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Guanine nucleotide-binding protein G(t) subunit alpha-1

Functions as a signal transducer for the rod photoreceptor RHO. Required for normal RHO-mediated light perception by the retina¹. Guanine nucleotide-binding proteins (G proteins) function as transducers downstream of G protein-coupled receptors (GPCRs), such as the photoreceptor RHO. The alpha chain contains the guanine nucleotide binding site and alternates between an active, GTP-bound state and an inactive, GDP-bound state. Activated RHO promotes GDP release and GTP binding. Signaling is mediated via downstream effector proteins, such as cGMP-phosphodiesterase (By similarity).

AlphaFold DB , UniProt , Accession P11488, Species HUMAN (Homo sapiens, Human), Gene GNAT1, Length 350 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	39.9	Very low	71.2	Confident	242 Å²	242	104.4 Å²	104.4	100%	1.192	65%	0.645	S	S	*	*				0	111.6	0	-63.9	-178.5	-158.7	0	0	106.5	A3	M1-A3 PolarHBondContact O-N 3.19Å
2	G	50.4	Low	72.7	Confident	81 Å²	81	100.4 Å²	100.4	84%	0.835	62%	0.624	S	S	*	*			trans	-65	116.7	178	0	0	0	0	0	108.7	G4	G2-G4 PolarHBondContact O-N 3.38Å
3	A	59.3	Low	73.9	Confident	102 Å²	102	105.1 Å²	105.1	84%	0.843	62%	0.623	S	S	*	*			trans	-60.2	104.1	168.1	0	0	0	0	0	106.4	M1 A5	M1-A3 PolarHBondContact O-N 3.19Å; A3-A5 PolarHBondContact O-N 2.93Å
4	G	61.8	Low	75	Confident	66 Å²	66	105.9 Å²	105.9	68%	0.68	62%	0.618	S	S	*	*	P	Polyproline II helix	trans	-60.3	132	174.9	0	0	0	0	0	108.1	G2 S6	G2-G4 PolarHBondContact O-N 3.38Å; G4-S6 PolarHBondContact O-N 3.34Å
5	A	69.5	Low	76.1	Confident	27 Å²	27	104.4 Å²	104.4	22%	0.223	61%	0.606	C	S	.	*	P	Polyproline II helix	trans	-48.5	134.5	176.6	0	0	0	0	0	109.9	A3 E9 K10	A3-A5 PolarHBondContact O-N 2.93Å; A5-E9 WeakPolarHBondContact CA-OE2 3.4Å; A5-E9 HydrophobicContact CB-CB 4.17Å; A5-E9 WeakPolarHBondContact CB-OE2 3.18Å; A5-K10 HydrophobicContact CB-CG 4.01Å; A5-K10 WeakPolarHBondContact O-CE 3.4Å
6	S	81.9	Confident	76.9	Confident	50 Å²	50	105.6 Å²	105.6	35%	0.35	60%	0.604	S	S	.	*	P	Polyproline II helix	trans	-60.3	158.3	-179.6	81.8	0	0	0	0	110.1	G4 E8 E9 K10	G4-S6 PolarHBondContact O-N 3.34Å; S6-E8 PolarHBondContact O-N 3.14Å; S6-E8 PolarHBondContact OG-N 3.43Å; S6-E9 PolarHBondContact N-OE2 3.07Å; S6-E9 VanDerWaalsContact N-OE2 3.07Å; S6-E9 PolarHBondContact O-N 2.97Å; S6-E9 VanDerWaalsContact O-N 3.14Å; S6-E9 WeakPolarHBondContact OG-CG 3.45Å; S6-E9 PolarHBondContact OG-N 2.85Å; S6-K10 PolarHBondContact O-N 3Å
7	A	82.6	Confident	77.7	Confident	85 Å²	85	107.1 Å²	107.1	70%	0.702	60%	0.602	S	S	*	*	H	α-helix	trans	-56.3	-34.5	176.2	0	0	0	0	0	111.7	H11	A7-H11 WeakPolarHBondContact O-CB 3.42Å; A7-H11 PolarHBondContact O-N 3.07Å
8	E	82.4	Confident	78.4	Confident	164 Å²	164	108.5 Å²	108.5	77%	0.766	60%	0.6	S	S	*	*	H	α-helix	trans	-68.7	-43.7	175.7	-65.1	174.6	170.7	0	0	112.2	S6 K10 H11 S12	S6-E8 PolarHBondContact O-N 3.14Å; S6-E8 PolarHBondContact OG-N 3.43Å; E8-K10 VanDerWaalsContact C-N 3.33Å; E8-K10 PolarHBondContact O-N 2.98Å; E8-H11 PolarHBondContact O-N 3.04Å; E8-S12 WeakPolarHBondContact O-CB 3.45Å; E8-S12 PolarHBondContact O-N 3.21Å
9	E	84.4	Confident	79	Confident	97 Å²	97	108.7 Å²	108.7	45%	0.453	60%	0.6	S	S	.	*	H	α-helix	trans	-63.8	-38.8	175.9	-74	176.1	162.7	0	0	112	A5 S6 R13	A5-E9 WeakPolarHBondContact CA-OE2 3.4Å; A5-E9 HydrophobicContact CB-CB 4.17Å; A5-E9 WeakPolarHBondContact CB-OE2 3.18Å; S6-E9 PolarHBondContact N-OE2 3.07Å; S6-E9 VanDerWaalsContact N-OE2 3.07Å; S6-E9 PolarHBondContact O-N 2.97Å; S6-E9 VanDerWaalsContact O-N 3.14Å; S6-E9 WeakPolarHBondContact OG-CG 3.45Å; S6-E9 PolarHBondContact OG-N 2.85Å; E9-R13 WeakPolarHBondContact O-CB 3.35Å; E9-R13 VanDerWaalsContact O-CG 3.27Å; E9-R13 WeakPolarHBondContact O-CG 3.44Å; E9-R13 PolarHBondContact O-N 3.28Å
10	K	85	Confident	79.4	Confident	119 Å²	119	110.1 Å²	110.1	52%	0.517	60%	0.599	S	S	.	*	H	α-helix	trans	-64	-46.2	174.3	-70.7	-179	-177.9	179	0	111	A5 S6 E8 R13 E14	A5-K10 HydrophobicContact CB-CG 4.01Å; A5-K10 WeakPolarHBondContact O-CE 3.4Å; S6-K10 PolarHBondContact O-N 3Å; E8-K10 VanDerWaalsContact C-N 3.33Å; E8-K10 PolarHBondContact O-N 2.98Å; K10-R13 PolarHBondContact O-N 3.37Å; K10-E14 WeakPolarHBondContact O-CG 3.27Å; K10-E14 PolarHBondContact O-N 3.46Å
11	H	85.8	Confident	79.7	Confident	115 Å²	115	109.4 Å²	109.4	53%	0.532	59%	0.592	S	S	.	*	H	α-helix	trans	-63.1	-42.6	178.3	-170.9	57.3	0	0	0	112.4	A7 E8 E14 L15	A7-H11 WeakPolarHBondContact O-CB 3.42Å; A7-H11 PolarHBondContact O-N 3.07Å; E8-H11 PolarHBondContact O-N 3.04Å; H11-E14 PolarHBondContact O-N 3.31Å; H11-L15 WeakPolarHBondContact NE2-CD1 3.49Å; H11-L15 WeakPolarHBondContact O-CB 3.43Å; H11-L15 PolarHBondContact O-N 2.94Å
12	S	89.1	Confident	81.9	Confident	57 Å²	57	102 Å²	102	40%	0.399	56%	0.558	S	S	.	*	H	α-helix	trans	-62.2	-44.3	176.5	-165.9	0	0	0	0	111.8	E8 E14 L15 E16	E8-S12 WeakPolarHBondContact O-CB 3.45Å; E8-S12 PolarHBondContact O-N 3.21Å; S12-E14 VanDerWaalsContact C-N 3.34Å; S12-E14 PolarHBondContact O-N 2.99Å; S12-L15 WeakPolarHBondContact O-CB 3.49Å; S12-L15 PolarHBondContact O-N 2.89Å; S12-E16 WeakPolarHBondContact O-CG 3.25Å; S12-E16 PolarHBondContact O-N 3.28Å
13	R	88.7	Confident	83.5	Confident	161 Å²	161	101 Å²	101	61%	0.608	54%	0.541	S	S	*	.	H	α-helix	trans	-64.9	-37	176.5	-73.3	175.5	-174.6	-178.3	5.3	112.6	E9 K10 K17	E9-R13 WeakPolarHBondContact O-CB 3.35Å; E9-R13 VanDerWaalsContact O-CG 3.27Å; E9-R13 WeakPolarHBondContact O-CG 3.44Å; E9-R13 PolarHBondContact O-N 3.28Å; K10-R13 PolarHBondContact O-N 3.37Å; R13-K17 VanDerWaalsContact O-CB 3.25Å; R13-K17 WeakPolarHBondContact O-CB 3.49Å; R13-K17 PolarHBondContact O-N 3.48Å
14	E	90	Very high	84.6	Confident	117 Å²	117	100.9 Å²	100.9	55%	0.547	52%	0.523	S	S	.	.	H	α-helix	trans	-66.7	-39.4	174.6	-75.1	173.1	-171.3	0	0	111.9	K10 H11 S12 K18	K10-E14 WeakPolarHBondContact O-CG 3.27Å; K10-E14 PolarHBondContact O-N 3.46Å; H11-E14 PolarHBondContact O-N 3.31Å; S12-E14 VanDerWaalsContact C-N 3.34Å; S12-E14 PolarHBondContact O-N 2.99Å; E14-K18 WeakPolarHBondContact O-CG 3.33Å; E14-K18 PolarHBondContact O-N 3.39Å
15	L	90.3	Very high	85.7	Confident	83 Å²	83	103.7 Å²	103.7	44%	0.435	52%	0.517	S	S	.	.	H	α-helix	trans	-64.5	-49.5	174	-98.4	153.4	0	0	0	112.1	H11 S12 K17 K18 L19	H11-L15 WeakPolarHBondContact NE2-CD1 3.49Å; H11-L15 WeakPolarHBondContact O-CB 3.43Å; H11-L15 PolarHBondContact O-N 2.94Å; S12-L15 WeakPolarHBondContact O-CB 3.49Å; S12-L15 PolarHBondContact O-N 2.89Å; L15-K17 VanDerWaalsContact C-N 3.29Å; L15-K17 PolarHBondContact O-N 3.29Å; L15-K18 PolarHBondContact O-N 3.22Å; L15-L19 WeakPolarHBondContact O-CB 3.4Å; L15-L19 WeakPolarHBondContact O-CG 3.43Å; L15-L19 PolarHBondContact O-N 2.87Å
16	E	90.2	Very high	86.3	Confident	124 Å²	124	107.9 Å²	107.9	58%	0.579	54%	0.535	S	S	*	.	H	α-helix	trans	-59.2	-41.4	176.4	-75.7	174.7	-174.6	0	0	111.7	S12 L19 K20	S12-E16 WeakPolarHBondContact O-CG 3.25Å; S12-E16 PolarHBondContact O-N 3.28Å; E16-L19 PolarHBondContact O-N 2.98Å; E16-K20 WeakPolarHBondContact O-CB 3.29Å; E16-K20 PolarHBondContact O-N 2.94Å
17	K	90.5	Very high	86.5	Confident	131 Å²	131	109.3 Å²	109.3	57%	0.57	55%	0.55	S	S	*	.	H	α-helix	trans	-62	-47.6	175.6	-178.2	178.4	169.1	-177.5	0	111.3	R13 L15 K20 E21	R13-K17 VanDerWaalsContact O-CB 3.25Å; R13-K17 WeakPolarHBondContact O-CB 3.49Å; R13-K17 PolarHBondContact O-N 3.48Å; L15-K17 VanDerWaalsContact C-N 3.29Å; L15-K17 PolarHBondContact O-N 3.29Å; K17-K20 PolarHBondContact O-N 3Å; K17-E21 WeakPolarHBondContact CE-OE1 3.34Å; K17-E21 IonicContact NZ-OE1 3.8Å; K17-E21 WeakPolarHBondContact O-CG 2.84Å; K17-E21 PolarHBondContact O-N 3.46Å
18	K	89.8	Confident	86.8	Confident	132 Å²	132	111.7 Å²	111.7	57%	0.574	54%	0.541	S	S	*	.	H	α-helix	trans	-61.5	-44.8	176.7	-78.6	-178	178.4	-177.9	0	112.2	E14 L15 K20 E21 D22	E14-K18 WeakPolarHBondContact O-CG 3.33Å; E14-K18 PolarHBondContact O-N 3.39Å; L15-K18 PolarHBondContact O-N 3.22Å; K18-K20 VanDerWaalsContact C-N 3.27Å; K18-K20 PolarHBondContact O-N 2.8Å; K18-E21 PolarHBondContact O-N 3.21Å; K18-D22 WeakPolarHBondContact O-CB 3.45Å; K18-D22 VanDerWaalsContact O-CG 3.26Å; K18-D22 PolarHBondContact O-N 3.35Å
19	L	88.9	Confident	87.4	Confident	113 Å²	113	105.5 Å²	105.5	59%	0.592	51%	0.514	S	S	*	.	H	α-helix	trans	-60.3	-39	177.5	-73.5	170.4	0	0	0	112	L15 E16 A23	L15-L19 WeakPolarHBondContact O-CB 3.4Å; L15-L19 WeakPolarHBondContact O-CG 3.43Å; L15-L19 PolarHBondContact O-N 2.87Å; E16-L19 PolarHBondContact O-N 2.98Å; L19-A23 VanDerWaalsContact O-CB 3.29Å; L19-A23 WeakPolarHBondContact O-CB 3.37Å; L19-A23 PolarHBondContact O-N 2.95Å
20	K	87	Confident	87.9	Confident	136 Å²	136	100.9 Å²	100.9	59%	0.591	49%	0.493	S	S	*	.	H	α-helix	trans	-68.6	-43.9	175.7	-168.3	-175.8	177.7	-164.6	0	111.9	E16 K17 K18 A23 E24	E16-K20 WeakPolarHBondContact O-CB 3.29Å; E16-K20 PolarHBondContact O-N 2.94Å; K17-K20 PolarHBondContact O-N 3Å; K18-K20 VanDerWaalsContact C-N 3.27Å; K18-K20 PolarHBondContact O-N 2.8Å; K20-A23 PolarHBondContact O-N 3.43Å; K20-E24 WeakPolarHBondContact CE-OE1 3.49Å; K20-E24 IonicContact NZ-OE1 3.15Å; K20-E24 WeakPolarHBondContact O-CB 3.37Å; K20-E24 WeakPolarHBondContact O-CG 3.31Å; K20-E24 PolarHBondContact O-N 3.5Å
21	E	86.8	Confident	88.4	Confident	96 Å²	96	96.6 Å²	96.6	45%	0.449	47%	0.474	S	S	.	.	H	α-helix	trans	-62.2	-41.9	176.1	-73.4	172.9	173.5	0	0	111.7	K17 K18 E24 K25	K17-E21 WeakPolarHBondContact CE-OE1 3.34Å; K17-E21 IonicContact NZ-OE1 3.8Å; K17-E21 WeakPolarHBondContact O-CG 2.84Å; K17-E21 PolarHBondContact O-N 3.46Å; K18-E21 PolarHBondContact O-N 3.21Å; E21-E24 PolarHBondContact O-N 3.37Å; E21-K25 WeakPolarHBondContact O-CB 3.21Å; E21-K25 PolarHBondContact O-N 2.81Å
22	D	85.7	Confident	88.9	Confident	87 Å²	87	91.1 Å²	91.1	47%	0.465	45%	0.449	S	S	.	.	H	α-helix	trans	-65.1	-44.2	175.8	-71.7	-23.4	0	0	0	110.9	K18 E24 K25 D26	K18-D22 WeakPolarHBondContact O-CB 3.45Å; K18-D22 VanDerWaalsContact O-CG 3.26Å; K18-D22 PolarHBondContact O-N 3.35Å; D22-E24 PolarHBondContact O-N 3.24Å; D22-K25 PolarHBondContact O-N 3.47Å; D22-D26 WeakPolarHBondContact O-CB 3.35Å; D22-D26 PolarHBondContact O-N 2.92Å
23	A	83.9	Confident	89.4	Confident	59 Å²	59	88.4 Å²	88.4	49%	0.488	43%	0.43	S	S	.	.	H	α-helix	trans	-63.2	-40.7	176.1	0	0	0	0	0	112.6	L19 K20 K25 D26 A27	L19-A23 VanDerWaalsContact O-CB 3.29Å; L19-A23 WeakPolarHBondContact O-CB 3.37Å; L19-A23 PolarHBondContact O-N 2.95Å; K20-A23 PolarHBondContact O-N 3.43Å; A23-K25 VanDerWaalsContact C-N 3.35Å; A23-D26 PolarHBondContact O-N 2.91Å; A23-A27 VanDerWaalsContact O-CB 3.31Å; A23-A27 WeakPolarHBondContact O-CB 3.47Å; A23-A27 PolarHBondContact O-N 2.96Å
24	E	82.9	Confident	89.8	Confident	100 Å²	100	80.8 Å²	80.8	47%	0.467	40%	0.401	S	S	.	.	H	α-helix	trans	-65.8	-38.2	175.3	-75.6	177.2	-170.2	0	0	111.8	K20 E21 D22 R28	K20-E24 WeakPolarHBondContact CE-OE1 3.49Å; K20-E24 IonicContact NZ-OE1 3.15Å; K20-E24 WeakPolarHBondContact O-CB 3.37Å; K20-E24 WeakPolarHBondContact O-CG 3.31Å; K20-E24 PolarHBondContact O-N 3.5Å; E21-E24 PolarHBondContact O-N 3.37Å; D22-E24 PolarHBondContact O-N 3.24Å; E24-R28 WeakPolarHBondContact O-CG 3.33Å; E24-R28 PolarHBondContact O-N 3.17Å
25	K	83.5	Confident	90.2	Very high	125 Å²	125	75.2 Å²	75.2	54%	0.543	38%	0.375	S	S	.	.	H	α-helix	trans	-67.9	-44.7	175.7	-175.8	-176.9	177.4	-174.7	0	111.6	E21 D22 A23 A27 R28 T29	E21-K25 WeakPolarHBondContact O-CB 3.21Å; E21-K25 PolarHBondContact O-N 2.81Å; D22-K25 PolarHBondContact O-N 3.47Å; A23-K25 VanDerWaalsContact C-N 3.35Å; K25-A27 VanDerWaalsContact C-N 3.34Å; K25-R28 CarbonylContact O-C 3.52Å; K25-R28 PolarHBondContact O-N 3.07Å; K25-R28 VanDerWaalsContact O-N 3.15Å; K25-T29 PolarHBondContact O-N 2.71Å; K25-T29 PolarHBondContact O-OG1 3.15Å
26	D	83.9	Confident	90.6	Very high	115 Å²	115	71.2 Å²	71.2	62%	0.615	35%	0.354	S	S	*	.	H	α-helix	trans	-64.1	-40.5	178.7	-76.5	-11.3	0	0	0	110.9	D22 A23 R28 T29	D22-D26 WeakPolarHBondContact O-CB 3.35Å; D22-D26 PolarHBondContact O-N 2.92Å; A23-D26 PolarHBondContact O-N 2.91Å; D26-R28 PolarHBondContact O-N 2.73Å; D26-T29 PolarHBondContact O-N 3.39Å
27	A	85	Confident	90.9	Very high	79 Å²	79	65.9 Å²	65.9	65%	0.653	33%	0.331	S	S	*	.	H	α-helix	trans	-61.4	-23.9	175	0	0	0	0	0	113.8	A23 K25	A23-A27 VanDerWaalsContact O-CB 3.31Å; A23-A27 WeakPolarHBondContact O-CB 3.47Å; A23-A27 PolarHBondContact O-N 2.96Å; K25-A27 VanDerWaalsContact C-N 3.34Å
28	R	89.7	Confident	91.1	Very high	136 Å²	136	60.6 Å²	60.6	51%	0.513	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.8	1.6	176.2	-63.2	-177.5	-173	-165.3	2.8	113.4	E24 K25 D26 L190 N191	E24-R28 WeakPolarHBondContact O-CG 3.33Å; E24-R28 PolarHBondContact O-N 3.17Å; K25-R28 CarbonylContact O-C 3.52Å; K25-R28 PolarHBondContact O-N 3.07Å; K25-R28 VanDerWaalsContact O-N 3.15Å; D26-R28 PolarHBondContact O-N 2.73Å; R28-L190 HydrophobicContact CB-CD2 4.48Å; R28-L190 WeakPolarHBondContact O-CA 3.38Å; R28-N191 PolarHBondContact O-N 2.74Å
29	T	93.5	Very high	91.3	Very high	33 Å²	33	56.6 Å²	56.6	20%	0.202	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	123.8	-178	-64	0	0	0	0	110.2	K25 D26 N191 R193	K25-T29 PolarHBondContact O-N 2.71Å; K25-T29 PolarHBondContact O-OG1 3.15Å; D26-T29 PolarHBondContact O-N 3.39Å; T29-N191 CarbonylContact C-O 3.55Å; T29-N191 VanDerWaalsContact CA-O 3.31Å; T29-N191 WeakPolarHBondContact CA-O 3.45Å; T29-R193 HydrophobicContact CG2-CG 4.04Å
30	V	95.1	Very high	91.7	Very high	1 Å²	1	51.3 Å²	51.3	1%	0.006	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	117.5	178.3	176.5	0	0	0	0	109.3	L32 L190 N191 F192 R193 T215 I339	V30-L32 HydrophobicContact CG1-CD2 3.79Å; V30-L32 HydrophobicContact CG1-CG 4.08Å; V30-L190 HydrophobicContact CG2-CB 4.34Å; V30-L190 HydrophobicContact CG2-CD1 4.02Å; V30-L190 HydrophobicContact CG2-CD2 4.36Å; V30-L190 HydrophobicContact CG2-CG 4.49Å; V30-N191 PolarHBondContact N-O 3.46Å; V30-F192 HydrophobicContact CB-CD1 3.81Å; V30-F192 HydrophobicContact CB-CE1 3.88Å; V30-F192 HydrophobicContact CB-CG 4.45Å; V30-F192 HydrophobicContact CG1-CD1 3.75Å; V30-F192 HydrophobicContact CG1-CE1 3.64Å; V30-F192 HydrophobicContact CG2-CE1 4.35Å; V30-F192 CarbonylContact O-C 3.59Å; V30-F192 WeakPolarHBondContact O-CA 3.4Å; V30-R193 PolarHBondContact O-N 3.36Å; V30-T215 HydrophobicContact CG1-CG2 4Å; V30-I339 HydrophobicContact CG1-CD1 4.15Å; V30-I339 HydrophobicContact CG1-CG2 4.07Å; V30-I339 HydrophobicContact CG2-CG2 4.04Å
31	K	95.9	Very high	92.2	Very high	29 Å²	29	45.4 Å²	45.4	13%	0.126	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	109.4	173.4	-178.1	171	-179.3	-175.5	0	110	R193 F195 C210 E212 G213 V214 T215 C216	K31-R193 WeakPolarHBondContact CA-O 3.44Å; K31-F195 HydrophobicContact CD-CD2 4.35Å; K31-F195 HydrophobicContact CD-CE2 3.94Å; K31-F195 HydrophobicContact CG-CD2 3.87Å; K31-F195 HydrophobicContact CG-CE2 3.7Å; K31-C210 WeakPolarHBondContact CE-O 3.38Å; K31-C210 PolarHBondContact NZ-O 3.19Å; K31-E212 PolarHBondContact NZ-O 2.92Å; K31-G213 WeakPolarHBondContact CB-O 3.32Å; K31-G213 WeakPolarHBondContact CD-O 3.48Å; K31-V214 HydrophobicContact CD-CG2 4.31Å; K31-T215 PolarHBondContact N-OG1 3.29Å; K31-T215 WeakPolarHBondContact O-CB 3.24Å; K31-T215 PolarHBondContact O-N 2.76Å; K31-C216 PolarHBondContact O-N 3.02Å
32	L	97.6	Very high	92.7	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	130	173.8	-63.2	-177	0	0	0	110.5	V30 F192 R193 M194 F195 C216 I218 F332 I339	V30-L32 HydrophobicContact CG1-CD2 3.79Å; V30-L32 HydrophobicContact CG1-CG 4.08Å; L32-F192 HydrophobicContact CD1-CD1 3.49Å; L32-F192 VanDerWaalsContact CD1-CD1 3.49Å; L32-F192 HydrophobicContact CD1-CE1 3.89Å; L32-F192 HydrophobicContact CG-CD1 3.83Å; L32-F192 HydrophobicContact CG-CE1 4.28Å; L32-R193 PolarHBondContact N-O 3.07Å; L32-M194 HydrophobicContact CB-CB 4.42Å; L32-M194 HydrophobicContact CB-CG 4.43Å; L32-M194 HydrophobicContact CD1-CE 3.72Å; L32-M194 CarbonylContact O-C 3.58Å; L32-M194 WeakPolarHBondContact O-CA 3.04Å; L32-F195 PolarHBondContact O-N 2.81Å; L32-C216 WeakPolarHBondContact CA-O 3.42Å; L32-C216 HydrophobicContact CD2-CB 3.72Å; L32-I218 HydrophobicContact CD1-CD1 4.24Å; L32-F332 HydrophobicContact CD1-CE2 3.63Å; L32-F332 HydrophobicContact CD1-CZ 3.71Å; L32-I339 HydrophobicContact CD2-CD1 3.71Å
33	L	98.1	Very high	93.3	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	116.7	174.2	-177.7	59.7	0	0	0	110.1	L35 F195 V197 C210 F211 V214 C216 I217 I218 F255	L33-L35 HydrophobicContact CD1-CD2 4.25Å; L33-L35 HydrophobicContact CD2-CD1 4.02Å; L33-L35 HydrophobicContact CD2-CD2 4.14Å; L33-L35 HydrophobicContact CD2-CG 4.16Å; L33-L35 HydrophobicContact CG-CD1 4.29Å; L33-L35 HydrophobicContact CG-CD2 3.96Å; L33-L35 HydrophobicContact CG-CG 3.92Å; L33-F195 HydrophobicContact CD1-CB 3.81Å; L33-V197 HydrophobicContact CD1-CG1 4.37Å; L33-C210 HydrophobicContact CD1-CB 3.7Å; L33-C210 HydrophobicContact CD2-CB 4.39Å; L33-F211 HydrophobicContact CD2-CD1 3.86Å; L33-F211 HydrophobicContact CD2-CE1 4Å; L33-V214 HydrophobicContact CB-CG1 3.8Å; L33-V214 HydrophobicContact CB-CG2 4.18Å; L33-V214 HydrophobicContact CD2-CG2 4.02Å; L33-C216 PolarHBondContact N-O 3.49Å; L33-I217 HydrophobicContact CB-CG1 4.45Å; L33-I217 WeakPolarHBondContact O-CA 3.46Å; L33-I218 PolarHBondContact O-N 2.99Å; L33-F255 HydrophobicContact CD2-CE1 4.47Å; L33-F255 HydrophobicContact CD2-CZ 4.03Å
34	L	98.4	Very high	94	Very high	0 Å²	0	37 Å²	37	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	118.5	175.8	-55.5	-170.1	0	0	0	110	K42 I45 V46 M194 F195 D196 V197 I218	L34-K42 HydrophobicContact CB-CB 4.22Å; L34-K42 HydrophobicContact CB-CD 4.18Å; L34-K42 HydrophobicContact CB-CG 4.21Å; L34-K42 HydrophobicContact CD1-CB 4.26Å; L34-I45 HydrophobicContact CD1-CB 4.4Å; L34-I45 HydrophobicContact CD1-CG2 4.36Å; L34-V46 HydrophobicContact CD1-CG2 3.63Å; L34-M194 HydrophobicContact CD1-CG 4.05Å; L34-M194 HydrophobicContact CD1-SD 3.79Å; L34-M194 HydrophobicContact CD2-CE 4.43Å; L34-M194 HydrophobicContact CD2-CG 4.28Å; L34-M194 HydrophobicContact CD2-SD 4.28Å; L34-M194 HydrophobicContact CG-CG 3.94Å; L34-M194 HydrophobicContact CG-SD 4.19Å; L34-F195 PolarHBondContact N-O 2.87Å; L34-D196 HydrophobicContact CD1-CB 4.41Å; L34-V197 WeakPolarHBondContact O-CG2 3.24Å; L34-I218 WeakPolarHBondContact CA-O 3.31Å; L34-I218 HydrophobicContact CD2-CB 3.7Å; L34-I218 HydrophobicContact CD2-CD1 4Å; L34-I218 HydrophobicContact CD2-CG1 4.32Å; L34-I218 HydrophobicContact CD2-CG2 4.18Å
35	L	98.3	Very high	94.7	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	158.8	179	-63.1	179.2	0	0	0	111.4	L33 V197 W207 I217 I218 F219 I220 I249 F255	L33-L35 HydrophobicContact CD1-CD2 4.25Å; L33-L35 HydrophobicContact CD2-CD1 4.02Å; L33-L35 HydrophobicContact CD2-CD2 4.14Å; L33-L35 HydrophobicContact CD2-CG 4.16Å; L33-L35 HydrophobicContact CG-CD1 4.29Å; L33-L35 HydrophobicContact CG-CD2 3.96Å; L33-L35 HydrophobicContact CG-CG 3.92Å; L35-V197 HydrophobicContact CD2-CG2 3.77Å; L35-W207 HydrophobicContact CD2-CD2 3.82Å; L35-W207 HydrophobicContact CD2-CE3 3.69Å; L35-W207 HydrophobicContact CD2-CG 4.33Å; L35-W207 HydrophobicContact CD2-CH2 4.36Å; L35-W207 HydrophobicContact CD2-CZ2 4.5Å; L35-W207 HydrophobicContact CD2-CZ3 3.97Å; L35-I217 HydrophobicContact CB-CG2 4.38Å; L35-I217 HydrophobicContact CD1-CD1 4.46Å; L35-I217 HydrophobicContact CD1-CG2 3.92Å; L35-I217 HydrophobicContact CG-CG2 4.24Å; L35-I218 PolarHBondContact N-O 2.86Å; L35-F219 HydrophobicContact CB-CD2 3.93Å; L35-F219 HydrophobicContact CB-CE2 4.47Å; L35-F219 CarbonylContact O-C 3.6Å; L35-F219 WeakPolarHBondContact O-CA 3.42Å; L35-I220 PolarHBondContact O-N 3.49Å; L35-I249 HydrophobicContact CD1-CD1 3.83Å; L35-I249 HydrophobicContact CD1-CG1 4.06Å; L35-I249 HydrophobicContact CD1-CG2 3.71Å; L35-F255 HydrophobicContact CD1-CE2 4.33Å
36	G	98	Very high	95.4	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	16%	0.158	C	C	.	.			trans	143.4	164.1	-179.4	0	0	0	0	0	112.3	K42 G199	G36-K42 PolarHBondContact O-NZ 3.06Å; G36-G199 WeakPolarHBondContact O-CA 3.47Å
37	A	96.8	Very high	96.1	Very high	11 Å²	11	23.1 Å²	23.1	9%	0.091	13%	0.134	C	C	.	.	S	Bend	trans	-60.3	168.3	-179.2	0	0	0	0	0	112.5	E39 S40 K42 L245	A37-E39 PolarHBondContact O-N 3.28Å; A37-S40 PolarHBondContact O-N 3.46Å; A37-S40 PolarHBondContact O-OG 2.69Å; A37-K42 PolarHBondContact O-NZ 3.17Å; A37-L245 HydrophobicContact CB-CD2 4.4Å
38	G	94.3	Very high	96.7	Very high	20 Å²	20	19.3 Å²	19.3	21%	0.206	10%	0.103	C	C	.	.	T	Hydrogen-bonded Turn	trans	-51.1	141.7	169.5	0	0	0	0	0	110.4	S40 G199	G38-S40 PolarHBondContact O-N 2.92Å; G38-S40 VanDerWaalsContact O-N 3.08Å; G38-G199 PolarHBondContact N-O 3.33Å
39	E	94.7	Very high	97	Very high	48 Å²	48	12.9 Å²	12.9	22%	0.224	8%	0.079	C	C	.	.	T	Hydrogen-bonded Turn	trans	65.9	10.9	173.2	-41.4	-166.3	142.2	0	0	115.7	A37 G41 R174 R238 K266	A37-E39 PolarHBondContact O-N 3.28Å; E39-G41 PolarHBondContact O-N 3.41Å; E39-R174 IonicContact OE1-CZ 3.61Å; E39-R174 IonicContact OE1-NE 2.8Å; E39-R174 PolarHBondContact OE1-NE 2.69Å; E39-R174 IonicContact OE1-NH2 3.29Å; E39-R174 PolarHBondContact OE1-NH2 3.09Å; E39-R238 IonicContact OE2-CZ 3.5Å; E39-R238 IonicContact OE2-NH1 3.41Å; E39-R238 PolarHBondContact OE2-NH1 3.22Å; E39-R238 IonicContact OE2-NH2 2.74Å; E39-R238 PolarHBondContact OE2-NH2 2.97Å; E39-K266 WeakPolarHBondContact O-CE 3.34Å; E39-K266 PolarHBondContact O-NZ 3.25Å
40	S	97.5	Very high	97.2	Very high	3 Å²	3	13.1 Å²	13.1	2%	0.021	8%	0.077	C	C	.	.	S	Bend	trans	-69.6	-18.5	177.3	66.8	0	0	0	0	114.5	A37 G38 I220 N265	A37-S40 PolarHBondContact O-N 3.46Å; A37-S40 PolarHBondContact O-OG 2.69Å; G38-S40 PolarHBondContact O-N 2.92Å; G38-S40 VanDerWaalsContact O-N 3.08Å; S40-I220 WeakPolarHBondContact CB-O 3.44Å; S40-I220 VanDerWaalsContact O-CG2 3.27Å; S40-I220 WeakPolarHBondContact O-CG2 3.31Å; S40-I220 PolarHBondContact OG-O 3.22Å; S40-N265 PolarHBondContact O-ND2 3.17Å
41	G	97.2	Very high	97.3	Very high	11 Å²	11	14 Å²	14	11%	0.113	8%	0.081	C	C	.	.	S	Bend	trans	112.1	11.8	177.9	0	0	0	0	0	115.9	E39 T44 I45	E39-G41 PolarHBondContact O-N 3.41Å; G41-T44 WeakPolarHBondContact O-CB 3.3Å; G41-T44 PolarHBondContact O-N 3.44Å; G41-I45 PolarHBondContact O-N 3.24Å
42	K	97.9	Very high	97.3	Very high	9 Å²	9	14 Å²	14	4%	0.039	8%	0.082	C	C	.	.	H	α-helix	trans	-53.2	-56.6	178.5	-60.8	-177.7	-64.5	-66.2	0	113.7	L34 G36 A37 T44 I45 V46 D196 V197 I220	L34-K42 HydrophobicContact CB-CB 4.22Å; L34-K42 HydrophobicContact CB-CD 4.18Å; L34-K42 HydrophobicContact CB-CG 4.21Å; L34-K42 HydrophobicContact CD1-CB 4.26Å; G36-K42 PolarHBondContact O-NZ 3.06Å; A37-K42 PolarHBondContact O-NZ 3.17Å; K42-T44 PolarHBondContact O-N 2.92Å; K42-I45 WeakPolarHBondContact O-CA 3.43Å; K42-I45 WeakPolarHBondContact O-CB 3.44Å; K42-I45 PolarHBondContact O-N 3.14Å; K42-V46 PolarHBondContact O-N 3.01Å; K42-V46 VanDerWaalsContact O-N 3.1Å; K42-D196 WeakPolarHBondContact CB-OD1 3.47Å; K42-V197 WeakPolarHBondContact CE-O 3.05Å; K42-I220 HydrophobicContact CB-CD1 4.13Å; K42-I220 HydrophobicContact CG-CB 4.29Å; K42-I220 HydrophobicContact CG-CD1 3.76Å; K42-I220 HydrophobicContact CG-CG1 4.25Å
