PolarHBondContact O-N 3.21Å; F73-F77 HydrophobicContact CD1-CE2 4Å; F73-F77 AromaticContact CE1-CE2 3.78Å; F73-F77 HydrophobicContact CE1-CE2 3.78Å; F73-F77 HydrophobicContact CE1-CZ 4.15Å; F73-F77 HydrophobicContact CE2-CE2 4.46Å; F73-F77 HydrophobicContact CG-CE2 4.42Å; F73-F77 HydrophobicContact CZ-CE2 4.02Å; F73-F77 HydrophobicContact CZ-CZ 4.08Å; F73-F77 WeakPolarHBondContact O-CD2 3.39Å; F73-F77 VanDerWaalsContact O-CE2 3.3Å; F73-F77 WeakPolarHBondContact O-CE2 3.46Å; F73-A148 HydrophobicContact CE1-CB 4.12Å; F73-A148 WeakPolarHBondContact CE1-O 3.29Å; F73-A148 HydrophobicContact CZ-CB 4.17Å; F73-A151 HydrophobicContact CB-CB 3.98Å; F73-A151 HydrophobicContact CD1-CB 3.78Å; F73-A151 HydrophobicContact CG-CB 4.07Å; F73-L152 HydrophobicContact CD1-CD2 3.57Å; F73-L152 HydrophobicContact CD1-CG 4.06Å; F73-L152 HydrophobicContact CE1-CD2 3.65Å; F73-L152 HydrophobicContact CE1-CG 4.06Å; F73-S156 WeakPolarHBondContact CB-OG 3.45Å; F73-S156 PolarHBondContact N-OG 3.05Å; F73-L159 HydrophobicContact CB-CD2 4.45Å; F73-L159 HydrophobicContact CD1-CD2 4.01Å; F73-L159 HydrophobicContact CD2-CD2 3.62Å; F73-L159 HydrophobicContact CE1-CD2 4.1Å; F73-L159 HydrophobicContact CE2-CD2 3.7Å; F73-L159 HydrophobicContact CG-CD2 3.78Å; F73-L159 HydrophobicContact CZ-CD2 3.96Å; F73-V211 HydrophobicContact CZ-CG1 4.4Å; F73-E214 HydrophobicContact CE2-CB 3.64Å; F73-E214 HydrophobicContact CE2-CG 4.41Å; F73-E214 HydrophobicContact CZ-CB 4.14Å; F73-I218 HydrophobicContact CE2-CD1 4.43Å
74	R	94.3	Very high	75.7	Confident	99 Å²	99	82.2 Å²	82.2	37%	0.374	44%	0.435	S	S	.	.	G	3₁₀ helix	trans	-54	-41.4	172.7	-176.4	-178.8	-178.9	-75.3	-8.9	113.1	S72 L76 F77 D79 L82 L152	S72-R74 PolarHBondContact O-N 3.01Å; R74-L76 PolarHBondContact O-N 3.19Å; R74-L76 VanDerWaalsContact O-N 3.14Å; R74-F77 PolarHBondContact O-N 3.24Å; R74-D79 IonicContact NH2-OD1 3.95Å; R74-L82 HydrophobicContact CG-CD1 4.16Å; R74-L152 WeakPolarHBondContact CB-O 3.48Å; R74-L152 WeakPolarHBondContact CD-O 3.45Å; R74-L152 WeakPolarHBondContact CG-O 3.45Å
75	Q	93.9	Very high	78.8	Confident	116 Å²	116	76.7 Å²	76.7	54%	0.542	40%	0.397	S	S	.	.	G	3₁₀ helix	trans	-70.5	-5.1	-175.9	-72	172.5	-35	0	0	113.9	K71 S72 F73	K71-Q75 VanDerWaalsContact CA-OE1 3.24Å; K71-Q75 HydrophobicContact CB-CB 4.24Å; S72-Q75 WeakPolarHBondContact O-CB 3.49Å; S72-Q75 PolarHBondContact O-N 2.63Å; S72-Q75 WeakPolarHBondContact OG-CG 3.42Å; F73-Q75 VanDerWaalsContact C-N 3.29Å; F73-Q75 PolarHBondContact O-N 3.16Å
76	L	94.5	Very high	82.1	Confident	38 Å²	38	73.5 Å²	73.5	20%	0.199	38%	0.379	C	S	.	.	G	3₁₀ helix	trans	-81.3	-19.8	174.8	-55.7	177.2	0	0	0	112.3	K71 F73 R74 H210 E214	K71-L76 HydrophobicContact CB-CD2 4.36Å; F73-L76 HydrophobicContact CD2-CD1 4.22Å; F73-L76 WeakPolarHBondContact O-CB 3.16Å; F73-L76 PolarHBondContact O-N 3.21Å; R74-L76 PolarHBondContact O-N 3.19Å; R74-L76 VanDerWaalsContact O-N 3.14Å; L76-H210 PolarHBondContact O-CE1 2.93Å; L76-H210 VanDerWaalsContact O-CE1 3.23Å; L76-E214 HydrophobicContact CD1-CG 4.03Å
77	F	96.8	Very high	85.4	Confident	15 Å²	15	72 Å²	72	7%	0.066	37%	0.369	C	S	.	.	S	Bend	trans	-109.4	145.2	-173.1	-57.6	-90.7	0	0	0	111.2	F73 R74 E81 L82 L85 L152 H210 V211 E214	F73-F77 HydrophobicContact CD1-CE2 4Å; F73-F77 AromaticContact CE1-CE2 3.78Å; F73-F77 HydrophobicContact CE1-CE2 3.78Å; F73-F77 HydrophobicContact CE1-CZ 4.15Å; F73-F77 HydrophobicContact CE2-CE2 4.46Å; F73-F77 HydrophobicContact CG-CE2 4.42Å; F73-F77 HydrophobicContact CZ-CE2 4.02Å; F73-F77 HydrophobicContact CZ-CZ 4.08Å; F73-F77 WeakPolarHBondContact O-CD2 3.39Å; F73-F77 VanDerWaalsContact O-CE2 3.3Å; F73-F77 WeakPolarHBondContact O-CE2 3.46Å; R74-F77 PolarHBondContact O-N 3.24Å; F77-E81 HydrophobicContact CB-CB 4.26Å; F77-E81 HydrophobicContact CD1-CB 4.45Å; F77-L82 HydrophobicContact CB-CD2 3.94Å; F77-L82 HydrophobicContact CB-CG 4.11Å; F77-L85 HydrophobicContact CD1-CD1 4.12Å; F77-L85 HydrophobicContact CE1-CD1 4.46Å; F77-L152 HydrophobicContact CD2-CD2 3.31Å; F77-L152 HydrophobicContact CE2-CD2 3.48Å; F77-L152 VanDerWaalsContact CE2-CD2 3.48Å; F77-L152 HydrophobicContact CG-CD2 3.99Å; F77-L152 HydrophobicContact CZ-CD2 4.26Å; F77-H210 HydrophobicContact CD1-CB 4.48Å; F77-H210 AromaticContact CD1-ND1 3.62Å; F77-H210 HydrophobicContact CE1-CB 3.92Å; F77-H210 AromaticContact CE1-CG 3.59Å; F77-H210 AromaticContact CE1-ND1 3.65Å; F77-V211 HydrophobicContact CD1-CG2 4.28Å; F77-V211 HydrophobicContact CE1-CB 4.28Å; F77-V211 HydrophobicContact CE1-CG2 3.44Å; F77-V211 VanDerWaalsContact CE1-CG2 3.44Å; F77-V211 HydrophobicContact CZ-CB 4.31Å; F77-V211 HydrophobicContact CZ-CG2 3.67Å; F77-E214 HydrophobicContact CZ-CG 4.16Å
78	S	97.2	Very high	88.5	Confident	55 Å²	55	65.7 Å²	65.7	39%	0.385	34%	0.337	S	S	.	.			trans	-74.6	160.1	170.2	62.4	0	0	0	0	111.8	L80 E81 L82	S78-L80 PolarHBondContact O-N 2.93Å; S78-E81 WeakPolarHBondContact CB-OE2 3.28Å; S78-E81 PolarHBondContact N-OE2 3.09Å; S78-E81 PolarHBondContact O-N 3.5Å; S78-E81 VanDerWaalsContact O-N 3.13Å; S78-E81 VanDerWaalsContact OG-CG 3.31Å; S78-E81 WeakPolarHBondContact OG-CG 3.33Å; S78-E81 PolarHBondContact OG-N 2.96Å; S78-E81 PolarHBondContact OG-OE2 3.19Å; S78-L82 WeakPolarHBondContact O-CG 3.31Å; S78-L82 PolarHBondContact O-N 2.79Å
79	D	96.8	Very high	91.4	Very high	113 Å²	113	63.7 Å²	63.7	60%	0.604	32%	0.322	S	S	*	.	H	α-helix	trans	-59.4	-37.1	177.6	-65.5	-32.6	0	0	0	111.8	R74 L82 D83	R74-D79 IonicContact NH2-OD1 3.95Å; D79-L82 PolarHBondContact O-N 2.97Å; D79-D83 PolarHBondContact O-N 3.25Å
80	L	97	Very high	93.9	Very high	109 Å²	109	59.1 Å²	59.1	57%	0.571	31%	0.307	S	S	*	.	H	α-helix	trans	-61.8	-44.9	174.5	179	64.2	0	0	0	112.1	S78 L82 D83 V84	S78-L80 PolarHBondContact O-N 2.93Å; L80-L82 VanDerWaalsContact C-N 3.32Å; L80-L82 PolarHBondContact O-N 2.93Å; L80-D83 PolarHBondContact O-N 2.9Å; L80-V84 VanDerWaalsContact O-CG2 3.3Å; L80-V84 WeakPolarHBondContact O-CG2 3.28Å; L80-V84 PolarHBondContact O-N 3.02Å; L80-V84 VanDerWaalsContact O-N 3.09Å
81	E	98.2	Very high	95.5	Very high	44 Å²	44	59 Å²	59	21%	0.206	31%	0.306	C	S	.	.	H	α-helix	trans	-63	-41.3	176	-73.2	167	113.3	0	0	111.2	F77 S78 V84 L85 A207 H210	F77-E81 HydrophobicContact CB-CB 4.26Å; F77-E81 HydrophobicContact CD1-CB 4.45Å; S78-E81 WeakPolarHBondContact CB-OE2 3.28Å; S78-E81 PolarHBondContact N-OE2 3.09Å; S78-E81 PolarHBondContact O-N 3.5Å; S78-E81 VanDerWaalsContact O-N 3.13Å; S78-E81 VanDerWaalsContact OG-CG 3.31Å; S78-E81 WeakPolarHBondContact OG-CG 3.33Å; S78-E81 PolarHBondContact OG-N 2.96Å; S78-E81 PolarHBondContact OG-OE2 3.19Å; E81-V84 PolarHBondContact O-N 3.12Å; E81-L85 WeakPolarHBondContact O-CB 3.35Å; E81-L85 WeakPolarHBondContact O-CD1 3.27Å; E81-L85 WeakPolarHBondContact O-CG 3.47Å; E81-L85 PolarHBondContact O-N 3.09Å; E81-A207 HydrophobicContact CB-CB 4.15Å; E81-A207 HydrophobicContact CG-CB 4.12Å; E81-H210 IonicContact OE1-CE1 3.73Å; E81-H210 IonicContact OE1-CG 3.23Å; E81-H210 IonicContact OE1-ND1 3.71Å; E81-H210 PolarHBondContact OE1-ND1 3.5Å
82	L	98	Very high	96.5	Very high	5 Å²	5	53.2 Å²	53.2	3%	0.026	28%	0.281	C	S	.	.	H	α-helix	trans	-61.2	-45.2	177.1	-68	176	0	0	0	111.5	R74 F77 S78 D79 L80 V84 L85 Y86 L152	R74-L82 HydrophobicContact CG-CD1 4.16Å; F77-L82 HydrophobicContact CB-CD2 3.94Å; F77-L82 HydrophobicContact CB-CG 4.11Å; S78-L82 WeakPolarHBondContact O-CG 3.31Å; S78-L82 PolarHBondContact O-N 2.79Å; D79-L82 PolarHBondContact O-N 2.97Å; L80-L82 VanDerWaalsContact C-N 3.32Å; L80-L82 PolarHBondContact O-N 2.93Å; L82-V84 VanDerWaalsContact C-N 3.32Å; L82-V84 PolarHBondContact O-N 3.01Å; L82-L85 PolarHBondContact O-N 2.82Å; L82-Y86 HydrophobicContact CB-CD2 4.26Å; L82-Y86 HydrophobicContact CB-CE2 3.96Å; L82-Y86 HydrophobicContact CD2-CE2 4.33Å; L82-Y86 WeakPolarHBondContact O-CB 3.4Å; L82-Y86 WeakPolarHBondContact O-CD2 3.42Å; L82-Y86 PolarHBondContact O-N 3.23Å; L82-L152 HydrophobicContact CD2-CB 4.04Å; L82-L152 HydrophobicContact CD2-CD1 4.36Å; L82-L152 HydrophobicContact CD2-CD2 3.92Å; L82-L152 HydrophobicContact CD2-CG 4.33Å
83	D	97.9	Very high	96.9	Very high	108 Å²	108	53.4 Å²	53.4	58%	0.578	28%	0.282	S	S	*	.	H	α-helix	trans	-60.2	-42.5	177.3	-73.4	-17.7	0	0	0	111.9	D79 L80 S87	D79-D83 PolarHBondContact O-N 3.25Å; L80-D83 PolarHBondContact O-N 2.9Å; D83-S87 VanDerWaalsContact O-CB 3.27Å; D83-S87 WeakPolarHBondContact O-CB 3.33Å; D83-S87 PolarHBondContact O-N 2.96Å; D83-S87 PolarHBondContact O-OG 3.25Å
84	V	98.2	Very high	97.1	Very high	18 Å²	18	62.3 Å²	62.3	11%	0.109	32%	0.321	C	S	.	.	H	α-helix	trans	-63.5	-46.2	175.7	169.6	0	0	0	0	111.5	L80 E81 L82 S87 T88 D203 V204 A207	L80-V84 VanDerWaalsContact O-CG2 3.3Å; L80-V84 WeakPolarHBondContact O-CG2 3.28Å; L80-V84 PolarHBondContact O-N 3.02Å; L80-V84 VanDerWaalsContact O-N 3.09Å; E81-V84 PolarHBondContact O-N 3.12Å; L82-V84 VanDerWaalsContact C-N 3.32Å; L82-V84 PolarHBondContact O-N 3.01Å; V84-S87 PolarHBondContact O-OG 2.83Å; V84-T88 WeakPolarHBondContact O-CB 3.43Å; V84-T88 WeakPolarHBondContact O-CG2 3.33Å; V84-T88 PolarHBondContact O-N 3.45Å; V84-T88 VanDerWaalsContact O-N 3.1Å; V84-T88 PolarHBondContact O-OG1 2.9Å; V84-D203 HydrophobicContact CG2-CB 4.31Å; V84-V204 HydrophobicContact CG1-CB 4.2Å; V84-V204 HydrophobicContact CG1-CG2 3.73Å; V84-A207 HydrophobicContact CB-CB 4.25Å; V84-A207 HydrophobicContact CG1-CB 3.84Å
85	L	98.2	Very high	97.3	Very high	0 Å²	0	61.5 Å²	61.5	0%	0	32%	0.324	C	S	.	.	H	α-helix	trans	-64.5	-44.9	-179.8	-70	165.5	0	0	0	111.3	F77 E81 L82 W89 L152 A207 W208 V211	F77-L85 HydrophobicContact CD1-CD1 4.12Å; F77-L85 HydrophobicContact CE1-CD1 4.46Å; E81-L85 WeakPolarHBondContact O-CB 3.35Å; E81-L85 WeakPolarHBondContact O-CD1 3.27Å; E81-L85 WeakPolarHBondContact O-CG 3.47Å; E81-L85 PolarHBondContact O-N 3.09Å; L82-L85 PolarHBondContact O-N 2.82Å; L85-W89 WeakPolarHBondContact O-CB 3.48Å; L85-W89 PolarHBondContact O-N 3.05Å; L85-L152 HydrophobicContact CB-CD1 4.32Å; L85-L152 HydrophobicContact CD1-CD1 3.74Å; L85-A207 HydrophobicContact CD2-CB 4.16Å; L85-A207 HydrophobicContact CG-CB 4.06Å; L85-W208 HydrophobicContact CD2-CD2 3.68Å; L85-W208 HydrophobicContact CD2-CE3 4.08Å; L85-W208 HydrophobicContact CD2-CG 3.95Å; L85-W208 HydrophobicContact CD2-CH2 4.42Å; L85-W208 HydrophobicContact CD2-CZ2 4.09Å; L85-W208 HydrophobicContact CD2-CZ3 4.43Å; L85-V211 HydrophobicContact CD1-CG2 3.53Å; L85-V211 HydrophobicContact CD2-CG2 3.7Å; L85-V211 HydrophobicContact CG-CG2 4.28Å
86	Y	97.7	Very high	97.4	Very high	80 Å²	80	58.7 Å²	58.7	31%	0.314	32%	0.316	S	S	.	.	H	α-helix	trans	-70.7	-35.9	-179.6	-67	-43.8	0	0	0	113.4	L82 P90 V149 L152 E153	L82-Y86 HydrophobicContact CB-CD2 4.26Å; L82-Y86 HydrophobicContact CB-CE2 3.96Å; L82-Y86 HydrophobicContact CD2-CE2 4.33Å; L82-Y86 WeakPolarHBondContact O-CB 3.4Å; L82-Y86 WeakPolarHBondContact O-CD2 3.42Å; L82-Y86 PolarHBondContact O-N 3.23Å; Y86-P90 WeakPolarHBondContact O-CD 3.37Å; Y86-V149 HydrophobicContact CE1-CG1 4.49Å; Y86-L152 HydrophobicContact CE1-CB 4.24Å; Y86-L152 VanDerWaalsContact OH-CB 3.31Å; Y86-L152 WeakPolarHBondContact OH-CB 3.27Å; Y86-L152 PolarHBondContact OH-O 3.47Å; Y86-E153 HydrophobicContact CE1-CG 4.48Å; Y86-E153 PolarHBondContact OH-N 2.93Å
87	S	97.6	Very high	97.6	Very high	79 Å²	79	60.5 Å²	60.5	55%	0.552	33%	0.325	S	S	*	.	H	α-helix	trans	-70.9	-36.5	177.3	56.7	0	0	0	0	112.7	D83 V84	D83-S87 VanDerWaalsContact O-CB 3.27Å; D83-S87 WeakPolarHBondContact O-CB 3.33Å; D83-S87 PolarHBondContact O-N 2.96Å; D83-S87 PolarHBondContact O-OG 3.25Å; V84-S87 PolarHBondContact O-OG 2.83Å
88	T	98.3	Very high	97.6	Very high	10 Å²	10	66.3 Å²	66.3	6%	0.061	35%	0.346	C	S	.	.	H	α-helix	trans	-89.9	-27.9	-176.5	57.5	0	0	0	0	114.2	V84 L91 L92 I196 V204 W208	V84-T88 WeakPolarHBondContact O-CB 3.43Å; V84-T88 WeakPolarHBondContact O-CG2 3.33Å; V84-T88 PolarHBondContact O-N 3.45Å; V84-T88 VanDerWaalsContact O-N 3.1Å; V84-T88 PolarHBondContact O-OG1 2.9Å; T88-L91 WeakPolarHBondContact O-CB 3.36Å; T88-L91 PolarHBondContact O-N 2.93Å; T88-L92 WeakPolarHBondContact O-CG 3.43Å; T88-L92 PolarHBondContact O-N 3.35Å; T88-I196 HydrophobicContact CG2-CD1 4.27Å; T88-V204 HydrophobicContact CG2-CG1 4.13Å; T88-V204 HydrophobicContact CG2-CG2 3.83Å; T88-W208 PolarHBondContact OG1-NE1 3.04Å
89	W	98.2	Very high	97.6	Very high	25 Å²	25	64 Å²	64	10%	0.095	33%	0.33	C	S	.	.	H	α-helix	trans	-54.7	-44.6	-177.9	176.5	-120.1	0	0	0	114.4	L85 L91 L92 S93 M142 I145 H146 V149 W192 W208	L85-W89 WeakPolarHBondContact O-CB 3.48Å; L85-W89 PolarHBondContact O-N 3.05Å; W89-L91 PolarHBondContact O-N 2.98Å; W89-L92 HydrophobicContact CE3-CB 4.22Å; W89-L92 PolarHBondContact O-N 3.3Å; W89-L92 VanDerWaalsContact O-N 3.1Å; W89-S93 WeakPolarHBondContact O-CB 3.33Å; W89-S93 PolarHBondContact O-N 3.18Å; W89-S93 PolarHBondContact O-OG 3.04Å; W89-S93 VanDerWaalsContact O-OG 3.07Å; W89-M142 HydrophobicContact CH2-CE 3.94Å; W89-M142 HydrophobicContact CZ3-CE 4.14Å; W89-I145 HydrophobicContact CE3-CG2 4.45Å; W89-I145 HydrophobicContact CH2-CB 4.23Å; W89-I145 HydrophobicContact CH2-CG2 3.68Å; W89-I145 HydrophobicContact CZ3-CB 4.49Å; W89-I145 HydrophobicContact CZ3-CG2 3.54Å; W89-H146 HydrophobicContact CH2-CB 4.44Å; W89-H146 HydrophobicContact CZ2-CB 3.85Å; W89-H146 AromaticContact CZ2-ND1 3.69Å; W89-H146 AromaticContact NE1-ND1 3.75Å; W89-V149 HydrophobicContact CD2-CG2 3.85Å; W89-V149 HydrophobicContact CE3-CG2 4.25Å; W89-V149 HydrophobicContact CG-CG1 4.05Å; W89-V149 HydrophobicContact CG-CG2 4.04Å; W89-W192 HydrophobicContact CZ3-CZ2 4.4Å; W89-W208 HydrophobicContact CB-CH2 4.28Å; W89-W208 HydrophobicContact CB-CZ2 4.02Å; W89-W208 HydrophobicContact CD2-CH2 4.04Å; W89-W208 AromaticContact CE3-CH2 3.31Å; W89-W208 HydrophobicContact CE3-CH2 3.31Å; W89-W208 AromaticContact CE3-CZ2 3.84Å; W89-W208 HydrophobicContact CE3-CZ2 3.84Å; W89-W208 HydrophobicContact CE3-CZ3 4.27Å; W89-W208 HydrophobicContact CG-CH2 4.47Å; W89-W208 AromaticContact CZ3-CH2 3.91Å; W89-W208 HydrophobicContact CZ3-CH2 3.91Å; W89-W208 HydrophobicContact CZ3-CZ3 4.48Å
90	P	97.5	Very high	97.6	Very high	77 Å²	77	58.7 Å²	58.7	50%	0.5	30%	0.301	S	S	.	.	H	α-helix	trans	-57.4	-32.5	177.3	-26.4	35.6	0	0	0	114.1	Y86 K94	Y86-P90 WeakPolarHBondContact O-CD 3.37Å; P90-K94 PolarHBondContact O-N 3.02Å
91	L	97.2	Very high	97.6	Very high	95 Å²	95	53.5 Å²	53.5	50%	0.497	27%	0.274	S	S	.	.	H	α-helix	trans	-70.1	-46.1	176.8	-56.1	176.9	0	0	0	110.6	T88 W89 K94 I196	T88-L91 WeakPolarHBondContact O-CB 3.36Å; T88-L91 PolarHBondContact O-N 2.93Å; W89-L91 PolarHBondContact O-N 2.98Å; L91-K94 WeakPolarHBondContact O-CB 3.46Å; L91-K94 PolarHBondContact O-N 3.43Å; L91-I196 HydrophobicContact CB-CG2 3.82Å; L91-I196 HydrophobicContact CD1-CG2 4.19Å
92	L	97.7	Very high	97.6	Very high	0 Å²	0	52.8 Å²	52.8	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-73.2	-32.8	-175.6	-62.3	164.7	0	0	0	112.5	T88 W89 T99 W192 L195 I196 W208	T88-L92 WeakPolarHBondContact O-CG 3.43Å; T88-L92 PolarHBondContact O-N 3.35Å; W89-L92 HydrophobicContact CE3-CB 4.22Å; W89-L92 PolarHBondContact O-N 3.3Å; W89-L92 VanDerWaalsContact O-N 3.1Å; L92-T99 PolarHBondContact O-OG1 3.37Å; L92-W192 HydrophobicContact CB-CZ2 4.26Å; L92-W192 HydrophobicContact CD1-CD2 4.2Å; L92-W192 HydrophobicContact CD1-CG 3.96Å; L92-W192 VanDerWaalsContact CD1-NE1 3.3Å; L92-W192 HydrophobicContact CD2-CB 3.9Å; L92-W192 HydrophobicContact CD2-CD2 3.58Å; L92-W192 HydrophobicContact CD2-CE3 4.06Å; L92-W192 HydrophobicContact CD2-CG 3.51Å; L92-W192 HydrophobicContact CG-CD2 4.31Å; L92-W192 HydrophobicContact CG-CG 4.31Å; L92-L195 HydrophobicContact CD2-CB 4.4Å; L92-I196 HydrophobicContact CD2-CD1 4.48Å; L92-I196 HydrophobicContact CD2-CG2 3.77Å; L92-I196 HydrophobicContact CG-CG2 4.32Å; L92-W208 HydrophobicContact CD1-CD2 4.4Å; L92-W208 HydrophobicContact CD1-CH2 4.48Å; L92-W208 HydrophobicContact CD1-CZ2 3.56Å
93	S	97.2	Very high	97.6	Very high	35 Å²	35	52.6 Å²	52.6	25%	0.245	27%	0.271	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.5	3.6	-180	75.6	0	0	0	0	114	W89 N95 P96	W89-S93 WeakPolarHBondContact O-CB 3.33Å; W89-S93 PolarHBondContact O-N 3.18Å; W89-S93 PolarHBondContact O-OG 3.04Å; W89-S93 VanDerWaalsContact O-OG 3.07Å; S93-N95 VanDerWaalsContact C-N 3.28Å; S93-N95 PolarHBondContact O-N 2.99Å; S93-P96 WeakPolarHBondContact O-CD 3.17Å
94	K	97.3	Very high	97.6	Very high	187 Å²	187	47.6 Å²	47.6	81%	0.813	24%	0.244	S	C	*	.	S	Bend	trans	-58.3	-36.4	-176	-175.6	175.8	-178.8	176.5	0	113.4	P90 L91	P90-K94 PolarHBondContact O-N 3.02Å; L91-K94 WeakPolarHBondContact O-CB 3.46Å; L91-K94 PolarHBondContact O-N 3.43Å
95	N	97	Very high	97.5	Very high	82 Å²	82	49.6 Å²	49.6	44%	0.439	25%	0.251	S	S	.	.	S	Bend	trans	-138	77.8	174.6	-172	-20.2	0	0	0	109.5	S93 I97 R98 T99	S93-N95 VanDerWaalsContact C-N 3.28Å; S93-N95 PolarHBondContact O-N 2.99Å; N95-I97 VanDerWaalsContact C-N 3.35Å; N95-I97 PolarHBondContact O-N 2.63Å; N95-R98 HydrophobicContact CB-CB 4.21Å; N95-R98 VanDerWaalsContact CG-CB 3.4Å; N95-R98 PolarHBondContact O-N 2.89Å; N95-R98 VanDerWaalsContact OD1-CB 3.28Å; N95-R98 WeakPolarHBondContact OD1-CB 3.44Å; N95-R98 PolarHBondContact OD1-N 2.96Å; N95-T99 WeakPolarHBondContact O-CB 3.3Å; N95-T99 PolarHBondContact O-N 3.11Å; N95-T99 PolarHBondContact O-OG1 2.89Å
96	P	97.4	Very high	97.4	Very high	57 Å²	57	49.8 Å²	49.8	37%	0.37	25%	0.252	S	S	.	.	H	α-helix	trans	-62.3	-43.3	-165.3	24.3	-31.5	0	0	0	111.1	S93 R98 T99 G100 M142	S93-P96 WeakPolarHBondContact O-CD 3.17Å; P96-R98 PolarHBondContact O-N 3.44Å; P96-T99 WeakPolarHBondContact O-CB 3.26Å; P96-T99 PolarHBondContact O-N 3.08Å; P96-G100 PolarHBondContact O-N 3.11Å; P96-M142 HydrophobicContact CB-CB 3.99Å; P96-M142 HydrophobicContact CB-CE 4.25Å; P96-M142 HydrophobicContact CB-CG 4.22Å; P96-M142 VanDerWaalsContact O-CG 3.24Å; P96-M142 WeakPolarHBondContact O-CG 3.28Å
97	I	97.7	Very high	97.4	Very high	76 Å²	76	46 Å²	46	39%	0.39	24%	0.237	S	C	.	.	H	α-helix	trans	-61.7	-46.8	-179	-59.3	177.6	0	0	0	110.8	N95 G100 C101 K135 A139	N95-I97 VanDerWaalsContact C-N 3.35Å; N95-I97 PolarHBondContact O-N 2.63Å; I97-G100 PolarHBondContact O-N 3.39Å; I97-C101 PolarHBondContact O-N 3.04Å; I97-C101 PolarHBondContact O-SG 3.07Å; I97-C101 VanDerWaalsContact O-SG 3.33Å; I97-K135 HydrophobicContact CG2-CB 3.76Å; I97-K135 HydrophobicContact CG2-CG 3.78Å; I97-A139 HydrophobicContact CG1-CB 4.32Å
