A0A077YX56_TRITR Loading...

Tetraspannin domain containing protein

AlphaFold DB , UniProt , Accession A0A077YX56, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 285 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	49.1	Very low	62.2	Low	248 Å²	248	113.2 Å²	113.2	100%	1.222	68%	0.675	S	S	*	*				0	90.7	0	-66	176.7	174.5	0	0	108.5
2	R	53.5	Low	62.8	Low	248 Å²	248	113.8 Å²	113.8	94%	0.936	67%	0.671	S	S	*	*			trans	-149	13.8	-178.9	-117.7	179	-177.4	169.4	0.5	113.8
3	G	54.2	Low	63.5	Low	64 Å²	64	111.9 Å²	111.9	66%	0.66	66%	0.656	S	S	*	*	S	Bend	trans	-107.1	2.7	-176.6	0	0	0	0	0	115.5
4	G	56.2	Low	63.8	Low	59 Å²	59	110.8 Å²	110.8	61%	0.608	64%	0.644	S	S	*	*	S	Bend	trans	-88.4	-23.7	-174.5	0	0	0	0	0	115.3	S6	G4-S6 PolarHBondContact O-N 2.79Å
5	E	56.6	Low	63.8	Low	162 Å²	162	106.1 Å²	106.1	76%	0.757	62%	0.624	S	S	*	*	H	α-helix	trans	-75.1	-25.5	-173.5	-66.4	177.1	141.3	0	0	112.9	S9	E5-S9 PolarHBondContact O-N 2.9Å
6	S	67.1	Low	64	Low	85 Å²	85	104.6 Å²	104.6	59%	0.594	62%	0.616	S	S	*	*	H	α-helix	trans	-70.1	-37.9	178.9	164.5	0	0	0	0	113.1	G4 T10	G4-S6 PolarHBondContact O-N 2.79Å; S6-T10 PolarHBondContact O-N 2.98Å; S6-T10 PolarHBondContact O-OG1 3.47Å
7	V	67.3	Low	64.3	Low	102 Å²	102	108.6 Å²	108.6	62%	0.618	62%	0.618	S	S	*	*	H	α-helix	trans	-74.4	-41.3	-176.3	-175.8	0	0	0	0	110.9	T10 A11	V7-T10 PolarHBondContact O-N 3.47Å; V7-A11 WeakPolarHBondContact O-CB 3.29Å; V7-A11 PolarHBondContact O-N 3.16Å
8	A	67.8	Low	64.4	Low	64 Å²	64	108.7 Å²	108.7	53%	0.529	62%	0.616	S	S	.	*	H	α-helix	trans	-64	-42.3	178.5	0	0	0	0	0	112.5	T10 A11 L12	A8-T10 PolarHBondContact O-N 3.47Å; A8-A11 PolarHBondContact O-N 3.41Å; A8-L12 WeakPolarHBondContact O-CB 3.36Å; A8-L12 PolarHBondContact O-N 3.23Å
9	S	71.6	Confident	65	Low	80 Å²	80	109.7 Å²	109.7	56%	0.559	62%	0.615	S	S	*	*	H	α-helix	trans	-64.1	-39.8	176.2	-179.5	0	0	0	0	112.2	E5 L12 N13	E5-S9 PolarHBondContact O-N 2.9Å; S9-L12 PolarHBondContact O-N 3.03Å; S9-N13 PolarHBondContact O-N 3.18Å; S9-N13 VanDerWaalsContact O-N 3.09Å
10	T	74.2	Confident	65.5	Low	76 Å²	76	106 Å²	106	47%	0.466	60%	0.602	S	S	.	*	H	α-helix	trans	-66.6	-43.1	177	-53.3	0	0	0	0	111.5	S6 V7 A8 N13 I14	S6-T10 PolarHBondContact O-N 2.98Å; S6-T10 PolarHBondContact O-OG1 3.47Å; V7-T10 PolarHBondContact O-N 3.47Å; A8-T10 PolarHBondContact O-N 3.47Å; T10-N13 PolarHBondContact O-N 3.41Å; T10-I14 HydrophobicContact CG2-CD1 4.07Å; T10-I14 VanDerWaalsContact O-CG1 3.31Å; T10-I14 WeakPolarHBondContact O-CG1 3.28Å; T10-I14 PolarHBondContact O-N 2.95Å; T10-I14 VanDerWaalsContact O-N 3.09Å
11	A	67.1	Low	66.4	Low	57 Å²	57	108.2 Å²	108.2	47%	0.471	61%	0.605	S	S	.	*	H	α-helix	trans	-63	-41.8	176.8	0	0	0	0	0	112.4	V7 A8 I14 A15	V7-A11 WeakPolarHBondContact O-CB 3.29Å; V7-A11 PolarHBondContact O-N 3.16Å; A8-A11 PolarHBondContact O-N 3.41Å; A11-I14 PolarHBondContact O-N 3.49Å; A11-A15 WeakPolarHBondContact O-CB 3.42Å; A11-A15 PolarHBondContact O-N 3.07Å
12	L	69.1	Low	67.8	Low	120 Å²	120	98.7 Å²	98.7	63%	0.628	57%	0.565	S	S	*	*	H	α-helix	trans	-63.8	-43.6	177.2	-172.7	70.7	0	0	0	112	A8 S9 I14 A15 V16	A8-L12 WeakPolarHBondContact O-CB 3.36Å; A8-L12 PolarHBondContact O-N 3.23Å; S9-L12 PolarHBondContact O-N 3.03Å; L12-I14 VanDerWaalsContact C-N 3.31Å; L12-I14 PolarHBondContact O-N 3.24Å; L12-A15 PolarHBondContact O-N 2.96Å; L12-V16 WeakPolarHBondContact O-CG2 3.21Å; L12-V16 PolarHBondContact O-N 3.33Å
13	N	71.2	Confident	69.1	Low	90 Å²	90	91.5 Å²	91.5	48%	0.481	55%	0.549	S	S	.	.	H	α-helix	trans	-64.6	-36.6	177.9	-165	-11.5	0	0	0	111.8	S9 T10 R17	S9-N13 PolarHBondContact O-N 3.18Å; S9-N13 VanDerWaalsContact O-N 3.09Å; T10-N13 PolarHBondContact O-N 3.41Å; N13-R17 WeakPolarHBondContact O-CB 3.48Å; N13-R17 WeakPolarHBondContact O-CG 3.36Å; N13-R17 PolarHBondContact O-N 3.22Å; N13-R17 VanDerWaalsContact O-N 3.08Å
14	I	68.9	Low	70.6	Confident	96 Å²	96	93.6 Å²	93.6	49%	0.492	54%	0.544	S	S	.	.	H	α-helix	trans	-65.7	-45.6	173.5	-68.7	166.6	0	0	0	110.8	T10 A11 L12 R17 L18	T10-I14 HydrophobicContact CG2-CD1 4.07Å; T10-I14 VanDerWaalsContact O-CG1 3.31Å; T10-I14 WeakPolarHBondContact O-CG1 3.28Å; T10-I14 PolarHBondContact O-N 2.95Å; T10-I14 VanDerWaalsContact O-N 3.09Å; A11-I14 PolarHBondContact O-N 3.49Å; L12-I14 VanDerWaalsContact C-N 3.31Å; L12-I14 PolarHBondContact O-N 3.24Å; I14-R17 PolarHBondContact O-N 3.5Å; I14-L18 HydrophobicContact CG2-CD1 3.62Å; I14-L18 WeakPolarHBondContact O-CB 3.31Å; I14-L18 WeakPolarHBondContact O-CD1 3.44Å; I14-L18 WeakPolarHBondContact O-CG 3.28Å; I14-L18 PolarHBondContact O-N 2.84Å
15	A	62.6	Low	71.9	Confident	40 Å²	40	93.5 Å²	93.5	33%	0.331	54%	0.537	S	S	.	.	H	α-helix	trans	-60.9	-48.2	178.1	0	0	0	0	0	112.2	A11 L12 R17 L18 E19	A11-A15 WeakPolarHBondContact O-CB 3.42Å; A11-A15 PolarHBondContact O-N 3.07Å; L12-A15 PolarHBondContact O-N 2.96Å; A15-R17 VanDerWaalsContact C-N 3.31Å; A15-R17 PolarHBondContact O-N 3.38Å; A15-L18 WeakPolarHBondContact O-CB 3.31Å; A15-L18 PolarHBondContact O-N 2.78Å; A15-L18 VanDerWaalsContact O-N 3.09Å; A15-E19 WeakPolarHBondContact O-CG 3.23Å; A15-E19 PolarHBondContact O-N 3.4Å
16	V	67.3	Low	73.1	Confident	83 Å²	83	90.1 Å²	90.1	50%	0.503	52%	0.52	S	S	.	.	H	α-helix	trans	-61.6	-39.1	177.4	173.1	0	0	0	0	111.5	L12 E19 G20	L12-V16 WeakPolarHBondContact O-CG2 3.21Å; L12-V16 PolarHBondContact O-N 3.33Å; V16-E19 PolarHBondContact O-N 2.73Å; V16-G20 PolarHBondContact O-N 3.39Å
17	R	69.6	Low	74	Confident	173 Å²	173	88.8 Å²	88.8	65%	0.653	52%	0.515	S	S	*	.	H	α-helix	trans	-67.3	-35.7	174.5	-78.5	-177.8	176.8	-161.2	-3.1	112.7	N13 I14 A15 K21	N13-R17 WeakPolarHBondContact O-CB 3.48Å; N13-R17 WeakPolarHBondContact O-CG 3.36Å; N13-R17 PolarHBondContact O-N 3.22Å; N13-R17 VanDerWaalsContact O-N 3.08Å; I14-R17 PolarHBondContact O-N 3.5Å; A15-R17 VanDerWaalsContact C-N 3.31Å; A15-R17 PolarHBondContact O-N 3.38Å; R17-K21 WeakPolarHBondContact O-CG 3.23Å; R17-K21 PolarHBondContact O-N 2.8Å
18	L	65.4	Low	75	Confident	109 Å²	109	89 Å²	89	57%	0.571	51%	0.511	S	S	*	.	H	α-helix	trans	-67.7	-44	175.3	-84.2	153.6	0	0	0	111	I14 A15 K21 A22	I14-L18 HydrophobicContact CG2-CD1 3.62Å; I14-L18 WeakPolarHBondContact O-CB 3.31Å; I14-L18 WeakPolarHBondContact O-CD1 3.44Å; I14-L18 WeakPolarHBondContact O-CG 3.28Å; I14-L18 PolarHBondContact O-N 2.84Å; A15-L18 WeakPolarHBondContact O-CB 3.31Å; A15-L18 PolarHBondContact O-N 2.78Å; A15-L18 VanDerWaalsContact O-N 3.09Å; L18-K21 PolarHBondContact O-N 3.38Å; L18-A22 VanDerWaalsContact O-CB 3.31Å; L18-A22 WeakPolarHBondContact O-CB 3.49Å; L18-A22 PolarHBondContact O-N 2.88Å
19	E	75.9	Confident	75.8	Confident	129 Å²	129	88.6 Å²	88.6	60%	0.603	50%	0.5	S	S	*	.	H	α-helix	trans	-60.9	-46.6	174.5	-72.8	178.5	177.2	0	0	111.2	A15 V16 K21 A22 V23	A15-E19 WeakPolarHBondContact O-CG 3.23Å; A15-E19 PolarHBondContact O-N 3.4Å; V16-E19 PolarHBondContact O-N 2.73Å; E19-K21 PolarHBondContact O-N 2.93Å; E19-A22 PolarHBondContact O-N 3.46Å; E19-V23 VanDerWaalsContact O-CG2 3.31Å; E19-V23 WeakPolarHBondContact O-CG2 3.44Å; E19-V23 PolarHBondContact O-N 3.18Å
20	G	76.1	Confident	76.6	Confident	35 Å²	35	87.7 Å²	87.7	36%	0.361	49%	0.488	S	S	.	.	H	α-helix	trans	-59.6	-43.4	176.6	0	0	0	0	0	113.1	V16 V23 I24	V16-G20 PolarHBondContact O-N 3.39Å; G20-V23 PolarHBondContact O-N 3.25Å; G20-I24 WeakPolarHBondContact O-CG1 3.32Å; G20-I24 PolarHBondContact O-N 2.93Å; G20-I24 VanDerWaalsContact O-N 3.13Å
21	K	83.3	Confident	77.4	Confident	153 Å²	153	89.6 Å²	89.6	67%	0.665	50%	0.495	S	S	*	.	H	α-helix	trans	-66.3	-39.1	174.9	-74.4	-179.9	-179.6	-172.6	0	112.4	R17 L18 E19 I24 A25	R17-K21 WeakPolarHBondContact O-CG 3.23Å; R17-K21 PolarHBondContact O-N 2.8Å; L18-K21 PolarHBondContact O-N 3.38Å; E19-K21 PolarHBondContact O-N 2.93Å; K21-I24 PolarHBondContact O-N 3.47Å; K21-A25 WeakPolarHBondContact O-CB 3.28Å; K21-A25 PolarHBondContact O-N 2.88Å
22	A	79.3	Confident	78.4	Confident	47 Å²	47	90.8 Å²	90.8	39%	0.388	49%	0.493	S	S	.	.	H	α-helix	trans	-64.6	-41.3	177.9	0	0	0	0	0	111.4	L18 E19 A25 K26	L18-A22 VanDerWaalsContact O-CB 3.31Å; L18-A22 WeakPolarHBondContact O-CB 3.49Å; L18-A22 PolarHBondContact O-N 2.88Å; E19-A22 PolarHBondContact O-N 3.46Å; A22-A25 PolarHBondContact O-N 3.46Å; A22-K26 WeakPolarHBondContact O-CB 3.48Å; A22-K26 VanDerWaalsContact O-CG 3.3Å; A22-K26 WeakPolarHBondContact O-CG 3.07Å; A22-K26 PolarHBondContact O-N 3.47Å
23	V	81	Confident	79.3	Confident	97 Å²	97	85.1 Å²	85.1	59%	0.588	46%	0.463	S	S	*	.	H	α-helix	trans	-62.4	-45.7	175.3	173.3	0	0	0	0	111.1	E19 G20 K26 A27	E19-V23 VanDerWaalsContact O-CG2 3.31Å; E19-V23 WeakPolarHBondContact O-CG2 3.44Å; E19-V23 PolarHBondContact O-N 3.18Å; G20-V23 PolarHBondContact O-N 3.25Å; V23-K26 PolarHBondContact O-N 3.25Å; V23-A27 WeakPolarHBondContact O-CB 3.37Å; V23-A27 PolarHBondContact O-N 2.89Å
24	I	85.4	Confident	80.2	Confident	108 Å²	108	84.8 Å²	84.8	55%	0.554	46%	0.461	S	S	*	.	H	α-helix	trans	-62.1	-45.5	176.7	-67.5	162.5	0	0	0	110.9	G20 K21 K26 A27 I28	G20-I24 WeakPolarHBondContact O-CG1 3.32Å; G20-I24 PolarHBondContact O-N 2.93Å; G20-I24 VanDerWaalsContact O-N 3.13Å; K21-I24 PolarHBondContact O-N 3.47Å; I24-K26 PolarHBondContact O-N 3.36Å; I24-A27 PolarHBondContact O-N 3.01Å; I24-I28 HydrophobicContact CG2-CD1 3.77Å; I24-I28 HydrophobicContact CG2-CG1 4.41Å; I24-I28 VanDerWaalsContact O-CG1 3.32Å; I24-I28 WeakPolarHBondContact O-CG1 3.48Å; I24-I28 PolarHBondContact O-N 3.34Å
25	A	82.5	Confident	81.2	Confident	57 Å²	57	83.5 Å²	83.5	47%	0.471	46%	0.457	S	S	.	.	H	α-helix	trans	-62.2	-41.7	178.6	0	0	0	0	0	112.2	K21 A22 I28 L29	K21-A25 WeakPolarHBondContact O-CB 3.28Å; K21-A25 PolarHBondContact O-N 2.88Å; A22-A25 PolarHBondContact O-N 3.46Å; A25-I28 PolarHBondContact O-N 3.42Å; A25-L29 WeakPolarHBondContact O-CB 3.4Å; A25-L29 PolarHBondContact O-N 2.93Å
26	K	82.8	Confident	82.5	Confident	91 Å²	91	84.3 Å²	84.3	40%	0.396	46%	0.456	S	S	.	.	H	α-helix	trans	-60.4	-45.9	173.6	-76.5	176.1	174.7	-176.9	0	111.5	A22 V23 I24 I28 L29 L30 E108	A22-K26 WeakPolarHBondContact O-CB 3.48Å; A22-K26 VanDerWaalsContact O-CG 3.3Å; A22-K26 WeakPolarHBondContact O-CG 3.07Å; A22-K26 PolarHBondContact O-N 3.47Å; V23-K26 PolarHBondContact O-N 3.25Å; I24-K26 PolarHBondContact O-N 3.36Å; K26-I28 PolarHBondContact O-N 3.46Å; K26-L29 PolarHBondContact O-N 2.87Å; K26-L30 WeakPolarHBondContact O-CB 3.27Å; K26-L30 PolarHBondContact O-N 3.49Å; K26-E108 IonicContact NZ-OE1 4Å; K26-E108 PolarHBondContact NZ-OE1 3.4Å; K26-E108 IonicContact NZ-OE2 3.74Å; K26-E108 PolarHBondContact NZ-OE2 3.35Å
27	A	84.8	Confident	83.4	Confident	58 Å²	58	81.1 Å²	81.1	48%	0.479	44%	0.438	S	S	.	.	H	α-helix	trans	-62.4	-42.2	178.3	0	0	0	0	0	112.2	V23 I24 L30 L31	V23-A27 WeakPolarHBondContact O-CB 3.37Å; V23-A27 PolarHBondContact O-N 2.89Å; I24-A27 PolarHBondContact O-N 3.01Å; A27-L30 PolarHBondContact O-N 3.37Å; A27-L31 WeakPolarHBondContact O-CB 3.34Å; A27-L31 PolarHBondContact O-N 2.95Å
28	I	89.1	Confident	84.4	Confident	106 Å²	106	79.6 Å²	79.6	54%	0.544	44%	0.437	S	S	.	.	H	α-helix	trans	-63.7	-45.6	175.5	-67.6	167.9	0	0	0	110.7	I24 A25 K26 L30 L31 L32	I24-I28 HydrophobicContact CG2-CD1 3.77Å; I24-I28 HydrophobicContact CG2-CG1 4.41Å; I24-I28 VanDerWaalsContact O-CG1 3.32Å; I24-I28 WeakPolarHBondContact O-CG1 3.48Å; I24-I28 PolarHBondContact O-N 3.34Å; A25-I28 PolarHBondContact O-N 3.42Å; K26-I28 PolarHBondContact O-N 3.46Å; I28-L30 VanDerWaalsContact C-N 3.34Å; I28-L30 PolarHBondContact O-N 2.82Å; I28-L31 PolarHBondContact O-N 3.22Å; I28-L32 VanDerWaalsContact O-CB 3.27Å; I28-L32 WeakPolarHBondContact O-CB 3.39Å; I28-L32 PolarHBondContact O-N 3.04Å
29	L	85.7	Confident	85.5	Confident	55 Å²	55	78.8 Å²	78.8	29%	0.288	43%	0.432	S	S	.	.	H	α-helix	trans	-62.7	-41.9	178.9	-174.2	69.5	0	0	0	111.6	A25 K26 L32 T33 L113 Y116	A25-L29 WeakPolarHBondContact O-CB 3.4Å; A25-L29 PolarHBondContact O-N 2.93Å; K26-L29 PolarHBondContact O-N 2.87Å; L29-L32 PolarHBondContact O-N 2.67Å; L29-T33 WeakPolarHBondContact O-CB 3.41Å; L29-T33 VanDerWaalsContact O-CG2 3.29Å; L29-T33 WeakPolarHBondContact O-CG2 3.38Å; L29-T33 PolarHBondContact O-N 3.46Å; L29-T33 PolarHBondContact O-OG1 2.98Å; L29-L113 HydrophobicContact CD2-CD2 3.7Å; L29-Y116 HydrophobicContact CD1-CE1 4.41Å
30	L	87.8	Confident	86	Confident	62 Å²	62	73.3 Å²	73.3	33%	0.325	41%	0.408	S	S	.	.	H	α-helix	trans	-64.4	-46	176.4	-175.2	147.2	0	0	0	111.1	K26 A27 I28 L32 T33 I34 L102 I106	K26-L30 WeakPolarHBondContact O-CB 3.27Å; K26-L30 PolarHBondContact O-N 3.49Å; A27-L30 PolarHBondContact O-N 3.37Å; I28-L30 VanDerWaalsContact C-N 3.34Å; I28-L30 PolarHBondContact O-N 2.82Å; L30-L32 PolarHBondContact O-N 3.28Å; L30-T33 WeakPolarHBondContact CA-OG1 3.43Å; L30-T33 PolarHBondContact O-N 3.45Å; L30-T33 PolarHBondContact O-OG1 2.69Å; L30-I34 HydrophobicContact CD2-CD1 3.45Å; L30-I34 VanDerWaalsContact CD2-CD1 3.45Å; L30-I34 HydrophobicContact CD2-CG1 4.42Å; L30-I34 HydrophobicContact CG-CD1 4.15Å; L30-I34 WeakPolarHBondContact O-CB 3.46Å; L30-I34 VanDerWaalsContact O-CG1 3.25Å; L30-I34 WeakPolarHBondContact O-CG1 3.34Å; L30-I34 PolarHBondContact O-N 2.83Å; L30-L102 HydrophobicContact CG-CD1 4.33Å; L30-I106 HydrophobicContact CD1-CG1 4.26Å
31	L	90.4	Very high	86.5	Confident	115 Å²	115	75.4 Å²	75.4	60%	0.602	41%	0.414	S	S	*	.	H	α-helix	trans	-61.8	-44.6	176.7	-176.4	139.3	0	0	0	111.5	A27 I28 I34 V35	A27-L31 WeakPolarHBondContact O-CB 3.34Å; A27-L31 PolarHBondContact O-N 2.95Å; I28-L31 PolarHBondContact O-N 3.22Å; L31-I34 PolarHBondContact O-N 3.47Å; L31-V35 HydrophobicContact CD2-CG2 4.38Å; L31-V35 WeakPolarHBondContact O-CB 3.2Å; L31-V35 VanDerWaalsContact O-CG2 3.26Å; L31-V35 WeakPolarHBondContact O-CG2 3.2Å; L31-V35 PolarHBondContact O-N 3.19Å
32	L	89.1	Confident	86.7	Confident	83 Å²	83	70.3 Å²	70.3	44%	0.435	40%	0.395	S	S	.	.	H	α-helix	trans	-62.8	-47.1	178.3	-172.9	109.9	0	0	0	111.6	I28 L29 L30 I34 V35 L36	I28-L32 VanDerWaalsContact O-CB 3.27Å; I28-L32 WeakPolarHBondContact O-CB 3.39Å; I28-L32 PolarHBondContact O-N 3.04Å; L29-L32 PolarHBondContact O-N 2.67Å; L30-L32 PolarHBondContact O-N 3.28Å; L32-I34 PolarHBondContact O-N 2.96Å; L32-V35 PolarHBondContact O-N 3.36Å; L32-L36 HydrophobicContact CD2-CD1 3.66Å; L32-L36 HydrophobicContact CG-CD1 3.77Å; L32-L36 HydrophobicContact CG-CG 4.36Å; L32-L36 WeakPolarHBondContact O-CB 3.2Å; L32-L36 WeakPolarHBondContact O-CG 3.31Å; L32-L36 PolarHBondContact O-N 2.88Å
33	T	87.5	Confident	87	Confident	0 Å²	0	71.1 Å²	71.1	0%	0	40%	0.395	C	S	.	.	H	α-helix	trans	-64.8	-37.9	179.6	49.4	0	0	0	0	112.2	L29 L30 A37 Y116	L29-T33 WeakPolarHBondContact O-CB 3.41Å; L29-T33 VanDerWaalsContact O-CG2 3.29Å; L29-T33 WeakPolarHBondContact O-CG2 3.38Å; L29-T33 PolarHBondContact O-N 3.46Å; L29-T33 PolarHBondContact O-OG1 2.98Å; L30-T33 WeakPolarHBondContact CA-OG1 3.43Å; L30-T33 PolarHBondContact O-N 3.45Å; L30-T33 PolarHBondContact O-OG1 2.69Å; T33-A37 WeakPolarHBondContact O-CB 3.25Å; T33-A37 PolarHBondContact O-N 3.11Å; T33-Y116 HydrophobicContact CG2-CE1 4.2Å
34	I	89.1	Confident	87.2	Confident	83 Å²	83	68 Å²	68	43%	0.426	38%	0.375	S	S	.	.	H	α-helix	trans	-64.2	-48.9	173.9	-69.7	174.6	0	0	0	111	L30 L31 L32 L36 A37 F38 L102	L30-I34 HydrophobicContact CD2-CD1 3.45Å; L30-I34 VanDerWaalsContact CD2-CD1 3.45Å; L30-I34 HydrophobicContact CD2-CG1 4.42Å; L30-I34 HydrophobicContact CG-CD1 4.15Å; L30-I34 WeakPolarHBondContact O-CB 3.46Å; L30-I34 VanDerWaalsContact O-CG1 3.25Å; L30-I34 WeakPolarHBondContact O-CG1 3.34Å; L30-I34 PolarHBondContact O-N 2.83Å; L31-I34 PolarHBondContact O-N 3.47Å; L32-I34 PolarHBondContact O-N 2.96Å; I34-L36 VanDerWaalsContact C-N 3.33Å; I34-L36 PolarHBondContact O-N 3.42Å; I34-A37 PolarHBondContact O-N 2.94Å; I34-F38 WeakPolarHBondContact O-CB 3.17Å; I34-F38 PolarHBondContact O-N 3Å; I34-L102 HydrophobicContact CD1-CD1 4.22Å; I34-L102 HydrophobicContact CG1-CD1 3.74Å
35	V	91.3	Very high	87.2	Confident	70 Å²	70	67 Å²	67	42%	0.424	37%	0.374	S	S	.	.	H	α-helix	trans	-60.6	-45.4	179.4	169.9	0	0	0	0	110.4	L31 L32 F38 L39	L31-V35 HydrophobicContact CD2-CG2 4.38Å; L31-V35 WeakPolarHBondContact O-CB 3.2Å; L31-V35 VanDerWaalsContact O-CG2 3.26Å; L31-V35 WeakPolarHBondContact O-CG2 3.2Å; L31-V35 PolarHBondContact O-N 3.19Å; L32-V35 PolarHBondContact O-N 3.36Å; V35-F38 PolarHBondContact O-N 2.93Å; V35-L39 HydrophobicContact CG1-CD1 3.95Å; V35-L39 HydrophobicContact CG1-CG 4.4Å; V35-L39 WeakPolarHBondContact O-CB 3.2Å; V35-L39 VanDerWaalsContact O-CG 3.27Å; V35-L39 WeakPolarHBondContact O-CG 3.33Å; V35-L39 PolarHBondContact O-N 2.74Å
36	L	89.7	Confident	87.2	Confident	56 Å²	56	69.3 Å²	69.3	29%	0.293	37%	0.374	S	S	.	.	H	α-helix	trans	-69.3	-37	179.8	-67.7	173.5	0	0	0	112.9	L32 I34 L39 S40 H98	L32-L36 HydrophobicContact CD2-CD1 3.66Å; L32-L36 HydrophobicContact CG-CD1 3.77Å; L32-L36 HydrophobicContact CG-CG 4.36Å; L32-L36 WeakPolarHBondContact O-CB 3.2Å; L32-L36 WeakPolarHBondContact O-CG 3.31Å; L32-L36 PolarHBondContact O-N 2.88Å; I34-L36 VanDerWaalsContact C-N 3.33Å; I34-L36 PolarHBondContact O-N 3.42Å; L36-L39 HydrophobicContact CD2-CD1 4.48Å; L36-L39 PolarHBondContact O-N 3.49Å; L36-S40 WeakPolarHBondContact O-CB 3.47Å; L36-S40 PolarHBondContact O-N 2.9Å; L36-S40 PolarHBondContact O-OG 2.85Å; L36-H98 VanDerWaalsContact CB-CE1 3.48Å; L36-H98 WeakPolarHBondContact CB-CE1 3.49Å; L36-H98 VanDerWaalsContact CD1-CE1 3.49Å; L36-H98 WeakPolarHBondContact CD1-CE1 3.14Å
37	A	86.2	Confident	86.9	Confident	17 Å²	17	65.6 Å²	65.6	14%	0.14	36%	0.359	C	S	.	.	H	α-helix	trans	-62.4	-45.6	172.4	0	0	0	0	0	110.9	T33 I34 S40 V41 H98	T33-A37 WeakPolarHBondContact O-CB 3.25Å; T33-A37 PolarHBondContact O-N 3.11Å; I34-A37 PolarHBondContact O-N 2.94Å; A37-S40 PolarHBondContact O-N 3.35Å; A37-V41 WeakPolarHBondContact O-CG2 3.43Å; A37-V41 PolarHBondContact O-N 3.43Å; A37-H98 HydrophobicContact CB-CB 3.86Å
38	F	89.4	Confident	86.7	Confident	141 Å²	141	66.4 Å²	66.4	62%	0.618	36%	0.355	S	S	*	.	H	α-helix	trans	-61.4	-47.3	176.9	-178.3	-98.7	0	0	0	111.6	I34 V35 S40 V41 V42	I34-F38 WeakPolarHBondContact O-CB 3.17Å; I34-F38 PolarHBondContact O-N 3Å; V35-F38 PolarHBondContact O-N 2.93Å; F38-S40 VanDerWaalsContact C-N 3.3Å; F38-S40 PolarHBondContact O-N 3.49Å; F38-V41 PolarHBondContact O-N 2.93Å; F38-V42 HydrophobicContact CD1-CG2 4.11Å; F38-V42 HydrophobicContact CE1-CG2 3.72Å; F38-V42 HydrophobicContact CE2-CG2 4.39Å; F38-V42 HydrophobicContact CZ-CG2 3.88Å; F38-V42 WeakPolarHBondContact O-CG2 3.07Å; F38-V42 PolarHBondContact O-N 2.94Å
39	L	89.3	Confident	86.2	Confident	91 Å²	91	64 Å²	64	48%	0.476	35%	0.348	S	S	.	.	H	α-helix	trans	-59.5	-41.4	175.4	-71.8	173.4	0	0	0	111.7	V35 L36 V41 V42 V43	V35-L39 HydrophobicContact CG1-CD1 3.95Å; V35-L39 HydrophobicContact CG1-CG 4.4Å; V35-L39 WeakPolarHBondContact O-CB 3.2Å; V35-L39 VanDerWaalsContact O-CG 3.27Å; V35-L39 WeakPolarHBondContact O-CG 3.33Å; V35-L39 PolarHBondContact O-N 2.74Å; L36-L39 HydrophobicContact CD2-CD1 4.48Å; L36-L39 PolarHBondContact O-N 3.49Å; L39-V41 PolarHBondContact O-N 2.83Å; L39-V42 PolarHBondContact O-N 3.09Å; L39-V43 VanDerWaalsContact O-CG2 3.3Å; L39-V43 WeakPolarHBondContact O-CG2 3.46Å; L39-V43 PolarHBondContact O-N 3.07Å
40	S	86.9	Confident	85.4	Confident	15 Å²	15	61.7 Å²	61.7	11%	0.105	34%	0.336	C	S	.	.	H	α-helix	trans	-62.5	-43.7	177.4	-57.6	0	0	0	0	111.6	L36 A37 F38 V43 I44	L36-S40 WeakPolarHBondContact O-CB 3.47Å; L36-S40 PolarHBondContact O-N 2.9Å; L36-S40 PolarHBondContact O-OG 2.85Å; A37-S40 PolarHBondContact O-N 3.35Å; F38-S40 VanDerWaalsContact C-N 3.3Å; F38-S40 PolarHBondContact O-N 3.49Å; S40-V43 PolarHBondContact O-N 3.42Å; S40-I44 WeakPolarHBondContact O-CD1 3.4Å; S40-I44 WeakPolarHBondContact O-CG1 3.33Å; S40-I44 PolarHBondContact O-N 3.09Å
41	V	87.2	Confident	84.8	Confident	78 Å²	78	60.1 Å²	60.1	47%	0.473	33%	0.326	S	S	.	.	H	α-helix	trans	-64.1	-42.7	175.8	172.8	0	0	0	0	111.3	A37 F38 L39 V43 I44 T45	A37-V41 WeakPolarHBondContact O-CG2 3.43Å; A37-V41 PolarHBondContact O-N 3.43Å; F38-V41 PolarHBondContact O-N 2.93Å; L39-V41 PolarHBondContact O-N 2.83Å; V41-V43 VanDerWaalsContact C-N 3.33Å; V41-V43 PolarHBondContact O-N 3.36Å; V41-I44 PolarHBondContact O-N 2.92Å; V41-T45 WeakPolarHBondContact O-CB 3.46Å; V41-T45 PolarHBondContact O-N 2.86Å; V41-T45 PolarHBondContact O-OG1 3.43Å