43	S	97.7	Very high	97.3	Very high	32 Å²	32	16.2 Å²	16.2	22%	0.224	9%	0.093	C	C	.	.	H	α-helix	trans	-64.2	-26.3	-179.9	-44.8	0	0	0	0	112.4	V46 K47 T177 D196	S43-V46 PolarHBondContact O-N 2.86Å; S43-K47 VanDerWaalsContact O-CG 3.26Å; S43-K47 WeakPolarHBondContact O-CG 3.47Å; S43-K47 PolarHBondContact O-N 2.82Å; S43-T177 PolarHBondContact OG-OG1 2.89Å; S43-D196 WeakPolarHBondContact CA-OD2 3.46Å; S43-D196 VanDerWaalsContact CB-OD2 3.31Å; S43-D196 WeakPolarHBondContact CB-OD2 3.43Å; S43-D196 PolarHBondContact OG-OD2 3.31Å
44	T	98	Very high	97.1	Very high	25 Å²	25	19.7 Å²	19.7	15%	0.153	11%	0.109	C	C	.	.	H	α-helix	trans	-68	-39	172	-50.2	0	0	0	0	111.2	G41 K42 V46 K47 Q48 L171 A322 T323	G41-T44 WeakPolarHBondContact O-CB 3.3Å; G41-T44 PolarHBondContact O-N 3.44Å; K42-T44 PolarHBondContact O-N 2.92Å; T44-V46 VanDerWaalsContact C-N 3.34Å; T44-K47 WeakPolarHBondContact O-CB 3.44Å; T44-K47 PolarHBondContact O-N 2.84Å; T44-Q48 VanDerWaalsContact O-CG 3.32Å; T44-Q48 WeakPolarHBondContact O-CG 3.48Å; T44-Q48 PolarHBondContact O-N 3.44Å; T44-L171 HydrophobicContact CG2-CB 4.43Å; T44-L171 HydrophobicContact CG2-CD2 3.9Å; T44-A322 HydrophobicContact CG2-CB 3.63Å; T44-A322 WeakPolarHBondContact CG2-O 3.32Å; T44-T323 HydrophobicContact CG2-CG2 4.17Å
45	I	98.2	Very high	96.9	Very high	1 Å²	1	27.9 Å²	27.9	1%	0.005	15%	0.153	C	C	.	.	H	α-helix	trans	-62.5	-40.8	172	-64.9	-58.4	0	0	0	111.4	L34 G41 K42 K47 Q48 M49 I220 F263 A322 V328	L34-I45 HydrophobicContact CD1-CB 4.4Å; L34-I45 HydrophobicContact CD1-CG2 4.36Å; G41-I45 PolarHBondContact O-N 3.24Å; K42-I45 WeakPolarHBondContact O-CA 3.43Å; K42-I45 WeakPolarHBondContact O-CB 3.44Å; K42-I45 PolarHBondContact O-N 3.14Å; I45-K47 PolarHBondContact O-N 2.96Å; I45-Q48 WeakPolarHBondContact O-CB 3.48Å; I45-Q48 PolarHBondContact O-N 3.24Å; I45-M49 WeakPolarHBondContact O-CG 3.45Å; I45-M49 PolarHBondContact O-N 2.99Å; I45-I220 HydrophobicContact CB-CD1 4.38Å; I45-I220 HydrophobicContact CG1-CD1 3.84Å; I45-F263 HydrophobicContact CD1-CD2 4.42Å; I45-F263 HydrophobicContact CD1-CE2 4.36Å; I45-F263 HydrophobicContact CG1-CD2 4.48Å; I45-A322 HydrophobicContact CD1-CB 3.71Å; I45-A322 HydrophobicContact CG1-CB 4.23Å; I45-V328 HydrophobicContact CD1-CG1 4.13Å; I45-V328 HydrophobicContact CD1-CG2 3.85Å
46	V	97.8	Very high	96.8	Very high	19 Å²	19	28.1 Å²	28.1	12%	0.115	16%	0.155	C	C	.	.	H	α-helix	trans	-60.3	-47.1	173.5	179.6	0	0	0	0	111.3	L34 K42 S43 T44 Q48 M49 K50 T183 M194 D196	L34-V46 HydrophobicContact CD1-CG2 3.63Å; K42-V46 PolarHBondContact O-N 3.01Å; K42-V46 VanDerWaalsContact O-N 3.1Å; S43-V46 PolarHBondContact O-N 2.86Å; T44-V46 VanDerWaalsContact C-N 3.34Å; V46-Q48 PolarHBondContact O-N 2.78Å; V46-M49 WeakPolarHBondContact O-CB 3.4Å; V46-M49 PolarHBondContact O-N 3.07Å; V46-K50 PolarHBondContact O-N 3.26Å; V46-T183 HydrophobicContact CG1-CG2 4.14Å; V46-T183 VanDerWaalsContact CG1-OG1 3.28Å; V46-T183 WeakPolarHBondContact CG1-OG1 3.45Å; V46-M194 HydrophobicContact CG2-CG 4.43Å; V46-M194 HydrophobicContact CG2-SD 3.92Å; V46-D196 HydrophobicContact CG2-CB 3.6Å
47	K	97.7	Very high	96.7	Very high	28 Å²	28	29.9 Å²	29.9	12%	0.122	16%	0.162	C	C	.	.	H	α-helix	trans	-57.5	-35.5	176.8	-72	173.8	177.8	-176.4	0	112	S43 T44 I45 K50 I51 Y57 V170 L171 S173	S43-K47 VanDerWaalsContact O-CG 3.26Å; S43-K47 WeakPolarHBondContact O-CG 3.47Å; S43-K47 PolarHBondContact O-N 2.82Å; T44-K47 WeakPolarHBondContact O-CB 3.44Å; T44-K47 PolarHBondContact O-N 2.84Å; I45-K47 PolarHBondContact O-N 2.96Å; K47-K50 PolarHBondContact O-N 2.94Å; K47-I51 PolarHBondContact O-N 3.19Å; K47-Y57 WeakPolarHBondContact CA-OH 3.33Å; K47-Y57 WeakPolarHBondContact CB-OH 3.27Å; K47-Y57 VanDerWaalsContact CG-OH 3.25Å; K47-Y57 WeakPolarHBondContact CG-OH 3.48Å; K47-Y57 PolarHBondContact O-OH 3.3Å; K47-V170 HydrophobicContact CD-CG1 4.37Å; K47-V170 PolarHBondContact NZ-O 3.29Å; K47-L171 HydrophobicContact CB-CD2 3.88Å; K47-S173 PolarHBondContact NZ-O 2.91Å; K47-S173 PolarHBondContact NZ-OG 2.75Å
48	Q	98.1	Very high	96.7	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-68.1	-37.2	175	-71.3	-75	21.9	0	0	112.6	T44 I45 V46 K50 I51 I52 L171 A322 T325 V328	T44-Q48 VanDerWaalsContact O-CG 3.32Å; T44-Q48 WeakPolarHBondContact O-CG 3.48Å; T44-Q48 PolarHBondContact O-N 3.44Å; I45-Q48 WeakPolarHBondContact O-CB 3.48Å; I45-Q48 PolarHBondContact O-N 3.24Å; V46-Q48 PolarHBondContact O-N 2.78Å; Q48-K50 PolarHBondContact O-N 3.06Å; Q48-I51 PolarHBondContact O-N 3.03Å; Q48-I51 VanDerWaalsContact O-N 3.13Å; Q48-I52 HydrophobicContact CB-CD1 4.05Å; Q48-I52 VanDerWaalsContact O-CB 3.29Å; Q48-I52 WeakPolarHBondContact O-CB 3.26Å; Q48-I52 WeakPolarHBondContact O-CD1 3.42Å; Q48-I52 WeakPolarHBondContact O-CG1 3.02Å; Q48-I52 PolarHBondContact O-N 2.74Å; Q48-L171 HydrophobicContact CG-CD2 3.65Å; Q48-A322 VanDerWaalsContact CG-O 3.26Å; Q48-A322 WeakPolarHBondContact CG-O 3.44Å; Q48-A322 PolarHBondContact NE2-O 2.87Å; Q48-T325 PolarHBondContact NE2-OG1 2.8Å; Q48-T325 PolarHBondContact OE1-OG1 2.68Å; Q48-V328 HydrophobicContact CB-CB 4.4Å; Q48-V328 HydrophobicContact CB-CG1 3.76Å; Q48-V328 HydrophobicContact CG-CB 4.28Å; Q48-V328 HydrophobicContact CG-CG1 4.11Å; Q48-V328 HydrophobicContact CG-CG2 4.11Å
49	M	97.5	Very high	96.9	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-60.6	-35.7	176.6	-62.6	-58.2	93.4	0	0	111.6	I45 V46 I52 H53 F185 M194 V328 F332	I45-M49 WeakPolarHBondContact O-CG 3.45Å; I45-M49 PolarHBondContact O-N 2.99Å; V46-M49 WeakPolarHBondContact O-CB 3.4Å; V46-M49 PolarHBondContact O-N 3.07Å; M49-I52 HydrophobicContact CE-CD1 4.01Å; M49-H53 WeakPolarHBondContact O-CA 3.32Å; M49-H53 WeakPolarHBondContact O-CB 3.19Å; M49-H53 PolarHBondContact O-N 2.95Å; M49-F185 HydrophobicContact CB-CD1 3.91Å; M49-F185 HydrophobicContact CB-CE1 3.7Å; M49-F185 HydrophobicContact CB-CG 4.42Å; M49-F185 HydrophobicContact CB-CZ 4.05Å; M49-F185 HydrophobicContact CG-CD1 4.31Å; M49-F185 HydrophobicContact CG-CE1 3.59Å; M49-F185 HydrophobicContact CG-CE2 4.37Å; M49-F185 HydrophobicContact CG-CZ 3.63Å; M49-F185 HydrophobicContact SD-CE1 4.07Å; M49-F185 HydrophobicContact SD-CE2 3.82Å; M49-F185 HydrophobicContact SD-CZ 3.44Å; M49-F185 WeakPolarHBondContact SD-CZ 3.42Å; M49-M194 HydrophobicContact CG-CE 3.55Å; M49-M194 HydrophobicContact CG-SD 3.76Å; M49-M194 HydrophobicContact SD-CE 3.93Å; M49-V328 HydrophobicContact CE-CG1 3.81Å; M49-F332 HydrophobicContact CE-CB 4.36Å; M49-F332 HydrophobicContact CE-CD1 4.45Å; M49-F332 HydrophobicContact CE-CD2 4.07Å; M49-F332 HydrophobicContact CE-CG 4.02Å; M49-F332 HydrophobicContact SD-CD1 4.04Å; M49-F332 HydrophobicContact SD-CD2 3.84Å; M49-F332 HydrophobicContact SD-CE1 3.95Å; M49-F332 HydrophobicContact SD-CE2 3.74Å; M49-F332 HydrophobicContact SD-CG 3.99Å; M49-F332 HydrophobicContact SD-CZ 3.81Å
50	K	96.5	Very high	97	Very high	39 Å²	39	41.1 Å²	41.1	17%	0.17	22%	0.217	C	C	.	.	H	α-helix	trans	-65.1	-46	173.1	-177.7	162.8	176.7	174.3	0	112.7	V46 K47 Q48 I52 Q54 G56 Y57 E61	V46-K50 PolarHBondContact O-N 3.26Å; K47-K50 PolarHBondContact O-N 2.94Å; Q48-K50 PolarHBondContact O-N 3.06Å; K50-I52 PolarHBondContact O-N 3.11Å; K50-Q54 HydrophobicContact CG-CB 4.24Å; K50-Q54 CarbonylContact O-C 3.59Å; K50-Q54 VanDerWaalsContact O-C 3.28Å; K50-Q54 VanDerWaalsContact O-CA 3.32Å; K50-Q54 WeakPolarHBondContact O-CA 3.32Å; K50-Q54 WeakPolarHBondContact O-CB 3.32Å; K50-Q54 PolarHBondContact O-N 3.23Å; K50-G56 WeakPolarHBondContact CE-O 3.31Å; K50-G56 WeakPolarHBondContact CG-O 3.46Å; K50-G56 PolarHBondContact O-N 2.98Å; K50-G56 VanDerWaalsContact O-N 3.12Å; K50-Y57 HydrophobicContact CD-CD1 4.03Å; K50-Y57 HydrophobicContact CD-CE1 3.64Å; K50-Y57 HydrophobicContact CD-CE2 4.46Å; K50-Y57 HydrophobicContact CG-CE1 4.47Å; K50-Y57 HydrophobicContact CG-CE2 4.46Å; K50-E61 IonicContact NZ-OE1 3.51Å; K50-E61 PolarHBondContact NZ-OE1 3.27Å; K50-E61 IonicContact NZ-OE2 2.69Å; K50-E61 PolarHBondContact NZ-OE2 2.75Å
51	I	97.2	Very high	97	Very high	18 Å²	18	43.9 Å²	43.9	9%	0.092	23%	0.229	C	C	.	.	H	α-helix	trans	-62.5	-42.2	175.8	-66.6	165.8	0	0	0	112.1	K47 Q48 Y57 E167 L171 T325	K47-I51 PolarHBondContact O-N 3.19Å; Q48-I51 PolarHBondContact O-N 3.03Å; Q48-I51 VanDerWaalsContact O-N 3.13Å; I51-Y57 HydrophobicContact CD1-CE2 4.01Å; I51-Y57 HydrophobicContact CG1-CD2 4.1Å; I51-Y57 HydrophobicContact CG1-CE2 3.71Å; I51-E167 HydrophobicContact CD1-CB 4.02Å; I51-E167 HydrophobicContact CD1-CG 4.23Å; I51-E167 HydrophobicContact CG1-CG 4.37Å; I51-L171 HydrophobicContact CD1-CD1 3.87Å; I51-L171 HydrophobicContact CD1-CD2 3.9Å; I51-L171 HydrophobicContact CD1-CG 3.82Å; I51-T325 HydrophobicContact CG2-CG2 4.1Å
52	I	97	Very high	97	Very high	30 Å²	30	44 Å²	44	15%	0.154	23%	0.228	C	C	.	.	H	α-helix	trans	-82.4	-36.7	-170.8	-64.7	168.2	0	0	0	111.7	Q48 M49 K50 T325 V328 K329	Q48-I52 HydrophobicContact CB-CD1 4.05Å; Q48-I52 VanDerWaalsContact O-CB 3.29Å; Q48-I52 WeakPolarHBondContact O-CB 3.26Å; Q48-I52 WeakPolarHBondContact O-CD1 3.42Å; Q48-I52 WeakPolarHBondContact O-CG1 3.02Å; Q48-I52 PolarHBondContact O-N 2.74Å; M49-I52 HydrophobicContact CE-CD1 4.01Å; K50-I52 PolarHBondContact O-N 3.11Å; I52-T325 HydrophobicContact CD1-CG2 4.35Å; I52-T325 HydrophobicContact CG1-CG2 3.93Å; I52-V328 HydrophobicContact CD1-CB 4.22Å; I52-V328 HydrophobicContact CD1-CG1 3.84Å; I52-K329 HydrophobicContact CB-CG 4.34Å; I52-K329 HydrophobicContact CD1-CB 4.46Å; I52-K329 HydrophobicContact CD1-CG 3.56Å; I52-K329 HydrophobicContact CG1-CD 4.35Å; I52-K329 HydrophobicContact CG1-CG 3.68Å; I52-K329 HydrophobicContact CG2-CD 4.32Å; I52-K329 HydrophobicContact CG2-CG 3.69Å
53	H	95.9	Very high	97	Very high	46 Å²	46	47.3 Å²	47.3	21%	0.213	25%	0.246	C	C	.	.	H	α-helix	trans	-124.6	-0.9	-167.9	-57.9	-63.8	0	0	0	114.7	M49 F185 F187 F332	M49-H53 WeakPolarHBondContact O-CA 3.32Å; M49-H53 WeakPolarHBondContact O-CB 3.19Å; M49-H53 PolarHBondContact O-N 2.95Å; H53-F185 HydrophobicContact CB-CB 4.18Å; H53-F185 HydrophobicContact CB-CD2 3.98Å; H53-F185 HydrophobicContact CB-CG 4.37Å; H53-F185 AromaticContact CD2-CD2 3.68Å; H53-F185 AromaticContact CD2-CE2 3.74Å; H53-F185 AromaticContact CG-CD2 3.95Å; H53-F187 AromaticContact CE1-CD2 3.27Å; H53-F187 WeakPolarHBondContact CE1-CD2 3.16Å; H53-F187 AromaticContact CE1-CE2 3.72Å; H53-F187 AromaticContact CE1-CG 3.49Å; H53-F187 VanDerWaalsContact CE1-CG 3.49Å; H53-F187 WeakPolarHBondContact CE1-CG 3.35Å; H53-F187 AromaticContact ND1-CD2 3.72Å; H53-F332 AromaticContact NE2-CD1 3.87Å
54	Q	94.8	Very high	96.9	Very high	74 Å²	74	52 Å²	52	35%	0.346	26%	0.264	S	S	.	.	S	Bend	trans	-138	33	-177	-51.2	-175.6	-56.9	0	0	113.2	K50 G56 Q184 F185	K50-Q54 HydrophobicContact CG-CB 4.24Å; K50-Q54 CarbonylContact O-C 3.59Å; K50-Q54 VanDerWaalsContact O-C 3.28Å; K50-Q54 VanDerWaalsContact O-CA 3.32Å; K50-Q54 WeakPolarHBondContact O-CA 3.32Å; K50-Q54 WeakPolarHBondContact O-CB 3.32Å; K50-Q54 PolarHBondContact O-N 3.23Å; Q54-G56 PolarHBondContact O-N 3.09Å; Q54-Q184 PolarHBondContact NE2-O 2.92Å; Q54-F185 HydrophobicContact CG-CB 4.1Å
55	D	94.7	Very high	96.9	Very high	171 Å²	171	52.1 Å²	52.1	91%	0.914	26%	0.263	S	S	*	.			trans	59.5	19.6	176	-54.5	-49.8	0	0	0	115.5
56	G	95.4	Very high	96.9	Very high	5 Å²	5	53.8 Å²	53.8	5%	0.052	27%	0.271	C	S	.	.			trans	77.7	-150.4	176	0	0	0	0	0	114.3	K50 Q54	K50-G56 WeakPolarHBondContact CE-O 3.31Å; K50-G56 WeakPolarHBondContact CG-O 3.46Å; K50-G56 PolarHBondContact O-N 2.98Å; K50-G56 VanDerWaalsContact O-N 3.12Å; Q54-G56 PolarHBondContact O-N 3.09Å
57	Y	96.9	Very high	96.9	Very high	37 Å²	37	55.1 Å²	55.1	15%	0.145	29%	0.285	C	S	.	.			trans	-105.5	134.1	-177	-66	-93.1	0	0	0	109.7	K47 K50 I51 E61 C62 F65 V170	K47-Y57 WeakPolarHBondContact CA-OH 3.33Å; K47-Y57 WeakPolarHBondContact CB-OH 3.27Å; K47-Y57 VanDerWaalsContact CG-OH 3.25Å; K47-Y57 WeakPolarHBondContact CG-OH 3.48Å; K47-Y57 PolarHBondContact O-OH 3.3Å; K50-Y57 HydrophobicContact CD-CD1 4.03Å; K50-Y57 HydrophobicContact CD-CE1 3.64Å; K50-Y57 HydrophobicContact CD-CE2 4.46Å; K50-Y57 HydrophobicContact CG-CE1 4.47Å; K50-Y57 HydrophobicContact CG-CE2 4.46Å; I51-Y57 HydrophobicContact CD1-CE2 4.01Å; I51-Y57 HydrophobicContact CG1-CD2 4.1Å; I51-Y57 HydrophobicContact CG1-CE2 3.71Å; Y57-E61 HydrophobicContact CD1-CB 4.24Å; Y57-C62 VanDerWaalsContact CB-SG 3.55Å; Y57-F65 AromaticContact CD1-CE2 3.95Å; Y57-F65 HydrophobicContact CD1-CE2 3.95Å; Y57-F65 AromaticContact CE1-CE2 3.9Å; Y57-F65 HydrophobicContact CE1-CE2 3.9Å; Y57-F65 HydrophobicContact CE1-CZ 4.19Å; Y57-V170 HydrophobicContact CD1-CG1 4.41Å; Y57-V170 HydrophobicContact CD2-CG1 4.09Å; Y57-V170 HydrophobicContact CE1-CG1 4.01Å; Y57-V170 HydrophobicContact CE2-CG1 3.67Å; Y57-V170 HydrophobicContact CG-CG1 4.46Å
58	S	96.8	Very high	96.9	Very high	58 Å²	58	56.2 Å²	56.2	41%	0.406	29%	0.291	S	S	.	.			trans	-67.1	163.4	170.9	66.8	0	0	0	0	111.1	E60 E61 C62	S58-E60 VanDerWaalsContact C-N 3.28Å; S58-E60 PolarHBondContact O-N 3.07Å; S58-E61 PolarHBondContact N-OE2 3.38Å; S58-E61 PolarHBondContact O-N 3.36Å; S58-E61 VanDerWaalsContact OG-CG 3.23Å; S58-E61 WeakPolarHBondContact OG-CG 3.39Å; S58-E61 PolarHBondContact OG-N 3.48Å; S58-E61 PolarHBondContact OG-OE2 3.39Å; S58-E61 VanDerWaalsContact OG-OE2 3.05Å; S58-C62 PolarHBondContact O-N 2.8Å; S58-C62 PolarHBondContact O-SG 3Å
59	L	97.3	Very high	96.9	Very high	111 Å²	111	56.2 Å²	56.2	58%	0.581	29%	0.291	S	S	*	.	H	α-helix	trans	-56.8	-43.5	176.9	177.3	60.9	0	0	0	111.9	E61 C62 L63 V164	L59-E61 PolarHBondContact O-N 2.79Å; L59-C62 PolarHBondContact O-N 3.17Å; L59-L63 HydrophobicContact CD1-CD1 4.42Å; L59-L63 HydrophobicContact CD1-CG 4.28Å; L59-L63 HydrophobicContact CG-CD1 4.28Å; L59-L63 VanDerWaalsContact O-CG 3.28Å; L59-L63 WeakPolarHBondContact O-CG 3.5Å; L59-L63 PolarHBondContact O-N 2.97Å; L59-V164 HydrophobicContact CD1-CG1 3.7Å; L59-V164 HydrophobicContact CD1-CG2 3.91Å
60	E	97.4	Very high	96.9	Very high	147 Å²	147	57.7 Å²	57.7	69%	0.687	30%	0.297	S	S	*	.	H	α-helix	trans	-59.8	-47.6	179.2	-173.7	169.4	-169.6	0	0	111.2	S58 C62 L63 E64	S58-E60 VanDerWaalsContact C-N 3.28Å; S58-E60 PolarHBondContact O-N 3.07Å; E60-C62 PolarHBondContact O-N 3.42Å; E60-L63 WeakPolarHBondContact O-CB 3.44Å; E60-L63 PolarHBondContact O-N 3.06Å; E60-L63 VanDerWaalsContact O-N 3.14Å; E60-E64 PolarHBondContact O-N 2.98Å
61	E	97	Very high	96.9	Very high	60 Å²	60	56.5 Å²	56.5	28%	0.28	30%	0.295	S	S	.	.	H	α-helix	trans	-64.6	-39.3	177.1	-66.1	170.2	136.2	0	0	112.3	K50 Y57 S58 L59 L63 E64 F65	K50-E61 IonicContact NZ-OE1 3.51Å; K50-E61 PolarHBondContact NZ-OE1 3.27Å; K50-E61 IonicContact NZ-OE2 2.69Å; K50-E61 PolarHBondContact NZ-OE2 2.75Å; Y57-E61 HydrophobicContact CD1-CB 4.24Å; S58-E61 PolarHBondContact N-OE2 3.38Å; S58-E61 PolarHBondContact O-N 3.36Å; S58-E61 VanDerWaalsContact OG-CG 3.23Å; S58-E61 WeakPolarHBondContact OG-CG 3.39Å; S58-E61 PolarHBondContact OG-N 3.48Å; S58-E61 PolarHBondContact OG-OE2 3.39Å; S58-E61 VanDerWaalsContact OG-OE2 3.05Å; L59-E61 PolarHBondContact O-N 2.79Å; E61-L63 VanDerWaalsContact C-N 3.29Å; E61-L63 PolarHBondContact O-N 2.81Å; E61-E64 WeakPolarHBondContact O-CB 3.25Å; E61-E64 PolarHBondContact O-N 3.47Å; E61-F65 WeakPolarHBondContact O-CD2 3.28Å
62	C	97.8	Very high	97	Very high	13 Å²	13	56.7 Å²	56.7	9%	0.088	30%	0.296	C	S	.	.	H	α-helix	trans	-59.8	-41.2	173.7	-74.7	0	0	0	0	111.4	Y57 S58 L59 E60 E64 F65 V164 P165	Y57-C62 VanDerWaalsContact CB-SG 3.55Å; S58-C62 PolarHBondContact O-N 2.8Å; S58-C62 PolarHBondContact O-SG 3Å; L59-C62 PolarHBondContact O-N 3.17Å; E60-C62 PolarHBondContact O-N 3.42Å; C62-E64 VanDerWaalsContact C-N 3.3Å; C62-E64 PolarHBondContact O-N 3.21Å; C62-F65 WeakPolarHBondContact O-CB 3.31Å; C62-F65 PolarHBondContact O-N 3.14Å; C62-F65 VanDerWaalsContact O-N 3.15Å; C62-V164 HydrophobicContact CB-CG1 4.01Å; C62-P165 WeakPolarHBondContact O-CD 3.46Å; C62-P165 WeakPolarHBondContact O-CG 3.26Å
63	L	97.4	Very high	97	Very high	80 Å²	80	55.2 Å²	55.2	42%	0.419	29%	0.289	S	S	.	.	H	α-helix	trans	-65.7	-32	179.3	-67.3	174.8	0	0	0	112.4	L59 E60 E61 F65 I66 V164	L59-L63 HydrophobicContact CD1-CD1 4.42Å; L59-L63 HydrophobicContact CD1-CG 4.28Å; L59-L63 HydrophobicContact CG-CD1 4.28Å; L59-L63 VanDerWaalsContact O-CG 3.28Å; L59-L63 WeakPolarHBondContact O-CG 3.5Å; L59-L63 PolarHBondContact O-N 2.97Å; E60-L63 WeakPolarHBondContact O-CB 3.44Å; E60-L63 PolarHBondContact O-N 3.06Å; E60-L63 VanDerWaalsContact O-N 3.14Å; E61-L63 VanDerWaalsContact C-N 3.29Å; E61-L63 PolarHBondContact O-N 2.81Å; L63-F65 PolarHBondContact O-N 3.4Å; L63-I66 HydrophobicContact CD2-CD1 3.68Å; L63-I66 WeakPolarHBondContact O-CB 3.42Å; L63-I66 WeakPolarHBondContact O-CG1 3.34Å; L63-I66 PolarHBondContact O-N 2.84Å; L63-I66 VanDerWaalsContact O-N 3.17Å; L63-V164 HydrophobicContact CD2-CG2 4.37Å
64	E	96.5	Very high	97.1	Very high	130 Å²	130	54 Å²	54	61%	0.607	28%	0.284	S	S	*	.	H	α-helix	trans	-61.9	-27.8	173.9	-65.9	177.3	177.4	0	0	112.8	E60 E61 C62 I66	E60-E64 PolarHBondContact O-N 2.98Å; E61-E64 WeakPolarHBondContact O-CB 3.25Å; E61-E64 PolarHBondContact O-N 3.47Å; C62-E64 VanDerWaalsContact C-N 3.3Å; C62-E64 PolarHBondContact O-N 3.21Å; E64-I66 VanDerWaalsContact C-N 3.29Å; E64-I66 PolarHBondContact O-N 3.41Å
65	F	97.9	Very high	97.2	Very high	27 Å²	27	54.8 Å²	54.8	12%	0.118	29%	0.288	C	S	.	.	H	α-helix	trans	-74	-15.3	177.7	-76.7	-78.4	0	0	0	114.1	Y57 E61 C62 L63 A67 I68 I69 P165 V170 S173	Y57-F65 AromaticContact CD1-CE2 3.95Å; Y57-F65 HydrophobicContact CD1-CE2 3.95Å; Y57-F65 AromaticContact CE1-CE2 3.9Å; Y57-F65 HydrophobicContact CE1-CE2 3.9Å; Y57-F65 HydrophobicContact CE1-CZ 4.19Å; E61-F65 WeakPolarHBondContact O-CD2 3.28Å; C62-F65 WeakPolarHBondContact O-CB 3.31Å; C62-F65 PolarHBondContact O-N 3.14Å; C62-F65 VanDerWaalsContact O-N 3.15Å; L63-F65 PolarHBondContact O-N 3.4Å; F65-A67 PolarHBondContact O-N 3.34Å; F65-I68 HydrophobicContact CD1-CD1 3.91Å; F65-I68 HydrophobicContact CE1-CD1 4.26Å; F65-I68 PolarHBondContact O-N 3.45Å; F65-I69 HydrophobicContact CB-CD1 3.99Å; F65-I69 WeakPolarHBondContact O-CB 3.39Å; F65-I69 WeakPolarHBondContact O-CD1 3.44Å; F65-I69 VanDerWaalsContact O-CG1 3.26Å; F65-I69 WeakPolarHBondContact O-CG1 3.36Å; F65-I69 PolarHBondContact O-N 2.91Å; F65-P165 HydrophobicContact CB-CB 4.43Å; F65-P165 HydrophobicContact CB-CG 4.32Å; F65-V170 HydrophobicContact CB-CG2 4.33Å; F65-V170 HydrophobicContact CD1-CG1 4.32Å; F65-V170 HydrophobicContact CD2-CB 4.41Å; F65-V170 HydrophobicContact CD2-CG1 3.99Å; F65-V170 HydrophobicContact CD2-CG2 3.66Å; F65-V170 HydrophobicContact CE1-CG1 3.97Å; F65-V170 HydrophobicContact CE2-CB 4.49Å; F65-V170 HydrophobicContact CE2-CG1 3.61Å; F65-V170 HydrophobicContact CE2-CG2 4.11Å; F65-V170 HydrophobicContact CG-CG1 4.35Å; F65-V170 HydrophobicContact CG-CG2 3.94Å; F65-V170 HydrophobicContact CZ-CG1 3.6Å; F65-S173 WeakPolarHBondContact CD1-OG 3.42Å
66	I	98	Very high	97.4	Very high	36 Å²	36	46.7 Å²	46.7	19%	0.185	25%	0.245	C	C	.	.	H	α-helix	trans	-57.6	-50.3	-177	-67.5	176.2	0	0	0	110.8	L63 E64 I68 I69 Y70 Y163 P165	L63-I66 HydrophobicContact CD2-CD1 3.68Å; L63-I66 WeakPolarHBondContact O-CB 3.42Å; L63-I66 WeakPolarHBondContact O-CG1 3.34Å; L63-I66 PolarHBondContact O-N 2.84Å; L63-I66 VanDerWaalsContact O-N 3.17Å; E64-I66 VanDerWaalsContact C-N 3.29Å; E64-I66 PolarHBondContact O-N 3.41Å; I66-I68 VanDerWaalsContact C-N 3.29Å; I66-I68 PolarHBondContact O-N 2.88Å; I66-I69 PolarHBondContact O-N 2.82Å; I66-Y70 HydrophobicContact CG2-CD2 3.84Å; I66-Y70 HydrophobicContact CG2-CE1 4.32Å; I66-Y70 HydrophobicContact CG2-CE2 3.46Å; I66-Y70 VanDerWaalsContact CG2-CE2 3.46Å; I66-Y70 HydrophobicContact CG2-CG 4.42Å; I66-Y70 PolarHBondContact O-N 3.05Å; I66-Y163 HydrophobicContact CG1-CD1 4.42Å; I66-Y163 HydrophobicContact CG1-CE1 4.45Å; I66-P165 HydrophobicContact CG1-CG 3.66Å
67	A	97.1	Very high	97.5	Very high	48 Å²	48	46.5 Å²	46.5	40%	0.397	24%	0.242	S	C	.	.	H	α-helix	trans	-61.3	-39.8	-179.9	0	0	0	0	0	112	F65 G71 G113	F65-A67 PolarHBondContact O-N 3.34Å; A67-G71 PolarHBondContact O-N 2.86Å; A67-G113 WeakPolarHBondContact CA-O 3.39Å; A67-G113 WeakPolarHBondContact O-CA 3.18Å
68	I	97.5	Very high	97.6	Very high	51 Å²	51	44.8 Å²	44.8	26%	0.262	24%	0.236	S	C	.	.	H	α-helix	trans	-64	-46.1	177.1	-61.6	166.8	0	0	0	110.4	F65 I66 G71 N72 V175	F65-I68 HydrophobicContact CD1-CD1 3.91Å; F65-I68 HydrophobicContact CE1-CD1 4.26Å; F65-I68 PolarHBondContact O-N 3.45Å; I66-I68 VanDerWaalsContact C-N 3.29Å; I66-I68 PolarHBondContact O-N 2.88Å; I68-G71 PolarHBondContact O-N 2.47Å; I68-N72 WeakPolarHBondContact O-CB 3.1Å; I68-N72 PolarHBondContact O-N 2.97Å; I68-N72 PolarHBondContact O-ND2 3.3Å; I68-V175 HydrophobicContact CD1-CG2 3.78Å; I68-V175 HydrophobicContact CG1-CG2 4.17Å; I68-V175 HydrophobicContact CG2-CG2 3.63Å
69	I	98.3	Very high	97.6	Very high	0 Å²	0	43 Å²	43	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-64.6	-43.3	-179.3	-69.9	159	0	0	0	110.8	F65 I66 N72 T73 Y151 L158 P165 D169	F65-I69 HydrophobicContact CB-CD1 3.99Å; F65-I69 WeakPolarHBondContact O-CB 3.39Å; F65-I69 WeakPolarHBondContact O-CD1 3.44Å; F65-I69 VanDerWaalsContact O-CG1 3.26Å; F65-I69 WeakPolarHBondContact O-CG1 3.36Å; F65-I69 PolarHBondContact O-N 2.91Å; I66-I69 PolarHBondContact O-N 2.82Å; I69-N72 PolarHBondContact O-N 2.83Å; I69-T73 WeakPolarHBondContact O-CB 3.41Å; I69-T73 PolarHBondContact O-N 3.2Å; I69-T73 PolarHBondContact O-OG1 2.81Å; I69-Y151 HydrophobicContact CB-CE1 4.48Å; I69-Y151 HydrophobicContact CG1-CE1 4.19Å; I69-Y151 HydrophobicContact CG2-CD1 3.85Å; I69-Y151 HydrophobicContact CG2-CE1 3.66Å; I69-L158 HydrophobicContact CG2-CD1 4.13Å; I69-L158 HydrophobicContact CG2-CD2 4.29Å; I69-P165 HydrophobicContact CD1-CB 3.77Å; I69-P165 HydrophobicContact CD1-CG 3.71Å; I69-D169 HydrophobicContact CD1-CB 3.75Å
70	Y	98	Very high	97.7	Very high	31 Å²	31	37.8 Å²	37.8	12%	0.122	20%	0.197	C	C	.	.	H	α-helix	trans	-63.7	-45.4	175.5	-70.2	-9.2	0	0	0	111.6	I66 N72 T73 L74 G113 M115 L158	I66-Y70 HydrophobicContact CG2-CD2 3.84Å; I66-Y70 HydrophobicContact CG2-CE1 4.32Å; I66-Y70 HydrophobicContact CG2-CE2 3.46Å; I66-Y70 VanDerWaalsContact CG2-CE2 3.46Å; I66-Y70 HydrophobicContact CG2-CG 4.42Å; I66-Y70 PolarHBondContact O-N 3.05Å; Y70-N72 PolarHBondContact O-N 3.26Å; Y70-T73 PolarHBondContact O-N 2.9Å; Y70-L74 WeakPolarHBondContact O-CB 3.37Å; Y70-L74 PolarHBondContact O-N 2.97Å; Y70-G113 WeakPolarHBondContact CD2-O 3.03Å; Y70-M115 HydrophobicContact CD1-CB 4.02Å; Y70-M115 HydrophobicContact CD1-CE 4.46Å; Y70-M115 HydrophobicContact CD2-CB 3.5Å; Y70-M115 VanDerWaalsContact CD2-CB 3.5Å; Y70-M115 HydrophobicContact CE1-CB 4.17Å; Y70-M115 HydrophobicContact CE2-CB 3.67Å; Y70-M115 HydrophobicContact CG-CB 3.68Å; Y70-M115 HydrophobicContact CG-CE 4.41Å; Y70-L158 HydrophobicContact CE1-CB 4.26Å; Y70-L158 VanDerWaalsContact CE1-O 3.28Å; Y70-L158 WeakPolarHBondContact CE1-O 3.26Å; Y70-L158 PolarHBondContact OH-O 3.03Å