98	R	96.5	Very high	97.3	Very high	137 Å²	137	43.4 Å²	43.4	52%	0.517	22%	0.216	S	C	.	.	H	α-helix	trans	-64.3	-42.9	177.6	-173	177.1	-174	-85.3	-0.5	111.7	N95 P96 G100 C101 L102	N95-R98 HydrophobicContact CB-CB 4.21Å; N95-R98 VanDerWaalsContact CG-CB 3.4Å; N95-R98 PolarHBondContact O-N 2.89Å; N95-R98 VanDerWaalsContact OD1-CB 3.28Å; N95-R98 WeakPolarHBondContact OD1-CB 3.44Å; N95-R98 PolarHBondContact OD1-N 2.96Å; P96-R98 PolarHBondContact O-N 3.44Å; R98-G100 VanDerWaalsContact C-N 3.33Å; R98-G100 PolarHBondContact O-N 3.38Å; R98-C101 PolarHBondContact O-N 2.91Å; R98-L102 WeakPolarHBondContact O-CG 3.49Å; R98-L102 PolarHBondContact O-N 2.63Å
99	T	97.7	Very high	97.1	Very high	8 Å²	8	48.6 Å²	48.6	5%	0.049	24%	0.24	C	C	.	.	H	α-helix	trans	-56.7	-46.8	175.6	-66.2	0	0	0	0	111	L92 N95 P96 C101 L102 I103 M142 T191 W192 L195	L92-T99 PolarHBondContact O-OG1 3.37Å; N95-T99 WeakPolarHBondContact O-CB 3.3Å; N95-T99 PolarHBondContact O-N 3.11Å; N95-T99 PolarHBondContact O-OG1 2.89Å; P96-T99 WeakPolarHBondContact O-CB 3.26Å; P96-T99 PolarHBondContact O-N 3.08Å; T99-C101 PolarHBondContact O-N 3.16Å; T99-L102 WeakPolarHBondContact O-CB 3.28Å; T99-L102 PolarHBondContact O-N 3.26Å; T99-I103 WeakPolarHBondContact O-CG1 3.45Å; T99-I103 PolarHBondContact O-N 3.01Å; T99-I103 VanDerWaalsContact O-N 3.08Å; T99-M142 HydrophobicContact CG2-CE 3.93Å; T99-M142 HydrophobicContact CG2-SD 4.05Å; T99-T191 HydrophobicContact CG2-CG2 4.35Å; T99-W192 HydrophobicContact CG2-CE3 4.18Å; T99-W192 HydrophobicContact CG2-CH2 3.5Å; T99-W192 VanDerWaalsContact CG2-CH2 3.5Å; T99-W192 HydrophobicContact CG2-CZ3 3.15Å; T99-L195 HydrophobicContact CG2-CD1 3.72Å
100	G	97.8	Very high	96.9	Very high	0 Å²	0	48.2 Å²	48.2	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-61.9	-39	175.2	0	0	0	0	0	113.5	P96 I97 R98 L102 I103 F104 S138	P96-G100 PolarHBondContact O-N 3.11Å; I97-G100 PolarHBondContact O-N 3.39Å; R98-G100 VanDerWaalsContact C-N 3.33Å; R98-G100 PolarHBondContact O-N 3.38Å; G100-L102 VanDerWaalsContact C-N 3.3Å; G100-L102 PolarHBondContact O-N 3.18Å; G100-I103 WeakPolarHBondContact O-CB 3.34Å; G100-I103 PolarHBondContact O-N 3.28Å; G100-I103 VanDerWaalsContact O-N 3.17Å; G100-F104 WeakPolarHBondContact O-CD2 3.36Å; G100-F104 PolarHBondContact O-N 3.04Å; G100-S138 VanDerWaalsContact C-CB 3.49Å; G100-S138 PolarHBondContact O-OG 2.97Å
101	C	97.4	Very high	96.7	Very high	0 Å²	0	45 Å²	45	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-64.3	-37.3	175.4	-65.8	0	0	0	0	111.8	I97 R98 T99 I103 F104 K105 V129 S138	I97-C101 PolarHBondContact O-N 3.04Å; I97-C101 PolarHBondContact O-SG 3.07Å; I97-C101 VanDerWaalsContact O-SG 3.33Å; R98-C101 PolarHBondContact O-N 2.91Å; T99-C101 PolarHBondContact O-N 3.16Å; C101-I103 VanDerWaalsContact C-N 3.31Å; C101-I103 PolarHBondContact O-N 3.23Å; C101-F104 PolarHBondContact O-N 3.18Å; C101-K105 PolarHBondContact O-N 3.21Å; C101-V129 HydrophobicContact CB-CB 4.2Å; C101-V129 HydrophobicContact CB-CG1 4.06Å; C101-S138 WeakPolarHBondContact CA-OG 3.23Å; C101-S138 PolarHBondContact N-OG 3.05Å; C101-S138 PolarHBondContact SG-OG 3.32Å
102	L	97.1	Very high	96.6	Very high	30 Å²	30	44.6 Å²	44.6	16%	0.157	22%	0.22	C	C	.	.	H	α-helix	trans	-65.3	-34	174.8	-67.9	174.1	0	0	0	112.1	R98 T99 G100 K105 N106 V129 T191 L195	R98-L102 WeakPolarHBondContact O-CG 3.49Å; R98-L102 PolarHBondContact O-N 2.63Å; T99-L102 WeakPolarHBondContact O-CB 3.28Å; T99-L102 PolarHBondContact O-N 3.26Å; G100-L102 VanDerWaalsContact C-N 3.3Å; G100-L102 PolarHBondContact O-N 3.18Å; L102-K105 HydrophobicContact CD2-CD 4.47Å; L102-K105 WeakPolarHBondContact O-CB 3.43Å; L102-K105 PolarHBondContact O-N 3.49Å; L102-N106 VanDerWaalsContact O-CB 3.29Å; L102-N106 WeakPolarHBondContact O-CB 3.31Å; L102-N106 PolarHBondContact O-N 3.35Å; L102-N106 PolarHBondContact O-ND2 3.15Å; L102-N106 PolarHBondContact O-OD1 3.01Å; L102-V129 HydrophobicContact CD2-CG1 4.33Å; L102-T191 HydrophobicContact CB-CG2 3.83Å; L102-L195 HydrophobicContact CD1-CD2 4.19Å
103	I	97.9	Very high	96.3	Very high	0 Å²	0	48.9 Å²	48.9	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-59.4	-47.4	172.8	-66.7	162.7	0	0	0	110.2	T99 G100 C101 N106 A107 M142 A187 I188 T191 W192	T99-I103 WeakPolarHBondContact O-CG1 3.45Å; T99-I103 PolarHBondContact O-N 3.01Å; T99-I103 VanDerWaalsContact O-N 3.08Å; G100-I103 WeakPolarHBondContact O-CB 3.34Å; G100-I103 PolarHBondContact O-N 3.28Å; G100-I103 VanDerWaalsContact O-N 3.17Å; C101-I103 VanDerWaalsContact C-N 3.31Å; C101-I103 PolarHBondContact O-N 3.23Å; I103-N106 WeakPolarHBondContact O-CB 3.46Å; I103-N106 PolarHBondContact O-N 3.31Å; I103-A107 WeakPolarHBondContact O-CB 3.44Å; I103-A107 PolarHBondContact O-N 2.94Å; I103-M142 HydrophobicContact CD1-SD 3.97Å; I103-A187 HydrophobicContact CG2-CB 4.11Å; I103-A187 WeakPolarHBondContact O-CB 3.41Å; I103-I188 HydrophobicContact CD1-CB 4.48Å; I103-I188 HydrophobicContact CD1-CG1 3.72Å; I103-I188 HydrophobicContact CG1-CG1 4.01Å; I103-I188 HydrophobicContact CG2-CG1 3.72Å; I103-T191 WeakPolarHBondContact CA-OG1 3.24Å; I103-T191 HydrophobicContact CG1-CG2 4.1Å; I103-T191 WeakPolarHBondContact CG1-OG1 3.31Å; I103-W192 HydrophobicContact CD1-CH2 3.98Å; I103-W192 HydrophobicContact CD1-CZ3 3.84Å; I103-W192 HydrophobicContact CG1-CZ3 4.28Å
104	F	97.5	Very high	96.1	Very high	4 Å²	4	47.5 Å²	47.5	2%	0.018	23%	0.229	C	C	.	.	H	α-helix	trans	-68.6	-36.3	178.2	-75.9	-70	0	0	0	113.3	G100 C101 N106 A107 F108 F118 F120 H137 V141 I184	G100-F104 WeakPolarHBondContact O-CD2 3.36Å; G100-F104 PolarHBondContact O-N 3.04Å; C101-F104 PolarHBondContact O-N 3.18Å; F104-N106 VanDerWaalsContact C-N 3.3Å; F104-N106 PolarHBondContact O-N 3Å; F104-A107 PolarHBondContact O-N 3.36Å; F104-F108 HydrophobicContact CB-CE2 4.48Å; F104-F108 HydrophobicContact CB-CZ 4.46Å; F104-F108 HydrophobicContact CD1-CE1 4.35Å; F104-F108 HydrophobicContact CD1-CZ 4.26Å; F104-F108 WeakPolarHBondContact O-CD2 3.42Å; F104-F108 VanDerWaalsContact O-CG 3.26Å; F104-F108 WeakPolarHBondContact O-CG 3.31Å; F104-F108 PolarHBondContact O-N 2.68Å; F104-F118 HydrophobicContact CD1-CE1 4.39Å; F104-F118 HydrophobicContact CD1-CZ 4.23Å; F104-F118 HydrophobicContact CE1-CD1 4.43Å; F104-F118 AromaticContact CE1-CE1 3.65Å; F104-F118 HydrophobicContact CE1-CE1 3.65Å; F104-F118 HydrophobicContact CE1-CE2 4.21Å; F104-F118 AromaticContact CE1-CZ 3.53Å; F104-F118 HydrophobicContact CE1-CZ 3.53Å; F104-F118 HydrophobicContact CZ-CE1 4.13Å; F104-F118 HydrophobicContact CZ-CZ 4.36Å; F104-F120 HydrophobicContact CB-CE2 4.25Å; F104-F120 HydrophobicContact CD1-CE2 4.29Å; F104-F120 HydrophobicContact CD1-CZ 4.41Å; F104-F120 HydrophobicContact CD2-CZ 4.47Å; F104-F120 HydrophobicContact CG-CE2 4.12Å; F104-F120 HydrophobicContact CG-CZ 4.32Å; F104-H137 AromaticContact CE2-CD2 3.6Å; F104-H137 AromaticContact CZ-CD2 3.27Å; F104-H137 WeakPolarHBondContact CZ-CD2 3.35Å; F104-H137 AromaticContact CZ-NE2 3.79Å; F104-V141 HydrophobicContact CE2-CG2 3.96Å; F104-V141 HydrophobicContact CZ-CG2 3.89Å; F104-I184 HydrophobicContact CE1-CD1 4.1Å
105	K	96.5	Very high	96	Very high	60 Å²	60	40 Å²	40	26%	0.261	20%	0.2	S	C	.	.	H	α-helix	trans	-54.9	-49.6	170.7	-179.7	169.7	173	154.7	0	110.8	C101 L102 E109 P125 L128	C101-K105 PolarHBondContact O-N 3.21Å; L102-K105 HydrophobicContact CD2-CD 4.47Å; L102-K105 WeakPolarHBondContact O-CB 3.43Å; L102-K105 PolarHBondContact O-N 3.49Å; K105-E109 PolarHBondContact O-N 3.41Å; K105-P125 HydrophobicContact CD-CB 4.12Å; K105-P125 HydrophobicContact CG-CB 4.23Å; K105-P125 PolarHBondContact NZ-O 2.97Å; K105-L128 HydrophobicContact CB-CD2 3.86Å
106	N	96.4	Very high	95.9	Very high	4 Å²	4	41.1 Å²	41.1	2%	0.021	21%	0.21	C	C	.	.	H	α-helix	trans	-65.5	-40	178.8	-73.4	-5.8	0	0	0	112.1	L102 I103 F104 F108 E109 I110 A187 M190 T191 R194	L102-N106 VanDerWaalsContact O-CB 3.29Å; L102-N106 WeakPolarHBondContact O-CB 3.31Å; L102-N106 PolarHBondContact O-N 3.35Å; L102-N106 PolarHBondContact O-ND2 3.15Å; L102-N106 PolarHBondContact O-OD1 3.01Å; I103-N106 WeakPolarHBondContact O-CB 3.46Å; I103-N106 PolarHBondContact O-N 3.31Å; F104-N106 VanDerWaalsContact C-N 3.3Å; F104-N106 PolarHBondContact O-N 3Å; N106-F108 PolarHBondContact O-N 2.73Å; N106-E109 WeakPolarHBondContact O-CB 3.29Å; N106-E109 PolarHBondContact O-N 3.5Å; N106-I110 WeakPolarHBondContact O-CD1 3.27Å; N106-I110 VanDerWaalsContact O-CG1 3.27Å; N106-I110 WeakPolarHBondContact O-CG1 3.48Å; N106-I110 PolarHBondContact O-N 3.01Å; N106-A187 HydrophobicContact CB-CB 4.06Å; N106-M190 HydrophobicContact CB-CE 3.32Å; N106-M190 VanDerWaalsContact CG-CE 3.42Å; N106-T191 PolarHBondContact ND2-N 3Å; N106-T191 PolarHBondContact ND2-OG1 3.13Å; N106-R194 PolarHBondContact OD1-NH1 2.95Å
107	A	96.8	Very high	95.8	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-66.3	-38.5	179.9	0	0	0	0	0	112.4	I103 F104 E109 I110 H111 L114 I184 A187	I103-A107 WeakPolarHBondContact O-CB 3.44Å; I103-A107 PolarHBondContact O-N 2.94Å; F104-A107 PolarHBondContact O-N 3.36Å; A107-E109 VanDerWaalsContact C-N 3.33Å; A107-I110 PolarHBondContact O-N 3.37Å; A107-H111 PolarHBondContact O-N 3.37Å; A107-L114 HydrophobicContact CB-CD2 4Å; A107-I184 HydrophobicContact CB-CD1 3.87Å; A107-A187 HydrophobicContact CB-CB 3.68Å
108	F	95.7	Very high	95.7	Very high	25 Å²	25	39 Å²	39	11%	0.11	19%	0.192	C	C	.	.	H	α-helix	trans	-73.1	-26.8	175.9	-59.6	-19.5	0	0	0	112.5	F104 N106 P112 L114 F118 F120 L128	F104-F108 HydrophobicContact CB-CE2 4.48Å; F104-F108 HydrophobicContact CB-CZ 4.46Å; F104-F108 HydrophobicContact CD1-CE1 4.35Å; F104-F108 HydrophobicContact CD1-CZ 4.26Å; F104-F108 WeakPolarHBondContact O-CD2 3.42Å; F104-F108 VanDerWaalsContact O-CG 3.26Å; F104-F108 WeakPolarHBondContact O-CG 3.31Å; F104-F108 PolarHBondContact O-N 2.68Å; N106-F108 PolarHBondContact O-N 2.73Å; F108-P112 VanDerWaalsContact O-CA 3.28Å; F108-P112 WeakPolarHBondContact O-CA 3.49Å; F108-P112 WeakPolarHBondContact O-CG 3.27Å; F108-L114 HydrophobicContact CD1-CB 4.29Å; F108-L114 HydrophobicContact CE1-CB 4.49Å; F108-L114 HydrophobicContact CE1-CG 4.4Å; F108-F118 AromaticContact CE1-CD2 3.65Å; F108-F118 HydrophobicContact CE1-CD2 3.65Å; F108-F118 AromaticContact CE1-CE2 3.96Å; F108-F118 HydrophobicContact CE1-CE2 3.96Å; F108-F118 HydrophobicContact CZ-CB 4.22Å; F108-F118 AromaticContact CZ-CD2 3.62Å; F108-F118 HydrophobicContact CZ-CD2 3.62Å; F108-F118 HydrophobicContact CZ-CE2 4.28Å; F108-F118 HydrophobicContact CZ-CG 4.06Å; F108-F120 AromaticContact CE2-CD2 3.97Å; F108-F120 HydrophobicContact CE2-CD2 3.97Å; F108-F120 AromaticContact CE2-CE2 3.93Å; F108-F120 HydrophobicContact CE2-CE2 3.93Å; F108-F120 HydrophobicContact CZ-CD2 4.11Å; F108-F120 AromaticContact CZ-CE2 3.71Å; F108-F120 HydrophobicContact CZ-CE2 3.71Å; F108-L128 HydrophobicContact CD2-CD2 4.19Å; F108-L128 HydrophobicContact CE2-CD1 4.13Å; F108-L128 HydrophobicContact CE2-CD2 4.36Å
109	E	94.2	Very high	95.6	Very high	118 Å²	118	36.3 Å²	36.3	55%	0.551	19%	0.193	S	C	*	.	H	α-helix	trans	-67.2	-45.2	168.9	-172.5	-177.6	176.1	0	0	111.1	K105 N106 A107 R194	K105-E109 PolarHBondContact O-N 3.41Å; N106-E109 WeakPolarHBondContact O-CB 3.29Å; N106-E109 PolarHBondContact O-N 3.5Å; A107-E109 VanDerWaalsContact C-N 3.33Å; E109-R194 IonicContact OE1-NH2 3.5Å; E109-R194 IonicContact OE2-NH1 3.38Å; E109-R194 PolarHBondContact OE2-NH1 3.25Å; E109-R194 IonicContact OE2-NH2 3.67Å
110	I	94.2	Very high	95.5	Very high	17 Å²	17	36 Å²	36	9%	0.087	19%	0.191	C	C	.	.	H	α-helix	trans	-67.7	-44	179.6	-68.9	163.3	0	0	0	111.8	N106 A107 I183 E186 A187 M190 N283	N106-I110 WeakPolarHBondContact O-CD1 3.27Å; N106-I110 VanDerWaalsContact O-CG1 3.27Å; N106-I110 WeakPolarHBondContact O-CG1 3.48Å; N106-I110 PolarHBondContact O-N 3.01Å; A107-I110 PolarHBondContact O-N 3.37Å; I110-I183 HydrophobicContact CB-CG2 4.35Å; I110-I183 HydrophobicContact CG2-CG2 3.89Å; I110-E186 HydrophobicContact CD1-CB 4.22Å; I110-E186 HydrophobicContact CD1-CG 3.84Å; I110-A187 HydrophobicContact CD1-CB 3.96Å; I110-M190 HydrophobicContact CD1-CE 3.9Å; I110-M190 HydrophobicContact CG1-CE 4.09Å; I110-N283 HydrophobicContact CG2-CB 3.76Å; I110-N283 PolarHBondContact O-ND2 2.97Å
111	H	94.2	Very high	95.4	Very high	11 Å²	11	36.5 Å²	36.5	5%	0.051	20%	0.196	C	C	.	.			trans	-143.1	90.3	-178.6	-167	71	0	0	0	111.1	A107 K113 L114 Y180 I183	A107-H111 PolarHBondContact O-N 3.37Å; H111-K113 PolarHBondContact O-N 3.03Å; H111-K113 VanDerWaalsContact O-N 3.11Å; H111-L114 WeakPolarHBondContact O-CB 3.44Å; H111-L114 PolarHBondContact O-N 3.26Å; H111-Y180 AromaticContact NE2-CE1 3.91Å; H111-I183 HydrophobicContact CB-CD1 3.62Å; H111-I183 HydrophobicContact CB-CG1 4.27Å; H111-I183 HydrophobicContact CB-CG2 4Å
112	P	93.5	Very high	95.2	Very high	85 Å²	85	43.9 Å²	43.9	55%	0.552	23%	0.23	S	C	*	.	G	3₁₀ helix	trans	-56	-32.9	-174.2	-30.2	35.7	0	0	0	115.1	F108 L114 S115	F108-P112 VanDerWaalsContact O-CA 3.28Å; F108-P112 WeakPolarHBondContact O-CA 3.49Å; F108-P112 WeakPolarHBondContact O-CG 3.27Å; P112-L114 PolarHBondContact O-N 3.43Å; P112-L114 VanDerWaalsContact O-N 3.16Å; P112-S115 VanDerWaalsContact O-CB 3.28Å; P112-S115 WeakPolarHBondContact O-CB 3.47Å; P112-S115 PolarHBondContact O-N 3.17Å; P112-S115 PolarHBondContact O-OG 3.44Å
113	K	92.1	Very high	95.1	Very high	90 Å²	90	44.8 Å²	44.8	39%	0.391	24%	0.235	S	C	.	.	G	3₁₀ helix	trans	-59.6	-24.7	176.2	-176.4	-176.4	179.8	-174.6	0	112.5	H111 S115 T116 E276	H111-K113 PolarHBondContact O-N 3.03Å; H111-K113 VanDerWaalsContact O-N 3.11Å; K113-S115 PolarHBondContact O-N 2.85Å; K113-T116 PolarHBondContact O-N 3.08Å; K113-T116 PolarHBondContact O-OG1 3.26Å; K113-E276 IonicContact NZ-OE1 2.63Å; K113-E276 PolarHBondContact NZ-OE1 3.35Å
114	L	93.4	Very high	94.9	Very high	6 Å²	6	47.6 Å²	47.6	3%	0.031	25%	0.254	C	S	.	.	G	3₁₀ helix	trans	-63.1	-26.9	176.6	-167.2	60	0	0	0	112.3	A107 F108 H111 P112 T116 F117 F118 Y180 I183 I184	A107-L114 HydrophobicContact CB-CD2 4Å; F108-L114 HydrophobicContact CD1-CB 4.29Å; F108-L114 HydrophobicContact CE1-CB 4.49Å; F108-L114 HydrophobicContact CE1-CG 4.4Å; H111-L114 WeakPolarHBondContact O-CB 3.44Å; H111-L114 PolarHBondContact O-N 3.26Å; P112-L114 PolarHBondContact O-N 3.43Å; P112-L114 VanDerWaalsContact O-N 3.16Å; L114-T116 PolarHBondContact O-N 2.93Å; L114-F117 HydrophobicContact CD1-CD2 4.06Å; L114-F117 HydrophobicContact CD1-CE2 4.5Å; L114-F117 WeakPolarHBondContact O-CD2 3.4Å; L114-F117 PolarHBondContact O-N 3.47Å; L114-F118 HydrophobicContact CD1-CE2 4.4Å; L114-F118 HydrophobicContact CG-CE2 4.12Å; L114-F118 VanDerWaalsContact O-CD2 3.28Å; L114-F118 WeakPolarHBondContact O-CD2 3.45Å; L114-F118 WeakPolarHBondContact O-CE2 3.44Å; L114-Y180 HydrophobicContact CD1-CD1 4.2Å; L114-Y180 HydrophobicContact CD1-CD2 4.35Å; L114-Y180 HydrophobicContact CD1-CG 3.93Å; L114-I183 HydrophobicContact CD2-CG2 3.9Å; L114-I184 HydrophobicContact CD2-CD1 3.78Å; L114-I184 HydrophobicContact CD2-CG1 4.39Å
115	S	94.7	Very high	94.5	Very high	29 Å²	29	50.7 Å²	50.7	20%	0.203	28%	0.275	C	S	.	.	G	3₁₀ helix	trans	-57.9	-29.3	176.7	66.6	0	0	0	0	113.3	P112 K113 F117 F118 G121	P112-S115 VanDerWaalsContact O-CB 3.28Å; P112-S115 WeakPolarHBondContact O-CB 3.47Å; P112-S115 PolarHBondContact O-N 3.17Å; P112-S115 PolarHBondContact O-OG 3.44Å; K113-S115 PolarHBondContact O-N 2.85Å; S115-F117 PolarHBondContact O-N 3.4Å; S115-F117 VanDerWaalsContact O-N 3.09Å; S115-F118 PolarHBondContact O-N 3.31Å; S115-F118 VanDerWaalsContact O-N 3.09Å; S115-G121 WeakPolarHBondContact CB-O 3.47Å; S115-G121 WeakPolarHBondContact O-CA 3.21Å
116	T	95	Very high	94.1	Very high	106 Å²	106	53.8 Å²	53.8	65%	0.65	29%	0.294	S	S	*	.	G	3₁₀ helix	trans	-67.8	-14.5	-175.7	67.7	0	0	0	0	113.5	K113 L114	K113-T116 PolarHBondContact O-N 3.08Å; K113-T116 PolarHBondContact O-OG1 3.26Å; L114-T116 PolarHBondContact O-N 2.93Å
117	F	94.7	Very high	94	Very high	53 Å²	53	57 Å²	57	23%	0.232	31%	0.314	C	S	.	.	G	3₁₀ helix	trans	-83.9	-11.5	177.4	-67.3	-83.6	0	0	0	113.5	L114 S115 I173 R174 N175 Y180	L114-F117 HydrophobicContact CD1-CD2 4.06Å; L114-F117 HydrophobicContact CD1-CE2 4.5Å; L114-F117 WeakPolarHBondContact O-CD2 3.4Å; L114-F117 PolarHBondContact O-N 3.47Å; S115-F117 PolarHBondContact O-N 3.4Å; S115-F117 VanDerWaalsContact O-N 3.09Å; F117-I173 HydrophobicContact CD1-CG2 3.83Å; F117-I173 HydrophobicContact CE1-CG2 4.22Å; F117-R174 WeakPolarHBondContact CE1-O 3.29Å; F117-N175 HydrophobicContact CE1-CB 4.41Å; F117-N175 HydrophobicContact CZ-CB 4.38Å; F117-N175 WeakPolarHBondContact CZ-O 3.34Å; F117-Y180 HydrophobicContact CE1-CE2 4.45Å; F117-Y180 HydrophobicContact CE2-CD2 4.21Å; F117-Y180 AromaticContact CE2-CE2 3.58Å; F117-Y180 HydrophobicContact CE2-CE2 3.58Å; F117-Y180 AromaticContact CE2-CZ 3.91Å; F117-Y180 HydrophobicContact CZ-CD2 4.26Å; F117-Y180 AromaticContact CZ-CE2 3.47Å; F117-Y180 HydrophobicContact CZ-CE2 3.47Å; F117-Y180 VanDerWaalsContact CZ-CE2 3.47Å
118	F	95.6	Very high	93.9	Very high	36 Å²	36	57.2 Å²	57.2	16%	0.158	32%	0.315	C	S	.	.	S	Bend	trans	-118.6	137.8	-171.1	-59.6	-86.6	0	0	0	111.5	F104 F108 L114 S115 F120 G121 H137	F104-F118 HydrophobicContact CD1-CE1 4.39Å; F104-F118 HydrophobicContact CD1-CZ 4.23Å; F104-F118 HydrophobicContact CE1-CD1 4.43Å; F104-F118 AromaticContact CE1-CE1 3.65Å; F104-F118 HydrophobicContact CE1-CE1 3.65Å; F104-F118 HydrophobicContact CE1-CE2 4.21Å; F104-F118 AromaticContact CE1-CZ 3.53Å; F104-F118 HydrophobicContact CE1-CZ 3.53Å; F104-F118 HydrophobicContact CZ-CE1 4.13Å; F104-F118 HydrophobicContact CZ-CZ 4.36Å; F108-F118 AromaticContact CE1-CD2 3.65Å; F108-F118 HydrophobicContact CE1-CD2 3.65Å; F108-F118 AromaticContact CE1-CE2 3.96Å; F108-F118 HydrophobicContact CE1-CE2 3.96Å; F108-F118 HydrophobicContact CZ-CB 4.22Å; F108-F118 AromaticContact CZ-CD2 3.62Å; F108-F118 HydrophobicContact CZ-CD2 3.62Å; F108-F118 HydrophobicContact CZ-CE2 4.28Å; F108-F118 HydrophobicContact CZ-CG 4.06Å; L114-F118 HydrophobicContact CD1-CE2 4.4Å; L114-F118 HydrophobicContact CG-CE2 4.12Å; L114-F118 VanDerWaalsContact O-CD2 3.28Å; L114-F118 WeakPolarHBondContact O-CD2 3.45Å; L114-F118 WeakPolarHBondContact O-CE2 3.44Å; S115-F118 PolarHBondContact O-N 3.31Å; S115-F118 VanDerWaalsContact O-N 3.09Å; F118-F120 HydrophobicContact CB-CD1 4.1Å; F118-F120 HydrophobicContact CB-CD2 3.91Å; F118-F120 HydrophobicContact CB-CE1 3.87Å; F118-F120 HydrophobicContact CB-CE2 3.69Å; F118-F120 HydrophobicContact CB-CG 4.15Å; F118-F120 HydrophobicContact CB-CZ 3.68Å; F118-F120 AromaticContact CD1-CE1 3.76Å; F118-F120 HydrophobicContact CD1-CE1 3.76Å; F118-F120 AromaticContact CD1-CE2 3.99Å; F118-F120 HydrophobicContact CD1-CE2 3.99Å; F118-F120 AromaticContact CD1-CZ 3.3Å; F118-F120 HydrophobicContact CD1-CZ 3.3Å; F118-F120 HydrophobicContact CE1-CZ 4.13Å; F118-F120 HydrophobicContact CG-CE1 4.18Å; F118-F120 AromaticContact CG-CE2 3.85Å; F118-F120 HydrophobicContact CG-CE2 3.85Å; F118-F120 AromaticContact CG-CZ 3.64Å; F118-F120 HydrophobicContact CG-CZ 3.64Å; F118-F120 PolarHBondContact O-N 3.3Å; F118-F120 VanDerWaalsContact O-N 3.12Å; F118-G121 PolarHBondContact O-N 2.88Å; F118-H137 AromaticContact CE1-CE1 3.88Å; F118-H137 AromaticContact CE1-NE2 3.83Å