42	V	87.3	Confident	84	Confident	46 Å²	46	55.8 Å²	55.8	28%	0.279	31%	0.309	S	S	.	.	H	α-helix	trans	-60.6	-44.3	176.5	170.5	0	0	0	0	110.9	F38 L39 K46	F38-V42 HydrophobicContact CD1-CG2 4.11Å; F38-V42 HydrophobicContact CE1-CG2 3.72Å; F38-V42 HydrophobicContact CE2-CG2 4.39Å; F38-V42 HydrophobicContact CZ-CG2 3.88Å; F38-V42 WeakPolarHBondContact O-CG2 3.07Å; F38-V42 PolarHBondContact O-N 2.94Å; L39-V42 PolarHBondContact O-N 3.09Å; V42-K46 HydrophobicContact CG1-CD 4.03Å; V42-K46 WeakPolarHBondContact O-CB 3.47Å; V42-K46 VanDerWaalsContact O-CG 3.32Å; V42-K46 WeakPolarHBondContact O-CG 3.42Å; V42-K46 PolarHBondContact O-N 2.91Å
43	V	85	Confident	82.9	Confident	64 Å²	64	54.8 Å²	54.8	39%	0.388	30%	0.302	S	S	.	.	H	α-helix	trans	-62.6	-49.6	176.4	172.6	0	0	0	0	110.5	L39 S40 V41 T45 K46 T47 S91	L39-V43 VanDerWaalsContact O-CG2 3.3Å; L39-V43 WeakPolarHBondContact O-CG2 3.46Å; L39-V43 PolarHBondContact O-N 3.07Å; S40-V43 PolarHBondContact O-N 3.42Å; V41-V43 VanDerWaalsContact C-N 3.33Å; V41-V43 PolarHBondContact O-N 3.36Å; V43-T45 PolarHBondContact O-N 3.33Å; V43-K46 PolarHBondContact O-N 3.08Å; V43-T47 WeakPolarHBondContact O-CB 3.34Å; V43-T47 PolarHBondContact O-N 3.37Å; V43-T47 PolarHBondContact O-OG1 2.91Å; V43-S91 WeakPolarHBondContact CG1-OG 3.48Å
44	I	85.3	Confident	81.9	Confident	32 Å²	32	55.5 Å²	55.5	16%	0.164	31%	0.305	C	S	.	.	H	α-helix	trans	-57.2	-49	178.6	-67.6	162.6	0	0	0	111.2	S40 V41 K46 T47 N48 A95	S40-I44 WeakPolarHBondContact O-CD1 3.4Å; S40-I44 WeakPolarHBondContact O-CG1 3.33Å; S40-I44 PolarHBondContact O-N 3.09Å; V41-I44 PolarHBondContact O-N 2.92Å; I44-K46 VanDerWaalsContact C-N 3.35Å; I44-K46 PolarHBondContact O-N 3.09Å; I44-T47 PolarHBondContact O-N 2.9Å; I44-N48 WeakPolarHBondContact CG2-ND2 3.3Å; I44-N48 VanDerWaalsContact O-CB 3.24Å; I44-N48 WeakPolarHBondContact O-CB 3.36Å; I44-N48 PolarHBondContact O-N 3.38Å; I44-N48 PolarHBondContact O-ND2 3.18Å; I44-A95 HydrophobicContact CD1-CB 3.96Å
45	T	85.3	Confident	80.9	Confident	86 Å²	86	53.6 Å²	53.6	53%	0.528	30%	0.297	S	S	.	.	H	α-helix	trans	-61.7	-43.4	-179.5	-60.4	0	0	0	0	111.4	V41 V43 S49	V41-T45 WeakPolarHBondContact O-CB 3.46Å; V41-T45 PolarHBondContact O-N 2.86Å; V41-T45 PolarHBondContact O-OG1 3.43Å; V43-T45 PolarHBondContact O-N 3.33Å; T45-S49 WeakPolarHBondContact O-CB 3.34Å; T45-S49 PolarHBondContact O-N 2.86Å
46	K	81.3	Confident	79.8	Confident	107 Å²	107	55.3 Å²	55.3	47%	0.465	30%	0.304	S	S	.	.	H	α-helix	trans	-68	-45.4	178.6	-76.6	-175.8	170.9	-167.6	0	112.2	V42 V43 I44 S49 S50 F165	V42-K46 HydrophobicContact CG1-CD 4.03Å; V42-K46 WeakPolarHBondContact O-CB 3.47Å; V42-K46 VanDerWaalsContact O-CG 3.32Å; V42-K46 WeakPolarHBondContact O-CG 3.42Å; V42-K46 PolarHBondContact O-N 2.91Å; V43-K46 PolarHBondContact O-N 3.08Å; I44-K46 VanDerWaalsContact C-N 3.35Å; I44-K46 PolarHBondContact O-N 3.09Å; K46-S49 PolarHBondContact O-N 2.94Å; K46-S50 PolarHBondContact O-N 3.46Å; K46-S50 PolarHBondContact O-OG 3.49Å; K46-F165 HydrophobicContact CB-CD1 3.77Å; K46-F165 HydrophobicContact CB-CE1 4.25Å; K46-F165 HydrophobicContact CB-CG 4.3Å; K46-F165 HydrophobicContact CD-CB 3.91Å; K46-F165 HydrophobicContact CD-CG 4.39Å; K46-F165 HydrophobicContact CG-CB 4.47Å
47	T	77.9	Confident	78.3	Confident	13 Å²	13	54.3 Å²	54.3	8%	0.08	30%	0.3	C	S	.	.	H	α-helix	trans	-64.5	-41.1	177.8	-55	0	0	0	0	111.4	V43 I44 S50 F51 F84 A87 I88	V43-T47 WeakPolarHBondContact O-CB 3.34Å; V43-T47 PolarHBondContact O-N 3.37Å; V43-T47 PolarHBondContact O-OG1 2.91Å; I44-T47 PolarHBondContact O-N 2.9Å; T47-S50 PolarHBondContact O-N 3.48Å; T47-F51 VanDerWaalsContact O-CB 3.27Å; T47-F51 WeakPolarHBondContact O-CB 3.34Å; T47-F51 PolarHBondContact O-N 3.36Å; T47-F84 HydrophobicContact CG2-CD1 4.12Å; T47-A87 HydrophobicContact CG2-CB 4.37Å; T47-I88 HydrophobicContact CG2-CD1 4.13Å; T47-I88 HydrophobicContact CG2-CG1 3.59Å
48	N	79	Confident	77.1	Confident	75 Å²	75	54.4 Å²	54.4	40%	0.401	30%	0.298	S	S	.	.	H	α-helix	trans	-64.1	-41.5	175.3	-75.3	-12.2	0	0	0	112.2	I44 F51 G52 I88	I44-N48 WeakPolarHBondContact CG2-ND2 3.3Å; I44-N48 VanDerWaalsContact O-CB 3.24Å; I44-N48 WeakPolarHBondContact O-CB 3.36Å; I44-N48 PolarHBondContact O-N 3.38Å; I44-N48 PolarHBondContact O-ND2 3.18Å; N48-F51 PolarHBondContact O-N 2.88Å; N48-G52 PolarHBondContact O-N 3.47Å; N48-I88 VanDerWaalsContact OD1-CD1 3.28Å; N48-I88 WeakPolarHBondContact OD1-CD1 3.38Å
49	S	79.1	Confident	76	Confident	56 Å²	56	50.4 Å²	50.4	39%	0.392	29%	0.288	S	S	.	.	H	α-helix	trans	-61.5	-46	175.6	179.5	0	0	0	0	111.4	T45 K46 G52 K53	T45-S49 WeakPolarHBondContact O-CB 3.34Å; T45-S49 PolarHBondContact O-N 2.86Å; K46-S49 PolarHBondContact O-N 2.94Å; S49-G52 PolarHBondContact O-N 2.73Å; S49-K53 WeakPolarHBondContact O-CG 3.42Å; S49-K53 PolarHBondContact O-N 2.96Å; S49-K53 PolarHBondContact OG-NZ 2.99Å; S49-K53 VanDerWaalsContact OG-NZ 3.1Å
50	S	70.3	Confident	74.7	Confident	5 Å²	5	52.2 Å²	52.2	4%	0.035	29%	0.294	C	S	.	.	H	α-helix	trans	-66.6	-38.4	176	-68.2	0	0	0	0	112.7	K46 T47 K53 I54 F165	K46-S50 PolarHBondContact O-N 3.46Å; K46-S50 PolarHBondContact O-OG 3.49Å; T47-S50 PolarHBondContact O-N 3.48Å; S50-K53 PolarHBondContact O-N 3.26Å; S50-I54 VanDerWaalsContact O-CG1 3.29Å; S50-I54 WeakPolarHBondContact O-CG1 3.2Å; S50-I54 PolarHBondContact O-N 3.41Å; S50-F165 VanDerWaalsContact OG-CD1 3.27Å; S50-F165 WeakPolarHBondContact OG-CD1 3.31Å; S50-F165 WeakPolarHBondContact OG-CE1 3.31Å
51	F	74.5	Confident	73	Confident	29 Å²	29	56.7 Å²	56.7	13%	0.127	32%	0.316	C	S	.	.	H	α-helix	trans	-61.1	-48.3	176.1	-177	-93.7	0	0	0	111.3	T47 N48 K53 I54 T55 F81 F84 Y85 I88	T47-F51 VanDerWaalsContact O-CB 3.27Å; T47-F51 WeakPolarHBondContact O-CB 3.34Å; T47-F51 PolarHBondContact O-N 3.36Å; N48-F51 PolarHBondContact O-N 2.88Å; F51-K53 VanDerWaalsContact C-N 3.29Å; F51-K53 PolarHBondContact O-N 3.38Å; F51-I54 PolarHBondContact O-N 3.42Å; F51-T55 HydrophobicContact CD1-CG2 3.98Å; F51-T55 HydrophobicContact CE1-CG2 3.44Å; F51-T55 VanDerWaalsContact CE1-CG2 3.44Å; F51-T55 HydrophobicContact CE2-CG2 4.22Å; F51-T55 HydrophobicContact CZ-CG2 3.56Å; F51-T55 PolarHBondContact O-N 3.5Å; F51-T55 PolarHBondContact O-OG1 3.25Å; F51-T55 VanDerWaalsContact O-OG1 3.13Å; F51-F81 AromaticContact CD2-CD1 3.97Å; F51-F81 HydrophobicContact CD2-CD1 3.97Å; F51-F81 HydrophobicContact CD2-CE1 4.34Å; F51-F81 HydrophobicContact CE2-CB 4.32Å; F51-F81 AromaticContact CE2-CD1 3.34Å; F51-F81 HydrophobicContact CE2-CD1 3.34Å; F51-F81 AromaticContact CE2-CE1 3.86Å; F51-F81 HydrophobicContact CE2-CE1 3.86Å; F51-F81 HydrophobicContact CE2-CG 4.13Å; F51-F81 HydrophobicContact CZ-CD1 4.07Å; F51-F81 HydrophobicContact CZ-CE1 4.3Å; F51-F84 HydrophobicContact CD2-CB 3.76Å; F51-F84 HydrophobicContact CD2-CG 4.36Å; F51-F84 HydrophobicContact CE2-CB 4.38Å; F51-Y85 HydrophobicContact CE1-CE1 4.49Å; F51-Y85 HydrophobicContact CE2-CD2 4.37Å; F51-Y85 HydrophobicContact CE2-CE1 4.22Å; F51-Y85 AromaticContact CE2-CE2 3.9Å; F51-Y85 HydrophobicContact CE2-CE2 3.9Å; F51-Y85 AromaticContact CE2-CZ 3.82Å; F51-Y85 AromaticContact CZ-CE1 3.88Å; F51-Y85 HydrophobicContact CZ-CE1 3.88Å; F51-Y85 AromaticContact CZ-CE2 3.88Å; F51-Y85 HydrophobicContact CZ-CE2 3.88Å; F51-Y85 AromaticContact CZ-CZ 3.39Å; F51-Y85 VanDerWaalsContact CZ-OH 3.26Å; F51-Y85 WeakPolarHBondContact CZ-OH 3.36Å; F51-I88 HydrophobicContact CB-CD1 4.45Å; F51-I88 HydrophobicContact CG-CD1 4.47Å
52	G	72.4	Confident	71.7	Confident	24 Å²	24	59.3 Å²	59.3	25%	0.247	32%	0.323	C	S	.	.	H	α-helix	trans	-55.4	-42.6	177.4	0	0	0	0	0	112.7	N48 S49 T55 D56	N48-G52 PolarHBondContact O-N 3.47Å; S49-G52 PolarHBondContact O-N 2.73Å; G52-T55 WeakPolarHBondContact CA-OG1 3.14Å; G52-T55 PolarHBondContact O-N 3.42Å; G52-T55 PolarHBondContact O-OG1 3.47Å; G52-D56 WeakPolarHBondContact O-CB 3.29Å; G52-D56 PolarHBondContact O-N 2.97Å
53	K	67.6	Low	70.5	Confident	63 Å²	63	62.7 Å²	62.7	27%	0.274	34%	0.344	S	S	.	.	H	α-helix	trans	-67	-43	177.4	-66.9	-170.2	-175.6	99.8	0	113.2	S49 S50 F51 T55 D56 V57 D161	S49-K53 WeakPolarHBondContact O-CG 3.42Å; S49-K53 PolarHBondContact O-N 2.96Å; S49-K53 PolarHBondContact OG-NZ 2.99Å; S49-K53 VanDerWaalsContact OG-NZ 3.1Å; S50-K53 PolarHBondContact O-N 3.26Å; F51-K53 VanDerWaalsContact C-N 3.29Å; F51-K53 PolarHBondContact O-N 3.38Å; K53-T55 VanDerWaalsContact C-N 3.3Å; K53-T55 PolarHBondContact O-N 2.88Å; K53-D56 PolarHBondContact O-N 2.97Å; K53-V57 WeakPolarHBondContact O-CG2 3.45Å; K53-V57 PolarHBondContact O-N 3.37Å; K53-V57 VanDerWaalsContact O-N 3.08Å; K53-D161 HydrophobicContact CD-CB 3.94Å; K53-D161 WeakPolarHBondContact CE-OD2 3.38Å; K53-D161 VanDerWaalsContact NZ-CG 3.31Å; K53-D161 IonicContact NZ-OD2 3.04Å; K53-D161 PolarHBondContact NZ-OD2 3.37Å
54	I	65.1	Low	68.9	Low	14 Å²	14	63.1 Å²	63.1	7%	0.072	35%	0.354	C	S	.	.	H	α-helix	trans	-64.5	-40	178.1	-65.8	167	0	0	0	109.7	S50 F51 I58 F81 F84 Y157	S50-I54 VanDerWaalsContact O-CG1 3.29Å; S50-I54 WeakPolarHBondContact O-CG1 3.2Å; S50-I54 PolarHBondContact O-N 3.41Å; F51-I54 PolarHBondContact O-N 3.42Å; I54-I58 HydrophobicContact CG2-CD1 3.77Å; I54-I58 WeakPolarHBondContact O-CB 3.33Å; I54-I58 WeakPolarHBondContact O-CG1 3.12Å; I54-I58 PolarHBondContact O-N 3.47Å; I54-F81 HydrophobicContact CB-CE1 4.32Å; I54-F81 HydrophobicContact CG2-CD1 4.49Å; I54-F81 HydrophobicContact CG2-CE1 3.59Å; I54-F81 HydrophobicContact CG2-CZ 4.02Å; I54-F84 HydrophobicContact CD1-CD2 4.5Å; I54-F84 HydrophobicContact CD1-CE1 4.19Å; I54-F84 HydrophobicContact CD1-CE2 3.68Å; I54-F84 HydrophobicContact CD1-CZ 3.49Å; I54-F84 VanDerWaalsContact CD1-CZ 3.49Å; I54-Y157 HydrophobicContact CG1-CE1 4.5Å
55	T	68.6	Low	67	Low	43 Å²	43	64.7 Å²	64.7	26%	0.264	38%	0.378	S	S	.	.	H	α-helix	trans	-65.5	-41.9	175.4	50.4	0	0	0	0	112.9	F51 G52 K53 I58 S59 F81	F51-T55 HydrophobicContact CD1-CG2 3.98Å; F51-T55 HydrophobicContact CE1-CG2 3.44Å; F51-T55 VanDerWaalsContact CE1-CG2 3.44Å; F51-T55 HydrophobicContact CE2-CG2 4.22Å; F51-T55 HydrophobicContact CZ-CG2 3.56Å; F51-T55 PolarHBondContact O-N 3.5Å; F51-T55 PolarHBondContact O-OG1 3.25Å; F51-T55 VanDerWaalsContact O-OG1 3.13Å; G52-T55 WeakPolarHBondContact CA-OG1 3.14Å; G52-T55 PolarHBondContact O-N 3.42Å; G52-T55 PolarHBondContact O-OG1 3.47Å; K53-T55 VanDerWaalsContact C-N 3.3Å; K53-T55 PolarHBondContact O-N 2.88Å; T55-I58 PolarHBondContact O-N 3.25Å; T55-S59 WeakPolarHBondContact O-CB 3.46Å; T55-S59 PolarHBondContact O-N 2.87Å; T55-F81 HydrophobicContact CG2-CE1 3.68Å; T55-F81 HydrophobicContact CG2-CZ 3.84Å
56	D	68.2	Low	65.2	Low	107 Å²	107	69.6 Å²	69.6	57%	0.572	39%	0.392	S	S	*	.	H	α-helix	trans	-62.7	-47.2	179.7	-72.9	-12.2	0	0	0	110.8	G52 K53 I58 S59 E60	G52-D56 WeakPolarHBondContact O-CB 3.29Å; G52-D56 PolarHBondContact O-N 2.97Å; K53-D56 PolarHBondContact O-N 2.97Å; D56-I58 PolarHBondContact O-N 3.37Å; D56-S59 PolarHBondContact O-N 3.26Å; D56-S59 PolarHBondContact O-OG 2.83Å; D56-E60 PolarHBondContact O-N 3.05Å
57	V	58.7	Low	63.5	Low	34 Å²	34	70.4 Å²	70.4	21%	0.206	41%	0.411	C	S	.	.	H	α-helix	trans	-67.5	-36	178.8	174.3	0	0	0	0	112.3	K53 S59 E60 L61 Y157	K53-V57 WeakPolarHBondContact O-CG2 3.45Å; K53-V57 PolarHBondContact O-N 3.37Å; K53-V57 VanDerWaalsContact O-N 3.08Å; V57-S59 VanDerWaalsContact C-N 3.31Å; V57-S59 PolarHBondContact O-N 3.18Å; V57-E60 WeakPolarHBondContact O-CB 3.22Å; V57-E60 PolarHBondContact O-N 3.44Å; V57-L61 HydrophobicContact CG1-CD1 4.17Å; V57-L61 WeakPolarHBondContact O-CG 3.12Å; V57-L61 PolarHBondContact O-N 3.4Å; V57-Y157 HydrophobicContact CB-CE1 3.52Å; V57-Y157 WeakPolarHBondContact CB-OH 3.31Å; V57-Y157 HydrophobicContact CG1-CE1 3.64Å; V57-Y157 VanDerWaalsContact CG1-OH 3.29Å; V57-Y157 WeakPolarHBondContact CG1-OH 3.46Å; V57-Y157 HydrophobicContact CG2-CD1 4.29Å; V57-Y157 HydrophobicContact CG2-CE1 3.57Å
58	I	61	Low	62.2	Low	20 Å²	20	75.1 Å²	75.1	10%	0.103	44%	0.436	C	S	.	.	H	α-helix	trans	-66.2	-37.4	174.9	-78.9	171.8	0	0	0	111.3	I54 T55 D56 E60 L61 E62 K77 F81	I54-I58 HydrophobicContact CG2-CD1 3.77Å; I54-I58 WeakPolarHBondContact O-CB 3.33Å; I54-I58 WeakPolarHBondContact O-CG1 3.12Å; I54-I58 PolarHBondContact O-N 3.47Å; T55-I58 PolarHBondContact O-N 3.25Å; D56-I58 PolarHBondContact O-N 3.37Å; I58-E60 VanDerWaalsContact C-N 3.32Å; I58-L61 PolarHBondContact O-N 2.7Å; I58-E62 WeakPolarHBondContact O-CG 3.22Å; I58-E62 PolarHBondContact O-N 3.46Å; I58-K77 HydrophobicContact CD1-CG 4.33Å; I58-K77 HydrophobicContact CG2-CD 3.73Å; I58-K77 HydrophobicContact CG2-CG 4.26Å; I58-F81 HydrophobicContact CB-CZ 4.47Å; I58-F81 HydrophobicContact CD1-CE1 4.19Å; I58-F81 HydrophobicContact CD1-CE2 3.63Å; I58-F81 HydrophobicContact CD1-CZ 3.28Å; I58-F81 HydrophobicContact CG1-CZ 4.41Å
59	S	65	Low	61	Low	57 Å²	57	76.6 Å²	76.6	40%	0.399	44%	0.444	S	S	.	.	H	α-helix	trans	-65.5	-38.2	173.6	79	0	0	0	0	111.4	T55 D56 V57 E62 T63	T55-S59 WeakPolarHBondContact O-CB 3.46Å; T55-S59 PolarHBondContact O-N 2.87Å; D56-S59 PolarHBondContact O-N 3.26Å; D56-S59 PolarHBondContact O-OG 2.83Å; V57-S59 VanDerWaalsContact C-N 3.31Å; V57-S59 PolarHBondContact O-N 3.18Å; S59-E62 PolarHBondContact O-N 3.45Å; S59-T63 WeakPolarHBondContact O-CG2 3.29Å; S59-T63 PolarHBondContact O-N 3.28Å; S59-T63 PolarHBondContact O-OG1 2.82Å
60	E	62	Low	60	Low	129 Å²	129	82 Å²	82	60%	0.603	46%	0.463	S	S	*	.	H	α-helix	trans	-64	-43.4	175.2	-168	173.1	-179.7	0	0	111.4	D56 V57 I58 E62 T63 A64	D56-E60 PolarHBondContact O-N 3.05Å; V57-E60 WeakPolarHBondContact O-CB 3.22Å; V57-E60 PolarHBondContact O-N 3.44Å; I58-E60 VanDerWaalsContact C-N 3.32Å; E60-E62 PolarHBondContact O-N 2.96Å; E60-T63 WeakPolarHBondContact CA-OG1 3.3Å; E60-T63 CarbonylContact O-C 3.57Å; E60-T63 PolarHBondContact O-N 2.85Å; E60-T63 VanDerWaalsContact O-N 3.16Å; E60-T63 PolarHBondContact O-OG1 3.25Å; E60-A64 WeakPolarHBondContact O-CB 3.44Å; E60-A64 PolarHBondContact O-N 3.11Å
61	L	52.5	Low	59.3	Low	109 Å²	109	86.8 Å²	86.8	57%	0.571	49%	0.492	S	S	*	.	H	α-helix	trans	-62.9	-36.6	174.9	-76	165.4	0	0	0	113.2	V57 I58 A64	V57-L61 HydrophobicContact CG1-CD1 4.17Å; V57-L61 WeakPolarHBondContact O-CG 3.12Å; V57-L61 PolarHBondContact O-N 3.4Å; I58-L61 PolarHBondContact O-N 2.7Å; L61-A64 PolarHBondContact O-N 3.31Å
62	E	60.6	Low	58.4	Low	132 Å²	132	91.2 Å²	91.2	62%	0.617	51%	0.513	S	S	*	.	H	α-helix	trans	-64.6	-41.8	172.3	-77.2	-179	162.8	0	0	111.4	I58 S59 E60 A64 K77	I58-E62 WeakPolarHBondContact O-CG 3.22Å; I58-E62 PolarHBondContact O-N 3.46Å; S59-E62 PolarHBondContact O-N 3.45Å; E60-E62 PolarHBondContact O-N 2.96Å; E62-A64 VanDerWaalsContact C-N 3.33Å; E62-A64 PolarHBondContact O-N 2.88Å; E62-K77 IonicContact OE1-NZ 2.72Å; E62-K77 PolarHBondContact OE1-NZ 2.9Å
63	T	60.3	Low	57.4	Low	118 Å²	118	90.9 Å²	90.9	72%	0.724	51%	0.508	S	S	*	.	H	α-helix	trans	-72.8	-24.6	178.4	60.5	0	0	0	0	113.5	S59 E60 G65	S59-T63 WeakPolarHBondContact O-CG2 3.29Å; S59-T63 PolarHBondContact O-N 3.28Å; S59-T63 PolarHBondContact O-OG1 2.82Å; E60-T63 WeakPolarHBondContact CA-OG1 3.3Å; E60-T63 CarbonylContact O-C 3.57Å; E60-T63 PolarHBondContact O-N 2.85Å; E60-T63 VanDerWaalsContact O-N 3.16Å; E60-T63 PolarHBondContact O-OG1 3.25Å; T63-G65 PolarHBondContact O-N 2.92Å
64	A	52.8	Low	56.9	Low	72 Å²	72	90.1 Å²	90.1	60%	0.595	51%	0.513	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.7	3.9	-178.9	0	0	0	0	0	114.5	E60 L61 E62 K66	E60-A64 WeakPolarHBondContact O-CB 3.44Å; E60-A64 PolarHBondContact O-N 3.11Å; L61-A64 PolarHBondContact O-N 3.31Å; E62-A64 VanDerWaalsContact C-N 3.33Å; E62-A64 PolarHBondContact O-N 2.88Å; A64-K66 VanDerWaalsContact C-N 3.33Å; A64-K66 PolarHBondContact O-N 3.33Å; A64-K66 VanDerWaalsContact O-N 3.16Å
65	G	44.9	Very low	56.6	Low	65 Å²	65	93.4 Å²	93.4	67%	0.67	53%	0.531	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.8	22	159	0	0	0	0	0	116.7	T63 S67	T63-G65 PolarHBondContact O-N 2.92Å; G65-S67 PolarHBondContact O-N 3.45Å
66	K	48.3	Very low	56	Low	189 Å²	189	94.9 Å²	94.9	82%	0.822	54%	0.536	S	S	*	.			trans	-80.8	118.7	166.8	-92.8	-177.9	177.3	173.8	0	109	A64 L68	A64-K66 VanDerWaalsContact C-N 3.33Å; A64-K66 PolarHBondContact O-N 3.33Å; A64-K66 VanDerWaalsContact O-N 3.16Å; K66-L68 PolarHBondContact O-N 3.17Å
67	S	44.9	Very low	55.6	Low	124 Å²	124	91.6 Å²	91.6	87%	0.867	52%	0.517	S	S	*	.			trans	-57.4	75	168	58.5	0	0	0	0	111.1	G65	G65-S67 PolarHBondContact O-N 3.45Å
68	L	49.8	Very low	55.9	Low	113 Å²	113	94.6 Å²	94.6	59%	0.592	54%	0.536	S	S	*	.			trans	-78.8	131.7	155.1	-139.2	77.4	0	0	0	105.2	K66 E70 A73	K66-L68 PolarHBondContact O-N 3.17Å; L68-E70 PolarHBondContact O-N 3.4Å; L68-A73 HydrophobicContact CB-CB 4.24Å; L68-A73 HydrophobicContact CD2-CB 3.76Å; L68-A73 HydrophobicContact CG-CB 4.45Å
69	D	54.8	Low	56	Low	106 Å²	106	99.5 Å²	99.5	57%	0.567	56%	0.556	S	S	*	*			trans	-47	110.5	174.4	-170	-18.3	0	0	0	107.9	T71 E72 A73	D69-T71 PolarHBondContact O-N 2.93Å; D69-T71 PolarHBondContact OD1-OG1 3.46Å; D69-T71 VanDerWaalsContact OD1-OG1 3.07Å; D69-E72 HydrophobicContact CB-CB 4.38Å; D69-E72 PolarHBondContact O-N 2.7Å; D69-A73 PolarHBondContact O-N 2.92Å
70	E	58	Low	55.8	Low	170 Å²	170	98.4 Å²	98.4	79%	0.794	55%	0.545	S	S	*	.	H	α-helix	trans	-52	-30.4	-168.8	-70.5	-178.9	159.5	0	0	110.8	L68 A74	L68-E70 PolarHBondContact O-N 3.4Å; E70-A74 WeakPolarHBondContact O-CB 3.18Å; E70-A74 PolarHBondContact O-N 3.4Å
71	T	54.8	Low	56	Low	105 Å²	105	93.6 Å²	93.6	64%	0.644	52%	0.522	S	S	*	.	H	α-helix	trans	-69.2	-42.9	179.1	-29.6	0	0	0	0	113.1	D69 N75	D69-T71 PolarHBondContact O-N 2.93Å; D69-T71 PolarHBondContact OD1-OG1 3.46Å; D69-T71 VanDerWaalsContact OD1-OG1 3.07Å; T71-N75 WeakPolarHBondContact O-CB 3.46Å; T71-N75 PolarHBondContact O-N 3.49Å; T71-N75 VanDerWaalsContact O-N 3.15Å
72	E	55.3	Low	56.9	Low	122 Å²	122	90.8 Å²	90.8	57%	0.57	51%	0.514	S	S	*	.	H	α-helix	trans	-77.4	-40	-179.3	-165.8	168.5	-162.1	0	0	110.6	D69 A74 N75 I76	D69-E72 HydrophobicContact CB-CB 4.38Å; D69-E72 PolarHBondContact O-N 2.7Å; E72-A74 PolarHBondContact O-N 2.91Å; E72-N75 PolarHBondContact O-N 3.47Å; E72-I76 HydrophobicContact CG-CD1 4.03Å; E72-I76 WeakPolarHBondContact O-CB 3.33Å; E72-I76 VanDerWaalsContact O-CG1 3.3Å; E72-I76 WeakPolarHBondContact O-CG1 3.33Å; E72-I76 PolarHBondContact O-N 3Å
73	A	53.1	Low	57.4	Low	17 Å²	17	88.5 Å²	88.5	14%	0.14	51%	0.505	C	S	.	.	H	α-helix	trans	-57.6	-48.6	172.2	0	0	0	0	0	111.5	L68 D69 N75 I76 K77	L68-A73 HydrophobicContact CB-CB 4.24Å; L68-A73 HydrophobicContact CD2-CB 3.76Å; L68-A73 HydrophobicContact CG-CB 4.45Å; D69-A73 PolarHBondContact O-N 2.92Å; A73-N75 VanDerWaalsContact C-N 3.33Å; A73-N75 PolarHBondContact O-N 2.94Å; A73-I76 PolarHBondContact O-N 3.4Å; A73-K77 WeakPolarHBondContact O-CB 3.33Å; A73-K77 WeakPolarHBondContact O-CG 3.34Å; A73-K77 PolarHBondContact O-N 3.07Å
74	A	57.3	Low	57.9	Low	47 Å²	47	83.9 Å²	83.9	39%	0.388	48%	0.475	S	S	.	.	H	α-helix	trans	-64.7	-37	179.6	0	0	0	0	0	112.4	E70 E72 T78	E70-A74 WeakPolarHBondContact O-CB 3.18Å; E70-A74 PolarHBondContact O-N 3.4Å; E72-A74 PolarHBondContact O-N 2.91Å; A74-T78 WeakPolarHBondContact O-CB 3.21Å; A74-T78 PolarHBondContact O-N 2.9Å; A74-T78 PolarHBondContact O-OG1 2.93Å
75	N	58.5	Low	59.1	Low	83 Å²	83	87 Å²	87	44%	0.444	47%	0.473	S	S	.	.	H	α-helix	trans	-72.9	-39.8	-179.6	-158.4	7.8	0	0	0	112	T71 E72 A73 K79	T71-N75 WeakPolarHBondContact O-CB 3.46Å; T71-N75 PolarHBondContact O-N 3.49Å; T71-N75 VanDerWaalsContact O-N 3.15Å; E72-N75 PolarHBondContact O-N 3.47Å; A73-N75 VanDerWaalsContact C-N 3.33Å; A73-N75 PolarHBondContact O-N 2.94Å; N75-K79 WeakPolarHBondContact O-CB 3.26Å; N75-K79 VanDerWaalsContact O-CG 3.3Å; N75-K79 WeakPolarHBondContact O-CG 3.3Å; N75-K79 PolarHBondContact O-N 3.25Å; N75-K79 VanDerWaalsContact OD1-CE 3.25Å; N75-K79 WeakPolarHBondContact OD1-CE 3.38Å
76	I	54.3	Low	60.8	Low	73 Å²	73	89.1 Å²	89.1	37%	0.374	47%	0.468	S	S	.	.	H	α-helix	trans	-63.1	-49.7	172.9	-67.9	169.9	0	0	0	109.6	E72 A73 T78 K79 E80	E72-I76 HydrophobicContact CG-CD1 4.03Å; E72-I76 WeakPolarHBondContact O-CB 3.33Å; E72-I76 VanDerWaalsContact O-CG1 3.3Å; E72-I76 WeakPolarHBondContact O-CG1 3.33Å; E72-I76 PolarHBondContact O-N 3Å; A73-I76 PolarHBondContact O-N 3.4Å; I76-T78 PolarHBondContact O-N 3.13Å; I76-K79 PolarHBondContact O-N 3.28Å; I76-E80 VanDerWaalsContact CG2-CD 3.42Å; I76-E80 HydrophobicContact CG2-CG 4.13Å; I76-E80 WeakPolarHBondContact CG2-OE1 3.47Å; I76-E80 WeakPolarHBondContact O-CB 3.39Å; I76-E80 WeakPolarHBondContact O-CG 3.42Å; I76-E80 PolarHBondContact O-N 3.48Å