71	G	97	Very high	97.7	Very high	13 Å²	13	30.9 Å²	30.9	13%	0.134	17%	0.165	C	C	.	.	H	α-helix	trans	-58.7	-46.3	173.7	0	0	0	0	0	112.3	A67 I68 T73 L74 Q75	A67-G71 PolarHBondContact O-N 2.86Å; I68-G71 PolarHBondContact O-N 2.47Å; G71-T73 PolarHBondContact O-N 2.99Å; G71-L74 PolarHBondContact O-N 3.18Å; G71-Q75 WeakPolarHBondContact O-CB 3.48Å; G71-Q75 VanDerWaalsContact O-CG 3.26Å; G71-Q75 WeakPolarHBondContact O-CG 3.37Å; G71-Q75 PolarHBondContact O-N 2.81Å
72	N	97.6	Very high	97.8	Very high	22 Å²	22	34.2 Å²	34.2	12%	0.118	18%	0.175	C	C	.	.	H	α-helix	trans	-60.9	-44.7	177.3	-70.6	179.4	0	0	0	112.1	I68 I69 Y70 S76 Y151 R174	I68-N72 WeakPolarHBondContact O-CB 3.1Å; I68-N72 PolarHBondContact O-N 2.97Å; I68-N72 PolarHBondContact O-ND2 3.3Å; I69-N72 PolarHBondContact O-N 2.83Å; Y70-N72 PolarHBondContact O-N 3.26Å; N72-S76 WeakPolarHBondContact O-CB 3.42Å; N72-S76 PolarHBondContact O-N 3.13Å; N72-S76 PolarHBondContact O-OG 2.81Å; N72-Y151 HydrophobicContact CB-CE2 4.32Å; N72-R174 PolarHBondContact ND2-O 3.26Å; N72-R174 PolarHBondContact OD1-N 3.37Å; N72-R174 PolarHBondContact OD1-O 2.81Å
73	T	98.2	Very high	97.8	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-60.6	-49.7	177.4	-53.9	0	0	0	0	111.4	I69 Y70 G71 S76 I77 M115 Y151 L152 L155	I69-T73 WeakPolarHBondContact O-CB 3.41Å; I69-T73 PolarHBondContact O-N 3.2Å; I69-T73 PolarHBondContact O-OG1 2.81Å; Y70-T73 PolarHBondContact O-N 2.9Å; G71-T73 PolarHBondContact O-N 2.99Å; T73-S76 WeakPolarHBondContact O-CB 3.44Å; T73-S76 PolarHBondContact O-N 3.47Å; T73-I77 PolarHBondContact O-N 3.45Å; T73-I77 VanDerWaalsContact O-N 3.13Å; T73-M115 HydrophobicContact CG2-CE 4.47Å; T73-Y151 WeakPolarHBondContact OG1-CB 3.44Å; T73-L152 HydrophobicContact CG2-CD2 3.79Å; T73-L155 HydrophobicContact CG2-CD1 4.15Å
74	L	97.8	Very high	97.8	Very high	21 Å²	21	30 Å²	30	11%	0.11	15%	0.153	C	C	.	.	H	α-helix	trans	-62.5	-47	-180	177.9	59.4	0	0	0	111.4	Y70 G71 S76 I77 L78 L103 A107 M119 I123	Y70-L74 WeakPolarHBondContact O-CB 3.37Å; Y70-L74 PolarHBondContact O-N 2.97Å; G71-L74 PolarHBondContact O-N 3.18Å; L74-S76 VanDerWaalsContact C-N 3.3Å; L74-S76 PolarHBondContact O-N 3.33Å; L74-I77 HydrophobicContact CD1-CG2 4.4Å; L74-I77 WeakPolarHBondContact O-CG2 3.32Å; L74-I77 PolarHBondContact O-N 2.92Å; L74-L78 HydrophobicContact CD1-CD1 3.93Å; L74-L78 HydrophobicContact CD1-CG 4.08Å; L74-L78 HydrophobicContact CG-CD1 3.85Å; L74-L78 HydrophobicContact CG-CG 4.43Å; L74-L78 WeakPolarHBondContact O-CB 3.39Å; L74-L78 VanDerWaalsContact O-CG 3.24Å; L74-L78 WeakPolarHBondContact O-CG 3.36Å; L74-L78 PolarHBondContact O-N 3.19Å; L74-L103 HydrophobicContact CD1-CD1 3.91Å; L74-L103 HydrophobicContact CD1-CG 4.4Å; L74-A107 HydrophobicContact CD1-CB 4.46Å; L74-A107 HydrophobicContact CD2-CB 4.32Å; L74-M119 HydrophobicContact CD1-SD 3.94Å; L74-M119 HydrophobicContact CD2-CE 4.26Å; L74-M119 HydrophobicContact CD2-SD 4.09Å; L74-I123 HydrophobicContact CD1-CD1 4.26Å
75	Q	97	Very high	97.8	Very high	89 Å²	89	29.4 Å²	29.4	42%	0.416	16%	0.158	S	C	.	.	H	α-helix	trans	-63.6	-36.7	178.2	-67.6	-55.6	-33.9	0	0	112.2	G71 L78 A79	G71-Q75 WeakPolarHBondContact O-CB 3.48Å; G71-Q75 VanDerWaalsContact O-CG 3.26Å; G71-Q75 WeakPolarHBondContact O-CG 3.37Å; G71-Q75 PolarHBondContact O-N 2.81Å; Q75-L78 PolarHBondContact O-N 3.02Å; Q75-A79 WeakPolarHBondContact O-CB 3.33Å; Q75-A79 PolarHBondContact O-N 3.45Å
76	S	98.2	Very high	97.7	Very high	2 Å²	2	33.8 Å²	33.8	1%	0.014	19%	0.188	C	C	.	.	H	α-helix	trans	-61.5	-49	175.5	-79.2	0	0	0	0	112.6	N72 T73 L74 A79 I80 L144 A148	N72-S76 WeakPolarHBondContact O-CB 3.42Å; N72-S76 PolarHBondContact O-N 3.13Å; N72-S76 PolarHBondContact O-OG 2.81Å; T73-S76 WeakPolarHBondContact O-CB 3.44Å; T73-S76 PolarHBondContact O-N 3.47Å; L74-S76 VanDerWaalsContact C-N 3.3Å; L74-S76 PolarHBondContact O-N 3.33Å; S76-A79 PolarHBondContact O-N 2.96Å; S76-I80 WeakPolarHBondContact O-CG1 3.23Å; S76-I80 PolarHBondContact O-N 3.11Å; S76-L144 WeakPolarHBondContact O-CD1 3.05Å; S76-A148 WeakPolarHBondContact OG-CB 3.39Å
77	I	98.6	Very high	97.7	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-68.6	-36.5	178.9	-172.2	63.7	0	0	0	112.2	T73 L74 A79 I80 V81 L103 I123 L126 I132 L152	T73-I77 PolarHBondContact O-N 3.45Å; T73-I77 VanDerWaalsContact O-N 3.13Å; L74-I77 HydrophobicContact CD1-CG2 4.4Å; L74-I77 WeakPolarHBondContact O-CG2 3.32Å; L74-I77 PolarHBondContact O-N 2.92Å; I77-A79 VanDerWaalsContact C-N 3.32Å; I77-A79 PolarHBondContact O-N 3.18Å; I77-I80 PolarHBondContact O-N 2.66Å; I77-V81 HydrophobicContact CG1-CG2 4.46Å; I77-V81 WeakPolarHBondContact O-CG2 3.49Å; I77-V81 PolarHBondContact O-N 2.83Å; I77-L103 HydrophobicContact CG1-CD2 4.01Å; I77-L103 HydrophobicContact CG2-CD2 3.79Å; I77-I123 HydrophobicContact CB-CG2 4.26Å; I77-I123 HydrophobicContact CG1-CG2 4.22Å; I77-I123 HydrophobicContact CG2-CD1 4.01Å; I77-I123 HydrophobicContact CG2-CG1 4Å; I77-I123 HydrophobicContact CG2-CG2 4.17Å; I77-L126 HydrophobicContact CD1-CB 4.18Å; I77-L126 HydrophobicContact CG1-CD1 4.45Å; I77-I132 HydrophobicContact CD1-CG2 4.3Å; I77-L152 HydrophobicContact CB-CD2 3.84Å; I77-L152 HydrophobicContact CG2-CD2 4.5Å
78	L	97.9	Very high	97.8	Very high	2 Å²	2	38 Å²	38	1%	0.01	20%	0.204	C	C	.	.	H	α-helix	trans	-63.9	-38.5	175.5	-70.8	171.4	0	0	0	111.8	L74 Q75 V81 R82 L103 M104 A107	L74-L78 HydrophobicContact CD1-CD1 3.93Å; L74-L78 HydrophobicContact CD1-CG 4.08Å; L74-L78 HydrophobicContact CG-CD1 3.85Å; L74-L78 HydrophobicContact CG-CG 4.43Å; L74-L78 WeakPolarHBondContact O-CB 3.39Å; L74-L78 VanDerWaalsContact O-CG 3.24Å; L74-L78 WeakPolarHBondContact O-CG 3.36Å; L74-L78 PolarHBondContact O-N 3.19Å; Q75-L78 PolarHBondContact O-N 3.02Å; L78-V81 PolarHBondContact O-N 3.45Å; L78-R82 VanDerWaalsContact O-CG 3.3Å; L78-R82 WeakPolarHBondContact O-CG 3.06Å; L78-R82 PolarHBondContact O-N 3.14Å; L78-L103 HydrophobicContact CD2-CD2 4.28Å; L78-L103 HydrophobicContact CD2-CG 4.12Å; L78-M104 HydrophobicContact CD2-CG 4.08Å; L78-A107 HydrophobicContact CD1-CB 3.59Å; L78-A107 HydrophobicContact CD2-CB 4.18Å; L78-A107 HydrophobicContact CG-CB 4.49Å
79	A	98.2	Very high	97.8	Very high	21 Å²	21	37 Å²	37	17%	0.174	20%	0.198	C	C	.	.	H	α-helix	trans	-60.6	-45.2	174.1	0	0	0	0	0	111.3	Q75 S76 I77 R82 A83 L144	Q75-A79 WeakPolarHBondContact O-CB 3.33Å; Q75-A79 PolarHBondContact O-N 3.45Å; S76-A79 PolarHBondContact O-N 2.96Å; I77-A79 VanDerWaalsContact C-N 3.32Å; I77-A79 PolarHBondContact O-N 3.18Å; A79-R82 PolarHBondContact O-N 3.04Å; A79-A83 WeakPolarHBondContact O-CB 3.49Å; A79-A83 PolarHBondContact O-N 3.13Å; A79-L144 HydrophobicContact CB-CD1 4.02Å
80	I	98.6	Very high	97.8	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-63.7	-46.2	176.9	-58.1	164.3	0	0	0	110.7	S76 I77 R82 A83 M84 W127 I132 C135 F136 Y142 L144 L152	S76-I80 WeakPolarHBondContact O-CG1 3.23Å; S76-I80 PolarHBondContact O-N 3.11Å; I77-I80 PolarHBondContact O-N 2.66Å; I80-R82 VanDerWaalsContact C-N 3.32Å; I80-R82 PolarHBondContact O-N 2.81Å; I80-A83 CarbonylContact O-C 3.55Å; I80-A83 WeakPolarHBondContact O-CA 3.29Å; I80-A83 WeakPolarHBondContact O-CB 3.46Å; I80-A83 PolarHBondContact O-N 2.81Å; I80-A83 VanDerWaalsContact O-N 3.07Å; I80-M84 WeakPolarHBondContact O-CG 3.47Å; I80-M84 PolarHBondContact O-N 3.1Å; I80-W127 HydrophobicContact CD1-CE3 4.47Å; I80-W127 HydrophobicContact CD1-CZ3 3.9Å; I80-I132 HydrophobicContact CG2-CD1 3.98Å; I80-I132 HydrophobicContact CG2-CG2 4.04Å; I80-C135 HydrophobicContact CG2-CB 4.02Å; I80-F136 HydrophobicContact CD1-CD2 4.03Å; I80-Y142 HydrophobicContact CG1-CE2 4.25Å; I80-L144 HydrophobicContact CD1-CD1 4.33Å; I80-L144 HydrophobicContact CD1-CD2 4.21Å; I80-L144 HydrophobicContact CG1-CD1 3.9Å; I80-L144 HydrophobicContact CG1-CD2 4.01Å; I80-L152 HydrophobicContact CD1-CD1 3.8Å
81	V	98.2	Very high	97.8	Very high	3 Å²	3	45.5 Å²	45.5	2%	0.018	24%	0.238	C	C	.	.	H	α-helix	trans	-58.3	-41.7	178.1	166.2	0	0	0	0	112	I77 L78 M84 A100 M104 L126 I132	I77-V81 HydrophobicContact CG1-CG2 4.46Å; I77-V81 WeakPolarHBondContact O-CG2 3.49Å; I77-V81 PolarHBondContact O-N 2.83Å; L78-V81 PolarHBondContact O-N 3.45Å; V81-M84 WeakPolarHBondContact O-CB 3.27Å; V81-M84 PolarHBondContact O-N 2.98Å; V81-A100 HydrophobicContact CG1-CB 3.9Å; V81-A100 HydrophobicContact CG2-CB 4.33Å; V81-M104 HydrophobicContact CG1-CE 4.38Å; V81-M104 HydrophobicContact CG1-CG 4.49Å; V81-M104 HydrophobicContact CG1-SD 4.23Å; V81-L126 HydrophobicContact CG2-CD1 4.46Å; V81-I132 HydrophobicContact CG2-CD1 4.13Å
82	R	97.9	Very high	97.8	Very high	129 Å²	129	47.2 Å²	47.2	49%	0.487	26%	0.255	S	S	.	.	H	α-helix	trans	-68.2	-37.5	175.2	-68.7	172.9	-171.3	135	-0.4	111.9	L78 A79 I80 M84 T85 T86	L78-R82 VanDerWaalsContact O-CG 3.3Å; L78-R82 WeakPolarHBondContact O-CG 3.06Å; L78-R82 PolarHBondContact O-N 3.14Å; A79-R82 PolarHBondContact O-N 3.04Å; I80-R82 VanDerWaalsContact C-N 3.32Å; I80-R82 PolarHBondContact O-N 2.81Å; R82-M84 VanDerWaalsContact C-N 3.33Å; R82-M84 PolarHBondContact O-N 3.39Å; R82-T85 PolarHBondContact O-N 3.06Å; R82-T86 PolarHBondContact O-N 2.96Å; R82-T86 PolarHBondContact O-OG1 2.61Å; R82-T86 VanDerWaalsContact O-OG1 3.11Å
83	A	98.2	Very high	97.8	Very high	5 Å²	5	49.3 Å²	49.3	4%	0.041	27%	0.267	C	S	.	.	H	α-helix	trans	-66.6	-32.3	176.7	0	0	0	0	0	112.4	A79 I80 T85 T86 L87 Y142	A79-A83 WeakPolarHBondContact O-CB 3.49Å; A79-A83 PolarHBondContact O-N 3.13Å; I80-A83 CarbonylContact O-C 3.55Å; I80-A83 WeakPolarHBondContact O-CA 3.29Å; I80-A83 WeakPolarHBondContact O-CB 3.46Å; I80-A83 PolarHBondContact O-N 2.81Å; I80-A83 VanDerWaalsContact O-N 3.07Å; A83-T85 VanDerWaalsContact C-N 3.28Å; A83-T85 PolarHBondContact O-N 2.92Å; A83-T86 PolarHBondContact O-N 2.89Å; A83-T86 VanDerWaalsContact O-N 3.14Å; A83-L87 WeakPolarHBondContact O-CB 3.43Å; A83-L87 WeakPolarHBondContact O-CG 3.44Å; A83-L87 PolarHBondContact O-N 3.5Å; A83-Y142 HydrophobicContact CB-CD1 3.56Å; A83-Y142 HydrophobicContact CB-CD2 3.63Å; A83-Y142 HydrophobicContact CB-CE1 3.67Å; A83-Y142 HydrophobicContact CB-CE2 3.74Å; A83-Y142 HydrophobicContact CB-CG 3.53Å
84	M	98.1	Very high	97.6	Very high	1 Å²	1	54.1 Å²	54.1	1%	0.005	30%	0.3	C	S	.	.	H	α-helix	trans	-53.1	-46.7	173.5	-67.7	-79.6	-69.7	0	0	111.6	I80 V81 R82 N88 I89 Y91 G131 I132 C135	I80-M84 WeakPolarHBondContact O-CG 3.47Å; I80-M84 PolarHBondContact O-N 3.1Å; V81-M84 WeakPolarHBondContact O-CB 3.27Å; V81-M84 PolarHBondContact O-N 2.98Å; R82-M84 VanDerWaalsContact C-N 3.33Å; R82-M84 PolarHBondContact O-N 3.39Å; M84-N88 PolarHBondContact O-N 3.05Å; M84-N88 VanDerWaalsContact O-N 3.12Å; M84-I89 HydrophobicContact CE-CB 4.22Å; M84-I89 HydrophobicContact CE-CG2 3.82Å; M84-I89 WeakPolarHBondContact CE-O 3.49Å; M84-I89 PolarHBondContact O-N 3.34Å; M84-I89 HydrophobicContact SD-CB 3.9Å; M84-I89 HydrophobicContact SD-CG2 3.7Å; M84-Y91 HydrophobicContact CE-CD1 3.89Å; M84-Y91 HydrophobicContact CE-CD2 4.41Å; M84-Y91 HydrophobicContact CE-CE1 4.03Å; M84-Y91 HydrophobicContact CE-CG 4.09Å; M84-G131 VanDerWaalsContact SD-C 3.53Å; M84-I132 HydrophobicContact CE-CD1 4.46Å; M84-I132 HydrophobicContact CG-CD1 3.82Å; M84-I132 HydrophobicContact SD-CD1 4.05Å; M84-C135 HydrophobicContact CG-CB 4.13Å; M84-C135 HydrophobicContact SD-CB 3.36Å; M84-C135 WeakPolarHBondContact SD-CB 3.26Å
85	T	95.9	Very high	97.6	Very high	117 Å²	117	55.3 Å²	55.3	72%	0.718	31%	0.313	S	S	*	.	H	α-helix	trans	-67	-45.1	177.4	-55.8	0	0	0	0	111.7	R82 A83 L87 N88	R82-T85 PolarHBondContact O-N 3.06Å; A83-T85 VanDerWaalsContact C-N 3.28Å; A83-T85 PolarHBondContact O-N 2.92Å; T85-L87 VanDerWaalsContact C-N 3.35Å; T85-L87 PolarHBondContact O-N 2.66Å; T85-N88 PolarHBondContact O-N 2.57Å
86	T	96.6	Very high	97.6	Very high	119 Å²	119	53.1 Å²	53.1	73%	0.73	30%	0.301	S	S	*	.	H	α-helix	trans	-64.2	-39.5	-177.6	-54	0	0	0	0	112.1	R82 A83 N88	R82-T86 PolarHBondContact O-N 2.96Å; R82-T86 PolarHBondContact O-OG1 2.61Å; R82-T86 VanDerWaalsContact O-OG1 3.11Å; A83-T86 PolarHBondContact O-N 2.89Å; A83-T86 VanDerWaalsContact O-N 3.14Å; T86-N88 VanDerWaalsContact C-N 3.33Å
87	L	97.7	Very high	97.5	Very high	32 Å²	32	58.5 Å²	58.5	17%	0.168	33%	0.326	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.3	3.2	-179.2	-58.9	-178.3	0	0	0	113.3	A83 T85 I89 R138 E141 Y142	A83-L87 WeakPolarHBondContact O-CB 3.43Å; A83-L87 WeakPolarHBondContact O-CG 3.44Å; A83-L87 PolarHBondContact O-N 3.5Å; T85-L87 VanDerWaalsContact C-N 3.35Å; T85-L87 PolarHBondContact O-N 2.66Å; L87-I89 VanDerWaalsContact C-N 3.31Å; L87-I89 HydrophobicContact CB-CD1 3.84Å; L87-I89 HydrophobicContact CB-CG1 3.93Å; L87-I89 HydrophobicContact CD1-CD1 4.16Å; L87-I89 PolarHBondContact O-N 3.28Å; L87-R138 HydrophobicContact CD1-CB 4.11Å; L87-E141 HydrophobicContact CD1-CB 4.47Å; L87-E141 HydrophobicContact CD2-CB 4.25Å; L87-E141 WeakPolarHBondContact CD2-OE2 3.46Å; L87-Y142 HydrophobicContact CD1-CD1 4.02Å; L87-Y142 HydrophobicContact CD1-CE1 4.11Å
88	N	97.6	Very high	97.5	Very high	140 Å²	140	61 Å²	61	75%	0.749	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.3	44.8	-177.7	-167.8	36.6	0	0	0	113.5	M84 T85 T86	M84-N88 PolarHBondContact O-N 3.05Å; M84-N88 VanDerWaalsContact O-N 3.12Å; T85-N88 PolarHBondContact O-N 2.57Å; T86-N88 VanDerWaalsContact C-N 3.33Å
89	I	98	Very high	97.5	Very high	30 Å²	30	61.3 Å²	61.3	15%	0.154	34%	0.341	C	S	.	.	P	Polyproline II helix	trans	-95.7	131.5	177.2	-58	173	0	0	0	108.4	M84 L87 C135	M84-I89 HydrophobicContact CE-CB 4.22Å; M84-I89 HydrophobicContact CE-CG2 3.82Å; M84-I89 WeakPolarHBondContact CE-O 3.49Å; M84-I89 PolarHBondContact O-N 3.34Å; M84-I89 HydrophobicContact SD-CB 3.9Å; M84-I89 HydrophobicContact SD-CG2 3.7Å; L87-I89 VanDerWaalsContact C-N 3.31Å; L87-I89 HydrophobicContact CB-CD1 3.84Å; L87-I89 HydrophobicContact CB-CG1 3.93Å; L87-I89 HydrophobicContact CD1-CD1 4.16Å; L87-I89 PolarHBondContact O-N 3.28Å; I89-C135 HydrophobicContact CD1-CB 3.64Å
90	Q	97.9	Very high	97.5	Very high	165 Å²	165	60.4 Å²	60.4	77%	0.771	33%	0.333	S	S	*	.	P	Polyproline II helix	trans	-87	149.1	175.6	-62.2	-177.3	21.3	0	0	110.5	G131	Q90-G131 VanDerWaalsContact O-CA 3.32Å; Q90-G131 WeakPolarHBondContact O-CA 3.32Å
91	Y	98.3	Very high	97.4	Very high	44 Å²	44	67.2 Å²	67.2	17%	0.173	36%	0.359	C	S	.	.	P	Polyproline II helix	trans	-63.9	144.8	168.5	-64.6	-84	0	0	0	110.3	M84 D93 R96 Q97 A100 L126 D129 I132	M84-Y91 HydrophobicContact CE-CD1 3.89Å; M84-Y91 HydrophobicContact CE-CD2 4.41Å; M84-Y91 HydrophobicContact CE-CE1 4.03Å; M84-Y91 HydrophobicContact CE-CG 4.09Å; Y91-D93 WeakPolarHBondContact CB-O 3.29Å; Y91-R96 HydrophobicContact CD1-CB 3.57Å; Y91-R96 HydrophobicContact CE1-CB 4.28Å; Y91-R96 HydrophobicContact CG-CB 3.98Å; Y91-Q97 HydrophobicContact CD2-CB 3.97Å; Y91-Q97 HydrophobicContact CD2-CG 4.4Å; Y91-Q97 HydrophobicContact CE2-CB 4.12Å; Y91-Q97 HydrophobicContact CE2-CG 4.22Å; Y91-A100 HydrophobicContact CE1-CB 4.17Å; Y91-A100 WeakPolarHBondContact OH-CB 3.31Å; Y91-L126 HydrophobicContact CE1-CD2 4.07Å; Y91-D129 WeakPolarHBondContact CA-OD2 3.15Å; Y91-I132 HydrophobicContact CD1-CG1 4.3Å; Y91-I132 HydrophobicContact CE1-CD1 4Å; Y91-I132 HydrophobicContact CE1-CG1 4.16Å
92	G	97.6	Very high	97.4	Very high	49 Å²	49	71.5 Å²	71.5	51%	0.505	38%	0.377	S	S	.	.	S	Bend	trans	-65.4	-41.4	173.9	0	0	0	0	0	112.3	D129 S130	G92-D129 VanDerWaalsContact CA-OD1 3.32Å; G92-D129 WeakPolarHBondContact CA-OD1 3.15Å; G92-D129 VanDerWaalsContact N-CG 3.33Å; G92-D129 PolarHBondContact N-OD1 3.28Å; G92-D129 PolarHBondContact N-OD2 3.02Å; G92-S130 VanDerWaalsContact CA-OG 3.29Å; G92-S130 WeakPolarHBondContact CA-OG 3.46Å
93	D	97.3	Very high	97.4	Very high	67 Å²	67	65.4 Å²	65.4	36%	0.358	35%	0.354	S	S	.	.	S	Bend	trans	-111	121.3	170.3	172.4	9.8	0	0	0	110.2	Y91 A95 R96 D129	Y91-D93 WeakPolarHBondContact CB-O 3.29Å; D93-A95 PolarHBondContact O-N 3.01Å; D93-A95 WeakPolarHBondContact OD1-CB 3.38Å; D93-A95 PolarHBondContact OD1-N 3.44Å; D93-R96 HydrophobicContact CB-CG 4.01Å; D93-R96 WeakPolarHBondContact O-CB 3.47Å; D93-R96 WeakPolarHBondContact O-CG 3.5Å; D93-R96 PolarHBondContact O-N 3Å; D93-R96 IonicContact OD2-CZ 2.77Å; D93-R96 IonicContact OD2-NH1 3.28Å; D93-R96 PolarHBondContact OD2-NH1 3.25Å; D93-R96 IonicContact OD2-NH2 2.57Å; D93-D129 PolarHBondContact N-OD1 2.94Å
94	S	95.2	Very high	97.3	Very high	101 Å²	101	68.5 Å²	68.5	71%	0.706	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.8	-28.2	177.7	63.7	0	0	0	0	114	R96 Q97	S94-R96 PolarHBondContact O-N 3.39Å; S94-Q97 WeakPolarHBondContact O-CB 3.38Å; S94-Q97 PolarHBondContact O-N 3.44Å
95	A	95.9	Very high	97.2	Very high	45 Å²	45	74.4 Å²	74.4	37%	0.372	40%	0.396	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-24.5	175.7	0	0	0	0	0	112.7	D93 Q97 D98 D99	D93-A95 PolarHBondContact O-N 3.01Å; D93-A95 WeakPolarHBondContact OD1-CB 3.38Å; D93-A95 PolarHBondContact OD1-N 3.44Å; A95-Q97 PolarHBondContact O-N 3.24Å; A95-D98 PolarHBondContact O-N 2.86Å; A95-D98 VanDerWaalsContact O-N 3.16Å; A95-D99 PolarHBondContact O-N 3.38Å
96	R	97.9	Very high	97.2	Very high	43 Å²	43	69.8 Å²	69.8	16%	0.162	37%	0.366	C	S	.	.	H	α-helix	trans	-67.9	-21.2	177.3	-60.7	-68.9	88	75.6	7.8	112.9	Y91 D93 S94 D98 D99 A100 R125 L126 D129	Y91-R96 HydrophobicContact CD1-CB 3.57Å; Y91-R96 HydrophobicContact CE1-CB 4.28Å; Y91-R96 HydrophobicContact CG-CB 3.98Å; D93-R96 HydrophobicContact CB-CG 4.01Å; D93-R96 WeakPolarHBondContact O-CB 3.47Å; D93-R96 WeakPolarHBondContact O-CG 3.5Å; D93-R96 PolarHBondContact O-N 3Å; D93-R96 IonicContact OD2-CZ 2.77Å; D93-R96 IonicContact OD2-NH1 3.28Å; D93-R96 PolarHBondContact OD2-NH1 3.25Å; D93-R96 IonicContact OD2-NH2 2.57Å; S94-R96 PolarHBondContact O-N 3.39Å; R96-D98 VanDerWaalsContact C-N 3.26Å; R96-D98 PolarHBondContact O-N 3.48Å; R96-D99 IonicContact CZ-OD2 2.82Å; R96-D99 VanDerWaalsContact CZ-OD2 3.27Å; R96-D99 IonicContact NE-OD2 3.83Å; R96-D99 PolarHBondContact NE-OD2 3.2Å; R96-D99 IonicContact NH2-OD2 3.49Å; R96-D99 PolarHBondContact NH2-OD2 3.27Å; R96-D99 PolarHBondContact O-N 2.96Å; R96-A100 WeakPolarHBondContact O-CB 3.38Å; R96-A100 PolarHBondContact O-N 3.16Å; R96-R125 WeakPolarHBondContact CD-O 3.43Å; R96-L126 HydrophobicContact CB-CD2 4.05Å; R96-D129 HydrophobicContact CG-CB 3.99Å; R96-D129 WeakPolarHBondContact CG-OD1 3.25Å
97	Q	97	Very high	97.1	Very high	116 Å²	116	65.4 Å²	65.4	54%	0.542	34%	0.343	S	S	.	.	H	α-helix	trans	-64	-33.6	172.4	-168.3	-179.5	23.2	0	0	112.1	Y91 S94 A95 R101	Y91-Q97 HydrophobicContact CD2-CB 3.97Å; Y91-Q97 HydrophobicContact CD2-CG 4.4Å; Y91-Q97 HydrophobicContact CE2-CB 4.12Å; Y91-Q97 HydrophobicContact CE2-CG 4.22Å; S94-Q97 WeakPolarHBondContact O-CB 3.38Å; S94-Q97 PolarHBondContact O-N 3.44Å; A95-Q97 PolarHBondContact O-N 3.24Å; Q97-R101 WeakPolarHBondContact O-CG 3.43Å; Q97-R101 PolarHBondContact O-N 2.82Å; Q97-R101 PolarHBondContact O-NE 3.07Å
98	D	97.3	Very high	96.9	Very high	53 Å²	53	70.5 Å²	70.5	28%	0.283	37%	0.37	S	S	.	.	H	α-helix	trans	-73.6	-42.5	173.9	-169.1	69	0	0	0	111.6	A95 R96 A100 R101 K102	A95-D98 PolarHBondContact O-N 2.86Å; A95-D98 VanDerWaalsContact O-N 3.16Å; R96-D98 VanDerWaalsContact C-N 3.26Å; R96-D98 PolarHBondContact O-N 3.48Å; D98-A100 VanDerWaalsContact C-N 3.31Å; D98-A100 PolarHBondContact O-N 3.15Å; D98-R101 PolarHBondContact O-N 2.92Å; D98-R101 IonicContact OD1-CZ 3.27Å; D98-R101 IonicContact OD1-NH1 2.7Å; D98-R101 IonicContact OD1-NH2 3.03Å; D98-R101 PolarHBondContact OD1-NH2 3.1Å; D98-K102 WeakPolarHBondContact O-CG 3.43Å; D98-K102 PolarHBondContact O-N 2.57Å; D98-K102 WeakPolarHBondContact OD2-CE 3.43Å; D98-K102 IonicContact OD2-NZ 3.52Å; D98-K102 PolarHBondContact OD2-NZ 3.42Å
99	D	98.2	Very high	96.6	Very high	8 Å²	8	68 Å²	68	4%	0.043	36%	0.36	C	S	.	.	H	α-helix	trans	-56.8	-43.8	173.5	-81.2	-28.3	0	0	0	111.6	A95 R96 K102 L103 I122 R125 L126	A95-D99 PolarHBondContact O-N 3.38Å; R96-D99 IonicContact CZ-OD2 2.82Å; R96-D99 VanDerWaalsContact CZ-OD2 3.27Å; R96-D99 IonicContact NE-OD2 3.83Å; R96-D99 PolarHBondContact NE-OD2 3.2Å; R96-D99 IonicContact NH2-OD2 3.49Å; R96-D99 PolarHBondContact NH2-OD2 3.27Å; R96-D99 PolarHBondContact O-N 2.96Å; D99-K102 PolarHBondContact O-N 2.98Å; D99-L103 WeakPolarHBondContact O-CB 3.39Å; D99-L103 PolarHBondContact O-N 2.77Å; D99-I122 HydrophobicContact CB-CG2 4.01Å; D99-I122 WeakPolarHBondContact O-CG2 3.47Å; D99-R125 IonicContact OD1-CZ 2.78Å; D99-R125 IonicContact OD1-NE 3.66Å; D99-R125 IonicContact OD1-NH2 2.76Å; D99-R125 PolarHBondContact OD1-NH2 2.8Å; D99-R125 IonicContact OD2-CZ 2.61Å; D99-R125 IonicContact OD2-NE 3.38Å; D99-R125 PolarHBondContact OD2-NE 3.27Å; D99-R125 IonicContact OD2-NH2 3.65Å; D99-L126 HydrophobicContact CB-CD2 4.05Å; D99-L126 HydrophobicContact CB-CG 4.15Å
100	A	98	Very high	96.3	Very high	1 Å²	1	68.9 Å²	68.9	1%	0.008	36%	0.364	C	S	.	.	H	α-helix	trans	-63.6	-42.5	176.6	0	0	0	0	0	112.8	V81 Y91 R96 D98 L103 M104 L126	V81-A100 HydrophobicContact CG1-CB 3.9Å; V81-A100 HydrophobicContact CG2-CB 4.33Å; Y91-A100 HydrophobicContact CE1-CB 4.17Å; Y91-A100 WeakPolarHBondContact OH-CB 3.31Å; R96-A100 WeakPolarHBondContact O-CB 3.38Å; R96-A100 PolarHBondContact O-N 3.16Å; D98-A100 VanDerWaalsContact C-N 3.31Å; D98-A100 PolarHBondContact O-N 3.15Å; A100-L103 PolarHBondContact O-N 2.85Å; A100-M104 WeakPolarHBondContact O-CG 3.18Å; A100-M104 PolarHBondContact O-N 2.85Å; A100-L126 HydrophobicContact CB-CD2 4.17Å
101	R	97.1	Very high	96	Very high	143 Å²	143	68.3 Å²	68.3	54%	0.54	36%	0.362	S	S	.	.	H	α-helix	trans	-62.7	-44.4	175.4	-76.8	-175.4	-68	130.3	4.8	111.7	Q97 D98 M104 H105	Q97-R101 WeakPolarHBondContact O-CG 3.43Å; Q97-R101 PolarHBondContact O-N 2.82Å; Q97-R101 PolarHBondContact O-NE 3.07Å; D98-R101 PolarHBondContact O-N 2.92Å; D98-R101 IonicContact OD1-CZ 3.27Å; D98-R101 IonicContact OD1-NH1 2.7Å; D98-R101 IonicContact OD1-NH2 3.03Å; D98-R101 PolarHBondContact OD1-NH2 3.1Å; R101-M104 HydrophobicContact CG-CE 4.39Å; R101-M104 PolarHBondContact O-N 2.81Å; R101-H105 PolarHBondContact O-N 2.79Å