119	P	94.7	Very high	93.7	Very high	80 Å²	80	57.5 Å²	57.5	52%	0.519	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.7	-23.8	176.3	25.7	-34.3	0	0	0	112.5	H122 D133	P119-H122 PolarHBondContact O-CE1 3.11Å; P119-H122 PolarHBondContact O-ND1 3.41Å; P119-D133 HydrophobicContact CG-CB 4.16Å
120	F	96	Very high	93.7	Very high	2 Å²	2	56.9 Å²	56.9	1%	0.009	32%	0.32	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.8	1.4	176.7	54.5	-99.5	0	0	0	114	F104 F108 F118 H122 L123 L128 D133 C134 H137	F104-F120 HydrophobicContact CB-CE2 4.25Å; F104-F120 HydrophobicContact CD1-CE2 4.29Å; F104-F120 HydrophobicContact CD1-CZ 4.41Å; F104-F120 HydrophobicContact CD2-CZ 4.47Å; F104-F120 HydrophobicContact CG-CE2 4.12Å; F104-F120 HydrophobicContact CG-CZ 4.32Å; F108-F120 AromaticContact CE2-CD2 3.97Å; F108-F120 HydrophobicContact CE2-CD2 3.97Å; F108-F120 AromaticContact CE2-CE2 3.93Å; F108-F120 HydrophobicContact CE2-CE2 3.93Å; F108-F120 HydrophobicContact CZ-CD2 4.11Å; F108-F120 AromaticContact CZ-CE2 3.71Å; F108-F120 HydrophobicContact CZ-CE2 3.71Å; F118-F120 HydrophobicContact CB-CD1 4.1Å; F118-F120 HydrophobicContact CB-CD2 3.91Å; F118-F120 HydrophobicContact CB-CE1 3.87Å; F118-F120 HydrophobicContact CB-CE2 3.69Å; F118-F120 HydrophobicContact CB-CG 4.15Å; F118-F120 HydrophobicContact CB-CZ 3.68Å; F118-F120 AromaticContact CD1-CE1 3.76Å; F118-F120 HydrophobicContact CD1-CE1 3.76Å; F118-F120 AromaticContact CD1-CE2 3.99Å; F118-F120 HydrophobicContact CD1-CE2 3.99Å; F118-F120 AromaticContact CD1-CZ 3.3Å; F118-F120 HydrophobicContact CD1-CZ 3.3Å; F118-F120 HydrophobicContact CE1-CZ 4.13Å; F118-F120 HydrophobicContact CG-CE1 4.18Å; F118-F120 AromaticContact CG-CE2 3.85Å; F118-F120 HydrophobicContact CG-CE2 3.85Å; F118-F120 AromaticContact CG-CZ 3.64Å; F118-F120 HydrophobicContact CG-CZ 3.64Å; F118-F120 PolarHBondContact O-N 3.3Å; F118-F120 VanDerWaalsContact O-N 3.12Å; F120-H122 PolarHBondContact O-N 3.08Å; F120-L123 HydrophobicContact CB-CD1 3.95Å; F120-L123 WeakPolarHBondContact O-CB 3.45Å; F120-L123 WeakPolarHBondContact O-CG 3.35Å; F120-L123 PolarHBondContact O-N 3Å; F120-L128 HydrophobicContact CB-CD1 4.32Å; F120-L128 HydrophobicContact CD2-CD1 3.64Å; F120-L128 HydrophobicContact CE2-CD1 4.45Å; F120-L128 HydrophobicContact CG-CD1 4.4Å; F120-L128 WeakPolarHBondContact O-CD1 3.27Å; F120-D133 HydrophobicContact CB-CB 4.32Å; F120-D133 HydrophobicContact CD1-CB 3.69Å; F120-D133 HydrophobicContact CG-CB 4.47Å; F120-C134 HydrophobicContact CB-CB 4.29Å; F120-C134 HydrophobicContact CD1-CB 4.13Å; F120-C134 HydrophobicContact CD2-CB 3.96Å; F120-C134 HydrophobicContact CE1-CB 4.42Å; F120-C134 HydrophobicContact CE2-CB 4.25Å; F120-C134 HydrophobicContact CG-CB 3.86Å; F120-C134 HydrophobicContact CZ-CB 4.46Å; F120-H137 HydrophobicContact CE1-CB 3.89Å; F120-H137 HydrophobicContact CZ-CB 4.16Å
121	G	95	Very high	93.8	Very high	11 Å²	11	56.7 Å²	56.7	11%	0.113	32%	0.319	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.6	-20.9	-174	0	0	0	0	0	114.8	S115 F118 L123	S115-G121 WeakPolarHBondContact CB-O 3.47Å; S115-G121 WeakPolarHBondContact O-CA 3.21Å; F118-G121 PolarHBondContact O-N 2.88Å; G121-L123 VanDerWaalsContact C-N 3.29Å; G121-L123 PolarHBondContact O-N 2.94Å
122	H	94.7	Very high	93.9	Very high	154 Å²	154	60.7 Å²	60.7	71%	0.713	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.7	-8.7	177.2	67.4	-86.9	0	0	0	113.8	P119 F120	P119-H122 PolarHBondContact O-CE1 3.11Å; P119-H122 PolarHBondContact O-ND1 3.41Å; F120-H122 PolarHBondContact O-N 3.08Å
123	L	95.3	Very high	94.1	Very high	49 Å²	49	59.2 Å²	59.2	26%	0.257	33%	0.334	S	S	.	.	S	Bend	trans	-76	145.1	-176.5	-64.1	179.3	0	0	0	111.3	F120 G121 V127 L128 S131	F120-L123 HydrophobicContact CB-CD1 3.95Å; F120-L123 WeakPolarHBondContact O-CB 3.45Å; F120-L123 WeakPolarHBondContact O-CG 3.35Å; F120-L123 PolarHBondContact O-N 3Å; G121-L123 VanDerWaalsContact C-N 3.29Å; G121-L123 PolarHBondContact O-N 2.94Å; L123-V127 HydrophobicContact CB-CG2 3.99Å; L123-V127 HydrophobicContact CD2-CG2 4.2Å; L123-L128 HydrophobicContact CB-CB 4.45Å; L123-L128 HydrophobicContact CB-CD1 4.24Å; L123-S131 VanDerWaalsContact CD1-CB 3.46Å
124	S	92.7	Very high	94.3	Very high	59 Å²	59	54.9 Å²	54.9	41%	0.413	32%	0.315	S	S	.	.			trans	-66.1	153.6	172.6	70.7	0	0	0	0	111.2	D126 V127 L128	S124-D126 PolarHBondContact O-N 3.43Å; S124-V127 PolarHBondContact O-N 3.21Å; S124-V127 VanDerWaalsContact O-N 3.15Å; S124-L128 WeakPolarHBondContact O-CB 3.34Å; S124-L128 PolarHBondContact O-N 3.45Å
125	P	88.3	Confident	94.5	Very high	69 Å²	69	58.2 Å²	58.2	45%	0.448	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.4	-21.5	-178.1	-26.6	34.8	0	0	0	115.6	K105	K105-P125 HydrophobicContact CD-CB 4.12Å; K105-P125 HydrophobicContact CG-CB 4.23Å; K105-P125 PolarHBondContact NZ-O 2.97Å
126	D	89.2	Confident	94.7	Very high	125 Å²	125	63.1 Å²	63.1	67%	0.668	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.8	-32.2	-178.1	-59.8	-36.8	0	0	0	112.5	S124	S124-D126 PolarHBondContact O-N 3.43Å
127	V	94.4	Very high	94.8	Very high	73 Å²	73	60.6 Å²	60.6	44%	0.442	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.8	-16.5	178.7	-53.3	0	0	0	0	112.8	L123 S124 V129 D130 S131	L123-V127 HydrophobicContact CB-CG2 3.99Å; L123-V127 HydrophobicContact CD2-CG2 4.2Å; S124-V127 PolarHBondContact O-N 3.21Å; S124-V127 VanDerWaalsContact O-N 3.15Å; V127-V129 VanDerWaalsContact C-N 3.26Å; V127-V129 PolarHBondContact O-N 2.81Å; V127-D130 PolarHBondContact O-N 3.44Å; V127-S131 PolarHBondContact O-N 3.29Å
128	L	93.5	Very high	94.9	Very high	3 Å²	3	58 Å²	58	2%	0.016	31%	0.313	C	S	.	.	G	3₁₀ helix	trans	-52.5	-44.6	178.8	179.8	71.5	0	0	0	111.9	K105 F108 F120 L123 S124 D130 S131 C134	K105-L128 HydrophobicContact CB-CD2 3.86Å; F108-L128 HydrophobicContact CD2-CD2 4.19Å; F108-L128 HydrophobicContact CE2-CD1 4.13Å; F108-L128 HydrophobicContact CE2-CD2 4.36Å; F120-L128 HydrophobicContact CB-CD1 4.32Å; F120-L128 HydrophobicContact CD2-CD1 3.64Å; F120-L128 HydrophobicContact CE2-CD1 4.45Å; F120-L128 HydrophobicContact CG-CD1 4.4Å; F120-L128 WeakPolarHBondContact O-CD1 3.27Å; L123-L128 HydrophobicContact CB-CB 4.45Å; L123-L128 HydrophobicContact CB-CD1 4.24Å; S124-L128 WeakPolarHBondContact O-CB 3.34Å; S124-L128 PolarHBondContact O-N 3.45Å; L128-D130 PolarHBondContact O-N 3.36Å; L128-S131 VanDerWaalsContact O-CB 3.28Å; L128-S131 WeakPolarHBondContact O-CB 3.39Å; L128-S131 PolarHBondContact O-N 3.28Å; L128-C134 HydrophobicContact CD1-CB 4.41Å; L128-C134 WeakPolarHBondContact O-CB 3.42Å
129	V	93.1	Very high	95	Very high	32 Å²	32	58.2 Å²	58.2	19%	0.194	32%	0.321	C	S	.	.	G	3₁₀ helix	trans	-66.3	-20.4	-177	-63.3	0	0	0	0	113.2	C101 L102 V127 K135	C101-V129 HydrophobicContact CB-CB 4.2Å; C101-V129 HydrophobicContact CB-CG1 4.06Å; L102-V129 HydrophobicContact CD2-CG1 4.33Å; V127-V129 VanDerWaalsContact C-N 3.26Å; V127-V129 PolarHBondContact O-N 2.81Å; V129-K135 WeakPolarHBondContact O-CE 3.28Å
130	D	93.3	Very high	95.2	Very high	105 Å²	105	60.4 Å²	60.4	56%	0.561	32%	0.322	S	S	*	.	G	3₁₀ helix	trans	-93.5	-15.2	179	-73.2	-45.9	0	0	0	114.1	V127 L128 K135	V127-D130 PolarHBondContact O-N 3.44Å; L128-D130 PolarHBondContact O-N 3.36Å; D130-K135 WeakPolarHBondContact O-CE 3.35Å; D130-K135 PolarHBondContact O-NZ 2.93Å; D130-K135 IonicContact OD1-NZ 2.63Å
131	S	95.8	Very high	95.3	Very high	12 Å²	12	61.6 Å²	61.6	8%	0.084	33%	0.33	C	S	.	.			trans	-56.4	126.4	179.8	175.3	0	0	0	0	112.6	L123 V127 L128 D133 C134 K135	L123-S131 VanDerWaalsContact CD1-CB 3.46Å; V127-S131 PolarHBondContact O-N 3.29Å; L128-S131 VanDerWaalsContact O-CB 3.28Å; L128-S131 WeakPolarHBondContact O-CB 3.39Å; L128-S131 PolarHBondContact O-N 3.28Å; S131-D133 PolarHBondContact O-N 2.77Å; S131-D133 PolarHBondContact OG-N 2.86Å; S131-C134 PolarHBondContact O-N 3.29Å; S131-C134 PolarHBondContact OG-N 3.24Å; S131-K135 WeakPolarHBondContact O-CB 3.11Å; S131-K135 VanDerWaalsContact O-CG 3.31Å; S131-K135 WeakPolarHBondContact O-CG 3.46Å; S131-K135 PolarHBondContact O-N 2.9Å
132	P	97.1	Very high	95.4	Very high	96 Å²	96	61.4 Å²	61.4	62%	0.623	33%	0.326	S	S	*	.	H	α-helix	trans	-58.3	-35.8	173.4	-25.7	34.9	0	0	0	113.2	R136	P132-R136 VanDerWaalsContact O-CB 3.32Å; P132-R136 WeakPolarHBondContact O-CB 3.44Å; P132-R136 PolarHBondContact O-N 2.81Å
133	D	97.1	Very high	95.5	Very high	53 Å²	53	60.4 Å²	60.4	28%	0.283	32%	0.316	S	S	.	.	H	α-helix	trans	-71.2	-41.7	178.7	-66.5	-31.6	0	0	0	111.7	P119 F120 S131 R136 H137	P119-D133 HydrophobicContact CG-CB 4.16Å; F120-D133 HydrophobicContact CB-CB 4.32Å; F120-D133 HydrophobicContact CD1-CB 3.69Å; F120-D133 HydrophobicContact CG-CB 4.47Å; S131-D133 PolarHBondContact O-N 2.77Å; S131-D133 PolarHBondContact OG-N 2.86Å; D133-R136 PolarHBondContact O-N 3.3Å; D133-R136 IonicContact OD1-CZ 2.67Å; D133-R136 IonicContact OD1-NH1 3.6Å; D133-R136 PolarHBondContact OD1-NH1 3Å; D133-R136 IonicContact OD1-NH2 3.89Å; D133-R136 PolarHBondContact OD1-NH2 3.37Å; D133-H137 PolarHBondContact O-N 3.29Å
134	C	97.6	Very high	95.6	Very high	0 Å²	0	58.9 Å²	58.9	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-62.8	-47.2	174.4	-169.9	0	0	0	0	110.4	F120 L128 S131 R136 H137 S138	F120-C134 HydrophobicContact CB-CB 4.29Å; F120-C134 HydrophobicContact CD1-CB 4.13Å; F120-C134 HydrophobicContact CD2-CB 3.96Å; F120-C134 HydrophobicContact CE1-CB 4.42Å; F120-C134 HydrophobicContact CE2-CB 4.25Å; F120-C134 HydrophobicContact CG-CB 3.86Å; F120-C134 HydrophobicContact CZ-CB 4.46Å; L128-C134 HydrophobicContact CD1-CB 4.41Å; L128-C134 WeakPolarHBondContact O-CB 3.42Å; S131-C134 PolarHBondContact O-N 3.29Å; S131-C134 PolarHBondContact OG-N 3.24Å; C134-R136 VanDerWaalsContact C-N 3.34Å; C134-R136 PolarHBondContact O-N 3.27Å; C134-H137 PolarHBondContact O-N 3.18Å; C134-S138 WeakPolarHBondContact O-CB 3.31Å; C134-S138 PolarHBondContact O-N 3.2Å; C134-S138 PolarHBondContact O-OG 2.91Å
135	K	97.8	Very high	95.9	Very high	75 Å²	75	56.3 Å²	56.3	33%	0.326	29%	0.29	S	S	.	.	H	α-helix	trans	-56.8	-45.1	176.5	-73.7	171.2	175.6	160.8	0	112	I97 V129 D130 S131 S138 A139	I97-K135 HydrophobicContact CG2-CB 3.76Å; I97-K135 HydrophobicContact CG2-CG 3.78Å; V129-K135 WeakPolarHBondContact O-CE 3.28Å; D130-K135 WeakPolarHBondContact O-CE 3.35Å; D130-K135 PolarHBondContact O-NZ 2.93Å; D130-K135 IonicContact OD1-NZ 2.63Å; S131-K135 WeakPolarHBondContact O-CB 3.11Å; S131-K135 VanDerWaalsContact O-CG 3.31Å; S131-K135 WeakPolarHBondContact O-CG 3.46Å; S131-K135 PolarHBondContact O-N 2.9Å; K135-S138 PolarHBondContact O-N 3.02Å; K135-A139 WeakPolarHBondContact O-CB 3.44Å; K135-A139 PolarHBondContact O-N 3.44Å
136	R	97.9	Very high	96.3	Very high	132 Å²	132	56.9 Å²	56.9	50%	0.498	29%	0.287	S	S	.	.	H	α-helix	trans	-64	-44.7	179.3	-176.4	175.3	66.2	-100.8	1.4	112.3	P132 D133 C134	P132-R136 VanDerWaalsContact O-CB 3.32Å; P132-R136 WeakPolarHBondContact O-CB 3.44Å; P132-R136 PolarHBondContact O-N 2.81Å; D133-R136 PolarHBondContact O-N 3.3Å; D133-R136 IonicContact OD1-CZ 2.67Å; D133-R136 IonicContact OD1-NH1 3.6Å; D133-R136 PolarHBondContact OD1-NH1 3Å; D133-R136 IonicContact OD1-NH2 3.89Å; D133-R136 PolarHBondContact OD1-NH2 3.37Å; C134-R136 VanDerWaalsContact C-N 3.34Å; C134-R136 PolarHBondContact O-N 3.27Å
137	H	96.6	Very high	96.6	Very high	53 Å²	53	52.5 Å²	52.5	25%	0.245	26%	0.263	C	S	.	.	H	α-helix	trans	-70.9	-40.6	178.7	-160.7	102	0	0	0	111.3	F104 F118 F120 D133 C134 A139 K140 V141	F104-H137 AromaticContact CE2-CD2 3.6Å; F104-H137 AromaticContact CZ-CD2 3.27Å; F104-H137 WeakPolarHBondContact CZ-CD2 3.35Å; F104-H137 AromaticContact CZ-NE2 3.79Å; F118-H137 AromaticContact CE1-CE1 3.88Å; F118-H137 AromaticContact CE1-NE2 3.83Å; F120-H137 HydrophobicContact CE1-CB 3.89Å; F120-H137 HydrophobicContact CZ-CB 4.16Å; D133-H137 PolarHBondContact O-N 3.29Å; C134-H137 PolarHBondContact O-N 3.18Å; H137-A139 VanDerWaalsContact C-N 3.32Å; H137-A139 PolarHBondContact O-N 3.26Å; H137-K140 WeakPolarHBondContact O-CB 3.32Å; H137-K140 PolarHBondContact O-N 3.33Å; H137-V141 PolarHBondContact O-N 3.28Å; H137-V141 VanDerWaalsContact O-N 3.15Å
138	S	97.9	Very high	96.7	Very high	0 Å²	0	49 Å²	49	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-57.1	-41.3	175	-65.4	0	0	0	0	112.8	G100 C101 C134 K135 K140 V141 M142	G100-S138 VanDerWaalsContact C-CB 3.49Å; G100-S138 PolarHBondContact O-OG 2.97Å; C101-S138 WeakPolarHBondContact CA-OG 3.23Å; C101-S138 PolarHBondContact N-OG 3.05Å; C101-S138 PolarHBondContact SG-OG 3.32Å; C134-S138 WeakPolarHBondContact O-CB 3.31Å; C134-S138 PolarHBondContact O-N 3.2Å; C134-S138 PolarHBondContact O-OG 2.91Å; K135-S138 PolarHBondContact O-N 3.02Å; S138-K140 VanDerWaalsContact C-N 3.27Å; S138-K140 PolarHBondContact O-N 3.4Å; S138-V141 PolarHBondContact O-N 3.18Å; S138-M142 WeakPolarHBondContact O-CG 3.36Å; S138-M142 PolarHBondContact O-N 3.32Å
139	A	98	Very high	96.9	Very high	40 Å²	40	49 Å²	49	33%	0.331	24%	0.242	S	C	.	.	H	α-helix	trans	-59.7	-37.1	174.7	0	0	0	0	0	112.5	I97 K135 H137 R143	I97-A139 HydrophobicContact CG1-CB 4.32Å; K135-A139 WeakPolarHBondContact O-CB 3.44Å; K135-A139 PolarHBondContact O-N 3.44Å; H137-A139 VanDerWaalsContact C-N 3.32Å; H137-A139 PolarHBondContact O-N 3.26Å; A139-R143 WeakPolarHBondContact O-CB 3.44Å; A139-R143 PolarHBondContact O-N 3.27Å
140	K	97.6	Very high	97	Very high	125 Å²	125	52 Å²	52	54%	0.543	25%	0.252	S	S	.	.	H	α-helix	trans	-68.9	-44.6	177.5	-63.4	177.4	-179.8	-175.8	0	111.8	H137 S138 R143 V144	H137-K140 WeakPolarHBondContact O-CB 3.32Å; H137-K140 PolarHBondContact O-N 3.33Å; S138-K140 VanDerWaalsContact C-N 3.27Å; S138-K140 PolarHBondContact O-N 3.4Å; K140-R143 WeakPolarHBondContact O-CB 3.49Å; K140-R143 PolarHBondContact O-N 3.42Å; K140-V144 PolarHBondContact O-N 3.47Å; K140-V144 VanDerWaalsContact O-N 3.13Å
141	V	97.6	Very high	97.1	Very high	28 Å²	28	47 Å²	47	17%	0.17	23%	0.226	C	C	.	.	H	α-helix	trans	-60.8	-47.2	177.2	174.9	0	0	0	0	110.6	F104 H137 S138 R143 V144 I145	F104-V141 HydrophobicContact CE2-CG2 3.96Å; F104-V141 HydrophobicContact CZ-CG2 3.89Å; H137-V141 PolarHBondContact O-N 3.28Å; H137-V141 VanDerWaalsContact O-N 3.15Å; S138-V141 PolarHBondContact O-N 3.18Å; V141-R143 VanDerWaalsContact C-N 3.32Å; V141-R143 PolarHBondContact O-N 3.49Å; V141-V144 WeakPolarHBondContact O-CB 3.24Å; V141-V144 PolarHBondContact O-N 2.92Å; V141-V144 VanDerWaalsContact O-N 3.12Å; V141-I145 HydrophobicContact CG1-CD1 4.32Å; V141-I145 PolarHBondContact O-N 2.67Å; V141-I145 VanDerWaalsContact O-N 3.14Å
142	M	98.3	Very high	97	Very high	6 Å²	6	46.5 Å²	46.5	3%	0.03	22%	0.222	C	C	.	.	H	α-helix	trans	-68.2	-30.4	179.1	-67.2	-58.4	-60.9	0	0	113.2	W89 P96 T99 I103 S138 V144 I145 H146 W192	W89-M142 HydrophobicContact CH2-CE 3.94Å; W89-M142 HydrophobicContact CZ3-CE 4.14Å; P96-M142 HydrophobicContact CB-CB 3.99Å; P96-M142 HydrophobicContact CB-CE 4.25Å; P96-M142 HydrophobicContact CB-CG 4.22Å; P96-M142 VanDerWaalsContact O-CG 3.24Å; P96-M142 WeakPolarHBondContact O-CG 3.28Å; T99-M142 HydrophobicContact CG2-CE 3.93Å; T99-M142 HydrophobicContact CG2-SD 4.05Å; I103-M142 HydrophobicContact CD1-SD 3.97Å; S138-M142 WeakPolarHBondContact O-CG 3.36Å; S138-M142 PolarHBondContact O-N 3.32Å; M142-V144 VanDerWaalsContact C-N 3.33Å; M142-I145 PolarHBondContact O-N 3.41Å; M142-I145 HydrophobicContact SD-CD1 3.92Å; M142-H146 WeakPolarHBondContact O-CB 3.41Å; M142-H146 PolarHBondContact O-N 3.42Å; M142-W192 HydrophobicContact CE-CH2 3.9Å; M142-W192 HydrophobicContact SD-CH2 3.99Å
143	R	97.2	Very high	96.8	Very high	133 Å²	133	47.4 Å²	47.4	50%	0.502	22%	0.218	S	C	.	.	H	α-helix	trans	-60.9	-42.2	170.1	173.9	179.4	168.5	-106.2	-0.6	111.2	A139 K140 V141 H146 M147 E162	A139-R143 WeakPolarHBondContact O-CB 3.44Å; A139-R143 PolarHBondContact O-N 3.27Å; K140-R143 WeakPolarHBondContact O-CB 3.49Å; K140-R143 PolarHBondContact O-N 3.42Å; V141-R143 VanDerWaalsContact C-N 3.32Å; V141-R143 PolarHBondContact O-N 3.49Å; R143-H146 WeakPolarHBondContact O-CB 3.37Å; R143-H146 PolarHBondContact O-N 3.03Å; R143-M147 HydrophobicContact CG-CG 4.45Å; R143-M147 HydrophobicContact CG-SD 4.2Å; R143-M147 VanDerWaalsContact O-CG 3.31Å; R143-M147 WeakPolarHBondContact O-CG 3.45Å; R143-M147 PolarHBondContact O-N 3.45Å; R143-E162 IonicContact CZ-OE1 3.57Å; R143-E162 IonicContact NH1-OE1 3.82Å; R143-E162 PolarHBondContact NH1-OE1 2.94Å; R143-E162 IonicContact NH2-OE1 2.76Å; R143-E162 PolarHBondContact NH2-OE1 3.43Å
144	V	97.1	Very high	96.1	Very high	18 Å²	18	46.9 Å²	46.9	11%	0.109	23%	0.225	C	C	.	.	H	α-helix	trans	-62.8	-46.4	177.6	171.1	0	0	0	0	111.2	K140 V141 M142 H146 M147 A148 L163 L166 I215	K140-V144 PolarHBondContact O-N 3.47Å; K140-V144 VanDerWaalsContact O-N 3.13Å; V141-V144 WeakPolarHBondContact O-CB 3.24Å; V141-V144 PolarHBondContact O-N 2.92Å; V141-V144 VanDerWaalsContact O-N 3.12Å; M142-V144 VanDerWaalsContact C-N 3.33Å; V144-H146 VanDerWaalsContact C-N 3.29Å; V144-H146 PolarHBondContact O-N 2.93Å; V144-M147 WeakPolarHBondContact O-CB 3.29Å; V144-M147 PolarHBondContact O-N 3.49Å; V144-A148 PolarHBondContact O-N 3.36Å; V144-L163 HydrophobicContact CG1-CD2 3.42Å; V144-L163 VanDerWaalsContact CG1-CD2 3.42Å; V144-L166 HydrophobicContact CG2-CD1 3.5Å; V144-I215 HydrophobicContact CG1-CG2 4.26Å
145	I	97.7	Very high	95.4	Very high	4 Å²	4	52.1 Å²	52.1	2%	0.021	25%	0.253	C	S	.	.	H	α-helix	trans	-61.6	-41.7	176.7	-60.7	169.7	0	0	0	110.3	W89 V141 M142 M147 A148 V149 I188 W192 W208	W89-I145 HydrophobicContact CE3-CG2 4.45Å; W89-I145 HydrophobicContact CH2-CB 4.23Å; W89-I145 HydrophobicContact CH2-CG2 3.68Å; W89-I145 HydrophobicContact CZ3-CB 4.49Å; W89-I145 HydrophobicContact CZ3-CG2 3.54Å; V141-I145 HydrophobicContact CG1-CD1 4.32Å; V141-I145 PolarHBondContact O-N 2.67Å; V141-I145 VanDerWaalsContact O-N 3.14Å; M142-I145 PolarHBondContact O-N 3.41Å; M142-I145 HydrophobicContact SD-CD1 3.92Å; I145-M147 PolarHBondContact O-N 3.38Å; I145-A148 WeakPolarHBondContact O-CB 3.27Å; I145-A148 PolarHBondContact O-N 3.3Å; I145-V149 WeakPolarHBondContact O-CG2 3.4Å; I145-V149 PolarHBondContact O-N 3Å; I145-I188 HydrophobicContact CD1-CD1 4.14Å; I145-W192 HydrophobicContact CD1-CH2 4.4Å; I145-W192 HydrophobicContact CD1-CZ2 4.41Å; I145-W208 HydrophobicContact CG2-CH2 4.33Å; I145-W208 HydrophobicContact CG2-CZ3 3.76Å