77	K	61.6	Low	62.2	Low	39 Å²	39	81.7 Å²	81.7	17%	0.17	44%	0.442	C	S	.	.	H	α-helix	trans	-52.9	-52.5	175.2	-75	177.6	-165.8	-161	0	111.6	I58 E62 A73 K79 E80 F81	I58-K77 HydrophobicContact CD1-CG 4.33Å; I58-K77 HydrophobicContact CG2-CD 3.73Å; I58-K77 HydrophobicContact CG2-CG 4.26Å; E62-K77 IonicContact OE1-NZ 2.72Å; E62-K77 PolarHBondContact OE1-NZ 2.9Å; A73-K77 WeakPolarHBondContact O-CB 3.33Å; A73-K77 WeakPolarHBondContact O-CG 3.34Å; A73-K77 PolarHBondContact O-N 3.07Å; K77-K79 VanDerWaalsContact C-N 3.33Å; K77-K79 PolarHBondContact O-N 2.88Å; K77-E80 PolarHBondContact O-N 3.05Å; K77-F81 HydrophobicContact CB-CD2 3.97Å; K77-F81 HydrophobicContact CB-CE2 3.98Å; K77-F81 HydrophobicContact CG-CE2 4.14Å; K77-F81 VanDerWaalsContact O-CB 3.24Å; K77-F81 WeakPolarHBondContact O-CB 3.26Å; K77-F81 WeakPolarHBondContact O-CD2 3.3Å; K77-F81 WeakPolarHBondContact O-CG 3.32Å; K77-F81 PolarHBondContact O-N 3.44Å
78	T	63.2	Low	64	Low	97 Å²	97	77.4 Å²	77.4	60%	0.595	41%	0.409	S	S	*	.	H	α-helix	trans	-62.4	-41.5	-175.8	-54.8	0	0	0	0	111.5	A74 I76 A82	A74-T78 WeakPolarHBondContact O-CB 3.21Å; A74-T78 PolarHBondContact O-N 2.9Å; A74-T78 PolarHBondContact O-OG1 2.93Å; I76-T78 PolarHBondContact O-N 3.13Å; T78-A82 VanDerWaalsContact O-CB 3.22Å; T78-A82 WeakPolarHBondContact O-CB 3.25Å; T78-A82 PolarHBondContact O-N 3.47Å
79	K	64.3	Low	65.8	Low	123 Å²	123	76.9 Å²	76.9	54%	0.535	41%	0.406	S	S	.	.	H	α-helix	trans	-72	-42.8	-179.9	-72.8	174.7	179.6	171.8	0	112.7	N75 I76 K77 A82	N75-K79 WeakPolarHBondContact O-CB 3.26Å; N75-K79 VanDerWaalsContact O-CG 3.3Å; N75-K79 WeakPolarHBondContact O-CG 3.3Å; N75-K79 PolarHBondContact O-N 3.25Å; N75-K79 VanDerWaalsContact OD1-CE 3.25Å; N75-K79 WeakPolarHBondContact OD1-CE 3.38Å; I76-K79 PolarHBondContact O-N 3.28Å; K77-K79 VanDerWaalsContact C-N 3.33Å; K77-K79 PolarHBondContact O-N 2.88Å; K79-A82 PolarHBondContact O-N 3.15Å
80	E	61.3	Low	67.3	Low	33 Å²	33	74.6 Å²	74.6	15%	0.154	40%	0.396	C	S	.	.	H	α-helix	trans	-68.7	-44.9	179.9	-71.9	-179.3	170.7	0	0	111.3	I76 K77 A82 I83 F84 F145	I76-E80 VanDerWaalsContact CG2-CD 3.42Å; I76-E80 HydrophobicContact CG2-CG 4.13Å; I76-E80 WeakPolarHBondContact CG2-OE1 3.47Å; I76-E80 WeakPolarHBondContact O-CB 3.39Å; I76-E80 WeakPolarHBondContact O-CG 3.42Å; I76-E80 PolarHBondContact O-N 3.48Å; K77-E80 PolarHBondContact O-N 3.05Å; E80-A82 VanDerWaalsContact C-N 3.29Å; E80-A82 PolarHBondContact O-N 3.43Å; E80-I83 PolarHBondContact O-N 3.24Å; E80-F84 WeakPolarHBondContact O-CD2 3.36Å; E80-F145 HydrophobicContact CB-CE2 4.36Å; E80-F145 HydrophobicContact CG-CE2 3.69Å; E80-F145 HydrophobicContact CG-CZ 4.16Å
81	F	66.3	Low	68.6	Low	28 Å²	28	67.5 Å²	67.5	12%	0.123	37%	0.365	C	S	.	.	H	α-helix	trans	-67.1	-30.1	176.1	-71.2	-55.9	0	0	0	112.8	F51 I54 T55 I58 K77 I83 F84 Y85	F51-F81 AromaticContact CD2-CD1 3.97Å; F51-F81 HydrophobicContact CD2-CD1 3.97Å; F51-F81 HydrophobicContact CD2-CE1 4.34Å; F51-F81 HydrophobicContact CE2-CB 4.32Å; F51-F81 AromaticContact CE2-CD1 3.34Å; F51-F81 HydrophobicContact CE2-CD1 3.34Å; F51-F81 AromaticContact CE2-CE1 3.86Å; F51-F81 HydrophobicContact CE2-CE1 3.86Å; F51-F81 HydrophobicContact CE2-CG 4.13Å; F51-F81 HydrophobicContact CZ-CD1 4.07Å; F51-F81 HydrophobicContact CZ-CE1 4.3Å; I54-F81 HydrophobicContact CB-CE1 4.32Å; I54-F81 HydrophobicContact CG2-CD1 4.49Å; I54-F81 HydrophobicContact CG2-CE1 3.59Å; I54-F81 HydrophobicContact CG2-CZ 4.02Å; T55-F81 HydrophobicContact CG2-CE1 3.68Å; T55-F81 HydrophobicContact CG2-CZ 3.84Å; I58-F81 HydrophobicContact CB-CZ 4.47Å; I58-F81 HydrophobicContact CD1-CE1 4.19Å; I58-F81 HydrophobicContact CD1-CE2 3.63Å; I58-F81 HydrophobicContact CD1-CZ 3.28Å; I58-F81 HydrophobicContact CG1-CZ 4.41Å; K77-F81 HydrophobicContact CB-CD2 3.97Å; K77-F81 HydrophobicContact CB-CE2 3.98Å; K77-F81 HydrophobicContact CG-CE2 4.14Å; K77-F81 VanDerWaalsContact O-CB 3.24Å; K77-F81 WeakPolarHBondContact O-CB 3.26Å; K77-F81 WeakPolarHBondContact O-CD2 3.3Å; K77-F81 WeakPolarHBondContact O-CG 3.32Å; K77-F81 PolarHBondContact O-N 3.44Å; F81-I83 PolarHBondContact O-N 3.36Å; F81-F84 PolarHBondContact O-N 3.05Å; F81-F84 VanDerWaalsContact O-N 3.13Å; F81-Y85 HydrophobicContact CB-CD2 4.01Å; F81-Y85 HydrophobicContact CB-CE2 3.89Å; F81-Y85 WeakPolarHBondContact O-CD2 3.48Å; F81-Y85 PolarHBondContact O-N 2.86Å
82	A	70.6	Confident	70.1	Confident	50 Å²	50	64.6 Å²	64.6	41%	0.413	35%	0.349	S	S	.	.	H	α-helix	trans	-57.1	-34.9	178.4	0	0	0	0	0	112.5	T78 K79 E80 L86	T78-A82 VanDerWaalsContact O-CB 3.22Å; T78-A82 WeakPolarHBondContact O-CB 3.25Å; T78-A82 PolarHBondContact O-N 3.47Å; K79-A82 PolarHBondContact O-N 3.15Å; E80-A82 VanDerWaalsContact C-N 3.29Å; E80-A82 PolarHBondContact O-N 3.43Å; A82-L86 WeakPolarHBondContact O-CB 3.41Å; A82-L86 PolarHBondContact O-N 3.44Å
83	I	70.7	Confident	71.6	Confident	84 Å²	84	63.5 Å²	63.5	43%	0.431	35%	0.345	S	S	.	.	H	α-helix	trans	-70.5	-42.8	178.4	-59.8	-171.3	0	0	0	111.1	E80 F81 L86 A87 F145	E80-I83 PolarHBondContact O-N 3.24Å; F81-I83 PolarHBondContact O-N 3.36Å; I83-L86 PolarHBondContact O-N 2.87Å; I83-A87 WeakPolarHBondContact O-CB 3.22Å; I83-A87 PolarHBondContact O-N 2.83Å; I83-F145 HydrophobicContact CD1-CD1 3.66Å; I83-F145 HydrophobicContact CD1-CD2 4.42Å; I83-F145 HydrophobicContact CD1-CE1 3.11Å; I83-F145 HydrophobicContact CD1-CE2 3.91Å; I83-F145 HydrophobicContact CD1-CG 4.32Å; I83-F145 HydrophobicContact CD1-CZ 3.24Å; I83-F145 HydrophobicContact CG1-CE1 4.39Å; I83-F145 HydrophobicContact CG1-CZ 4.15Å
84	F	71.5	Confident	73.3	Confident	22 Å²	22	63.4 Å²	63.4	10%	0.096	34%	0.344	C	S	.	.	H	α-helix	trans	-64	-43.7	175.5	-69.3	-74.2	0	0	0	111.6	T47 F51 I54 E80 F81 L86 A87 I88 F149	T47-F84 HydrophobicContact CG2-CD1 4.12Å; F51-F84 HydrophobicContact CD2-CB 3.76Å; F51-F84 HydrophobicContact CD2-CG 4.36Å; F51-F84 HydrophobicContact CE2-CB 4.38Å; I54-F84 HydrophobicContact CD1-CD2 4.5Å; I54-F84 HydrophobicContact CD1-CE1 4.19Å; I54-F84 HydrophobicContact CD1-CE2 3.68Å; I54-F84 HydrophobicContact CD1-CZ 3.49Å; I54-F84 VanDerWaalsContact CD1-CZ 3.49Å; E80-F84 WeakPolarHBondContact O-CD2 3.36Å; F81-F84 PolarHBondContact O-N 3.05Å; F81-F84 VanDerWaalsContact O-N 3.13Å; F84-L86 VanDerWaalsContact C-N 3.33Å; F84-L86 PolarHBondContact O-N 3.39Å; F84-A87 PolarHBondContact O-N 3.26Å; F84-I88 VanDerWaalsContact O-CG1 3.25Å; F84-I88 WeakPolarHBondContact O-CG1 3.38Å; F84-I88 PolarHBondContact O-N 3.36Å; F84-F149 AromaticContact CE2-CE2 3.91Å; F84-F149 HydrophobicContact CE2-CE2 3.91Å; F84-F149 AromaticContact CZ-CE2 3.62Å; F84-F149 HydrophobicContact CZ-CE2 3.62Å; F84-F149 AromaticContact CZ-CZ 3.86Å; F84-F149 HydrophobicContact CZ-CZ 3.86Å
85	Y	76.9	Confident	74.7	Confident	136 Å²	136	61.7 Å²	61.7	53%	0.533	33%	0.331	S	S	.	.	H	α-helix	trans	-60.9	-42.3	174.5	-78.5	-60.3	0	0	0	112.1	F51 F81 I88 L89	F51-Y85 HydrophobicContact CE1-CE1 4.49Å; F51-Y85 HydrophobicContact CE2-CD2 4.37Å; F51-Y85 HydrophobicContact CE2-CE1 4.22Å; F51-Y85 AromaticContact CE2-CE2 3.9Å; F51-Y85 HydrophobicContact CE2-CE2 3.9Å; F51-Y85 AromaticContact CE2-CZ 3.82Å; F51-Y85 AromaticContact CZ-CE1 3.88Å; F51-Y85 HydrophobicContact CZ-CE1 3.88Å; F51-Y85 AromaticContact CZ-CE2 3.88Å; F51-Y85 HydrophobicContact CZ-CE2 3.88Å; F51-Y85 AromaticContact CZ-CZ 3.39Å; F51-Y85 VanDerWaalsContact CZ-OH 3.26Å; F51-Y85 WeakPolarHBondContact CZ-OH 3.36Å; F81-Y85 HydrophobicContact CB-CD2 4.01Å; F81-Y85 HydrophobicContact CB-CE2 3.89Å; F81-Y85 WeakPolarHBondContact O-CD2 3.48Å; F81-Y85 PolarHBondContact O-N 2.86Å; Y85-I88 PolarHBondContact O-N 3.37Å; Y85-L89 VanDerWaalsContact O-CB 3.22Å; Y85-L89 WeakPolarHBondContact O-CB 3.31Å; Y85-L89 PolarHBondContact O-N 3.2Å
86	L	81.1	Confident	76.2	Confident	111 Å²	111	62 Å²	62	58%	0.581	34%	0.335	S	S	*	.	H	α-helix	trans	-64.6	-42.8	176.4	-173.1	143.1	0	0	0	111	A82 I83 F84 L89 V90	A82-L86 WeakPolarHBondContact O-CB 3.41Å; A82-L86 PolarHBondContact O-N 3.44Å; I83-L86 PolarHBondContact O-N 2.87Å; F84-L86 VanDerWaalsContact C-N 3.33Å; F84-L86 PolarHBondContact O-N 3.39Å; L86-L89 PolarHBondContact O-N 2.89Å; L86-V90 HydrophobicContact CD2-CG2 4.03Å; L86-V90 HydrophobicContact CG-CG2 4.32Å; L86-V90 VanDerWaalsContact O-CB 3.29Å; L86-V90 WeakPolarHBondContact O-CB 3.42Å; L86-V90 WeakPolarHBondContact O-CG2 3.49Å; L86-V90 PolarHBondContact O-N 2.88Å
87	A	78.4	Confident	77.9	Confident	33 Å²	33	59.3 Å²	59.3	27%	0.273	32%	0.322	S	S	.	.	H	α-helix	trans	-61.3	-48.2	175.7	0	0	0	0	0	111.7	T47 I83 F84 L89 V90 S91	T47-A87 HydrophobicContact CG2-CB 4.37Å; I83-A87 WeakPolarHBondContact O-CB 3.22Å; I83-A87 PolarHBondContact O-N 2.83Å; F84-A87 PolarHBondContact O-N 3.26Å; A87-L89 VanDerWaalsContact C-N 3.34Å; A87-L89 PolarHBondContact O-N 3.32Å; A87-V90 PolarHBondContact O-N 3.48Å; A87-S91 VanDerWaalsContact O-CB 3.31Å; A87-S91 WeakPolarHBondContact O-CB 3.36Å; A87-S91 PolarHBondContact O-N 3.35Å; A87-S91 PolarHBondContact O-OG 3.45Å; A87-S91 VanDerWaalsContact O-OG 3.04Å
88	I	83.2	Confident	79.2	Confident	33 Å²	33	58.1 Å²	58.1	17%	0.169	32%	0.316	C	S	.	.	H	α-helix	trans	-60.1	-45.6	176.9	-66.8	163.5	0	0	0	110.4	T47 N48 F51 F84 Y85 S92	T47-I88 HydrophobicContact CG2-CD1 4.13Å; T47-I88 HydrophobicContact CG2-CG1 3.59Å; N48-I88 VanDerWaalsContact OD1-CD1 3.28Å; N48-I88 WeakPolarHBondContact OD1-CD1 3.38Å; F51-I88 HydrophobicContact CB-CD1 4.45Å; F51-I88 HydrophobicContact CG-CD1 4.47Å; F84-I88 VanDerWaalsContact O-CG1 3.25Å; F84-I88 WeakPolarHBondContact O-CG1 3.38Å; F84-I88 PolarHBondContact O-N 3.36Å; Y85-I88 PolarHBondContact O-N 3.37Å; I88-S92 VanDerWaalsContact O-CB 3.22Å; I88-S92 WeakPolarHBondContact O-CB 3.35Å; I88-S92 PolarHBondContact O-N 3.13Å; I88-S92 PolarHBondContact O-OG 2.99Å
89	L	86.4	Confident	80.4	Confident	102 Å²	102	57.2 Å²	57.2	53%	0.534	31%	0.307	S	S	.	.	H	α-helix	trans	-61.3	-52	179.3	-177.7	66.8	0	0	0	111	Y85 L86 A87 S91 S92 M93	Y85-L89 VanDerWaalsContact O-CB 3.22Å; Y85-L89 WeakPolarHBondContact O-CB 3.31Å; Y85-L89 PolarHBondContact O-N 3.2Å; L86-L89 PolarHBondContact O-N 2.89Å; A87-L89 VanDerWaalsContact C-N 3.34Å; A87-L89 PolarHBondContact O-N 3.32Å; L89-S91 PolarHBondContact O-N 2.87Å; L89-S92 PolarHBondContact O-N 3.45Å; L89-S92 PolarHBondContact O-OG 3.04Å; L89-M93 HydrophobicContact CG-SD 4.43Å; L89-M93 WeakPolarHBondContact O-CG 3.37Å; L89-M93 PolarHBondContact O-N 2.74Å
90	V	86.1	Confident	81.6	Confident	58 Å²	58	53.3 Å²	53.3	35%	0.352	29%	0.293	S	S	.	.	H	α-helix	trans	-60.8	-45.6	180	170.2	0	0	0	0	110.9	L86 A87 M93 A94 F123	L86-V90 HydrophobicContact CD2-CG2 4.03Å; L86-V90 HydrophobicContact CG-CG2 4.32Å; L86-V90 VanDerWaalsContact O-CB 3.29Å; L86-V90 WeakPolarHBondContact O-CB 3.42Å; L86-V90 WeakPolarHBondContact O-CG2 3.49Å; L86-V90 PolarHBondContact O-N 2.88Å; A87-V90 PolarHBondContact O-N 3.48Å; V90-M93 PolarHBondContact O-N 2.88Å; V90-A94 WeakPolarHBondContact O-CB 3.21Å; V90-A94 PolarHBondContact O-N 2.86Å; V90-F123 HydrophobicContact CG1-CE2 4.47Å; V90-F123 HydrophobicContact CG1-CZ 3.73Å
91	S	85.5	Confident	82.9	Confident	21 Å²	21	51.8 Å²	51.8	15%	0.147	29%	0.287	C	S	.	.	H	α-helix	trans	-67	-37.2	177.7	-62	0	0	0	0	112.5	V43 A87 L89 A94 A95	V43-S91 WeakPolarHBondContact CG1-OG 3.48Å; A87-S91 VanDerWaalsContact O-CB 3.31Å; A87-S91 WeakPolarHBondContact O-CB 3.36Å; A87-S91 PolarHBondContact O-N 3.35Å; A87-S91 PolarHBondContact O-OG 3.45Å; A87-S91 VanDerWaalsContact O-OG 3.04Å; L89-S91 PolarHBondContact O-N 2.87Å; S91-A94 PolarHBondContact O-N 3.47Å; S91-A95 WeakPolarHBondContact O-CB 3.35Å; S91-A95 PolarHBondContact O-N 3.46Å
92	S	86.6	Confident	83.9	Confident	45 Å²	45	52.4 Å²	52.4	32%	0.315	29%	0.291	S	S	.	.	H	α-helix	trans	-65.1	-42.5	175.8	74.6	0	0	0	0	111.9	I88 L89 A95 V96	I88-S92 VanDerWaalsContact O-CB 3.22Å; I88-S92 WeakPolarHBondContact O-CB 3.35Å; I88-S92 PolarHBondContact O-N 3.13Å; I88-S92 PolarHBondContact O-OG 2.99Å; L89-S92 PolarHBondContact O-N 3.45Å; L89-S92 PolarHBondContact O-OG 3.04Å; S92-A95 PolarHBondContact O-N 3.47Å; S92-V96 WeakPolarHBondContact O-CG2 3.27Å; S92-V96 PolarHBondContact O-N 2.85Å
93	M	87.7	Confident	84.8	Confident	99 Å²	99	55.2 Å²	55.2	49%	0.488	29%	0.294	S	S	.	.	H	α-helix	trans	-63.2	-43.4	174.7	-70	-178.4	73.1	0	0	111.1	L89 V90 A95 V96 L97	L89-M93 HydrophobicContact CG-SD 4.43Å; L89-M93 WeakPolarHBondContact O-CG 3.37Å; L89-M93 PolarHBondContact O-N 2.74Å; V90-M93 PolarHBondContact O-N 2.88Å; M93-A95 PolarHBondContact O-N 2.89Å; M93-V96 PolarHBondContact O-N 3.42Å; M93-L97 WeakPolarHBondContact O-CG 3.34Å; M93-L97 PolarHBondContact O-N 3.46Å
94	A	87.6	Confident	85.6	Confident	14 Å²	14	51.2 Å²	51.2	12%	0.116	27%	0.273	C	S	.	.	H	α-helix	trans	-60.8	-44.3	175.4	0	0	0	0	0	111.8	V90 S91 V96 L97 H98	V90-A94 WeakPolarHBondContact O-CB 3.21Å; V90-A94 PolarHBondContact O-N 2.86Å; S91-A94 PolarHBondContact O-N 3.47Å; A94-V96 PolarHBondContact O-N 3.35Å; A94-L97 PolarHBondContact O-N 2.93Å; A94-H98 PolarHBondContact O-CD2 3.48Å; A94-H98 PolarHBondContact O-N 3.05Å
95	A	87.7	Confident	86.3	Confident	12 Å²	12	50.9 Å²	50.9	10%	0.099	28%	0.275	C	S	.	.	H	α-helix	trans	-59	-46.2	177.1	0	0	0	0	0	111.9	I44 S91 S92 M93 L97 H98 I99	I44-A95 HydrophobicContact CD1-CB 3.96Å; S91-A95 WeakPolarHBondContact O-CB 3.35Å; S91-A95 PolarHBondContact O-N 3.46Å; S92-A95 PolarHBondContact O-N 3.47Å; M93-A95 PolarHBondContact O-N 2.89Å; A95-L97 VanDerWaalsContact C-N 3.33Å; A95-L97 PolarHBondContact O-N 2.96Å; A95-H98 PolarHBondContact O-N 2.92Å; A95-I99 VanDerWaalsContact O-CG1 3.3Å; A95-I99 WeakPolarHBondContact O-CG1 3.44Å; A95-I99 PolarHBondContact O-N 2.88Å
96	V	88.9	Confident	86.8	Confident	90 Å²	90	48.8 Å²	48.8	55%	0.545	27%	0.272	S	S	.	.	H	α-helix	trans	-60.3	-44	175.9	173.8	0	0	0	0	110.9	S92 M93 A94 H98 I99 V100	S92-V96 WeakPolarHBondContact O-CG2 3.27Å; S92-V96 PolarHBondContact O-N 2.85Å; M93-V96 PolarHBondContact O-N 3.42Å; A94-V96 PolarHBondContact O-N 3.35Å; V96-H98 PolarHBondContact O-N 2.92Å; V96-I99 PolarHBondContact O-N 3.3Å; V96-V100 WeakPolarHBondContact O-CG2 3.43Å; V96-V100 PolarHBondContact O-N 3.48Å
97	L	90.1	Very high	87.2	Confident	16 Å²	16	50.6 Å²	50.6	8%	0.084	28%	0.275	C	S	.	.	H	α-helix	trans	-61.8	-42.8	176.8	-71.3	174.9	0	0	0	112.1	M93 A94 A95 I99 V100 G101 Y116 F119	M93-L97 WeakPolarHBondContact O-CG 3.34Å; M93-L97 PolarHBondContact O-N 3.46Å; A94-L97 PolarHBondContact O-N 2.93Å; A95-L97 VanDerWaalsContact C-N 3.33Å; A95-L97 PolarHBondContact O-N 2.96Å; L97-I99 VanDerWaalsContact C-N 3.33Å; L97-I99 PolarHBondContact O-N 2.89Å; L97-V100 PolarHBondContact O-N 2.98Å; L97-G101 PolarHBondContact O-N 2.97Å; L97-Y116 WeakPolarHBondContact O-CD2 3.49Å; L97-Y116 WeakPolarHBondContact O-CE2 3.3Å; L97-F119 HydrophobicContact CD1-CB 4.41Å; L97-F119 HydrophobicContact CD2-CB 3.58Å; L97-F119 HydrophobicContact CD2-CD1 4.29Å; L97-F119 HydrophobicContact CD2-CG 4.1Å
98	H	89.2	Confident	87.5	Confident	13 Å²	13	54.9 Å²	54.9	6%	0.06	29%	0.29	C	S	.	.	H	α-helix	trans	-66.4	-34.7	177.4	-67.7	-52.6	0	0	0	112.6	L36 A37 A94 A95 V96 G101 L102 Y116	L36-H98 VanDerWaalsContact CB-CE1 3.48Å; L36-H98 WeakPolarHBondContact CB-CE1 3.49Å; L36-H98 VanDerWaalsContact CD1-CE1 3.49Å; L36-H98 WeakPolarHBondContact CD1-CE1 3.14Å; A37-H98 HydrophobicContact CB-CB 3.86Å; A94-H98 PolarHBondContact O-CD2 3.48Å; A94-H98 PolarHBondContact O-N 3.05Å; A95-H98 PolarHBondContact O-N 2.92Å; V96-H98 PolarHBondContact O-N 2.92Å; H98-G101 PolarHBondContact O-N 3.24Å; H98-L102 WeakPolarHBondContact O-CB 3.37Å; H98-L102 PolarHBondContact O-N 2.9Å; H98-Y116 PolarHBondContact ND1-OH 2.81Å
99	I	87.7	Confident	87.8	Confident	79 Å²	79	55.5 Å²	55.5	41%	0.405	30%	0.297	S	S	.	.	H	α-helix	trans	-65.1	-43.1	172.5	-68.7	165.7	0	0	0	110.7	A95 V96 L97 G101 L102 F103	A95-I99 VanDerWaalsContact O-CG1 3.3Å; A95-I99 WeakPolarHBondContact O-CG1 3.44Å; A95-I99 PolarHBondContact O-N 2.88Å; V96-I99 PolarHBondContact O-N 3.3Å; L97-I99 VanDerWaalsContact C-N 3.33Å; L97-I99 PolarHBondContact O-N 2.89Å; I99-G101 VanDerWaalsContact C-N 3.34Å; I99-G101 PolarHBondContact O-N 3.49Å; I99-L102 WeakPolarHBondContact O-CB 3.17Å; I99-L102 PolarHBondContact O-N 2.88Å; I99-F103 HydrophobicContact CG2-CD2 3.6Å; I99-F103 HydrophobicContact CG2-CE2 3.38Å; I99-F103 WeakPolarHBondContact O-CD2 3.34Å; I99-F103 PolarHBondContact O-N 2.87Å
100	V	89.5	Confident	87.8	Confident	40 Å²	40	56.8 Å²	56.8	24%	0.242	30%	0.3	C	S	.	.	H	α-helix	trans	-62.7	-41.8	174.7	173.5	0	0	0	0	111.2	V96 L97 L102 F103 G104 F115	V96-V100 WeakPolarHBondContact O-CG2 3.43Å; V96-V100 PolarHBondContact O-N 3.48Å; L97-V100 PolarHBondContact O-N 2.98Å; V100-L102 VanDerWaalsContact C-N 3.35Å; V100-F103 PolarHBondContact O-N 2.91Å; V100-G104 PolarHBondContact O-N 3.36Å; V100-F115 HydrophobicContact CG1-CD1 4.06Å
101	G	88.8	Confident	88	Confident	1 Å²	1	61.7 Å²	61.7	1%	0.01	32%	0.317	C	S	.	.	H	α-helix	trans	-61.9	-41.4	174.6	0	0	0	0	0	112.6	L97 H98 I99 G104 A105	L97-G101 PolarHBondContact O-N 2.97Å; H98-G101 PolarHBondContact O-N 3.24Å; I99-G101 VanDerWaalsContact C-N 3.34Å; I99-G101 PolarHBondContact O-N 3.49Å; G101-G104 PolarHBondContact O-N 3.26Å; G101-A105 WeakPolarHBondContact O-CB 2.97Å; G101-A105 PolarHBondContact O-N 3.4Å
102	L	88.3	Confident	88.1	Confident	42 Å²	42	61.5 Å²	61.5	22%	0.22	32%	0.317	C	S	.	.	H	α-helix	trans	-62.5	-47.1	174.7	-179.3	63.2	0	0	0	111.3	L30 I34 H98 I99 V100 G104 A105 I106	L30-L102 HydrophobicContact CG-CD1 4.33Å; I34-L102 HydrophobicContact CD1-CD1 4.22Å; I34-L102 HydrophobicContact CG1-CD1 3.74Å; H98-L102 WeakPolarHBondContact O-CB 3.37Å; H98-L102 PolarHBondContact O-N 2.9Å; I99-L102 WeakPolarHBondContact O-CB 3.17Å; I99-L102 PolarHBondContact O-N 2.88Å; V100-L102 VanDerWaalsContact C-N 3.35Å; L102-G104 VanDerWaalsContact C-N 3.34Å; L102-G104 PolarHBondContact O-N 2.57Å; L102-A105 PolarHBondContact O-N 3.42Å; L102-I106 HydrophobicContact CD1-CD1 3.83Å; L102-I106 HydrophobicContact CD1-CG1 4.24Å; L102-I106 HydrophobicContact CG-CD1 3.81Å; L102-I106 WeakPolarHBondContact O-CG1 3.36Å; L102-I106 PolarHBondContact O-N 2.86Å
103	F	88.6	Confident	88.1	Confident	108 Å²	108	62 Å²	62	47%	0.474	32%	0.315	S	S	.	.	H	α-helix	trans	-62.5	-40.2	175.9	-79.9	-56.5	0	0	0	112.6	I99 V100 A105 I106 F107	I99-F103 HydrophobicContact CG2-CD2 3.6Å; I99-F103 HydrophobicContact CG2-CE2 3.38Å; I99-F103 WeakPolarHBondContact O-CD2 3.34Å; I99-F103 PolarHBondContact O-N 2.87Å; V100-F103 PolarHBondContact O-N 2.91Å; F103-A105 VanDerWaalsContact C-N 3.32Å; F103-A105 PolarHBondContact O-N 3.28Å; F103-I106 PolarHBondContact O-N 3.36Å; F103-F107 HydrophobicContact CB-CD2 4.37Å; F103-F107 AromaticContact CD1-CD2 3.9Å; F103-F107 HydrophobicContact CD1-CD2 3.9Å; F103-F107 AromaticContact CD1-CE2 3.45Å; F103-F107 HydrophobicContact CD1-CE2 3.45Å; F103-F107 VanDerWaalsContact CD1-CE2 3.45Å; F103-F107 AromaticContact CE1-CE2 3.94Å; F103-F107 HydrophobicContact CE1-CE2 3.94Å; F103-F107 HydrophobicContact CG-CE2 4.49Å; F103-F107 WeakPolarHBondContact O-CB 3.24Å; F103-F107 WeakPolarHBondContact O-CD2 3.28Å; F103-F107 PolarHBondContact O-N 3Å
104	G	88.1	Confident	88.2	Confident	0 Å²	0	65.6 Å²	65.6	0%	0	32%	0.324	C	S	.	.	H	α-helix	trans	-62.3	-38.6	174.4	0	0	0	0	0	112.9	V100 G101 L102 E108 S109	V100-G104 PolarHBondContact O-N 3.36Å; G101-G104 PolarHBondContact O-N 3.26Å; L102-G104 VanDerWaalsContact C-N 3.34Å; L102-G104 PolarHBondContact O-N 2.57Å; G104-E108 WeakPolarHBondContact O-CA 3.25Å; G104-E108 PolarHBondContact O-N 3.46Å; G104-S109 PolarHBondContact O-N 3.44Å
105	A	86	Confident	88.4	Confident	15 Å²	15	68.7 Å²	68.7	12%	0.124	34%	0.335	C	S	.	.	H	α-helix	trans	-71.3	-41	177.1	0	0	0	0	0	112.9	G101 L102 F103	G101-A105 WeakPolarHBondContact O-CB 2.97Å; G101-A105 PolarHBondContact O-N 3.4Å; L102-A105 PolarHBondContact O-N 3.42Å; F103-A105 VanDerWaalsContact C-N 3.32Å; F103-A105 PolarHBondContact O-N 3.28Å
106	I	88	Confident	88.5	Confident	92 Å²	92	68.8 Å²	68.8	47%	0.472	33%	0.333	S	S	.	.	H	α-helix	trans	-71.4	-46.9	-178.9	-69	170.7	0	0	0	111.7	L30 L102 F103 E108	L30-I106 HydrophobicContact CD1-CG1 4.26Å; L102-I106 HydrophobicContact CD1-CD1 3.83Å; L102-I106 HydrophobicContact CD1-CG1 4.24Å; L102-I106 HydrophobicContact CG-CD1 3.81Å; L102-I106 WeakPolarHBondContact O-CG1 3.36Å; L102-I106 PolarHBondContact O-N 2.86Å; F103-I106 PolarHBondContact O-N 3.36Å; I106-E108 VanDerWaalsContact C-N 3.33Å