102	K	97.4	Very high	95.5	Very high	93 Å²	93	74.7 Å²	74.7	40%	0.404	39%	0.393	S	S	.	.	H	α-helix	trans	-60.9	-46.4	175.4	-75.9	170.8	172.2	160	0	111.6	D98 D99 M104 H105 M106 I122	D98-K102 WeakPolarHBondContact O-CG 3.43Å; D98-K102 PolarHBondContact O-N 2.57Å; D98-K102 WeakPolarHBondContact OD2-CE 3.43Å; D98-K102 IonicContact OD2-NZ 3.52Å; D98-K102 PolarHBondContact OD2-NZ 3.42Å; D99-K102 PolarHBondContact O-N 2.98Å; K102-M104 VanDerWaalsContact C-N 3.34Å; K102-M104 PolarHBondContact O-N 2.82Å; K102-H105 PolarHBondContact O-N 2.84Å; K102-M106 WeakPolarHBondContact O-CB 3.38Å; K102-M106 VanDerWaalsContact O-CG 3.29Å; K102-M106 WeakPolarHBondContact O-CG 3.42Å; K102-M106 PolarHBondContact O-N 3.09Å; K102-I122 HydrophobicContact CB-CD1 4.08Å
103	L	97.7	Very high	95.2	Very high	1 Å²	1	73.1 Å²	73.1	1%	0.005	38%	0.377	C	S	.	.	H	α-helix	trans	-59.8	-43.3	179.3	-173.8	64.1	0	0	0	112.3	L74 I77 L78 D99 A100 H105 M106 A107 M119 I122 I123 L126	L74-L103 HydrophobicContact CD1-CD1 3.91Å; L74-L103 HydrophobicContact CD1-CG 4.4Å; I77-L103 HydrophobicContact CG1-CD2 4.01Å; I77-L103 HydrophobicContact CG2-CD2 3.79Å; L78-L103 HydrophobicContact CD2-CD2 4.28Å; L78-L103 HydrophobicContact CD2-CG 4.12Å; D99-L103 WeakPolarHBondContact O-CB 3.39Å; D99-L103 PolarHBondContact O-N 2.77Å; A100-L103 PolarHBondContact O-N 2.85Å; L103-H105 VanDerWaalsContact C-N 3.35Å; L103-H105 PolarHBondContact O-N 3.23Å; L103-M106 PolarHBondContact O-N 2.87Å; L103-A107 WeakPolarHBondContact O-CB 3.4Å; L103-A107 PolarHBondContact O-N 3.47Å; L103-M119 HydrophobicContact CD1-CG 3.75Å; L103-I122 HydrophobicContact CB-CG2 3.87Å; L103-I122 HydrophobicContact CD1-CG2 4.26Å; L103-I122 HydrophobicContact CG-CG2 4.45Å; L103-I123 HydrophobicContact CD1-CD1 4.14Å; L103-I123 HydrophobicContact CD1-CG1 3.76Å; L103-I123 HydrophobicContact CD2-CG1 4.03Å; L103-L126 HydrophobicContact CB-CD1 4.35Å; L103-L126 HydrophobicContact CD2-CD1 3.63Å
104	M	96.2	Very high	95.1	Very high	71 Å²	71	72.1 Å²	72.1	35%	0.35	37%	0.373	S	S	.	.	H	α-helix	trans	-61.1	-43.7	176.6	-72.8	-174.6	-73.1	0	0	111.6	L78 V81 A100 R101 K102 A107 D108	L78-M104 HydrophobicContact CD2-CG 4.08Å; V81-M104 HydrophobicContact CG1-CE 4.38Å; V81-M104 HydrophobicContact CG1-CG 4.49Å; V81-M104 HydrophobicContact CG1-SD 4.23Å; A100-M104 WeakPolarHBondContact O-CG 3.18Å; A100-M104 PolarHBondContact O-N 2.85Å; R101-M104 HydrophobicContact CG-CE 4.39Å; R101-M104 PolarHBondContact O-N 2.81Å; K102-M104 VanDerWaalsContact C-N 3.34Å; K102-M104 PolarHBondContact O-N 2.82Å; M104-A107 PolarHBondContact O-N 2.88Å; M104-D108 PolarHBondContact O-N 3.47Å
105	H	96.1	Very high	95.2	Very high	125 Å²	125	68.2 Å²	68.2	58%	0.579	34%	0.344	S	S	*	.	H	α-helix	trans	-64.9	-40.8	176.1	-177.3	58.1	0	0	0	112.9	R101 K102 L103 A107 D108 T109	R101-H105 PolarHBondContact O-N 2.79Å; K102-H105 PolarHBondContact O-N 2.84Å; L103-H105 VanDerWaalsContact C-N 3.35Å; L103-H105 PolarHBondContact O-N 3.23Å; H105-A107 VanDerWaalsContact C-N 3.32Å; H105-A107 PolarHBondContact O-N 2.72Å; H105-D108 PolarHBondContact O-N 3.27Å; H105-T109 WeakPolarHBondContact O-CG2 3.31Å; H105-T109 PolarHBondContact O-N 3.27Å; H105-T109 PolarHBondContact O-OG1 3.29Å
106	M	96.4	Very high	95.2	Very high	19 Å²	19	68.5 Å²	68.5	9%	0.094	34%	0.342	C	S	.	.	H	α-helix	trans	-61.8	-39.9	175.5	-76.3	-179.9	87.3	0	0	111.9	K102 L103 D108 T109 I110 E118 M119 I122	K102-M106 WeakPolarHBondContact O-CB 3.38Å; K102-M106 VanDerWaalsContact O-CG 3.29Å; K102-M106 WeakPolarHBondContact O-CG 3.42Å; K102-M106 PolarHBondContact O-N 3.09Å; L103-M106 PolarHBondContact O-N 2.87Å; M106-D108 PolarHBondContact O-N 3.21Å; M106-T109 WeakPolarHBondContact CA-OG1 3.34Å; M106-T109 PolarHBondContact O-N 3.2Å; M106-T109 PolarHBondContact O-OG1 3.34Å; M106-I110 HydrophobicContact CB-CD1 3.86Å; M106-I110 HydrophobicContact CE-CD1 3.47Å; M106-I110 VanDerWaalsContact CE-CD1 3.47Å; M106-I110 HydrophobicContact CG-CD1 4.1Å; M106-I110 VanDerWaalsContact O-CB 3.3Å; M106-I110 WeakPolarHBondContact O-CB 3.22Å; M106-I110 PolarHBondContact O-N 3.29Å; M106-E118 HydrophobicContact CE-CB 4.14Å; M106-E118 HydrophobicContact CE-CG 4.07Å; M106-E118 HydrophobicContact SD-CG 4.41Å; M106-M119 HydrophobicContact CB-CE 4.19Å; M106-M119 HydrophobicContact CE-CB 3.66Å; M106-M119 HydrophobicContact CE-CG 4.44Å; M106-M119 HydrophobicContact SD-CB 4.49Å; M106-I122 HydrophobicContact SD-CD1 3.68Å
107	A	94.7	Very high	95.1	Very high	28 Å²	28	72.5 Å²	72.5	23%	0.231	36%	0.361	C	S	.	.	H	α-helix	trans	-63.5	-28.8	178.7	0	0	0	0	0	113.5	L74 L78 L103 M104 H105	L74-A107 HydrophobicContact CD1-CB 4.46Å; L74-A107 HydrophobicContact CD2-CB 4.32Å; L78-A107 HydrophobicContact CD1-CB 3.59Å; L78-A107 HydrophobicContact CD2-CB 4.18Å; L78-A107 HydrophobicContact CG-CB 4.49Å; L103-A107 WeakPolarHBondContact O-CB 3.4Å; L103-A107 PolarHBondContact O-N 3.47Å; M104-A107 PolarHBondContact O-N 2.88Å; H105-A107 VanDerWaalsContact C-N 3.32Å; H105-A107 PolarHBondContact O-N 2.72Å
108	D	92.4	Very high	95.1	Very high	139 Å²	139	73 Å²	73	74%	0.743	36%	0.363	S	S	*	.	H	α-helix	trans	-85.7	-14.2	178.1	-65.3	-27.7	0	0	0	113.2	M104 H105 M106	M104-D108 PolarHBondContact O-N 3.47Å; H105-D108 PolarHBondContact O-N 3.27Å; M106-D108 PolarHBondContact O-N 3.21Å
109	T	92.5	Very high	95.1	Very high	88 Å²	88	70.5 Å²	70.5	54%	0.54	35%	0.35	S	S	.	.	H	α-helix	trans	-117	-26.8	-169.9	50.7	0	0	0	0	114.3	H105 M106	H105-T109 WeakPolarHBondContact O-CG2 3.31Å; H105-T109 PolarHBondContact O-N 3.27Å; H105-T109 PolarHBondContact O-OG1 3.29Å; M106-T109 WeakPolarHBondContact CA-OG1 3.34Å; M106-T109 PolarHBondContact O-N 3.2Å; M106-T109 PolarHBondContact O-OG1 3.34Å
110	I	90.9	Very high	95.1	Very high	47 Å²	47	70.1 Å²	70.1	24%	0.241	35%	0.348	C	S	.	.	S	Bend	trans	-87	146.7	-178.5	-71.5	169.1	0	0	0	110.2	M106 E112 T114 P116 M119	M106-I110 HydrophobicContact CB-CD1 3.86Å; M106-I110 HydrophobicContact CE-CD1 3.47Å; M106-I110 VanDerWaalsContact CE-CD1 3.47Å; M106-I110 HydrophobicContact CG-CD1 4.1Å; M106-I110 VanDerWaalsContact O-CB 3.3Å; M106-I110 WeakPolarHBondContact O-CB 3.22Å; M106-I110 PolarHBondContact O-N 3.29Å; I110-E112 PolarHBondContact O-N 2.66Å; I110-T114 WeakPolarHBondContact CG2-OG1 3.34Å; I110-P116 HydrophobicContact CD1-CG 4.09Å; I110-P116 HydrophobicContact CG2-CG 4.02Å; I110-M119 HydrophobicContact CB-CE 3.98Å; I110-M119 HydrophobicContact CD1-CE 3.47Å; I110-M119 VanDerWaalsContact CD1-CE 3.47Å; I110-M119 HydrophobicContact CG1-CE 4.3Å; I110-M119 HydrophobicContact CG2-CE 3.89Å
111	E	91.3	Very high	95.1	Very high	154 Å²	154	72.4 Å²	72.4	72%	0.72	36%	0.359	S	S	*	.	P	Polyproline II helix	trans	-57.2	130.2	176.4	-175.9	176.2	-170.1	0	0	111.4	G113 T114	E111-G113 PolarHBondContact O-N 2.91Å; E111-T114 HydrophobicContact CB-CG2 3.96Å; E111-T114 HydrophobicContact CG-CG2 4.14Å; E111-T114 PolarHBondContact O-N 2.8Å; E111-T114 PolarHBondContact O-OG1 3.39Å
112	E	89.2	Confident	95.2	Very high	178 Å²	178	65.7 Å²	65.7	83%	0.832	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59	136.5	179.9	-171.6	174.1	-171.4	0	0	111	I110 T114	I110-E112 PolarHBondContact O-N 2.66Å; E112-T114 VanDerWaalsContact C-N 3.32Å
113	G	90.9	Very high	95.2	Very high	16 Å²	16	61.2 Å²	61.2	17%	0.165	32%	0.315	C	S	.	.	T	Hydrogen-bonded Turn	trans	80.6	9.4	-178.9	0	0	0	0	0	114.8	A67 Y70 E111	A67-G113 WeakPolarHBondContact CA-O 3.39Å; A67-G113 WeakPolarHBondContact O-CA 3.18Å; Y70-G113 WeakPolarHBondContact CD2-O 3.03Å; E111-G113 PolarHBondContact O-N 2.91Å
114	T	95.3	Very high	95.3	Very high	45 Å²	45	62.9 Å²	62.9	28%	0.276	32%	0.323	S	S	.	.			trans	-104	158	169.8	70.9	0	0	0	0	111.6	I110 E111 E112	I110-T114 WeakPolarHBondContact CG2-OG1 3.34Å; E111-T114 HydrophobicContact CB-CG2 3.96Å; E111-T114 HydrophobicContact CG-CG2 4.14Å; E111-T114 PolarHBondContact O-N 2.8Å; E111-T114 PolarHBondContact O-OG1 3.39Å; E112-T114 VanDerWaalsContact C-N 3.32Å
115	M	96.9	Very high	95.4	Very high	20 Å²	20	64.1 Å²	64.1	10%	0.099	32%	0.324	C	S	.	.			trans	-137.7	76.5	178.3	-172.2	64.7	64.8	0	0	110.8	Y70 T73 M119 I123 V159	Y70-M115 HydrophobicContact CD1-CB 4.02Å; Y70-M115 HydrophobicContact CD1-CE 4.46Å; Y70-M115 HydrophobicContact CD2-CB 3.5Å; Y70-M115 VanDerWaalsContact CD2-CB 3.5Å; Y70-M115 HydrophobicContact CE1-CB 4.17Å; Y70-M115 HydrophobicContact CE2-CB 3.67Å; Y70-M115 HydrophobicContact CG-CB 3.68Å; Y70-M115 HydrophobicContact CG-CE 4.41Å; T73-M115 HydrophobicContact CG2-CE 4.47Å; M115-M119 HydrophobicContact CE-SD 4.36Å; M115-M119 HydrophobicContact SD-CB 4.34Å; M115-M119 HydrophobicContact SD-CG 4.01Å; M115-M119 HydrophobicContact SD-SD 3.73Å; M115-I123 HydrophobicContact CE-CD1 4.12Å; M115-I123 HydrophobicContact SD-CD1 3.85Å; M115-V159 HydrophobicContact CB-CG1 4.35Å; M115-V159 HydrophobicContact CG-CG1 3.5Å
116	P	96.1	Very high	95.5	Very high	50 Å²	50	58.2 Å²	58.2	33%	0.325	30%	0.296	S	S	.	.			trans	-60	151.8	177.8	-26.5	38.5	0	0	0	112.4	I110 E118 M119 S120	I110-P116 HydrophobicContact CD1-CG 4.09Å; I110-P116 HydrophobicContact CG2-CG 4.02Å; P116-E118 VanDerWaalsContact C-N 3.32Å; P116-E118 PolarHBondContact O-N 3.18Å; P116-M119 WeakPolarHBondContact O-CA 3.35Å; P116-M119 WeakPolarHBondContact O-CB 3.28Å; P116-M119 PolarHBondContact O-N 3.13Å; P116-S120 PolarHBondContact O-N 3.42Å
117	K	96.2	Very high	95.6	Very high	128 Å²	128	58.4 Å²	58.4	56%	0.557	30%	0.296	S	S	*	.	H	α-helix	trans	-53.9	-46.8	-174.5	-177.4	55.3	177.3	155	0	112.7	M119 S120 D121	K117-M119 VanDerWaalsContact C-N 3.31Å; K117-M119 PolarHBondContact O-N 2.89Å; K117-S120 PolarHBondContact O-N 3.19Å; K117-S120 PolarHBondContact O-OG 3.48Å; K117-D121 VanDerWaalsContact CE-OD1 3.25Å; K117-D121 WeakPolarHBondContact CE-OD1 3.48Å; K117-D121 WeakPolarHBondContact CE-OD2 3.08Å; K117-D121 IonicContact NZ-OD1 3.27Å; K117-D121 PolarHBondContact NZ-OD1 2.9Å; K117-D121 IonicContact NZ-OD2 3.52Å; K117-D121 VanDerWaalsContact O-CG 3.25Å; K117-D121 PolarHBondContact O-N 2.99Å
118	E	96.8	Very high	95.8	Very high	126 Å²	126	64.8 Å²	64.8	59%	0.589	32%	0.318	S	S	*	.	H	α-helix	trans	-56.7	-42.7	176.7	-178	176.1	-165.7	0	0	112.5	M106 P116 D121 I122	M106-E118 HydrophobicContact CE-CB 4.14Å; M106-E118 HydrophobicContact CE-CG 4.07Å; M106-E118 HydrophobicContact SD-CG 4.41Å; P116-E118 VanDerWaalsContact C-N 3.32Å; P116-E118 PolarHBondContact O-N 3.18Å; E118-D121 PolarHBondContact O-N 3.43Å; E118-I122 HydrophobicContact CG-CD1 4.1Å; E118-I122 WeakPolarHBondContact O-CG1 3.42Å; E118-I122 PolarHBondContact O-N 2.75Å
119	M	97.5	Very high	96.1	Very high	1 Å²	1	58.6 Å²	58.6	1%	0.005	29%	0.285	C	S	.	.	H	α-helix	trans	-63.3	-49.9	177.5	-172.2	-172.6	-73.7	0	0	110.1	L74 L103 M106 I110 M115 P116 K117 D121 I122 I123	L74-M119 HydrophobicContact CD1-SD 3.94Å; L74-M119 HydrophobicContact CD2-CE 4.26Å; L74-M119 HydrophobicContact CD2-SD 4.09Å; L103-M119 HydrophobicContact CD1-CG 3.75Å; M106-M119 HydrophobicContact CB-CE 4.19Å; M106-M119 HydrophobicContact CE-CB 3.66Å; M106-M119 HydrophobicContact CE-CG 4.44Å; M106-M119 HydrophobicContact SD-CB 4.49Å; I110-M119 HydrophobicContact CB-CE 3.98Å; I110-M119 HydrophobicContact CD1-CE 3.47Å; I110-M119 VanDerWaalsContact CD1-CE 3.47Å; I110-M119 HydrophobicContact CG1-CE 4.3Å; I110-M119 HydrophobicContact CG2-CE 3.89Å; M115-M119 HydrophobicContact CE-SD 4.36Å; M115-M119 HydrophobicContact SD-CB 4.34Å; M115-M119 HydrophobicContact SD-CG 4.01Å; M115-M119 HydrophobicContact SD-SD 3.73Å; P116-M119 WeakPolarHBondContact O-CA 3.35Å; P116-M119 WeakPolarHBondContact O-CB 3.28Å; P116-M119 PolarHBondContact O-N 3.13Å; K117-M119 VanDerWaalsContact C-N 3.31Å; K117-M119 PolarHBondContact O-N 2.89Å; M119-D121 VanDerWaalsContact C-N 3.28Å; M119-D121 PolarHBondContact O-N 3.15Å; M119-I122 WeakPolarHBondContact O-CB 3.49Å; M119-I122 PolarHBondContact O-N 3.35Å; M119-I123 HydrophobicContact CG-CD1 3.96Å; M119-I123 HydrophobicContact CG-CG1 4.46Å; M119-I123 VanDerWaalsContact O-CG1 3.31Å; M119-I123 WeakPolarHBondContact O-CG1 3.5Å; M119-I123 PolarHBondContact O-N 2.93Å; M119-I123 HydrophobicContact SD-CD1 4.44Å
120	S	97.9	Very high	96.4	Very high	0 Å²	0	58.3 Å²	58.3	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-60.5	-38.8	-179.9	71.6	0	0	0	0	112.2	P116 K117 I123 Q124	P116-S120 PolarHBondContact O-N 3.42Å; K117-S120 PolarHBondContact O-N 3.19Å; K117-S120 PolarHBondContact O-OG 3.48Å; S120-I123 PolarHBondContact O-N 3.27Å; S120-Q124 VanDerWaalsContact O-CG 3.3Å; S120-Q124 WeakPolarHBondContact O-CG 3.35Å; S120-Q124 PolarHBondContact O-N 3.14Å
121	D	98.1	Very high	96.7	Very high	48 Å²	48	56.3 Å²	56.3	26%	0.257	28%	0.278	S	S	.	.	H	α-helix	trans	-67.9	-38.4	178.8	-68.9	-21.3	0	0	0	111.6	K117 E118 M119 R125	K117-D121 VanDerWaalsContact CE-OD1 3.25Å; K117-D121 WeakPolarHBondContact CE-OD1 3.48Å; K117-D121 WeakPolarHBondContact CE-OD2 3.08Å; K117-D121 IonicContact NZ-OD1 3.27Å; K117-D121 PolarHBondContact NZ-OD1 2.9Å; K117-D121 IonicContact NZ-OD2 3.52Å; K117-D121 VanDerWaalsContact O-CG 3.25Å; K117-D121 PolarHBondContact O-N 2.99Å; E118-D121 PolarHBondContact O-N 3.43Å; M119-D121 VanDerWaalsContact C-N 3.28Å; M119-D121 PolarHBondContact O-N 3.15Å; D121-R125 WeakPolarHBondContact O-CG 3.18Å; D121-R125 PolarHBondContact O-N 3.45Å; D121-R125 VanDerWaalsContact O-N 3.13Å; D121-R125 PolarHBondContact O-NH1 3.49Å
122	I	98.4	Very high	97.1	Very high	2 Å²	2	49 Å²	49	1%	0.01	24%	0.244	C	C	.	.	H	α-helix	trans	-62.2	-49.5	172.4	-73.9	165.5	0	0	0	110.5	D99 K102 L103 M106 E118 M119 Q124 R125 L126	D99-I122 HydrophobicContact CB-CG2 4.01Å; D99-I122 WeakPolarHBondContact O-CG2 3.47Å; K102-I122 HydrophobicContact CB-CD1 4.08Å; L103-I122 HydrophobicContact CB-CG2 3.87Å; L103-I122 HydrophobicContact CD1-CG2 4.26Å; L103-I122 HydrophobicContact CG-CG2 4.45Å; M106-I122 HydrophobicContact SD-CD1 3.68Å; E118-I122 HydrophobicContact CG-CD1 4.1Å; E118-I122 WeakPolarHBondContact O-CG1 3.42Å; E118-I122 PolarHBondContact O-N 2.75Å; M119-I122 WeakPolarHBondContact O-CB 3.49Å; M119-I122 PolarHBondContact O-N 3.35Å; I122-Q124 VanDerWaalsContact C-N 3.31Å; I122-Q124 PolarHBondContact O-N 3.5Å; I122-R125 PolarHBondContact O-N 2.91Å; I122-L126 HydrophobicContact CG2-CD1 3.72Å; I122-L126 HydrophobicContact CG2-CG 4.36Å; I122-L126 WeakPolarHBondContact O-CG 3.15Å; I122-L126 PolarHBondContact O-N 3.28Å
123	I	98.6	Very high	97.5	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-60.9	-41.9	-179.6	-63.7	173.9	0	0	0	110.7	L74 I77 L103 M115 M119 S120 R125 L126 W127 L152 L155	L74-I123 HydrophobicContact CD1-CD1 4.26Å; I77-I123 HydrophobicContact CB-CG2 4.26Å; I77-I123 HydrophobicContact CG1-CG2 4.22Å; I77-I123 HydrophobicContact CG2-CD1 4.01Å; I77-I123 HydrophobicContact CG2-CG1 4Å; I77-I123 HydrophobicContact CG2-CG2 4.17Å; L103-I123 HydrophobicContact CD1-CD1 4.14Å; L103-I123 HydrophobicContact CD1-CG1 3.76Å; L103-I123 HydrophobicContact CD2-CG1 4.03Å; M115-I123 HydrophobicContact CE-CD1 4.12Å; M115-I123 HydrophobicContact SD-CD1 3.85Å; M119-I123 HydrophobicContact CG-CD1 3.96Å; M119-I123 HydrophobicContact CG-CG1 4.46Å; M119-I123 VanDerWaalsContact O-CG1 3.31Å; M119-I123 WeakPolarHBondContact O-CG1 3.5Å; M119-I123 PolarHBondContact O-N 2.93Å; M119-I123 HydrophobicContact SD-CD1 4.44Å; S120-I123 PolarHBondContact O-N 3.27Å; I123-R125 PolarHBondContact O-N 3.27Å; I123-L126 PolarHBondContact O-N 3.41Å; I123-W127 WeakPolarHBondContact O-CB 3.15Å; I123-W127 PolarHBondContact O-N 3.29Å; I123-L152 HydrophobicContact CG2-CD2 3.68Å; I123-L155 HydrophobicContact CB-CD2 3.64Å; I123-L155 HydrophobicContact CG2-CD2 3.43Å; I123-L155 VanDerWaalsContact CG2-CD2 3.43Å
124	Q	98.4	Very high	97.9	Very high	36 Å²	36	44.6 Å²	44.6	17%	0.168	23%	0.225	C	C	.	.	H	α-helix	trans	-62.5	-40.5	176.8	-73.3	-177.7	28.6	0	0	112.7	S120 I122 K128 L155	S120-Q124 VanDerWaalsContact O-CG 3.3Å; S120-Q124 WeakPolarHBondContact O-CG 3.35Å; S120-Q124 PolarHBondContact O-N 3.14Å; I122-Q124 VanDerWaalsContact C-N 3.31Å; I122-Q124 PolarHBondContact O-N 3.5Å; Q124-K128 WeakPolarHBondContact O-CG 3.29Å; Q124-K128 PolarHBondContact O-N 3.43Å; Q124-L155 HydrophobicContact CG-CB 4.36Å; Q124-L155 HydrophobicContact CG-CD2 3.85Å; Q124-L155 HydrophobicContact CG-CG 4.23Å
125	R	98.4	Very high	98	Very high	97 Å²	97	42.4 Å²	42.4	37%	0.366	21%	0.212	S	C	.	.	H	α-helix	trans	-67	-42.1	175.7	-73	-168.9	-58.3	-86.2	7.1	111.9	R96 D99 D121 I122 I123 K128 D129	R96-R125 WeakPolarHBondContact CD-O 3.43Å; D99-R125 IonicContact OD1-CZ 2.78Å; D99-R125 IonicContact OD1-NE 3.66Å; D99-R125 IonicContact OD1-NH2 2.76Å; D99-R125 PolarHBondContact OD1-NH2 2.8Å; D99-R125 IonicContact OD2-CZ 2.61Å; D99-R125 IonicContact OD2-NE 3.38Å; D99-R125 PolarHBondContact OD2-NE 3.27Å; D99-R125 IonicContact OD2-NH2 3.65Å; D121-R125 WeakPolarHBondContact O-CG 3.18Å; D121-R125 PolarHBondContact O-N 3.45Å; D121-R125 VanDerWaalsContact O-N 3.13Å; D121-R125 PolarHBondContact O-NH1 3.49Å; I122-R125 PolarHBondContact O-N 2.91Å; I123-R125 PolarHBondContact O-N 3.27Å; R125-K128 PolarHBondContact O-N 3.12Å; R125-D129 PolarHBondContact O-N 3.13Å
126	L	98.7	Very high	98.1	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-63.6	-46.3	176.1	-72.4	168.7	0	0	0	111.2	I77 V81 Y91 R96 D99 A100 L103 I122 I123 K128 D129 I132	I77-L126 HydrophobicContact CD1-CB 4.18Å; I77-L126 HydrophobicContact CG1-CD1 4.45Å; V81-L126 HydrophobicContact CG2-CD1 4.46Å; Y91-L126 HydrophobicContact CE1-CD2 4.07Å; R96-L126 HydrophobicContact CB-CD2 4.05Å; D99-L126 HydrophobicContact CB-CD2 4.05Å; D99-L126 HydrophobicContact CB-CG 4.15Å; A100-L126 HydrophobicContact CB-CD2 4.17Å; L103-L126 HydrophobicContact CB-CD1 4.35Å; L103-L126 HydrophobicContact CD2-CD1 3.63Å; I122-L126 HydrophobicContact CG2-CD1 3.72Å; I122-L126 HydrophobicContact CG2-CG 4.36Å; I122-L126 WeakPolarHBondContact O-CG 3.15Å; I122-L126 PolarHBondContact O-N 3.28Å; I123-L126 PolarHBondContact O-N 3.41Å; L126-K128 PolarHBondContact O-N 3.18Å; L126-D129 WeakPolarHBondContact O-CB 3.42Å; L126-D129 PolarHBondContact O-N 3.17Å; L126-I132 WeakPolarHBondContact O-CB 3.49Å; L126-I132 WeakPolarHBondContact O-CG1 3.2Å; L126-I132 WeakPolarHBondContact O-CG2 3.35Å
127	W	98.6	Very high	98.1	Very high	23 Å²	23	48.2 Å²	48.2	9%	0.087	23%	0.234	C	C	.	.	H	α-helix	trans	-61.4	-33.2	-179.4	-175.1	-124.6	0	0	0	112.8	I80 I123 D129 I132 Q133 F136 L152 S153	I80-W127 HydrophobicContact CD1-CE3 4.47Å; I80-W127 HydrophobicContact CD1-CZ3 3.9Å; I123-W127 WeakPolarHBondContact O-CB 3.15Å; I123-W127 PolarHBondContact O-N 3.29Å; W127-D129 VanDerWaalsContact C-N 3.29Å; W127-D129 PolarHBondContact O-N 3.29Å; W127-I132 HydrophobicContact CE3-CG2 4.02Å; W127-I132 HydrophobicContact CZ3-CG2 4.48Å; W127-Q133 VanDerWaalsContact CE2-NE2 3.29Å; W127-Q133 VanDerWaalsContact CE3-NE2 3.28Å; W127-Q133 PolarHBondContact O-NE2 3.07Å; W127-F136 HydrophobicContact CH2-CB 4.22Å; W127-F136 AromaticContact CH2-CD1 3.61Å; W127-F136 HydrophobicContact CH2-CD1 3.61Å; W127-F136 AromaticContact CH2-CD2 3.79Å; W127-F136 HydrophobicContact CH2-CD2 3.79Å; W127-F136 AromaticContact CH2-CE1 3.84Å; W127-F136 HydrophobicContact CH2-CE1 3.84Å; W127-F136 HydrophobicContact CH2-CE2 4.02Å; W127-F136 AromaticContact CH2-CG 3.58Å; W127-F136 HydrophobicContact CH2-CG 3.58Å; W127-F136 HydrophobicContact CH2-CZ 4.04Å; W127-F136 HydrophobicContact CZ3-CB 4.04Å; W127-F136 HydrophobicContact CZ3-CD1 4.3Å; W127-F136 AromaticContact CZ3-CD2 3.97Å; W127-F136 HydrophobicContact CZ3-CD2 3.97Å; W127-F136 AromaticContact CZ3-CG 3.83Å; W127-F136 HydrophobicContact CZ3-CG 3.83Å; W127-L152 HydrophobicContact CD2-CB 3.55Å; W127-L152 HydrophobicContact CD2-CD1 4.18Å; W127-L152 HydrophobicContact CD2-CG 4.44Å; W127-L152 HydrophobicContact CE3-CB 3.94Å; W127-L152 HydrophobicContact CE3-CD1 3.64Å; W127-L152 HydrophobicContact CE3-CG 4.37Å; W127-L152 HydrophobicContact CG-CB 3.85Å; W127-L152 HydrophobicContact CH2-CB 4.45Å; W127-L152 HydrophobicContact CH2-CD1 4.24Å; W127-L152 HydrophobicContact CZ2-CB 4.12Å; W127-L152 HydrophobicContact CZ3-CB 4.37Å; W127-L152 HydrophobicContact CZ3-CD1 3.69Å; W127-S153 PolarHBondContact NE1-OG 3Å; W127-S153 VanDerWaalsContact NE1-OG 3.13Å
128	K	98.4	Very high	98.1	Very high	163 Å²	163	46.3 Å²	46.3	71%	0.709	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78.4	-8.1	176.3	-68.3	173.5	-176	175.9	0	114	Q124 R125 L126	Q124-K128 WeakPolarHBondContact O-CG 3.29Å; Q124-K128 PolarHBondContact O-N 3.43Å; R125-K128 PolarHBondContact O-N 3.12Å; L126-K128 PolarHBondContact O-N 3.18Å
129	D	98.7	Very high	98.1	Very high	9 Å²	9	41.4 Å²	41.4	5%	0.048	20%	0.204	C	C	.	.			trans	-71.7	136.4	179.6	-177.8	76.2	0	0	0	111.6	Y91 G92 D93 R96 R125 L126 W127 G131 I132 Q133	Y91-D129 WeakPolarHBondContact CA-OD2 3.15Å; G92-D129 VanDerWaalsContact CA-OD1 3.32Å; G92-D129 WeakPolarHBondContact CA-OD1 3.15Å; G92-D129 VanDerWaalsContact N-CG 3.33Å; G92-D129 PolarHBondContact N-OD1 3.28Å; G92-D129 PolarHBondContact N-OD2 3.02Å; D93-D129 PolarHBondContact N-OD1 2.94Å; R96-D129 HydrophobicContact CG-CB 3.99Å; R96-D129 WeakPolarHBondContact CG-OD1 3.25Å; R125-D129 PolarHBondContact O-N 3.13Å; L126-D129 WeakPolarHBondContact O-CB 3.42Å; L126-D129 PolarHBondContact O-N 3.17Å; W127-D129 VanDerWaalsContact C-N 3.29Å; W127-D129 PolarHBondContact O-N 3.29Å; D129-G131 VanDerWaalsContact C-N 3.32Å; D129-G131 PolarHBondContact O-N 2.96Å; D129-G131 VanDerWaalsContact OD2-CA 3.3Å; D129-G131 WeakPolarHBondContact OD2-CA 3.49Å; D129-G131 PolarHBondContact OD2-N 3.48Å; D129-I132 HydrophobicContact CB-CB 4.13Å; D129-I132 HydrophobicContact CB-CG1 4.06Å; D129-I132 PolarHBondContact O-N 3.49Å; D129-I132 PolarHBondContact OD2-N 3.42Å; D129-I132 VanDerWaalsContact OD2-N 3.16Å; D129-Q133 WeakPolarHBondContact O-CG 3.39Å; D129-Q133 PolarHBondContact O-N 3.31Å
130	S	98.5	Very high	98.1	Very high	82 Å²	82	43.3 Å²	43.3	57%	0.573	22%	0.217	S	C	*	.	H	α-helix	trans	-67.8	-30.7	-177.8	56.3	0	0	0	0	113.3	G92 A134	G92-S130 VanDerWaalsContact CA-OG 3.29Å; G92-S130 WeakPolarHBondContact CA-OG 3.46Å; S130-A134 WeakPolarHBondContact O-CB 3.26Å; S130-A134 PolarHBondContact O-N 3.48Å
131	G	98.6	Very high	98	Very high	5 Å²	5	48.2 Å²	48.2	5%	0.052	24%	0.24	C	C	.	.	H	α-helix	trans	-67.6	-44.7	174.1	0	0	0	0	0	111.6	M84 Q90 D129 Q133 A134 C135	M84-G131 VanDerWaalsContact SD-C 3.53Å; Q90-G131 VanDerWaalsContact O-CA 3.32Å; Q90-G131 WeakPolarHBondContact O-CA 3.32Å; D129-G131 VanDerWaalsContact C-N 3.32Å; D129-G131 PolarHBondContact O-N 2.96Å; D129-G131 VanDerWaalsContact OD2-CA 3.3Å; D129-G131 WeakPolarHBondContact OD2-CA 3.49Å; D129-G131 PolarHBondContact OD2-N 3.48Å; G131-Q133 PolarHBondContact O-N 3.43Å; G131-A134 PolarHBondContact O-N 3.38Å; G131-C135 WeakPolarHBondContact O-CB 3.39Å; G131-C135 PolarHBondContact O-N 2.87Å