146	H	96.9	Very high	94.8	Very high	82 Å²	82	48.9 Å²	48.9	38%	0.38	24%	0.24	S	C	.	.	H	α-helix	trans	-61.2	-42.7	174.8	-175.6	68.7	0	0	0	112.6	W89 M142 R143 V144 A148 V149 K150	W89-H146 HydrophobicContact CH2-CB 4.44Å; W89-H146 HydrophobicContact CZ2-CB 3.85Å; W89-H146 AromaticContact CZ2-ND1 3.69Å; W89-H146 AromaticContact NE1-ND1 3.75Å; M142-H146 WeakPolarHBondContact O-CB 3.41Å; M142-H146 PolarHBondContact O-N 3.42Å; R143-H146 WeakPolarHBondContact O-CB 3.37Å; R143-H146 PolarHBondContact O-N 3.03Å; V144-H146 VanDerWaalsContact C-N 3.29Å; V144-H146 PolarHBondContact O-N 2.93Å; H146-A148 VanDerWaalsContact C-N 3.29Å; H146-A148 PolarHBondContact O-N 3.43Å; H146-V149 PolarHBondContact O-N 3.32Å; H146-K150 WeakPolarHBondContact O-CG 3.46Å; H146-K150 PolarHBondContact O-N 3.32Å
147	M	96.2	Very high	94	Very high	32 Å²	32	48.4 Å²	48.4	16%	0.158	24%	0.241	C	C	.	.	H	α-helix	trans	-61.4	-38.6	175.1	-73.3	176.1	63.4	0	0	111.6	R143 V144 I145 K150 A151 L159 E162	R143-M147 HydrophobicContact CG-CG 4.45Å; R143-M147 HydrophobicContact CG-SD 4.2Å; R143-M147 VanDerWaalsContact O-CG 3.31Å; R143-M147 WeakPolarHBondContact O-CG 3.45Å; R143-M147 PolarHBondContact O-N 3.45Å; V144-M147 WeakPolarHBondContact O-CB 3.29Å; V144-M147 PolarHBondContact O-N 3.49Å; I145-M147 PolarHBondContact O-N 3.38Å; M147-K150 PolarHBondContact O-N 2.89Å; M147-A151 PolarHBondContact O-N 2.84Å; M147-L159 HydrophobicContact CB-CD1 3.97Å; M147-E162 HydrophobicContact CE-CB 3.81Å; M147-E162 HydrophobicContact CE-CG 3.84Å; M147-E162 HydrophobicContact SD-CG 4.24Å
148	A	97	Very high	93.5	Very high	0 Å²	0	49.1 Å²	49.1	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-64.1	-44.3	175.3	0	0	0	0	0	111.7	F73 V144 I145 H146 K150 A151 L152 L159 V211 I215	F73-A148 HydrophobicContact CE1-CB 4.12Å; F73-A148 WeakPolarHBondContact CE1-O 3.29Å; F73-A148 HydrophobicContact CZ-CB 4.17Å; V144-A148 PolarHBondContact O-N 3.36Å; I145-A148 WeakPolarHBondContact O-CB 3.27Å; I145-A148 PolarHBondContact O-N 3.3Å; H146-A148 VanDerWaalsContact C-N 3.29Å; H146-A148 PolarHBondContact O-N 3.43Å; A148-K150 VanDerWaalsContact C-N 3.3Å; A148-K150 PolarHBondContact O-N 3.49Å; A148-A151 WeakPolarHBondContact O-CB 3.31Å; A148-A151 PolarHBondContact O-N 3.46Å; A148-A151 VanDerWaalsContact O-N 3.1Å; A148-L152 WeakPolarHBondContact O-CG 3.4Å; A148-L152 PolarHBondContact O-N 3.48Å; A148-L159 HydrophobicContact CB-CD1 4.18Å; A148-L159 HydrophobicContact CB-CD2 4.28Å; A148-V211 HydrophobicContact CB-CG1 4.16Å; A148-I215 HydrophobicContact CB-CD1 3.66Å; A148-I215 HydrophobicContact CB-CG1 4.1Å
149	V	96.8	Very high	93.3	Very high	4 Å²	4	49.2 Å²	49.2	2%	0.024	25%	0.253	C	S	.	.	H	α-helix	trans	-60.7	-41	174	176.2	0	0	0	0	111.2	Y86 W89 I145 H146 A151 L152 W208	Y86-V149 HydrophobicContact CE1-CG1 4.49Å; W89-V149 HydrophobicContact CD2-CG2 3.85Å; W89-V149 HydrophobicContact CE3-CG2 4.25Å; W89-V149 HydrophobicContact CG-CG1 4.05Å; W89-V149 HydrophobicContact CG-CG2 4.04Å; I145-V149 WeakPolarHBondContact O-CG2 3.4Å; I145-V149 PolarHBondContact O-N 3Å; H146-V149 PolarHBondContact O-N 3.32Å; V149-A151 VanDerWaalsContact C-N 3.32Å; V149-A151 PolarHBondContact O-N 3.27Å; V149-L152 VanDerWaalsContact O-CB 3.32Å; V149-L152 WeakPolarHBondContact O-CB 3.36Å; V149-L152 PolarHBondContact O-N 2.95Å; V149-W208 HydrophobicContact CG2-CH2 3.85Å; V149-W208 HydrophobicContact CG2-CZ3 4.33Å
150	K	94.9	Very high	93.1	Very high	93 Å²	93	48 Å²	48	40%	0.404	24%	0.24	S	C	.	.	H	α-helix	trans	-63.3	-35.9	173.7	-74.1	-51.5	-163.3	178.3	0	113.3	H146 M147 A148 L152 E153	H146-K150 WeakPolarHBondContact O-CG 3.46Å; H146-K150 PolarHBondContact O-N 3.32Å; M147-K150 PolarHBondContact O-N 2.89Å; A148-K150 VanDerWaalsContact C-N 3.3Å; A148-K150 PolarHBondContact O-N 3.49Å; K150-L152 PolarHBondContact O-N 2.89Å; K150-E153 WeakPolarHBondContact CD-OE1 3.4Å; K150-E153 WeakPolarHBondContact CD-OE2 3.46Å; K150-E153 IonicContact NZ-OE1 2.73Å; K150-E153 PolarHBondContact NZ-OE1 3.13Å; K150-E153 IonicContact NZ-OE2 2.85Å; K150-E153 PolarHBondContact NZ-OE2 3.03Å; K150-E153 VanDerWaalsContact O-CB 3.29Å; K150-E153 WeakPolarHBondContact O-CB 3.45Å; K150-E153 PolarHBondContact O-N 3.36Å
151	A	95.4	Very high	92.8	Very high	2 Å²	2	45.2 Å²	45.2	2%	0.017	23%	0.229	C	C	.	.	H	α-helix	trans	-67.6	-22.7	176.2	0	0	0	0	0	113.6	F73 M147 A148 V149 E153 G154 D155 L159	F73-A151 HydrophobicContact CB-CB 3.98Å; F73-A151 HydrophobicContact CD1-CB 3.78Å; F73-A151 HydrophobicContact CG-CB 4.07Å; M147-A151 PolarHBondContact O-N 2.84Å; A148-A151 WeakPolarHBondContact O-CB 3.31Å; A148-A151 PolarHBondContact O-N 3.46Å; A148-A151 VanDerWaalsContact O-N 3.1Å; V149-A151 VanDerWaalsContact C-N 3.32Å; V149-A151 PolarHBondContact O-N 3.27Å; A151-E153 PolarHBondContact O-N 3.37Å; A151-G154 PolarHBondContact O-N 3.49Å; A151-D155 WeakPolarHBondContact CA-O 3.34Å; A151-L159 HydrophobicContact CB-CB 4.07Å; A151-L159 HydrophobicContact CB-CD2 3.6Å; A151-L159 HydrophobicContact CB-CG 4.4Å
152	L	95.4	Very high	92.7	Very high	0 Å²	0	46 Å²	46	0%	0	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.6	-19.6	170.8	-58.8	170.7	0	0	0	112.2	F73 R74 F77 L82 L85 Y86 A148 V149 K150 G154	F73-L152 HydrophobicContact CD1-CD2 3.57Å; F73-L152 HydrophobicContact CD1-CG 4.06Å; F73-L152 HydrophobicContact CE1-CD2 3.65Å; F73-L152 HydrophobicContact CE1-CG 4.06Å; R74-L152 WeakPolarHBondContact CB-O 3.48Å; R74-L152 WeakPolarHBondContact CD-O 3.45Å; R74-L152 WeakPolarHBondContact CG-O 3.45Å; F77-L152 HydrophobicContact CD2-CD2 3.31Å; F77-L152 HydrophobicContact CE2-CD2 3.48Å; F77-L152 VanDerWaalsContact CE2-CD2 3.48Å; F77-L152 HydrophobicContact CG-CD2 3.99Å; F77-L152 HydrophobicContact CZ-CD2 4.26Å; L82-L152 HydrophobicContact CD2-CB 4.04Å; L82-L152 HydrophobicContact CD2-CD1 4.36Å; L82-L152 HydrophobicContact CD2-CD2 3.92Å; L82-L152 HydrophobicContact CD2-CG 4.33Å; L85-L152 HydrophobicContact CB-CD1 4.32Å; L85-L152 HydrophobicContact CD1-CD1 3.74Å; Y86-L152 HydrophobicContact CE1-CB 4.24Å; Y86-L152 VanDerWaalsContact OH-CB 3.31Å; Y86-L152 WeakPolarHBondContact OH-CB 3.27Å; Y86-L152 PolarHBondContact OH-O 3.47Å; A148-L152 WeakPolarHBondContact O-CG 3.4Å; A148-L152 PolarHBondContact O-N 3.48Å; V149-L152 VanDerWaalsContact O-CB 3.32Å; V149-L152 WeakPolarHBondContact O-CB 3.36Å; V149-L152 PolarHBondContact O-N 2.95Å; K150-L152 PolarHBondContact O-N 2.89Å; L152-G154 VanDerWaalsContact C-N 3.32Å
153	E	91.5	Very high	92.6	Very high	115 Å²	115	45.8 Å²	45.8	54%	0.537	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.8	-15.8	177.6	-58.6	174.8	-178.9	0	0	112.4	Y86 K150 A151	Y86-E153 HydrophobicContact CE1-CG 4.48Å; Y86-E153 PolarHBondContact OH-N 2.93Å; K150-E153 WeakPolarHBondContact CD-OE1 3.4Å; K150-E153 WeakPolarHBondContact CD-OE2 3.46Å; K150-E153 IonicContact NZ-OE1 2.73Å; K150-E153 PolarHBondContact NZ-OE1 3.13Å; K150-E153 IonicContact NZ-OE2 2.85Å; K150-E153 PolarHBondContact NZ-OE2 3.03Å; K150-E153 VanDerWaalsContact O-CB 3.29Å; K150-E153 WeakPolarHBondContact O-CB 3.45Å; K150-E153 PolarHBondContact O-N 3.36Å; A151-E153 PolarHBondContact O-N 3.37Å
154	G	82.4	Confident	92.5	Very high	42 Å²	42	39.8 Å²	39.8	43%	0.433	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	139.3	-22.6	167.7	0	0	0	0	0	117	A151 L152	A151-G154 PolarHBondContact O-N 3.49Å; L152-G154 VanDerWaalsContact C-N 3.32Å
155	D	82.8	Confident	92.4	Very high	111 Å²	111	43 Å²	43	59%	0.594	23%	0.225	S	C	*	.			trans	-103.8	111.8	175.3	-179.2	8.8	0	0	0	111.3	A151 K157	A151-D155 WeakPolarHBondContact CA-O 3.34Å; D155-K157 PolarHBondContact OD1-N 3.41Å; D155-K157 VanDerWaalsContact OD1-N 3.16Å
156	S	85.4	Confident	92.4	Very high	6 Å²	6	44.5 Å²	44.5	4%	0.042	23%	0.232	C	C	.	.			trans	-110.5	-6.3	-173.5	-40.8	0	0	0	0	114.2	F73 S158 L159 Y160	F73-S156 WeakPolarHBondContact CB-OG 3.45Å; F73-S156 PolarHBondContact N-OG 3.05Å; S156-S158 PolarHBondContact O-N 3.46Å; S156-L159 WeakPolarHBondContact O-CB 3.28Å; S156-L159 PolarHBondContact O-N 2.97Å; S156-L159 VanDerWaalsContact O-N 3.15Å; S156-Y160 WeakPolarHBondContact O-CD2 3.41Å; S156-Y160 PolarHBondContact O-N 2.63Å
157	K	82	Confident	92.4	Very high	122 Å²	122	40.6 Å²	40.6	53%	0.53	21%	0.214	S	C	.	.	H	α-helix	trans	-63.6	-45	-168.9	-174	-179	175.2	-173.6	0	111.6	D155 L159 Y160 E161	D155-K157 PolarHBondContact OD1-N 3.41Å; D155-K157 VanDerWaalsContact OD1-N 3.16Å; K157-L159 PolarHBondContact O-N 3.04Å; K157-Y160 PolarHBondContact O-N 3.23Å; K157-E161 WeakPolarHBondContact CE-OE1 3.37Å; K157-E161 PolarHBondContact O-N 3.32Å
158	S	86.4	Confident	92.4	Very high	68 Å²	68	40 Å²	40	48%	0.476	21%	0.214	S	C	.	.	H	α-helix	trans	-63.3	-28.9	178.8	62.8	0	0	0	0	113.2	S156 E162	S156-S158 PolarHBondContact O-N 3.46Å; S158-E162 VanDerWaalsContact O-CB 3.27Å; S158-E162 WeakPolarHBondContact O-CB 3.16Å; S158-E162 PolarHBondContact O-N 3.06Å
159	L	93.7	Very high	92.3	Very high	2 Å²	2	45.6 Å²	45.6	1%	0.01	24%	0.239	C	C	.	.	H	α-helix	trans	-68.2	-51.1	177.3	-179.3	70.2	0	0	0	111.2	F73 M147 A148 A151 S156 K157 E161 E162 L163	F73-L159 HydrophobicContact CB-CD2 4.45Å; F73-L159 HydrophobicContact CD1-CD2 4.01Å; F73-L159 HydrophobicContact CD2-CD2 3.62Å; F73-L159 HydrophobicContact CE1-CD2 4.1Å; F73-L159 HydrophobicContact CE2-CD2 3.7Å; F73-L159 HydrophobicContact CG-CD2 3.78Å; F73-L159 HydrophobicContact CZ-CD2 3.96Å; M147-L159 HydrophobicContact CB-CD1 3.97Å; A148-L159 HydrophobicContact CB-CD1 4.18Å; A148-L159 HydrophobicContact CB-CD2 4.28Å; A151-L159 HydrophobicContact CB-CB 4.07Å; A151-L159 HydrophobicContact CB-CD2 3.6Å; A151-L159 HydrophobicContact CB-CG 4.4Å; S156-L159 WeakPolarHBondContact O-CB 3.28Å; S156-L159 PolarHBondContact O-N 2.97Å; S156-L159 VanDerWaalsContact O-N 3.15Å; K157-L159 PolarHBondContact O-N 3.04Å; L159-E161 PolarHBondContact O-N 3.48Å; L159-E162 PolarHBondContact O-N 2.86Å; L159-L163 HydrophobicContact CD1-CD1 3.74Å; L159-L163 HydrophobicContact CD1-CG 3.96Å; L159-L163 HydrophobicContact CD2-CD1 4.32Å; L159-L163 HydrophobicContact CG-CD1 3.73Å; L159-L163 HydrophobicContact CG-CG 4.24Å; L159-L163 WeakPolarHBondContact O-CB 3.42Å; L159-L163 VanDerWaalsContact O-CG 3.29Å; L159-L163 WeakPolarHBondContact O-CG 3.45Å; L159-L163 PolarHBondContact O-N 3.42Å
160	Y	93.2	Very high	92.3	Very high	14 Å²	14	47.6 Å²	47.6	6%	0.055	25%	0.248	C	C	.	.	H	α-helix	trans	-61.3	-44.5	-175.7	-70.8	-68.9	0	0	0	112.2	L25 S156 K157 A164 I218	L25-Y160 HydrophobicContact CD1-CD2 4.36Å; L25-Y160 HydrophobicContact CD1-CE2 4.4Å; L25-Y160 HydrophobicContact CD2-CD2 4.33Å; L25-Y160 HydrophobicContact CD2-CG 4.47Å; S156-Y160 WeakPolarHBondContact O-CD2 3.41Å; S156-Y160 PolarHBondContact O-N 2.63Å; K157-Y160 PolarHBondContact O-N 3.23Å; Y160-A164 WeakPolarHBondContact O-CB 3.47Å; Y160-A164 PolarHBondContact O-N 2.95Å; Y160-I218 HydrophobicContact CD1-CD1 3.46Å; Y160-I218 VanDerWaalsContact CD1-CD1 3.46Å; Y160-I218 HydrophobicContact CD1-CG1 3.84Å; Y160-I218 HydrophobicContact CD1-CG2 4.17Å; Y160-I218 HydrophobicContact CE1-CD1 3.42Å; Y160-I218 VanDerWaalsContact CE1-CD1 3.42Å; Y160-I218 HydrophobicContact CE1-CG1 3.95Å
161	E	91.5	Very high	92.2	Very high	67 Å²	67	43.1 Å²	43.1	31%	0.313	23%	0.228	S	C	.	.	H	α-helix	trans	-66	-45.4	179.6	-68.9	175.3	179.6	0	0	111.8	S29 K157 L159 L165	S29-E161 WeakPolarHBondContact CB-OE1 3.48Å; S29-E161 PolarHBondContact OG-OE1 3.4Å; K157-E161 WeakPolarHBondContact CE-OE1 3.37Å; K157-E161 PolarHBondContact O-N 3.32Å; L159-E161 PolarHBondContact O-N 3.48Å; E161-L165 WeakPolarHBondContact O-CB 3.47Å; E161-L165 PolarHBondContact O-N 3.04Å
162	E	94.5	Very high	92.1	Very high	46 Å²	46	45.3 Å²	45.3	22%	0.215	25%	0.246	C	C	.	.	H	α-helix	trans	-63.7	-45	178.2	-177.8	78.5	166.9	0	0	111.3	R143 M147 S158 L159 L165 L166	R143-E162 IonicContact CZ-OE1 3.57Å; R143-E162 IonicContact NH1-OE1 3.82Å; R143-E162 PolarHBondContact NH1-OE1 2.94Å; R143-E162 IonicContact NH2-OE1 2.76Å; R143-E162 PolarHBondContact NH2-OE1 3.43Å; M147-E162 HydrophobicContact CE-CB 3.81Å; M147-E162 HydrophobicContact CE-CG 3.84Å; M147-E162 HydrophobicContact SD-CG 4.24Å; S158-E162 VanDerWaalsContact O-CB 3.27Å; S158-E162 WeakPolarHBondContact O-CB 3.16Å; S158-E162 PolarHBondContact O-N 3.06Å; L159-E162 PolarHBondContact O-N 2.86Å; E162-L165 PolarHBondContact O-N 3.15Å; E162-L166 HydrophobicContact CG-CD1 4.01Å; E162-L166 HydrophobicContact CG-CG 4.46Å; E162-L166 WeakPolarHBondContact O-CB 3.24Å; E162-L166 VanDerWaalsContact O-CG 3.24Å; E162-L166 WeakPolarHBondContact O-CG 3.4Å; E162-L166 PolarHBondContact O-N 2.92Å
163	L	96.9	Very high	92	Very high	1 Å²	1	48.6 Å²	48.6	1%	0.005	26%	0.263	C	S	.	.	H	α-helix	trans	-65.5	-41.7	-179.6	-74.6	-179.6	0	0	0	112.5	V144 L159 L166 G167 I215 I218 M219	V144-L163 HydrophobicContact CG1-CD2 3.42Å; V144-L163 VanDerWaalsContact CG1-CD2 3.42Å; L159-L163 HydrophobicContact CD1-CD1 3.74Å; L159-L163 HydrophobicContact CD1-CG 3.96Å; L159-L163 HydrophobicContact CD2-CD1 4.32Å; L159-L163 HydrophobicContact CG-CD1 3.73Å; L159-L163 HydrophobicContact CG-CG 4.24Å; L159-L163 WeakPolarHBondContact O-CB 3.42Å; L159-L163 VanDerWaalsContact O-CG 3.29Å; L159-L163 WeakPolarHBondContact O-CG 3.45Å; L159-L163 PolarHBondContact O-N 3.42Å; L163-L166 PolarHBondContact O-N 3.26Å; L163-G167 PolarHBondContact O-N 3.46Å; L163-I215 HydrophobicContact CD1-CB 4.41Å; L163-I215 HydrophobicContact CD1-CG1 4.22Å; L163-I215 HydrophobicContact CD1-CG2 4.35Å; L163-I215 HydrophobicContact CD2-CG2 3.86Å; L163-I218 HydrophobicContact CB-CB 4.06Å; L163-I218 HydrophobicContact CB-CG2 3.49Å; L163-I218 VanDerWaalsContact CB-CG2 3.49Å; L163-I218 HydrophobicContact CD1-CB 4.01Å; L163-I218 HydrophobicContact CD1-CD1 3.69Å; L163-I218 HydrophobicContact CD1-CG1 4.49Å; L163-I218 HydrophobicContact CD1-CG2 4.13Å; L163-I218 HydrophobicContact CG-CG2 4.49Å; L163-M219 HydrophobicContact CB-CG 4.34Å; L163-M219 HydrophobicContact CD2-CG 3.99Å; L163-M219 HydrophobicContact CD2-SD 4.39Å
164	A	94.9	Very high	91.9	Very high	6 Å²	6	51.8 Å²	51.8	5%	0.05	27%	0.27	C	S	.	.	H	α-helix	trans	-63.7	-43.7	175.9	0	0	0	0	0	111.3	V26 Y160 L166 G167 A168 G222	V26-A164 HydrophobicContact CB-CB 4.39Å; V26-A164 HydrophobicContact CG1-CB 3.8Å; V26-A164 HydrophobicContact CG2-CB 3.57Å; Y160-A164 WeakPolarHBondContact O-CB 3.47Å; Y160-A164 PolarHBondContact O-N 2.95Å; A164-L166 VanDerWaalsContact C-N 3.34Å; A164-L166 PolarHBondContact O-N 2.85Å; A164-G167 PolarHBondContact O-N 3.32Å; A164-A168 PolarHBondContact O-N 3.02Å; A164-G222 WeakPolarHBondContact O-CA 3.3Å
165	L	95.8	Very high	92.2	Very high	87 Å²	87	52.8 Å²	52.8	46%	0.455	27%	0.266	S	S	.	.	H	α-helix	trans	-63.3	-39.6	175.3	179.4	61.6	0	0	0	112.1	E161 E162 G167 A168 K169	E161-L165 WeakPolarHBondContact O-CB 3.47Å; E161-L165 PolarHBondContact O-N 3.04Å; E162-L165 PolarHBondContact O-N 3.15Å; L165-G167 VanDerWaalsContact C-N 3.35Å; L165-A168 PolarHBondContact O-N 3Å; L165-K169 HydrophobicContact CG-CD 4.38Å; L165-K169 WeakPolarHBondContact O-CG 3.35Å; L165-K169 PolarHBondContact O-N 3.16Å
166	L	97	Very high	92.6	Very high	34 Å²	34	48.1 Å²	48.1	18%	0.178	24%	0.24	C	C	.	.	H	α-helix	trans	-64.5	-40.3	174.4	-74	171.4	0	0	0	111.5	V144 E162 L163 A164 K169 H170 M219	V144-L166 HydrophobicContact CG2-CD1 3.5Å; E162-L166 HydrophobicContact CG-CD1 4.01Å; E162-L166 HydrophobicContact CG-CG 4.46Å; E162-L166 WeakPolarHBondContact O-CB 3.24Å; E162-L166 VanDerWaalsContact O-CG 3.24Å; E162-L166 WeakPolarHBondContact O-CG 3.4Å; E162-L166 PolarHBondContact O-N 2.92Å; L163-L166 PolarHBondContact O-N 3.26Å; A164-L166 VanDerWaalsContact C-N 3.34Å; A164-L166 PolarHBondContact O-N 2.85Å; L166-K169 PolarHBondContact O-N 3.05Å; L166-H170 PolarHBondContact O-N 3.08Å; L166-H170 PolarHBondContact O-ND1 3.39Å; L166-M219 HydrophobicContact CB-CE 4.1Å
167	G	96.7	Very high	92.9	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-55.1	-51.8	172.2	0	0	0	0	0	112	L163 A164 L165 K169 H170 A171 M219 C223	L163-G167 PolarHBondContact O-N 3.46Å; A164-G167 PolarHBondContact O-N 3.32Å; L165-G167 VanDerWaalsContact C-N 3.35Å; G167-K169 VanDerWaalsContact C-N 3.35Å; G167-K169 PolarHBondContact O-N 3.24Å; G167-H170 PolarHBondContact O-N 3.41Å; G167-H170 VanDerWaalsContact O-N 3.11Å; G167-A171 PolarHBondContact O-N 3.4Å; G167-M219 VanDerWaalsContact CA-O 3.27Å; G167-M219 WeakPolarHBondContact CA-O 3.48Å; G167-C223 VanDerWaalsContact C-SG 3.59Å; G167-C223 PolarHBondContact O-SG 3.1Å
168	A	95.8	Very high	93.5	Very high	20 Å²	20	43.8 Å²	43.8	17%	0.165	22%	0.222	C	C	.	.	H	α-helix	trans	-58.4	-44.3	176.8	0	0	0	0	0	112.4	A164 L165 H170 A171 A172 G222 F226	A164-A168 PolarHBondContact O-N 3.02Å; L165-A168 PolarHBondContact O-N 3Å; A168-H170 VanDerWaalsContact C-N 3.29Å; A168-H170 PolarHBondContact O-N 3.03Å; A168-A171 PolarHBondContact O-N 3.5Å; A168-A172 PolarHBondContact O-N 2.81Å; A168-G222 WeakPolarHBondContact CA-O 3.2Å; A168-G222 PolarHBondContact N-O 3.23Å; A168-F226 HydrophobicContact CB-CB 3.89Å; A168-F226 HydrophobicContact CB-CD2 4.35Å; A168-F226 HydrophobicContact CB-CG 4.5Å
169	K	95.9	Very high	93.7	Very high	117 Å²	117	41.6 Å²	41.6	51%	0.509	20%	0.204	S	C	.	.	H	α-helix	trans	-61.5	-35.2	176	-74.4	171.1	179.5	169.3	0	113.1	L165 L166 G167	L165-K169 HydrophobicContact CG-CD 4.38Å; L165-K169 WeakPolarHBondContact O-CG 3.35Å; L165-K169 PolarHBondContact O-N 3.16Å; L166-K169 PolarHBondContact O-N 3.05Å; G167-K169 VanDerWaalsContact C-N 3.35Å; G167-K169 PolarHBondContact O-N 3.24Å
170	H	95.3	Very high	93.8	Very high	46 Å²	46	41.6 Å²	41.6	21%	0.213	20%	0.204	C	C	.	.	H	α-helix	trans	-73.5	-41.1	175.1	-77.6	79.2	0	0	0	111.3	L166 G167 A168 A172 I173 M176 F181	L166-H170 PolarHBondContact O-N 3.08Å; L166-H170 PolarHBondContact O-ND1 3.39Å; G167-H170 PolarHBondContact O-N 3.41Å; G167-H170 VanDerWaalsContact O-N 3.11Å; A168-H170 VanDerWaalsContact C-N 3.29Å; A168-H170 PolarHBondContact O-N 3.03Å; H170-A172 PolarHBondContact O-N 3.44Å; H170-I173 VanDerWaalsContact O-CB 3.27Å; H170-I173 WeakPolarHBondContact O-CB 3.41Å; H170-I173 WeakPolarHBondContact O-CG1 3.47Å; H170-I173 PolarHBondContact O-N 3.49Å; H170-M176 HydrophobicContact CB-CE 4.21Å; H170-M176 HydrophobicContact CB-CG 4.43Å; H170-M176 WeakPolarHBondContact O-CB 3.45Å; H170-M176 VanDerWaalsContact O-CG 3.28Å; H170-M176 WeakPolarHBondContact O-CG 3.44Å; H170-F181 HydrophobicContact CB-CE1 4.32Å; H170-F181 HydrophobicContact CB-CZ 3.71Å; H170-F181 AromaticContact CD2-CE1 3.81Å; H170-F181 AromaticContact CG-CE1 3.95Å; H170-F181 AromaticContact CG-CZ 3.81Å