107	F	89.4	Confident	88.5	Confident	149 Å²	149	68 Å²	68	65%	0.654	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.8	3.6	-175.1	-65.9	-60.4	0	0	0	113.7	F103 S109	F103-F107 HydrophobicContact CB-CD2 4.37Å; F103-F107 AromaticContact CD1-CD2 3.9Å; F103-F107 HydrophobicContact CD1-CD2 3.9Å; F103-F107 AromaticContact CD1-CE2 3.45Å; F103-F107 HydrophobicContact CD1-CE2 3.45Å; F103-F107 VanDerWaalsContact CD1-CE2 3.45Å; F103-F107 AromaticContact CE1-CE2 3.94Å; F103-F107 HydrophobicContact CE1-CE2 3.94Å; F103-F107 HydrophobicContact CG-CE2 4.49Å; F103-F107 WeakPolarHBondContact O-CB 3.24Å; F103-F107 WeakPolarHBondContact O-CD2 3.28Å; F103-F107 PolarHBondContact O-N 3Å; F107-S109 PolarHBondContact O-N 2.85Å; F107-S109 VanDerWaalsContact O-N 3.07Å
108	E	85.3	Confident	88.5	Confident	123 Å²	123	72.3 Å²	72.3	58%	0.575	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.5	32.5	-175.2	-50.8	-159.5	162.1	0	0	113.1	K26 G104 I106 E110	K26-E108 IonicContact NZ-OE1 4Å; K26-E108 PolarHBondContact NZ-OE1 3.4Å; K26-E108 IonicContact NZ-OE2 3.74Å; K26-E108 PolarHBondContact NZ-OE2 3.35Å; G104-E108 WeakPolarHBondContact O-CA 3.25Å; G104-E108 PolarHBondContact O-N 3.46Å; I106-E108 VanDerWaalsContact C-N 3.33Å; E108-E110 PolarHBondContact O-N 3.41Å
109	S	89	Confident	88.6	Confident	47 Å²	47	75.9 Å²	75.9	33%	0.329	37%	0.369	S	S	.	.			trans	-77.1	107.2	-178.6	178.2	0	0	0	0	109.8	G104 F107 F111 A112 L113	G104-S109 PolarHBondContact O-N 3.44Å; F107-S109 PolarHBondContact O-N 2.85Å; F107-S109 VanDerWaalsContact O-N 3.07Å; S109-F111 PolarHBondContact O-N 2.71Å; S109-A112 PolarHBondContact O-N 2.93Å; S109-A112 VanDerWaalsContact O-N 3.16Å; S109-A112 PolarHBondContact OG-N 3.43Å; S109-L113 PolarHBondContact O-N 3.19Å
110	E	86.3	Confident	88.6	Confident	128 Å²	128	73.9 Å²	73.9	60%	0.598	36%	0.359	S	S	*	.	H	α-helix	trans	-54.1	-39.4	175.5	-71.6	-165.9	-161.5	0	0	112.1	E108 R114	E108-E110 PolarHBondContact O-N 3.41Å; E110-R114 WeakPolarHBondContact O-CB 3.45Å; E110-R114 WeakPolarHBondContact O-CG 3.21Å; E110-R114 PolarHBondContact O-N 3.33Å; E110-R114 IonicContact OE2-CZ 3.64Å; E110-R114 IonicContact OE2-NE 3.91Å; E110-R114 IonicContact OE2-NH2 2.79Å; E110-R114 PolarHBondContact OE2-NH2 3.45Å
111	F	88.9	Confident	88.6	Confident	162 Å²	162	79.2 Å²	79.2	71%	0.711	38%	0.379	S	S	*	.	H	α-helix	trans	-62.4	-48.5	179	179.8	-97.2	0	0	0	111.4	S109 L113 R114 F115	S109-F111 PolarHBondContact O-N 2.71Å; F111-L113 PolarHBondContact O-N 2.83Å; F111-R114 PolarHBondContact O-N 3.43Å; F111-F115 VanDerWaalsContact O-CB 3.28Å; F111-F115 WeakPolarHBondContact O-CB 3.39Å; F111-F115 PolarHBondContact O-N 2.97Å
112	A	89.2	Confident	88.6	Confident	16 Å²	16	82.2 Å²	82.2	13%	0.132	40%	0.397	C	S	.	.	H	α-helix	trans	-65.7	-39.1	-179.6	0	0	0	0	0	112.3	S109 F115 Y116	S109-A112 PolarHBondContact O-N 2.93Å; S109-A112 VanDerWaalsContact O-N 3.16Å; S109-A112 PolarHBondContact OG-N 3.43Å; A112-F115 PolarHBondContact O-N 2.72Å; A112-Y116 VanDerWaalsContact O-CB 3.27Å; A112-Y116 WeakPolarHBondContact O-CB 3.21Å; A112-Y116 PolarHBondContact O-N 2.94Å
113	L	86.5	Confident	88.6	Confident	55 Å²	55	82.8 Å²	82.8	29%	0.288	40%	0.398	S	S	.	.	H	α-helix	trans	-68.1	-41.5	176.7	-73.8	171	0	0	0	112.4	L29 S109 F111 Y116 S117	L29-L113 HydrophobicContact CD2-CD2 3.7Å; S109-L113 PolarHBondContact O-N 3.19Å; F111-L113 PolarHBondContact O-N 2.83Å; L113-Y116 PolarHBondContact O-N 2.85Å; L113-S117 WeakPolarHBondContact O-CB 3.43Å; L113-S117 PolarHBondContact O-N 3.44Å
114	R	89.8	Confident	88.6	Confident	176 Å²	176	82.6 Å²	82.6	66%	0.664	40%	0.401	S	S	*	.	H	α-helix	trans	-64	-43.1	174.4	-72.5	177.7	-166.1	-165.7	9.3	111.3	E110 F111 S117 L118	E110-R114 WeakPolarHBondContact O-CB 3.45Å; E110-R114 WeakPolarHBondContact O-CG 3.21Å; E110-R114 PolarHBondContact O-N 3.33Å; E110-R114 IonicContact OE2-CZ 3.64Å; E110-R114 IonicContact OE2-NE 3.91Å; E110-R114 IonicContact OE2-NH2 2.79Å; E110-R114 PolarHBondContact OE2-NH2 3.45Å; F111-R114 PolarHBondContact O-N 3.43Å; R114-S117 PolarHBondContact O-N 2.86Å; R114-L118 WeakPolarHBondContact O-CB 3.25Å; R114-L118 PolarHBondContact O-N 3.45Å
115	F	90.2	Very high	88.6	Confident	78 Å²	78	84.1 Å²	84.1	34%	0.342	41%	0.414	S	S	.	.	H	α-helix	trans	-60.6	-52.3	174.9	-172.4	-87	0	0	0	110.7	V100 F111 A112 S117 L118 F119	V100-F115 HydrophobicContact CG1-CD1 4.06Å; F111-F115 VanDerWaalsContact O-CB 3.28Å; F111-F115 WeakPolarHBondContact O-CB 3.39Å; F111-F115 PolarHBondContact O-N 2.97Å; A112-F115 PolarHBondContact O-N 2.72Å; F115-S117 VanDerWaalsContact C-N 3.35Å; F115-S117 PolarHBondContact O-N 3.25Å; F115-L118 PolarHBondContact O-N 3.4Å; F115-F119 AromaticContact CD1-CD2 3.7Å; F115-F119 HydrophobicContact CD1-CD2 3.7Å; F115-F119 HydrophobicContact CD1-CE2 4.08Å; F115-F119 HydrophobicContact CD1-CG 4.41Å; F115-F119 AromaticContact CD2-CD2 3.89Å; F115-F119 HydrophobicContact CD2-CD2 3.89Å; F115-F119 AromaticContact CD2-CE2 3.54Å; F115-F119 HydrophobicContact CD2-CE2 3.54Å; F115-F119 AromaticContact CE1-CD2 3.52Å; F115-F119 HydrophobicContact CE1-CD2 3.52Å; F115-F119 AromaticContact CE1-CE2 3.65Å; F115-F119 HydrophobicContact CE1-CE2 3.65Å; F115-F119 HydrophobicContact CE1-CG 4.04Å; F115-F119 HydrophobicContact CE1-CZ 4.21Å; F115-F119 AromaticContact CE2-CD2 3.74Å; F115-F119 HydrophobicContact CE2-CD2 3.74Å; F115-F119 AromaticContact CE2-CE2 3.06Å; F115-F119 HydrophobicContact CE2-CE2 3.06Å; F115-F119 AromaticContact CE2-CZ 3.69Å; F115-F119 HydrophobicContact CE2-CZ 3.69Å; F115-F119 AromaticContact CG-CD2 3.88Å; F115-F119 HydrophobicContact CG-CD2 3.88Å; F115-F119 HydrophobicContact CG-CE2 4.03Å; F115-F119 AromaticContact CZ-CD2 3.55Å; F115-F119 HydrophobicContact CZ-CD2 3.55Å; F115-F119 HydrophobicContact CZ-CE1 4.21Å; F115-F119 AromaticContact CZ-CE2 3.12Å; F115-F119 HydrophobicContact CZ-CE2 3.12Å; F115-F119 HydrophobicContact CZ-CG 4.27Å; F115-F119 AromaticContact CZ-CZ 3.48Å; F115-F119 HydrophobicContact CZ-CZ 3.48Å; F115-F119 VanDerWaalsContact CZ-CZ 3.48Å; F115-F119 WeakPolarHBondContact O-CB 3.27Å; F115-F119 VanDerWaalsContact O-CD2 3.29Å; F115-F119 WeakPolarHBondContact O-CD2 3.25Å; F115-F119 PolarHBondContact O-N 2.9Å
116	Y	90.7	Very high	88.8	Confident	15 Å²	15	86.9 Å²	86.9	6%	0.059	43%	0.43	C	S	.	.	H	α-helix	trans	-54.8	-48.5	177	175.6	-109.9	0	0	0	112.2	L29 T33 L97 H98 A112 L113 L118 F119 I120	L29-Y116 HydrophobicContact CD1-CE1 4.41Å; T33-Y116 HydrophobicContact CG2-CE1 4.2Å; L97-Y116 WeakPolarHBondContact O-CD2 3.49Å; L97-Y116 WeakPolarHBondContact O-CE2 3.3Å; H98-Y116 PolarHBondContact ND1-OH 2.81Å; A112-Y116 VanDerWaalsContact O-CB 3.27Å; A112-Y116 WeakPolarHBondContact O-CB 3.21Å; A112-Y116 PolarHBondContact O-N 2.94Å; L113-Y116 PolarHBondContact O-N 2.85Å; Y116-L118 PolarHBondContact O-N 3.35Å; Y116-F119 PolarHBondContact O-N 3.47Å; Y116-I120 HydrophobicContact CE2-CB 4.5Å; Y116-I120 WeakPolarHBondContact O-CB 3.25Å; Y116-I120 VanDerWaalsContact O-CG2 3.28Å; Y116-I120 WeakPolarHBondContact O-CG2 3.48Å; Y116-I120 PolarHBondContact O-N 2.99Å
117	S	88.4	Confident	88.7	Confident	73 Å²	73	84.6 Å²	84.6	51%	0.51	42%	0.424	S	S	.	.	H	α-helix	trans	-62.8	-41.7	-180	-179	0	0	0	0	112.8	L113 R114 F115 I120 F121	L113-S117 WeakPolarHBondContact O-CB 3.43Å; L113-S117 PolarHBondContact O-N 3.44Å; R114-S117 PolarHBondContact O-N 2.86Å; F115-S117 VanDerWaalsContact C-N 3.35Å; F115-S117 PolarHBondContact O-N 3.25Å; S117-I120 WeakPolarHBondContact O-CG2 3.35Å; S117-F121 VanDerWaalsContact O-CB 3.28Å; S117-F121 WeakPolarHBondContact O-CB 3.39Å; S117-F121 PolarHBondContact O-N 3.3Å
118	L	90.7	Very high	88.6	Confident	106 Å²	106	80.4 Å²	80.4	56%	0.555	41%	0.413	S	S	*	.	H	α-helix	trans	-68.4	-44.1	178.8	-176.4	146.4	0	0	0	111.3	R114 F115 Y116 T122	R114-L118 WeakPolarHBondContact O-CB 3.25Å; R114-L118 PolarHBondContact O-N 3.45Å; F115-L118 PolarHBondContact O-N 3.4Å; Y116-L118 PolarHBondContact O-N 3.35Å; L118-T122 VanDerWaalsContact O-CB 3.31Å; L118-T122 WeakPolarHBondContact O-CB 3.38Å; L118-T122 PolarHBondContact O-N 3.36Å; L118-T122 PolarHBondContact O-OG1 3.45Å
119	F	90.8	Very high	88.9	Confident	89 Å²	89	79.5 Å²	79.5	39%	0.39	41%	0.411	S	S	.	.	H	α-helix	trans	-70.6	-42.2	-178.9	-86.9	-93.8	0	0	0	112.3	L97 F115 Y116 F121 T122 F123	L97-F119 HydrophobicContact CD1-CB 4.41Å; L97-F119 HydrophobicContact CD2-CB 3.58Å; L97-F119 HydrophobicContact CD2-CD1 4.29Å; L97-F119 HydrophobicContact CD2-CG 4.1Å; F115-F119 AromaticContact CD1-CD2 3.7Å; F115-F119 HydrophobicContact CD1-CD2 3.7Å; F115-F119 HydrophobicContact CD1-CE2 4.08Å; F115-F119 HydrophobicContact CD1-CG 4.41Å; F115-F119 AromaticContact CD2-CD2 3.89Å; F115-F119 HydrophobicContact CD2-CD2 3.89Å; F115-F119 AromaticContact CD2-CE2 3.54Å; F115-F119 HydrophobicContact CD2-CE2 3.54Å; F115-F119 AromaticContact CE1-CD2 3.52Å; F115-F119 HydrophobicContact CE1-CD2 3.52Å; F115-F119 AromaticContact CE1-CE2 3.65Å; F115-F119 HydrophobicContact CE1-CE2 3.65Å; F115-F119 HydrophobicContact CE1-CG 4.04Å; F115-F119 HydrophobicContact CE1-CZ 4.21Å; F115-F119 AromaticContact CE2-CD2 3.74Å; F115-F119 HydrophobicContact CE2-CD2 3.74Å; F115-F119 AromaticContact CE2-CE2 3.06Å; F115-F119 HydrophobicContact CE2-CE2 3.06Å; F115-F119 AromaticContact CE2-CZ 3.69Å; F115-F119 HydrophobicContact CE2-CZ 3.69Å; F115-F119 AromaticContact CG-CD2 3.88Å; F115-F119 HydrophobicContact CG-CD2 3.88Å; F115-F119 HydrophobicContact CG-CE2 4.03Å; F115-F119 AromaticContact CZ-CD2 3.55Å; F115-F119 HydrophobicContact CZ-CD2 3.55Å; F115-F119 HydrophobicContact CZ-CE1 4.21Å; F115-F119 AromaticContact CZ-CE2 3.12Å; F115-F119 HydrophobicContact CZ-CE2 3.12Å; F115-F119 HydrophobicContact CZ-CG 4.27Å; F115-F119 AromaticContact CZ-CZ 3.48Å; F115-F119 HydrophobicContact CZ-CZ 3.48Å; F115-F119 VanDerWaalsContact CZ-CZ 3.48Å; F115-F119 WeakPolarHBondContact O-CB 3.27Å; F115-F119 VanDerWaalsContact O-CD2 3.29Å; F115-F119 WeakPolarHBondContact O-CD2 3.25Å; F115-F119 PolarHBondContact O-N 2.9Å; Y116-F119 PolarHBondContact O-N 3.47Å; F119-F121 VanDerWaalsContact C-N 3.33Å; F119-F121 PolarHBondContact O-N 2.92Å; F119-T122 PolarHBondContact O-N 2.9Å; F119-F123 WeakPolarHBondContact O-CB 3.34Å; F119-F123 PolarHBondContact O-N 3.41Å
120	I	88.1	Confident	88.8	Confident	36 Å²	36	82.1 Å²	82.1	19%	0.185	42%	0.421	C	S	.	.	H	α-helix	trans	-64.8	-40	177.8	-163.2	64.8	0	0	0	111	Y116 S117 L124	Y116-I120 HydrophobicContact CE2-CB 4.5Å; Y116-I120 WeakPolarHBondContact O-CB 3.25Å; Y116-I120 VanDerWaalsContact O-CG2 3.28Å; Y116-I120 WeakPolarHBondContact O-CG2 3.48Å; Y116-I120 PolarHBondContact O-N 2.99Å; S117-I120 WeakPolarHBondContact O-CG2 3.35Å; I120-L124 HydrophobicContact CG1-CD1 4.06Å; I120-L124 HydrophobicContact CG1-CG 4.44Å; I120-L124 WeakPolarHBondContact O-CB 3.3Å; I120-L124 WeakPolarHBondContact O-CG 3.27Å; I120-L124 PolarHBondContact O-N 3.01Å
121	F	88.8	Confident	88.7	Confident	152 Å²	152	78.9 Å²	78.9	67%	0.667	42%	0.416	S	S	*	.	H	α-helix	trans	-65	-47.6	176.5	-177.1	-96.3	0	0	0	111.5	S117 F119 L124 A125	S117-F121 VanDerWaalsContact O-CB 3.28Å; S117-F121 WeakPolarHBondContact O-CB 3.39Å; S117-F121 PolarHBondContact O-N 3.3Å; F119-F121 VanDerWaalsContact C-N 3.33Å; F119-F121 PolarHBondContact O-N 2.92Å; F121-L124 PolarHBondContact O-N 3.4Å; F121-A125 VanDerWaalsContact O-CB 3.23Å; F121-A125 WeakPolarHBondContact O-CB 3.45Å; F121-A125 PolarHBondContact O-N 2.88Å
122	T	90.1	Very high	88.6	Confident	65 Å²	65	75.3 Å²	75.3	40%	0.399	41%	0.407	S	S	.	.	H	α-helix	trans	-64.1	-43.3	178.8	-54.6	0	0	0	0	111.1	L118 F119 A125 V126	L118-T122 VanDerWaalsContact O-CB 3.31Å; L118-T122 WeakPolarHBondContact O-CB 3.38Å; L118-T122 PolarHBondContact O-N 3.36Å; L118-T122 PolarHBondContact O-OG1 3.45Å; F119-T122 PolarHBondContact O-N 2.9Å; T122-A125 PolarHBondContact O-N 3.48Å; T122-V126 HydrophobicContact CG2-CG2 4.13Å; T122-V126 VanDerWaalsContact O-CB 3.31Å; T122-V126 WeakPolarHBondContact O-CB 3.48Å; T122-V126 VanDerWaalsContact O-CG2 3.23Å; T122-V126 WeakPolarHBondContact O-CG2 3.26Å; T122-V126 PolarHBondContact O-N 3.45Å
123	F	88	Confident	88.5	Confident	53 Å²	53	77.5 Å²	77.5	23%	0.232	42%	0.422	C	S	.	.	H	α-helix	trans	-62.1	-47.7	178.3	-179.9	-96.6	0	0	0	111.4	V90 F119 A127	V90-F123 HydrophobicContact CG1-CE2 4.47Å; V90-F123 HydrophobicContact CG1-CZ 3.73Å; F119-F123 WeakPolarHBondContact O-CB 3.34Å; F119-F123 PolarHBondContact O-N 3.41Å; F123-A127 WeakPolarHBondContact O-CB 3.38Å; F123-A127 PolarHBondContact O-N 3.13Å
124	L	87.4	Confident	88.3	Confident	104 Å²	104	82.3 Å²	82.3	55%	0.545	44%	0.436	S	S	.	.	H	α-helix	trans	-65.4	-40.3	176.9	-69.7	173.6	0	0	0	112	I120 F121 S128	I120-L124 HydrophobicContact CG1-CD1 4.06Å; I120-L124 HydrophobicContact CG1-CG 4.44Å; I120-L124 WeakPolarHBondContact O-CB 3.3Å; I120-L124 WeakPolarHBondContact O-CG 3.27Å; I120-L124 PolarHBondContact O-N 3.01Å; F121-L124 PolarHBondContact O-N 3.4Å; L124-S128 WeakPolarHBondContact O-CB 3.32Å; L124-S128 PolarHBondContact O-N 2.89Å; L124-S128 PolarHBondContact O-OG 3.41Å
125	A	89	Confident	87.9	Confident	33 Å²	33	79.4 Å²	79.4	27%	0.273	43%	0.433	S	S	.	.	H	α-helix	trans	-64.6	-49.6	177.3	0	0	0	0	0	111.5	F121 T122 S128 I129	F121-A125 VanDerWaalsContact O-CB 3.23Å; F121-A125 WeakPolarHBondContact O-CB 3.45Å; F121-A125 PolarHBondContact O-N 2.88Å; T122-A125 PolarHBondContact O-N 3.48Å; A125-S128 PolarHBondContact O-N 3.02Å; A125-S128 PolarHBondContact O-OG 3.32Å; A125-I129 WeakPolarHBondContact O-CB 3.33Å; A125-I129 WeakPolarHBondContact O-CD1 3.5Å; A125-I129 WeakPolarHBondContact O-CG1 3.38Å; A125-I129 PolarHBondContact O-N 3.37Å
126	V	90	Very high	87.6	Confident	73 Å²	73	81.3 Å²	81.3	44%	0.442	45%	0.451	S	S	.	.	H	α-helix	trans	-65.6	-46.5	179	172.9	0	0	0	0	110.9	T122 S128 I129 I130	T122-V126 HydrophobicContact CG2-CG2 4.13Å; T122-V126 VanDerWaalsContact O-CB 3.31Å; T122-V126 WeakPolarHBondContact O-CB 3.48Å; T122-V126 VanDerWaalsContact O-CG2 3.23Å; T122-V126 WeakPolarHBondContact O-CG2 3.26Å; T122-V126 PolarHBondContact O-N 3.45Å; V126-S128 VanDerWaalsContact C-N 3.35Å; V126-S128 PolarHBondContact O-N 3.38Å; V126-I129 PolarHBondContact O-N 3.25Å; V126-I130 HydrophobicContact CG1-CD1 3.57Å; V126-I130 HydrophobicContact CG1-CG1 4.3Å; V126-I130 WeakPolarHBondContact O-CB 3.33Å; V126-I130 VanDerWaalsContact O-CG1 3.25Å; V126-I130 WeakPolarHBondContact O-CG1 3.33Å; V126-I130 PolarHBondContact O-N 2.92Å
127	A	86.1	Confident	87.3	Confident	43 Å²	43	86.4 Å²	86.4	36%	0.355	48%	0.483	S	S	.	.	H	α-helix	trans	-62.1	-41.3	179	0	0	0	0	0	112	F123 A131	F123-A127 WeakPolarHBondContact O-CB 3.38Å; F123-A127 PolarHBondContact O-N 3.13Å; A127-A131 WeakPolarHBondContact O-CB 3.33Å; A127-A131 PolarHBondContact O-N 2.76Å
128	S	88.1	Confident	86.9	Confident	61 Å²	61	83.2 Å²	83.2	43%	0.427	46%	0.462	S	S	.	.	H	α-helix	trans	-68	-41.6	177.2	58.6	0	0	0	0	112.5	L124 A125 V126 A131 T132	L124-S128 WeakPolarHBondContact O-CB 3.32Å; L124-S128 PolarHBondContact O-N 2.89Å; L124-S128 PolarHBondContact O-OG 3.41Å; A125-S128 PolarHBondContact O-N 3.02Å; A125-S128 PolarHBondContact O-OG 3.32Å; V126-S128 VanDerWaalsContact C-N 3.35Å; V126-S128 PolarHBondContact O-N 3.38Å; S128-A131 PolarHBondContact O-N 3.48Å; S128-T132 WeakPolarHBondContact O-CB 3.24Å; S128-T132 VanDerWaalsContact O-CG2 3.26Å; S128-T132 WeakPolarHBondContact O-CG2 3.42Å; S128-T132 PolarHBondContact O-N 3.39Å; S128-T132 PolarHBondContact O-OG1 3.33Å
129	I	89.9	Confident	86.4	Confident	104 Å²	104	84 Å²	84	53%	0.533	46%	0.462	S	S	.	.	H	α-helix	trans	-62.8	-45.9	175.4	-68.3	165.3	0	0	0	110.5	A125 V126 T132 S133	A125-I129 WeakPolarHBondContact O-CB 3.33Å; A125-I129 WeakPolarHBondContact O-CD1 3.5Å; A125-I129 WeakPolarHBondContact O-CG1 3.38Å; A125-I129 PolarHBondContact O-N 3.37Å; V126-I129 PolarHBondContact O-N 3.25Å; I129-T132 PolarHBondContact O-OG1 3.18Å; I129-T132 VanDerWaalsContact O-OG1 3.11Å; I129-S133 WeakPolarHBondContact O-CB 3.42Å; I129-S133 PolarHBondContact O-N 3.05Å; I129-S133 PolarHBondContact O-OG 3.01Å
130	I	87.9	Confident	85.7	Confident	103 Å²	103	87.9 Å²	87.9	53%	0.528	48%	0.482	S	S	.	.	H	α-helix	trans	-63.2	-49	178.3	-68.1	170.9	0	0	0	110.2	V126 T132 S133 W134	V126-I130 HydrophobicContact CG1-CD1 3.57Å; V126-I130 HydrophobicContact CG1-CG1 4.3Å; V126-I130 WeakPolarHBondContact O-CB 3.33Å; V126-I130 VanDerWaalsContact O-CG1 3.25Å; V126-I130 WeakPolarHBondContact O-CG1 3.33Å; V126-I130 PolarHBondContact O-N 2.92Å; I130-T132 PolarHBondContact O-N 3.48Å; I130-S133 PolarHBondContact O-N 3.35Å; I130-W134 WeakPolarHBondContact O-CB 3.33Å; I130-W134 PolarHBondContact O-N 2.82Å
131	A	83.5	Confident	84.8	Confident	60 Å²	60	95 Å²	95	50%	0.496	51%	0.506	S	S	.	.	H	α-helix	trans	-62.8	-44.6	-178	0	0	0	0	0	112.3	A127 S128 W134 L135	A127-A131 WeakPolarHBondContact O-CB 3.33Å; A127-A131 PolarHBondContact O-N 2.76Å; S128-A131 PolarHBondContact O-N 3.48Å; A131-W134 PolarHBondContact O-N 2.85Å; A131-L135 WeakPolarHBondContact O-CB 3.27Å; A131-L135 PolarHBondContact O-N 2.89Å
132	T	86.4	Confident	83.9	Confident	86 Å²	86	89.8 Å²	89.8	53%	0.528	49%	0.487	S	S	.	.	H	α-helix	trans	-67.4	-42.9	178.2	51.9	0	0	0	0	111.9	S128 I129 I130 W134 L135 V136	S128-T132 WeakPolarHBondContact O-CB 3.24Å; S128-T132 VanDerWaalsContact O-CG2 3.26Å; S128-T132 WeakPolarHBondContact O-CG2 3.42Å; S128-T132 PolarHBondContact O-N 3.39Å; S128-T132 PolarHBondContact O-OG1 3.33Å; I129-T132 PolarHBondContact O-OG1 3.18Å; I129-T132 VanDerWaalsContact O-OG1 3.11Å; I130-T132 PolarHBondContact O-N 3.48Å; T132-W134 VanDerWaalsContact C-N 3.34Å; T132-W134 PolarHBondContact O-N 3Å; T132-L135 PolarHBondContact O-N 3.31Å; T132-V136 WeakPolarHBondContact O-CG2 3.43Å; T132-V136 PolarHBondContact O-N 3.16Å; T132-V136 VanDerWaalsContact O-N 3.17Å
133	S	87	Confident	83	Confident	63 Å²	63	90.9 Å²	90.9	44%	0.441	49%	0.489	S	S	.	.	H	α-helix	trans	-63.9	-41.4	176.3	-56.4	0	0	0	0	111.5	I129 I130 V136 V137	I129-S133 WeakPolarHBondContact O-CB 3.42Å; I129-S133 PolarHBondContact O-N 3.05Å; I129-S133 PolarHBondContact O-OG 3.01Å; I130-S133 PolarHBondContact O-N 3.35Å; S133-V136 PolarHBondContact O-N 3.03Å; S133-V137 WeakPolarHBondContact O-CG2 3.4Å; S133-V137 PolarHBondContact O-N 3.49Å; S133-V137 VanDerWaalsContact O-N 3.11Å
134	W	84	Confident	82.3	Confident	156 Å²	156	95.2 Å²	95.2	59%	0.591	51%	0.509	S	S	*	.	H	α-helix	trans	-63.4	-46	177.1	-173.5	-88.4	0	0	0	111.6	I130 A131 T132 V136 V137 A138 T142	I130-W134 WeakPolarHBondContact O-CB 3.33Å; I130-W134 PolarHBondContact O-N 2.82Å; A131-W134 PolarHBondContact O-N 2.85Å; T132-W134 VanDerWaalsContact C-N 3.34Å; T132-W134 PolarHBondContact O-N 3Å; W134-V136 VanDerWaalsContact C-N 3.27Å; W134-V136 PolarHBondContact O-N 3.44Å; W134-V137 PolarHBondContact O-N 3.36Å; W134-A138 HydrophobicContact CD2-CB 4.15Å; W134-A138 HydrophobicContact CG-CB 4.44Å; W134-A138 HydrophobicContact CZ2-CB 4.09Å; W134-A138 WeakPolarHBondContact O-CA 3.49Å; W134-A138 WeakPolarHBondContact O-CB 3.47Å; W134-A138 PolarHBondContact O-N 2.77Å; W134-T142 PolarHBondContact NE1-OG1 2.99Å
135	L	80.8	Confident	81.3	Confident	114 Å²	114	92.7 Å²	92.7	60%	0.597	49%	0.494	S	S	*	.	H	α-helix	trans	-61.7	-35.8	-179.3	-169.6	136.4	0	0	0	112	A131 T132 E139	A131-L135 WeakPolarHBondContact O-CB 3.27Å; A131-L135 PolarHBondContact O-N 2.89Å; T132-L135 PolarHBondContact O-N 3.31Å; L135-E139 WeakPolarHBondContact O-CB 3.23Å; L135-E139 PolarHBondContact O-N 2.95Å
136	V	84.3	Confident	80.6	Confident	118 Å²	118	95.3 Å²	95.3	72%	0.715	50%	0.503	S	S	*	.	H	α-helix	trans	-73.8	-38.4	176.7	174.4	0	0	0	0	112.6	T132 S133 W134	T132-V136 WeakPolarHBondContact O-CG2 3.43Å; T132-V136 PolarHBondContact O-N 3.16Å; T132-V136 VanDerWaalsContact O-N 3.17Å; S133-V136 PolarHBondContact O-N 3.03Å; W134-V136 VanDerWaalsContact C-N 3.27Å; W134-V136 PolarHBondContact O-N 3.44Å
137	V	85	Confident	79.9	Confident	122 Å²	122	98.8 Å²	98.8	74%	0.739	51%	0.508	S	S	*	.	H	α-helix	trans	-87.9	-31.1	-173.2	174.6	0	0	0	0	112.9	S133 W134	S133-V137 WeakPolarHBondContact O-CG2 3.4Å; S133-V137 PolarHBondContact O-N 3.49Å; S133-V137 VanDerWaalsContact O-N 3.11Å; W134-V137 PolarHBondContact O-N 3.36Å