132	I	98.7	Very high	97.9	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-60.3	-44.3	173.8	-69.9	-71.4	0	0	0	111.2	I77 I80 V81 M84 Y91 L126 W127 D129 C135 F136	I77-I132 HydrophobicContact CD1-CG2 4.3Å; I80-I132 HydrophobicContact CG2-CD1 3.98Å; I80-I132 HydrophobicContact CG2-CG2 4.04Å; V81-I132 HydrophobicContact CG2-CD1 4.13Å; M84-I132 HydrophobicContact CE-CD1 4.46Å; M84-I132 HydrophobicContact CG-CD1 3.82Å; M84-I132 HydrophobicContact SD-CD1 4.05Å; Y91-I132 HydrophobicContact CD1-CG1 4.3Å; Y91-I132 HydrophobicContact CE1-CD1 4Å; Y91-I132 HydrophobicContact CE1-CG1 4.16Å; L126-I132 WeakPolarHBondContact O-CB 3.49Å; L126-I132 WeakPolarHBondContact O-CG1 3.2Å; L126-I132 WeakPolarHBondContact O-CG2 3.35Å; W127-I132 HydrophobicContact CE3-CG2 4.02Å; W127-I132 HydrophobicContact CZ3-CG2 4.48Å; D129-I132 HydrophobicContact CB-CB 4.13Å; D129-I132 HydrophobicContact CB-CG1 4.06Å; D129-I132 PolarHBondContact O-N 3.49Å; D129-I132 PolarHBondContact OD2-N 3.42Å; D129-I132 VanDerWaalsContact OD2-N 3.16Å; I132-C135 PolarHBondContact O-N 3.45Å; I132-F136 WeakPolarHBondContact O-CB 3.38Å; I132-F136 PolarHBondContact O-N 3.18Å
133	Q	98.7	Very high	97.9	Very high	62 Å²	62	50.5 Å²	50.5	29%	0.29	25%	0.248	S	C	.	.	H	α-helix	trans	-62.7	-43.4	175.6	-71.4	-61.3	-51.7	0	0	112	W127 D129 G131 C135 F136 E137	W127-Q133 VanDerWaalsContact CE2-NE2 3.29Å; W127-Q133 VanDerWaalsContact CE3-NE2 3.28Å; W127-Q133 PolarHBondContact O-NE2 3.07Å; D129-Q133 WeakPolarHBondContact O-CG 3.39Å; D129-Q133 PolarHBondContact O-N 3.31Å; G131-Q133 PolarHBondContact O-N 3.43Å; Q133-C135 VanDerWaalsContact C-N 3.29Å; Q133-C135 PolarHBondContact O-N 3.48Å; Q133-F136 WeakPolarHBondContact O-CB 3.36Å; Q133-F136 PolarHBondContact O-N 2.83Å; Q133-F136 VanDerWaalsContact O-N 3.14Å; Q133-E137 WeakPolarHBondContact O-CG 3.4Å; Q133-E137 PolarHBondContact O-N 3.07Å
134	A	98.3	Very high	97.8	Very high	39 Å²	39	51.2 Å²	51.2	32%	0.322	25%	0.252	S	S	.	.	H	α-helix	trans	-62.6	-34.7	175.3	0	0	0	0	0	112.7	S130 G131	S130-A134 WeakPolarHBondContact O-CB 3.26Å; S130-A134 PolarHBondContact O-N 3.48Å; G131-A134 PolarHBondContact O-N 3.38Å
135	C	98.5	Very high	97.5	Very high	0 Å²	0	51.4 Å²	51.4	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-71.4	-37	173.3	-172.1	0	0	0	0	112.2	I80 M84 I89 G131 I132 Q133 E137 R138 Y142	I80-C135 HydrophobicContact CG2-CB 4.02Å; M84-C135 HydrophobicContact CG-CB 4.13Å; M84-C135 HydrophobicContact SD-CB 3.36Å; M84-C135 WeakPolarHBondContact SD-CB 3.26Å; I89-C135 HydrophobicContact CD1-CB 3.64Å; G131-C135 WeakPolarHBondContact O-CB 3.39Å; G131-C135 PolarHBondContact O-N 2.87Å; I132-C135 PolarHBondContact O-N 3.45Å; Q133-C135 VanDerWaalsContact C-N 3.29Å; Q133-C135 PolarHBondContact O-N 3.48Å; C135-E137 VanDerWaalsContact C-N 3.31Å; C135-E137 PolarHBondContact O-N 3.17Å; C135-R138 CarbonylContact O-C 3.57Å; C135-R138 PolarHBondContact O-N 2.71Å; C135-R138 VanDerWaalsContact O-N 3.13Å; C135-Y142 WeakPolarHBondContact O-CE1 3.47Å; C135-Y142 PolarHBondContact O-OH 2.78Å
136	F	98.2	Very high	97.3	Very high	57 Å²	57	49.8 Å²	49.8	25%	0.25	25%	0.253	C	S	.	.	H	α-helix	trans	-63.8	-35.3	174.1	180	-108.4	0	0	0	112.4	I80 W127 I132 Q133 R138 A139 L144 A148	I80-F136 HydrophobicContact CD1-CD2 4.03Å; W127-F136 HydrophobicContact CH2-CB 4.22Å; W127-F136 AromaticContact CH2-CD1 3.61Å; W127-F136 HydrophobicContact CH2-CD1 3.61Å; W127-F136 AromaticContact CH2-CD2 3.79Å; W127-F136 HydrophobicContact CH2-CD2 3.79Å; W127-F136 AromaticContact CH2-CE1 3.84Å; W127-F136 HydrophobicContact CH2-CE1 3.84Å; W127-F136 HydrophobicContact CH2-CE2 4.02Å; W127-F136 AromaticContact CH2-CG 3.58Å; W127-F136 HydrophobicContact CH2-CG 3.58Å; W127-F136 HydrophobicContact CH2-CZ 4.04Å; W127-F136 HydrophobicContact CZ3-CB 4.04Å; W127-F136 HydrophobicContact CZ3-CD1 4.3Å; W127-F136 AromaticContact CZ3-CD2 3.97Å; W127-F136 HydrophobicContact CZ3-CD2 3.97Å; W127-F136 AromaticContact CZ3-CG 3.83Å; W127-F136 HydrophobicContact CZ3-CG 3.83Å; I132-F136 WeakPolarHBondContact O-CB 3.38Å; I132-F136 PolarHBondContact O-N 3.18Å; Q133-F136 WeakPolarHBondContact O-CB 3.36Å; Q133-F136 PolarHBondContact O-N 2.83Å; Q133-F136 VanDerWaalsContact O-N 3.14Å; F136-R138 PolarHBondContact O-N 2.85Å; F136-R138 VanDerWaalsContact O-N 3.17Å; F136-A139 WeakPolarHBondContact O-CB 3.27Å; F136-A139 PolarHBondContact O-N 2.81Å; F136-A139 VanDerWaalsContact O-N 3.11Å; F136-L144 HydrophobicContact CD2-CD2 3.52Å; F136-L144 HydrophobicContact CE2-CD2 3.59Å; F136-A148 HydrophobicContact CE2-CB 4.19Å
137	E	96.6	Very high	97.2	Very high	134 Å²	134	50.7 Å²	50.7	63%	0.626	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.4	-20.8	174	-72.2	179.1	169.9	0	0	113.6	Q133 C135	Q133-E137 WeakPolarHBondContact O-CG 3.4Å; Q133-E137 PolarHBondContact O-N 3.07Å; C135-E137 VanDerWaalsContact C-N 3.31Å; C135-E137 PolarHBondContact O-N 3.17Å
138	R	96.7	Very high	97.1	Very high	89 Å²	89	49.6 Å²	49.6	34%	0.336	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.3	21.8	177.6	-65.1	173.8	66.3	-173.1	-1.3	112.7	L87 C135 F136 S140 E141 Y142	L87-R138 HydrophobicContact CD1-CB 4.11Å; C135-R138 CarbonylContact O-C 3.57Å; C135-R138 PolarHBondContact O-N 2.71Å; C135-R138 VanDerWaalsContact O-N 3.13Å; F136-R138 PolarHBondContact O-N 2.85Å; F136-R138 VanDerWaalsContact O-N 3.17Å; R138-S140 PolarHBondContact O-N 3.39Å; R138-E141 WeakPolarHBondContact CB-OE1 3.46Å; R138-E141 WeakPolarHBondContact CG-OE1 3.45Å; R138-E141 IonicContact CZ-OE1 2.68Å; R138-E141 IonicContact CZ-OE2 3.54Å; R138-E141 IonicContact NE-OE1 3.46Å; R138-E141 PolarHBondContact NE-OE1 3.42Å; R138-E141 IonicContact NE-OE2 2.92Å; R138-E141 PolarHBondContact NE-OE2 3.3Å; R138-E141 IonicContact NH2-OE1 2.74Å; R138-E141 PolarHBondContact NH2-OE1 3.02Å; R138-E141 IonicContact NH2-OE2 2.8Å; R138-E141 PolarHBondContact NH2-OE2 2.82Å; R138-E141 WeakPolarHBondContact O-CB 3.26Å; R138-E141 PolarHBondContact O-N 2.99Å; R138-Y142 WeakPolarHBondContact O-CE1 3.48Å
139	A	96.9	Very high	97.1	Very high	23 Å²	23	42.6 Å²	42.6	19%	0.19	23%	0.229	C	C	.	.	G	3₁₀ helix	trans	-60.4	-11.3	-176.2	0	0	0	0	0	115.7	F136 E141 L144	F136-A139 WeakPolarHBondContact O-CB 3.27Å; F136-A139 PolarHBondContact O-N 2.81Å; F136-A139 VanDerWaalsContact O-N 3.11Å; A139-E141 VanDerWaalsContact C-N 3.31Å; A139-L144 HydrophobicContact CB-CB 4.29Å; A139-L144 HydrophobicContact CB-CD2 3.69Å
140	S	95.6	Very high	97.1	Very high	40 Å²	40	44.7 Å²	44.7	28%	0.28	24%	0.237	S	C	.	.	G	3₁₀ helix	trans	-74.7	-19.9	170.5	48.9	0	0	0	0	113.3	R138 Y142 D227	R138-S140 PolarHBondContact O-N 3.39Å; S140-Y142 VanDerWaalsContact C-N 3.33Å; S140-D227 WeakPolarHBondContact CB-OD2 3.03Å
141	E	96.3	Very high	97.1	Very high	103 Å²	103	40.9 Å²	40.9	48%	0.481	21%	0.21	S	C	.	.	G	3₁₀ helix	trans	-84.4	-4.6	-178.1	-61	178.6	-128.9	0	0	113.4	L87 R138 A139	L87-E141 HydrophobicContact CD1-CB 4.47Å; L87-E141 HydrophobicContact CD2-CB 4.25Å; L87-E141 WeakPolarHBondContact CD2-OE2 3.46Å; R138-E141 WeakPolarHBondContact CB-OE1 3.46Å; R138-E141 WeakPolarHBondContact CG-OE1 3.45Å; R138-E141 IonicContact CZ-OE1 2.68Å; R138-E141 IonicContact CZ-OE2 3.54Å; R138-E141 IonicContact NE-OE1 3.46Å; R138-E141 PolarHBondContact NE-OE1 3.42Å; R138-E141 IonicContact NE-OE2 2.92Å; R138-E141 PolarHBondContact NE-OE2 3.3Å; R138-E141 IonicContact NH2-OE1 2.74Å; R138-E141 PolarHBondContact NH2-OE1 3.02Å; R138-E141 IonicContact NH2-OE2 2.8Å; R138-E141 PolarHBondContact NH2-OE2 2.82Å; R138-E141 WeakPolarHBondContact O-CB 3.26Å; R138-E141 PolarHBondContact O-N 2.99Å; A139-E141 VanDerWaalsContact C-N 3.31Å
142	Y	97.4	Very high	97.1	Very high	30 Å²	30	40.8 Å²	40.8	12%	0.118	21%	0.208	C	C	.	.	S	Bend	trans	-150.2	172.4	177.7	59.9	-83.5	0	0	0	111.3	I80 A83 L87 C135 R138 S140 L144	I80-Y142 HydrophobicContact CG1-CE2 4.25Å; A83-Y142 HydrophobicContact CB-CD1 3.56Å; A83-Y142 HydrophobicContact CB-CD2 3.63Å; A83-Y142 HydrophobicContact CB-CE1 3.67Å; A83-Y142 HydrophobicContact CB-CE2 3.74Å; A83-Y142 HydrophobicContact CB-CG 3.53Å; L87-Y142 HydrophobicContact CD1-CD1 4.02Å; L87-Y142 HydrophobicContact CD1-CE1 4.11Å; C135-Y142 WeakPolarHBondContact O-CE1 3.47Å; C135-Y142 PolarHBondContact O-OH 2.78Å; R138-Y142 WeakPolarHBondContact O-CE1 3.48Å; S140-Y142 VanDerWaalsContact C-N 3.33Å; Y142-L144 HydrophobicContact CD2-CB 4.15Å; Y142-L144 HydrophobicContact CE2-CB 3.82Å; Y142-L144 HydrophobicContact CE2-CD1 4.36Å; Y142-L144 HydrophobicContact CE2-CD2 4.12Å; Y142-L144 HydrophobicContact CE2-CG 4.32Å; Y142-L144 PolarHBondContact O-N 2.9Å
143	Q	96.6	Very high	97.1	Very high	69 Å²	69	44.7 Å²	44.7	32%	0.322	24%	0.236	S	C	.	.			trans	-83.6	101.9	-176.3	-56.1	-59.7	-27.1	0	0	110.5	V229 L230 V231	Q143-V229 PolarHBondContact NE2-O 2.8Å; Q143-V229 VanDerWaalsContact NE2-O 3.14Å; Q143-L230 PolarHBondContact NE2-O 2.97Å; Q143-V231 HydrophobicContact CB-CG2 4.49Å; Q143-V231 HydrophobicContact CG-CG2 4.04Å; Q143-V231 VanDerWaalsContact OE1-CG2 3.3Å
144	L	97.2	Very high	97	Very high	14 Å²	14	44.4 Å²	44.4	7%	0.073	24%	0.236	C	C	.	.			trans	-128.8	137	175.9	-170.2	64.8	0	0	0	111.4	S76 A79 I80 F136 A139 Y142 A148	S76-L144 WeakPolarHBondContact O-CD1 3.05Å; A79-L144 HydrophobicContact CB-CD1 4.02Å; I80-L144 HydrophobicContact CD1-CD1 4.33Å; I80-L144 HydrophobicContact CD1-CD2 4.21Å; I80-L144 HydrophobicContact CG1-CD1 3.9Å; I80-L144 HydrophobicContact CG1-CD2 4.01Å; F136-L144 HydrophobicContact CD2-CD2 3.52Å; F136-L144 HydrophobicContact CE2-CD2 3.59Å; A139-L144 HydrophobicContact CB-CB 4.29Å; A139-L144 HydrophobicContact CB-CD2 3.69Å; Y142-L144 HydrophobicContact CD2-CB 4.15Å; Y142-L144 HydrophobicContact CE2-CB 3.82Å; Y142-L144 HydrophobicContact CE2-CD1 4.36Å; Y142-L144 HydrophobicContact CE2-CD2 4.12Å; Y142-L144 HydrophobicContact CE2-CG 4.32Å; Y142-L144 PolarHBondContact O-N 2.9Å; L144-A148 HydrophobicContact CD1-CB 3.79Å; L144-A148 HydrophobicContact CD2-CB 3.92Å; L144-A148 HydrophobicContact CG-CB 3.77Å
145	N	93.1	Very high	97	Very high	41 Å²	41	42.6 Å²	42.6	22%	0.219	22%	0.221	C	C	.	.			trans	-67.3	136.4	174.7	-68.3	-38.4	0	0	0	111.1	S147 A148	N145-S147 PolarHBondContact O-N 2.76Å; N145-S147 VanDerWaalsContact O-N 3.11Å; N145-A148 WeakPolarHBondContact O-CB 3.38Å; N145-A148 PolarHBondContact O-N 3.47Å
146	D	93.1	Very high	97	Very high	62 Å²	62	49.4 Å²	49.4	33%	0.332	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57	-30.6	177.4	-61.9	-41.8	0	0	0	113.4	A148 K266	D146-A148 PolarHBondContact O-N 3.18Å; D146-K266 VanDerWaalsContact OD2-CD 3.31Å; D146-K266 WeakPolarHBondContact OD2-CD 3.47Å; D146-K266 VanDerWaalsContact OD2-CE 3.27Å; D146-K266 WeakPolarHBondContact OD2-CE 3.3Å; D146-K266 IonicContact OD2-NZ 2.66Å; D146-K266 PolarHBondContact OD2-NZ 2.89Å
147	S	96.3	Very high	96.9	Very high	20 Å²	20	49.9 Å²	49.9	14%	0.14	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.1	-4.7	177.2	-55	0	0	0	0	114.3	N145 G149 Y150 Y151 R172	N145-S147 PolarHBondContact O-N 2.76Å; N145-S147 VanDerWaalsContact O-N 3.11Å; S147-G149 PolarHBondContact O-N 3.38Å; S147-Y150 WeakPolarHBondContact O-CB 3.48Å; S147-Y150 PolarHBondContact O-N 3.24Å; S147-Y150 VanDerWaalsContact O-N 3.13Å; S147-Y151 WeakPolarHBondContact O-CD2 3.36Å; S147-Y151 PolarHBondContact O-N 3.26Å; S147-Y151 VanDerWaalsContact O-N 3.11Å; S147-R172 WeakPolarHBondContact CB-O 3.38Å; S147-R172 WeakPolarHBondContact OG-CB 3.17Å; S147-R172 PolarHBondContact OG-O 3.22Å
148	A	98.1	Very high	97	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-54.3	-52.1	-176.4	0	0	0	0	0	111.7	S76 F136 L144 N145 D146 Y150 Y151 L152	S76-A148 WeakPolarHBondContact OG-CB 3.39Å; F136-A148 HydrophobicContact CE2-CB 4.19Å; L144-A148 HydrophobicContact CD1-CB 3.79Å; L144-A148 HydrophobicContact CD2-CB 3.92Å; L144-A148 HydrophobicContact CG-CB 3.77Å; N145-A148 WeakPolarHBondContact O-CB 3.38Å; N145-A148 PolarHBondContact O-N 3.47Å; D146-A148 PolarHBondContact O-N 3.18Å; A148-Y150 VanDerWaalsContact C-N 3.28Å; A148-Y150 PolarHBondContact O-N 3.08Å; A148-Y151 PolarHBondContact O-N 2.89Å; A148-L152 HydrophobicContact CB-CD1 4.35Å; A148-L152 VanDerWaalsContact O-CB 3.29Å; A148-L152 WeakPolarHBondContact O-CB 3.37Å; A148-L152 WeakPolarHBondContact O-CD1 3.4Å; A148-L152 WeakPolarHBondContact O-CG 3.39Å; A148-L152 PolarHBondContact O-N 3.36Å
149	G	97.7	Very high	97	Very high	15 Å²	15	40.8 Å²	40.8	16%	0.155	22%	0.216	C	C	.	.	H	α-helix	trans	-62.8	-33.5	180	0	0	0	0	0	113.3	S147 S153	S147-G149 PolarHBondContact O-N 3.38Å; G149-S153 WeakPolarHBondContact O-CB 3.49Å; G149-S153 PolarHBondContact O-N 3.14Å; G149-S153 PolarHBondContact O-OG 3Å
150	Y	98.2	Very high	97	Very high	54 Å²	54	43.1 Å²	43.1	21%	0.212	23%	0.228	C	C	.	.	H	α-helix	trans	-64.9	-52.8	177.2	172.8	-97.5	0	0	0	111.5	S147 A148 D154 R157 Q168 D169 R172	S147-Y150 WeakPolarHBondContact O-CB 3.48Å; S147-Y150 PolarHBondContact O-N 3.24Å; S147-Y150 VanDerWaalsContact O-N 3.13Å; A148-Y150 VanDerWaalsContact C-N 3.28Å; A148-Y150 PolarHBondContact O-N 3.08Å; Y150-D154 WeakPolarHBondContact O-CB 3.44Å; Y150-D154 PolarHBondContact O-N 3.11Å; Y150-R157 PolarHBondContact OH-NH2 3.41Å; Y150-Q168 HydrophobicContact CE2-CG 3.96Å; Y150-Q168 WeakPolarHBondContact OH-CG 3.48Å; Y150-D169 WeakPolarHBondContact CE1-OD1 3.37Å; Y150-D169 PolarHBondContact OH-OD1 2.82Å; Y150-R172 HydrophobicContact CD1-CB 4.25Å; Y150-R172 HydrophobicContact CD1-CG 4.38Å; Y150-R172 HydrophobicContact CE1-CB 4.42Å
151	Y	98.5	Very high	97	Very high	1 Å²	1	47.4 Å²	47.4	0%	0.004	26%	0.255	C	S	.	.	H	α-helix	trans	-72.9	-40.4	-176.9	-66.1	-56.2	0	0	0	112.9	I69 N72 T73 S147 A148 S153 D154 L155 L158 D169 R172 S173	I69-Y151 HydrophobicContact CB-CE1 4.48Å; I69-Y151 HydrophobicContact CG1-CE1 4.19Å; I69-Y151 HydrophobicContact CG2-CD1 3.85Å; I69-Y151 HydrophobicContact CG2-CE1 3.66Å; N72-Y151 HydrophobicContact CB-CE2 4.32Å; T73-Y151 WeakPolarHBondContact OG1-CB 3.44Å; S147-Y151 WeakPolarHBondContact O-CD2 3.36Å; S147-Y151 PolarHBondContact O-N 3.26Å; S147-Y151 VanDerWaalsContact O-N 3.11Å; A148-Y151 PolarHBondContact O-N 2.89Å; Y151-S153 VanDerWaalsContact C-N 3.32Å; Y151-S153 PolarHBondContact O-N 3.3Å; Y151-D154 CarbonylContact O-C 3.57Å; Y151-D154 PolarHBondContact O-N 3.03Å; Y151-L155 PolarHBondContact O-N 3.28Å; Y151-L155 VanDerWaalsContact O-N 3.1Å; Y151-L158 HydrophobicContact CD1-CD1 3.77Å; Y151-L158 HydrophobicContact CG-CD1 4.33Å; Y151-D169 HydrophobicContact CE1-CB 4.46Å; Y151-D169 PolarHBondContact OH-O 3.14Å; Y151-R172 HydrophobicContact CE2-CB 4.36Å; Y151-R172 PolarHBondContact OH-O 3.21Å; Y151-S173 WeakPolarHBondContact OH-CA 3.42Å; Y151-S173 PolarHBondContact OH-N 2.83Å
152	L	98.7	Very high	97	Very high	3 Å²	3	46.2 Å²	46.2	2%	0.016	27%	0.27	C	S	.	.	H	α-helix	trans	-66.9	-35.3	-178.3	-66.4	170.1	0	0	0	112	T73 I77 I80 I123 W127 A148 D154	T73-L152 HydrophobicContact CG2-CD2 3.79Å; I77-L152 HydrophobicContact CB-CD2 3.84Å; I77-L152 HydrophobicContact CG2-CD2 4.5Å; I80-L152 HydrophobicContact CD1-CD1 3.8Å; I123-L152 HydrophobicContact CG2-CD2 3.68Å; W127-L152 HydrophobicContact CD2-CB 3.55Å; W127-L152 HydrophobicContact CD2-CD1 4.18Å; W127-L152 HydrophobicContact CD2-CG 4.44Å; W127-L152 HydrophobicContact CE3-CB 3.94Å; W127-L152 HydrophobicContact CE3-CD1 3.64Å; W127-L152 HydrophobicContact CE3-CG 4.37Å; W127-L152 HydrophobicContact CG-CB 3.85Å; W127-L152 HydrophobicContact CH2-CB 4.45Å; W127-L152 HydrophobicContact CH2-CD1 4.24Å; W127-L152 HydrophobicContact CZ2-CB 4.12Å; W127-L152 HydrophobicContact CZ3-CB 4.37Å; W127-L152 HydrophobicContact CZ3-CD1 3.69Å; A148-L152 HydrophobicContact CB-CD1 4.35Å; A148-L152 VanDerWaalsContact O-CB 3.29Å; A148-L152 WeakPolarHBondContact O-CB 3.37Å; A148-L152 WeakPolarHBondContact O-CD1 3.4Å; A148-L152 WeakPolarHBondContact O-CG 3.39Å; A148-L152 PolarHBondContact O-N 3.36Å; L152-D154 VanDerWaalsContact C-N 3.31Å; L152-D154 PolarHBondContact O-N 3.24Å
153	S	98.2	Very high	97	Very high	83 Å²	83	45.8 Å²	45.8	58%	0.58	27%	0.268	S	S	*	.	H	α-helix	trans	-74	-23	178.3	-56	0	0	0	0	113.4	W127 G149 Y151	W127-S153 PolarHBondContact NE1-OG 3Å; W127-S153 VanDerWaalsContact NE1-OG 3.13Å; G149-S153 WeakPolarHBondContact O-CB 3.49Å; G149-S153 PolarHBondContact O-N 3.14Å; G149-S153 PolarHBondContact O-OG 3Å; Y151-S153 VanDerWaalsContact C-N 3.32Å; Y151-S153 PolarHBondContact O-N 3.3Å
154	D	97.6	Very high	97.1	Very high	55 Å²	55	45.6 Å²	45.6	29%	0.294	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-114.5	17.4	-174.2	-154.2	7.2	0	0	0	112.4	Y150 Y151 L152 E156 R157 L158	Y150-D154 WeakPolarHBondContact O-CB 3.44Å; Y150-D154 PolarHBondContact O-N 3.11Å; Y151-D154 CarbonylContact O-C 3.57Å; Y151-D154 PolarHBondContact O-N 3.03Å; L152-D154 VanDerWaalsContact C-N 3.31Å; L152-D154 PolarHBondContact O-N 3.24Å; D154-E156 PolarHBondContact O-N 3.12Å; D154-E156 VanDerWaalsContact O-N 3.11Å; D154-R157 VanDerWaalsContact CG-NE 3.32Å; D154-R157 WeakPolarHBondContact O-CB 3.26Å; D154-R157 PolarHBondContact O-N 3.49Å; D154-R157 WeakPolarHBondContact OD1-CB 3.41Å; D154-R157 IonicContact OD1-NE 3.24Å; D154-R157 IonicContact OD2-CZ 2.89Å; D154-R157 IonicContact OD2-NE 3.38Å; D154-R157 PolarHBondContact OD2-NE 3.35Å; D154-R157 IonicContact OD2-NH2 3.77Å; D154-R157 PolarHBondContact OD2-NH2 3.09Å; D154-L158 WeakPolarHBondContact O-CG 3.26Å; D154-L158 PolarHBondContact O-N 3.01Å
155	L	98.2	Very high	97.1	Very high	2 Å²	2	45.1 Å²	45.1	1%	0.01	27%	0.27	C	S	.	.	H	α-helix	trans	-57	-32.1	-173.6	-179.7	55.9	0	0	0	113	T73 I123 Q124 Y151 R157 L158 V159	T73-L155 HydrophobicContact CG2-CD1 4.15Å; I123-L155 HydrophobicContact CB-CD2 3.64Å; I123-L155 HydrophobicContact CG2-CD2 3.43Å; I123-L155 VanDerWaalsContact CG2-CD2 3.43Å; Q124-L155 HydrophobicContact CG-CB 4.36Å; Q124-L155 HydrophobicContact CG-CD2 3.85Å; Q124-L155 HydrophobicContact CG-CG 4.23Å; Y151-L155 PolarHBondContact O-N 3.28Å; Y151-L155 VanDerWaalsContact O-N 3.1Å; L155-R157 VanDerWaalsContact C-N 3.33Å; L155-R157 PolarHBondContact O-N 3.21Å; L155-L158 HydrophobicContact CD1-CB 4.43Å; L155-L158 PolarHBondContact O-N 3.1Å; L155-V159 HydrophobicContact CD1-CG1 3.75Å; L155-V159 HydrophobicContact CG-CG1 4.42Å; L155-V159 WeakPolarHBondContact O-CG2 3.48Å; L155-V159 PolarHBondContact O-N 3.28Å; L155-V159 VanDerWaalsContact O-N 3.12Å
156	E	97.2	Very high	97.4	Very high	142 Å²	142	46.1 Å²	46.1	66%	0.664	28%	0.277	S	S	*	.	H	α-helix	trans	-59.4	-42	176.2	-173.8	171.7	-169.3	0	0	112.2	D154 T160	D154-E156 PolarHBondContact O-N 3.12Å; D154-E156 VanDerWaalsContact O-N 3.11Å; E156-T160 PolarHBondContact O-N 3.4Å; E156-T160 PolarHBondContact O-OG1 2.92Å
157	R	98	Very high	97.6	Very high	68 Å²	68	47.3 Å²	47.3	26%	0.257	28%	0.281	S	S	.	.	H	α-helix	trans	-65.7	-43.6	174.4	-178.9	-179.6	60.3	82.3	1.6	111.2	Y150 D154 L155 V159 T160 D169	Y150-R157 PolarHBondContact OH-NH2 3.41Å; D154-R157 VanDerWaalsContact CG-NE 3.32Å; D154-R157 WeakPolarHBondContact O-CB 3.26Å; D154-R157 PolarHBondContact O-N 3.49Å; D154-R157 WeakPolarHBondContact OD1-CB 3.41Å; D154-R157 IonicContact OD1-NE 3.24Å; D154-R157 IonicContact OD2-CZ 2.89Å; D154-R157 IonicContact OD2-NE 3.38Å; D154-R157 PolarHBondContact OD2-NE 3.35Å; D154-R157 IonicContact OD2-NH2 3.77Å; D154-R157 PolarHBondContact OD2-NH2 3.09Å; L155-R157 VanDerWaalsContact C-N 3.33Å; L155-R157 PolarHBondContact O-N 3.21Å; R157-V159 PolarHBondContact O-N 2.87Å; R157-T160 WeakPolarHBondContact O-CB 3.26Å; R157-T160 PolarHBondContact O-N 3.35Å; R157-D169 IonicContact CZ-OD1 2.79Å; R157-D169 IonicContact CZ-OD2 2.67Å; R157-D169 IonicContact NH1-OD1 3.74Å; R157-D169 PolarHBondContact NH1-OD1 2.97Å; R157-D169 IonicContact NH1-OD2 3.75Å; R157-D169 PolarHBondContact NH1-OD2 2.95Å; R157-D169 IonicContact NH2-OD1 3.67Å; R157-D169 PolarHBondContact NH2-OD1 3.49Å; R157-D169 IonicContact NH2-OD2 3.6Å
158	L	98	Very high	97.6	Very high	0 Å²	0	49 Å²	49	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-64.4	-27.3	-175.9	-55.7	178.5	0	0	0	113.1	I69 Y70 Y151 D154 L155 Y163	I69-L158 HydrophobicContact CG2-CD1 4.13Å; I69-L158 HydrophobicContact CG2-CD2 4.29Å; Y70-L158 HydrophobicContact CE1-CB 4.26Å; Y70-L158 VanDerWaalsContact CE1-O 3.28Å; Y70-L158 WeakPolarHBondContact CE1-O 3.26Å; Y70-L158 PolarHBondContact OH-O 3.03Å; Y151-L158 HydrophobicContact CD1-CD1 3.77Å; Y151-L158 HydrophobicContact CG-CD1 4.33Å; D154-L158 WeakPolarHBondContact O-CG 3.26Å; D154-L158 PolarHBondContact O-N 3.01Å; L155-L158 HydrophobicContact CD1-CB 4.43Å; L155-L158 PolarHBondContact O-N 3.1Å; L158-Y163 HydrophobicContact CB-CE1 4.46Å; L158-Y163 HydrophobicContact CD2-CE1 4.06Å; L158-Y163 HydrophobicContact CD2-CE2 4.08Å; L158-Y163 VanDerWaalsContact CD2-OH 3.31Å; L158-Y163 WeakPolarHBondContact CD2-OH 3.42Å; L158-Y163 WeakPolarHBondContact O-CD1 3.45Å
159	V	97.2	Very high	97.6	Very high	31 Å²	31	49 Å²	49	19%	0.188	29%	0.287	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103.8	6.1	-179.5	-54.6	0	0	0	0	113.7	M115 L155 R157	M115-V159 HydrophobicContact CB-CG1 4.35Å; M115-V159 HydrophobicContact CG-CG1 3.5Å; L155-V159 HydrophobicContact CD1-CG1 3.75Å; L155-V159 HydrophobicContact CG-CG1 4.42Å; L155-V159 WeakPolarHBondContact O-CG2 3.48Å; L155-V159 PolarHBondContact O-N 3.28Å; L155-V159 VanDerWaalsContact O-N 3.12Å; R157-V159 PolarHBondContact O-N 2.87Å
160	T	96.8	Very high	97.7	Very high	73 Å²	73	48.3 Å²	48.3	45%	0.448	28%	0.28	S	S	.	.	S	Bend	trans	-64.7	132.4	174.7	-66.7	0	0	0	0	109.6	E156 R157 G162 Y163	E156-T160 PolarHBondContact O-N 3.4Å; E156-T160 PolarHBondContact O-OG1 2.92Å; R157-T160 WeakPolarHBondContact O-CB 3.26Å; R157-T160 PolarHBondContact O-N 3.35Å; T160-G162 PolarHBondContact O-N 3.2Å; T160-Y163 VanDerWaalsContact O-CB 3.24Å; T160-Y163 WeakPolarHBondContact O-CB 3.39Å; T160-Y163 PolarHBondContact O-N 3.4Å
161	P	95.7	Very high	97.7	Very high	129 Å²	129	45.9 Å²	45.9	84%	0.838	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.5	129.8	177.2	-27.1	35.3	0	0	0	112
162	G	95.3	Very high	97.6	Very high	78 Å²	78	48.6 Å²	48.6	80%	0.804	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.7	15.9	-175.6	0	0	0	0	0	114.6	T160 V164	T160-G162 PolarHBondContact O-N 3.2Å; G162-V164 PolarHBondContact O-N 3.35Å
163	Y	97.5	Very high	97.6	Very high	21 Å²	21	48.8 Å²	48.8	8%	0.082	28%	0.282	C	S	.	.			trans	-52.9	128.9	171.1	168.6	-121.5	0	0	0	111.6	I66 L158 T160 P165 D169	I66-Y163 HydrophobicContact CG1-CD1 4.42Å; I66-Y163 HydrophobicContact CG1-CE1 4.45Å; L158-Y163 HydrophobicContact CB-CE1 4.46Å; L158-Y163 HydrophobicContact CD2-CE1 4.06Å; L158-Y163 HydrophobicContact CD2-CE2 4.08Å; L158-Y163 VanDerWaalsContact CD2-OH 3.31Å; L158-Y163 WeakPolarHBondContact CD2-OH 3.42Å; L158-Y163 WeakPolarHBondContact O-CD1 3.45Å; T160-Y163 VanDerWaalsContact O-CB 3.24Å; T160-Y163 WeakPolarHBondContact O-CB 3.39Å; T160-Y163 PolarHBondContact O-N 3.4Å; Y163-P165 HydrophobicContact CE1-CG 3.85Å; Y163-P165 WeakPolarHBondContact OH-CA 3.35Å; Y163-D169 WeakPolarHBondContact OH-CB 3.06Å; Y163-D169 PolarHBondContact OH-OD2 3.29Å