171	A	94.3	Very high	93.9	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-59.2	-32.6	176.7	0	0	0	0	0	112	G167 A168 I173 C223 F226 R266 V269	G167-A171 PolarHBondContact O-N 3.4Å; A168-A171 PolarHBondContact O-N 3.5Å; A171-I173 PolarHBondContact O-N 2.72Å; A171-C223 HydrophobicContact CB-CB 3.92Å; A171-F226 HydrophobicContact CB-CB 3.99Å; A171-F226 HydrophobicContact CB-CD1 3.56Å; A171-F226 HydrophobicContact CB-CE1 4.35Å; A171-F226 HydrophobicContact CB-CG 3.94Å; A171-R266 PolarHBondContact O-NH2 3.5Å; A171-V269 HydrophobicContact CB-CG1 4.13Å; A171-V269 HydrophobicContact CB-CG2 4.33Å
172	A	92.8	Very high	94.1	Very high	47 Å²	47	42.1 Å²	42.1	39%	0.388	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-11.9	172.5	0	0	0	0	0	114.9	A168 H170 F226 R266	A168-A172 PolarHBondContact O-N 2.81Å; H170-A172 PolarHBondContact O-N 3.44Å; A172-F226 HydrophobicContact CB-CE1 4.32Å; A172-F226 HydrophobicContact CB-CE2 3.9Å; A172-F226 HydrophobicContact CB-CZ 3.73Å; A172-R266 PolarHBondContact O-NH2 3.49Å
173	I	92.3	Very high	94.1	Very high	70 Å²	70	40 Å²	40	36%	0.359	20%	0.195	S	C	.	.	S	Bend	trans	-78.9	126.1	173.2	-57.7	169.8	0	0	0	109.8	F117 H170 A171 N175 M176	F117-I173 HydrophobicContact CD1-CG2 3.83Å; F117-I173 HydrophobicContact CE1-CG2 4.22Å; H170-I173 VanDerWaalsContact O-CB 3.27Å; H170-I173 WeakPolarHBondContact O-CB 3.41Å; H170-I173 WeakPolarHBondContact O-CG1 3.47Å; H170-I173 PolarHBondContact O-N 3.49Å; A171-I173 PolarHBondContact O-N 2.72Å; I173-N175 PolarHBondContact O-N 3.17Å; I173-M176 HydrophobicContact CB-CB 4.13Å; I173-M176 WeakPolarHBondContact O-CB 3.45Å; I173-M176 PolarHBondContact O-N 3.08Å; I173-M176 VanDerWaalsContact O-N 3.12Å
174	R	89.6	Confident	94.1	Very high	182 Å²	182	41.3 Å²	41.3	69%	0.687	20%	0.202	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.2	134.4	179.5	-171.6	179.9	66.3	86.6	0.1	111.1	F117 M176	F117-R174 WeakPolarHBondContact CE1-O 3.29Å; R174-M176 PolarHBondContact O-N 3.34Å
175	N	89.7	Confident	94.2	Very high	62 Å²	62	42.9 Å²	42.9	33%	0.332	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	64.8	12	-177.4	-55.2	-18.5	0	0	0	115.4	F117 I173	F117-N175 HydrophobicContact CE1-CB 4.41Å; F117-N175 HydrophobicContact CZ-CB 4.38Å; F117-N175 WeakPolarHBondContact CZ-O 3.34Å; I173-N175 PolarHBondContact O-N 3.17Å
176	M	90.8	Very high	94.3	Very high	13 Å²	13	40.3 Å²	40.3	6%	0.064	19%	0.194	C	C	.	.			trans	-62.5	148.6	171.6	-177	62.1	-173.7	0	0	110.9	H170 I173 R174 Y180 F181 V269	H170-M176 HydrophobicContact CB-CE 4.21Å; H170-M176 HydrophobicContact CB-CG 4.43Å; H170-M176 WeakPolarHBondContact O-CB 3.45Å; H170-M176 VanDerWaalsContact O-CG 3.28Å; H170-M176 WeakPolarHBondContact O-CG 3.44Å; I173-M176 HydrophobicContact CB-CB 4.13Å; I173-M176 WeakPolarHBondContact O-CB 3.45Å; I173-M176 PolarHBondContact O-N 3.08Å; I173-M176 VanDerWaalsContact O-N 3.12Å; R174-M176 PolarHBondContact O-N 3.34Å; M176-Y180 HydrophobicContact CE-CD2 4.42Å; M176-Y180 HydrophobicContact SD-CD2 3.75Å; M176-F181 HydrophobicContact CE-CD1 4.15Å; M176-F181 HydrophobicContact CE-CD2 4.4Å; M176-F181 HydrophobicContact CE-CE1 3.65Å; M176-F181 HydrophobicContact CE-CE2 3.94Å; M176-F181 HydrophobicContact CE-CG 4.49Å; M176-F181 HydrophobicContact CE-CZ 3.53Å; M176-V269 HydrophobicContact CB-CG1 4.48Å; M176-V269 WeakPolarHBondContact O-CA 3.19Å; M176-V269 WeakPolarHBondContact O-CG1 3.37Å
177	K	92.3	Very high	94.4	Very high	13 Å²	13	38.7 Å²	38.7	6%	0.057	19%	0.185	C	C	.	.			trans	-136.5	140.8	176.5	-70.2	169.6	177.8	159.4	0	109.6	E179 Y180 V269 V272 E276	K177-E179 PolarHBondContact O-N 3.05Å; K177-Y180 HydrophobicContact CB-CD2 3.91Å; K177-Y180 HydrophobicContact CB-CE2 3.84Å; K177-Y180 HydrophobicContact CB-CG 4.34Å; K177-Y180 HydrophobicContact CD-CE2 4.3Å; K177-Y180 HydrophobicContact CG-CE2 4.15Å; K177-Y180 WeakPolarHBondContact O-CB 3.46Å; K177-Y180 PolarHBondContact O-N 3.22Å; K177-V269 WeakPolarHBondContact CA-O 3.31Å; K177-V272 HydrophobicContact CB-CG2 3.99Å; K177-V272 HydrophobicContact CD-CB 4.41Å; K177-V272 HydrophobicContact CD-CG1 3.99Å; K177-V272 HydrophobicContact CD-CG2 3.57Å; K177-V272 HydrophobicContact CG-CG2 3.74Å; K177-E276 IonicContact NZ-OE1 3.07Å; K177-E276 PolarHBondContact NZ-OE1 3.4Å; K177-E276 IonicContact NZ-OE2 3.49Å; K177-E276 PolarHBondContact NZ-OE2 3.01Å
178	I	93.3	Very high	94.4	Very high	25 Å²	25	39 Å²	39	13%	0.128	19%	0.187	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.1	-32	177.9	-66.8	175.7	0	0	0	110.2	Y180 F181 C223 L224 V269 A270	I178-Y180 PolarHBondContact O-N 3.36Å; I178-F181 HydrophobicContact CG2-CD2 4.35Å; I178-F181 WeakPolarHBondContact O-CB 3.38Å; I178-F181 WeakPolarHBondContact O-CD2 3.47Å; I178-F181 PolarHBondContact O-N 3.38Å; I178-C223 HydrophobicContact CD1-CB 4.02Å; I178-C223 HydrophobicContact CG1-CB 4Å; I178-L224 HydrophobicContact CD1-CD2 4.12Å; I178-L224 HydrophobicContact CD1-CG 4.25Å; I178-V269 HydrophobicContact CD1-CG2 4.03Å; I178-V269 HydrophobicContact CG1-CB 4.4Å; I178-V269 HydrophobicContact CG1-CG2 3.88Å; I178-V269 PolarHBondContact N-O 2.72Å; I178-A270 HydrophobicContact CD1-CB 4.13Å
179	E	92.2	Very high	94.6	Very high	21 Å²	21	38.6 Å²	38.6	10%	0.098	18%	0.182	C	C	.	.	H	α-helix	trans	-59.3	-29.1	177.7	-73.4	68.5	-155.9	0	0	113.5	K177 F181 K182 I183 V272 L277 I280	K177-E179 PolarHBondContact O-N 3.05Å; E179-F181 PolarHBondContact O-N 2.92Å; E179-K182 WeakPolarHBondContact O-CB 3.2Å; E179-K182 PolarHBondContact O-N 3.46Å; E179-I183 PolarHBondContact O-N 3.47Å; E179-V272 VanDerWaalsContact CD-CG2 3.45Å; E179-V272 HydrophobicContact CG-CG2 4.22Å; E179-V272 WeakPolarHBondContact OE2-CG2 3.37Å; E179-L277 HydrophobicContact CG-CD2 3.65Å; E179-I280 HydrophobicContact CB-CD1 3.89Å; E179-I280 HydrophobicContact CB-CG2 4.29Å; E179-I280 HydrophobicContact CG-CD1 4.49Å
180	Y	94.9	Very high	94.6	Very high	3 Å²	3	35.2 Å²	35.2	1%	0.012	17%	0.168	C	C	.	.	H	α-helix	trans	-63.9	-26.4	176.5	-62.5	-37.8	0	0	0	112	H111 L114 F117 M176 K177 I178 K182 I183 I184 I280	H111-Y180 AromaticContact NE2-CE1 3.91Å; L114-Y180 HydrophobicContact CD1-CD1 4.2Å; L114-Y180 HydrophobicContact CD1-CD2 4.35Å; L114-Y180 HydrophobicContact CD1-CG 3.93Å; F117-Y180 HydrophobicContact CE1-CE2 4.45Å; F117-Y180 HydrophobicContact CE2-CD2 4.21Å; F117-Y180 AromaticContact CE2-CE2 3.58Å; F117-Y180 HydrophobicContact CE2-CE2 3.58Å; F117-Y180 AromaticContact CE2-CZ 3.91Å; F117-Y180 HydrophobicContact CZ-CD2 4.26Å; F117-Y180 AromaticContact CZ-CE2 3.47Å; F117-Y180 HydrophobicContact CZ-CE2 3.47Å; F117-Y180 VanDerWaalsContact CZ-CE2 3.47Å; M176-Y180 HydrophobicContact CE-CD2 4.42Å; M176-Y180 HydrophobicContact SD-CD2 3.75Å; K177-Y180 HydrophobicContact CB-CD2 3.91Å; K177-Y180 HydrophobicContact CB-CE2 3.84Å; K177-Y180 HydrophobicContact CB-CG 4.34Å; K177-Y180 HydrophobicContact CD-CE2 4.3Å; K177-Y180 HydrophobicContact CG-CE2 4.15Å; K177-Y180 WeakPolarHBondContact O-CB 3.46Å; K177-Y180 PolarHBondContact O-N 3.22Å; I178-Y180 PolarHBondContact O-N 3.36Å; Y180-K182 PolarHBondContact O-N 3.21Å; Y180-I183 HydrophobicContact CD1-CD1 3.99Å; Y180-I183 PolarHBondContact O-N 3.39Å; Y180-I184 WeakPolarHBondContact O-CG1 3.18Å; Y180-I184 PolarHBondContact O-N 3.18Å; Y180-I184 VanDerWaalsContact O-N 3.08Å; Y180-I280 HydrophobicContact CE1-CD1 4.28Å
181	F	95.8	Very high	94.8	Very high	13 Å²	13	33 Å²	33	6%	0.057	16%	0.158	C	C	.	.	H	α-helix	trans	-64.6	-30.2	172	-63.1	-52.3	0	0	0	112.7	H170 M176 I178 E179 I184 K185 V216 M219	H170-F181 HydrophobicContact CB-CE1 4.32Å; H170-F181 HydrophobicContact CB-CZ 3.71Å; H170-F181 AromaticContact CD2-CE1 3.81Å; H170-F181 AromaticContact CG-CE1 3.95Å; H170-F181 AromaticContact CG-CZ 3.81Å; M176-F181 HydrophobicContact CE-CD1 4.15Å; M176-F181 HydrophobicContact CE-CD2 4.4Å; M176-F181 HydrophobicContact CE-CE1 3.65Å; M176-F181 HydrophobicContact CE-CE2 3.94Å; M176-F181 HydrophobicContact CE-CG 4.49Å; M176-F181 HydrophobicContact CE-CZ 3.53Å; I178-F181 HydrophobicContact CG2-CD2 4.35Å; I178-F181 WeakPolarHBondContact O-CB 3.38Å; I178-F181 WeakPolarHBondContact O-CD2 3.47Å; I178-F181 PolarHBondContact O-N 3.38Å; E179-F181 PolarHBondContact O-N 2.92Å; F181-I184 PolarHBondContact O-N 3.19Å; F181-K185 PolarHBondContact O-N 2.98Å; F181-V216 HydrophobicContact CB-CB 4.45Å; F181-V216 HydrophobicContact CB-CG1 3.77Å; F181-V216 HydrophobicContact CB-CG2 3.95Å; F181-M219 HydrophobicContact CD1-CE 4.16Å; F181-M219 HydrophobicContact CD1-SD 4.42Å; F181-M219 HydrophobicContact CE1-CE 3.35Å; F181-M219 HydrophobicContact CE1-SD 4.17Å; F181-M219 HydrophobicContact CE2-CB 4.28Å; F181-M219 HydrophobicContact CE2-CE 4.45Å; F181-M219 HydrophobicContact CZ-CB 4.42Å; F181-M219 HydrophobicContact CZ-CE 3.53Å
182	K	94.6	Very high	94.9	Very high	79 Å²	79	33 Å²	33	34%	0.343	16%	0.158	S	C	.	.	H	α-helix	trans	-69.8	-36.1	176	-58.5	179.1	-175.6	171.1	0	111.5	E179 Y180 K185 E186 Y281	E179-K182 WeakPolarHBondContact O-CB 3.2Å; E179-K182 PolarHBondContact O-N 3.46Å; Y180-K182 PolarHBondContact O-N 3.21Å; K182-K185 WeakPolarHBondContact O-CB 3.43Å; K182-K185 PolarHBondContact O-N 3.27Å; K182-E186 PolarHBondContact O-N 3.47Å; K182-Y281 HydrophobicContact CD-CE1 3.83Å; K182-Y281 PolarHBondContact NZ-OH 2.77Å
183	I	95.6	Very high	95.2	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-63.7	-43.1	171.5	-69.5	159.1	0	0	0	110.5	I110 H111 L114 E179 Y180 E186 A187 I280	I110-I183 HydrophobicContact CB-CG2 4.35Å; I110-I183 HydrophobicContact CG2-CG2 3.89Å; H111-I183 HydrophobicContact CB-CD1 3.62Å; H111-I183 HydrophobicContact CB-CG1 4.27Å; H111-I183 HydrophobicContact CB-CG2 4Å; L114-I183 HydrophobicContact CD2-CG2 3.9Å; E179-I183 PolarHBondContact O-N 3.47Å; Y180-I183 HydrophobicContact CD1-CD1 3.99Å; Y180-I183 PolarHBondContact O-N 3.39Å; I183-E186 PolarHBondContact O-N 3.04Å; I183-A187 WeakPolarHBondContact O-CB 3.48Å; I183-A187 PolarHBondContact O-N 3.42Å; I183-I280 HydrophobicContact CD1-CB 4.47Å; I183-I280 HydrophobicContact CD1-CG1 4.27Å; I183-I280 HydrophobicContact CD1-CG2 3.75Å; I183-I280 HydrophobicContact CG1-CG2 4Å
184	I	96.9	Very high	95.4	Very high	29 Å²	29	33.6 Å²	33.6	15%	0.149	15%	0.152	C	C	.	.	H	α-helix	trans	-63.2	-42.2	176.1	-64.3	-62	0	0	0	111.1	F104 A107 L114 Y180 F181 E186 A187 I188	F104-I184 HydrophobicContact CE1-CD1 4.1Å; A107-I184 HydrophobicContact CB-CD1 3.87Å; L114-I184 HydrophobicContact CD2-CD1 3.78Å; L114-I184 HydrophobicContact CD2-CG1 4.39Å; Y180-I184 WeakPolarHBondContact O-CG1 3.18Å; Y180-I184 PolarHBondContact O-N 3.18Å; Y180-I184 VanDerWaalsContact O-N 3.08Å; F181-I184 PolarHBondContact O-N 3.19Å; I184-E186 PolarHBondContact O-N 3.47Å; I184-A187 PolarHBondContact O-N 3.49Å; I184-I188 HydrophobicContact CG2-CD1 3.96Å; I184-I188 HydrophobicContact CG2-CG1 4.45Å; I184-I188 VanDerWaalsContact O-CG1 3.27Å; I184-I188 WeakPolarHBondContact O-CG1 3.45Å; I184-I188 PolarHBondContact O-N 3.03Å
185	K	97.4	Very high	95.7	Very high	39 Å²	39	27.4 Å²	27.4	17%	0.17	13%	0.132	C	C	.	.	H	α-helix	trans	-54.6	-50.7	172.8	172.8	-174.1	-179.7	-164.2	0	111.3	F181 K182 A187 I188 L189 G209 L212 D213	F181-K185 PolarHBondContact O-N 2.98Å; K182-K185 WeakPolarHBondContact O-CB 3.43Å; K182-K185 PolarHBondContact O-N 3.27Å; K185-A187 VanDerWaalsContact C-N 3.32Å; K185-A187 PolarHBondContact O-N 2.7Å; K185-I188 WeakPolarHBondContact O-CB 3.48Å; K185-I188 PolarHBondContact O-N 2.83Å; K185-I188 VanDerWaalsContact O-N 3.15Å; K185-L189 HydrophobicContact CG-CD1 4.44Å; K185-L189 PolarHBondContact O-N 3.34Å; K185-G209 WeakPolarHBondContact CE-O 3.46Å; K185-L212 HydrophobicContact CB-CB 4.48Å; K185-L212 HydrophobicContact CD-CB 4.17Å; K185-L212 HydrophobicContact CG-CB 3.79Å; K185-L212 HydrophobicContact CG-CD1 4Å; K185-D213 WeakPolarHBondContact CE-OD1 3.47Å; K185-D213 IonicContact NZ-OD1 2.74Å; K185-D213 PolarHBondContact NZ-OD1 3.42Å; K185-D213 IonicContact NZ-OD2 3.95Å; K185-D213 PolarHBondContact NZ-OD2 3.44Å
186	E	97.3	Very high	96.1	Very high	34 Å²	34	25.3 Å²	25.3	16%	0.159	12%	0.121	C	C	.	.	H	α-helix	trans	-59.4	-44.6	178.7	-175.4	61.4	-157.8	0	0	111.4	I110 K182 I183 I184 I188 L189 M190 K285	I110-E186 HydrophobicContact CD1-CB 4.22Å; I110-E186 HydrophobicContact CD1-CG 3.84Å; K182-E186 PolarHBondContact O-N 3.47Å; I183-E186 PolarHBondContact O-N 3.04Å; I184-E186 PolarHBondContact O-N 3.47Å; E186-I188 VanDerWaalsContact C-N 3.27Å; E186-I188 PolarHBondContact O-N 3.06Å; E186-L189 PolarHBondContact O-N 3.32Å; E186-M190 WeakPolarHBondContact O-CB 3.24Å; E186-M190 PolarHBondContact O-N 3.32Å; E186-K285 PolarHBondContact OE2-N 2.73Å
187	A	97.9	Very high	96.3	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-61.6	-34.6	177.1	0	0	0	0	0	112.7	I103 N106 A107 I110 I183 I184 K185 T191	I103-A187 HydrophobicContact CG2-CB 4.11Å; I103-A187 WeakPolarHBondContact O-CB 3.41Å; N106-A187 HydrophobicContact CB-CB 4.06Å; A107-A187 HydrophobicContact CB-CB 3.68Å; I110-A187 HydrophobicContact CD1-CB 3.96Å; I183-A187 WeakPolarHBondContact O-CB 3.48Å; I183-A187 PolarHBondContact O-N 3.42Å; I184-A187 PolarHBondContact O-N 3.49Å; K185-A187 VanDerWaalsContact C-N 3.32Å; K185-A187 PolarHBondContact O-N 2.7Å; A187-T191 WeakPolarHBondContact O-CB 3.42Å; A187-T191 PolarHBondContact O-N 3.35Å; A187-T191 PolarHBondContact O-OG1 3.45Å
188	I	98.4	Very high	96.5	Very high	7 Å²	7	41.4 Å²	41.4	4%	0.036	19%	0.19	C	C	.	.	H	α-helix	trans	-65.8	-50.9	174	-66.2	162.6	0	0	0	110.5	I103 I145 I184 K185 E186 M190 T191 W192 L212	I103-I188 HydrophobicContact CD1-CB 4.48Å; I103-I188 HydrophobicContact CD1-CG1 3.72Å; I103-I188 HydrophobicContact CG1-CG1 4.01Å; I103-I188 HydrophobicContact CG2-CG1 3.72Å; I145-I188 HydrophobicContact CD1-CD1 4.14Å; I184-I188 HydrophobicContact CG2-CD1 3.96Å; I184-I188 HydrophobicContact CG2-CG1 4.45Å; I184-I188 VanDerWaalsContact O-CG1 3.27Å; I184-I188 WeakPolarHBondContact O-CG1 3.45Å; I184-I188 PolarHBondContact O-N 3.03Å; K185-I188 WeakPolarHBondContact O-CB 3.48Å; K185-I188 PolarHBondContact O-N 2.83Å; K185-I188 VanDerWaalsContact O-N 3.15Å; E186-I188 VanDerWaalsContact C-N 3.27Å; E186-I188 PolarHBondContact O-N 3.06Å; I188-M190 VanDerWaalsContact C-N 3.34Å; I188-M190 PolarHBondContact O-N 3.15Å; I188-T191 CarbonylContact O-C 3.59Å; I188-T191 WeakPolarHBondContact O-CA 3.22Å; I188-T191 WeakPolarHBondContact O-CB 3.34Å; I188-T191 PolarHBondContact O-N 3.37Å; I188-W192 HydrophobicContact CG2-CD2 4.03Å; I188-W192 HydrophobicContact CG2-CE3 4.23Å; I188-W192 HydrophobicContact CG2-CH2 4.07Å; I188-W192 HydrophobicContact CG2-CZ2 3.91Å; I188-W192 HydrophobicContact CG2-CZ3 4.2Å; I188-W192 PolarHBondContact O-N 3.29Å; I188-L212 HydrophobicContact CB-CD1 3.97Å; I188-L212 HydrophobicContact CD1-CD1 4.48Å; I188-L212 HydrophobicContact CD1-CD2 3.66Å; I188-L212 HydrophobicContact CG2-CD1 3.71Å; I188-L212 HydrophobicContact CG2-CD2 4.18Å
189	L	98.3	Very high	96.5	Very high	10 Å²	10	46.2 Å²	46.2	5%	0.052	21%	0.212	C	C	.	.	H	α-helix	trans	-61.9	-41.4	179.3	-66.8	176.8	0	0	0	111.8	K185 E186 T191 W192 G193 F200 W208 L212	K185-L189 HydrophobicContact CG-CD1 4.44Å; K185-L189 PolarHBondContact O-N 3.34Å; E186-L189 PolarHBondContact O-N 3.32Å; L189-T191 VanDerWaalsContact C-N 3.29Å; L189-T191 PolarHBondContact O-N 3.02Å; L189-W192 PolarHBondContact O-N 3.38Å; L189-W192 VanDerWaalsContact O-N 3.17Å; L189-G193 PolarHBondContact O-N 3.47Å; L189-F200 HydrophobicContact CB-CZ 4.43Å; L189-F200 HydrophobicContact CD2-CZ 4.42Å; L189-F200 WeakPolarHBondContact O-CZ 3.16Å; L189-W208 HydrophobicContact CD2-CB 3.89Å; L189-L212 HydrophobicContact CD2-CD1 3.9Å; L189-L212 HydrophobicContact CG-CD1 3.96Å
190	M	97.5	Very high	96.8	Very high	46 Å²	46	47.4 Å²	47.4	23%	0.227	22%	0.216	C	C	.	.	H	α-helix	trans	-61.9	-37.7	173.2	-176.1	166.3	72.1	0	0	111.8	N106 I110 E186 I188 R194	N106-M190 HydrophobicContact CB-CE 3.32Å; N106-M190 VanDerWaalsContact CG-CE 3.42Å; I110-M190 HydrophobicContact CD1-CE 3.9Å; I110-M190 HydrophobicContact CG1-CE 4.09Å; E186-M190 WeakPolarHBondContact O-CB 3.24Å; E186-M190 PolarHBondContact O-N 3.32Å; I188-M190 VanDerWaalsContact C-N 3.34Å; I188-M190 PolarHBondContact O-N 3.15Å; M190-R194 VanDerWaalsContact O-CG 3.31Å; M190-R194 WeakPolarHBondContact O-CG 3.37Å; M190-R194 PolarHBondContact O-N 3.33Å; M190-R194 VanDerWaalsContact O-N 3.15Å; M190-R194 PolarHBondContact SD-NH2 3.03Å
191	T	98.1	Very high	97	Very high	1 Å²	1	50.3 Å²	50.3	1%	0.006	24%	0.235	C	C	.	.	H	α-helix	trans	-65.3	-41.3	174.5	-53.3	0	0	0	0	111.1	T99 L102 I103 N106 A187 I188 L189 R194 L195	T99-T191 HydrophobicContact CG2-CG2 4.35Å; L102-T191 HydrophobicContact CB-CG2 3.83Å; I103-T191 WeakPolarHBondContact CA-OG1 3.24Å; I103-T191 HydrophobicContact CG1-CG2 4.1Å; I103-T191 WeakPolarHBondContact CG1-OG1 3.31Å; N106-T191 PolarHBondContact ND2-N 3Å; N106-T191 PolarHBondContact ND2-OG1 3.13Å; A187-T191 WeakPolarHBondContact O-CB 3.42Å; A187-T191 PolarHBondContact O-N 3.35Å; A187-T191 PolarHBondContact O-OG1 3.45Å; I188-T191 CarbonylContact O-C 3.59Å; I188-T191 WeakPolarHBondContact O-CA 3.22Å; I188-T191 WeakPolarHBondContact O-CB 3.34Å; I188-T191 PolarHBondContact O-N 3.37Å; L189-T191 VanDerWaalsContact C-N 3.29Å; L189-T191 PolarHBondContact O-N 3.02Å; T191-R194 PolarHBondContact O-N 2.95Å; T191-L195 HydrophobicContact CG2-CD1 3.86Å; T191-L195 HydrophobicContact CG2-CG 4.21Å; T191-L195 WeakPolarHBondContact O-CB 2.99Å; T191-L195 VanDerWaalsContact O-CG 3.29Å; T191-L195 WeakPolarHBondContact O-CG 3.45Å; T191-L195 PolarHBondContact O-N 3.31Å