138	A	79.4	Confident	79.1	Confident	7 Å²	7	98.2 Å²	98.2	6%	0.058	51%	0.506	C	S	.	.	S	Bend	trans	-125.4	26.6	-169.1	0	0	0	0	0	112.3	W134 E140 R141 T142	W134-A138 HydrophobicContact CD2-CB 4.15Å; W134-A138 HydrophobicContact CG-CB 4.44Å; W134-A138 HydrophobicContact CZ2-CB 4.09Å; W134-A138 WeakPolarHBondContact O-CA 3.49Å; W134-A138 WeakPolarHBondContact O-CB 3.47Å; W134-A138 PolarHBondContact O-N 2.77Å; A138-E140 PolarHBondContact O-N 2.93Å; A138-R141 PolarHBondContact O-N 2.92Å; A138-T142 VanDerWaalsContact O-CB 3.25Å; A138-T142 WeakPolarHBondContact O-CB 3.3Å; A138-T142 PolarHBondContact O-N 3.3Å; A138-T142 PolarHBondContact O-OG1 3.44Å
139	E	78.8	Confident	78.4	Confident	122 Å²	122	96.9 Å²	96.9	57%	0.57	49%	0.493	S	S	*	.	H	α-helix	trans	-51.7	-55.9	178.7	-169.5	177.5	172.9	0	0	111.1	L135 R141 T142 M143	L135-E139 WeakPolarHBondContact O-CB 3.23Å; L135-E139 PolarHBondContact O-N 2.95Å; E139-R141 PolarHBondContact O-N 3.43Å; E139-T142 PolarHBondContact O-N 2.65Å; E139-M143 HydrophobicContact CG-CG 4.43Å; E139-M143 WeakPolarHBondContact O-CB 3.39Å; E139-M143 VanDerWaalsContact O-CG 3.3Å; E139-M143 WeakPolarHBondContact O-CG 3.17Å; E139-M143 PolarHBondContact O-N 3.2Å
140	E	76.2	Confident	77.9	Confident	171 Å²	171	93.4 Å²	93.4	80%	0.799	47%	0.473	S	S	*	.	H	α-helix	trans	-58.8	-47.4	-178	-66.2	-177	168.5	0	0	112	A138 T142 M143 E144	A138-E140 PolarHBondContact O-N 2.93Å; E140-T142 VanDerWaalsContact C-N 3.33Å; E140-T142 PolarHBondContact O-N 2.93Å; E140-M143 PolarHBondContact O-N 2.94Å; E140-E144 WeakPolarHBondContact O-CB 3.37Å; E140-E144 PolarHBondContact O-N 3.5Å
141	R	70.9	Confident	77.5	Confident	186 Å²	186	93.5 Å²	93.5	70%	0.702	47%	0.467	S	S	*	.	H	α-helix	trans	-64.8	-38.6	179.2	-62	-172.6	-155	177.4	6.6	112	A138 E139 F145	A138-R141 PolarHBondContact O-N 2.92Å; E139-R141 PolarHBondContact O-N 3.43Å; R141-F145 VanDerWaalsContact O-CB 3.27Å; R141-F145 WeakPolarHBondContact O-CB 3.22Å; R141-F145 PolarHBondContact O-N 3.37Å
142	T	69.1	Low	77.1	Confident	42 Å²	42	93.6 Å²	93.6	26%	0.258	46%	0.459	S	S	.	.	H	α-helix	trans	-68.9	-42	179.3	-55.7	0	0	0	0	110	W134 A138 E139 E140 F145 L146	W134-T142 PolarHBondContact NE1-OG1 2.99Å; A138-T142 VanDerWaalsContact O-CB 3.25Å; A138-T142 WeakPolarHBondContact O-CB 3.3Å; A138-T142 PolarHBondContact O-N 3.3Å; A138-T142 PolarHBondContact O-OG1 3.44Å; E139-T142 PolarHBondContact O-N 2.65Å; E140-T142 VanDerWaalsContact C-N 3.33Å; E140-T142 PolarHBondContact O-N 2.93Å; T142-F145 PolarHBondContact O-N 3.37Å; T142-L146 HydrophobicContact CG2-CD1 4.09Å; T142-L146 HydrophobicContact CG2-CG 4.46Å; T142-L146 WeakPolarHBondContact O-CB 3.29Å; T142-L146 VanDerWaalsContact O-CG 3.25Å; T142-L146 WeakPolarHBondContact O-CG 2.98Å; T142-L146 PolarHBondContact O-N 2.82Å
143	M	71.9	Confident	76.8	Confident	88 Å²	88	90 Å²	90	43%	0.433	44%	0.436	S	S	.	.	H	α-helix	trans	-67.5	-40.2	176.7	-70.9	-62.7	-77.8	0	0	112.2	E139 E140 L146 R147	E139-M143 HydrophobicContact CG-CG 4.43Å; E139-M143 WeakPolarHBondContact O-CB 3.39Å; E139-M143 VanDerWaalsContact O-CG 3.3Å; E139-M143 WeakPolarHBondContact O-CG 3.17Å; E139-M143 PolarHBondContact O-N 3.2Å; E140-M143 PolarHBondContact O-N 2.94Å; M143-L146 PolarHBondContact O-N 3.18Å; M143-R147 VanDerWaalsContact O-CB 3.3Å; M143-R147 WeakPolarHBondContact O-CB 3.29Å; M143-R147 VanDerWaalsContact O-CG 3.23Å; M143-R147 WeakPolarHBondContact O-CG 3.27Å; M143-R147 PolarHBondContact O-N 2.9Å
144	E	71.6	Confident	76.7	Confident	143 Å²	143	87 Å²	87	67%	0.668	42%	0.415	S	S	*	.	H	α-helix	trans	-62.4	-45.8	173.9	-174.6	174.1	-158.1	0	0	111.3	E140 R147 G148	E140-E144 WeakPolarHBondContact O-CB 3.37Å; E140-E144 PolarHBondContact O-N 3.5Å; E144-R147 PolarHBondContact O-N 2.84Å; E144-G148 PolarHBondContact O-N 3.36Å
145	F	67.7	Low	76.5	Confident	51 Å²	51	81.4 Å²	81.4	22%	0.224	40%	0.395	C	S	.	.	H	α-helix	trans	-58.5	-50.7	173.9	174.8	-86.1	0	0	0	111.8	E80 I83 R141 T142 R147 G148 F149	E80-F145 HydrophobicContact CB-CE2 4.36Å; E80-F145 HydrophobicContact CG-CE2 3.69Å; E80-F145 HydrophobicContact CG-CZ 4.16Å; I83-F145 HydrophobicContact CD1-CD1 3.66Å; I83-F145 HydrophobicContact CD1-CD2 4.42Å; I83-F145 HydrophobicContact CD1-CE1 3.11Å; I83-F145 HydrophobicContact CD1-CE2 3.91Å; I83-F145 HydrophobicContact CD1-CG 4.32Å; I83-F145 HydrophobicContact CD1-CZ 3.24Å; I83-F145 HydrophobicContact CG1-CE1 4.39Å; I83-F145 HydrophobicContact CG1-CZ 4.15Å; R141-F145 VanDerWaalsContact O-CB 3.27Å; R141-F145 WeakPolarHBondContact O-CB 3.22Å; R141-F145 PolarHBondContact O-N 3.37Å; T142-F145 PolarHBondContact O-N 3.37Å; F145-R147 VanDerWaalsContact C-N 3.29Å; F145-R147 PolarHBondContact O-N 3.34Å; F145-G148 PolarHBondContact O-N 3.45Å; F145-F149 HydrophobicContact CE1-CB 4.14Å; F145-F149 HydrophobicContact CZ-CB 4.42Å; F145-F149 WeakPolarHBondContact O-CB 3.4Å; F145-F149 PolarHBondContact O-N 3.24Å
146	L	73.4	Confident	76.3	Confident	88 Å²	88	78 Å²	78	46%	0.461	38%	0.381	S	S	.	.	H	α-helix	trans	-62.5	-37.6	-178.9	-74.7	171.9	0	0	0	111.7	T142 M143 Y150	T142-L146 HydrophobicContact CG2-CD1 4.09Å; T142-L146 HydrophobicContact CG2-CG 4.46Å; T142-L146 WeakPolarHBondContact O-CB 3.29Å; T142-L146 VanDerWaalsContact O-CG 3.25Å; T142-L146 WeakPolarHBondContact O-CG 2.98Å; T142-L146 PolarHBondContact O-N 2.82Å; M143-L146 PolarHBondContact O-N 3.18Å; L146-Y150 WeakPolarHBondContact O-CB 3.49Å; L146-Y150 PolarHBondContact O-N 2.86Å
147	R	75.7	Confident	76	Confident	147 Å²	147	73.3 Å²	73.3	56%	0.555	35%	0.35	S	S	*	.	H	α-helix	trans	-64.7	-45.5	173.7	-79.4	175.9	-174.5	164.4	3.3	111.8	M143 E144 F145 Y150 R151 Y182	M143-R147 VanDerWaalsContact O-CB 3.3Å; M143-R147 WeakPolarHBondContact O-CB 3.29Å; M143-R147 VanDerWaalsContact O-CG 3.23Å; M143-R147 WeakPolarHBondContact O-CG 3.27Å; M143-R147 PolarHBondContact O-N 2.9Å; E144-R147 PolarHBondContact O-N 2.84Å; F145-R147 VanDerWaalsContact C-N 3.29Å; F145-R147 PolarHBondContact O-N 3.34Å; R147-Y150 PolarHBondContact O-N 3.41Å; R147-R151 WeakPolarHBondContact O-CB 3.5Å; R147-R151 PolarHBondContact O-N 2.88Å; R147-Y182 HydrophobicContact CB-CE2 3.97Å; R147-Y182 HydrophobicContact CG-CE2 4.39Å
148	G	70.2	Confident	75.9	Confident	30 Å²	30	67.5 Å²	67.5	31%	0.309	32%	0.315	S	S	.	.	H	α-helix	trans	-60.9	-47.7	176.1	0	0	0	0	0	111.8	E144 F145 R151 L152	E144-G148 PolarHBondContact O-N 3.36Å; F145-G148 PolarHBondContact O-N 3.45Å; G148-R151 PolarHBondContact O-N 3.16Å; G148-L152 WeakPolarHBondContact O-CB 3.37Å; G148-L152 PolarHBondContact O-N 2.9Å
149	F	72.1	Confident	76.1	Confident	33 Å²	33	71 Å²	71	15%	0.145	33%	0.329	C	S	.	.	H	α-helix	trans	-59.9	-49.2	175.7	176.6	-97.9	0	0	0	112	F84 F145 R151 L152 Y153 L166	F84-F149 AromaticContact CE2-CE2 3.91Å; F84-F149 HydrophobicContact CE2-CE2 3.91Å; F84-F149 AromaticContact CZ-CE2 3.62Å; F84-F149 HydrophobicContact CZ-CE2 3.62Å; F84-F149 AromaticContact CZ-CZ 3.86Å; F84-F149 HydrophobicContact CZ-CZ 3.86Å; F145-F149 HydrophobicContact CE1-CB 4.14Å; F145-F149 HydrophobicContact CZ-CB 4.42Å; F145-F149 WeakPolarHBondContact O-CB 3.4Å; F145-F149 PolarHBondContact O-N 3.24Å; F149-R151 VanDerWaalsContact C-N 3.32Å; F149-R151 PolarHBondContact O-N 3.5Å; F149-L152 PolarHBondContact O-N 3.08Å; F149-Y153 HydrophobicContact CZ-CD2 4.31Å; F149-Y153 VanDerWaalsContact O-CB 3.22Å; F149-Y153 WeakPolarHBondContact O-CB 3.43Å; F149-Y153 PolarHBondContact O-N 3.35Å; F149-L166 HydrophobicContact CE1-CD2 4.4Å; F149-L166 HydrophobicContact CZ-CD1 4.2Å; F149-L166 HydrophobicContact CZ-CD2 4.35Å
150	Y	80.9	Confident	76	Confident	32 Å²	32	68.8 Å²	68.8	13%	0.125	32%	0.319	C	S	.	.	H	α-helix	trans	-59.4	-44	179	178.6	-92.2	0	0	0	111.5	L146 R147 L154 I170 V173 Q174 G181 Y182	L146-Y150 WeakPolarHBondContact O-CB 3.49Å; L146-Y150 PolarHBondContact O-N 2.86Å; R147-Y150 PolarHBondContact O-N 3.41Å; Y150-L154 HydrophobicContact CD1-CD1 3.7Å; Y150-L154 HydrophobicContact CE1-CD1 3.14Å; Y150-L154 HydrophobicContact CE1-CG 4.21Å; Y150-L154 HydrophobicContact CE2-CD1 4.26Å; Y150-L154 HydrophobicContact CG-CD1 4.47Å; Y150-L154 VanDerWaalsContact CZ-CD1 3.45Å; Y150-L154 WeakPolarHBondContact O-CB 3.45Å; Y150-L154 WeakPolarHBondContact O-CG 3.34Å; Y150-L154 PolarHBondContact O-N 3.47Å; Y150-I170 HydrophobicContact CD2-CD1 3.26Å; Y150-I170 HydrophobicContact CE2-CD1 3.34Å; Y150-I170 HydrophobicContact CE2-CG2 4.18Å; Y150-I170 HydrophobicContact CG-CD1 4.31Å; Y150-V173 HydrophobicContact CE2-CG1 3.95Å; Y150-Q174 WeakPolarHBondContact OH-CG 3.33Å; Y150-Q174 PolarHBondContact OH-NE2 2.53Å; Y150-G181 WeakPolarHBondContact CE1-O 3.31Å; Y150-G181 PolarHBondContact OH-O 2.86Å; Y150-Y182 HydrophobicContact CD1-CD2 4.07Å
151	R	79.6	Confident	75.8	Confident	105 Å²	105	62 Å²	62	40%	0.396	29%	0.288	S	S	.	.	H	α-helix	trans	-60.8	-54.3	175.1	-177.9	-169.8	-178.6	177.6	-7	111.6	R147 G148 F149 Y153 L154 E155 Y182	R147-R151 WeakPolarHBondContact O-CB 3.5Å; R147-R151 PolarHBondContact O-N 2.88Å; G148-R151 PolarHBondContact O-N 3.16Å; F149-R151 VanDerWaalsContact C-N 3.32Å; F149-R151 PolarHBondContact O-N 3.5Å; R151-Y153 VanDerWaalsContact C-N 3.29Å; R151-Y153 PolarHBondContact O-N 2.95Å; R151-L154 PolarHBondContact O-N 2.81Å; R151-E155 HydrophobicContact CG-CG 4.34Å; R151-E155 VanDerWaalsContact CG-OE1 3.27Å; R151-E155 WeakPolarHBondContact CG-OE1 3.46Å; R151-E155 IonicContact CZ-OE1 2.67Å; R151-E155 IonicContact NE-OE1 2.53Å; R151-E155 PolarHBondContact NE-OE1 2.87Å; R151-E155 IonicContact NE-OE2 2.75Å; R151-E155 IonicContact NH2-OE1 2.57Å; R151-E155 WeakPolarHBondContact O-CB 3.32Å; R151-E155 WeakPolarHBondContact O-CG 3.27Å; R151-E155 PolarHBondContact O-N 3.1Å; R151-Y182 HydrophobicContact CB-CD1 3.75Å; R151-Y182 HydrophobicContact CB-CD2 3.88Å; R151-Y182 HydrophobicContact CB-CE1 4.02Å; R151-Y182 HydrophobicContact CB-CE2 4.1Å; R151-Y182 HydrophobicContact CB-CG 3.67Å; R151-Y182 VanDerWaalsContact CD-CE1 3.42Å; R151-Y182 HydrophobicContact CG-CD1 3.45Å; R151-Y182 VanDerWaalsContact CG-CD1 3.45Å; R151-Y182 HydrophobicContact CG-CD2 4.5Å; R151-Y182 HydrophobicContact CG-CE1 3.82Å; R151-Y182 HydrophobicContact CG-CG 3.84Å
152	L	74.9	Confident	75.9	Confident	62 Å²	62	59.3 Å²	59.3	33%	0.325	29%	0.294	S	S	.	.	H	α-helix	trans	-60.4	-42.1	-177.6	-177.5	66.5	0	0	0	111.2	G148 F149 E155 S156	G148-L152 WeakPolarHBondContact O-CB 3.37Å; G148-L152 PolarHBondContact O-N 2.9Å; F149-L152 PolarHBondContact O-N 3.08Å; L152-E155 PolarHBondContact O-N 3.23Å; L152-S156 WeakPolarHBondContact O-CB 3.39Å; L152-S156 PolarHBondContact O-N 2.98Å
153	Y	80.1	Confident	76	Confident	10 Å²	10	65.4 Å²	65.4	4%	0.039	32%	0.32	C	S	.	.	I	π-helix	trans	-62.2	-47	176.7	-170.3	-87.1	0	0	0	111.7	F149 R151 Y157 Y158 S164 L166 D167 I170	F149-Y153 HydrophobicContact CZ-CD2 4.31Å; F149-Y153 VanDerWaalsContact O-CB 3.22Å; F149-Y153 WeakPolarHBondContact O-CB 3.43Å; F149-Y153 PolarHBondContact O-N 3.35Å; R151-Y153 VanDerWaalsContact C-N 3.29Å; R151-Y153 PolarHBondContact O-N 2.95Å; Y153-Y157 HydrophobicContact CD2-CD2 4.43Å; Y153-Y157 HydrophobicContact CD2-CG 4.39Å; Y153-Y157 HydrophobicContact CE2-CG 4.5Å; Y153-Y157 CarbonylContact O-C 3.51Å; Y153-Y157 WeakPolarHBondContact O-CA 3.43Å; Y153-Y157 PolarHBondContact O-N 2.89Å; Y153-Y158 HydrophobicContact CE1-CD2 4.25Å; Y153-Y158 PolarHBondContact O-N 3.28Å; Y153-S164 PolarHBondContact OH-OG 2.6Å; Y153-L166 HydrophobicContact CD2-CB 4.36Å; Y153-L166 HydrophobicContact CD2-CD1 3.87Å; Y153-L166 HydrophobicContact CE1-CB 3.84Å; Y153-L166 HydrophobicContact CE2-CB 3.57Å; Y153-L166 HydrophobicContact CE2-CD1 3.39Å; Y153-L166 HydrophobicContact CE2-CG 4.1Å; Y153-L166 VanDerWaalsContact OH-CB 3.31Å; Y153-L166 WeakPolarHBondContact OH-CB 3.07Å; Y153-D167 VanDerWaalsContact CE1-OD1 3.31Å; Y153-D167 WeakPolarHBondContact CE1-OD1 3.37Å; Y153-D167 PolarHBondContact OH-OD1 3.47Å; Y153-I170 HydrophobicContact CD1-CD1 4.16Å; Y153-I170 HydrophobicContact CD1-CG1 3.75Å; Y153-I170 HydrophobicContact CE1-CG1 3.94Å
154	L	83.6	Confident	76.1	Confident	0 Å²	0	61.7 Å²	61.7	0%	0	30%	0.303	C	S	.	.	I	π-helix	trans	-61.5	-45	175.8	-84.9	176	0	0	0	113.3	Y150 R151 Y158 I170 Y200 F201 T205	Y150-L154 HydrophobicContact CD1-CD1 3.7Å; Y150-L154 HydrophobicContact CE1-CD1 3.14Å; Y150-L154 HydrophobicContact CE1-CG 4.21Å; Y150-L154 HydrophobicContact CE2-CD1 4.26Å; Y150-L154 HydrophobicContact CG-CD1 4.47Å; Y150-L154 VanDerWaalsContact CZ-CD1 3.45Å; Y150-L154 WeakPolarHBondContact O-CB 3.45Å; Y150-L154 WeakPolarHBondContact O-CG 3.34Å; Y150-L154 PolarHBondContact O-N 3.47Å; R151-L154 PolarHBondContact O-N 2.81Å; L154-Y158 HydrophobicContact CD2-CD1 4.25Å; L154-Y158 HydrophobicContact CD2-CD2 4.1Å; L154-Y158 HydrophobicContact CD2-CG 3.91Å; L154-I170 HydrophobicContact CD2-CG2 3.61Å; L154-I170 HydrophobicContact CG-CG2 4.29Å; L154-Y200 HydrophobicContact CD1-CE1 4.41Å; L154-F201 HydrophobicContact CD2-CE1 4.38Å; L154-T205 WeakPolarHBondContact O-CB 3.33Å; L154-T205 WeakPolarHBondContact O-CG2 3.37Å
155	E	81.6	Confident	76.3	Confident	38 Å²	38	57.8 Å²	57.8	18%	0.178	28%	0.284	C	S	.	.	I	π-helix	trans	-70.3	-39.8	-176.1	-71.6	179.4	-173.1	0	0	111.7	R151 L152 Y200 M204 T205 S206	R151-E155 HydrophobicContact CG-CG 4.34Å; R151-E155 VanDerWaalsContact CG-OE1 3.27Å; R151-E155 WeakPolarHBondContact CG-OE1 3.46Å; R151-E155 IonicContact CZ-OE1 2.67Å; R151-E155 IonicContact NE-OE1 2.53Å; R151-E155 PolarHBondContact NE-OE1 2.87Å; R151-E155 IonicContact NE-OE2 2.75Å; R151-E155 IonicContact NH2-OE1 2.57Å; R151-E155 WeakPolarHBondContact O-CB 3.32Å; R151-E155 WeakPolarHBondContact O-CG 3.27Å; R151-E155 PolarHBondContact O-N 3.1Å; L152-E155 PolarHBondContact O-N 3.23Å; E155-Y200 HydrophobicContact CG-CE2 4.18Å; E155-Y200 WeakPolarHBondContact CG-OH 3.48Å; E155-M204 WeakPolarHBondContact CA-O 3.07Å; E155-M204 WeakPolarHBondContact CB-O 3.18Å; E155-M204 WeakPolarHBondContact CG-O 3.44Å; E155-T205 CarbonylContact O-C 3.56Å; E155-T205 VanDerWaalsContact O-CA 3.31Å; E155-T205 WeakPolarHBondContact O-CA 3.39Å; E155-S206 PolarHBondContact O-N 3.2Å
156	S	76.4	Confident	76.8	Confident	42 Å²	42	55.9 Å²	55.9	29%	0.294	28%	0.276	S	S	.	.	I	π-helix	trans	-104.6	-39.6	-170.6	-57.4	0	0	0	0	114.2	L152 S206	L152-S156 WeakPolarHBondContact O-CB 3.39Å; L152-S156 PolarHBondContact O-N 2.98Å; S156-S206 WeakPolarHBondContact O-CB 3.33Å; S156-S206 PolarHBondContact O-OG 3.38Å
157	Y	76.7	Confident	77.4	Confident	20 Å²	20	51.9 Å²	51.9	8%	0.078	26%	0.255	C	S	.	.	I	π-helix	trans	-117.2	-18.3	-160.6	-63	-81.5	0	0	0	115.4	I54 V57 Y153 K159 E160	I54-Y157 HydrophobicContact CG1-CE1 4.5Å; V57-Y157 HydrophobicContact CB-CE1 3.52Å; V57-Y157 WeakPolarHBondContact CB-OH 3.31Å; V57-Y157 HydrophobicContact CG1-CE1 3.64Å; V57-Y157 VanDerWaalsContact CG1-OH 3.29Å; V57-Y157 WeakPolarHBondContact CG1-OH 3.46Å; V57-Y157 HydrophobicContact CG2-CD1 4.29Å; V57-Y157 HydrophobicContact CG2-CE1 3.57Å; Y153-Y157 HydrophobicContact CD2-CD2 4.43Å; Y153-Y157 HydrophobicContact CD2-CG 4.39Å; Y153-Y157 HydrophobicContact CE2-CG 4.5Å; Y153-Y157 CarbonylContact O-C 3.51Å; Y153-Y157 WeakPolarHBondContact O-CA 3.43Å; Y153-Y157 PolarHBondContact O-N 2.89Å; Y157-K159 PolarHBondContact O-N 2.81Å; Y157-E160 WeakPolarHBondContact O-CB 3.41Å; Y157-E160 WeakPolarHBondContact O-CG 3.36Å; Y157-E160 PolarHBondContact O-N 3.36Å; Y157-E160 VanDerWaalsContact O-N 3.11Å
158	Y	83.2	Confident	77.8	Confident	0 Å²	0	48.1 Å²	48.1	0%	0	25%	0.251	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.9	125.9	-173.2	177.6	-100.8	0	0	0	111.7	Y153 L154 E160 D167 I170 D171 F201 F207 P227 S229	Y153-Y158 HydrophobicContact CE1-CD2 4.25Å; Y153-Y158 PolarHBondContact O-N 3.28Å; L154-Y158 HydrophobicContact CD2-CD1 4.25Å; L154-Y158 HydrophobicContact CD2-CD2 4.1Å; L154-Y158 HydrophobicContact CD2-CG 3.91Å; Y158-E160 PolarHBondContact O-N 3.15Å; Y158-D167 HydrophobicContact CD2-CB 4.48Å; Y158-D167 HydrophobicContact CE2-CB 4.4Å; Y158-I170 HydrophobicContact CD2-CB 4.1Å; Y158-I170 HydrophobicContact CD2-CG2 3.77Å; Y158-I170 HydrophobicContact CE2-CB 3.98Å; Y158-I170 HydrophobicContact CE2-CG2 3.61Å; Y158-D171 WeakPolarHBondContact CE2-OD1 3.3Å; Y158-D171 VanDerWaalsContact CZ-OD1 3.3Å; Y158-D171 PolarHBondContact OH-OD1 3.03Å; Y158-F201 HydrophobicContact CE1-CE1 4.45Å; Y158-F207 HydrophobicContact CD1-CB 4.17Å; Y158-F207 HydrophobicContact CD1-CG 4.45Å; Y158-P227 HydrophobicContact CD1-CG 4.33Å; Y158-P227 HydrophobicContact CE1-CB 3.79Å; Y158-P227 HydrophobicContact CE1-CG 3.31Å; Y158-P227 WeakPolarHBondContact OH-CB 3.17Å; Y158-S229 PolarHBondContact OH-OG 2.9Å
159	K	83.8	Confident	78.4	Confident	82 Å²	82	52.1 Å²	52.1	36%	0.357	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	61.2	19.2	-176.2	-56.9	-69.3	178.7	-166.6	0	114.9	Y157 D167 D171 F207	Y157-K159 PolarHBondContact O-N 2.81Å; K159-D167 WeakPolarHBondContact CA-OD2 3.31Å; K159-D167 HydrophobicContact CD-CB 4.38Å; K159-D167 VanDerWaalsContact N-CG 3.34Å; K159-D167 PolarHBondContact N-OD1 2.7Å; K159-D167 PolarHBondContact N-OD2 3.42Å; K159-D171 IonicContact NZ-OD1 3.57Å; K159-D171 IonicContact NZ-OD2 3.38Å; K159-D171 PolarHBondContact NZ-OD2 3.45Å; K159-F207 HydrophobicContact CB-CD2 3.76Å; K159-F207 HydrophobicContact CB-CE2 4.5Å; K159-F207 HydrophobicContact CG-CD2 3.95Å; K159-F207 HydrophobicContact CG-CE2 4.39Å
160	E	77.2	Confident	79	Confident	75 Å²	75	50.6 Å²	50.6	35%	0.35	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.5	-33.6	169.7	-63.8	-149.6	124.5	0	0	112.6	Y157 Y158 S206 K210	Y157-E160 WeakPolarHBondContact O-CB 3.41Å; Y157-E160 WeakPolarHBondContact O-CG 3.36Å; Y157-E160 PolarHBondContact O-N 3.36Å; Y157-E160 VanDerWaalsContact O-N 3.11Å; Y158-E160 PolarHBondContact O-N 3.15Å; E160-S206 PolarHBondContact OE1-OG 3.11Å; E160-K210 VanDerWaalsContact CD-NZ 3.29Å; E160-K210 VanDerWaalsContact CG-NZ 3.25Å; E160-K210 IonicContact OE1-NZ 2.83Å; E160-K210 PolarHBondContact OE1-NZ 3.49Å
161	D	71.8	Confident	79.4	Confident	27 Å²	27	50.2 Å²	50.2	14%	0.144	25%	0.254	C	S	.	.	S	Bend	trans	-118.6	119	176.7	170.6	38.3	0	0	0	110.8	K53 E163 S164	K53-D161 HydrophobicContact CD-CB 3.94Å; K53-D161 WeakPolarHBondContact CE-OD2 3.38Å; K53-D161 VanDerWaalsContact NZ-CG 3.31Å; K53-D161 IonicContact NZ-OD2 3.04Å; K53-D161 PolarHBondContact NZ-OD2 3.37Å; D161-E163 PolarHBondContact O-N 2.88Å; D161-E163 VanDerWaalsContact O-N 3.08Å; D161-E163 PolarHBondContact OD1-N 2.92Å; D161-E163 VanDerWaalsContact OD1-N 3.14Å; D161-S164 WeakPolarHBondContact O-CB 3.44Å; D161-S164 PolarHBondContact O-N 2.94Å; D161-S164 VanDerWaalsContact O-N 3.09Å; D161-S164 PolarHBondContact OD2-N 3.44Å; D161-S164 VanDerWaalsContact OD2-N 3.14Å
162	P	72.6	Confident	79.6	Confident	130 Å²	130	49.2 Å²	49.2	84%	0.844	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.4	-19.7	178.3	25.8	-35.5	0	0	0	114
163	E	71	Confident	80	Confident	170 Å²	170	47.8 Å²	47.8	79%	0.794	25%	0.25	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.6	6	179.7	-59.6	-168.4	168.7	0	0	114	D161 F165	D161-E163 PolarHBondContact O-N 2.88Å; D161-E163 VanDerWaalsContact O-N 3.08Å; D161-E163 PolarHBondContact OD1-N 2.92Å; D161-E163 VanDerWaalsContact OD1-N 3.14Å; E163-F165 PolarHBondContact O-N 3.24Å
164	S	73.7	Confident	80.2	Confident	11 Å²	11	47.4 Å²	47.4	8%	0.077	25%	0.249	C	C	.	.			trans	-67.8	120.4	-176.1	-176	0	0	0	0	111.9	Y153 D161 L166 D167	Y153-S164 PolarHBondContact OH-OG 2.6Å; D161-S164 WeakPolarHBondContact O-CB 3.44Å; D161-S164 PolarHBondContact O-N 2.94Å; D161-S164 VanDerWaalsContact O-N 3.09Å; D161-S164 PolarHBondContact OD2-N 3.44Å; D161-S164 VanDerWaalsContact OD2-N 3.14Å; S164-L166 PolarHBondContact O-N 3.34Å; S164-L166 PolarHBondContact OG-N 3.37Å; S164-D167 PolarHBondContact O-N 3.22Å
165	F	75.7	Confident	80	Confident	60 Å²	60	53.7 Å²	53.7	26%	0.263	27%	0.273	S	S	.	.	H	α-helix	trans	-66	-29.6	173.9	84.2	-97.1	0	0	0	112.1	K46 S50 E163 D167 S168 F169	K46-F165 HydrophobicContact CB-CD1 3.77Å; K46-F165 HydrophobicContact CB-CE1 4.25Å; K46-F165 HydrophobicContact CB-CG 4.3Å; K46-F165 HydrophobicContact CD-CB 3.91Å; K46-F165 HydrophobicContact CD-CG 4.39Å; K46-F165 HydrophobicContact CG-CB 4.47Å; S50-F165 VanDerWaalsContact OG-CD1 3.27Å; S50-F165 WeakPolarHBondContact OG-CD1 3.31Å; S50-F165 WeakPolarHBondContact OG-CE1 3.31Å; E163-F165 PolarHBondContact O-N 3.24Å; F165-D167 VanDerWaalsContact C-N 3.29Å; F165-S168 PolarHBondContact O-N 3.3Å; F165-F169 PolarHBondContact O-N 2.78Å; F165-F169 VanDerWaalsContact O-N 3.11Å