164	V	97.9	Very high	97.5	Very high	65 Å²	65	47.7 Å²	47.7	39%	0.394	27%	0.265	S	S	.	.			trans	-118.5	125.2	169.8	179.1	0	0	0	0	107.6	L59 C62 L63 G162 T166	L59-V164 HydrophobicContact CD1-CG1 3.7Å; L59-V164 HydrophobicContact CD1-CG2 3.91Å; C62-V164 HydrophobicContact CB-CG1 4.01Å; L63-V164 HydrophobicContact CD2-CG2 4.37Å; G162-V164 PolarHBondContact O-N 3.35Å; V164-T166 PolarHBondContact O-N 2.87Å
165	P	98.4	Very high	97.4	Very high	5 Å²	5	48.7 Å²	48.7	3%	0.032	27%	0.273	C	S	.	.			trans	-55.5	133.2	176.9	-32.2	40.8	0	0	0	113.3	C62 F65 I66 I69 Y163 D169 V170	C62-P165 WeakPolarHBondContact O-CD 3.46Å; C62-P165 WeakPolarHBondContact O-CG 3.26Å; F65-P165 HydrophobicContact CB-CB 4.43Å; F65-P165 HydrophobicContact CB-CG 4.32Å; I66-P165 HydrophobicContact CG1-CG 3.66Å; I69-P165 HydrophobicContact CD1-CB 3.77Å; I69-P165 HydrophobicContact CD1-CG 3.71Å; Y163-P165 HydrophobicContact CE1-CG 3.85Å; Y163-P165 WeakPolarHBondContact OH-CA 3.35Å; P165-D169 HydrophobicContact CB-CB 4.09Å; P165-V170 HydrophobicContact CB-CG2 4.22Å
166	T	98	Very high	97.2	Very high	61 Å²	61	53.7 Å²	53.7	37%	0.374	29%	0.294	S	S	.	.			trans	-77.7	163	170.3	64.7	0	0	0	0	110	V164 Q168 D169 V170	V164-T166 PolarHBondContact O-N 2.87Å; T166-Q168 PolarHBondContact O-N 2.82Å; T166-Q168 VanDerWaalsContact O-N 3.14Å; T166-Q168 PolarHBondContact OG1-N 3.3Å; T166-D169 PolarHBondContact N-OD2 3.19Å; T166-D169 WeakPolarHBondContact O-CB 3.22Å; T166-D169 PolarHBondContact O-N 3.5Å; T166-D169 PolarHBondContact OG1-N 3.01Å; T166-D169 VanDerWaalsContact OG1-N 3.16Å; T166-D169 PolarHBondContact OG1-OD2 3.23Å; T166-V170 WeakPolarHBondContact O-CG2 3.43Å; T166-V170 PolarHBondContact O-N 2.98Å
167	E	97.5	Very high	97.1	Very high	88 Å²	88	47.7 Å²	47.7	41%	0.411	27%	0.267	S	S	.	.	H	α-helix	trans	-54.3	-34.2	170.8	-67.1	-175.2	158.4	0	0	112	I51 V170 L171	I51-E167 HydrophobicContact CD1-CB 4.02Å; I51-E167 HydrophobicContact CD1-CG 4.23Å; I51-E167 HydrophobicContact CG1-CG 4.37Å; E167-V170 PolarHBondContact O-N 3.03Å; E167-L171 WeakPolarHBondContact O-CB 3.36Å; E167-L171 WeakPolarHBondContact O-CG 3.4Å; E167-L171 PolarHBondContact O-N 3.46Å
168	Q	97.9	Very high	96.9	Very high	56 Å²	56	48.9 Å²	48.9	26%	0.262	28%	0.283	S	S	.	.	H	α-helix	trans	-67.4	-39.4	177.2	-168	60.9	37.5	0	0	112.4	Y150 T166 V170 L171 R172 T323	Y150-Q168 HydrophobicContact CE2-CG 3.96Å; Y150-Q168 WeakPolarHBondContact OH-CG 3.48Å; T166-Q168 PolarHBondContact O-N 2.82Å; T166-Q168 VanDerWaalsContact O-N 3.14Å; T166-Q168 PolarHBondContact OG1-N 3.3Å; Q168-V170 VanDerWaalsContact C-N 3.33Å; Q168-L171 PolarHBondContact O-N 3.43Å; Q168-R172 WeakPolarHBondContact O-CB 3.41Å; Q168-R172 WeakPolarHBondContact O-CG 3.44Å; Q168-R172 PolarHBondContact O-N 2.97Å; Q168-T323 PolarHBondContact OE1-O 3.24Å
169	D	98.4	Very high	96.7	Very high	0 Å²	0	49.8 Å²	49.8	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-63.6	-42.5	173.5	-60.7	-51.1	0	0	0	110.4	I69 Y150 Y151 R157 Y163 P165 T166 R172 S173	I69-D169 HydrophobicContact CD1-CB 3.75Å; Y150-D169 WeakPolarHBondContact CE1-OD1 3.37Å; Y150-D169 PolarHBondContact OH-OD1 2.82Å; Y151-D169 HydrophobicContact CE1-CB 4.46Å; Y151-D169 PolarHBondContact OH-O 3.14Å; R157-D169 IonicContact CZ-OD1 2.79Å; R157-D169 IonicContact CZ-OD2 2.67Å; R157-D169 IonicContact NH1-OD1 3.74Å; R157-D169 PolarHBondContact NH1-OD1 2.97Å; R157-D169 IonicContact NH1-OD2 3.75Å; R157-D169 PolarHBondContact NH1-OD2 2.95Å; R157-D169 IonicContact NH2-OD1 3.67Å; R157-D169 PolarHBondContact NH2-OD1 3.49Å; R157-D169 IonicContact NH2-OD2 3.6Å; Y163-D169 WeakPolarHBondContact OH-CB 3.06Å; Y163-D169 PolarHBondContact OH-OD2 3.29Å; P165-D169 HydrophobicContact CB-CB 4.09Å; T166-D169 PolarHBondContact N-OD2 3.19Å; T166-D169 WeakPolarHBondContact O-CB 3.22Å; T166-D169 PolarHBondContact O-N 3.5Å; T166-D169 PolarHBondContact OG1-N 3.01Å; T166-D169 VanDerWaalsContact OG1-N 3.16Å; T166-D169 PolarHBondContact OG1-OD2 3.23Å; D169-R172 PolarHBondContact O-N 3.27Å; D169-S173 PolarHBondContact O-N 3.35Å; D169-S173 VanDerWaalsContact O-N 3.09Å
170	V	98.2	Very high	96.6	Very high	0 Å²	0	51.4 Å²	51.4	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-64.2	-46.2	177.8	174.4	0	0	0	0	111.2	K47 Y57 F65 P165 T166 E167 Q168 R172 S173	K47-V170 HydrophobicContact CD-CG1 4.37Å; K47-V170 PolarHBondContact NZ-O 3.29Å; Y57-V170 HydrophobicContact CD1-CG1 4.41Å; Y57-V170 HydrophobicContact CD2-CG1 4.09Å; Y57-V170 HydrophobicContact CE1-CG1 4.01Å; Y57-V170 HydrophobicContact CE2-CG1 3.67Å; Y57-V170 HydrophobicContact CG-CG1 4.46Å; F65-V170 HydrophobicContact CB-CG2 4.33Å; F65-V170 HydrophobicContact CD1-CG1 4.32Å; F65-V170 HydrophobicContact CD2-CB 4.41Å; F65-V170 HydrophobicContact CD2-CG1 3.99Å; F65-V170 HydrophobicContact CD2-CG2 3.66Å; F65-V170 HydrophobicContact CE1-CG1 3.97Å; F65-V170 HydrophobicContact CE2-CB 4.49Å; F65-V170 HydrophobicContact CE2-CG1 3.61Å; F65-V170 HydrophobicContact CE2-CG2 4.11Å; F65-V170 HydrophobicContact CG-CG1 4.35Å; F65-V170 HydrophobicContact CG-CG2 3.94Å; F65-V170 HydrophobicContact CZ-CG1 3.6Å; P165-V170 HydrophobicContact CB-CG2 4.22Å; T166-V170 WeakPolarHBondContact O-CG2 3.43Å; T166-V170 PolarHBondContact O-N 2.98Å; E167-V170 PolarHBondContact O-N 3.03Å; Q168-V170 VanDerWaalsContact C-N 3.33Å; V170-R172 VanDerWaalsContact C-N 3.33Å; V170-R172 PolarHBondContact O-N 2.75Å; V170-S173 PolarHBondContact O-N 3.37Å; V170-S173 PolarHBondContact O-OG 2.9Å
171	L	98.1	Very high	96.6	Very high	2 Å²	2	51.8 Å²	51.8	1%	0.01	30%	0.297	C	S	.	.	H	α-helix	trans	-63.8	-36.4	179.7	-75.7	170	0	0	0	112.8	T44 K47 Q48 I51 E167 Q168 S173 T323	T44-L171 HydrophobicContact CG2-CB 4.43Å; T44-L171 HydrophobicContact CG2-CD2 3.9Å; K47-L171 HydrophobicContact CB-CD2 3.88Å; Q48-L171 HydrophobicContact CG-CD2 3.65Å; I51-L171 HydrophobicContact CD1-CD1 3.87Å; I51-L171 HydrophobicContact CD1-CD2 3.9Å; I51-L171 HydrophobicContact CD1-CG 3.82Å; E167-L171 WeakPolarHBondContact O-CB 3.36Å; E167-L171 WeakPolarHBondContact O-CG 3.4Å; E167-L171 PolarHBondContact O-N 3.46Å; Q168-L171 PolarHBondContact O-N 3.43Å; L171-S173 VanDerWaalsContact C-N 3.34Å; L171-T323 HydrophobicContact CB-CG2 4.35Å
172	R	97.9	Very high	96.7	Very high	59 Å²	59	49.1 Å²	49.1	22%	0.223	27%	0.273	C	S	.	.	H	α-helix	trans	-82	-11.7	178.9	-73.6	-177.4	178.2	-79.4	-4.9	113.6	S147 Y150 Y151 Q168 D169 V170 T323	S147-R172 WeakPolarHBondContact CB-O 3.38Å; S147-R172 WeakPolarHBondContact OG-CB 3.17Å; S147-R172 PolarHBondContact OG-O 3.22Å; Y150-R172 HydrophobicContact CD1-CB 4.25Å; Y150-R172 HydrophobicContact CD1-CG 4.38Å; Y150-R172 HydrophobicContact CE1-CB 4.42Å; Y151-R172 HydrophobicContact CE2-CB 4.36Å; Y151-R172 PolarHBondContact OH-O 3.21Å; Q168-R172 WeakPolarHBondContact O-CB 3.41Å; Q168-R172 WeakPolarHBondContact O-CG 3.44Å; Q168-R172 PolarHBondContact O-N 2.97Å; D169-R172 PolarHBondContact O-N 3.27Å; V170-R172 VanDerWaalsContact C-N 3.33Å; V170-R172 PolarHBondContact O-N 2.75Å; R172-T323 HydrophobicContact CG-CG2 4.06Å
173	S	97.6	Very high	96.7	Very high	6 Å²	6	46.6 Å²	46.6	4%	0.042	24%	0.243	C	C	.	.			trans	-72.8	142.8	-179.9	70.1	0	0	0	0	111	K47 F65 Y151 D169 V170 L171	K47-S173 PolarHBondContact NZ-O 2.91Å; K47-S173 PolarHBondContact NZ-OG 2.75Å; F65-S173 WeakPolarHBondContact CD1-OG 3.42Å; Y151-S173 WeakPolarHBondContact OH-CA 3.42Å; Y151-S173 PolarHBondContact OH-N 2.83Å; D169-S173 PolarHBondContact O-N 3.35Å; D169-S173 VanDerWaalsContact O-N 3.09Å; V170-S173 PolarHBondContact O-N 3.37Å; V170-S173 PolarHBondContact O-OG 2.9Å; L171-S173 VanDerWaalsContact C-N 3.34Å
174	R	95.6	Very high	96.7	Very high	60 Å²	60	51.2 Å²	51.2	23%	0.226	27%	0.265	C	S	.	.			trans	-118.4	115.9	-172.8	179.4	71.6	-177.2	91.3	14.6	109.6	E39 N72 K176	E39-R174 IonicContact OE1-CZ 3.61Å; E39-R174 IonicContact OE1-NE 2.8Å; E39-R174 PolarHBondContact OE1-NE 2.69Å; E39-R174 IonicContact OE1-NH2 3.29Å; E39-R174 PolarHBondContact OE1-NH2 3.09Å; N72-R174 PolarHBondContact ND2-O 3.26Å; N72-R174 PolarHBondContact OD1-N 3.37Å; N72-R174 PolarHBondContact OD1-O 2.81Å; R174-K176 VanDerWaalsContact NH1-CA 3.33Å
175	V	95.4	Very high	96.6	Very high	77 Å²	77	48.7 Å²	48.7	47%	0.467	25%	0.248	S	C	.	.			trans	-124.6	128.7	166.9	-178	0	0	0	0	108.2	I68 T177	I68-V175 HydrophobicContact CD1-CG2 3.78Å; I68-V175 HydrophobicContact CG1-CG2 4.17Å; I68-V175 HydrophobicContact CG2-CG2 3.63Å; V175-T177 PolarHBondContact O-N 3.47Å
176	K	94.7	Very high	96.4	Very high	106 Å²	106	52 Å²	52	46%	0.461	27%	0.272	S	S	.	.			trans	-62.6	110.4	174.5	-177.9	177.4	176.4	-179.7	0	109.6	R174 T178	R174-K176 VanDerWaalsContact NH1-CA 3.33Å; K176-T178 PolarHBondContact O-N 3.42Å
177	T	95.1	Very high	96.2	Very high	16 Å²	16	51.2 Å²	51.2	10%	0.098	26%	0.264	C	S	.	.			trans	-63.4	123	173.3	-43.8	0	0	0	0	109.7	S43 V175 I181 G198	S43-T177 PolarHBondContact OG-OG1 2.89Å; V175-T177 PolarHBondContact O-N 3.47Å; T177-I181 HydrophobicContact CG2-CD1 3.88Å; T177-I181 HydrophobicContact CG2-CG1 4.38Å; T177-G198 WeakPolarHBondContact O-CA 3.38Å
178	T	94.1	Very high	95.9	Very high	94 Å²	94	50.8 Å²	50.8	58%	0.577	26%	0.26	S	S	*	.			trans	-115.6	139.4	172.6	62.2	0	0	0	0	108.8	K176 E203	K176-T178 PolarHBondContact O-N 3.42Å; T178-E203 WeakPolarHBondContact CA-OE2 3.48Å
179	G	93.7	Very high	95.5	Very high	18 Å²	18	54.8 Å²	54.8	19%	0.186	28%	0.283	C	S	.	.	S	Bend	trans	70.9	-144.1	-177.6	0	0	0	0	0	113.7	G198 E203	G179-G198 PolarHBondContact O-N 2.69Å; G179-E203 PolarHBondContact N-OE2 3.24Å
180	I	95.7	Very high	95.2	Very high	66 Å²	66	55.7 Å²	55.7	34%	0.338	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	125.7	-173.8	-61.5	155.7	0	0	0	107.1	F195 D196 V197 H209 C210	I180-F195 HydrophobicContact CG2-CD1 3.86Å; I180-D196 WeakPolarHBondContact CA-O 3.33Å; I180-V197 HydrophobicContact CB-CG1 4.4Å; I180-V197 HydrophobicContact CG1-CG1 3.89Å; I180-V197 HydrophobicContact CG2-CG1 4.28Å; I180-H209 HydrophobicContact CD1-CB 3.89Å; I180-C210 VanDerWaalsContact CD1-SG 3.54Å; I180-C210 WeakPolarHBondContact CG2-SG 3.43Å
181	I	96.1	Very high	95.1	Very high	81 Å²	81	58.4 Å²	58.4	42%	0.415	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	124.5	177.5	-57.9	178.4	0	0	0	107.7	T177 F195 D196	T177-I181 HydrophobicContact CG2-CD1 3.88Å; T177-I181 HydrophobicContact CG2-CG1 4.38Å; I181-F195 WeakPolarHBondContact O-CA 3.27Å; I181-D196 PolarHBondContact N-O 3.42Å; I181-D196 PolarHBondContact O-N 3.09Å
182	E	97	Very high	95	Very high	72 Å²	72	58.4 Å²	58.4	34%	0.336	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	132	174	-173.9	178.4	159.5	0	0	109.6	Q184 R193 M194 F195	E182-Q184 HydrophobicContact CG-CG 4.37Å; E182-Q184 PolarHBondContact OE1-NE2 2.85Å; E182-R193 IonicContact OE1-CZ 3.84Å; E182-R193 IonicContact OE1-NE 3.93Å; E182-R193 PolarHBondContact OE1-NE 3.29Å; E182-R193 IonicContact OE1-NH2 2.78Å; E182-R193 PolarHBondContact OE1-NH2 2.87Å; E182-R193 VanDerWaalsContact OE1-NH2 3.07Å; E182-R193 IonicContact OE2-CZ 3.34Å; E182-R193 IonicContact OE2-NH2 2.73Å; E182-R193 PolarHBondContact OE2-NH2 3.1Å; E182-M194 CarbonylContact C-O 3.56Å; E182-M194 WeakPolarHBondContact CA-O 3.48Å; E182-F195 HydrophobicContact CB-CD1 4.27Å; E182-F195 HydrophobicContact CB-CE1 4.02Å; E182-F195 HydrophobicContact CB-CZ 4.45Å; E182-F195 HydrophobicContact CG-CD1 4.41Å; E182-F195 HydrophobicContact CG-CE1 3.94Å; E182-F195 HydrophobicContact CG-CE2 4.26Å; E182-F195 HydrophobicContact CG-CZ 3.86Å; E182-F195 WeakPolarHBondContact OE2-CE1 3.31Å; E182-F195 VanDerWaalsContact OE2-CZ 3.3Å; E182-F195 WeakPolarHBondContact OE2-CZ 3.22Å
183	T	96.4	Very high	95	Very high	26 Å²	26	60 Å²	60	16%	0.16	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	131.8	172.7	-59.8	0	0	0	0	108.9	V46 M194	V46-T183 HydrophobicContact CG1-CG2 4.14Å; V46-T183 VanDerWaalsContact CG1-OG1 3.28Å; V46-T183 WeakPolarHBondContact CG1-OG1 3.45Å; T183-M194 PolarHBondContact N-O 2.9Å; T183-M194 PolarHBondContact O-N 2.82Å
184	Q	96.8	Very high	95	Very high	118 Å²	118	59.8 Å²	59.8	55%	0.551	31%	0.307	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-115.7	133.9	-177.2	-60.5	-177.3	6.8	0	0	110.7	Q54 E182 F192 R193	Q54-Q184 PolarHBondContact NE2-O 2.92Å; E182-Q184 HydrophobicContact CG-CG 4.37Å; E182-Q184 PolarHBondContact OE1-NE2 2.85Å; Q184-F192 VanDerWaalsContact CA-O 3.25Å; Q184-F192 WeakPolarHBondContact CA-O 3.3Å; Q184-R193 HydrophobicContact CG-CG 4.26Å
185	F	96.5	Very high	95.1	Very high	11 Å²	11	57.6 Å²	57.6	5%	0.048	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.8	162.4	176.5	59.5	-85.4	0	0	0	110.2	M49 H53 Q54 F192 M194 F332	M49-F185 HydrophobicContact CB-CD1 3.91Å; M49-F185 HydrophobicContact CB-CE1 3.7Å; M49-F185 HydrophobicContact CB-CG 4.42Å; M49-F185 HydrophobicContact CB-CZ 4.05Å; M49-F185 HydrophobicContact CG-CD1 4.31Å; M49-F185 HydrophobicContact CG-CE1 3.59Å; M49-F185 HydrophobicContact CG-CE2 4.37Å; M49-F185 HydrophobicContact CG-CZ 3.63Å; M49-F185 HydrophobicContact SD-CE1 4.07Å; M49-F185 HydrophobicContact SD-CE2 3.82Å; M49-F185 HydrophobicContact SD-CZ 3.44Å; M49-F185 WeakPolarHBondContact SD-CZ 3.42Å; H53-F185 HydrophobicContact CB-CB 4.18Å; H53-F185 HydrophobicContact CB-CD2 3.98Å; H53-F185 HydrophobicContact CB-CG 4.37Å; H53-F185 AromaticContact CD2-CD2 3.68Å; H53-F185 AromaticContact CD2-CE2 3.74Å; H53-F185 AromaticContact CG-CD2 3.95Å; Q54-F185 HydrophobicContact CG-CB 4.1Å; F185-F192 HydrophobicContact CD1-CB 4.17Å; F185-F192 HydrophobicContact CD2-CB 4.02Å; F185-F192 HydrophobicContact CD2-CD2 4.25Å; F185-F192 HydrophobicContact CD2-CG 4.38Å; F185-F192 HydrophobicContact CE1-CB 3.81Å; F185-F192 HydrophobicContact CE2-CB 3.66Å; F185-F192 AromaticContact CE2-CD2 3.83Å; F185-F192 HydrophobicContact CE2-CD2 3.83Å; F185-F192 AromaticContact CE2-CG 3.74Å; F185-F192 HydrophobicContact CE2-CG 3.74Å; F185-F192 HydrophobicContact CG-CB 4.26Å; F185-F192 HydrophobicContact CZ-CB 3.54Å; F185-F192 HydrophobicContact CZ-CD1 4.39Å; F185-F192 HydrophobicContact CZ-CD2 4.43Å; F185-F192 AromaticContact CZ-CG 3.88Å; F185-F192 HydrophobicContact CZ-CG 3.88Å; F185-F192 PolarHBondContact N-O 3.28Å; F185-F192 VanDerWaalsContact N-O 3.14Å; F185-F192 WeakPolarHBondContact O-CB 3.26Å; F185-F192 PolarHBondContact O-N 3.32Å; F185-M194 HydrophobicContact CE1-CB 4Å; F185-M194 HydrophobicContact CE1-CE 3.93Å; F185-M194 HydrophobicContact CE1-SD 4.39Å; F185-M194 HydrophobicContact CZ-CE 3.86Å; F185-F332 AromaticContact CE2-CE1 3.77Å; F185-F332 HydrophobicContact CE2-CE1 3.77Å; F185-F332 AromaticContact CE2-CZ 3.77Å; F185-F332 HydrophobicContact CE2-CZ 3.77Å; F185-F332 HydrophobicContact CZ-CE1 4.07Å; F185-F332 HydrophobicContact CZ-CE2 4.35Å; F185-F332 AromaticContact CZ-CZ 3.59Å; F185-F332 HydrophobicContact CZ-CZ 3.59Å
186	S	94.2	Very high	95.2	Very high	75 Å²	75	54 Å²	54	52%	0.524	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	138.5	179.1	-58.9	0	0	0	0	110.9	L190 N191	S186-L190 VanDerWaalsContact CA-O 3.27Å; S186-L190 WeakPolarHBondContact CA-O 3.43Å; S186-N191 PolarHBondContact OG-OD1 3.44Å
187	F	94.2	Very high	95.4	Very high	45 Å²	45	49 Å²	49	20%	0.197	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.8	135.3	177.6	178	-124.4	0	0	0	110.3	H53 D189 L190 F192 F332 D333 T336	H53-F187 AromaticContact CE1-CD2 3.27Å; H53-F187 WeakPolarHBondContact CE1-CD2 3.16Å; H53-F187 AromaticContact CE1-CE2 3.72Å; H53-F187 AromaticContact CE1-CG 3.49Å; H53-F187 VanDerWaalsContact CE1-CG 3.49Å; H53-F187 WeakPolarHBondContact CE1-CG 3.35Å; H53-F187 AromaticContact ND1-CD2 3.72Å; F187-D189 VanDerWaalsContact C-N 3.3Å; F187-D189 PolarHBondContact O-N 3.4Å; F187-L190 PolarHBondContact N-O 3.31Å; F187-L190 WeakPolarHBondContact O-CB 3.48Å; F187-L190 PolarHBondContact O-N 3.46Å; F187-F192 HydrophobicContact CB-CD2 4.1Å; F187-F192 HydrophobicContact CB-CE2 3.82Å; F187-F192 HydrophobicContact CD1-CE2 4.24Å; F187-F332 HydrophobicContact CD1-CD1 4.17Å; F187-F332 AromaticContact CD1-CE1 3.97Å; F187-F332 HydrophobicContact CD1-CE1 3.97Å; F187-F332 HydrophobicContact CE1-CD1 4.27Å; F187-F332 HydrophobicContact CE1-CE1 4.49Å; F187-D333 HydrophobicContact CZ-CB 4.47Å; F187-D333 VanDerWaalsContact CZ-OD1 3.29Å; F187-D333 WeakPolarHBondContact CZ-OD1 3.37Å; F187-T336 HydrophobicContact CD1-CG2 3.88Å; F187-T336 HydrophobicContact CE1-CG2 3.9Å; F187-T336 WeakPolarHBondContact CE1-OG1 3.32Å
188	K	91.1	Very high	95.4	Very high	79 Å²	79	48.2 Å²	48.2	34%	0.343	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	47.7	47.7	-177.8	-71.2	179.5	160.7	174.2	0	113.4	L190 D333 T336 D337 I340	K188-L190 PolarHBondContact O-N 2.93Å; K188-D333 WeakPolarHBondContact CE-OD1 3.49Å; K188-D333 IonicContact NZ-OD1 2.74Å; K188-D333 PolarHBondContact NZ-OD1 3.18Å; K188-D333 IonicContact NZ-OD2 3.03Å; K188-T336 HydrophobicContact CB-CG2 4.38Å; K188-T336 HydrophobicContact CD-CG2 3.85Å; K188-D337 IonicContact NZ-OD1 2.57Å; K188-D337 PolarHBondContact NZ-OD1 3.47Å; K188-D337 IonicContact NZ-OD2 2.92Å; K188-D337 PolarHBondContact NZ-OD2 2.91Å; K188-I340 HydrophobicContact CB-CD1 4.43Å; K188-I340 HydrophobicContact CD-CD1 4.31Å
189	D	88.3	Confident	95.5	Very high	139 Å²	139	43.9 Å²	43.9	74%	0.743	22%	0.224	S	C	*	.	T	Hydrogen-bonded Turn	trans	60.9	9.9	-177.7	-57.8	-44.9	0	0	0	116.2	F187	F187-D189 VanDerWaalsContact C-N 3.3Å; F187-D189 PolarHBondContact O-N 3.4Å
190	L	93.6	Very high	95.5	Very high	20 Å²	20	43.8 Å²	43.8	11%	0.105	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	147.9	173.7	-60.5	172.3	0	0	0	110.8	R28 V30 S186 F187 K188 F192 T336 I340	R28-L190 HydrophobicContact CB-CD2 4.48Å; R28-L190 WeakPolarHBondContact O-CA 3.38Å; V30-L190 HydrophobicContact CG2-CB 4.34Å; V30-L190 HydrophobicContact CG2-CD1 4.02Å; V30-L190 HydrophobicContact CG2-CD2 4.36Å; V30-L190 HydrophobicContact CG2-CG 4.49Å; S186-L190 VanDerWaalsContact CA-O 3.27Å; S186-L190 WeakPolarHBondContact CA-O 3.43Å; F187-L190 PolarHBondContact N-O 3.31Å; F187-L190 WeakPolarHBondContact O-CB 3.48Å; F187-L190 PolarHBondContact O-N 3.46Å; K188-L190 PolarHBondContact O-N 2.93Å; L190-F192 HydrophobicContact CB-CD2 4.25Å; L190-F192 HydrophobicContact CB-CE2 3.72Å; L190-F192 HydrophobicContact CB-CZ 4.27Å; L190-F192 HydrophobicContact CD1-CE2 4.29Å; L190-F192 HydrophobicContact CD1-CZ 4.09Å; L190-T336 HydrophobicContact CD1-CG2 4.25Å; L190-I340 HydrophobicContact CD1-CD1 4.03Å; L190-I340 HydrophobicContact CD1-CG1 3.68Å
191	N	94.3	Very high	95.5	Very high	57 Å²	57	45 Å²	45	31%	0.305	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	107.1	173.8	-63.6	-48.4	0	0	0	109.1	R28 T29 V30 S186	R28-N191 PolarHBondContact O-N 2.74Å; T29-N191 CarbonylContact C-O 3.55Å; T29-N191 VanDerWaalsContact CA-O 3.31Å; T29-N191 WeakPolarHBondContact CA-O 3.45Å; V30-N191 PolarHBondContact N-O 3.46Å; S186-N191 PolarHBondContact OG-OD1 3.44Å
192	F	97.1	Very high	95.5	Very high	1 Å²	1	44.8 Å²	44.8	0%	0.004	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	132.8	179.9	-72.2	-91.3	0	0	0	110.8	V30 L32 Q184 F185 F187 L190 F332 T336 I339	V30-F192 HydrophobicContact CB-CD1 3.81Å; V30-F192 HydrophobicContact CB-CE1 3.88Å; V30-F192 HydrophobicContact CB-CG 4.45Å; V30-F192 HydrophobicContact CG1-CD1 3.75Å; V30-F192 HydrophobicContact CG1-CE1 3.64Å; V30-F192 HydrophobicContact CG2-CE1 4.35Å; V30-F192 CarbonylContact O-C 3.59Å; V30-F192 WeakPolarHBondContact O-CA 3.4Å; L32-F192 HydrophobicContact CD1-CD1 3.49Å; L32-F192 VanDerWaalsContact CD1-CD1 3.49Å; L32-F192 HydrophobicContact CD1-CE1 3.89Å; L32-F192 HydrophobicContact CG-CD1 3.83Å; L32-F192 HydrophobicContact CG-CE1 4.28Å; Q184-F192 VanDerWaalsContact CA-O 3.25Å; Q184-F192 WeakPolarHBondContact CA-O 3.3Å; F185-F192 HydrophobicContact CD1-CB 4.17Å; F185-F192 HydrophobicContact CD2-CB 4.02Å; F185-F192 HydrophobicContact CD2-CD2 4.25Å; F185-F192 HydrophobicContact CD2-CG 4.38Å; F185-F192 HydrophobicContact CE1-CB 3.81Å; F185-F192 HydrophobicContact CE2-CB 3.66Å; F185-F192 AromaticContact CE2-CD2 3.83Å; F185-F192 HydrophobicContact CE2-CD2 3.83Å; F185-F192 AromaticContact CE2-CG 3.74Å; F185-F192 HydrophobicContact CE2-CG 3.74Å; F185-F192 HydrophobicContact CG-CB 4.26Å; F185-F192 HydrophobicContact CZ-CB 3.54Å; F185-F192 HydrophobicContact CZ-CD1 4.39Å; F185-F192 HydrophobicContact CZ-CD2 4.43Å; F185-F192 AromaticContact CZ-CG 3.88Å; F185-F192 HydrophobicContact CZ-CG 3.88Å; F185-F192 PolarHBondContact N-O 3.28Å; F185-F192 VanDerWaalsContact N-O 3.14Å; F185-F192 WeakPolarHBondContact O-CB 3.26Å; F185-F192 PolarHBondContact O-N 3.32Å; F187-F192 HydrophobicContact CB-CD2 4.1Å; F187-F192 HydrophobicContact CB-CE2 3.82Å; F187-F192 HydrophobicContact CD1-CE2 4.24Å; L190-F192 HydrophobicContact CB-CD2 4.25Å; L190-F192 HydrophobicContact CB-CE2 3.72Å; L190-F192 HydrophobicContact CB-CZ 4.27Å; L190-F192 HydrophobicContact CD1-CE2 4.29Å; L190-F192 HydrophobicContact CD1-CZ 4.09Å; F192-F332 HydrophobicContact CD1-CZ 4.09Å; F192-F332 HydrophobicContact CE1-CE1 4.43Å; F192-F332 AromaticContact CE1-CZ 3.98Å; F192-F332 HydrophobicContact CE1-CZ 3.98Å; F192-F332 HydrophobicContact CZ-CE1 4.35Å; F192-F332 HydrophobicContact CZ-CZ 4.34Å; F192-T336 HydrophobicContact CE2-CG2 4.5Å; F192-T336 HydrophobicContact CZ-CG2 3.9Å; F192-I339 HydrophobicContact CE1-CD1 4.48Å
193	R	97.3	Very high	95.4	Very high	94 Å²	94	42.2 Å²	42.2	36%	0.355	21%	0.213	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	99.4	166.3	-60.8	178.2	63.6	-164.5	0.3	107.7	T29 V30 K31 L32 E182 Q184 F195	T29-R193 HydrophobicContact CG2-CG 4.04Å; V30-R193 PolarHBondContact O-N 3.36Å; K31-R193 WeakPolarHBondContact CA-O 3.44Å; L32-R193 PolarHBondContact N-O 3.07Å; E182-R193 IonicContact OE1-CZ 3.84Å; E182-R193 IonicContact OE1-NE 3.93Å; E182-R193 PolarHBondContact OE1-NE 3.29Å; E182-R193 IonicContact OE1-NH2 2.78Å; E182-R193 PolarHBondContact OE1-NH2 2.87Å; E182-R193 VanDerWaalsContact OE1-NH2 3.07Å; E182-R193 IonicContact OE2-CZ 3.34Å; E182-R193 IonicContact OE2-NH2 2.73Å; E182-R193 PolarHBondContact OE2-NH2 3.1Å; Q184-R193 HydrophobicContact CG-CG 4.26Å; R193-F195 HydrophobicContact CB-CE2 3.84Å; R193-F195 WeakPolarHBondContact O-CD2 3.32Å
194	M	97.9	Very high	95.4	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	124.3	-178.1	-176.8	175.9	-73.9	0	0	110.4	L32 L34 V46 M49 E182 T183 F185 F332	L32-M194 HydrophobicContact CB-CB 4.42Å; L32-M194 HydrophobicContact CB-CG 4.43Å; L32-M194 HydrophobicContact CD1-CE 3.72Å; L32-M194 CarbonylContact O-C 3.58Å; L32-M194 WeakPolarHBondContact O-CA 3.04Å; L34-M194 HydrophobicContact CD1-CG 4.05Å; L34-M194 HydrophobicContact CD1-SD 3.79Å; L34-M194 HydrophobicContact CD2-CE 4.43Å; L34-M194 HydrophobicContact CD2-CG 4.28Å; L34-M194 HydrophobicContact CD2-SD 4.28Å; L34-M194 HydrophobicContact CG-CG 3.94Å; L34-M194 HydrophobicContact CG-SD 4.19Å; V46-M194 HydrophobicContact CG2-CG 4.43Å; V46-M194 HydrophobicContact CG2-SD 3.92Å; M49-M194 HydrophobicContact CG-CE 3.55Å; M49-M194 HydrophobicContact CG-SD 3.76Å; M49-M194 HydrophobicContact SD-CE 3.93Å; E182-M194 CarbonylContact C-O 3.56Å; E182-M194 WeakPolarHBondContact CA-O 3.48Å; T183-M194 PolarHBondContact N-O 2.9Å; T183-M194 PolarHBondContact O-N 2.82Å; F185-M194 HydrophobicContact CE1-CB 4Å; F185-M194 HydrophobicContact CE1-CE 3.93Å; F185-M194 HydrophobicContact CE1-SD 4.39Å; F185-M194 HydrophobicContact CZ-CE 3.86Å; M194-F332 HydrophobicContact CE-CE2 3.81Å; M194-F332 HydrophobicContact CE-CZ 4.34Å