192	W	98.1	Very high	97.1	Very high	0 Å²	0	55.6 Å²	55.6	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-65.1	-47.7	-178	-80	-160.3	0	0	0	109.7	W89 L92 T99 I103 M142 I145 I188 L189 R194 L195 I196 F200 W208	W89-W192 HydrophobicContact CZ3-CZ2 4.4Å; L92-W192 HydrophobicContact CB-CZ2 4.26Å; L92-W192 HydrophobicContact CD1-CD2 4.2Å; L92-W192 HydrophobicContact CD1-CG 3.96Å; L92-W192 VanDerWaalsContact CD1-NE1 3.3Å; L92-W192 HydrophobicContact CD2-CB 3.9Å; L92-W192 HydrophobicContact CD2-CD2 3.58Å; L92-W192 HydrophobicContact CD2-CE3 4.06Å; L92-W192 HydrophobicContact CD2-CG 3.51Å; L92-W192 HydrophobicContact CG-CD2 4.31Å; L92-W192 HydrophobicContact CG-CG 4.31Å; T99-W192 HydrophobicContact CG2-CE3 4.18Å; T99-W192 HydrophobicContact CG2-CH2 3.5Å; T99-W192 VanDerWaalsContact CG2-CH2 3.5Å; T99-W192 HydrophobicContact CG2-CZ3 3.15Å; I103-W192 HydrophobicContact CD1-CH2 3.98Å; I103-W192 HydrophobicContact CD1-CZ3 3.84Å; I103-W192 HydrophobicContact CG1-CZ3 4.28Å; M142-W192 HydrophobicContact CE-CH2 3.9Å; M142-W192 HydrophobicContact SD-CH2 3.99Å; I145-W192 HydrophobicContact CD1-CH2 4.4Å; I145-W192 HydrophobicContact CD1-CZ2 4.41Å; I188-W192 HydrophobicContact CG2-CD2 4.03Å; I188-W192 HydrophobicContact CG2-CE3 4.23Å; I188-W192 HydrophobicContact CG2-CH2 4.07Å; I188-W192 HydrophobicContact CG2-CZ2 3.91Å; I188-W192 HydrophobicContact CG2-CZ3 4.2Å; I188-W192 PolarHBondContact O-N 3.29Å; L189-W192 PolarHBondContact O-N 3.38Å; L189-W192 VanDerWaalsContact O-N 3.17Å; W192-R194 VanDerWaalsContact C-N 3.26Å; W192-R194 PolarHBondContact O-N 3.47Å; W192-L195 HydrophobicContact CE3-CD1 4.25Å; W192-L195 HydrophobicContact CZ3-CD1 4.42Å; W192-L195 PolarHBondContact O-N 2.74Å; W192-I196 WeakPolarHBondContact O-CG1 3.29Å; W192-I196 PolarHBondContact O-N 3.41Å; W192-F200 HydrophobicContact CB-CD2 3.91Å; W192-F200 HydrophobicContact CB-CE2 3.55Å; W192-F200 HydrophobicContact CB-CZ 4.33Å; W192-W208 AromaticContact CD1-CD1 3.84Å; W192-W208 AromaticContact CD1-CD2 3.76Å; W192-W208 AromaticContact CD1-CG 3.65Å; W192-W208 AromaticContact NE1-CD2 3.34Å; W192-W208 VanDerWaalsContact NE1-CD2 3.34Å; W192-W208 AromaticContact NE1-CE2 3.65Å; W192-W208 AromaticContact NE1-CE3 3.56Å; W192-W208 AromaticContact NE1-CG 3.75Å
193	G	97.7	Very high	97.2	Very high	20 Å²	20	56.3 Å²	56.3	21%	0.206	27%	0.271	C	S	.	.	H	α-helix	trans	-55.1	-39.7	174.6	0	0	0	0	0	113.4	L189 L195 Y197 F200	L189-G193 PolarHBondContact O-N 3.47Å; G193-L195 VanDerWaalsContact C-N 3.35Å; G193-L195 PolarHBondContact O-N 3.21Å; G193-Y197 WeakPolarHBondContact O-CA 3.41Å; G193-Y197 PolarHBondContact O-N 2.75Å; G193-Y197 VanDerWaalsContact O-N 3.13Å; G193-F200 VanDerWaalsContact CA-CD1 3.46Å; G193-F200 VanDerWaalsContact CA-CG 3.43Å
194	R	96.5	Very high	97.3	Very high	109 Å²	109	56.6 Å²	56.6	41%	0.411	27%	0.273	S	S	.	.	H	α-helix	trans	-74.2	-19.6	176.3	-69.9	174.5	-179.6	-175.5	-3.4	113.9	N106 E109 M190 T191 W192 Y197	N106-R194 PolarHBondContact OD1-NH1 2.95Å; E109-R194 IonicContact OE1-NH2 3.5Å; E109-R194 IonicContact OE2-NH1 3.38Å; E109-R194 PolarHBondContact OE2-NH1 3.25Å; E109-R194 IonicContact OE2-NH2 3.67Å; M190-R194 VanDerWaalsContact O-CG 3.31Å; M190-R194 WeakPolarHBondContact O-CG 3.37Å; M190-R194 PolarHBondContact O-N 3.33Å; M190-R194 VanDerWaalsContact O-N 3.15Å; M190-R194 PolarHBondContact SD-NH2 3.03Å; T191-R194 PolarHBondContact O-N 2.95Å; W192-R194 VanDerWaalsContact C-N 3.26Å; W192-R194 PolarHBondContact O-N 3.47Å; R194-Y197 VanDerWaalsContact O-CE2 3.28Å; R194-Y197 WeakPolarHBondContact O-CE2 3.31Å; R194-Y197 PolarHBondContact O-OH 2.98Å
195	L	97	Very high	97.4	Very high	52 Å²	52	58.6 Å²	58.6	27%	0.272	28%	0.281	S	S	.	.	H	α-helix	trans	-92.3	-40.2	-176.9	-77.3	177.7	0	0	0	113.2	L92 T99 L102 T191 W192 G193	L92-L195 HydrophobicContact CD2-CB 4.4Å; T99-L195 HydrophobicContact CG2-CD1 3.72Å; L102-L195 HydrophobicContact CD1-CD2 4.19Å; T191-L195 HydrophobicContact CG2-CD1 3.86Å; T191-L195 HydrophobicContact CG2-CG 4.21Å; T191-L195 WeakPolarHBondContact O-CB 2.99Å; T191-L195 VanDerWaalsContact O-CG 3.29Å; T191-L195 WeakPolarHBondContact O-CG 3.45Å; T191-L195 PolarHBondContact O-N 3.31Å; W192-L195 HydrophobicContact CE3-CD1 4.25Å; W192-L195 HydrophobicContact CZ3-CD1 4.42Å; W192-L195 PolarHBondContact O-N 2.74Å; G193-L195 VanDerWaalsContact C-N 3.35Å; G193-L195 PolarHBondContact O-N 3.21Å
196	I	97	Very high	97.4	Very high	17 Å²	17	61.6 Å²	61.6	9%	0.087	30%	0.299	C	S	.	.	H	α-helix	trans	-110.8	-0.8	-175.6	69.3	172.8	0	0	0	113.4	T88 L91 L92 W192 E198 E199 F200 V204	T88-I196 HydrophobicContact CG2-CD1 4.27Å; L91-I196 HydrophobicContact CB-CG2 3.82Å; L91-I196 HydrophobicContact CD1-CG2 4.19Å; L92-I196 HydrophobicContact CD2-CD1 4.48Å; L92-I196 HydrophobicContact CD2-CG2 3.77Å; L92-I196 HydrophobicContact CG-CG2 4.32Å; W192-I196 WeakPolarHBondContact O-CG1 3.29Å; W192-I196 PolarHBondContact O-N 3.41Å; I196-E198 PolarHBondContact O-N 3.05Å; I196-E198 VanDerWaalsContact O-N 3.13Å; I196-E199 HydrophobicContact CB-CB 4.1Å; I196-E199 HydrophobicContact CD1-CB 4.13Å; I196-E199 HydrophobicContact CG1-CB 4.2Å; I196-E199 WeakPolarHBondContact O-CB 3.35Å; I196-E199 PolarHBondContact O-N 2.93Å; I196-F200 HydrophobicContact CD1-CB 4.2Å; I196-F200 HydrophobicContact CD1-CD2 4.19Å; I196-F200 HydrophobicContact CG1-CB 3.83Å; I196-F200 HydrophobicContact CG1-CD2 4.36Å; I196-V204 HydrophobicContact CD1-CG1 4.03Å
197	Y	95.8	Very high	97.5	Very high	177 Å²	177	60.1 Å²	60.1	69%	0.694	29%	0.292	S	S	*	.	G	3₁₀ helix	trans	50.3	-112.6	169	-58.7	-87.8	0	0	0	113.2	G193 R194 E199 F200	G193-Y197 WeakPolarHBondContact O-CA 3.41Å; G193-Y197 PolarHBondContact O-N 2.75Å; G193-Y197 VanDerWaalsContact O-N 3.13Å; R194-Y197 VanDerWaalsContact O-CE2 3.28Å; R194-Y197 WeakPolarHBondContact O-CE2 3.31Å; R194-Y197 PolarHBondContact O-OH 2.98Å; Y197-E199 PolarHBondContact O-N 3.19Å; Y197-F200 WeakPolarHBondContact O-CB 3.41Å; Y197-F200 PolarHBondContact O-N 2.78Å
198	E	95.3	Very high	97.5	Very high	187 Å²	187	60.1 Å²	60.1	87%	0.874	29%	0.292	S	S	*	.	G	3₁₀ helix	trans	-62.9	-25	-177.1	-62.3	-178.8	-178.8	0	0	112.9	I196 F200	I196-E198 PolarHBondContact O-N 3.05Å; I196-E198 VanDerWaalsContact O-N 3.13Å; E198-F200 PolarHBondContact O-N 3.26Å
199	E	95.2	Very high	97.5	Very high	126 Å²	126	60.1 Å²	60.1	59%	0.589	29%	0.294	S	S	*	.	G	3₁₀ helix	trans	-76.2	-11	175.3	-58.1	-65	167.2	0	0	112.5	I196 Y197 T201 V204	I196-E199 HydrophobicContact CB-CB 4.1Å; I196-E199 HydrophobicContact CD1-CB 4.13Å; I196-E199 HydrophobicContact CG1-CB 4.2Å; I196-E199 WeakPolarHBondContact O-CB 3.35Å; I196-E199 PolarHBondContact O-N 2.93Å; Y197-E199 PolarHBondContact O-N 3.19Å; E199-T201 PolarHBondContact O-N 3.1Å; E199-V204 WeakPolarHBondContact O-CG2 3.29Å
200	F	97.9	Very high	97.5	Very high	46 Å²	46	62 Å²	62	20%	0.202	30%	0.302	C	S	.	.			trans	-81.6	68.3	176.6	-166.9	-111.1	0	0	0	111.1	L189 W192 G193 I196 Y197 E198 V204 K205	L189-F200 HydrophobicContact CB-CZ 4.43Å; L189-F200 HydrophobicContact CD2-CZ 4.42Å; L189-F200 WeakPolarHBondContact O-CZ 3.16Å; W192-F200 HydrophobicContact CB-CD2 3.91Å; W192-F200 HydrophobicContact CB-CE2 3.55Å; W192-F200 HydrophobicContact CB-CZ 4.33Å; G193-F200 VanDerWaalsContact CA-CD1 3.46Å; G193-F200 VanDerWaalsContact CA-CG 3.43Å; I196-F200 HydrophobicContact CD1-CB 4.2Å; I196-F200 HydrophobicContact CD1-CD2 4.19Å; I196-F200 HydrophobicContact CG1-CB 3.83Å; I196-F200 HydrophobicContact CG1-CD2 4.36Å; Y197-F200 WeakPolarHBondContact O-CB 3.41Å; Y197-F200 PolarHBondContact O-N 2.78Å; E198-F200 PolarHBondContact O-N 3.26Å; F200-V204 HydrophobicContact CD2-CB 4.29Å; F200-V204 HydrophobicContact CD2-CG1 3.66Å; F200-V204 HydrophobicContact CE2-CG1 4.01Å; F200-K205 HydrophobicContact CE1-CB 3.94Å; F200-K205 HydrophobicContact CE1-CD 4.38Å; F200-K205 HydrophobicContact CE1-CG 4.16Å; F200-K205 HydrophobicContact CE2-CB 4.37Å; F200-K205 HydrophobicContact CZ-CB 3.74Å; F200-K205 HydrophobicContact CZ-CG 3.94Å
201	T	97.8	Very high	97.6	Very high	64 Å²	64	59.9 Å²	59.9	39%	0.393	29%	0.292	S	S	.	.			trans	-72.1	169.8	177.3	69	0	0	0	0	112	E199 D203 V204 K205	E199-T201 PolarHBondContact O-N 3.1Å; T201-D203 PolarHBondContact O-N 3.16Å; T201-V204 WeakPolarHBondContact O-CB 3.34Å; T201-V204 PolarHBondContact O-N 2.89Å; T201-V204 VanDerWaalsContact O-N 3.1Å; T201-V204 WeakPolarHBondContact OG1-CG2 3.48Å; T201-V204 PolarHBondContact OG1-N 2.85Å; T201-K205 PolarHBondContact O-N 3.18Å
202	D	97.8	Very high	97.6	Very high	125 Å²	125	60 Å²	60	67%	0.668	29%	0.293	S	S	*	.	H	α-helix	trans	-58.8	-36.4	174.1	-73.9	-27.1	0	0	0	112	V204 K205 N206	D202-V204 VanDerWaalsContact C-N 3.34Å; D202-V204 PolarHBondContact O-N 3.4Å; D202-K205 PolarHBondContact O-N 2.76Å; D202-N206 VanDerWaalsContact O-CB 3.26Å; D202-N206 WeakPolarHBondContact O-CB 3.33Å; D202-N206 PolarHBondContact O-N 2.9Å; D202-N206 PolarHBondContact O-ND2 3.22Å
203	D	97.9	Very high	97.5	Very high	93 Å²	93	63.8 Å²	63.8	50%	0.497	31%	0.312	S	S	.	.	H	α-helix	trans	-62.8	-41.5	175.5	-67.3	-28.1	0	0	0	111.2	V84 T201 N206 A207	V84-D203 HydrophobicContact CG2-CB 4.31Å; T201-D203 PolarHBondContact O-N 3.16Å; D203-N206 PolarHBondContact O-N 2.89Å; D203-A207 VanDerWaalsContact O-CB 3.27Å; D203-A207 WeakPolarHBondContact O-CB 3.48Å; D203-A207 PolarHBondContact O-N 3.3Å
204	V	98.3	Very high	97.5	Very high	7 Å²	7	63.7 Å²	63.7	4%	0.042	31%	0.307	C	S	.	.	H	α-helix	trans	-65.1	-47.1	174.7	179.7	0	0	0	0	111.2	V84 T88 I196 E199 F200 T201 D202 N206 W208	V84-V204 HydrophobicContact CG1-CB 4.2Å; V84-V204 HydrophobicContact CG1-CG2 3.73Å; T88-V204 HydrophobicContact CG2-CG1 4.13Å; T88-V204 HydrophobicContact CG2-CG2 3.83Å; I196-V204 HydrophobicContact CD1-CG1 4.03Å; E199-V204 WeakPolarHBondContact O-CG2 3.29Å; F200-V204 HydrophobicContact CD2-CB 4.29Å; F200-V204 HydrophobicContact CD2-CG1 3.66Å; F200-V204 HydrophobicContact CE2-CG1 4.01Å; T201-V204 WeakPolarHBondContact O-CB 3.34Å; T201-V204 PolarHBondContact O-N 2.89Å; T201-V204 VanDerWaalsContact O-N 3.1Å; T201-V204 WeakPolarHBondContact OG1-CG2 3.48Å; T201-V204 PolarHBondContact OG1-N 2.85Å; D202-V204 VanDerWaalsContact C-N 3.34Å; D202-V204 PolarHBondContact O-N 3.4Å; V204-N206 VanDerWaalsContact C-N 3.3Å; V204-N206 PolarHBondContact O-N 3.33Å; V204-W208 WeakPolarHBondContact O-CB 3.28Å; V204-W208 PolarHBondContact O-N 3.13Å
205	K	98.3	Very high	97.5	Very high	71 Å²	71	59 Å²	59	31%	0.309	29%	0.29	S	S	.	.	H	α-helix	trans	-58.2	-44.8	177.2	-176.4	177.6	178.8	178.6	0	110.8	F200 T201 D202 G209 K285	F200-K205 HydrophobicContact CE1-CB 3.94Å; F200-K205 HydrophobicContact CE1-CD 4.38Å; F200-K205 HydrophobicContact CE1-CG 4.16Å; F200-K205 HydrophobicContact CE2-CB 4.37Å; F200-K205 HydrophobicContact CZ-CB 3.74Å; F200-K205 HydrophobicContact CZ-CG 3.94Å; T201-K205 PolarHBondContact O-N 3.18Å; D202-K205 PolarHBondContact O-N 2.76Å; K205-G209 WeakPolarHBondContact O-CA 3.49Å; K205-G209 PolarHBondContact O-N 3.38Å; K205-K285 PolarHBondContact NZ-O 2.85Å
206	N	98.2	Very high	97.5	Very high	102 Å²	102	57.7 Å²	57.7	55%	0.545	28%	0.284	S	S	.	.	H	α-helix	trans	-69.6	-47.2	-177.4	-70.4	-31.9	0	0	0	112	D202 D203 V204 G209 H210	D202-N206 VanDerWaalsContact O-CB 3.26Å; D202-N206 WeakPolarHBondContact O-CB 3.33Å; D202-N206 PolarHBondContact O-N 2.9Å; D202-N206 PolarHBondContact O-ND2 3.22Å; D203-N206 PolarHBondContact O-N 2.89Å; V204-N206 VanDerWaalsContact C-N 3.3Å; V204-N206 PolarHBondContact O-N 3.33Å; N206-G209 PolarHBondContact O-N 3.45Å; N206-H210 WeakPolarHBondContact O-CB 3.44Å; N206-H210 PolarHBondContact O-N 2.96Å
207	A	98.5	Very high	97.5	Very high	2 Å²	2	58.7 Å²	58.7	2%	0.017	30%	0.298	C	S	.	.	H	α-helix	trans	-63.4	-46.6	-179.8	0	0	0	0	0	111.8	E81 V84 L85 D203 H210 V211	E81-A207 HydrophobicContact CB-CB 4.15Å; E81-A207 HydrophobicContact CG-CB 4.12Å; V84-A207 HydrophobicContact CB-CB 4.25Å; V84-A207 HydrophobicContact CG1-CB 3.84Å; L85-A207 HydrophobicContact CD2-CB 4.16Å; L85-A207 HydrophobicContact CG-CB 4.06Å; D203-A207 VanDerWaalsContact O-CB 3.27Å; D203-A207 WeakPolarHBondContact O-CB 3.48Å; D203-A207 PolarHBondContact O-N 3.3Å; A207-H210 PolarHBondContact O-N 3.32Å; A207-V211 PolarHBondContact O-N 3.26Å; A207-V211 VanDerWaalsContact O-N 3.13Å
208	W	98.7	Very high	97.4	Very high	0 Å²	0	50.3 Å²	50.3	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-66.9	-37.5	174.1	-80.4	101.7	0	0	0	112.2	L85 T88 W89 L92 I145 V149 L189 W192 V204 H210 V211 L212	L85-W208 HydrophobicContact CD2-CD2 3.68Å; L85-W208 HydrophobicContact CD2-CE3 4.08Å; L85-W208 HydrophobicContact CD2-CG 3.95Å; L85-W208 HydrophobicContact CD2-CH2 4.42Å; L85-W208 HydrophobicContact CD2-CZ2 4.09Å; L85-W208 HydrophobicContact CD2-CZ3 4.43Å; T88-W208 PolarHBondContact OG1-NE1 3.04Å; W89-W208 HydrophobicContact CB-CH2 4.28Å; W89-W208 HydrophobicContact CB-CZ2 4.02Å; W89-W208 HydrophobicContact CD2-CH2 4.04Å; W89-W208 AromaticContact CE3-CH2 3.31Å; W89-W208 HydrophobicContact CE3-CH2 3.31Å; W89-W208 AromaticContact CE3-CZ2 3.84Å; W89-W208 HydrophobicContact CE3-CZ2 3.84Å; W89-W208 HydrophobicContact CE3-CZ3 4.27Å; W89-W208 HydrophobicContact CG-CH2 4.47Å; W89-W208 AromaticContact CZ3-CH2 3.91Å; W89-W208 HydrophobicContact CZ3-CH2 3.91Å; W89-W208 HydrophobicContact CZ3-CZ3 4.48Å; L92-W208 HydrophobicContact CD1-CD2 4.4Å; L92-W208 HydrophobicContact CD1-CH2 4.48Å; L92-W208 HydrophobicContact CD1-CZ2 3.56Å; I145-W208 HydrophobicContact CG2-CH2 4.33Å; I145-W208 HydrophobicContact CG2-CZ3 3.76Å; V149-W208 HydrophobicContact CG2-CH2 3.85Å; V149-W208 HydrophobicContact CG2-CZ3 4.33Å; L189-W208 HydrophobicContact CD2-CB 3.89Å; W192-W208 AromaticContact CD1-CD1 3.84Å; W192-W208 AromaticContact CD1-CD2 3.76Å; W192-W208 AromaticContact CD1-CG 3.65Å; W192-W208 AromaticContact NE1-CD2 3.34Å; W192-W208 VanDerWaalsContact NE1-CD2 3.34Å; W192-W208 AromaticContact NE1-CE2 3.65Å; W192-W208 AromaticContact NE1-CE3 3.56Å; W192-W208 AromaticContact NE1-CG 3.75Å; V204-W208 WeakPolarHBondContact O-CB 3.28Å; V204-W208 PolarHBondContact O-N 3.13Å; W208-H210 VanDerWaalsContact C-N 3.27Å; W208-H210 PolarHBondContact O-N 3.05Å; W208-V211 PolarHBondContact O-N 3.25Å; W208-L212 WeakPolarHBondContact O-CB 3.24Å; W208-L212 WeakPolarHBondContact O-CG 3.27Å; W208-L212 PolarHBondContact O-N 3.15Å
209	G	98.4	Very high	97.5	Very high	7 Å²	7	42.2 Å²	42.2	7%	0.072	23%	0.227	C	C	.	.	H	α-helix	trans	-57.2	-41.6	174.2	0	0	0	0	0	112.1	K185 K205 N206 L212 D213	K185-G209 WeakPolarHBondContact CE-O 3.46Å; K205-G209 WeakPolarHBondContact O-CA 3.49Å; K205-G209 PolarHBondContact O-N 3.38Å; N206-G209 PolarHBondContact O-N 3.45Å; G209-L212 PolarHBondContact O-N 3.13Å; G209-D213 WeakPolarHBondContact O-CB 3.39Å; G209-D213 PolarHBondContact O-N 2.88Å
210	H	98.2	Very high	97.5	Very high	50 Å²	50	36.5 Å²	36.5	23%	0.231	20%	0.203	C	C	.	.	H	α-helix	trans	-66.2	-46.8	176.7	-169.7	-175	0	0	0	111.7	L76 F77 E81 N206 A207 W208 L212 D213 E214	L76-H210 PolarHBondContact O-CE1 2.93Å; L76-H210 VanDerWaalsContact O-CE1 3.23Å; F77-H210 HydrophobicContact CD1-CB 4.48Å; F77-H210 AromaticContact CD1-ND1 3.62Å; F77-H210 HydrophobicContact CE1-CB 3.92Å; F77-H210 AromaticContact CE1-CG 3.59Å; F77-H210 AromaticContact CE1-ND1 3.65Å; E81-H210 IonicContact OE1-CE1 3.73Å; E81-H210 IonicContact OE1-CG 3.23Å; E81-H210 IonicContact OE1-ND1 3.71Å; E81-H210 PolarHBondContact OE1-ND1 3.5Å; N206-H210 WeakPolarHBondContact O-CB 3.44Å; N206-H210 PolarHBondContact O-N 2.96Å; A207-H210 PolarHBondContact O-N 3.32Å; W208-H210 VanDerWaalsContact C-N 3.27Å; W208-H210 PolarHBondContact O-N 3.05Å; H210-L212 VanDerWaalsContact C-N 3.28Å; H210-L212 PolarHBondContact O-N 3.5Å; H210-D213 PolarHBondContact O-N 2.93Å; H210-E214 IonicContact CD2-OE1 3.69Å; H210-E214 IonicContact NE2-OE1 2.76Å; H210-E214 PolarHBondContact O-N 3.37Å
211	V	98.2	Very high	97.3	Very high	1 Å²	1	34.5 Å²	34.5	1%	0.006	19%	0.194	C	C	.	.	H	α-helix	trans	-56.2	-45.5	174.8	171.9	0	0	0	0	111.2	F73 F77 L85 A148 A207 W208 E214 I215	F73-V211 HydrophobicContact CZ-CG1 4.4Å; F77-V211 HydrophobicContact CD1-CG2 4.28Å; F77-V211 HydrophobicContact CE1-CB 4.28Å; F77-V211 HydrophobicContact CE1-CG2 3.44Å; F77-V211 VanDerWaalsContact CE1-CG2 3.44Å; F77-V211 HydrophobicContact CZ-CB 4.31Å; F77-V211 HydrophobicContact CZ-CG2 3.67Å; L85-V211 HydrophobicContact CD1-CG2 3.53Å; L85-V211 HydrophobicContact CD2-CG2 3.7Å; L85-V211 HydrophobicContact CG-CG2 4.28Å; A148-V211 HydrophobicContact CB-CG1 4.16Å; A207-V211 PolarHBondContact O-N 3.26Å; A207-V211 VanDerWaalsContact O-N 3.13Å; W208-V211 PolarHBondContact O-N 3.25Å; V211-E214 PolarHBondContact O-N 3.4Å; V211-I215 HydrophobicContact CG1-CD1 3.98Å; V211-I215 WeakPolarHBondContact O-CG1 3.36Å; V211-I215 PolarHBondContact O-N 3.37Å
212	L	98.3	Very high	97.2	Very high	5 Å²	5	31.6 Å²	31.6	3%	0.026	18%	0.177	C	C	.	.	H	α-helix	trans	-69.2	-35.9	-179.5	-64.9	169.1	0	0	0	112	K185 I188 L189 W208 G209 H210 E214 I215 V216	K185-L212 HydrophobicContact CB-CB 4.48Å; K185-L212 HydrophobicContact CD-CB 4.17Å; K185-L212 HydrophobicContact CG-CB 3.79Å; K185-L212 HydrophobicContact CG-CD1 4Å; I188-L212 HydrophobicContact CB-CD1 3.97Å; I188-L212 HydrophobicContact CD1-CD1 4.48Å; I188-L212 HydrophobicContact CD1-CD2 3.66Å; I188-L212 HydrophobicContact CG2-CD1 3.71Å; I188-L212 HydrophobicContact CG2-CD2 4.18Å; L189-L212 HydrophobicContact CD2-CD1 3.9Å; L189-L212 HydrophobicContact CG-CD1 3.96Å; W208-L212 WeakPolarHBondContact O-CB 3.24Å; W208-L212 WeakPolarHBondContact O-CG 3.27Å; W208-L212 PolarHBondContact O-N 3.15Å; G209-L212 PolarHBondContact O-N 3.13Å; H210-L212 VanDerWaalsContact C-N 3.28Å; H210-L212 PolarHBondContact O-N 3.5Å; L212-E214 VanDerWaalsContact C-N 3.34Å; L212-I215 HydrophobicContact CD2-CD1 4.44Å; L212-I215 PolarHBondContact O-N 3.01Å; L212-V216 WeakPolarHBondContact O-CB 3.36Å; L212-V216 VanDerWaalsContact O-CG2 3.24Å; L212-V216 WeakPolarHBondContact O-CG2 3.26Å; L212-V216 PolarHBondContact O-N 3.17Å
213	D	97.7	Very high	97.1	Very high	78 Å²	78	25.7 Å²	25.7	42%	0.417	15%	0.145	S	C	.	.	H	α-helix	trans	-61.9	-41.5	173.7	-83.2	-33.1	0	0	0	112	K185 G209 H210 V216 G217	K185-D213 WeakPolarHBondContact CE-OD1 3.47Å; K185-D213 IonicContact NZ-OD1 2.74Å; K185-D213 PolarHBondContact NZ-OD1 3.42Å; K185-D213 IonicContact NZ-OD2 3.95Å; K185-D213 PolarHBondContact NZ-OD2 3.44Å; G209-D213 WeakPolarHBondContact O-CB 3.39Å; G209-D213 PolarHBondContact O-N 2.88Å; H210-D213 PolarHBondContact O-N 2.93Å; D213-V216 PolarHBondContact O-N 3.3Å; D213-G217 PolarHBondContact O-N 3.01Å
214	E	97.1	Very high	96.9	Very high	19 Å²	19	24.3 Å²	24.3	9%	0.089	14%	0.137	C	C	.	.	H	α-helix	trans	-65.6	-43.8	176	-65.8	-56.2	139	0	0	111.5	F73 L76 F77 H210 V211 L212 V216 G217 I218	F73-E214 HydrophobicContact CE2-CB 3.64Å; F73-E214 HydrophobicContact CE2-CG 4.41Å; F73-E214 HydrophobicContact CZ-CB 4.14Å; L76-E214 HydrophobicContact CD1-CG 4.03Å; F77-E214 HydrophobicContact CZ-CG 4.16Å; H210-E214 IonicContact CD2-OE1 3.69Å; H210-E214 IonicContact NE2-OE1 2.76Å; H210-E214 PolarHBondContact O-N 3.37Å; V211-E214 PolarHBondContact O-N 3.4Å; L212-E214 VanDerWaalsContact C-N 3.34Å; E214-V216 PolarHBondContact O-N 2.66Å; E214-G217 PolarHBondContact O-N 3.12Å; E214-I218 WeakPolarHBondContact O-CD1 3.28Å; E214-I218 VanDerWaalsContact O-CG1 3.24Å; E214-I218 WeakPolarHBondContact O-CG1 3.31Å; E214-I218 PolarHBondContact O-N 3.14Å