166	L	77.7	Confident	79.8	Confident	11 Å²	11	56.1 Å²	56.1	6%	0.058	29%	0.294	C	S	.	.	H	α-helix	trans	-68.1	-33.4	179.9	-75.1	168.5	0	0	0	110	F149 Y153 S164 S168 F169 I170	F149-L166 HydrophobicContact CE1-CD2 4.4Å; F149-L166 HydrophobicContact CZ-CD1 4.2Å; F149-L166 HydrophobicContact CZ-CD2 4.35Å; Y153-L166 HydrophobicContact CD2-CB 4.36Å; Y153-L166 HydrophobicContact CD2-CD1 3.87Å; Y153-L166 HydrophobicContact CE1-CB 3.84Å; Y153-L166 HydrophobicContact CE2-CB 3.57Å; Y153-L166 HydrophobicContact CE2-CD1 3.39Å; Y153-L166 HydrophobicContact CE2-CG 4.1Å; Y153-L166 VanDerWaalsContact OH-CB 3.31Å; Y153-L166 WeakPolarHBondContact OH-CB 3.07Å; S164-L166 PolarHBondContact O-N 3.34Å; S164-L166 PolarHBondContact OG-N 3.37Å; L166-S168 VanDerWaalsContact C-N 3.33Å; L166-S168 PolarHBondContact O-N 2.73Å; L166-F169 WeakPolarHBondContact O-CB 3.35Å; L166-F169 PolarHBondContact O-N 3.34Å; L166-F169 VanDerWaalsContact O-N 3.15Å; L166-I170 WeakPolarHBondContact O-CB 3.15Å; L166-I170 WeakPolarHBondContact O-CG1 3.47Å; L166-I170 PolarHBondContact O-N 3.14Å
167	D	86.1	Confident	79.9	Confident	5 Å²	5	59.1 Å²	59.1	3%	0.027	31%	0.306	C	S	.	.	H	α-helix	trans	-61.4	-43.3	174.7	-70.3	-2.8	0	0	0	111.8	Y153 Y158 K159 S164 F165 F169 I170 D171	Y153-D167 VanDerWaalsContact CE1-OD1 3.31Å; Y153-D167 WeakPolarHBondContact CE1-OD1 3.37Å; Y153-D167 PolarHBondContact OH-OD1 3.47Å; Y158-D167 HydrophobicContact CD2-CB 4.48Å; Y158-D167 HydrophobicContact CE2-CB 4.4Å; K159-D167 WeakPolarHBondContact CA-OD2 3.31Å; K159-D167 HydrophobicContact CD-CB 4.38Å; K159-D167 VanDerWaalsContact N-CG 3.34Å; K159-D167 PolarHBondContact N-OD1 2.7Å; K159-D167 PolarHBondContact N-OD2 3.42Å; S164-D167 PolarHBondContact O-N 3.22Å; F165-D167 VanDerWaalsContact C-N 3.29Å; D167-F169 VanDerWaalsContact C-N 3.32Å; D167-F169 PolarHBondContact O-N 3.11Å; D167-I170 PolarHBondContact O-N 3.09Å; D167-D171 WeakPolarHBondContact O-CB 3.4Å; D167-D171 PolarHBondContact O-N 3.14Å
168	S	84.4	Confident	79.8	Confident	68 Å²	68	65.6 Å²	65.6	48%	0.476	34%	0.337	S	S	.	.	H	α-helix	trans	-63.2	-40.5	174.8	-58.8	0	0	0	0	111.8	F165 L166 D171 D172	F165-S168 PolarHBondContact O-N 3.3Å; L166-S168 VanDerWaalsContact C-N 3.33Å; L166-S168 PolarHBondContact O-N 2.73Å; S168-D171 PolarHBondContact O-N 2.88Å; S168-D172 WeakPolarHBondContact O-CB 3.21Å; S168-D172 VanDerWaalsContact O-CG 3.24Å; S168-D172 PolarHBondContact O-N 2.89Å
169	F	82.6	Confident	79.5	Confident	114 Å²	114	67.8 Å²	67.8	50%	0.5	35%	0.352	S	S	.	.	H	α-helix	trans	-62.8	-45.7	175.8	172.3	-100.1	0	0	0	111.8	F165 L166 D167 D171 D172 V173	F165-F169 PolarHBondContact O-N 2.78Å; F165-F169 VanDerWaalsContact O-N 3.11Å; L166-F169 WeakPolarHBondContact O-CB 3.35Å; L166-F169 PolarHBondContact O-N 3.34Å; L166-F169 VanDerWaalsContact O-N 3.15Å; D167-F169 VanDerWaalsContact C-N 3.32Å; D167-F169 PolarHBondContact O-N 3.11Å; F169-D171 VanDerWaalsContact C-N 3.35Å; F169-D172 PolarHBondContact O-N 3.27Å; F169-V173 HydrophobicContact CD1-CG2 4.29Å; F169-V173 HydrophobicContact CD2-CG2 4.43Å; F169-V173 HydrophobicContact CE1-CG2 3.85Å; F169-V173 HydrophobicContact CE2-CG2 4Å; F169-V173 HydrophobicContact CZ-CG2 3.69Å; F169-V173 VanDerWaalsContact O-CG2 3.32Å; F169-V173 WeakPolarHBondContact O-CG2 3.43Å; F169-V173 PolarHBondContact O-N 2.65Å
170	I	86.4	Confident	79.3	Confident	1 Å²	1	65.5 Å²	65.5	1%	0.005	35%	0.346	C	S	.	.	H	α-helix	trans	-63.2	-43	176.6	-64.5	-68.1	0	0	0	110.5	Y150 Y153 L154 Y158 L166 D167 D172 V173 Q174	Y150-I170 HydrophobicContact CD2-CD1 3.26Å; Y150-I170 HydrophobicContact CE2-CD1 3.34Å; Y150-I170 HydrophobicContact CE2-CG2 4.18Å; Y150-I170 HydrophobicContact CG-CD1 4.31Å; Y153-I170 HydrophobicContact CD1-CD1 4.16Å; Y153-I170 HydrophobicContact CD1-CG1 3.75Å; Y153-I170 HydrophobicContact CE1-CG1 3.94Å; L154-I170 HydrophobicContact CD2-CG2 3.61Å; L154-I170 HydrophobicContact CG-CG2 4.29Å; Y158-I170 HydrophobicContact CD2-CB 4.1Å; Y158-I170 HydrophobicContact CD2-CG2 3.77Å; Y158-I170 HydrophobicContact CE2-CB 3.98Å; Y158-I170 HydrophobicContact CE2-CG2 3.61Å; L166-I170 WeakPolarHBondContact O-CB 3.15Å; L166-I170 WeakPolarHBondContact O-CG1 3.47Å; L166-I170 PolarHBondContact O-N 3.14Å; D167-I170 PolarHBondContact O-N 3.09Å; I170-D172 VanDerWaalsContact C-N 3.27Å; I170-D172 PolarHBondContact O-N 3.08Å; I170-V173 PolarHBondContact O-N 2.8Å; I170-Q174 HydrophobicContact CG2-CG 4.47Å; I170-Q174 WeakPolarHBondContact O-CB 3.47Å; I170-Q174 VanDerWaalsContact O-CG 3.3Å; I170-Q174 WeakPolarHBondContact O-CG 3.33Å; I170-Q174 PolarHBondContact O-N 3.14Å
171	D	87.7	Confident	79.3	Confident	23 Å²	23	62.3 Å²	62.3	12%	0.123	33%	0.333	C	S	.	.	H	α-helix	trans	-59.4	-40.4	176.6	-73.8	-5	0	0	0	111.6	Y158 K159 D167 S168 F169 R175 S229	Y158-D171 WeakPolarHBondContact CE2-OD1 3.3Å; Y158-D171 VanDerWaalsContact CZ-OD1 3.3Å; Y158-D171 PolarHBondContact OH-OD1 3.03Å; K159-D171 IonicContact NZ-OD1 3.57Å; K159-D171 IonicContact NZ-OD2 3.38Å; K159-D171 PolarHBondContact NZ-OD2 3.45Å; D167-D171 WeakPolarHBondContact O-CB 3.4Å; D167-D171 PolarHBondContact O-N 3.14Å; S168-D171 PolarHBondContact O-N 2.88Å; F169-D171 VanDerWaalsContact C-N 3.35Å; D171-R175 VanDerWaalsContact O-CB 3.31Å; D171-R175 WeakPolarHBondContact O-CB 3.41Å; D171-R175 PolarHBondContact O-N 2.48Å; D171-S229 VanDerWaalsContact CA-CB 3.42Å; D171-S229 WeakPolarHBondContact O-CB 3.41Å; D171-S229 WeakPolarHBondContact OD1-CB 3.32Å; D171-S229 PolarHBondContact OD1-OG 3.46Å
172	D	85.4	Confident	79.2	Confident	84 Å²	84	64.1 Å²	64.1	45%	0.449	34%	0.339	S	S	.	.	H	α-helix	trans	-72.9	-38.7	177.8	-72.8	-17	0	0	0	112	S168 F169 I170 Q174 R175 S176	S168-D172 WeakPolarHBondContact O-CB 3.21Å; S168-D172 VanDerWaalsContact O-CG 3.24Å; S168-D172 PolarHBondContact O-N 2.89Å; F169-D172 PolarHBondContact O-N 3.27Å; I170-D172 VanDerWaalsContact C-N 3.27Å; I170-D172 PolarHBondContact O-N 3.08Å; D172-Q174 VanDerWaalsContact C-N 3.35Å; D172-R175 PolarHBondContact O-N 3.26Å; D172-R175 IonicContact OD1-CZ 3.57Å; D172-R175 IonicContact OD1-NH1 2.77Å; D172-R175 PolarHBondContact OD1-NH1 2.85Å; D172-R175 IonicContact OD1-NH2 3.37Å; D172-S176 WeakPolarHBondContact O-CB 3.48Å; D172-S176 PolarHBondContact O-N 3.25Å; D172-S176 PolarHBondContact O-OG 2.83Å
173	V	82	Confident	78.9	Confident	33 Å²	33	61.8 Å²	61.8	20%	0.2	31%	0.314	C	S	.	.	H	α-helix	trans	-60.4	-46.3	173.1	167.2	0	0	0	0	110.4	Y150 F169 I170 S176 N177	Y150-V173 HydrophobicContact CE2-CG1 3.95Å; F169-V173 HydrophobicContact CD1-CG2 4.29Å; F169-V173 HydrophobicContact CD2-CG2 4.43Å; F169-V173 HydrophobicContact CE1-CG2 3.85Å; F169-V173 HydrophobicContact CE2-CG2 4Å; F169-V173 HydrophobicContact CZ-CG2 3.69Å; F169-V173 VanDerWaalsContact O-CG2 3.32Å; F169-V173 WeakPolarHBondContact O-CG2 3.43Å; F169-V173 PolarHBondContact O-N 2.65Å; I170-V173 PolarHBondContact O-N 2.8Å; V173-S176 PolarHBondContact O-OG 3.41Å; V173-N177 WeakPolarHBondContact O-CB 3.33Å; V173-N177 PolarHBondContact O-N 3.39Å; V173-N177 PolarHBondContact O-ND2 3.37Å
174	Q	84.3	Confident	78	Confident	1 Å²	1	59.7 Å²	59.7	1%	0.005	31%	0.312	C	S	.	.	H	α-helix	trans	-62.2	-46.1	177.7	-74.4	176.7	-15.9	0	0	111.8	Y150 I170 D172 E178 C179 S229	Y150-Q174 WeakPolarHBondContact OH-CG 3.33Å; Y150-Q174 PolarHBondContact OH-NE2 2.53Å; I170-Q174 HydrophobicContact CG2-CG 4.47Å; I170-Q174 WeakPolarHBondContact O-CB 3.47Å; I170-Q174 VanDerWaalsContact O-CG 3.3Å; I170-Q174 WeakPolarHBondContact O-CG 3.33Å; I170-Q174 PolarHBondContact O-N 3.14Å; D172-Q174 VanDerWaalsContact C-N 3.35Å; Q174-E178 WeakPolarHBondContact O-CA 3.43Å; Q174-E178 PolarHBondContact O-N 2.72Å; Q174-E178 VanDerWaalsContact O-N 3.08Å; Q174-C179 CarbonylContact C-O 3.59Å; Q174-C179 VanDerWaalsContact CA-O 3.32Å; Q174-C179 WeakPolarHBondContact CA-O 3.44Å; Q174-C179 VanDerWaalsContact CB-O 3.24Å; Q174-C179 WeakPolarHBondContact CB-O 3.26Å; Q174-C179 PolarHBondContact O-N 2.94Å; Q174-S229 PolarHBondContact OE1-OG 3.31Å
175	R	78.7	Confident	77	Confident	133 Å²	133	62.3 Å²	62.3	50%	0.502	32%	0.322	S	S	.	.	H	α-helix	trans	-68.3	-42.5	179.4	-165.7	-175.1	-53.6	112.7	9.6	112.9	D171 D172	D171-R175 VanDerWaalsContact O-CB 3.31Å; D171-R175 WeakPolarHBondContact O-CB 3.41Å; D171-R175 PolarHBondContact O-N 2.48Å; D172-R175 PolarHBondContact O-N 3.26Å; D172-R175 IonicContact OD1-CZ 3.57Å; D172-R175 IonicContact OD1-NH1 2.77Å; D172-R175 PolarHBondContact OD1-NH1 2.85Å; D172-R175 IonicContact OD1-NH2 3.37Å
176	S	78.5	Confident	75.6	Confident	89 Å²	89	63.8 Å²	63.8	62%	0.622	34%	0.338	S	S	*	.	H	α-helix	trans	-74.5	-30	-175.5	58.1	0	0	0	0	113.3	D172 V173	D172-S176 WeakPolarHBondContact O-CB 3.48Å; D172-S176 PolarHBondContact O-N 3.25Å; D172-S176 PolarHBondContact O-OG 2.83Å; V173-S176 PolarHBondContact O-OG 3.41Å
177	N	77.8	Confident	74.1	Confident	105 Å²	105	70.1 Å²	70.1	56%	0.561	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.4	7.1	178.3	-61.7	-79.1	0	0	0	112.9	V173 C179	V173-N177 WeakPolarHBondContact O-CB 3.33Å; V173-N177 PolarHBondContact O-N 3.39Å; V173-N177 PolarHBondContact O-ND2 3.37Å; N177-C179 HydrophobicContact CB-CB 4.39Å; N177-C179 PolarHBondContact O-N 3.11Å; N177-C179 VanDerWaalsContact O-N 3.1Å
178	E	74.2	Confident	72.3	Confident	156 Å²	156	77.1 Å²	77.1	73%	0.729	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.6	37.8	-176.3	-58.6	-177.7	158.6	0	0	112.3	Q174	Q174-E178 WeakPolarHBondContact O-CA 3.43Å; Q174-E178 PolarHBondContact O-N 2.72Å; Q174-E178 VanDerWaalsContact O-N 3.08Å
179	C	78.7	Confident	70.6	Confident	46 Å²	46	75 Å²	75	31%	0.311	40%	0.399	S	S	.	.			trans	-115.7	158.7	-175.7	74.9	0	0	0	0	111.3	Q174 N177	Q174-C179 CarbonylContact C-O 3.59Å; Q174-C179 VanDerWaalsContact CA-O 3.32Å; Q174-C179 WeakPolarHBondContact CA-O 3.44Å; Q174-C179 VanDerWaalsContact CB-O 3.24Å; Q174-C179 WeakPolarHBondContact CB-O 3.26Å; Q174-C179 PolarHBondContact O-N 2.94Å; N177-C179 HydrophobicContact CB-CB 4.39Å; N177-C179 PolarHBondContact O-N 3.11Å; N177-C179 VanDerWaalsContact O-N 3.1Å
180	C	79.1	Confident	69	Low	34 Å²	34	77.9 Å²	77.9	23%	0.23	42%	0.415	C	S	.	.			trans	-139.2	118.6	179.7	-174.2	0	0	0	0	110.8	T197 F201 C230	C180-T197 HydrophobicContact CB-CG2 3.96Å; C180-T197 WeakPolarHBondContact SG-CG2 3.31Å; C180-F201 WeakPolarHBondContact SG-CE2 3.3Å; C180-C230 VanDerWaalsContact CA-SG 3.52Å; C180-C230 HydrophobicContact CB-CB 3.65Å; C180-C230 WeakPolarHBondContact CB-SG 3.46Å; C180-C230 WeakPolarHBondContact SG-CB 3.42Å; C180-C230 CovalentContact SG-SG 2.02Å; C180-C230 PolarHBondContact SG-SG 2.93Å
181	G	77.5	Confident	67.4	Low	8 Å²	8	80.9 Å²	80.9	8%	0.082	45%	0.445	C	S	.	.	S	Bend	trans	71.3	-163.2	179.8	0	0	0	0	0	114.2	Y150	Y150-G181 WeakPolarHBondContact CE1-O 3.31Å; Y150-G181 PolarHBondContact OH-O 2.86Å
182	Y	70.1	Confident	66.1	Low	64 Å²	64	86.4 Å²	86.4	25%	0.251	47%	0.466	S	S	.	.	S	Bend	trans	-119.5	103.1	174.4	177.4	-90.5	0	0	0	108.3	R147 Y150 R151 Y200	R147-Y182 HydrophobicContact CB-CE2 3.97Å; R147-Y182 HydrophobicContact CG-CE2 4.39Å; Y150-Y182 HydrophobicContact CD1-CD2 4.07Å; R151-Y182 HydrophobicContact CB-CD1 3.75Å; R151-Y182 HydrophobicContact CB-CD2 3.88Å; R151-Y182 HydrophobicContact CB-CE1 4.02Å; R151-Y182 HydrophobicContact CB-CE2 4.1Å; R151-Y182 HydrophobicContact CB-CG 3.67Å; R151-Y182 VanDerWaalsContact CD-CE1 3.42Å; R151-Y182 HydrophobicContact CG-CD1 3.45Å; R151-Y182 VanDerWaalsContact CG-CD1 3.45Å; R151-Y182 HydrophobicContact CG-CD2 4.5Å; R151-Y182 HydrophobicContact CG-CE1 3.82Å; R151-Y182 HydrophobicContact CG-CG 3.84Å; Y182-Y200 WeakPolarHBondContact CB-OH 3.26Å
183	Y	64.6	Low	65	Low	82 Å²	82	87.3 Å²	87.3	32%	0.322	47%	0.467	S	S	.	.			trans	-142.3	144.6	173.5	-78.5	-66.2	0	0	0	114.7	M196 Y200	Y183-M196 PolarHBondContact OH-O 2.75Å; Y183-Y200 HydrophobicContact CD1-CD2 4.46Å; Y183-Y200 HydrophobicContact CD2-CD1 4.18Å; Y183-Y200 HydrophobicContact CD2-CD2 4.25Å; Y183-Y200 AromaticContact CD2-CG 3.93Å; Y183-Y200 HydrophobicContact CD2-CG 3.93Å; Y183-Y200 AromaticContact CE1-CD2 3.55Å; Y183-Y200 HydrophobicContact CE1-CD2 3.55Å; Y183-Y200 HydrophobicContact CE1-CE2 4.19Å; Y183-Y200 HydrophobicContact CE1-CG 4.07Å; Y183-Y200 AromaticContact CE2-CD1 3.56Å; Y183-Y200 HydrophobicContact CE2-CD1 3.56Å; Y183-Y200 AromaticContact CE2-CD2 3.37Å; Y183-Y200 HydrophobicContact CE2-CD2 3.37Å; Y183-Y200 HydrophobicContact CE2-CE1 4.42Å; Y183-Y200 HydrophobicContact CE2-CE2 4.25Å; Y183-Y200 AromaticContact CE2-CG 2.95Å; Y183-Y200 HydrophobicContact CE2-CG 2.95Å; Y183-Y200 AromaticContact CZ-CD2 2.96Å; Y183-Y200 AromaticContact CZ-CE2 3.96Å; Y183-Y200 AromaticContact CZ-CG 3.06Å; Y183-Y200 WeakPolarHBondContact OH-CA 3.42Å; Y183-Y200 WeakPolarHBondContact OH-CB 3.34Å; Y183-Y200 WeakPolarHBondContact OH-CD2 3.11Å; Y183-Y200 PolarHBondContact OH-N 2.61Å; Y183-Y200 VanDerWaalsContact OH-N 3.12Å
184	T	52.1	Low	64.2	Low	125 Å²	125	87.6 Å²	87.6	77%	0.767	47%	0.47	S	S	*	.			trans	-107.1	103.9	163	48.3	0	0	0	0	106.6
185	F	53.1	Low	63.4	Low	66 Å²	66	93.6 Å²	93.6	29%	0.289	49%	0.494	S	S	.	.			trans	-72.8	137.4	169.5	-64	-64.8	0	0	0	108.5	V187 E193 M196	F185-V187 PolarHBondContact O-N 3.35Å; F185-E193 HydrophobicContact CD1-CG 4.23Å; F185-E193 HydrophobicContact CD2-CG 4.05Å; F185-E193 HydrophobicContact CE1-CB 4.16Å; F185-E193 HydrophobicContact CE1-CG 4.24Å; F185-E193 HydrophobicContact CE2-CB 4.09Å; F185-E193 HydrophobicContact CE2-CG 4.04Å; F185-E193 HydrophobicContact CG-CG 4.16Å; F185-E193 HydrophobicContact CZ-CB 3.86Å; F185-E193 HydrophobicContact CZ-CG 4.15Å; F185-M196 HydrophobicContact CE1-CB 3.75Å; F185-M196 HydrophobicContact CE1-CG 4.43Å
186	P	46.5	Very low	63.1	Low	92 Å²	92	90.9 Å²	90.9	60%	0.597	49%	0.488	S	S	*	.			trans	-57.6	134	157.6	24.9	-27.8	0	0	0	107.2	D188 S189	P186-D188 PolarHBondContact O-N 2.92Å; P186-S189 PolarHBondContact O-N 3.26Å; P186-S189 VanDerWaalsContact O-N 3.11Å; P186-S189 PolarHBondContact O-OG 2.93Å
187	V	45.9	Very low	62.9	Low	143 Å²	143	87.6 Å²	87.6	87%	0.867	46%	0.464	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.6	-15.6	-171.9	-175.2	0	0	0	0	113	F185	F185-V187 PolarHBondContact O-N 3.35Å
188	D	48.4	Very low	62.8	Low	153 Å²	153	83.7 Å²	83.7	82%	0.818	44%	0.443	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.3	7.7	-172.7	-52.9	-37	0	0	0	114.4	P186 E190	P186-D188 PolarHBondContact O-N 2.92Å; D188-E190 PolarHBondContact O-N 3.11Å
189	S	49.8	Very low	63	Low	22 Å²	22	77.8 Å²	77.8	15%	0.154	42%	0.416	C	S	.	.			trans	-91.9	58.7	-177.8	68	0	0	0	0	114	P186 G191 Y192	P186-S189 PolarHBondContact O-N 3.26Å; P186-S189 VanDerWaalsContact O-N 3.11Å; P186-S189 PolarHBondContact O-OG 2.93Å; S189-G191 PolarHBondContact O-N 3.23Å; S189-Y192 PolarHBondContact O-N 2.81Å
190	E	48.7	Very low	63.1	Low	176 Å²	176	75.7 Å²	75.7	82%	0.822	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.5	125.9	172.4	-72.4	-169.6	169.8	0	0	110.7	D188	D188-E190 PolarHBondContact O-N 3.11Å
191	G	51.7	Low	63.3	Low	63 Å²	63	74.1 Å²	74.1	65%	0.649	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	91.6	-10.3	175.9	0	0	0	0	0	115.9	S189	S189-G191 PolarHBondContact O-N 3.23Å
192	Y	60.1	Low	63.4	Low	140 Å²	140	75 Å²	75	55%	0.549	39%	0.394	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.9	-10.8	178.6	-70.9	-84.4	0	0	0	113.9	S189 S194 Y195 M196	S189-Y192 PolarHBondContact O-N 2.81Å; Y192-S194 PolarHBondContact O-N 3.1Å; Y192-Y195 PolarHBondContact O-N 2.97Å; Y192-M196 VanDerWaalsContact O-CB 3.31Å; Y192-M196 WeakPolarHBondContact O-CB 3.04Å; Y192-M196 WeakPolarHBondContact O-CG 3.24Å; Y192-M196 PolarHBondContact O-N 3.25Å
193	E	63.3	Low	63.8	Low	103 Å²	103	77.7 Å²	77.7	48%	0.481	41%	0.409	S	S	.	.	H	α-helix	trans	-59.3	-47.9	-173.4	-61	-176.7	164.7	0	0	113	F185 Y195 M196 T197	F185-E193 HydrophobicContact CD1-CG 4.23Å; F185-E193 HydrophobicContact CD2-CG 4.05Å; F185-E193 HydrophobicContact CE1-CB 4.16Å; F185-E193 HydrophobicContact CE1-CG 4.24Å; F185-E193 HydrophobicContact CE2-CB 4.09Å; F185-E193 HydrophobicContact CE2-CG 4.04Å; F185-E193 HydrophobicContact CG-CG 4.16Å; F185-E193 HydrophobicContact CZ-CB 3.86Å; F185-E193 HydrophobicContact CZ-CG 4.15Å; E193-Y195 VanDerWaalsContact C-N 3.34Å; E193-Y195 PolarHBondContact O-N 3.08Å; E193-M196 PolarHBondContact O-N 2.88Å; E193-T197 VanDerWaalsContact O-CB 3.3Å; E193-T197 WeakPolarHBondContact O-CB 3.42Å; E193-T197 PolarHBondContact O-N 3.29Å; E193-T197 PolarHBondContact O-OG1 3.35Å
194	S	65.1	Low	64.6	Low	38 Å²	38	77.9 Å²	77.9	27%	0.266	41%	0.413	S	S	.	.	H	α-helix	trans	-53.6	-50.5	174.7	-49	0	0	0	0	112.3	Y192 T197 I198 L267	Y192-S194 PolarHBondContact O-N 3.1Å; S194-T197 PolarHBondContact O-N 2.8Å; S194-I198 WeakPolarHBondContact O-CG1 3.1Å; S194-I198 PolarHBondContact O-N 2.99Å; S194-L267 WeakPolarHBondContact OG-CD2 3.26Å
195	Y	68	Low	66.1	Low	127 Å²	127	71.9 Å²	71.9	50%	0.498	38%	0.377	S	S	.	.	H	α-helix	trans	-69.7	-44	-175.5	175.2	-106.7	0	0	0	111	Y192 E193 T197 I198 L199	Y192-Y195 PolarHBondContact O-N 2.97Å; E193-Y195 VanDerWaalsContact C-N 3.34Å; E193-Y195 PolarHBondContact O-N 3.08Å; Y195-T197 VanDerWaalsContact C-N 3.33Å; Y195-T197 PolarHBondContact O-N 2.96Å; Y195-I198 WeakPolarHBondContact O-CB 3.41Å; Y195-I198 PolarHBondContact O-N 3.12Å; Y195-L199 HydrophobicContact CD1-CD1 3.81Å; Y195-L199 HydrophobicContact CD1-CG 4.38Å; Y195-L199 HydrophobicContact CE1-CD1 3.26Å; Y195-L199 HydrophobicContact CE1-CG 4.02Å; Y195-L199 HydrophobicContact CE2-CD1 4.35Å; Y195-L199 HydrophobicContact CE2-CD2 4.45Å; Y195-L199 HydrophobicContact CE2-CG 4.28Å; Y195-L199 WeakPolarHBondContact O-CG 2.76Å; Y195-L199 PolarHBondContact O-N 2.02Å
196	M	71.8	Confident	67.5	Low	76 Å²	76	69.5 Å²	69.5	37%	0.374	37%	0.368	S	S	.	.	H	α-helix	trans	-65.8	-36.2	176.5	-70.2	-62.3	-178.5	0	0	112.1	Y183 F185 Y192 E193 L199 Y200	Y183-M196 PolarHBondContact OH-O 2.75Å; F185-M196 HydrophobicContact CE1-CB 3.75Å; F185-M196 HydrophobicContact CE1-CG 4.43Å; Y192-M196 VanDerWaalsContact O-CB 3.31Å; Y192-M196 WeakPolarHBondContact O-CB 3.04Å; Y192-M196 WeakPolarHBondContact O-CG 3.24Å; Y192-M196 PolarHBondContact O-N 3.25Å; E193-M196 PolarHBondContact O-N 2.88Å; M196-L199 PolarHBondContact O-N 3.44Å; M196-L199 HydrophobicContact SD-CD1 4.15Å; M196-Y200 PolarHBondContact O-N 3.3Å
197	T	75.5	Confident	69.4	Low	20 Å²	20	66.1 Å²	66.1	12%	0.123	34%	0.344	C	S	.	.	H	α-helix	trans	-63.2	-44	173	-57.2	0	0	0	0	111	C180 E193 S194 Y195 Y200 F201 V226	C180-T197 HydrophobicContact CB-CG2 3.96Å; C180-T197 WeakPolarHBondContact SG-CG2 3.31Å; E193-T197 VanDerWaalsContact O-CB 3.3Å; E193-T197 WeakPolarHBondContact O-CB 3.42Å; E193-T197 PolarHBondContact O-N 3.29Å; E193-T197 PolarHBondContact O-OG1 3.35Å; S194-T197 PolarHBondContact O-N 2.8Å; Y195-T197 VanDerWaalsContact C-N 3.33Å; Y195-T197 PolarHBondContact O-N 2.96Å; T197-Y200 WeakPolarHBondContact O-CB 3.46Å; T197-Y200 PolarHBondContact O-N 3.29Å; T197-F201 HydrophobicContact CG2-CD2 4.29Å; T197-F201 HydrophobicContact CG2-CE2 4.31Å; T197-F201 WeakPolarHBondContact O-CD2 3.27Å; T197-F201 PolarHBondContact O-N 2.89Å; T197-V226 HydrophobicContact CG2-CG1 4.17Å
198	I	75.7	Confident	71.2	Confident	23 Å²	23	59.3 Å²	59.3	12%	0.118	30%	0.303	C	S	.	.	H	α-helix	trans	-61.9	-48.3	174.5	-71	166.2	0	0	0	110.7	S194 Y195 Y200 F201 L202 Y225 V226 L249 L267	S194-I198 WeakPolarHBondContact O-CG1 3.1Å; S194-I198 PolarHBondContact O-N 2.99Å; Y195-I198 WeakPolarHBondContact O-CB 3.41Å; Y195-I198 PolarHBondContact O-N 3.12Å; I198-Y200 PolarHBondContact O-N 3.24Å; I198-F201 PolarHBondContact O-N 3.45Å; I198-L202 HydrophobicContact CG2-CD1 3.69Å; I198-L202 HydrophobicContact CG2-CG 4.26Å; I198-L202 WeakPolarHBondContact O-CB 3.05Å; I198-L202 WeakPolarHBondContact O-CG 2.87Å; I198-L202 PolarHBondContact O-N 3.21Å; I198-Y225 HydrophobicContact CG2-CD1 3.64Å; I198-Y225 HydrophobicContact CG2-CE1 4.35Å; I198-Y225 HydrophobicContact CG2-CG 3.97Å; I198-V226 HydrophobicContact CG1-CG1 4.3Å; I198-L249 HydrophobicContact CD1-CD2 3.83Å; I198-L267 HydrophobicContact CD1-CD1 4.38Å
199	L	76.8	Confident	72.8	Confident	33 Å²	33	57 Å²	57	17%	0.173	29%	0.287	C	S	.	.	H	α-helix	trans	-57.9	-35.1	177.5	-74.6	-180	0	0	0	112	Y195 M196 E203	Y195-L199 HydrophobicContact CD1-CD1 3.81Å; Y195-L199 HydrophobicContact CD1-CG 4.38Å; Y195-L199 HydrophobicContact CE1-CD1 3.26Å; Y195-L199 HydrophobicContact CE1-CG 4.02Å; Y195-L199 HydrophobicContact CE2-CD1 4.35Å; Y195-L199 HydrophobicContact CE2-CD2 4.45Å; Y195-L199 HydrophobicContact CE2-CG 4.28Å; Y195-L199 WeakPolarHBondContact O-CG 2.76Å; Y195-L199 PolarHBondContact O-N 2.02Å; M196-L199 PolarHBondContact O-N 3.44Å; M196-L199 HydrophobicContact SD-CD1 4.15Å; L199-E203 WeakPolarHBondContact O-CB 3.2Å; L199-E203 WeakPolarHBondContact O-CG 3.41Å; L199-E203 PolarHBondContact O-N 3.09Å