195	F	98	Very high	95.3	Very high	14 Å²	14	46.6 Å²	46.6	6%	0.061	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	113.3	179.6	-68.9	-96.3	0	0	0	109.7	K31 L32 L33 L34 I180 I181 E182 R193	K31-F195 HydrophobicContact CD-CD2 4.35Å; K31-F195 HydrophobicContact CD-CE2 3.94Å; K31-F195 HydrophobicContact CG-CD2 3.87Å; K31-F195 HydrophobicContact CG-CE2 3.7Å; L32-F195 PolarHBondContact O-N 2.81Å; L33-F195 HydrophobicContact CD1-CB 3.81Å; L34-F195 PolarHBondContact N-O 2.87Å; I180-F195 HydrophobicContact CG2-CD1 3.86Å; I181-F195 WeakPolarHBondContact O-CA 3.27Å; E182-F195 HydrophobicContact CB-CD1 4.27Å; E182-F195 HydrophobicContact CB-CE1 4.02Å; E182-F195 HydrophobicContact CB-CZ 4.45Å; E182-F195 HydrophobicContact CG-CD1 4.41Å; E182-F195 HydrophobicContact CG-CE1 3.94Å; E182-F195 HydrophobicContact CG-CE2 4.26Å; E182-F195 HydrophobicContact CG-CZ 3.86Å; E182-F195 WeakPolarHBondContact OE2-CE1 3.31Å; E182-F195 VanDerWaalsContact OE2-CZ 3.3Å; E182-F195 WeakPolarHBondContact OE2-CZ 3.22Å; R193-F195 HydrophobicContact CB-CE2 3.84Å; R193-F195 WeakPolarHBondContact O-CD2 3.32Å
196	D	97.8	Very high	95.2	Very high	3 Å²	3	49.9 Å²	49.9	2%	0.016	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	135	169.6	-178.6	32.8	0	0	0	110.2	L34 K42 S43 V46 I180 I181	L34-D196 HydrophobicContact CD1-CB 4.41Å; K42-D196 WeakPolarHBondContact CB-OD1 3.47Å; S43-D196 WeakPolarHBondContact CA-OD2 3.46Å; S43-D196 VanDerWaalsContact CB-OD2 3.31Å; S43-D196 WeakPolarHBondContact CB-OD2 3.43Å; S43-D196 PolarHBondContact OG-OD2 3.31Å; V46-D196 HydrophobicContact CG2-CB 3.6Å; I180-D196 WeakPolarHBondContact CA-O 3.33Å; I181-D196 PolarHBondContact N-O 3.42Å; I181-D196 PolarHBondContact O-N 3.09Å
197	V	97.6	Very high	95.3	Very high	0 Å²	0	46.8 Å²	46.8	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	148	-174.7	-60.6	0	0	0	0	110.6	L33 L34 L35 K42 I180 G199 W207	L33-V197 HydrophobicContact CD1-CG1 4.37Å; L34-V197 WeakPolarHBondContact O-CG2 3.24Å; L35-V197 HydrophobicContact CD2-CG2 3.77Å; K42-V197 WeakPolarHBondContact CE-O 3.05Å; I180-V197 HydrophobicContact CB-CG1 4.4Å; I180-V197 HydrophobicContact CG1-CG1 3.89Å; I180-V197 HydrophobicContact CG2-CG1 4.28Å; V197-G199 PolarHBondContact O-N 3.39Å; V197-W207 VanDerWaalsContact CG2-CD1 3.49Å; V197-W207 HydrophobicContact CG2-CD2 4.21Å; V197-W207 HydrophobicContact CG2-CG 4.08Å; V197-W207 HydrophobicContact CG2-CZ2 4.31Å
198	G	96.3	Very high	95.2	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	23%	0.228	C	C	.	.			trans	-54.3	126.9	174.2	0	0	0	0	0	112	T177 G179 E203 W207	T177-G198 WeakPolarHBondContact O-CA 3.38Å; G179-G198 PolarHBondContact O-N 2.69Å; G198-E203 WeakPolarHBondContact O-CB 3.33Å; G198-W207 PolarHBondContact O-NE1 3.39Å
199	G	94.9	Very high	95.4	Very high	2 Å²	2	51.8 Å²	51.8	2%	0.021	24%	0.244	C	C	.	.			trans	-87.5	-20.3	-175.2	0	0	0	0	0	115.2	G36 G38 V197 R204	G36-G199 WeakPolarHBondContact O-CA 3.47Å; G38-G199 PolarHBondContact N-O 3.33Å; V197-G199 PolarHBondContact O-N 3.39Å; G199-R204 PolarHBondContact O-NE 3.27Å; G199-R204 VanDerWaalsContact O-NE 3.09Å
200	Q	95.4	Very high	95.7	Very high	17 Å²	17	45.3 Å²	45.3	8%	0.079	21%	0.21	C	C	.	.	S	Bend	trans	-65.5	152.3	-178.7	-66.9	80.9	10.5	0	0	111	S202 E203 R204 E232	Q200-S202 PolarHBondContact O-N 3.27Å; Q200-S202 VanDerWaalsContact O-N 3.11Å; Q200-E203 PolarHBondContact O-N 2.78Å; Q200-R204 WeakPolarHBondContact O-CG 3.5Å; Q200-R204 PolarHBondContact O-N 2.76Å; Q200-E232 WeakPolarHBondContact CA-OE1 3.42Å; Q200-E232 VanDerWaalsContact CB-OE1 3.31Å; Q200-E232 WeakPolarHBondContact CB-OE1 3.41Å
201	R	95.5	Very high	95.7	Very high	92 Å²	92	45 Å²	45	35%	0.347	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.6	-38.6	-176.1	-74.5	-177.8	170.5	174.5	-1.6	112.9	E203 R204 E232 D233 E241	R201-E203 VanDerWaalsContact C-N 3.28Å; R201-E203 PolarHBondContact O-N 2.69Å; R201-R204 PolarHBondContact O-N 3.5Å; R201-E232 PolarHBondContact N-OE1 3.06Å; R201-D233 IonicContact CZ-OD2 3.5Å; R201-D233 IonicContact NH1-OD2 3.63Å; R201-D233 PolarHBondContact NH1-OD2 3.31Å; R201-D233 IonicContact NH2-OD2 3.81Å; R201-E241 IonicContact CZ-OE2 2.66Å; R201-E241 IonicContact NE-OE1 2.72Å; R201-E241 PolarHBondContact NE-OE1 3.42Å; R201-E241 IonicContact NE-OE2 3.12Å; R201-E241 IonicContact NH2-OE1 2.7Å; R201-E241 IonicContact NH2-OE2 3.48Å; R201-E241 PolarHBondContact NH2-OE2 3.11Å
202	S	94.8	Very high	95.6	Very high	76 Å²	76	50.3 Å²	50.3	53%	0.531	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.2	-24.3	178.9	55.4	0	0	0	0	114.6	Q200	Q200-S202 PolarHBondContact O-N 3.27Å; Q200-S202 VanDerWaalsContact O-N 3.11Å
203	E	96.3	Very high	95.3	Very high	18 Å²	18	53.2 Å²	53.2	8%	0.084	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.3	-20.2	-176.8	-62.9	-60.2	103.2	0	0	112.8	T178 G179 G198 Q200 R201 K205 K206	T178-E203 WeakPolarHBondContact CA-OE2 3.48Å; G179-E203 PolarHBondContact N-OE2 3.24Å; G198-E203 WeakPolarHBondContact O-CB 3.33Å; Q200-E203 PolarHBondContact O-N 2.78Å; R201-E203 VanDerWaalsContact C-N 3.28Å; R201-E203 PolarHBondContact O-N 2.69Å; E203-K205 VanDerWaalsContact C-N 3.27Å; E203-K205 PolarHBondContact O-N 2.61Å; E203-K206 VanDerWaalsContact CD-NZ 3.26Å; E203-K206 VanDerWaalsContact O-CB 3.31Å; E203-K206 WeakPolarHBondContact O-CB 3.42Å; E203-K206 PolarHBondContact O-N 2.87Å; E203-K206 IonicContact OE1-NZ 2.97Å; E203-K206 PolarHBondContact OE1-NZ 3.27Å; E203-K206 IonicContact OE2-NZ 3.07Å; E203-K206 PolarHBondContact OE2-NZ 3.28Å
204	R	95.3	Very high	95.2	Very high	49 Å²	49	49.3 Å²	49.3	19%	0.185	25%	0.248	C	C	.	.	G	3₁₀ helix	trans	-64.5	-26.3	-170.5	-55.6	-165.2	-169.7	152.9	5.7	115	G199 Q200 R201 K206 W207 E241	G199-R204 PolarHBondContact O-NE 3.27Å; G199-R204 VanDerWaalsContact O-NE 3.09Å; Q200-R204 WeakPolarHBondContact O-CG 3.5Å; Q200-R204 PolarHBondContact O-N 2.76Å; R201-R204 PolarHBondContact O-N 3.5Å; R204-K206 PolarHBondContact O-N 3.21Å; R204-K206 VanDerWaalsContact O-N 3.17Å; R204-W207 HydrophobicContact CB-CD2 4.16Å; R204-W207 HydrophobicContact CB-CZ2 4.33Å; R204-W207 HydrophobicContact CG-CD2 4.4Å; R204-W207 HydrophobicContact CG-CH2 4.08Å; R204-W207 HydrophobicContact CG-CZ2 3.68Å; R204-W207 VanDerWaalsContact O-CB 3.32Å; R204-W207 WeakPolarHBondContact O-CB 3.22Å; R204-W207 VanDerWaalsContact O-CG 3.28Å; R204-W207 PolarHBondContact O-N 3.19Å; R204-W207 VanDerWaalsContact O-N 3.09Å; R204-E241 IonicContact CZ-OE1 3.69Å; R204-E241 IonicContact NH1-OE1 3.47Å; R204-E241 PolarHBondContact NH1-OE1 3.39Å; R204-E241 IonicContact NH2-OE1 2.61Å; R204-E241 PolarHBondContact NH2-OE1 2.91Å
205	K	94.3	Very high	95	Very high	187 Å²	187	50.9 Å²	50.9	81%	0.813	26%	0.257	S	S	*	.	G	3₁₀ helix	trans	-59.5	-26.3	174.3	-67.7	-177	-178.9	177.9	0	112.1	E203 W207 I208	E203-K205 VanDerWaalsContact C-N 3.27Å; E203-K205 PolarHBondContact O-N 2.61Å; K205-W207 VanDerWaalsContact C-N 3.32Å; K205-I208 WeakPolarHBondContact O-CG2 3.32Å
206	K	95.7	Very high	94.9	Very high	79 Å²	79	50.2 Å²	50.2	34%	0.343	26%	0.255	S	S	.	.	G	3₁₀ helix	trans	-77.5	-17	-179.6	-55.8	174.5	-173.7	167.7	0	112.6	E203 R204 I208 H209	E203-K206 VanDerWaalsContact CD-NZ 3.26Å; E203-K206 VanDerWaalsContact O-CB 3.31Å; E203-K206 WeakPolarHBondContact O-CB 3.42Å; E203-K206 PolarHBondContact O-N 2.87Å; E203-K206 IonicContact OE1-NZ 2.97Å; E203-K206 PolarHBondContact OE1-NZ 3.27Å; E203-K206 IonicContact OE2-NZ 3.07Å; E203-K206 PolarHBondContact OE2-NZ 3.28Å; R204-K206 PolarHBondContact O-N 3.21Å; R204-K206 VanDerWaalsContact O-N 3.17Å; K206-I208 PolarHBondContact O-N 2.98Å; K206-H209 WeakPolarHBondContact O-CB 3.41Å; K206-H209 PolarHBondContact O-CD2 3.33Å; K206-H209 PolarHBondContact O-N 3.1Å; K206-H209 VanDerWaalsContact O-N 3.17Å
207	W	96	Very high	94.9	Very high	10 Å²	10	50.1 Å²	50.1	4%	0.038	25%	0.254	C	S	.	.	G	3₁₀ helix	trans	-61.8	-32.4	-174.1	-65.9	2.5	0	0	0	113.4	L35 V197 G198 R204 K205 H209 C210 F211 L245 I249	L35-W207 HydrophobicContact CD2-CD2 3.82Å; L35-W207 HydrophobicContact CD2-CE3 3.69Å; L35-W207 HydrophobicContact CD2-CG 4.33Å; L35-W207 HydrophobicContact CD2-CH2 4.36Å; L35-W207 HydrophobicContact CD2-CZ2 4.5Å; L35-W207 HydrophobicContact CD2-CZ3 3.97Å; V197-W207 VanDerWaalsContact CG2-CD1 3.49Å; V197-W207 HydrophobicContact CG2-CD2 4.21Å; V197-W207 HydrophobicContact CG2-CG 4.08Å; V197-W207 HydrophobicContact CG2-CZ2 4.31Å; G198-W207 PolarHBondContact O-NE1 3.39Å; R204-W207 HydrophobicContact CB-CD2 4.16Å; R204-W207 HydrophobicContact CB-CZ2 4.33Å; R204-W207 HydrophobicContact CG-CD2 4.4Å; R204-W207 HydrophobicContact CG-CH2 4.08Å; R204-W207 HydrophobicContact CG-CZ2 3.68Å; R204-W207 VanDerWaalsContact O-CB 3.32Å; R204-W207 WeakPolarHBondContact O-CB 3.22Å; R204-W207 VanDerWaalsContact O-CG 3.28Å; R204-W207 PolarHBondContact O-N 3.19Å; R204-W207 VanDerWaalsContact O-N 3.09Å; K205-W207 VanDerWaalsContact C-N 3.32Å; W207-H209 PolarHBondContact O-N 2.95Å; W207-C210 PolarHBondContact O-N 3.3Å; W207-F211 HydrophobicContact CB-CE1 3.78Å; W207-F211 HydrophobicContact CB-CZ 4.14Å; W207-F211 WeakPolarHBondContact O-CD1 3.42Å; W207-F211 VanDerWaalsContact O-CE1 3.26Å; W207-F211 WeakPolarHBondContact O-CE1 3.38Å; W207-L245 HydrophobicContact CH2-CD1 3.79Å; W207-L245 HydrophobicContact CH2-CD2 3.75Å; W207-L245 HydrophobicContact CH2-CG 4.21Å; W207-L245 HydrophobicContact CZ3-CD1 3.63Å; W207-L245 HydrophobicContact CZ3-CD2 4.34Å; W207-L245 HydrophobicContact CZ3-CG 4.31Å; W207-I249 HydrophobicContact CE3-CD1 4.23Å; W207-I249 HydrophobicContact CZ3-CD1 4.1Å; W207-I249 HydrophobicContact CZ3-CG1 4.44Å
208	I	92.8	Very high	94.9	Very high	80 Å²	80	50.1 Å²	50.1	41%	0.41	25%	0.254	S	S	.	.	G	3₁₀ helix	trans	-55.7	-27.7	179.3	-168.5	59.6	0	0	0	112.6	K205 K206 C210 F211 Y254	K205-I208 WeakPolarHBondContact O-CG2 3.32Å; K206-I208 PolarHBondContact O-N 2.98Å; I208-C210 PolarHBondContact O-N 2.98Å; I208-F211 HydrophobicContact CD1-CB 4.37Å; I208-F211 HydrophobicContact CD1-CD2 3.6Å; I208-F211 HydrophobicContact CD1-CE2 4.17Å; I208-F211 HydrophobicContact CD1-CG 4.14Å; I208-F211 PolarHBondContact O-N 3.42Å; I208-Y254 HydrophobicContact CD1-CE2 4.31Å
209	H	93.4	Very high	95	Very high	149 Å²	149	50.1 Å²	50.1	69%	0.69	25%	0.254	S	S	*	.	G	3₁₀ helix	trans	-68.8	-9.5	177.6	-58.2	-60.1	0	0	0	113.7	I180 K206 W207	I180-H209 HydrophobicContact CD1-CB 3.89Å; K206-H209 WeakPolarHBondContact O-CB 3.41Å; K206-H209 PolarHBondContact O-CD2 3.33Å; K206-H209 PolarHBondContact O-N 3.1Å; K206-H209 VanDerWaalsContact O-N 3.17Å; W207-H209 PolarHBondContact O-N 2.95Å
210	C	95	Very high	95.2	Very high	3 Å²	3	50 Å²	50	2%	0.02	25%	0.253	C	S	.	.	G	3₁₀ helix	trans	-109.7	-3.2	178.4	-59.6	0	0	0	0	113.9	K31 L33 I180 W207 I208 E212 V214	K31-C210 WeakPolarHBondContact CE-O 3.38Å; K31-C210 PolarHBondContact NZ-O 3.19Å; L33-C210 HydrophobicContact CD1-CB 3.7Å; L33-C210 HydrophobicContact CD2-CB 4.39Å; I180-C210 VanDerWaalsContact CD1-SG 3.54Å; I180-C210 WeakPolarHBondContact CG2-SG 3.43Å; W207-C210 PolarHBondContact O-N 3.3Å; I208-C210 PolarHBondContact O-N 2.98Å; C210-E212 PolarHBondContact O-N 3.39Å; C210-V214 WeakPolarHBondContact O-CG2 3.28Å
211	F	94.2	Very high	95.4	Very high	15 Å²	15	49.2 Å²	49.2	7%	0.066	25%	0.249	C	C	.	.			trans	-76.6	-18.3	-166.4	-78.1	15.7	0	0	0	114.6	L33 W207 I208 I249 H252 Y254 F255	L33-F211 HydrophobicContact CD2-CD1 3.86Å; L33-F211 HydrophobicContact CD2-CE1 4Å; W207-F211 HydrophobicContact CB-CE1 3.78Å; W207-F211 HydrophobicContact CB-CZ 4.14Å; W207-F211 WeakPolarHBondContact O-CD1 3.42Å; W207-F211 VanDerWaalsContact O-CE1 3.26Å; W207-F211 WeakPolarHBondContact O-CE1 3.38Å; I208-F211 HydrophobicContact CD1-CB 4.37Å; I208-F211 HydrophobicContact CD1-CD2 3.6Å; I208-F211 HydrophobicContact CD1-CE2 4.17Å; I208-F211 HydrophobicContact CD1-CG 4.14Å; I208-F211 PolarHBondContact O-N 3.42Å; F211-I249 HydrophobicContact CZ-CD1 4.32Å; F211-H252 AromaticContact CD2-CE1 3.8Å; F211-H252 AromaticContact CE2-CE1 3.61Å; F211-H252 AromaticContact CE2-ND1 3.82Å; F211-Y254 HydrophobicContact CB-CD1 4.48Å; F211-Y254 HydrophobicContact CD2-CG 4.42Å; F211-F255 HydrophobicContact CB-CE1 4.11Å; F211-F255 HydrophobicContact CB-CZ 4.17Å; F211-F255 HydrophobicContact CD1-CE1 4.09Å; F211-F255 HydrophobicContact CD1-CE2 4.26Å; F211-F255 AromaticContact CD1-CZ 3.36Å; F211-F255 HydrophobicContact CD1-CZ 3.36Å; F211-F255 HydrophobicContact CD2-CE1 4.2Å; F211-F255 HydrophobicContact CD2-CE2 4.01Å; F211-F255 AromaticContact CD2-CZ 3.59Å; F211-F255 HydrophobicContact CD2-CZ 3.59Å; F211-F255 AromaticContact CE1-CE2 3.93Å; F211-F255 HydrophobicContact CE1-CE2 3.93Å; F211-F255 AromaticContact CE1-CZ 3.44Å; F211-F255 HydrophobicContact CE1-CZ 3.44Å; F211-F255 VanDerWaalsContact CE1-CZ 3.44Å; F211-F255 AromaticContact CE2-CE2 3.69Å; F211-F255 HydrophobicContact CE2-CE2 3.69Å; F211-F255 AromaticContact CE2-CZ 3.68Å; F211-F255 HydrophobicContact CE2-CZ 3.68Å; F211-F255 AromaticContact CG-CE1 3.89Å; F211-F255 HydrophobicContact CG-CE1 3.89Å; F211-F255 HydrophobicContact CG-CE2 4.29Å; F211-F255 AromaticContact CG-CZ 3.43Å; F211-F255 HydrophobicContact CG-CZ 3.43Å; F211-F255 VanDerWaalsContact CG-CZ 3.43Å; F211-F255 AromaticContact CZ-CE2 3.63Å; F211-F255 HydrophobicContact CZ-CE2 3.63Å; F211-F255 AromaticContact CZ-CZ 3.6Å; F211-F255 HydrophobicContact CZ-CZ 3.6Å
212	E	92.5	Very high	95.5	Very high	167 Å²	167	45.3 Å²	45.3	78%	0.78	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74.5	137.5	178.5	-173.7	172.8	-164.3	0	0	111.9	K31 C210 V214	K31-E212 PolarHBondContact NZ-O 2.92Å; C210-E212 PolarHBondContact O-N 3.39Å; E212-V214 VanDerWaalsContact C-N 3.26Å; E212-V214 PolarHBondContact O-N 3.14Å
213	G	91.4	Very high	95.7	Very high	62 Å²	62	41.7 Å²	41.7	64%	0.639	21%	0.212	S	C	*	.	T	Hydrogen-bonded Turn	trans	62.7	25.7	172.2	0	0	0	0	0	115.1	K31 T215	K31-G213 WeakPolarHBondContact CB-O 3.32Å; K31-G213 WeakPolarHBondContact CD-O 3.48Å; G213-T215 PolarHBondContact O-N 2.83Å
214	V	95.2	Very high	95.7	Very high	13 Å²	13	40.9 Å²	40.9	8%	0.079	21%	0.208	C	C	.	.			trans	-74	122.4	177.1	-179.9	0	0	0	0	109.6	K31 L33 C210 E212 C216 I217 F255 T258	K31-V214 HydrophobicContact CD-CG2 4.31Å; L33-V214 HydrophobicContact CB-CG1 3.8Å; L33-V214 HydrophobicContact CB-CG2 4.18Å; L33-V214 HydrophobicContact CD2-CG2 4.02Å; C210-V214 WeakPolarHBondContact O-CG2 3.28Å; E212-V214 VanDerWaalsContact C-N 3.26Å; E212-V214 PolarHBondContact O-N 3.14Å; V214-C216 WeakPolarHBondContact CG1-O 3.4Å; V214-I217 HydrophobicContact CG1-CG1 3.88Å; V214-F255 HydrophobicContact CG2-CE1 4.34Å; V214-T258 HydrophobicContact CB-CG2 4.16Å; V214-T258 HydrophobicContact CG1-CG2 3.77Å; V214-T258 WeakPolarHBondContact O-CG2 3.23Å
215	T	93.6	Very high	95.9	Very high	32 Å²	32	39 Å²	39	20%	0.196	20%	0.203	C	C	.	.	S	Bend	trans	-76.2	-48.6	175.4	-46	0	0	0	0	110.6	V30 K31 G213 I339	V30-T215 HydrophobicContact CG1-CG2 4Å; K31-T215 PolarHBondContact N-OG1 3.29Å; K31-T215 WeakPolarHBondContact O-CB 3.24Å; K31-T215 PolarHBondContact O-N 2.76Å; G213-T215 PolarHBondContact O-N 2.83Å; T215-I339 HydrophobicContact CG2-CG2 3.99Å
216	C	95.4	Very high	96	Very high	1 Å²	1	30.1 Å²	30.1	1%	0.007	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	140.4	-179.4	178.1	0	0	0	0	111.4	K31 L32 L33 V214 S259 I339	K31-C216 PolarHBondContact O-N 3.02Å; L32-C216 WeakPolarHBondContact CA-O 3.42Å; L32-C216 HydrophobicContact CD2-CB 3.72Å; L33-C216 PolarHBondContact N-O 3.49Å; V214-C216 WeakPolarHBondContact CG1-O 3.4Å; C216-S259 WeakPolarHBondContact CA-O 3.28Å; C216-I339 HydrophobicContact CB-CD1 3.78Å; C216-I339 HydrophobicContact CB-CG1 3.95Å
217	I	97.2	Very high	96.1	Very high	0 Å²	0	27.4 Å²	27.4	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	128.3	170.8	-63.5	170	0	0	0	108.7	L33 L35 V214 I249 F255 T258 S259 I260 V261	L33-I217 HydrophobicContact CB-CG1 4.45Å; L33-I217 WeakPolarHBondContact O-CA 3.46Å; L35-I217 HydrophobicContact CB-CG2 4.38Å; L35-I217 HydrophobicContact CD1-CD1 4.46Å; L35-I217 HydrophobicContact CD1-CG2 3.92Å; L35-I217 HydrophobicContact CG-CG2 4.24Å; V214-I217 HydrophobicContact CG1-CG1 3.88Å; I217-I249 HydrophobicContact CD1-CG2 4.17Å; I217-I249 HydrophobicContact CG2-CG2 4.36Å; I217-F255 HydrophobicContact CD1-CB 3.96Å; I217-F255 HydrophobicContact CD1-CD1 3.53Å; I217-F255 HydrophobicContact CD1-CD2 3.43Å; I217-F255 VanDerWaalsContact CD1-CD2 3.43Å; I217-F255 HydrophobicContact CD1-CE1 3.7Å; I217-F255 HydrophobicContact CD1-CE2 3.61Å; I217-F255 HydrophobicContact CD1-CG 3.37Å; I217-F255 HydrophobicContact CD1-CZ 3.7Å; I217-F255 HydrophobicContact CG1-CE1 4.49Å; I217-T258 HydrophobicContact CD1-CG2 4.11Å; I217-T258 HydrophobicContact CG1-CG2 3.91Å; I217-S259 PolarHBondContact N-O 3.37Å; I217-I260 HydrophobicContact CB-CG1 4.28Å; I217-I260 HydrophobicContact CD1-CD1 4.44Å; I217-I260 HydrophobicContact CD1-CG1 4.4Å; I217-I260 WeakPolarHBondContact O-CA 3.11Å; I217-V261 PolarHBondContact O-N 3.31Å
218	I	98.1	Very high	96.2	Very high	0 Å²	0	27.4 Å²	27.4	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	104.2	165.6	-59.8	171.8	0	0	0	106.7	L32 L33 L34 L35 I220 V261 F263 F332 V335	L32-I218 HydrophobicContact CD1-CD1 4.24Å; L33-I218 PolarHBondContact O-N 2.99Å; L34-I218 WeakPolarHBondContact CA-O 3.31Å; L34-I218 HydrophobicContact CD2-CB 3.7Å; L34-I218 HydrophobicContact CD2-CD1 4Å; L34-I218 HydrophobicContact CD2-CG1 4.32Å; L34-I218 HydrophobicContact CD2-CG2 4.18Å; L35-I218 PolarHBondContact N-O 2.86Å; I218-I220 HydrophobicContact CG2-CD1 4.32Å; I218-I220 HydrophobicContact CG2-CG1 3.96Å; I218-V261 CarbonylContact C-O 3.53Å; I218-V261 WeakPolarHBondContact CA-O 3.45Å; I218-F263 HydrophobicContact CD1-CZ 4.39Å; I218-F263 HydrophobicContact CG2-CD1 4.04Å; I218-F263 HydrophobicContact CG2-CD2 3.56Å; I218-F263 HydrophobicContact CG2-CE1 4.08Å; I218-F263 HydrophobicContact CG2-CE2 3.62Å; I218-F263 HydrophobicContact CG2-CG 3.77Å; I218-F263 HydrophobicContact CG2-CZ 3.87Å; I218-F332 HydrophobicContact CD1-CE2 4.4Å; I218-V335 HydrophobicContact CD1-CG1 4.4Å
219	F	98.6	Very high	96.4	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	125.1	174	-169.3	-84.1	0	0	0	109.9	L35 A221 L245 F246 I249 V261 L262 F263 F303	L35-F219 HydrophobicContact CB-CD2 3.93Å; L35-F219 HydrophobicContact CB-CE2 4.47Å; L35-F219 CarbonylContact O-C 3.6Å; L35-F219 WeakPolarHBondContact O-CA 3.42Å; F219-A221 HydrophobicContact CE1-CB 4.23Å; F219-L245 HydrophobicContact CE2-CD2 4.05Å; F219-L245 HydrophobicContact CE2-CG 3.9Å; F219-L245 HydrophobicContact CZ-CB 4.23Å; F219-L245 HydrophobicContact CZ-CD2 3.96Å; F219-L245 HydrophobicContact CZ-CG 3.99Å; F219-F246 HydrophobicContact CB-CD2 3.96Å; F219-F246 HydrophobicContact CB-CE2 3.98Å; F219-F246 HydrophobicContact CD1-CB 4.34Å; F219-F246 AromaticContact CD1-CD2 3.49Å; F219-F246 HydrophobicContact CD1-CD2 3.49Å; F219-F246 VanDerWaalsContact CD1-CD2 3.49Å; F219-F246 HydrophobicContact CD1-CE2 4.19Å; F219-F246 HydrophobicContact CD1-CG 4.31Å; F219-F246 AromaticContact CD2-CD2 3.83Å; F219-F246 HydrophobicContact CD2-CD2 3.83Å; F219-F246 HydrophobicContact CE1-CB 3.8Å; F219-F246 AromaticContact CE1-CD2 3.85Å; F219-F246 HydrophobicContact CE1-CD2 3.85Å; F219-F246 HydrophobicContact CE1-CG 4.26Å; F219-F246 HydrophobicContact CE2-CB 4.16Å; F219-F246 HydrophobicContact CE2-CD2 4.15Å; F219-F246 AromaticContact CG-CD2 3.47Å; F219-F246 HydrophobicContact CG-CD2 3.47Å; F219-F246 VanDerWaalsContact CG-CD2 3.47Å; F219-F246 HydrophobicContact CG-CE2 4.03Å; F219-F246 HydrophobicContact CZ-CB 3.69Å; F219-F246 HydrophobicContact CZ-CD2 4.16Å; F219-F246 HydrophobicContact CZ-CG 4.45Å; F219-I249 HydrophobicContact CD2-CG2 4.48Å; F219-I249 HydrophobicContact CE2-CG1 4.29Å; F219-V261 PolarHBondContact N-O 3.01Å; F219-L262 HydrophobicContact CD1-CD1 3.86Å; F219-L262 CarbonylContact O-C 3.58Å; F219-L262 WeakPolarHBondContact O-CA 3.37Å; F219-F263 PolarHBondContact O-N 2.86Å; F219-F303 HydrophobicContact CE1-CE1 4.15Å
220	I	98.8	Very high	96.5	Very high	0 Å²	0	19.5 Å²	19.5	0%	0	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	118.2	-175.1	-46.8	179.9	0	0	0	109.1	L35 S40 K42 I45 I218 F263 N265	L35-I220 PolarHBondContact O-N 3.49Å; S40-I220 WeakPolarHBondContact CB-O 3.44Å; S40-I220 VanDerWaalsContact O-CG2 3.27Å; S40-I220 WeakPolarHBondContact O-CG2 3.31Å; S40-I220 PolarHBondContact OG-O 3.22Å; K42-I220 HydrophobicContact CB-CD1 4.13Å; K42-I220 HydrophobicContact CG-CB 4.29Å; K42-I220 HydrophobicContact CG-CD1 3.76Å; K42-I220 HydrophobicContact CG-CG1 4.25Å; I45-I220 HydrophobicContact CB-CD1 4.38Å; I45-I220 HydrophobicContact CG1-CD1 3.84Å; I218-I220 HydrophobicContact CG2-CD1 4.32Å; I218-I220 HydrophobicContact CG2-CG1 3.96Å; I220-F263 WeakPolarHBondContact CA-O 3.49Å; I220-F263 HydrophobicContact CB-CB 4.42Å; I220-F263 HydrophobicContact CD1-CD2 4.49Å; I220-F263 HydrophobicContact CG1-CB 4.15Å; I220-F263 HydrophobicContact CG1-CD2 4.35Å; I220-F263 HydrophobicContact CG2-CB 4.17Å; I220-N265 HydrophobicContact CG2-CB 3.65Å
221	A	98.8	Very high	96.4	Very high	0 Å²	0	23.7 Å²	23.7	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	134.3	175.2	0	0	0	0	0	109.8	F219 L223 S242 L262 F263 L264 N265 F303	F219-A221 HydrophobicContact CE1-CB 4.23Å; A221-L223 PolarHBondContact O-N 3.29Å; A221-S242 WeakPolarHBondContact CB-OG 3.36Å; A221-L262 HydrophobicContact CB-CD1 4.44Å; A221-F263 PolarHBondContact N-O 2.77Å; A221-L264 HydrophobicContact CB-CD2 4.33Å; A221-L264 CarbonylContact O-C 3.28Å; A221-N265 PolarHBondContact O-N 3.01Å; A221-F303 HydrophobicContact CB-CE1 3.98Å; A221-F303 HydrophobicContact CB-CE2 4.02Å; A221-F303 HydrophobicContact CB-CZ 3.52Å
222	A	98.4	Very high	96.5	Very high	11 Å²	11	27 Å²	27	9%	0.091	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	113.2	175.7	0	0	0	0	0	110.3	S224 A225 M239 K266	A222-S224 VanDerWaalsContact C-N 3.25Å; A222-S224 PolarHBondContact O-N 2.98Å; A222-A225 HydrophobicContact CB-CB 4.04Å; A222-A225 WeakPolarHBondContact O-CB 3.45Å; A222-A225 PolarHBondContact O-N 3.35Å; A222-M239 VanDerWaalsContact O-CE 3.22Å; A222-M239 WeakPolarHBondContact O-CE 3.45Å; A222-K266 HydrophobicContact CB-CD 3.95Å; A222-K266 HydrophobicContact CB-CG 4.47Å