215	I	97	Very high	96.6	Very high	11 Å²	11	25.4 Å²	25.4	6%	0.056	14%	0.143	C	C	.	.	H	α-helix	trans	-58	-51.1	174.8	-69.8	168.3	0	0	0	110.9	V144 A148 L163 V211 L212 G217 I218 M219	V144-I215 HydrophobicContact CG1-CG2 4.26Å; A148-I215 HydrophobicContact CB-CD1 3.66Å; A148-I215 HydrophobicContact CB-CG1 4.1Å; L163-I215 HydrophobicContact CD1-CB 4.41Å; L163-I215 HydrophobicContact CD1-CG1 4.22Å; L163-I215 HydrophobicContact CD1-CG2 4.35Å; L163-I215 HydrophobicContact CD2-CG2 3.86Å; V211-I215 HydrophobicContact CG1-CD1 3.98Å; V211-I215 WeakPolarHBondContact O-CG1 3.36Å; V211-I215 PolarHBondContact O-N 3.37Å; L212-I215 HydrophobicContact CD2-CD1 4.44Å; L212-I215 PolarHBondContact O-N 3.01Å; I215-G217 VanDerWaalsContact C-N 3.3Å; I215-G217 PolarHBondContact O-N 3.4Å; I215-I218 PolarHBondContact O-N 3.43Å; I215-M219 HydrophobicContact CG2-CG 4.48Å; I215-M219 HydrophobicContact CG2-SD 4.2Å; I215-M219 WeakPolarHBondContact O-CG 3.39Å; I215-M219 PolarHBondContact O-N 3.33Å
216	V	96.9	Very high	96.4	Very high	24 Å²	24	24.5 Å²	24.5	15%	0.145	14%	0.139	C	C	.	.	H	α-helix	trans	-63.2	-38.4	-179.6	171.1	0	0	0	0	111	F181 L212 D213 E214 M219 G220	F181-V216 HydrophobicContact CB-CB 4.45Å; F181-V216 HydrophobicContact CB-CG1 3.77Å; F181-V216 HydrophobicContact CB-CG2 3.95Å; L212-V216 WeakPolarHBondContact O-CB 3.36Å; L212-V216 VanDerWaalsContact O-CG2 3.24Å; L212-V216 WeakPolarHBondContact O-CG2 3.26Å; L212-V216 PolarHBondContact O-N 3.17Å; D213-V216 PolarHBondContact O-N 3.3Å; E214-V216 PolarHBondContact O-N 2.66Å; V216-M219 PolarHBondContact O-N 3.34Å; V216-G220 PolarHBondContact O-N 3.17Å
217	G	95.7	Very high	95.9	Very high	37 Å²	37	20.5 Å²	20.5	38%	0.381	12%	0.117	S	C	.	.	H	α-helix	trans	-59.4	-49.4	175.3	0	0	0	0	0	112.3	D213 E214 I215 G220 V221	D213-G217 PolarHBondContact O-N 3.01Å; E214-G217 PolarHBondContact O-N 3.12Å; I215-G217 VanDerWaalsContact C-N 3.3Å; I215-G217 PolarHBondContact O-N 3.4Å; G217-G220 PolarHBondContact O-N 3.41Å; G217-V221 PolarHBondContact O-N 3.26Å
218	I	95.2	Very high	95.5	Very high	1 Å²	1	25.3 Å²	25.3	1%	0.005	14%	0.139	C	C	.	.	H	α-helix	trans	-67.7	-40.5	-179.9	-58.4	155.9	0	0	0	111.2	F73 Y160 L163 E214 I215 G220 V221 G222	F73-I218 HydrophobicContact CE2-CD1 4.43Å; Y160-I218 HydrophobicContact CD1-CD1 3.46Å; Y160-I218 VanDerWaalsContact CD1-CD1 3.46Å; Y160-I218 HydrophobicContact CD1-CG1 3.84Å; Y160-I218 HydrophobicContact CD1-CG2 4.17Å; Y160-I218 HydrophobicContact CE1-CD1 3.42Å; Y160-I218 VanDerWaalsContact CE1-CD1 3.42Å; Y160-I218 HydrophobicContact CE1-CG1 3.95Å; L163-I218 HydrophobicContact CB-CB 4.06Å; L163-I218 HydrophobicContact CB-CG2 3.49Å; L163-I218 VanDerWaalsContact CB-CG2 3.49Å; L163-I218 HydrophobicContact CD1-CB 4.01Å; L163-I218 HydrophobicContact CD1-CD1 3.69Å; L163-I218 HydrophobicContact CD1-CG1 4.49Å; L163-I218 HydrophobicContact CD1-CG2 4.13Å; L163-I218 HydrophobicContact CG-CG2 4.49Å; E214-I218 WeakPolarHBondContact O-CD1 3.28Å; E214-I218 VanDerWaalsContact O-CG1 3.24Å; E214-I218 WeakPolarHBondContact O-CG1 3.31Å; E214-I218 PolarHBondContact O-N 3.14Å; I215-I218 PolarHBondContact O-N 3.43Å; I218-G220 VanDerWaalsContact C-N 3.31Å; I218-G220 PolarHBondContact O-N 3.23Å; I218-V221 WeakPolarHBondContact O-CB 3.27Å; I218-V221 PolarHBondContact O-N 2.89Å; I218-G222 PolarHBondContact O-N 3.26Å; I218-G222 VanDerWaalsContact O-N 3.11Å
219	M	96.2	Very high	95.1	Very high	17 Å²	17	29 Å²	29	8%	0.084	16%	0.156	C	C	.	.	H	α-helix	trans	-61.5	-41.3	173.2	-71.8	-170.4	73.1	0	0	111.6	L163 L166 G167 F181 I215 V216 V221 G222 C223	L163-M219 HydrophobicContact CB-CG 4.34Å; L163-M219 HydrophobicContact CD2-CG 3.99Å; L163-M219 HydrophobicContact CD2-SD 4.39Å; L166-M219 HydrophobicContact CB-CE 4.1Å; G167-M219 VanDerWaalsContact CA-O 3.27Å; G167-M219 WeakPolarHBondContact CA-O 3.48Å; F181-M219 HydrophobicContact CD1-CE 4.16Å; F181-M219 HydrophobicContact CD1-SD 4.42Å; F181-M219 HydrophobicContact CE1-CE 3.35Å; F181-M219 HydrophobicContact CE1-SD 4.17Å; F181-M219 HydrophobicContact CE2-CB 4.28Å; F181-M219 HydrophobicContact CE2-CE 4.45Å; F181-M219 HydrophobicContact CZ-CB 4.42Å; F181-M219 HydrophobicContact CZ-CE 3.53Å; I215-M219 HydrophobicContact CG2-CG 4.48Å; I215-M219 HydrophobicContact CG2-SD 4.2Å; I215-M219 WeakPolarHBondContact O-CG 3.39Å; I215-M219 PolarHBondContact O-N 3.33Å; V216-M219 PolarHBondContact O-N 3.34Å; M219-V221 VanDerWaalsContact C-N 3.31Å; M219-V221 PolarHBondContact O-N 3.41Å; M219-G222 WeakPolarHBondContact O-CA 3.37Å; M219-G222 PolarHBondContact O-N 2.96Å; M219-G222 VanDerWaalsContact O-N 3.08Å; M219-C223 PolarHBondContact O-N 3.31Å; M219-C223 PolarHBondContact O-SG 3.19Å; M219-C223 VanDerWaalsContact O-SG 3.37Å
220	G	95.4	Very high	94.5	Very high	7 Å²	7	31.4 Å²	31.4	7%	0.072	17%	0.166	C	C	.	.	H	α-helix	trans	-58.8	-41.5	174.9	0	0	0	0	0	112.3	V216 G217 I218 G222 C223 L224	V216-G220 PolarHBondContact O-N 3.17Å; G217-G220 PolarHBondContact O-N 3.41Å; I218-G220 VanDerWaalsContact C-N 3.31Å; I218-G220 PolarHBondContact O-N 3.23Å; G220-G222 VanDerWaalsContact C-N 3.32Å; G220-G222 PolarHBondContact O-N 3.37Å; G220-C223 WeakPolarHBondContact O-CB 3.48Å; G220-C223 PolarHBondContact O-N 3.01Å; G220-C223 VanDerWaalsContact O-N 3.17Å; G220-L224 WeakPolarHBondContact O-CG 3.36Å; G220-L224 PolarHBondContact O-N 3.33Å
221	V	93.7	Very high	94	Very high	4 Å²	4	34.4 Å²	34.4	2%	0.024	18%	0.18	C	C	.	.	H	α-helix	trans	-58.5	-45.2	172.2	170.5	0	0	0	0	111.1	Q23 V26 G217 I218 M219 C223 L224 I225	Q23-V221 HydrophobicContact CG-CG1 3.89Å; Q23-V221 HydrophobicContact CG-CG2 4.19Å; V26-V221 HydrophobicContact CG2-CG1 4.26Å; G217-V221 PolarHBondContact O-N 3.26Å; I218-V221 WeakPolarHBondContact O-CB 3.27Å; I218-V221 PolarHBondContact O-N 2.89Å; M219-V221 VanDerWaalsContact C-N 3.31Å; M219-V221 PolarHBondContact O-N 3.41Å; V221-C223 VanDerWaalsContact C-N 3.3Å; V221-C223 PolarHBondContact O-N 2.99Å; V221-L224 PolarHBondContact O-N 3.33Å; V221-I225 HydrophobicContact CG1-CD1 3.75Å; V221-I225 HydrophobicContact CG1-CG1 4.42Å; V221-I225 VanDerWaalsContact O-CG1 3.31Å; V221-I225 WeakPolarHBondContact O-CG1 3.44Å; V221-I225 PolarHBondContact O-N 2.85Å
222	G	95.2	Very high	93.6	Very high	2 Å²	2	39.1 Å²	39.1	2%	0.021	20%	0.197	C	C	.	.	H	α-helix	trans	-59	-38.9	174.9	0	0	0	0	0	113.8	A164 A168 I218 M219 G220 F226	A164-G222 WeakPolarHBondContact O-CA 3.3Å; A168-G222 WeakPolarHBondContact CA-O 3.2Å; A168-G222 PolarHBondContact N-O 3.23Å; I218-G222 PolarHBondContact O-N 3.26Å; I218-G222 VanDerWaalsContact O-N 3.11Å; M219-G222 WeakPolarHBondContact O-CA 3.37Å; M219-G222 PolarHBondContact O-N 2.96Å; M219-G222 VanDerWaalsContact O-N 3.08Å; G220-G222 VanDerWaalsContact C-N 3.32Å; G220-G222 PolarHBondContact O-N 3.37Å; G222-F226 PolarHBondContact O-N 3.25Å
223	C	95.5	Very high	93	Very high	1 Å²	1	42.2 Å²	42.2	1%	0.007	21%	0.214	C	C	.	.	H	α-helix	trans	-64.9	-47.2	175.2	-64.3	0	0	0	0	112.3	G167 A171 I178 M219 G220 V221 I225 F226 E227 V269	G167-C223 VanDerWaalsContact C-SG 3.59Å; G167-C223 PolarHBondContact O-SG 3.1Å; A171-C223 HydrophobicContact CB-CB 3.92Å; I178-C223 HydrophobicContact CD1-CB 4.02Å; I178-C223 HydrophobicContact CG1-CB 4Å; M219-C223 PolarHBondContact O-N 3.31Å; M219-C223 PolarHBondContact O-SG 3.19Å; M219-C223 VanDerWaalsContact O-SG 3.37Å; G220-C223 WeakPolarHBondContact O-CB 3.48Å; G220-C223 PolarHBondContact O-N 3.01Å; G220-C223 VanDerWaalsContact O-N 3.17Å; V221-C223 VanDerWaalsContact C-N 3.3Å; V221-C223 PolarHBondContact O-N 2.99Å; C223-I225 VanDerWaalsContact C-N 3.31Å; C223-I225 PolarHBondContact O-N 3Å; C223-F226 WeakPolarHBondContact O-CB 3.41Å; C223-F226 PolarHBondContact O-N 2.88Å; C223-F226 VanDerWaalsContact O-N 3.16Å; C223-E227 PolarHBondContact O-N 2.76Å; C223-V269 HydrophobicContact CB-CG2 3.85Å
224	L	94.4	Very high	92.2	Very high	64 Å²	64	40.5 Å²	40.5	34%	0.335	20%	0.204	S	C	.	.	H	α-helix	trans	-63.8	-37.7	-179.9	-66.3	172.8	0	0	0	111.9	I178 G220 V221 F226 E227 E228 A270	I178-L224 HydrophobicContact CD1-CD2 4.12Å; I178-L224 HydrophobicContact CD1-CG 4.25Å; G220-L224 WeakPolarHBondContact O-CG 3.36Å; G220-L224 PolarHBondContact O-N 3.33Å; V221-L224 PolarHBondContact O-N 3.33Å; L224-F226 VanDerWaalsContact C-N 3.33Å; L224-E227 PolarHBondContact O-N 3.48Å; L224-E228 WeakPolarHBondContact O-CB 3.2Å; L224-E228 PolarHBondContact O-N 3.17Å; L224-A270 HydrophobicContact CD2-CB 3.7Å
225	I	92.4	Very high	91.5	Very high	30 Å²	30	44.7 Å²	44.7	15%	0.154	22%	0.224	C	C	.	.	H	α-helix	trans	-63.3	-40.7	174.8	-70.7	168.3	0	0	0	110.9	V26 I30 V221 C223 E229	V26-I225 HydrophobicContact CB-CD1 3.85Å; V26-I225 HydrophobicContact CG1-CD1 3.35Å; I30-I225 HydrophobicContact CD1-CG2 4.29Å; V221-I225 HydrophobicContact CG1-CD1 3.75Å; V221-I225 HydrophobicContact CG1-CG1 4.42Å; V221-I225 VanDerWaalsContact O-CG1 3.31Å; V221-I225 WeakPolarHBondContact O-CG1 3.44Å; V221-I225 PolarHBondContact O-N 2.85Å; C223-I225 VanDerWaalsContact C-N 3.31Å; C223-I225 PolarHBondContact O-N 3Å; I225-E229 VanDerWaalsContact O-CB 3.3Å; I225-E229 WeakPolarHBondContact O-CB 3.49Å; I225-E229 PolarHBondContact O-N 2.95Å
226	F	93	Very high	91	Very high	52 Å²	52	48.9 Å²	48.9	23%	0.228	24%	0.243	C	C	.	.	H	α-helix	trans	-63.4	-43.3	176.2	175.7	-88.1	0	0	0	111.8	A168 A171 A172 G222 C223 L224 E229 E230	A168-F226 HydrophobicContact CB-CB 3.89Å; A168-F226 HydrophobicContact CB-CD2 4.35Å; A168-F226 HydrophobicContact CB-CG 4.5Å; A171-F226 HydrophobicContact CB-CB 3.99Å; A171-F226 HydrophobicContact CB-CD1 3.56Å; A171-F226 HydrophobicContact CB-CE1 4.35Å; A171-F226 HydrophobicContact CB-CG 3.94Å; A172-F226 HydrophobicContact CB-CE1 4.32Å; A172-F226 HydrophobicContact CB-CE2 3.9Å; A172-F226 HydrophobicContact CB-CZ 3.73Å; G222-F226 PolarHBondContact O-N 3.25Å; C223-F226 WeakPolarHBondContact O-CB 3.41Å; C223-F226 PolarHBondContact O-N 2.88Å; C223-F226 VanDerWaalsContact O-N 3.16Å; L224-F226 VanDerWaalsContact C-N 3.33Å; F226-E229 PolarHBondContact O-N 2.9Å; F226-E230 HydrophobicContact CE1-CB 4.48Å; F226-E230 VanDerWaalsContact CE1-OE2 3.31Å; F226-E230 WeakPolarHBondContact CE1-OE2 3.13Å; F226-E230 WeakPolarHBondContact O-CB 3.46Å; F226-E230 PolarHBondContact O-N 3.38Å
227	E	89.3	Confident	90.2	Very high	19 Å²	19	51.4 Å²	51.4	9%	0.089	25%	0.253	C	S	.	.	H	α-helix	trans	-62.9	-47.5	176.2	-69	-175.7	126.7	0	0	112.1	C223 L224 E229 E230 E231 S268 V269	C223-E227 PolarHBondContact O-N 2.76Å; L224-E227 PolarHBondContact O-N 3.48Å; E227-E229 VanDerWaalsContact C-N 3.27Å; E227-E229 PolarHBondContact O-N 3.23Å; E227-E230 PolarHBondContact O-N 3.05Å; E227-E231 WeakPolarHBondContact O-CB 3.42Å; E227-E231 WeakPolarHBondContact O-CG 3.5Å; E227-E231 PolarHBondContact O-N 3.47Å; E227-S268 VanDerWaalsContact OE1-C 3.32Å; E227-S268 WeakPolarHBondContact OE1-CA 3.44Å; E227-S268 WeakPolarHBondContact OE1-CB 3.46Å; E227-S268 PolarHBondContact OE1-OG 3.33Å; E227-V269 HydrophobicContact CG-CG2 3.85Å; E227-V269 VanDerWaalsContact OE1-CG2 3.24Å; E227-V269 WeakPolarHBondContact OE1-CG2 3.48Å; E227-V269 PolarHBondContact OE1-N 2.89Å; E227-V269 WeakPolarHBondContact OE2-CG2 3.32Å
228	E	89.6	Confident	89.4	Confident	103 Å²	103	55 Å²	55	48%	0.481	26%	0.26	S	S	.	.	H	α-helix	trans	-58.2	-40.2	177.7	-175.4	-179.7	-168.3	0	0	111.3	K27 L224 R232	K27-E228 IonicContact NZ-OE1 3.36Å; K27-E228 IonicContact NZ-OE2 3.92Å; K27-E228 PolarHBondContact NZ-OE2 3.36Å; L224-E228 WeakPolarHBondContact O-CB 3.2Å; L224-E228 PolarHBondContact O-N 3.17Å; E228-R232 WeakPolarHBondContact O-CB 3.5Å; E228-R232 PolarHBondContact O-N 2.85Å; E228-R232 VanDerWaalsContact O-N 3.07Å
229	E	89.8	Confident	88.6	Confident	77 Å²	77	61.1 Å²	61.1	36%	0.36	29%	0.289	S	S	.	.	H	α-helix	trans	-70.3	-44.3	177.3	-174.1	69.9	-163.3	0	0	112.7	I225 F226 E227 R232 I233	I225-E229 VanDerWaalsContact O-CB 3.3Å; I225-E229 WeakPolarHBondContact O-CB 3.49Å; I225-E229 PolarHBondContact O-N 2.95Å; F226-E229 PolarHBondContact O-N 2.9Å; E227-E229 VanDerWaalsContact C-N 3.27Å; E227-E229 PolarHBondContact O-N 3.23Å; E229-R232 PolarHBondContact O-N 2.94Å; E229-R232 IonicContact OE1-CZ 3.76Å; E229-R232 IonicContact OE1-NH1 3.05Å; E229-R232 IonicContact OE1-NH2 3.4Å; E229-R232 PolarHBondContact OE1-NH2 3.25Å; E229-R232 IonicContact OE2-CZ 3.75Å; E229-R232 VanDerWaalsContact OE2-CZ 3.23Å; E229-R232 IonicContact OE2-NH1 2.76Å; E229-R232 PolarHBondContact OE2-NH1 2.99Å; E229-R232 IonicContact OE2-NH2 3.09Å; E229-R232 PolarHBondContact OE2-NH2 3.02Å; E229-I233 HydrophobicContact CG-CD1 4.08Å; E229-I233 WeakPolarHBondContact O-CG1 3.44Å; E229-I233 PolarHBondContact O-N 3.1Å
230	E	86.8	Confident	87.5	Confident	57 Å²	57	66.2 Å²	66.2	27%	0.266	31%	0.312	S	S	.	.	H	α-helix	trans	-61.9	-44.1	177.2	-171	175.7	-148.4	0	0	110.2	F226 E227 I233 L234 R266	F226-E230 HydrophobicContact CE1-CB 4.48Å; F226-E230 VanDerWaalsContact CE1-OE2 3.31Å; F226-E230 WeakPolarHBondContact CE1-OE2 3.13Å; F226-E230 WeakPolarHBondContact O-CB 3.46Å; F226-E230 PolarHBondContact O-N 3.38Å; E227-E230 PolarHBondContact O-N 3.05Å; E230-I233 PolarHBondContact O-N 3.05Å; E230-L234 HydrophobicContact CG-CD1 4.44Å; E230-L234 WeakPolarHBondContact O-CG 3.4Å; E230-L234 PolarHBondContact O-N 2.9Å; E230-L234 VanDerWaalsContact O-N 3.1Å; E230-R266 VanDerWaalsContact OE1-CD 3.26Å; E230-R266 WeakPolarHBondContact OE1-CD 3.14Å; E230-R266 IonicContact OE1-CZ 2.73Å; E230-R266 IonicContact OE1-NE 3.16Å; E230-R266 IonicContact OE1-NH1 2.68Å; E230-R266 PolarHBondContact OE1-NH1 3.4Å; E230-R266 WeakPolarHBondContact OE2-CD 3.37Å; E230-R266 IonicContact OE2-CZ 3.91Å; E230-R266 IonicContact OE2-NE 2.71Å; E230-R266 PolarHBondContact OE2-NE 3.26Å; E230-R266 IonicContact OE2-NH1 3.5Å
231	E	87.1	Confident	85.9	Confident	113 Å²	113	67.3 Å²	67.3	53%	0.528	32%	0.323	S	S	.	.	H	α-helix	trans	-61.5	-42.2	174.7	-74.4	178.9	-173.7	0	0	112.5	E227 L234 Q235	E227-E231 WeakPolarHBondContact O-CB 3.42Å; E227-E231 WeakPolarHBondContact O-CG 3.5Å; E227-E231 PolarHBondContact O-N 3.47Å; E231-L234 PolarHBondContact O-N 3.46Å; E231-Q235 WeakPolarHBondContact O-CG 3.48Å; E231-Q235 PolarHBondContact O-N 3.3Å; E231-Q235 VanDerWaalsContact O-N 3.08Å
232	R	88.6	Confident	84.3	Confident	100 Å²	100	72.7 Å²	72.7	38%	0.377	35%	0.352	S	S	.	.	H	α-helix	trans	-65	-45.6	178.6	-165.8	-174	71.2	-112.2	-0.9	112.2	E228 E229 L234 Q235 E236	E228-R232 WeakPolarHBondContact O-CB 3.5Å; E228-R232 PolarHBondContact O-N 2.85Å; E228-R232 VanDerWaalsContact O-N 3.07Å; E229-R232 PolarHBondContact O-N 2.94Å; E229-R232 IonicContact OE1-CZ 3.76Å; E229-R232 IonicContact OE1-NH1 3.05Å; E229-R232 IonicContact OE1-NH2 3.4Å; E229-R232 PolarHBondContact OE1-NH2 3.25Å; E229-R232 IonicContact OE2-CZ 3.75Å; E229-R232 VanDerWaalsContact OE2-CZ 3.23Å; E229-R232 IonicContact OE2-NH1 2.76Å; E229-R232 PolarHBondContact OE2-NH1 2.99Å; E229-R232 IonicContact OE2-NH2 3.09Å; E229-R232 PolarHBondContact OE2-NH2 3.02Å; R232-L234 PolarHBondContact O-N 3.26Å; R232-Q235 PolarHBondContact O-N 3.05Å; R232-Q235 VanDerWaalsContact O-N 3.16Å; R232-E236 WeakPolarHBondContact CD-OE1 3.39Å; R232-E236 WeakPolarHBondContact CG-OE1 3.37Å; R232-E236 IonicContact NE-OE1 2.55Å; R232-E236 PolarHBondContact NE-OE1 3.13Å; R232-E236 VanDerWaalsContact NE-OE1 3.09Å; R232-E236 WeakPolarHBondContact O-CG 3.41Å; R232-E236 PolarHBondContact O-N 3.41Å
233	I	86.2	Confident	82.4	Confident	71 Å²	71	79.1 Å²	79.1	36%	0.364	38%	0.381	S	S	.	.	H	α-helix	trans	-60	-40	177.7	-68.4	166.2	0	0	0	110.4	E229 E230 Q235 E236 E237	E229-I233 HydrophobicContact CG-CD1 4.08Å; E229-I233 WeakPolarHBondContact O-CG1 3.44Å; E229-I233 PolarHBondContact O-N 3.1Å; E230-I233 PolarHBondContact O-N 3.05Å; I233-Q235 PolarHBondContact O-N 2.95Å; I233-E236 PolarHBondContact O-N 3.1Å; I233-E237 HydrophobicContact CG2-CG 4.41Å; I233-E237 WeakPolarHBondContact O-CB 3.4Å; I233-E237 VanDerWaalsContact O-CG 3.3Å; I233-E237 WeakPolarHBondContact O-CG 3.31Å; I233-E237 PolarHBondContact O-N 3.16Å
234	L	81.9	Confident	80.5	Confident	42 Å²	42	83 Å²	83	22%	0.22	40%	0.401	C	S	.	.	H	α-helix	trans	-64.3	-39.2	177.2	-69.7	171.6	0	0	0	112.5	E230 E231 R232 E238 K263	E230-L234 HydrophobicContact CG-CD1 4.44Å; E230-L234 WeakPolarHBondContact O-CG 3.4Å; E230-L234 PolarHBondContact O-N 2.9Å; E230-L234 VanDerWaalsContact O-N 3.1Å; E231-L234 PolarHBondContact O-N 3.46Å; R232-L234 PolarHBondContact O-N 3.26Å; L234-E238 WeakPolarHBondContact O-CB 3.42Å; L234-E238 WeakPolarHBondContact O-CG 3.5Å; L234-E238 PolarHBondContact O-N 3.15Å; L234-K263 HydrophobicContact CD2-CB 3.98Å; L234-K263 HydrophobicContact CD2-CD 3.42Å; L234-K263 VanDerWaalsContact CD2-CD 3.42Å; L234-K263 HydrophobicContact CD2-CG 3.58Å
235	Q	82.8	Confident	78.3	Confident	107 Å²	107	84.8 Å²	84.8	50%	0.5	41%	0.408	S	S	.	.	H	α-helix	trans	-65.7	-45.7	175.7	-70.8	168	10.8	0	0	111.6	E231 R232 I233 E237 E238 E239	E231-Q235 WeakPolarHBondContact O-CG 3.48Å; E231-Q235 PolarHBondContact O-N 3.3Å; E231-Q235 VanDerWaalsContact O-N 3.08Å; R232-Q235 PolarHBondContact O-N 3.05Å; R232-Q235 VanDerWaalsContact O-N 3.16Å; I233-Q235 PolarHBondContact O-N 2.95Å; Q235-E237 VanDerWaalsContact C-N 3.31Å; Q235-E237 PolarHBondContact O-N 2.94Å; Q235-E238 PolarHBondContact O-N 3.2Å; Q235-E239 WeakPolarHBondContact O-CG 3.36Å; Q235-E239 PolarHBondContact O-N 3.1Å
236	E	84.6	Confident	76.4	Confident	98 Å²	98	91.1 Å²	91.1	46%	0.458	44%	0.437	S	S	.	.	H	α-helix	trans	-59.8	-40.8	176.9	-69.4	170.2	-164.8	0	0	111.5	R232 I233 E240	R232-E236 WeakPolarHBondContact CD-OE1 3.39Å; R232-E236 WeakPolarHBondContact CG-OE1 3.37Å; R232-E236 IonicContact NE-OE1 2.55Å; R232-E236 PolarHBondContact NE-OE1 3.13Å; R232-E236 VanDerWaalsContact NE-OE1 3.09Å; R232-E236 WeakPolarHBondContact O-CG 3.41Å; R232-E236 PolarHBondContact O-N 3.41Å; I233-E236 PolarHBondContact O-N 3.1Å; E236-E240 WeakPolarHBondContact O-CB 3.3Å; E236-E240 PolarHBondContact O-N 3.23Å