200	Y	81.7	Confident	74.4	Confident	2 Å²	2	60.6 Å²	60.6	1%	0.008	30%	0.3	C	S	.	.	I	π-helix	trans	-55.5	-55.8	173.7	-161.5	-135.1	0	0	0	113.9	L154 E155 Y182 Y183 M196 T197 I198 L202 E203 M204 T205	L154-Y200 HydrophobicContact CD1-CE1 4.41Å; E155-Y200 HydrophobicContact CG-CE2 4.18Å; E155-Y200 WeakPolarHBondContact CG-OH 3.48Å; Y182-Y200 WeakPolarHBondContact CB-OH 3.26Å; Y183-Y200 HydrophobicContact CD1-CD2 4.46Å; Y183-Y200 HydrophobicContact CD2-CD1 4.18Å; Y183-Y200 HydrophobicContact CD2-CD2 4.25Å; Y183-Y200 AromaticContact CD2-CG 3.93Å; Y183-Y200 HydrophobicContact CD2-CG 3.93Å; Y183-Y200 AromaticContact CE1-CD2 3.55Å; Y183-Y200 HydrophobicContact CE1-CD2 3.55Å; Y183-Y200 HydrophobicContact CE1-CE2 4.19Å; Y183-Y200 HydrophobicContact CE1-CG 4.07Å; Y183-Y200 AromaticContact CE2-CD1 3.56Å; Y183-Y200 HydrophobicContact CE2-CD1 3.56Å; Y183-Y200 AromaticContact CE2-CD2 3.37Å; Y183-Y200 HydrophobicContact CE2-CD2 3.37Å; Y183-Y200 HydrophobicContact CE2-CE1 4.42Å; Y183-Y200 HydrophobicContact CE2-CE2 4.25Å; Y183-Y200 AromaticContact CE2-CG 2.95Å; Y183-Y200 HydrophobicContact CE2-CG 2.95Å; Y183-Y200 AromaticContact CZ-CD2 2.96Å; Y183-Y200 AromaticContact CZ-CE2 3.96Å; Y183-Y200 AromaticContact CZ-CG 3.06Å; Y183-Y200 WeakPolarHBondContact OH-CA 3.42Å; Y183-Y200 WeakPolarHBondContact OH-CB 3.34Å; Y183-Y200 WeakPolarHBondContact OH-CD2 3.11Å; Y183-Y200 PolarHBondContact OH-N 2.61Å; Y183-Y200 VanDerWaalsContact OH-N 3.12Å; M196-Y200 PolarHBondContact O-N 3.3Å; T197-Y200 WeakPolarHBondContact O-CB 3.46Å; T197-Y200 PolarHBondContact O-N 3.29Å; I198-Y200 PolarHBondContact O-N 3.24Å; Y200-L202 VanDerWaalsContact C-N 3.27Å; Y200-L202 PolarHBondContact O-N 2.75Å; Y200-E203 PolarHBondContact O-N 2.62Å; Y200-M204 HydrophobicContact CD2-CB 3.58Å; Y200-M204 HydrophobicContact CD2-CG 3.87Å; Y200-M204 HydrophobicContact CE2-CB 3.81Å; Y200-M204 HydrophobicContact CE2-CG 4.38Å; Y200-M204 HydrophobicContact CG-CB 4.47Å; Y200-M204 CarbonylContact O-C 3.51Å; Y200-M204 VanDerWaalsContact O-CA 3.26Å; Y200-M204 WeakPolarHBondContact O-CA 3.07Å; Y200-M204 WeakPolarHBondContact O-CB 3.07Å; Y200-M204 PolarHBondContact O-N 3.2Å; Y200-T205 HydrophobicContact CD1-CG2 4.07Å; Y200-T205 HydrophobicContact CE1-CG2 3.87Å; Y200-T205 HydrophobicContact CG-CG2 4.49Å; Y200-T205 PolarHBondContact O-N 3.28Å; Y200-T205 VanDerWaalsContact O-N 3.11Å
201	F	83.4	Confident	76	Confident	0 Å²	0	55.5 Å²	55.5	0%	0	28%	0.276	C	S	.	.	I	π-helix	trans	-72.9	-40.6	-166.8	-87.1	-79.1	0	0	0	106	L154 Y158 C180 T197 I198 T205 F207 G208 Y225 V226 P227	L154-F201 HydrophobicContact CD2-CE1 4.38Å; Y158-F201 HydrophobicContact CE1-CE1 4.45Å; C180-F201 WeakPolarHBondContact SG-CE2 3.3Å; T197-F201 HydrophobicContact CG2-CD2 4.29Å; T197-F201 HydrophobicContact CG2-CE2 4.31Å; T197-F201 WeakPolarHBondContact O-CD2 3.27Å; T197-F201 PolarHBondContact O-N 2.89Å; I198-F201 PolarHBondContact O-N 3.45Å; F201-T205 VanDerWaalsContact CA-OG1 3.3Å; F201-T205 WeakPolarHBondContact CA-OG1 2.84Å; F201-T205 HydrophobicContact CD1-CG2 3.8Å; F201-T205 HydrophobicContact CE1-CG2 4.22Å; F201-T205 HydrophobicContact CG-CG2 4.34Å; F201-T205 PolarHBondContact O-OG1 2.96Å; F201-F207 AromaticContact CD1-CD1 3.99Å; F201-F207 HydrophobicContact CD1-CD1 3.99Å; F201-G208 WeakPolarHBondContact O-CA 3.49Å; F201-G208 PolarHBondContact O-N 3.48Å; F201-Y225 WeakPolarHBondContact CB-O 2.93Å; F201-V226 HydrophobicContact CB-CG1 4.43Å; F201-V226 HydrophobicContact CD2-CB 4.28Å; F201-V226 HydrophobicContact CD2-CG1 3.84Å; F201-V226 HydrophobicContact CG-CG1 4.36Å; F201-P227 HydrophobicContact CD1-CG 3.85Å; F201-P227 VanDerWaalsContact CE1-CD 3.41Å; F201-P227 HydrophobicContact CE1-CG 3.39Å; F201-P227 HydrophobicContact CZ-CG 3.85Å
202	L	78.6	Confident	77.1	Confident	28 Å²	28	52.5 Å²	52.5	15%	0.147	25%	0.245	C	C	.	.	I	π-helix	trans	-60.1	-50.3	173.4	-71.7	178.8	0	0	0	114.5	I198 Y200 Q209 Y225	I198-L202 HydrophobicContact CG2-CD1 3.69Å; I198-L202 HydrophobicContact CG2-CG 4.26Å; I198-L202 WeakPolarHBondContact O-CB 3.05Å; I198-L202 WeakPolarHBondContact O-CG 2.87Å; I198-L202 PolarHBondContact O-N 3.21Å; Y200-L202 VanDerWaalsContact C-N 3.27Å; Y200-L202 PolarHBondContact O-N 2.75Å; L202-Q209 VanDerWaalsContact O-CG 3.27Å; L202-Q209 WeakPolarHBondContact O-CG 3.44Å; L202-Y225 HydrophobicContact CD1-CD1 3.56Å; L202-Y225 HydrophobicContact CD1-CE1 3.71Å; L202-Y225 HydrophobicContact CD2-CD1 3.65Å; L202-Y225 HydrophobicContact CD2-CE1 4.03Å; L202-Y225 HydrophobicContact CG-CD1 3.76Å; L202-Y225 HydrophobicContact CG-CE1 4.28Å
203	E	79.9	Confident	78	Confident	120 Å²	120	49 Å²	49	56%	0.561	24%	0.242	S	C	*	.	I	π-helix	trans	-99.5	-37.3	-166.7	-59.7	-173.9	168.1	0	0	112.9	L199 Y200 Q209	L199-E203 WeakPolarHBondContact O-CB 3.2Å; L199-E203 WeakPolarHBondContact O-CG 3.41Å; L199-E203 PolarHBondContact O-N 3.09Å; Y200-E203 PolarHBondContact O-N 2.62Å; E203-Q209 PolarHBondContact O-NE2 3.25Å
204	M	81.3	Confident	78.7	Confident	85 Å²	85	47.4 Å²	47.4	42%	0.419	25%	0.252	S	S	.	.	I	π-helix	trans	-100.1	-15.8	-172.1	-54.1	-62.1	-65	0	0	113.6	E155 Y200	E155-M204 WeakPolarHBondContact CA-O 3.07Å; E155-M204 WeakPolarHBondContact CB-O 3.18Å; E155-M204 WeakPolarHBondContact CG-O 3.44Å; Y200-M204 HydrophobicContact CD2-CB 3.58Å; Y200-M204 HydrophobicContact CD2-CG 3.87Å; Y200-M204 HydrophobicContact CE2-CB 3.81Å; Y200-M204 HydrophobicContact CE2-CG 4.38Å; Y200-M204 HydrophobicContact CG-CB 4.47Å; Y200-M204 CarbonylContact O-C 3.51Å; Y200-M204 VanDerWaalsContact O-CA 3.26Å; Y200-M204 WeakPolarHBondContact O-CA 3.07Å; Y200-M204 WeakPolarHBondContact O-CB 3.07Å; Y200-M204 PolarHBondContact O-N 3.2Å
205	T	83.7	Confident	79.3	Confident	0 Å²	0	47.2 Å²	47.2	0%	0	25%	0.248	C	C	.	.			trans	-111.6	140.1	179.4	80.7	0	0	0	0	113	L154 E155 Y200 F201 F207 G208 Q209	L154-T205 WeakPolarHBondContact O-CB 3.33Å; L154-T205 WeakPolarHBondContact O-CG2 3.37Å; E155-T205 CarbonylContact O-C 3.56Å; E155-T205 VanDerWaalsContact O-CA 3.31Å; E155-T205 WeakPolarHBondContact O-CA 3.39Å; Y200-T205 HydrophobicContact CD1-CG2 4.07Å; Y200-T205 HydrophobicContact CE1-CG2 3.87Å; Y200-T205 HydrophobicContact CG-CG2 4.49Å; Y200-T205 PolarHBondContact O-N 3.28Å; Y200-T205 VanDerWaalsContact O-N 3.11Å; F201-T205 VanDerWaalsContact CA-OG1 3.3Å; F201-T205 WeakPolarHBondContact CA-OG1 2.84Å; F201-T205 HydrophobicContact CD1-CG2 3.8Å; F201-T205 HydrophobicContact CE1-CG2 4.22Å; F201-T205 HydrophobicContact CG-CG2 4.34Å; F201-T205 PolarHBondContact O-OG1 2.96Å; T205-F207 PolarHBondContact O-N 3.29Å; T205-G208 PolarHBondContact O-N 3.2Å; T205-G208 PolarHBondContact OG1-N 3.48Å; T205-Q209 WeakPolarHBondContact O-CG 3.32Å; T205-Q209 PolarHBondContact O-N 3.27Å
206	S	81.8	Confident	79.5	Confident	16 Å²	16	43.5 Å²	43.5	11%	0.112	25%	0.248	C	C	.	.	H	α-helix	trans	-59.5	-32.5	173.4	65.8	0	0	0	0	111.9	E155 S156 E160 K210	E155-S206 PolarHBondContact O-N 3.2Å; S156-S206 WeakPolarHBondContact O-CB 3.33Å; S156-S206 PolarHBondContact O-OG 3.38Å; E160-S206 PolarHBondContact OE1-OG 3.11Å; S206-K210 WeakPolarHBondContact O-CB 3.17Å; S206-K210 VanDerWaalsContact O-CG 3.26Å; S206-K210 WeakPolarHBondContact O-CG 3.19Å; S206-K210 PolarHBondContact O-N 3.46Å
207	F	87.1	Confident	79.4	Confident	20 Å²	20	46.8 Å²	46.8	9%	0.088	26%	0.257	C	S	.	.	H	α-helix	trans	-53.6	-59.6	172.4	167.7	-98.8	0	0	0	112	Y158 K159 F201 T205 Q209 K210 Q211 P227	Y158-F207 HydrophobicContact CD1-CB 4.17Å; Y158-F207 HydrophobicContact CD1-CG 4.45Å; K159-F207 HydrophobicContact CB-CD2 3.76Å; K159-F207 HydrophobicContact CB-CE2 4.5Å; K159-F207 HydrophobicContact CG-CD2 3.95Å; K159-F207 HydrophobicContact CG-CE2 4.39Å; F201-F207 AromaticContact CD1-CD1 3.99Å; F201-F207 HydrophobicContact CD1-CD1 3.99Å; T205-F207 PolarHBondContact O-N 3.29Å; F207-Q209 PolarHBondContact O-N 3.03Å; F207-K210 PolarHBondContact O-N 2.94Å; F207-Q211 HydrophobicContact CD2-CG 4.32Å; F207-Q211 HydrophobicContact CE1-CG 4.13Å; F207-Q211 HydrophobicContact CE2-CG 3.93Å; F207-Q211 HydrophobicContact CZ-CG 3.83Å; F207-Q211 WeakPolarHBondContact O-CG 3.31Å; F207-Q211 PolarHBondContact O-N 3.44Å; F207-P227 HydrophobicContact CD1-CG 4.25Å; F207-P227 HydrophobicContact CE1-CG 4.04Å; F207-P227 HydrophobicContact CZ-CG 4.42Å
208	G	82.5	Confident	79.2	Confident	0 Å²	0	50.1 Å²	50.1	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-71	-31.5	-174.9	0	0	0	0	0	112.8	F201 T205 K210 Q211 A212	F201-G208 WeakPolarHBondContact O-CA 3.49Å; F201-G208 PolarHBondContact O-N 3.48Å; T205-G208 PolarHBondContact O-N 3.2Å; T205-G208 PolarHBondContact OG1-N 3.48Å; G208-K210 VanDerWaalsContact C-N 3.34Å; G208-K210 PolarHBondContact O-N 2.92Å; G208-Q211 PolarHBondContact O-N 3.31Å; G208-A212 WeakPolarHBondContact O-CB 3.36Å; G208-A212 PolarHBondContact O-N 2.88Å
209	Q	81.7	Confident	78.9	Confident	106 Å²	106	53.8 Å²	53.8	50%	0.495	30%	0.304	S	S	.	.	H	α-helix	trans	-62.4	-39.7	170.9	-66.5	-178.7	8.5	0	0	112	L202 E203 T205 F207 S213	L202-Q209 VanDerWaalsContact O-CG 3.27Å; L202-Q209 WeakPolarHBondContact O-CG 3.44Å; E203-Q209 PolarHBondContact O-NE2 3.25Å; T205-Q209 WeakPolarHBondContact O-CG 3.32Å; T205-Q209 PolarHBondContact O-N 3.27Å; F207-Q209 PolarHBondContact O-N 3.03Å; Q209-S213 WeakPolarHBondContact O-CB 3.33Å; Q209-S213 PolarHBondContact O-N 2.86Å; Q209-S213 PolarHBondContact O-OG 2.86Å
210	K	84.7	Confident	78.5	Confident	97 Å²	97	54.5 Å²	54.5	42%	0.422	32%	0.32	S	S	.	.	H	α-helix	trans	-66.4	-40.8	173.6	-76.6	175	-173.4	171.5	0	112	E160 S206 F207 G208 S213 G214	E160-K210 VanDerWaalsContact CD-NZ 3.29Å; E160-K210 VanDerWaalsContact CG-NZ 3.25Å; E160-K210 IonicContact OE1-NZ 2.83Å; E160-K210 PolarHBondContact OE1-NZ 3.49Å; S206-K210 WeakPolarHBondContact O-CB 3.17Å; S206-K210 VanDerWaalsContact O-CG 3.26Å; S206-K210 WeakPolarHBondContact O-CG 3.19Å; S206-K210 PolarHBondContact O-N 3.46Å; F207-K210 PolarHBondContact O-N 2.94Å; G208-K210 VanDerWaalsContact C-N 3.34Å; G208-K210 PolarHBondContact O-N 2.92Å; K210-S213 WeakPolarHBondContact CA-OG 2.92Å; K210-S213 PolarHBondContact O-OG 2.83Å; K210-G214 PolarHBondContact O-N 3.23Å
211	Q	82.4	Confident	77.9	Confident	68 Å²	68	55.3 Å²	55.3	32%	0.318	33%	0.329	S	S	.	.	H	α-helix	trans	-62.9	-46	175.7	-65.7	-65.5	-32.6	0	0	111.6	F207 G208 G214 V223	F207-Q211 HydrophobicContact CD2-CG 4.32Å; F207-Q211 HydrophobicContact CE1-CG 4.13Å; F207-Q211 HydrophobicContact CE2-CG 3.93Å; F207-Q211 HydrophobicContact CZ-CG 3.83Å; F207-Q211 WeakPolarHBondContact O-CG 3.31Å; F207-Q211 PolarHBondContact O-N 3.44Å; G208-Q211 PolarHBondContact O-N 3.31Å; Q211-G214 PolarHBondContact O-N 3.46Å; Q211-V223 HydrophobicContact CB-CG2 3.76Å
212	A	73.2	Confident	77.6	Confident	0 Å²	0	60.9 Å²	60.9	0%	0	36%	0.358	C	S	.	.	H	α-helix	trans	-67.9	-39.9	179.7	0	0	0	0	0	112.8	G208 I215 W217	G208-A212 WeakPolarHBondContact O-CB 3.36Å; G208-A212 PolarHBondContact O-N 2.88Å; A212-I215 WeakPolarHBondContact O-CG1 3.3Å; A212-I215 PolarHBondContact O-N 3.48Å; A212-W217 HydrophobicContact CB-CD2 4.41Å; A212-W217 HydrophobicContact CB-CE3 4.22Å; A212-W217 HydrophobicContact CB-CH2 3.6Å; A212-W217 HydrophobicContact CB-CZ2 3.77Å; A212-W217 HydrophobicContact CB-CZ3 3.84Å; A212-W217 PolarHBondContact O-N 3.46Å
213	S	79.9	Confident	77.6	Confident	68 Å²	68	59.6 Å²	59.6	48%	0.476	35%	0.351	S	S	.	.	H	α-helix	trans	-68.9	-33.3	175	59.3	0	0	0	0	112.7	Q209 K210 I215 G216	Q209-S213 WeakPolarHBondContact O-CB 3.33Å; Q209-S213 PolarHBondContact O-N 2.86Å; Q209-S213 PolarHBondContact O-OG 2.86Å; K210-S213 WeakPolarHBondContact CA-OG 2.92Å; K210-S213 PolarHBondContact O-OG 2.83Å; S213-I215 VanDerWaalsContact C-N 3.26Å; S213-I215 PolarHBondContact O-N 3.19Å; S213-G216 PolarHBondContact O-N 3.4Å
214	G	78.9	Confident	77.6	Confident	68 Å²	68	55.7 Å²	55.7	70%	0.701	34%	0.337	S	S	*	.	H	α-helix	trans	-61	-30	176.3	0	0	0	0	0	114.4	K210 Q211 G216	K210-G214 PolarHBondContact O-N 3.23Å; Q211-G214 PolarHBondContact O-N 3.46Å; G214-G216 VanDerWaalsContact C-N 3.34Å
215	I	76.5	Confident	77.4	Confident	34 Å²	34	52.5 Å²	52.5	17%	0.174	32%	0.32	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.3	3.7	173.4	63.2	157.8	0	0	0	113.3	A212 S213 W217 V218 L222 V223 Y243	A212-I215 WeakPolarHBondContact O-CG1 3.3Å; A212-I215 PolarHBondContact O-N 3.48Å; S213-I215 VanDerWaalsContact C-N 3.26Å; S213-I215 PolarHBondContact O-N 3.19Å; I215-W217 PolarHBondContact O-N 2.7Å; I215-V218 WeakPolarHBondContact O-CB 3.4Å; I215-V218 VanDerWaalsContact O-CG2 3.28Å; I215-V218 WeakPolarHBondContact O-CG2 3.34Å; I215-V218 PolarHBondContact O-N 3.44Å; I215-V218 VanDerWaalsContact O-N 3.07Å; I215-L222 WeakPolarHBondContact CG2-O 3.42Å; I215-V223 HydrophobicContact CD1-CB 4.03Å; I215-V223 HydrophobicContact CD1-CG2 4.49Å; I215-Y243 HydrophobicContact CD1-CD1 4.07Å; I215-Y243 HydrophobicContact CD1-CD2 4.1Å; I215-Y243 HydrophobicContact CD1-CG 3.56Å
216	G	73.3	Confident	77.3	Confident	49 Å²	49	53.3 Å²	53.3	51%	0.505	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	60	24.8	-178.3	0	0	0	0	0	114	S213 G214 V218	S213-G216 PolarHBondContact O-N 3.4Å; G214-G216 VanDerWaalsContact C-N 3.34Å; G216-V218 PolarHBondContact O-N 3.29Å; G216-V218 VanDerWaalsContact O-N 3.11Å
217	W	69.6	Low	77.5	Confident	145 Å²	145	52.7 Å²	52.7	55%	0.549	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	56.7	21.7	-173.3	-55.5	92.2	0	0	0	114.2	A212 I215 S219 Y243	A212-W217 HydrophobicContact CB-CD2 4.41Å; A212-W217 HydrophobicContact CB-CE3 4.22Å; A212-W217 HydrophobicContact CB-CH2 3.6Å; A212-W217 HydrophobicContact CB-CZ2 3.77Å; A212-W217 HydrophobicContact CB-CZ3 3.84Å; A212-W217 PolarHBondContact O-N 3.46Å; I215-W217 PolarHBondContact O-N 2.7Å; W217-S219 PolarHBondContact O-N 3.05Å; W217-Y243 HydrophobicContact CB-CE1 4.5Å; W217-Y243 HydrophobicContact CE3-CE1 4.27Å; W217-Y243 HydrophobicContact CE3-CE2 4.02Å; W217-Y243 AromaticContact CE3-CZ 3.59Å; W217-Y243 VanDerWaalsContact CE3-OH 3.25Å; W217-Y243 HydrophobicContact CZ3-CE2 4.16Å; W217-Y243 WeakPolarHBondContact O-CE1 3.47Å
218	V	70.7	Confident	77.3	Confident	90 Å²	90	60.2 Å²	60.2	55%	0.545	35%	0.349	S	S	.	.			trans	-74.3	125.1	-177.4	179.7	0	0	0	0	109.8	I215 G216 G220 G221	I215-V218 WeakPolarHBondContact O-CB 3.4Å; I215-V218 VanDerWaalsContact O-CG2 3.28Å; I215-V218 WeakPolarHBondContact O-CG2 3.34Å; I215-V218 PolarHBondContact O-N 3.44Å; I215-V218 VanDerWaalsContact O-N 3.07Å; G216-V218 PolarHBondContact O-N 3.29Å; G216-V218 VanDerWaalsContact O-N 3.11Å; V218-G220 PolarHBondContact O-N 3.36Å; V218-G221 PolarHBondContact O-N 3.18Å; V218-G221 VanDerWaalsContact O-N 3.14Å
219	S	69.3	Low	77.3	Confident	100 Å²	100	60.5 Å²	60.5	70%	0.699	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.3	126.7	171.9	-175.7	0	0	0	0	109.8	W217	W217-S219 PolarHBondContact O-N 3.05Å
220	G	67.9	Low	77.3	Confident	49 Å²	49	56 Å²	56	51%	0.505	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	101.2	-11.6	-175.9	0	0	0	0	0	115.2	V218 I242 Y243	V218-G220 PolarHBondContact O-N 3.36Å; G220-I242 VanDerWaalsContact CA-CG2 3.46Å; G220-Y243 PolarHBondContact N-O 3.11Å; G220-Y243 VanDerWaalsContact N-O 3.12Å
221	G	70	Confident	76.9	Confident	18 Å²	18	51.5 Å²	51.5	19%	0.186	31%	0.312	C	S	.	.			trans	-69.8	139.3	174.7	0	0	0	0	0	112.1	V218 V223 Y243	V218-G221 PolarHBondContact O-N 3.18Å; V218-G221 VanDerWaalsContact O-N 3.14Å; G221-V223 PolarHBondContact O-N 2.86Å; G221-Y243 WeakPolarHBondContact O-CB 3.18Å; G221-Y243 PolarHBondContact O-N 3.17Å
222	L	76.9	Confident	76.2	Confident	117 Å²	117	52.8 Å²	52.8	61%	0.613	32%	0.32	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76.8	121.2	171.7	-173.3	75.1	0	0	0	108.9	I215	I215-L222 WeakPolarHBondContact CG2-O 3.42Å
223	V	77.5	Confident	76	Confident	1 Å²	1	55.9 Å²	55.9	1%	0.006	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	136.2	179.1	66.5	0	0	0	0	110.1	Q211 I215 G221 Y225 S240 D241 Y243	Q211-V223 HydrophobicContact CB-CG2 3.76Å; I215-V223 HydrophobicContact CD1-CB 4.03Å; I215-V223 HydrophobicContact CD1-CG2 4.49Å; G221-V223 PolarHBondContact O-N 2.86Å; V223-Y225 HydrophobicContact CG1-CD1 4.01Å; V223-Y225 HydrophobicContact CG1-CD2 4.04Å; V223-Y225 HydrophobicContact CG1-CE1 3.53Å; V223-Y225 HydrophobicContact CG1-CE2 3.52Å; V223-Y225 HydrophobicContact CG1-CG 4.27Å; V223-Y225 PolarHBondContact O-N 3.06Å; V223-S240 WeakPolarHBondContact O-CA 3.38Å; V223-S240 WeakPolarHBondContact O-CB 3.45Å; V223-D241 PolarHBondContact N-O 3.11Å; V223-D241 PolarHBondContact O-N 3.49Å; V223-D241 VanDerWaalsContact O-N 3.1Å; V223-Y243 HydrophobicContact CG1-CD2 4.29Å
224	S	81.6	Confident	75.3	Confident	38 Å²	38	57.7 Å²	57.7	27%	0.266	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	102.7	171.2	-59.8	0	0	0	0	108.6	V226 S239	S224-V226 VanDerWaalsContact C-N 3.35Å; S224-S239 CarbonylContact C-O 3.48Å; S224-S239 WeakPolarHBondContact CA-O 3.49Å
225	Y	75.3	Confident	74.8	Confident	18 Å²	18	59.9 Å²	59.9	7%	0.071	34%	0.335	C	S	.	.			trans	-70.8	-33.2	-177.5	-74.3	-68.2	0	0	0	112.6	I198 F201 L202 V223 S239 D241 I242 Y243 L249	I198-Y225 HydrophobicContact CG2-CD1 3.64Å; I198-Y225 HydrophobicContact CG2-CE1 4.35Å; I198-Y225 HydrophobicContact CG2-CG 3.97Å; F201-Y225 WeakPolarHBondContact CB-O 2.93Å; L202-Y225 HydrophobicContact CD1-CD1 3.56Å; L202-Y225 HydrophobicContact CD1-CE1 3.71Å; L202-Y225 HydrophobicContact CD2-CD1 3.65Å; L202-Y225 HydrophobicContact CD2-CE1 4.03Å; L202-Y225 HydrophobicContact CG-CD1 3.76Å; L202-Y225 HydrophobicContact CG-CE1 4.28Å; V223-Y225 HydrophobicContact CG1-CD1 4.01Å; V223-Y225 HydrophobicContact CG1-CD2 4.04Å; V223-Y225 HydrophobicContact CG1-CE1 3.53Å; V223-Y225 HydrophobicContact CG1-CE2 3.52Å; V223-Y225 HydrophobicContact CG1-CG 4.27Å; V223-Y225 PolarHBondContact O-N 3.06Å; Y225-S239 PolarHBondContact N-O 3.24Å; Y225-D241 HydrophobicContact CD2-CB 4.09Å; Y225-D241 HydrophobicContact CE2-CB 3.74Å; Y225-I242 PolarHBondContact OH-O 3.44Å; Y225-Y243 WeakPolarHBondContact OH-CA 3.32Å; Y225-L249 HydrophobicContact CE2-CD1 4.18Å
226	V	82.5	Confident	74.4	Confident	17 Å²	17	63.2 Å²	63.2	10%	0.103	37%	0.368	C	S	.	.	S	Bend	trans	-135.7	163	178.8	-61.6	0	0	0	0	109.7	T197 I198 F201 S224 C230 S239	T197-V226 HydrophobicContact CG2-CG1 4.17Å; I198-V226 HydrophobicContact CG1-CG1 4.3Å; F201-V226 HydrophobicContact CB-CG1 4.43Å; F201-V226 HydrophobicContact CD2-CB 4.28Å; F201-V226 HydrophobicContact CD2-CG1 3.84Å; F201-V226 HydrophobicContact CG-CG1 4.36Å; S224-V226 VanDerWaalsContact C-N 3.35Å; V226-C230 HydrophobicContact CB-CB 4.38Å; V226-C230 HydrophobicContact CG2-CB 4.26Å; V226-S239 PolarHBondContact N-O 2.05Å; V226-S239 WeakPolarHBondContact O-CB 3.17Å
227	P	85.8	Confident	74	Confident	4 Å²	4	63 Å²	63	3%	0.026	37%	0.365	C	S	.	.			trans	-72.8	156.6	176.2	-16.1	32.1	0	0	0	112.1	Y158 F201 F207 S229 C230	Y158-P227 HydrophobicContact CD1-CG 4.33Å; Y158-P227 HydrophobicContact CE1-CB 3.79Å; Y158-P227 HydrophobicContact CE1-CG 3.31Å; Y158-P227 WeakPolarHBondContact OH-CB 3.17Å; F201-P227 HydrophobicContact CD1-CG 3.85Å; F201-P227 VanDerWaalsContact CE1-CD 3.41Å; F201-P227 HydrophobicContact CE1-CG 3.39Å; F201-P227 HydrophobicContact CZ-CG 3.85Å; F207-P227 HydrophobicContact CD1-CG 4.25Å; F207-P227 HydrophobicContact CE1-CG 4.04Å; F207-P227 HydrophobicContact CZ-CG 4.42Å; P227-S229 WeakPolarHBondContact CB-OG 3.06Å; P227-S229 PolarHBondContact O-N 2.96Å; P227-C230 VanDerWaalsContact O-CB 3.32Å; P227-C230 WeakPolarHBondContact O-CB 3.09Å; P227-C230 PolarHBondContact O-N 3.38Å; P227-C230 VanDerWaalsContact O-N 3.09Å
228	R	83.1	Confident	74.2	Confident	178 Å²	178	57.6 Å²	57.6	67%	0.672	35%	0.349	S	S	*	.	G	3₁₀ helix	trans	-64.6	-22.9	177.4	-74.2	-175.7	-177.4	-174.8	2.6	113.8	C230 C231 S239	R228-C230 PolarHBondContact O-N 3.48Å; R228-C231 WeakPolarHBondContact O-CA 3.38Å; R228-C231 WeakPolarHBondContact O-CB 3.45Å; R228-C231 PolarHBondContact O-N 3.3Å; R228-C231 PolarHBondContact O-SG 3.29Å; R228-S239 VanDerWaalsContact CG-OG 3.29Å; R228-S239 WeakPolarHBondContact CG-OG 3.3Å
229	S	83.2	Confident	74.5	Confident	5 Å²	5	53.7 Å²	53.7	4%	0.035	33%	0.326	C	S	.	.	G	3₁₀ helix	trans	-65.6	-26.8	173.9	45.4	0	0	0	0	113	Y158 D171 Q174 P227 C231	Y158-S229 PolarHBondContact OH-OG 2.9Å; D171-S229 VanDerWaalsContact CA-CB 3.42Å; D171-S229 WeakPolarHBondContact O-CB 3.41Å; D171-S229 WeakPolarHBondContact OD1-CB 3.32Å; D171-S229 PolarHBondContact OD1-OG 3.46Å; Q174-S229 PolarHBondContact OE1-OG 3.31Å; P227-S229 WeakPolarHBondContact CB-OG 3.06Å; P227-S229 PolarHBondContact O-N 2.96Å; S229-C231 PolarHBondContact O-N 3.48Å
230	C	80.9	Confident	74.6	Confident	11 Å²	11	50.1 Å²	50.1	7%	0.074	30%	0.301	C	S	.	.	G	3₁₀ helix	trans	-68.7	-14.3	169.6	-68.6	0	0	0	0	112.3	C180 V226 P227 R228 I232 L265	C180-C230 VanDerWaalsContact CA-SG 3.52Å; C180-C230 HydrophobicContact CB-CB 3.65Å; C180-C230 WeakPolarHBondContact CB-SG 3.46Å; C180-C230 WeakPolarHBondContact SG-CB 3.42Å; C180-C230 CovalentContact SG-SG 2.02Å; C180-C230 PolarHBondContact SG-SG 2.93Å; V226-C230 HydrophobicContact CB-CB 4.38Å; V226-C230 HydrophobicContact CG2-CB 4.26Å; P227-C230 VanDerWaalsContact O-CB 3.32Å; P227-C230 WeakPolarHBondContact O-CB 3.09Å; P227-C230 PolarHBondContact O-N 3.38Å; P227-C230 VanDerWaalsContact O-N 3.09Å; R228-C230 PolarHBondContact O-N 3.48Å; C230-I232 PolarHBondContact O-N 3.31Å; C230-L265 WeakPolarHBondContact O-CD1 3.17Å
231	C	75.8	Confident	74.7	Confident	3 Å²	3	49 Å²	49	2%	0.02	28%	0.284	C	S	.	.			trans	-76.9	104.5	177.7	-52.9	0	0	0	0	112.3	R228 S229 K233 C238 L265	R228-C231 WeakPolarHBondContact O-CA 3.38Å; R228-C231 WeakPolarHBondContact O-CB 3.45Å; R228-C231 PolarHBondContact O-N 3.3Å; R228-C231 PolarHBondContact O-SG 3.29Å; S229-C231 PolarHBondContact O-N 3.48Å; C231-K233 WeakPolarHBondContact CB-O 3.06Å; C231-K233 PolarHBondContact O-N 3.38Å; C231-C238 HydrophobicContact CB-CB 3.94Å; C231-C238 WeakPolarHBondContact CB-SG 3.39Å; C231-C238 WeakPolarHBondContact SG-CB 3.29Å; C231-C238 CovalentContact SG-SG 2.05Å; C231-C238 PolarHBondContact SG-SG 2.81Å; C231-L265 HydrophobicContact CB-CB 4.12Å; C231-L265 HydrophobicContact CB-CD1 4.5Å; C231-L265 HydrophobicContact CB-CD2 3.34Å; C231-L265 HydrophobicContact CB-CG 4.1Å; C231-L265 WeakPolarHBondContact SG-CD2 3.11Å
232	I	67.5	Low	74.7	Confident	95 Å²	95	52 Å²	52	49%	0.487	30%	0.295	S	S	.	.	S	Bend	trans	-45	-40.7	162.5	-62.9	167	0	0	0	111.3	C230 H264 L265	C230-I232 PolarHBondContact O-N 3.31Å; I232-H264 WeakPolarHBondContact CB-O 3.43Å; I232-H264 WeakPolarHBondContact CD1-O 3.05Å; I232-H264 WeakPolarHBondContact CG1-O 3.36Å; I232-H264 WeakPolarHBondContact CG2-O 3.42Å; I232-L265 HydrophobicContact CB-CB 3.94Å; I232-L265 HydrophobicContact CB-CD1 4.34Å; I232-L265 HydrophobicContact CD1-CD1 4.39Å; I232-L265 HydrophobicContact CG1-CD1 4.14Å
233	K	69.5	Low	74.2	Confident	66 Å²	66	49.6 Å²	49.6	29%	0.287	28%	0.278	S	S	.	.	S	Bend	trans	-121.2	116.9	167.4	-70.9	-170.8	173.5	-173.7	0	110.6	C231 E235 T262 T263	C231-K233 WeakPolarHBondContact CB-O 3.06Å; C231-K233 PolarHBondContact O-N 3.38Å; K233-E235 HydrophobicContact CB-CG 4.28Å; K233-E235 PolarHBondContact O-N 3.1Å; K233-T262 WeakPolarHBondContact CE-O 3.31Å; K233-T262 PolarHBondContact NZ-O 2.77Å; K233-T263 HydrophobicContact CD-CG2 3.56Å; K233-T263 VanDerWaalsContact NZ-CA 3.32Å; K233-T263 VanDerWaalsContact NZ-CB 3.28Å; K233-T263 PolarHBondContact NZ-OG1 3.45Å
234	P	64.7	Low	73.4	Confident	105 Å²	105	51.7 Å²	51.7	68%	0.682	30%	0.3	S	S	*	.			trans	-77.9	62.8	-177.3	32.8	-36.2	0	0	0	111.5
235	E	69.7	Low	72.4	Confident	115 Å²	115	51.2 Å²	51.2	54%	0.537	30%	0.298	S	S	.	.			trans	-85.9	154.6	176.2	-67.2	178.9	-163.9	0	0	111.2	K233 G237 C238	K233-E235 HydrophobicContact CB-CG 4.28Å; K233-E235 PolarHBondContact O-N 3.1Å; E235-G237 PolarHBondContact O-N 3.35Å; E235-C238 VanDerWaalsContact O-CB 3.3Å; E235-C238 WeakPolarHBondContact O-CB 3.35Å; E235-C238 PolarHBondContact O-N 3.14Å; E235-C238 VanDerWaalsContact O-N 3.12Å; E235-C238 PolarHBondContact O-SG 3.12Å
236	A	66.8	Low	71.2	Confident	104 Å²	104	54.7 Å²	54.7	86%	0.86	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.6	122.6	176.2	0	0	0	0	0	109.7
237	G	66.4	Low	69.3	Low	43 Å²	43	61.5 Å²	61.5	44%	0.443	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	91.1	-0.9	-178	0	0	0	0	0	115.2	E235 S239 S240	E235-G237 PolarHBondContact O-N 3.35Å; G237-S239 PolarHBondContact O-N 3.21Å; G237-S239 VanDerWaalsContact O-N 3.14Å; G237-S240 PolarHBondContact O-N 3Å
238	C	73.5	Confident	67.4	Low	32 Å²	32	62.6 Å²	62.6	22%	0.216	37%	0.365	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.2	-31.1	-178.4	71.3	0	0	0	0	113.8	C231 E235 L265	C231-C238 HydrophobicContact CB-CB 3.94Å; C231-C238 WeakPolarHBondContact CB-SG 3.39Å; C231-C238 WeakPolarHBondContact SG-CB 3.29Å; C231-C238 CovalentContact SG-SG 2.05Å; C231-C238 PolarHBondContact SG-SG 2.81Å; E235-C238 VanDerWaalsContact O-CB 3.3Å; E235-C238 WeakPolarHBondContact O-CB 3.35Å; E235-C238 PolarHBondContact O-N 3.14Å; E235-C238 VanDerWaalsContact O-N 3.12Å; E235-C238 PolarHBondContact O-SG 3.12Å; C238-L265 HydrophobicContact CB-CD2 3.62Å; C238-L265 WeakPolarHBondContact O-CD2 3.33Å
239	S	76.2	Confident	65.6	Low	8 Å²	8	56 Å²	56	6%	0.056	34%	0.343	C	S	.	.	T	Hydrogen-bonded Turn	trans	-109.3	-3.2	-172.6	23.7	0	0	0	0	113.8	S224 Y225 V226 R228 G237	S224-S239 CarbonylContact C-O 3.48Å; S224-S239 WeakPolarHBondContact CA-O 3.49Å; Y225-S239 PolarHBondContact N-O 3.24Å; V226-S239 PolarHBondContact N-O 2.05Å; V226-S239 WeakPolarHBondContact O-CB 3.17Å; R228-S239 VanDerWaalsContact CG-OG 3.29Å; R228-S239 WeakPolarHBondContact CG-OG 3.3Å; G237-S239 PolarHBondContact O-N 3.21Å; G237-S239 VanDerWaalsContact O-N 3.14Å
240	S	72.4	Confident	63.6	Low	26 Å²	26	61.1 Å²	61.1	18%	0.182	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	135.1	-167.7	62.3	0	0	0	0	112.4	V223 G237	V223-S240 WeakPolarHBondContact O-CA 3.38Å; V223-S240 WeakPolarHBondContact O-CB 3.45Å; G237-S240 PolarHBondContact O-N 3Å
241	D	69.5	Low	61.6	Low	26 Å²	26	64.2 Å²	64.2	14%	0.139	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140	174.6	172.6	-149.4	-22.3	0	0	0	110.2	V223 Y225 L249 K252	V223-D241 PolarHBondContact N-O 3.11Å; V223-D241 PolarHBondContact O-N 3.49Å; V223-D241 VanDerWaalsContact O-N 3.1Å; Y225-D241 HydrophobicContact CD2-CB 4.09Å; Y225-D241 HydrophobicContact CE2-CB 3.74Å; D241-L249 HydrophobicContact CB-CD1 4.37Å; D241-K252 IonicContact OD1-NZ 3.62Å; D241-K252 IonicContact OD2-NZ 2.72Å; D241-K252 PolarHBondContact OD2-NZ 3.07Å
242	I	69.8	Low	60.2	Low	81 Å²	81	69.8 Å²	69.8	42%	0.415	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	128.5	179.8	-63.4	175	0	0	0	109.7	G220 Y225 G244 A245	G220-I242 VanDerWaalsContact CA-CG2 3.46Å; Y225-I242 PolarHBondContact OH-O 3.44Å; I242-G244 PolarHBondContact O-N 3.45Å; I242-A245 HydrophobicContact CB-CB 4.06Å; I242-A245 HydrophobicContact CG2-CB 4.38Å; I242-A245 VanDerWaalsContact O-CB 3.29Å; I242-A245 WeakPolarHBondContact O-CB 3.49Å; I242-A245 PolarHBondContact O-N 2.88Å
243	Y	66.6	Low	58.9	Low	65 Å²	65	67.5 Å²	67.5	26%	0.255	40%	0.404	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.2	130.4	174.7	-172.8	-103.5	0	0	0	111.4	I215 W217 G220 G221 V223 Y225 A245	I215-Y243 HydrophobicContact CD1-CD1 4.07Å; I215-Y243 HydrophobicContact CD1-CD2 4.1Å; I215-Y243 HydrophobicContact CD1-CG 3.56Å; W217-Y243 HydrophobicContact CB-CE1 4.5Å; W217-Y243 HydrophobicContact CE3-CE1 4.27Å; W217-Y243 HydrophobicContact CE3-CE2 4.02Å; W217-Y243 AromaticContact CE3-CZ 3.59Å; W217-Y243 VanDerWaalsContact CE3-OH 3.25Å; W217-Y243 HydrophobicContact CZ3-CE2 4.16Å; W217-Y243 WeakPolarHBondContact O-CE1 3.47Å; G220-Y243 PolarHBondContact N-O 3.11Å; G220-Y243 VanDerWaalsContact N-O 3.12Å; G221-Y243 WeakPolarHBondContact O-CB 3.18Å; G221-Y243 PolarHBondContact O-N 3.17Å; V223-Y243 HydrophobicContact CG1-CD2 4.29Å; Y225-Y243 WeakPolarHBondContact OH-CA 3.32Å; Y243-A245 VanDerWaalsContact C-N 3.33Å
244	G	60.7	Low	57.5	Low	45 Å²	45	69.9 Å²	69.9	46%	0.464	42%	0.42	S	S	.	.	T	Hydrogen-bonded Turn	trans	84.4	-2.1	-177	0	0	0	0	0	115	I242 S246	I242-G244 PolarHBondContact O-N 3.45Å; G244-S246 PolarHBondContact O-N 3.28Å
245	A	61.2	Low	56.4	Low	29 Å²	29	71.7 Å²	71.7	24%	0.24	42%	0.424	C	S	.	.			trans	-74.8	40.8	174.7	0	0	0	0	0	113.1	I242 Y243 K247 G248 L249	I242-A245 HydrophobicContact CB-CB 4.06Å; I242-A245 HydrophobicContact CG2-CB 4.38Å; I242-A245 VanDerWaalsContact O-CB 3.29Å; I242-A245 WeakPolarHBondContact O-CB 3.49Å; I242-A245 PolarHBondContact O-N 2.88Å; Y243-A245 VanDerWaalsContact C-N 3.33Å; A245-K247 PolarHBondContact O-N 3.33Å; A245-G248 WeakPolarHBondContact O-CA 3.34Å; A245-G248 PolarHBondContact O-N 2.91Å; A245-L249 PolarHBondContact O-N 3Å; A245-L249 VanDerWaalsContact O-N 3.14Å
246	S	49.3	Very low	55.1	Low	91 Å²	91	69 Å²	69	64%	0.636	41%	0.412	S	S	*	.	H	α-helix	trans	-48.5	-31.5	-177.8	50.7	0	0	0	0	113.5	G244	G244-S246 PolarHBondContact O-N 3.28Å
247	K	43.4	Very low	53.4	Low	159 Å²	159	70.3 Å²	70.3	69%	0.691	40%	0.398	S	S	*	.	H	α-helix	trans	-78.3	-40	175.4	-142.3	177.2	-180	179.4	0	113.2	A245 L249 L250 D251	A245-K247 PolarHBondContact O-N 3.33Å; K247-L249 PolarHBondContact O-N 2.69Å; K247-L250 PolarHBondContact O-N 3.35Å; K247-D251 VanDerWaalsContact O-CB 3.26Å; K247-D251 WeakPolarHBondContact O-CB 3.47Å; K247-D251 PolarHBondContact O-N 2.82Å
248	G	44.6	Very low	51.7	Low	27 Å²	27	76.2 Å²	76.2	28%	0.278	42%	0.418	S	S	.	.	H	α-helix	trans	-68.6	-32.7	-179.7	0	0	0	0	0	113.8	A245 K252	A245-G248 WeakPolarHBondContact O-CA 3.34Å; A245-G248 PolarHBondContact O-N 2.91Å; G248-K252 WeakPolarHBondContact O-CB 2.91Å; G248-K252 WeakPolarHBondContact O-CG 3.28Å; G248-K252 PolarHBondContact O-N 2.97Å
249	L	45.4	Very low	49.4	Very low	40 Å²	40	77.7 Å²	77.7	21%	0.209	44%	0.438	C	S	.	.	H	α-helix	trans	-70.3	-36	174.9	-93.6	139.7	0	0	0	112.6	I198 Y225 D241 A245 K247 L267	I198-L249 HydrophobicContact CD1-CD2 3.83Å; Y225-L249 HydrophobicContact CE2-CD1 4.18Å; D241-L249 HydrophobicContact CB-CD1 4.37Å; A245-L249 PolarHBondContact O-N 3Å; A245-L249 VanDerWaalsContact O-N 3.14Å; K247-L249 PolarHBondContact O-N 2.69Å; L249-L267 HydrophobicContact CD2-CD1 4.38Å
250	L	41.6	Very low	47	Very low	112 Å²	112	83.6 Å²	83.6	59%	0.586	48%	0.48	S	S	*	.	H	α-helix	trans	-77.5	-37.4	174.3	-103.3	118.9	0	0	0	112.8	K247 A253 N254	K247-L250 PolarHBondContact O-N 3.35Å; L250-A253 PolarHBondContact O-N 3.47Å; L250-N254 PolarHBondContact O-N 3.14Å; L250-N254 PolarHBondContact O-ND2 2.79Å
251	D	39.7	Very low	44.8	Very low	76 Å²	76	86.3 Å²	86.3	41%	0.406	50%	0.499	S	S	.	.	H	α-helix	trans	-73	-39.9	-179.8	-68.4	-21.5	0	0	0	111.2	K247 A253 N254 D255	K247-D251 VanDerWaalsContact O-CB 3.26Å; K247-D251 WeakPolarHBondContact O-CB 3.47Å; K247-D251 PolarHBondContact O-N 2.82Å; D251-A253 PolarHBondContact O-N 3.2Å; D251-N254 PolarHBondContact O-N 3.42Å; D251-D255 PolarHBondContact O-N 3.31Å
252	K	45.7	Very low	42.7	Very low	121 Å²	121	91 Å²	91	53%	0.526	53%	0.529	S	S	.	.	H	α-helix	trans	-61	-30.4	171.7	-78.2	175.8	-173.2	169.4	0	112.8	D241 G248 N254	D241-K252 IonicContact OD1-NZ 3.62Å; D241-K252 IonicContact OD2-NZ 2.72Å; D241-K252 PolarHBondContact OD2-NZ 3.07Å; G248-K252 WeakPolarHBondContact O-CB 2.91Å; G248-K252 WeakPolarHBondContact O-CG 3.28Å; G248-K252 PolarHBondContact O-N 2.97Å; K252-N254 VanDerWaalsContact C-N 3.28Å; K252-N254 PolarHBondContact O-N 2.83Å
253	A	40	Very low	40.5	Very low	46 Å²	46	90.1 Å²	90.1	38%	0.38	53%	0.527	S	S	.	.	H	α-helix	trans	-72.9	-20.3	176.3	0	0	0	0	0	112.9	L250 D251	L250-A253 PolarHBondContact O-N 3.47Å; D251-A253 PolarHBondContact O-N 3.2Å
254	N	39.5	Very low	38.8	Very low	116 Å²	116	90.4 Å²	90.4	62%	0.62	53%	0.53	S	S	*	.	H	α-helix	trans	-97.4	-30.1	-175.6	-78.3	-36	0	0	0	114.4	L250 D251 K252 E256	L250-N254 PolarHBondContact O-N 3.14Å; L250-N254 PolarHBondContact O-ND2 2.79Å; D251-N254 PolarHBondContact O-N 3.42Å; K252-N254 VanDerWaalsContact C-N 3.28Å; K252-N254 PolarHBondContact O-N 2.83Å; N254-E256 PolarHBondContact O-N 3.12Å
255	D	42.8	Very low	37	Very low	143 Å²	143	90.3 Å²	90.3	77%	0.765	52%	0.519	S	S	*	.	S	Bend	trans	-79.6	-3	-175.5	-83.5	-22.8	0	0	0	114.7	D251 K257	D251-D255 PolarHBondContact O-N 3.31Å; D255-K257 PolarHBondContact O-N 3.31Å
256	E	42.3	Very low	35.4	Very low	59 Å²	59	92.4 Å²	92.4	28%	0.276	53%	0.528	S	S	.	.			trans	-109	52.3	-164	-101.7	-126.6	128.7	0	0	109.9	N254 V266 R268	N254-E256 PolarHBondContact O-N 3.12Å; E256-V266 WeakPolarHBondContact OE2-CG1 3.29Å; E256-R268 HydrophobicContact CB-CG 3.8Å; E256-R268 WeakPolarHBondContact O-CD 3.19Å; E256-R268 WeakPolarHBondContact O-CG 3.22Å; E256-R268 PolarHBondContact O-NE 3.45Å; E256-R268 PolarHBondContact O-NH1 3.14Å; E256-R268 IonicContact OE1-CZ 3.7Å; E256-R268 IonicContact OE1-NE 2.81Å; E256-R268 PolarHBondContact OE1-NE 3.38Å; E256-R268 IonicContact OE1-NH2 2.7Å; E256-R268 PolarHBondContact OE1-NH2 3.5Å; E256-R268 IonicContact OE2-CZ 3.64Å; E256-R268 IonicContact OE2-NE 3.55Å; E256-R268 PolarHBondContact OE2-NE 3.23Å; E256-R268 IonicContact OE2-NH2 3.67Å
257	K	30	Very low	34.3	Very low	131 Å²	131	91.5 Å²	91.5	57%	0.57	52%	0.516	S	S	*	.			trans	-106.6	141.3	165.4	-84.4	-176.4	179.7	175.3	0	109.5	D255 P270	D255-K257 PolarHBondContact O-N 3.31Å; K257-P270 HydrophobicContact CD-CB 4.47Å; K257-P270 HydrophobicContact CG-CB 4Å
258	I	31.1	Very low	33.5	Very low	168 Å²	168	87.3 Å²	87.3	86%	0.862	50%	0.496	S	S	*	.			trans	97.8	115.3	173.3	-51.1	156	0	0	0	113.7
259	G	26.4	Very low	32.7	Very low	63 Å²	63	90.5 Å²	90.5	65%	0.649	52%	0.52	S	S	*	.			trans	134.2	94.1	160.1	0	0	0	0	0	116.2	S261	G259-S261 PolarHBondContact O-N 2.87Å; G259-S261 VanDerWaalsContact O-N 3.11Å
260	S	26	Very low	31.9	Very low	132 Å²	132	92.1 Å²	92.1	92%	0.923	53%	0.532	S	S	*	.			trans	-46.9	105.9	164.9	160.7	0	0	0	0	113.1
261	S	24.8	Very low	31.4	Very low	83 Å²	83	91.3 Å²	91.3	58%	0.58	53%	0.534	S	S	*	.	S	Bend	trans	171.7	105.2	141.3	-170.9	0	0	0	0	111	G259 T263	G259-S261 PolarHBondContact O-N 2.87Å; G259-S261 VanDerWaalsContact O-N 3.11Å; S261-T263 PolarHBondContact O-N 3.38Å; S261-T263 PolarHBondContact O-OG1 2.98Å
262	T	26.1	Very low	30.7	Very low	125 Å²	125	92.7 Å²	92.7	77%	0.767	55%	0.549	S	S	*	.	S	Bend	trans	47.9	46.1	133.8	-17.2	0	0	0	0	118.2	K233	K233-T262 WeakPolarHBondContact CE-O 3.31Å; K233-T262 PolarHBondContact NZ-O 2.77Å
263	T	24.5	Very low	29.8	Very low	61 Å²	61	95.5 Å²	95.5	37%	0.374	57%	0.569	S	S	.	*			trans	-157.6	81.8	178.2	-46.6	0	0	0	0	113.2	K233 S261	K233-T263 HydrophobicContact CD-CG2 3.56Å; K233-T263 VanDerWaalsContact NZ-CA 3.32Å; K233-T263 VanDerWaalsContact NZ-CB 3.28Å; K233-T263 PolarHBondContact NZ-OG1 3.45Å; S261-T263 PolarHBondContact O-N 3.38Å; S261-T263 PolarHBondContact O-OG1 2.98Å
264	H	29.3	Very low	29.2	Very low	72 Å²	72	104.5 Å²	104.5	33%	0.333	59%	0.593	S	S	.	*			trans	-144.4	94.5	169.2	-71.1	-63.8	0	0	0	111.5	I232 R268	I232-H264 WeakPolarHBondContact CB-O 3.43Å; I232-H264 WeakPolarHBondContact CD1-O 3.05Å; I232-H264 WeakPolarHBondContact CG1-O 3.36Å; I232-H264 WeakPolarHBondContact CG2-O 3.42Å; H264-R268 WeakPolarHBondContact CE1-CD 3.48Å; H264-R268 PolarHBondContact CE1-NE 2.72Å; H264-R268 VanDerWaalsContact CE1-NE 3.33Å
265	L	24.2	Very low	28.9	Very low	42 Å²	42	103.9 Å²	103.9	22%	0.22	60%	0.596	C	S	.	*	S	Bend		-98.7	83.8	116.2	-169.9	84.7	0	0	0	107.5	C230 C231 I232 C238	C230-L265 WeakPolarHBondContact O-CD1 3.17Å; C231-L265 HydrophobicContact CB-CB 4.12Å; C231-L265 HydrophobicContact CB-CD1 4.5Å; C231-L265 HydrophobicContact CB-CD2 3.34Å; C231-L265 HydrophobicContact CB-CG 4.1Å; C231-L265 WeakPolarHBondContact SG-CD2 3.11Å; I232-L265 HydrophobicContact CB-CB 3.94Å; I232-L265 HydrophobicContact CB-CD1 4.34Å; I232-L265 HydrophobicContact CD1-CD1 4.39Å; I232-L265 HydrophobicContact CG1-CD1 4.14Å; C238-L265 HydrophobicContact CB-CD2 3.62Å; C238-L265 WeakPolarHBondContact O-CD2 3.33Å
266	V	26.8	Very low	28.1	Very low	73 Å²	73	104.4 Å²	104.4	44%	0.442	60%	0.599	S	S	.	*	S	Bend	trans	-149.9	127.9	162.6	-171.9	0	0	0	0	103.8	E256 R268	E256-V266 WeakPolarHBondContact OE2-CG1 3.29Å; V266-R268 PolarHBondContact O-N 3.25Å
267	L	26	Very low	27.5	Very low	72 Å²	72	106.6 Å²	106.6	38%	0.377	63%	0.627	S	S	.	*			trans	-48.2	100.2	-179.4	-55.1	171.3	0	0	0	110.5	S194 I198 L249	S194-L267 WeakPolarHBondContact OG-CD2 3.26Å; I198-L267 HydrophobicContact CD1-CD1 4.38Å; L249-L267 HydrophobicContact CD2-CD1 4.38Å
268	R	26.9	Very low	27.4	Very low	72 Å²	72	109.3 Å²	109.3	27%	0.272	64%	0.639	S	S	.	*			trans	-148.7	117.9	175	-90.8	-167.6	-156.5	-146.8	-15.4	110.3	E256 H264 V266	E256-R268 HydrophobicContact CB-CG 3.8Å; E256-R268 WeakPolarHBondContact O-CD 3.19Å; E256-R268 WeakPolarHBondContact O-CG 3.22Å; E256-R268 PolarHBondContact O-NE 3.45Å; E256-R268 PolarHBondContact O-NH1 3.14Å; E256-R268 IonicContact OE1-CZ 3.7Å; E256-R268 IonicContact OE1-NE 2.81Å; E256-R268 PolarHBondContact OE1-NE 3.38Å; E256-R268 IonicContact OE1-NH2 2.7Å; E256-R268 PolarHBondContact OE1-NH2 3.5Å; E256-R268 IonicContact OE2-CZ 3.64Å; E256-R268 IonicContact OE2-NE 3.55Å; E256-R268 PolarHBondContact OE2-NE 3.23Å; E256-R268 IonicContact OE2-NH2 3.67Å; H264-R268 WeakPolarHBondContact CE1-CD 3.48Å; H264-R268 PolarHBondContact CE1-NE 2.72Å; H264-R268 VanDerWaalsContact CE1-NE 3.33Å; V266-R268 PolarHBondContact O-N 3.25Å
269	A	27.4	Very low	27.2	Very low	94 Å²	94	107 Å²	107	78%	0.777	63%	0.633	S	S	*	*			trans	-113.6	129.3	148.1	0	0	0	0	0	107.7
270	P	29.9	Very low	27.2	Very low	73 Å²	73	112.2 Å²	112.2	47%	0.474	64%	0.644	S	S	.	*			trans	-127.4	155.9	155.8	32.2	-16.9	0	0	0	113.7	K257	K257-P270 HydrophobicContact CD-CB 4.47Å; K257-P270 HydrophobicContact CG-CB 4Å
271	P	29.5	Very low	27.5	Very low	95 Å²	95	113.5 Å²	113.5	62%	0.617	64%	0.639	S	S	*	*			trans	-97.3	109.5	-151.6	33.4	-24.3	0	0	0	110.2
272	S	26.6	Very low	27.8	Very low	105 Å²	105	114.5 Å²	114.5	73%	0.734	65%	0.646	S	S	*	*			trans	170.9	103.3	157.5	37.4	0	0	0	0	106.8
273	L	26.3	Very low	27.9	Very low	180 Å²	180	112.8 Å²	112.8	94%	0.942	64%	0.64	S	S	*	*			trans	172.6	104.6	147.5	-90.5	150	0	0	0	109
274	R	27.7	Very low	28.2	Very low	235 Å²	235	116.8 Å²	116.8	89%	0.887	66%	0.664	S	S	*	*			trans	-77.5	-178.4	158.8	-63.4	-175.7	176.5	-163.2	-0.6	109.1
275	P	31.7	Very low	28.3	Very low	103 Å²	103	120.8 Å²	120.8	67%	0.669	71%	0.709	S	S	*	*				-116.9	178.8	-74.9	34.9	-17.8	0	0	0	110.4
276	N	26.8	Very low	28.5	Very low	155 Å²	155	124.7 Å²	124.7	83%	0.829	73%	0.734	S	S	*	*			trans	98.6	102.5	167.6	-55.7	-48.6	0	0	0	117.7
277	A	30	Very low	28.6	Very low	104 Å²	104	127.4 Å²	127.4	86%	0.86	75%	0.749	S	S	*	*				-148	95.2	127.5	0	0	0	0	0	110.3
278	K	28	Very low	28.8	Very low	189 Å²	189	130.5 Å²	130.5	82%	0.822	77%	0.77	S	S	*	*			trans	19	117.2	145.1	-73	170.8	171.8	-178.6	0	118.8
279	T	26.3	Very low	28.9	Very low	120 Å²	120	133.9 Å²	133.9	74%	0.736	80%	0.799	S	S	*	*				46	99	111.9	-36.5	0	0	0	0	117.4
280	L	27.2	Very low	29	Very low	171 Å²	171	136.4 Å²	136.4	90%	0.895	80%	0.8	S	S	*	*	S	Bend	trans	-141.8	86.6	146	-106	155.2	0	0	0	106.5
281	I	31.6	Very low	28.9	Very low	160 Å²	160	140.7 Å²	140.7	82%	0.821	82%	0.822	S	S	*	*			trans	176.2	90.6	151	-79.1	144.4	0	0	0	103.1	S283	I281-S283 PolarHBondContact O-N 3.03Å
282	S	29.9	Very low	28.9	Very low	104 Å²	104	143.9 Å²	143.9	73%	0.727	84%	0.837	S	S	*	*			trans	-81.2	108.4	157.1	63.5	0	0	0	0	106.6	T284	S282-T284 PolarHBondContact O-N 3.29Å
283	S	29.7	Very low	29	Very low	89 Å²	89	146.9 Å²	146.9	62%	0.622	85%	0.845	S	S	*	*			trans	-46	122	153.3	175.4	0	0	0	0	108.9	I281 A285	I281-S283 PolarHBondContact O-N 3.03Å; S283-A285 VanDerWaalsContact C-N 3.35Å; S283-A285 PolarHBondContact O-N 2.97Å; S283-A285 PolarHBondContact OG-N 2.84Å; S283-A285 PolarHBondContact OG-O 2.83Å
284	T	30.3	Very low	29.2	Very low	144 Å²	144	144.2 Å²	144.2	88%	0.883	84%	0.837	S	S	*	*			trans	-84.9	87.1	155.3	25.2	0	0	0	0	106.9	S282	S282-T284 PolarHBondContact O-N 3.29Å
285	A	31.8	Very low	29.4	Very low	156 Å²	156	135.9 Å²	135.9	100%	1.289	83%	0.832	S	S	*	*			trans	162.7	0	158	0	0	0	0	0	107.6	S283	S283-A285 VanDerWaalsContact C-N 3.35Å; S283-A285 PolarHBondContact O-N 2.97Å; S283-A285 PolarHBondContact OG-N 2.84Å; S283-A285 PolarHBondContact OG-O 2.83Å

Retrieved 285 of 285 residues in 297 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).