237	E	81.4	Confident	74.4	Confident	77 Å²	77	97.8 Å²	97.8	36%	0.36	47%	0.466	S	S	.	.	H	α-helix	trans	-72.5	-28.4	176.6	-70.7	174.1	112.5	0	0	113.8	I233 Q235 G241 K263	I233-E237 HydrophobicContact CG2-CG 4.41Å; I233-E237 WeakPolarHBondContact O-CB 3.4Å; I233-E237 VanDerWaalsContact O-CG 3.3Å; I233-E237 WeakPolarHBondContact O-CG 3.31Å; I233-E237 PolarHBondContact O-N 3.16Å; Q235-E237 VanDerWaalsContact C-N 3.31Å; Q235-E237 PolarHBondContact O-N 2.94Å; E237-G241 PolarHBondContact O-N 3.4Å; E237-K263 IonicContact OE1-NZ 2.83Å; E237-K263 PolarHBondContact OE1-NZ 3.18Å; E237-K263 WeakPolarHBondContact OE2-CE 3.4Å; E237-K263 IonicContact OE2-NZ 2.54Å; E237-K263 PolarHBondContact OE2-NZ 3.14Å
238	E	79.1	Confident	72.5	Confident	113 Å²	113	101.2 Å²	101.2	53%	0.528	48%	0.484	S	S	.	.	H	α-helix	trans	-71	-43.1	172.5	-77.9	-179	175.5	0	0	110.6	L234 Q235 G241 D242	L234-E238 WeakPolarHBondContact O-CB 3.42Å; L234-E238 WeakPolarHBondContact O-CG 3.5Å; L234-E238 PolarHBondContact O-N 3.15Å; Q235-E238 PolarHBondContact O-N 3.2Å; E238-G241 PolarHBondContact O-N 3.27Å; E238-D242 PolarHBondContact O-N 3.2Å
239	E	78	Confident	70.6	Confident	129 Å²	129	102.5 Å²	102.5	60%	0.603	50%	0.499	S	S	*	.	H	α-helix	trans	-64.7	-42.3	175	-69.9	177.8	-177.4	0	0	112.2	Q235 H243	Q235-E239 WeakPolarHBondContact O-CG 3.36Å; Q235-E239 PolarHBondContact O-N 3.1Å; E239-H243 PolarHBondContact O-CD2 2.91Å; E239-H243 VanDerWaalsContact O-CD2 3.29Å; E239-H243 PolarHBondContact O-N 3.47Å; E239-H243 VanDerWaalsContact O-N 3.07Å
240	E	73.7	Confident	68.6	Low	124 Å²	124	103.5 Å²	103.5	58%	0.579	52%	0.515	S	S	*	.	H	α-helix	trans	-68.4	-36.6	174.3	-168.8	177	-164.9	0	0	111.6	E236 H243 I244	E236-E240 WeakPolarHBondContact O-CB 3.3Å; E236-E240 PolarHBondContact O-N 3.23Å; E240-H243 PolarHBondContact O-N 2.86Å; E240-I244 HydrophobicContact CG-CD1 4.08Å; E240-I244 VanDerWaalsContact O-CG1 3.26Å; E240-I244 WeakPolarHBondContact O-CG1 3.43Å; E240-I244 PolarHBondContact O-N 3.31Å
241	G	60	Low	66.8	Low	30 Å²	30	105.2 Å²	105.2	31%	0.309	53%	0.533	S	S	.	.	H	α-helix	trans	-61.9	-43.7	174.8	0	0	0	0	0	112.8	E237 E238 I244 Q245	E237-G241 PolarHBondContact O-N 3.4Å; E238-G241 PolarHBondContact O-N 3.27Å; G241-I244 PolarHBondContact O-N 3Å; G241-Q245 VanDerWaalsContact O-CB 3.29Å; G241-Q245 WeakPolarHBondContact O-CB 3.15Å; G241-Q245 PolarHBondContact O-N 3.44Å
242	D	60.2	Low	65.1	Low	117 Å²	117	106 Å²	106	63%	0.626	54%	0.54	S	S	*	.	H	α-helix	trans	-68.2	-38.2	176.1	-81	-9.3	0	0	0	111.6	E238 I244 Q245 E246	E238-D242 PolarHBondContact O-N 3.2Å; D242-I244 VanDerWaalsContact C-N 3.31Å; D242-I244 PolarHBondContact O-N 2.91Å; D242-Q245 PolarHBondContact O-N 3.3Å; D242-E246 PolarHBondContact O-N 3.49Å
243	H	56.6	Low	63.5	Low	138 Å²	138	108 Å²	108	64%	0.639	56%	0.559	S	S	*	*	H	α-helix	trans	-64.7	-31.5	173	-85.1	-50.3	0	0	0	113.6	E239 E240	E239-H243 PolarHBondContact O-CD2 2.91Å; E239-H243 VanDerWaalsContact O-CD2 3.29Å; E239-H243 PolarHBondContact O-N 3.47Å; E239-H243 VanDerWaalsContact O-N 3.07Å; E240-H243 PolarHBondContact O-N 2.86Å
244	I	55	Low	61.8	Low	83 Å²	83	114.2 Å²	114.2	43%	0.426	58%	0.579	S	S	.	*	H	α-helix	trans	-80.1	-35.2	173.5	-65.4	168.4	0	0	0	110.9	E240 G241 D242 E246 F247 I248	E240-I244 HydrophobicContact CG-CD1 4.08Å; E240-I244 VanDerWaalsContact O-CG1 3.26Å; E240-I244 WeakPolarHBondContact O-CG1 3.43Å; E240-I244 PolarHBondContact O-N 3.31Å; G241-I244 PolarHBondContact O-N 3Å; D242-I244 VanDerWaalsContact C-N 3.31Å; D242-I244 PolarHBondContact O-N 2.91Å; I244-E246 VanDerWaalsContact C-N 3.28Å; I244-E246 PolarHBondContact O-N 3.48Å; I244-F247 PolarHBondContact O-N 3.27Å; I244-I248 HydrophobicContact CG2-CD1 3.47Å; I244-I248 VanDerWaalsContact CG2-CD1 3.47Å; I244-I248 HydrophobicContact CG2-CG1 4.08Å; I244-I248 PolarHBondContact O-N 2.88Å
245	Q	49.1	Very low	60.2	Low	101 Å²	101	119.5 Å²	119.5	47%	0.472	60%	0.603	S	S	.	*	H	α-helix	trans	-67.8	-28	178.2	-158.3	72.2	48.7	0	0	112	G241 D242 F247	G241-Q245 VanDerWaalsContact O-CB 3.29Å; G241-Q245 WeakPolarHBondContact O-CB 3.15Å; G241-Q245 PolarHBondContact O-N 3.44Å; D242-Q245 PolarHBondContact O-N 3.3Å; Q245-F247 PolarHBondContact O-N 2.72Å
246	E	51.1	Low	58.5	Low	163 Å²	163	119.7 Å²	119.7	76%	0.762	60%	0.604	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.7	-16	169.6	-105.3	-177.1	170.1	0	0	113.8	D242 I244	D242-E246 PolarHBondContact O-N 3.49Å; I244-E246 VanDerWaalsContact C-N 3.28Å; I244-E246 PolarHBondContact O-N 3.48Å
247	F	51.2	Low	56.4	Low	192 Å²	192	119.9 Å²	119.9	84%	0.842	61%	0.608	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109.7	-13.7	179.9	-133.2	-93.4	0	0	0	114.4	I244 Q245	I244-F247 PolarHBondContact O-N 3.27Å; Q245-F247 PolarHBondContact O-N 2.72Å
248	I	50.9	Low	54.5	Low	90 Å²	90	125.9 Å²	125.9	46%	0.462	63%	0.628	S	S	.	*			trans	-116.4	73.3	-178.3	-52.2	-178.8	0	0	0	110.2	I244 S250	I244-I248 HydrophobicContact CG2-CD1 3.47Å; I244-I248 VanDerWaalsContact CG2-CD1 3.47Å; I244-I248 HydrophobicContact CG2-CG1 4.08Å; I244-I248 PolarHBondContact O-N 2.88Å; I248-S250 PolarHBondContact O-N 2.8Å
249	T	47.7	Very low	52.9	Low	131 Å²	131	127.3 Å²	127.3	80%	0.804	63%	0.633	S	S	*	*			trans	-90.1	66.5	159	54.8	0	0	0	0	109.8
250	S	49.5	Very low	51.1	Low	98 Å²	98	127 Å²	127	69%	0.685	63%	0.633	S	S	*	*	S	Bend	trans	174.6	111	168.4	157.7	0	0	0	0	110.8	I248	I248-S250 PolarHBondContact O-N 2.8Å
251	S	48	Very low	49.5	Very low	93 Å²	93	127.8 Å²	127.8	65%	0.65	64%	0.637	S	S	*	*			trans	71.2	106.8	162.3	-155	0	0	0	0	116.7
252	D	51.3	Low	48.9	Very low	128 Å²	128	133.3 Å²	133.3	68%	0.684	66%	0.659	S	S	*	*				160.4	92	124	-76.3	-9	0	0	0	112.4	Y254	D252-Y254 PolarHBondContact O-N 3.33Å
253	D	56.3	Low	48.4	Very low	143 Å²	143	131.6 Å²	131.6	77%	0.765	65%	0.646	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.6	0.8	-174.2	-133.7	-1.8	0	0	0	115.3
254	Y	50.3	Low	48.2	Very low	202 Å²	202	132.7 Å²	132.7	79%	0.792	65%	0.649	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.6	-24.3	-169.1	-87.9	-89.5	0	0	0	115.3	D252	D252-Y254 PolarHBondContact O-N 3.33Å
255	Q	46.8	Very low	48.2	Very low	153 Å²	153	133.1 Å²	133.1	72%	0.715	66%	0.659	S	S	*	*	S	Bend	trans	-85	-23.6	-179.4	-70.6	-165.2	-9.6	0	0	113.5	N257	Q255-N257 VanDerWaalsContact C-N 3.34Å; Q255-N257 PolarHBondContact O-N 3.3Å
256	Q	47.2	Very low	48.9	Very low	110 Å²	110	132.4 Å²	132.4	51%	0.514	65%	0.652	S	S	.	*	H	α-helix	trans	-68.9	-32.5	-175.6	-129.5	152.3	5.7	0	0	112.2	M260	Q256-M260 PolarHBondContact O-N 3.13Å
257	N	41.4	Very low	50.1	Low	102 Å²	102	129.7 Å²	129.7	55%	0.545	64%	0.643	S	S	.	*	H	α-helix	trans	-79.3	-26.6	-174	-140.8	1.8	0	0	0	114.2	Q255 H261	Q255-N257 VanDerWaalsContact C-N 3.34Å; Q255-N257 PolarHBondContact O-N 3.3Å; N257-H261 PolarHBondContact OD1-CD2 2.97Å; N257-H261 VanDerWaalsContact OD1-CD2 3.27Å; N257-H261 PolarHBondContact OD1-NE2 3.21Å; N257-H261 VanDerWaalsContact OD1-NE2 3.15Å
258	Y	40.4	Very low	51.6	Low	203 Å²	203	122.2 Å²	122.2	80%	0.796	61%	0.614	S	S	*	*	H	α-helix	trans	-79.7	-29.1	177.9	-88.6	-82	0	0	0	113.5
259	K	45.7	Very low	53	Low	144 Å²	144	118.1 Å²	118.1	63%	0.626	59%	0.593	S	S	*	*	H	α-helix	trans	-85.1	-33.8	179.2	-73.3	-175	177.1	-177.3	0	112.9
260	M	40.4	Very low	54.6	Low	122 Å²	122	113.8 Å²	113.8	60%	0.601	57%	0.571	S	S	*	*	H	α-helix	trans	-75.3	-30.3	-173.5	-132.6	-154.4	171.5	0	0	114.2	Q256	Q256-M260 PolarHBondContact O-N 3.13Å
261	H	40	Very low	56	Low	141 Å²	141	114 Å²	114	65%	0.653	57%	0.568	S	S	*	*	H	α-helix	trans	-84.9	-16.2	-171.7	-77.2	-36.1	0	0	0	115.7	N257	N257-H261 PolarHBondContact OD1-CD2 2.97Å; N257-H261 VanDerWaalsContact OD1-CD2 3.27Å; N257-H261 PolarHBondContact OD1-NE2 3.21Å; N257-H261 VanDerWaalsContact OD1-NE2 3.15Å
262	N	48.9	Very low	57.6	Low	146 Å²	146	110.3 Å²	110.3	78%	0.781	54%	0.541	S	S	*	.	H	α-helix	trans	-98.7	-22.1	179.9	-119.9	-9.9	0	0	0	113.9
263	K	49.4	Very low	59.1	Low	81 Å²	81	107.4 Å²	107.4	35%	0.352	53%	0.529	S	S	.	.	H	α-helix	trans	-86.9	-31.2	-169.5	-80.1	-179.2	169.5	-173.5	0	115.7	L234 E237	L234-K263 HydrophobicContact CD2-CB 3.98Å; L234-K263 HydrophobicContact CD2-CD 3.42Å; L234-K263 VanDerWaalsContact CD2-CD 3.42Å; L234-K263 HydrophobicContact CD2-CG 3.58Å; E237-K263 IonicContact OE1-NZ 2.83Å; E237-K263 PolarHBondContact OE1-NZ 3.18Å; E237-K263 WeakPolarHBondContact OE2-CE 3.4Å; E237-K263 IonicContact OE2-NZ 2.54Å; E237-K263 PolarHBondContact OE2-NZ 3.14Å
264	K	50.9	Low	60.4	Low	160 Å²	160	107.4 Å²	107.4	70%	0.696	52%	0.523	S	S	*	.	S	Bend	trans	-90.9	-0.8	-176.2	-75.8	-174.7	175.2	-179.7	0	115.8
265	S	55.8	Low	62.1	Low	93 Å²	93	104 Å²	104	65%	0.65	51%	0.514	S	S	*	.			trans	-103.9	-3.6	-169.9	-173.4	0	0	0	0	114.8	L267	S265-L267 PolarHBondContact O-N 3.42Å
266	R	64.8	Low	63.9	Low	85 Å²	85	97.8 Å²	97.8	32%	0.321	49%	0.485	S	S	.	.			trans	-76.7	112.4	-177.6	-162	-170.3	-173.4	108.5	21.8	109.8	A171 A172 E230	A171-R266 PolarHBondContact O-NH2 3.5Å; A172-R266 PolarHBondContact O-NH2 3.49Å; E230-R266 VanDerWaalsContact OE1-CD 3.26Å; E230-R266 WeakPolarHBondContact OE1-CD 3.14Å; E230-R266 IonicContact OE1-CZ 2.73Å; E230-R266 IonicContact OE1-NE 3.16Å; E230-R266 IonicContact OE1-NH1 2.68Å; E230-R266 PolarHBondContact OE1-NH1 3.4Å; E230-R266 WeakPolarHBondContact OE2-CD 3.37Å; E230-R266 IonicContact OE2-CZ 3.91Å; E230-R266 IonicContact OE2-NE 2.71Å; E230-R266 PolarHBondContact OE2-NE 3.26Å; E230-R266 IonicContact OE2-NH1 3.5Å
267	L	76.2	Confident	65.6	Low	107 Å²	107	94.4 Å²	94.4	56%	0.56	47%	0.47	S	S	*	.			trans	-66.7	135.4	172.9	-72.9	155.3	0	0	0	109.6	S265	S265-L267 PolarHBondContact O-N 3.42Å
268	S	81.6	Confident	67.7	Low	35 Å²	35	94.1 Å²	94.1	25%	0.245	47%	0.469	C	S	.	.			trans	-57.3	137.8	172.4	168.7	0	0	0	0	110.7	E227 A270 T271	E227-S268 VanDerWaalsContact OE1-C 3.32Å; E227-S268 WeakPolarHBondContact OE1-CA 3.44Å; E227-S268 WeakPolarHBondContact OE1-CB 3.46Å; E227-S268 PolarHBondContact OE1-OG 3.33Å; S268-A270 VanDerWaalsContact C-N 3.29Å; S268-A270 PolarHBondContact OG-N 3.1Å; S268-A270 VanDerWaalsContact OG-N 3.08Å; S268-T271 PolarHBondContact OG-N 2.96Å; S268-T271 PolarHBondContact OG-OG1 3.26Å
269	V	81.6	Confident	69.7	Low	3 Å²	3	89.7 Å²	89.7	2%	0.018	46%	0.455	C	S	.	.	S	Bend	trans	-73.4	-21	172.8	-48	0	0	0	0	112.4	A171 M176 K177 I178 C223 E227	A171-V269 HydrophobicContact CB-CG1 4.13Å; A171-V269 HydrophobicContact CB-CG2 4.33Å; M176-V269 HydrophobicContact CB-CG1 4.48Å; M176-V269 WeakPolarHBondContact O-CA 3.19Å; M176-V269 WeakPolarHBondContact O-CG1 3.37Å; K177-V269 WeakPolarHBondContact CA-O 3.31Å; I178-V269 HydrophobicContact CD1-CG2 4.03Å; I178-V269 HydrophobicContact CG1-CB 4.4Å; I178-V269 HydrophobicContact CG1-CG2 3.88Å; I178-V269 PolarHBondContact N-O 2.72Å; C223-V269 HydrophobicContact CB-CG2 3.85Å; E227-V269 HydrophobicContact CG-CG2 3.85Å; E227-V269 VanDerWaalsContact OE1-CG2 3.24Å; E227-V269 WeakPolarHBondContact OE1-CG2 3.48Å; E227-V269 PolarHBondContact OE1-N 2.89Å; E227-V269 WeakPolarHBondContact OE2-CG2 3.32Å
270	A	80.9	Confident	71.2	Confident	40 Å²	40	82.9 Å²	82.9	33%	0.331	43%	0.426	S	S	.	.	S	Bend	trans	-93.9	-22.1	179.2	0	0	0	0	0	113.2	I178 L224 S268	I178-A270 HydrophobicContact CD1-CB 4.13Å; L224-A270 HydrophobicContact CD2-CB 3.7Å; S268-A270 VanDerWaalsContact C-N 3.29Å; S268-A270 PolarHBondContact OG-N 3.1Å; S268-A270 VanDerWaalsContact OG-N 3.08Å
271	T	79.1	Confident	73.2	Confident	102 Å²	102	81.1 Å²	81.1	63%	0.626	41%	0.413	S	S	*	.			trans	-100.5	106.8	-179.3	-53.4	0	0	0	0	110.5	S268	S268-T271 PolarHBondContact OG-N 2.96Å; S268-T271 PolarHBondContact OG-OG1 3.26Å
272	V	80.2	Confident	75	Confident	16 Å²	16	78.2 Å²	78.2	10%	0.097	41%	0.407	C	S	.	.			trans	-115.6	125	175.5	-172.9	0	0	0	0	110.1	K177 E179 E276 L277 I280	K177-V272 HydrophobicContact CB-CG2 3.99Å; K177-V272 HydrophobicContact CD-CB 4.41Å; K177-V272 HydrophobicContact CD-CG1 3.99Å; K177-V272 HydrophobicContact CD-CG2 3.57Å; K177-V272 HydrophobicContact CG-CG2 3.74Å; E179-V272 VanDerWaalsContact CD-CG2 3.45Å; E179-V272 HydrophobicContact CG-CG2 4.22Å; E179-V272 WeakPolarHBondContact OE2-CG2 3.37Å; V272-E276 HydrophobicContact CG1-CB 3.83Å; V272-E276 HydrophobicContact CG1-CG 3.94Å; V272-L277 HydrophobicContact CB-CD2 3.61Å; V272-L277 HydrophobicContact CB-CG 4.02Å; V272-L277 HydrophobicContact CG1-CD2 3.6Å; V272-L277 HydrophobicContact CG1-CG 3.91Å; V272-L277 HydrophobicContact CG2-CD2 4.41Å; V272-I280 HydrophobicContact CG1-CD1 4.43Å
273	P	83.8	Confident	75.9	Confident	67 Å²	67	75 Å²	75	44%	0.435	39%	0.39	S	S	.	.			trans	-56.3	147.4	175.4	-24.4	34	0	0	0	111.9	E275 E276 L277	P273-E275 WeakPolarHBondContact CB-OE2 3.34Å; P273-E275 PolarHBondContact O-N 2.89Å; P273-E276 PolarHBondContact O-N 3.19Å; P273-L277 PolarHBondContact O-N 3.03Å
274	K	83.2	Confident	76.6	Confident	144 Å²	144	72.8 Å²	72.8	63%	0.626	38%	0.384	S	S	*	.	H	α-helix	trans	-57.3	-39.5	-176.9	-176.3	-179.5	174.7	-174.1	0	112	E276 L277 D278	K274-E276 PolarHBondContact O-N 3.32Å; K274-L277 WeakPolarHBondContact O-CB 3.37Å; K274-L277 PolarHBondContact O-N 3.49Å; K274-L277 VanDerWaalsContact O-N 3.16Å; K274-D278 WeakPolarHBondContact O-CB 3.34Å; K274-D278 VanDerWaalsContact O-CG 3.23Å; K274-D278 PolarHBondContact O-N 3.07Å
275	E	86.2	Confident	76.8	Confident	129 Å²	129	75.1 Å²	75.1	60%	0.603	39%	0.394	S	S	*	.	H	α-helix	trans	-61.6	-28.7	-179.7	-58.3	71.3	-153.1	0	0	112.3	P273 Q279	P273-E275 WeakPolarHBondContact CB-OE2 3.34Å; P273-E275 PolarHBondContact O-N 2.89Å; E275-Q279 WeakPolarHBondContact O-CG 3.13Å; E275-Q279 PolarHBondContact O-NE2 2.91Å
276	E	83.4	Confident	77.8	Confident	23 Å²	23	74.3 Å²	74.3	11%	0.107	38%	0.381	C	S	.	.	H	α-helix	trans	-89.5	-33.7	176.7	-172.5	165.4	-171.8	0	0	112.1	K113 K177 V272 P273 K274 D278 Q279 I280	K113-E276 IonicContact NZ-OE1 2.63Å; K113-E276 PolarHBondContact NZ-OE1 3.35Å; K177-E276 IonicContact NZ-OE1 3.07Å; K177-E276 PolarHBondContact NZ-OE1 3.4Å; K177-E276 IonicContact NZ-OE2 3.49Å; K177-E276 PolarHBondContact NZ-OE2 3.01Å; V272-E276 HydrophobicContact CG1-CB 3.83Å; V272-E276 HydrophobicContact CG1-CG 3.94Å; P273-E276 PolarHBondContact O-N 3.19Å; K274-E276 PolarHBondContact O-N 3.32Å; E276-D278 PolarHBondContact O-N 2.83Å; E276-Q279 WeakPolarHBondContact O-CA 3.27Å; E276-Q279 WeakPolarHBondContact O-CB 3.06Å; E276-Q279 PolarHBondContact O-N 3.44Å; E276-I280 HydrophobicContact CG-CD1 4.16Å; E276-I280 WeakPolarHBondContact O-CG1 3.44Å; E276-I280 PolarHBondContact O-N 3.42Å
277	L	84.5	Confident	78.5	Confident	40 Å²	40	73.7 Å²	73.7	21%	0.209	38%	0.384	C	S	.	.	H	α-helix	trans	-58.9	-39.9	167.9	-67.6	-175.6	0	0	0	111.4	E179 V272 P273 K274 Q279 I280 Y281	E179-L277 HydrophobicContact CG-CD2 3.65Å; V272-L277 HydrophobicContact CB-CD2 3.61Å; V272-L277 HydrophobicContact CB-CG 4.02Å; V272-L277 HydrophobicContact CG1-CD2 3.6Å; V272-L277 HydrophobicContact CG1-CG 3.91Å; V272-L277 HydrophobicContact CG2-CD2 4.41Å; P273-L277 PolarHBondContact O-N 3.03Å; K274-L277 WeakPolarHBondContact O-CB 3.37Å; K274-L277 PolarHBondContact O-N 3.49Å; K274-L277 VanDerWaalsContact O-N 3.16Å; L277-Q279 PolarHBondContact O-N 3.09Å; L277-I280 PolarHBondContact O-N 3.19Å; L277-I280 VanDerWaalsContact O-N 3.07Å; L277-Y281 HydrophobicContact CB-CD2 3.89Å; L277-Y281 HydrophobicContact CB-CE2 3.88Å; L277-Y281 HydrophobicContact CD1-CE2 4.21Å; L277-Y281 HydrophobicContact CD2-CD2 4.3Å; L277-Y281 HydrophobicContact CD2-CE2 3.55Å; L277-Y281 HydrophobicContact CG-CE2 4.08Å; L277-Y281 WeakPolarHBondContact O-CD2 3.4Å; L277-Y281 PolarHBondContact O-N 3.06Å
278	D	84.8	Confident	78.6	Confident	96 Å²	96	71.8 Å²	71.8	51%	0.513	37%	0.374	S	S	.	.	H	α-helix	trans	-66.6	-15.6	174.9	-69.2	-18.5	0	0	0	112.4	K274 E276 P282	K274-D278 WeakPolarHBondContact O-CB 3.34Å; K274-D278 VanDerWaalsContact O-CG 3.23Å; K274-D278 PolarHBondContact O-N 3.07Å; E276-D278 PolarHBondContact O-N 2.83Å; D278-P282 WeakPolarHBondContact O-CD 3.14Å; D278-P282 WeakPolarHBondContact O-CG 3.29Å
279	Q	81.5	Confident	78.4	Confident	110 Å²	110	74 Å²	74	51%	0.514	38%	0.382	S	S	.	.	H	α-helix	trans	-92.7	-23.3	170.6	-68.6	166.5	47.7	0	0	113	E275 E276 L277	E275-Q279 WeakPolarHBondContact O-CG 3.13Å; E275-Q279 PolarHBondContact O-NE2 2.91Å; E276-Q279 WeakPolarHBondContact O-CA 3.27Å; E276-Q279 WeakPolarHBondContact O-CB 3.06Å; E276-Q279 PolarHBondContact O-N 3.44Å; L277-Q279 PolarHBondContact O-N 3.09Å
280	I	79.1	Confident	78.2	Confident	0 Å²	0	78.4 Å²	78.4	0%	0	41%	0.405	C	S	.	.	H	α-helix	trans	-88	-51	-177.7	-69.3	166.9	0	0	0	110.8	E179 Y180 I183 V272 E276 L277	E179-I280 HydrophobicContact CB-CD1 3.89Å; E179-I280 HydrophobicContact CB-CG2 4.29Å; E179-I280 HydrophobicContact CG-CD1 4.49Å; Y180-I280 HydrophobicContact CE1-CD1 4.28Å; I183-I280 HydrophobicContact CD1-CB 4.47Å; I183-I280 HydrophobicContact CD1-CG1 4.27Å; I183-I280 HydrophobicContact CD1-CG2 3.75Å; I183-I280 HydrophobicContact CG1-CG2 4Å; V272-I280 HydrophobicContact CG1-CD1 4.43Å; E276-I280 HydrophobicContact CG-CD1 4.16Å; E276-I280 WeakPolarHBondContact O-CG1 3.44Å; E276-I280 PolarHBondContact O-N 3.42Å; L277-I280 PolarHBondContact O-N 3.19Å; L277-I280 VanDerWaalsContact O-N 3.07Å
281	Y	80.9	Confident	78.1	Confident	86 Å²	86	81 Å²	81	34%	0.337	41%	0.41	S	S	.	.	G	3₁₀ helix	trans	-74.9	-31.6	-167.9	-71.5	-58.1	0	0	0	116.5	K182 L277 N283 C284	K182-Y281 HydrophobicContact CD-CE1 3.83Å; K182-Y281 PolarHBondContact NZ-OH 2.77Å; L277-Y281 HydrophobicContact CB-CD2 3.89Å; L277-Y281 HydrophobicContact CB-CE2 3.88Å; L277-Y281 HydrophobicContact CD1-CE2 4.21Å; L277-Y281 HydrophobicContact CD2-CD2 4.3Å; L277-Y281 HydrophobicContact CD2-CE2 3.55Å; L277-Y281 HydrophobicContact CG-CE2 4.08Å; L277-Y281 WeakPolarHBondContact O-CD2 3.4Å; L277-Y281 PolarHBondContact O-N 3.06Å; Y281-N283 PolarHBondContact O-N 3.39Å; Y281-C284 PolarHBondContact O-N 2.94Å
282	P	79.3	Confident	78	Confident	80 Å²	80	79.5 Å²	79.5	52%	0.519	39%	0.394	S	S	.	.	G	3₁₀ helix	trans	-58.6	-21.5	179	-27.2	36.2	0	0	0	114.1	D278	D278-P282 WeakPolarHBondContact O-CD 3.14Å; D278-P282 WeakPolarHBondContact O-CG 3.29Å
283	N	66.7	Low	77.8	Confident	79 Å²	79	84.4 Å²	84.4	42%	0.422	42%	0.417	S	S	.	.	G	3₁₀ helix	trans	-96.2	-3.7	-178.4	-56.7	-20.3	0	0	0	113.2	I110 Y281	I110-N283 HydrophobicContact CG2-CB 3.76Å; I110-N283 PolarHBondContact O-ND2 2.97Å; Y281-N283 PolarHBondContact O-N 3.39Å
284	C	63.4	Low	77.3	Confident	33 Å²	33	85.8 Å²	85.8	22%	0.223	42%	0.416	C	S	.	.			trans	-100.3	114.3	176.1	-61.7	0	0	0	0	109.2	Y281	Y281-C284 PolarHBondContact O-N 2.94Å
285	K	54.8	Low	76.8	Confident	210 Å²	210	80.5 Å²	80.5	91%	0.913	40%	0.397	S	S	*	.			trans	-118.6	0	-173	-74.6	-172.3	179.8	178.8	0	115	E186 K205	E186-K285 PolarHBondContact OE2-N 2.73Å; K205-K285 PolarHBondContact NZ-O 2.85Å

Retrieved 285 of 285 residues in 170 ms (Link to these results)

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