223	L	98.6	Very high	96.6	Very high	0 Å²	0	21.1 Å²	21.1	0%	0	13%	0.134	C	C	.	.	G	3₁₀ helix	trans	-58.8	-40.3	174.6	-73.2	169.3	0	0	0	111.5	A221 A225 Y226 L264 N265 K267 F270 I299 M319	A221-L223 PolarHBondContact O-N 3.29Å; L223-A225 PolarHBondContact O-N 3.4Å; L223-Y226 WeakPolarHBondContact O-CD1 3.43Å; L223-L264 HydrophobicContact CD1-CB 3.96Å; L223-L264 HydrophobicContact CD2-CB 4Å; L223-L264 HydrophobicContact CD2-CD2 4.12Å; L223-L264 HydrophobicContact CD2-CG 4.45Å; L223-L264 HydrophobicContact CG-CB 3.9Å; L223-N265 WeakPolarHBondContact CB-O 3.32Å; L223-N265 PolarHBondContact N-O 3.38Å; L223-K267 HydrophobicContact CD1-CB 4.15Å; L223-F270 HydrophobicContact CB-CB 3.64Å; L223-F270 HydrophobicContact CB-CD1 4.19Å; L223-F270 HydrophobicContact CB-CD2 3.98Å; L223-F270 HydrophobicContact CB-CG 3.67Å; L223-F270 HydrophobicContact CD1-CD1 4.25Å; L223-F270 HydrophobicContact CD1-CG 4.49Å; L223-F270 WeakPolarHBondContact O-CD2 3.31Å; L223-I299 HydrophobicContact CD2-CB 4.15Å; L223-I299 HydrophobicContact CD2-CD1 3.93Å; L223-I299 HydrophobicContact CD2-CG2 3.86Å; L223-M319 HydrophobicContact CD1-SD 3.8Å
224	S	97.4	Very high	96.7	Very high	1 Å²	1	24.4 Å²	24.4	1%	0.007	14%	0.137	C	C	.	.	G	3₁₀ helix	trans	-67.4	-3.2	-177.7	64.7	0	0	0	0	115	A222 K266 K273	A222-S224 VanDerWaalsContact C-N 3.25Å; A222-S224 PolarHBondContact O-N 2.98Å; S224-K266 VanDerWaalsContact OG-CD 3.32Å; S224-K266 WeakPolarHBondContact OG-CD 3.48Å; S224-K273 PolarHBondContact O-NZ 2.96Å
225	A	97.5	Very high	96.7	Very high	10 Å²	10	32.3 Å²	32.3	8%	0.083	17%	0.173	C	C	.	.	G	3₁₀ helix	trans	-92.2	1.2	-176	0	0	0	0	0	114	A222 L223 D227 M228 R238	A222-A225 HydrophobicContact CB-CB 4.04Å; A222-A225 WeakPolarHBondContact O-CB 3.45Å; A222-A225 PolarHBondContact O-N 3.35Å; L223-A225 PolarHBondContact O-N 3.4Å; A225-D227 VanDerWaalsContact C-N 3.27Å; A225-D227 PolarHBondContact O-N 2.86Å; A225-M228 PolarHBondContact O-N 2.68Å; A225-R238 HydrophobicContact CB-CB 3.76Å
226	Y	98	Very high	96.9	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	17%	0.174	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-28.6	-174.7	76	-82.7	0	0	0	114.5	L223 N237 F270 K273 I274 A277 L279 C282	L223-Y226 WeakPolarHBondContact O-CD1 3.43Å; Y226-N237 PolarHBondContact O-ND2 3.21Å; Y226-F270 AromaticContact CD1-CD2 3.84Å; Y226-F270 HydrophobicContact CD1-CD2 3.84Å; Y226-F270 AromaticContact CD1-CE2 3.82Å; Y226-F270 HydrophobicContact CD1-CE2 3.82Å; Y226-F270 AromaticContact CE1-CD2 3.81Å; Y226-F270 HydrophobicContact CE1-CD2 3.81Å; Y226-F270 AromaticContact CE1-CE2 3.83Å; Y226-F270 HydrophobicContact CE1-CE2 3.83Å; Y226-K273 HydrophobicContact CE1-CB 4.11Å; Y226-K273 VanDerWaalsContact OH-C 3.3Å; Y226-K273 PolarHBondContact OH-O 2.75Å; Y226-I274 HydrophobicContact CE2-CD1 4.38Å; Y226-I274 WeakPolarHBondContact OH-CA 3.49Å; Y226-I274 PolarHBondContact OH-N 2.76Å; Y226-A277 HydrophobicContact CE2-CB 4.41Å; Y226-A277 PolarHBondContact OH-O 2.76Å; Y226-L279 HydrophobicContact CD2-CD1 4.02Å; Y226-L279 HydrophobicContact CG-CD1 4.26Å; Y226-C282 HydrophobicContact CD2-CB 4.36Å; Y226-C282 VanDerWaalsContact O-CB 3.23Å; Y226-C282 WeakPolarHBondContact O-CB 3.43Å
227	D	97.3	Very high	97	Very high	21 Å²	21	33.7 Å²	33.7	11%	0.112	18%	0.181	C	C	.	.	T	Hydrogen-bonded Turn	trans	-108	23.7	-179.1	64.1	-23.8	0	0	0	111.8	S140 A225 K273	S140-D227 WeakPolarHBondContact CB-OD2 3.03Å; A225-D227 VanDerWaalsContact C-N 3.27Å; A225-D227 PolarHBondContact O-N 2.86Å; D227-K273 VanDerWaalsContact CG-NZ 3.31Å; D227-K273 WeakPolarHBondContact OD1-CE 3.38Å; D227-K273 IonicContact OD1-NZ 3.92Å; D227-K273 PolarHBondContact OD1-NZ 3.04Å; D227-K273 WeakPolarHBondContact OD2-CE 3.29Å; D227-K273 IonicContact OD2-NZ 3.82Å; D227-K273 PolarHBondContact OD2-NZ 3.24Å
228	M	97.1	Very high	97	Very high	11 Å²	11	35 Å²	35	5%	0.054	19%	0.185	C	C	.	.			trans	-126.7	152.5	-177.7	-62.1	-179.8	73.9	0	0	111.7	A225 N237 R238	A225-M228 PolarHBondContact O-N 2.68Å; M228-N237 CarbonylContact O-C 3.52Å; M228-N237 WeakPolarHBondContact O-CA 3.29Å; M228-R238 HydrophobicContact CB-CG 4.12Å; M228-R238 WeakPolarHBondContact O-CG 3.5Å; M228-R238 PolarHBondContact O-N 3.24Å
229	V	97.3	Very high	97	Very high	52 Å²	52	35 Å²	35	32%	0.315	19%	0.186	S	C	.	.	B	Isolated β-bridge	trans	-102.6	159	172.6	-59.1	0	0	0	0	111.9	Q143 D234 V236 R238	Q143-V229 PolarHBondContact NE2-O 2.8Å; Q143-V229 VanDerWaalsContact NE2-O 3.14Å; V229-D234 WeakPolarHBondContact CG1-O 3.42Å; V229-D234 HydrophobicContact CG2-CB 4.27Å; V229-V236 CarbonylContact C-O 3.59Å; V229-V236 VanDerWaalsContact CA-O 3.28Å; V229-V236 WeakPolarHBondContact CA-O 3.35Å; V229-R238 VanDerWaalsContact C-CG 3.43Å; V229-R238 WeakPolarHBondContact O-CG 3.33Å; V229-R238 PolarHBondContact O-NE 3.32Å
230	L	96.1	Very high	97	Very high	10 Å²	10	38.3 Å²	38.3	5%	0.052	20%	0.201	C	C	.	.			trans	-65.7	153.2	179.5	-64.9	171.8	0	0	0	111.3	Q143 E232 D233 V236 R238 E241	Q143-L230 PolarHBondContact NE2-O 2.97Å; L230-E232 VanDerWaalsContact C-N 3.29Å; L230-D233 HydrophobicContact CB-CB 4.31Å; L230-D233 WeakPolarHBondContact CB-O 3.33Å; L230-D233 HydrophobicContact CD1-CB 4.32Å; L230-D233 PolarHBondContact N-O 3.38Å; L230-D233 CarbonylContact O-C 3.58Å; L230-V236 HydrophobicContact CD1-CB 3.91Å; L230-V236 HydrophobicContact CD1-CG1 3.65Å; L230-V236 HydrophobicContact CG-CB 4.41Å; L230-V236 HydrophobicContact CG-CG1 4.25Å; L230-V236 PolarHBondContact N-O 2.77Å; L230-R238 HydrophobicContact CD2-CB 4.36Å; L230-R238 HydrophobicContact CD2-CG 3.9Å; L230-R238 HydrophobicContact CG-CG 4.36Å; L230-E241 HydrophobicContact CD1-CB 3.91Å; L230-E241 HydrophobicContact CD1-CG 3.75Å; L230-E241 HydrophobicContact CD2-CB 4.05Å; L230-E241 HydrophobicContact CD2-CG 3.88Å; L230-E241 HydrophobicContact CG-CB 4.29Å; L230-E241 HydrophobicContact CG-CG 4.36Å
231	V	93.5	Very high	97	Very high	92 Å²	92	39 Å²	39	56%	0.558	20%	0.204	S	C	*	.	S	Bend	trans	-69.7	-36.2	168.8	179.5	0	0	0	0	109.7	Q143 D233	Q143-V231 HydrophobicContact CB-CG2 4.49Å; Q143-V231 HydrophobicContact CG-CG2 4.04Å; Q143-V231 VanDerWaalsContact OE1-CG2 3.3Å; V231-D233 VanDerWaalsContact C-N 3.3Å; V231-D233 PolarHBondContact O-N 3.16Å
232	E	94.7	Very high	97	Very high	84 Å²	84	39.3 Å²	39.3	39%	0.393	21%	0.206	S	C	.	.	S	Bend	trans	-76.4	-14.5	-178	-58.8	99.8	133.7	0	0	114.1	Q200 R201 L230	Q200-E232 WeakPolarHBondContact CA-OE1 3.42Å; Q200-E232 VanDerWaalsContact CB-OE1 3.31Å; Q200-E232 WeakPolarHBondContact CB-OE1 3.41Å; R201-E232 PolarHBondContact N-OE1 3.06Å; L230-E232 VanDerWaalsContact C-N 3.29Å
233	D	95.2	Very high	97	Very high	44 Å²	44	39.5 Å²	39.5	24%	0.235	21%	0.206	C	C	.	.			trans	-166.5	101.9	-168.8	-166.8	-21.2	0	0	0	110.1	R201 L230 V231 E235 V236	R201-D233 IonicContact CZ-OD2 3.5Å; R201-D233 IonicContact NH1-OD2 3.63Å; R201-D233 PolarHBondContact NH1-OD2 3.31Å; R201-D233 IonicContact NH2-OD2 3.81Å; L230-D233 HydrophobicContact CB-CB 4.31Å; L230-D233 WeakPolarHBondContact CB-O 3.33Å; L230-D233 HydrophobicContact CD1-CB 4.32Å; L230-D233 PolarHBondContact N-O 3.38Å; L230-D233 CarbonylContact O-C 3.58Å; V231-D233 VanDerWaalsContact C-N 3.3Å; V231-D233 PolarHBondContact O-N 3.16Å; D233-E235 PolarHBondContact O-N 3.45Å; D233-E235 PolarHBondContact OD1-N 3.38Å; D233-V236 HydrophobicContact CB-CB 4.24Å; D233-V236 HydrophobicContact CB-CG2 4.23Å; D233-V236 VanDerWaalsContact CG-CG2 3.45Å; D233-V236 PolarHBondContact O-N 3.46Å; D233-V236 VanDerWaalsContact OD2-CG2 3.26Å; D233-V236 WeakPolarHBondContact OD2-CG2 3.5Å
234	D	93.3	Very high	97	Very high	131 Å²	131	45.5 Å²	45.5	70%	0.701	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	-77.3	-6	-173.9	61.7	-17.5	0	0	0	113.9	V229	V229-D234 WeakPolarHBondContact CG1-O 3.42Å; V229-D234 HydrophobicContact CG2-CB 4.27Å
235	E	95.6	Very high	97	Very high	178 Å²	178	45.9 Å²	45.9	83%	0.832	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	-89.7	-13.3	172.1	-59.5	-169.5	148.4	0	0	112.5	D233	D233-E235 PolarHBondContact O-N 3.45Å; D233-E235 PolarHBondContact OD1-N 3.38Å
236	V	97	Very high	97	Very high	36 Å²	36	45.4 Å²	45.4	22%	0.218	23%	0.231	C	C	.	.	S	Bend	trans	-105.6	118.7	-174.5	177.9	0	0	0	0	111.4	V229 L230 D233 E241	V229-V236 CarbonylContact C-O 3.59Å; V229-V236 VanDerWaalsContact CA-O 3.28Å; V229-V236 WeakPolarHBondContact CA-O 3.35Å; L230-V236 HydrophobicContact CD1-CB 3.91Å; L230-V236 HydrophobicContact CD1-CG1 3.65Å; L230-V236 HydrophobicContact CG-CB 4.41Å; L230-V236 HydrophobicContact CG-CG1 4.25Å; L230-V236 PolarHBondContact N-O 2.77Å; D233-V236 HydrophobicContact CB-CB 4.24Å; D233-V236 HydrophobicContact CB-CG2 4.23Å; D233-V236 VanDerWaalsContact CG-CG2 3.45Å; D233-V236 PolarHBondContact O-N 3.46Å; D233-V236 VanDerWaalsContact OD2-CG2 3.26Å; D233-V236 WeakPolarHBondContact OD2-CG2 3.5Å; V236-E241 HydrophobicContact CG1-CB 4.12Å
237	N	97.9	Very high	97	Very high	27 Å²	27	47.7 Å²	47.7	14%	0.144	24%	0.243	C	C	.	.	B	Isolated β-bridge	trans	-63.6	134	171.4	-178.3	-73.4	0	0	0	111.8	Y226 M228 M239 H240 E241	Y226-N237 PolarHBondContact O-ND2 3.21Å; M228-N237 CarbonylContact O-C 3.52Å; M228-N237 WeakPolarHBondContact O-CA 3.29Å; N237-M239 VanDerWaalsContact C-N 3.35Å; N237-M239 PolarHBondContact O-N 2.97Å; N237-M239 WeakPolarHBondContact OD1-CA 3.37Å; N237-M239 VanDerWaalsContact OD1-CB 3.32Å; N237-M239 WeakPolarHBondContact OD1-CB 3.35Å; N237-M239 PolarHBondContact OD1-N 2.97Å; N237-H240 HydrophobicContact CB-CB 4.25Å; N237-H240 PolarHBondContact O-N 3.04Å; N237-H240 PolarHBondContact OD1-N 3.14Å; N237-E241 PolarHBondContact O-N 3.13Å
238	R	97.9	Very high	97	Very high	26 Å²	26	49.7 Å²	49.7	10%	0.098	26%	0.259	C	S	.	.	H	α-helix	trans	-64.2	-34.1	-175.8	-66	-166.7	174.3	-158.6	-2.9	113.6	E39 A225 M228 V229 L230 S242	E39-R238 IonicContact OE2-CZ 3.5Å; E39-R238 IonicContact OE2-NH1 3.41Å; E39-R238 PolarHBondContact OE2-NH1 3.22Å; E39-R238 IonicContact OE2-NH2 2.74Å; E39-R238 PolarHBondContact OE2-NH2 2.97Å; A225-R238 HydrophobicContact CB-CB 3.76Å; M228-R238 HydrophobicContact CB-CG 4.12Å; M228-R238 WeakPolarHBondContact O-CG 3.5Å; M228-R238 PolarHBondContact O-N 3.24Å; V229-R238 VanDerWaalsContact C-CG 3.43Å; V229-R238 WeakPolarHBondContact O-CG 3.33Å; V229-R238 PolarHBondContact O-NE 3.32Å; L230-R238 HydrophobicContact CD2-CB 4.36Å; L230-R238 HydrophobicContact CD2-CG 3.9Å; L230-R238 HydrophobicContact CG-CG 4.36Å; R238-S242 WeakPolarHBondContact O-CB 3.44Å; R238-S242 PolarHBondContact O-N 3.13Å
239	M	98.4	Very high	97	Very high	1 Å²	1	49.4 Å²	49.4	1%	0.005	26%	0.258	C	S	.	.	H	α-helix	trans	-70.9	-42	177.4	-179.9	61.7	69.2	0	0	111.2	A222 N237 S242 L243 F283 I299 F303	A222-M239 VanDerWaalsContact O-CE 3.22Å; A222-M239 WeakPolarHBondContact O-CE 3.45Å; N237-M239 VanDerWaalsContact C-N 3.35Å; N237-M239 PolarHBondContact O-N 2.97Å; N237-M239 WeakPolarHBondContact OD1-CA 3.37Å; N237-M239 VanDerWaalsContact OD1-CB 3.32Å; N237-M239 WeakPolarHBondContact OD1-CB 3.35Å; N237-M239 PolarHBondContact OD1-N 2.97Å; M239-S242 CarbonylContact O-C 3.55Å; M239-S242 WeakPolarHBondContact O-CA 3.36Å; M239-S242 WeakPolarHBondContact O-CB 3.41Å; M239-S242 PolarHBondContact O-N 3.25Å; M239-S242 VanDerWaalsContact O-N 3.09Å; M239-L243 HydrophobicContact CG-CD1 4.43Å; M239-L243 WeakPolarHBondContact O-CG 3.24Å; M239-L243 PolarHBondContact O-N 2.88Å; M239-F283 HydrophobicContact CG-CE2 4.07Å; M239-F283 HydrophobicContact CG-CZ 3.79Å; M239-I299 HydrophobicContact CE-CD1 4.25Å; M239-I299 HydrophobicContact CE-CG2 3.99Å; M239-I299 HydrophobicContact SD-CG2 3.95Å; M239-F303 HydrophobicContact SD-CE2 3.58Å; M239-F303 VanDerWaalsContact SD-CE2 3.58Å; M239-F303 HydrophobicContact SD-CZ 3.84Å
240	H	98.4	Very high	96.9	Very high	70 Å²	70	47 Å²	47	32%	0.324	24%	0.243	S	C	.	.	H	α-helix	trans	-60.9	-43.8	173.2	-79	-63.7	0	0	0	112.1	N237 S242 L243 H244 C282	N237-H240 HydrophobicContact CB-CB 4.25Å; N237-H240 PolarHBondContact O-N 3.04Å; N237-H240 PolarHBondContact OD1-N 3.14Å; H240-S242 VanDerWaalsContact C-N 3.28Å; H240-S242 PolarHBondContact O-N 3.49Å; H240-L243 PolarHBondContact O-N 3.31Å; H240-H244 PolarHBondContact O-CD2 2.91Å; H240-H244 PolarHBondContact O-N 3.48Å; H240-C282 PolarHBondContact NE2-O 3.32Å
241	E	98.2	Very high	96.9	Very high	15 Å²	15	47.8 Å²	47.8	7%	0.07	25%	0.247	C	C	.	.	H	α-helix	trans	-56.9	-42.4	171.2	176.2	71.5	-176.9	0	0	111.8	R201 R204 L230 V236 N237 H244 L245	R201-E241 IonicContact CZ-OE2 2.66Å; R201-E241 IonicContact NE-OE1 2.72Å; R201-E241 PolarHBondContact NE-OE1 3.42Å; R201-E241 IonicContact NE-OE2 3.12Å; R201-E241 IonicContact NH2-OE1 2.7Å; R201-E241 IonicContact NH2-OE2 3.48Å; R201-E241 PolarHBondContact NH2-OE2 3.11Å; R204-E241 IonicContact CZ-OE1 3.69Å; R204-E241 IonicContact NH1-OE1 3.47Å; R204-E241 PolarHBondContact NH1-OE1 3.39Å; R204-E241 IonicContact NH2-OE1 2.61Å; R204-E241 PolarHBondContact NH2-OE1 2.91Å; L230-E241 HydrophobicContact CD1-CB 3.91Å; L230-E241 HydrophobicContact CD1-CG 3.75Å; L230-E241 HydrophobicContact CD2-CB 4.05Å; L230-E241 HydrophobicContact CD2-CG 3.88Å; L230-E241 HydrophobicContact CG-CB 4.29Å; L230-E241 HydrophobicContact CG-CG 4.36Å; V236-E241 HydrophobicContact CG1-CB 4.12Å; N237-E241 PolarHBondContact O-N 3.13Å; E241-H244 PolarHBondContact O-N 3.19Å; E241-L245 VanDerWaalsContact O-CB 3.22Å; E241-L245 WeakPolarHBondContact O-CB 3.13Å; E241-L245 PolarHBondContact O-N 3.41Å
242	S	98.6	Very high	97	Very high	5 Å²	5	46.1 Å²	46.1	4%	0.035	23%	0.234	C	C	.	.	H	α-helix	trans	-65.9	-38.9	178.2	-168.7	0	0	0	0	112.3	A221 R238 M239 H240 F246	A221-S242 WeakPolarHBondContact CB-OG 3.36Å; R238-S242 WeakPolarHBondContact O-CB 3.44Å; R238-S242 PolarHBondContact O-N 3.13Å; M239-S242 CarbonylContact O-C 3.55Å; M239-S242 WeakPolarHBondContact O-CA 3.36Å; M239-S242 WeakPolarHBondContact O-CB 3.41Å; M239-S242 PolarHBondContact O-N 3.25Å; M239-S242 VanDerWaalsContact O-N 3.09Å; H240-S242 VanDerWaalsContact C-N 3.28Å; H240-S242 PolarHBondContact O-N 3.49Å; S242-F246 WeakPolarHBondContact O-CB 3.42Å; S242-F246 PolarHBondContact O-N 3.19Å
243	L	98.7	Very high	96.9	Very high	16 Å²	16	51.2 Å²	51.2	8%	0.084	25%	0.249	C	C	.	.	H	α-helix	trans	-65	-48.1	174.5	-75	166	0	0	0	111.2	M239 H240 L245 F246 N247 F283 Q302 F303 L306	M239-L243 HydrophobicContact CG-CD1 4.43Å; M239-L243 WeakPolarHBondContact O-CG 3.24Å; M239-L243 PolarHBondContact O-N 2.88Å; H240-L243 PolarHBondContact O-N 3.31Å; L243-L245 VanDerWaalsContact C-N 3.31Å; L243-L245 PolarHBondContact O-N 3.34Å; L243-F246 PolarHBondContact O-N 3.06Å; L243-N247 WeakPolarHBondContact O-CB 3.4Å; L243-N247 PolarHBondContact O-N 3.48Å; L243-F283 HydrophobicContact CD1-CE1 3.77Å; L243-F283 HydrophobicContact CD1-CZ 3.9Å; L243-Q302 HydrophobicContact CD2-CB 4.05Å; L243-F303 HydrophobicContact CD2-CB 4.46Å; L243-F303 HydrophobicContact CD2-CD1 3.82Å; L243-F303 HydrophobicContact CD2-CD2 3.76Å; L243-F303 HydrophobicContact CD2-CE1 3.85Å; L243-F303 HydrophobicContact CD2-CE2 3.79Å; L243-F303 HydrophobicContact CD2-CG 3.75Å; L243-F303 HydrophobicContact CD2-CZ 3.82Å; L243-F303 HydrophobicContact CG-CE1 4.27Å; L243-F303 HydrophobicContact CG-CE2 4.24Å; L243-F303 HydrophobicContact CG-CZ 4.01Å; L243-L306 HydrophobicContact CB-CD1 4.11Å; L243-L306 HydrophobicContact CD2-CD1 3.7Å; L243-L306 WeakPolarHBondContact O-CD1 3.36Å
244	H	98.2	Very high	96.8	Very high	125 Å²	125	55 Å²	55	58%	0.579	26%	0.261	S	S	*	.	H	α-helix	trans	-58	-44.9	175.6	-76	-55.7	0	0	0	111.9	H240 E241 N247 S248	H240-H244 PolarHBondContact O-CD2 2.91Å; H240-H244 PolarHBondContact O-N 3.48Å; E241-H244 PolarHBondContact O-N 3.19Å; H244-N247 PolarHBondContact O-N 3.37Å; H244-S248 PolarHBondContact O-N 3.36Å; H244-S248 VanDerWaalsContact O-N 3.13Å
245	L	97.9	Very high	96.8	Very high	9 Å²	9	48.8 Å²	48.8	5%	0.047	23%	0.228	C	C	.	.	H	α-helix	trans	-62.3	-47.1	176.4	-177.1	63.5	0	0	0	111.2	A37 W207 F219 E241 L243 N247 S248 I249	A37-L245 HydrophobicContact CB-CD2 4.4Å; W207-L245 HydrophobicContact CH2-CD1 3.79Å; W207-L245 HydrophobicContact CH2-CD2 3.75Å; W207-L245 HydrophobicContact CH2-CG 4.21Å; W207-L245 HydrophobicContact CZ3-CD1 3.63Å; W207-L245 HydrophobicContact CZ3-CD2 4.34Å; W207-L245 HydrophobicContact CZ3-CG 4.31Å; F219-L245 HydrophobicContact CE2-CD2 4.05Å; F219-L245 HydrophobicContact CE2-CG 3.9Å; F219-L245 HydrophobicContact CZ-CB 4.23Å; F219-L245 HydrophobicContact CZ-CD2 3.96Å; F219-L245 HydrophobicContact CZ-CG 3.99Å; E241-L245 VanDerWaalsContact O-CB 3.22Å; E241-L245 WeakPolarHBondContact O-CB 3.13Å; E241-L245 PolarHBondContact O-N 3.41Å; L243-L245 VanDerWaalsContact C-N 3.31Å; L243-L245 PolarHBondContact O-N 3.34Å; L245-N247 PolarHBondContact O-N 2.9Å; L245-S248 PolarHBondContact O-N 3.49Å; L245-S248 PolarHBondContact O-OG 2.93Å; L245-I249 WeakPolarHBondContact O-CG1 3.36Å; L245-I249 PolarHBondContact O-N 3.46Å; L245-I249 VanDerWaalsContact O-N 3.14Å
246	F	98.4	Very high	96.6	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-60.1	-46.5	178.5	-176.8	-107.9	0	0	0	112.1	F219 S242 L243 S248 I249 C250 I260 L262 F303 L306 I315	F219-F246 HydrophobicContact CB-CD2 3.96Å; F219-F246 HydrophobicContact CB-CE2 3.98Å; F219-F246 HydrophobicContact CD1-CB 4.34Å; F219-F246 AromaticContact CD1-CD2 3.49Å; F219-F246 HydrophobicContact CD1-CD2 3.49Å; F219-F246 VanDerWaalsContact CD1-CD2 3.49Å; F219-F246 HydrophobicContact CD1-CE2 4.19Å; F219-F246 HydrophobicContact CD1-CG 4.31Å; F219-F246 AromaticContact CD2-CD2 3.83Å; F219-F246 HydrophobicContact CD2-CD2 3.83Å; F219-F246 HydrophobicContact CE1-CB 3.8Å; F219-F246 AromaticContact CE1-CD2 3.85Å; F219-F246 HydrophobicContact CE1-CD2 3.85Å; F219-F246 HydrophobicContact CE1-CG 4.26Å; F219-F246 HydrophobicContact CE2-CB 4.16Å; F219-F246 HydrophobicContact CE2-CD2 4.15Å; F219-F246 AromaticContact CG-CD2 3.47Å; F219-F246 HydrophobicContact CG-CD2 3.47Å; F219-F246 VanDerWaalsContact CG-CD2 3.47Å; F219-F246 HydrophobicContact CG-CE2 4.03Å; F219-F246 HydrophobicContact CZ-CB 3.69Å; F219-F246 HydrophobicContact CZ-CD2 4.16Å; F219-F246 HydrophobicContact CZ-CG 4.45Å; S242-F246 WeakPolarHBondContact O-CB 3.42Å; S242-F246 PolarHBondContact O-N 3.19Å; L243-F246 PolarHBondContact O-N 3.06Å; F246-S248 PolarHBondContact O-N 3.45Å; F246-I249 PolarHBondContact O-N 3.19Å; F246-C250 HydrophobicContact CD1-CB 4.45Å; F246-C250 HydrophobicContact CE1-CB 4.05Å; F246-C250 HydrophobicContact CE2-CB 4.29Å; F246-C250 HydrophobicContact CZ-CB 3.98Å; F246-C250 PolarHBondContact O-N 2.99Å; F246-C250 PolarHBondContact O-SG 3.01Å; F246-I260 HydrophobicContact CE2-CG2 4.22Å; F246-L262 HydrophobicContact CD2-CD1 4.43Å; F246-L262 HydrophobicContact CE2-CD1 4.18Å; F246-F303 HydrophobicContact CB-CD1 3.69Å; F246-F303 HydrophobicContact CB-CE1 3.72Å; F246-F303 HydrophobicContact CD1-CB 4.33Å; F246-F303 AromaticContact CD1-CD1 3.66Å; F246-F303 HydrophobicContact CD1-CD1 3.66Å; F246-F303 HydrophobicContact CD1-CG 4.49Å; F246-F303 HydrophobicContact CD2-CD1 4.28Å; F246-F303 HydrophobicContact CE1-CB 4.3Å; F246-F303 HydrophobicContact CE1-CD1 4.32Å; F246-F303 WeakPolarHBondContact CE1-O 3.38Å; F246-F303 AromaticContact CG-CD1 3.61Å; F246-F303 HydrophobicContact CG-CD1 3.61Å; F246-F303 HydrophobicContact CG-CE1 4.12Å; F246-L306 HydrophobicContact CD1-CB 4.2Å; F246-L306 HydrophobicContact CD1-CD1 4.01Å; F246-I315 HydrophobicContact CE1-CD1 4.15Å; F246-I315 HydrophobicContact CZ-CD1 3.62Å; F246-I315 HydrophobicContact CZ-CG2 4.15Å
247	N	98.2	Very high	96.2	Very high	48 Å²	48	46.4 Å²	46.4	26%	0.257	23%	0.228	S	C	.	.	H	α-helix	trans	-53.3	-43.4	175.9	-173.4	24	0	0	0	111.6	L243 H244 L245 I249 N251 L306	L243-N247 WeakPolarHBondContact O-CB 3.4Å; L243-N247 PolarHBondContact O-N 3.48Å; H244-N247 PolarHBondContact O-N 3.37Å; L245-N247 PolarHBondContact O-N 2.9Å; N247-I249 VanDerWaalsContact C-N 3.33Å; N247-I249 PolarHBondContact O-N 2.92Å; N247-N251 WeakPolarHBondContact O-CB 3.3Å; N247-N251 PolarHBondContact O-N 3.41Å; N247-N251 PolarHBondContact O-ND2 3.39Å; N247-N251 VanDerWaalsContact O-ND2 3.1Å; N247-N251 PolarHBondContact OD1-ND2 2.95Å; N247-L306 HydrophobicContact CB-CB 4.26Å; N247-L306 HydrophobicContact CB-CD1 4.09Å; N247-L306 HydrophobicContact CB-CD2 4.12Å; N247-L306 HydrophobicContact CB-CG 4.38Å
248	S	96.7	Very high	95.9	Very high	63 Å²	63	45.7 Å²	45.7	44%	0.441	23%	0.225	S	C	.	.	H	α-helix	trans	-65.6	-34.8	178.5	78.2	0	0	0	0	113.1	H244 L245 F246 H252	H244-S248 PolarHBondContact O-N 3.36Å; H244-S248 VanDerWaalsContact O-N 3.13Å; L245-S248 PolarHBondContact O-N 3.49Å; L245-S248 PolarHBondContact O-OG 2.93Å; F246-S248 PolarHBondContact O-N 3.45Å; S248-H252 WeakPolarHBondContact O-CB 3.45Å; S248-H252 PolarHBondContact O-N 2.57Å
249	I	96.4	Very high	95.7	Very high	6 Å²	6	45.2 Å²	45.2	3%	0.031	23%	0.226	C	C	.	.	H	α-helix	trans	-81.3	-51.5	-177.9	-65.7	-54.7	0	0	0	111.3	L35 W207 F211 I217 F219 L245 F246 N247 N251 H252 F255	L35-I249 HydrophobicContact CD1-CD1 3.83Å; L35-I249 HydrophobicContact CD1-CG1 4.06Å; L35-I249 HydrophobicContact CD1-CG2 3.71Å; W207-I249 HydrophobicContact CE3-CD1 4.23Å; W207-I249 HydrophobicContact CZ3-CD1 4.1Å; W207-I249 HydrophobicContact CZ3-CG1 4.44Å; F211-I249 HydrophobicContact CZ-CD1 4.32Å; I217-I249 HydrophobicContact CD1-CG2 4.17Å; I217-I249 HydrophobicContact CG2-CG2 4.36Å; F219-I249 HydrophobicContact CD2-CG2 4.48Å; F219-I249 HydrophobicContact CE2-CG1 4.29Å; L245-I249 WeakPolarHBondContact O-CG1 3.36Å; L245-I249 PolarHBondContact O-N 3.46Å; L245-I249 VanDerWaalsContact O-N 3.14Å; F246-I249 PolarHBondContact O-N 3.19Å; N247-I249 VanDerWaalsContact C-N 3.33Å; N247-I249 PolarHBondContact O-N 2.92Å; I249-N251 PolarHBondContact O-N 3.38Å; I249-H252 WeakPolarHBondContact O-CB 3.42Å; I249-H252 PolarHBondContact O-N 2.8Å; I249-H252 VanDerWaalsContact O-N 3.07Å; I249-F255 HydrophobicContact CD1-CE2 4.3Å; I249-F255 HydrophobicContact CG2-CD2 4.1Å; I249-F255 HydrophobicContact CG2-CE2 4.15Å
250	C	96.5	Very high	95.5	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-64.7	-28.1	-172.4	68.8	0	0	0	0	112.8	F246 I260 K313 I315	F246-C250 HydrophobicContact CD1-CB 4.45Å; F246-C250 HydrophobicContact CE1-CB 4.05Å; F246-C250 HydrophobicContact CE2-CB 4.29Å; F246-C250 HydrophobicContact CZ-CB 3.98Å; F246-C250 PolarHBondContact O-N 2.99Å; F246-C250 PolarHBondContact O-SG 3.01Å; C250-I260 HydrophobicContact CB-CD1 4.01Å; C250-K313 PolarHBondContact O-NZ 2.97Å; C250-K313 VanDerWaalsContact O-NZ 3.13Å; C250-I315 HydrophobicContact CB-CD1 3.91Å
251	N	96.1	Very high	95.5	Very high	27 Å²	27	42 Å²	42	14%	0.144	21%	0.211	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.7	-0.1	178.2	-60.5	-50.9	0	0	0	114	N247 I249 L306 M308 R309	N247-N251 WeakPolarHBondContact O-CB 3.3Å; N247-N251 PolarHBondContact O-N 3.41Å; N247-N251 PolarHBondContact O-ND2 3.39Å; N247-N251 VanDerWaalsContact O-ND2 3.1Å; N247-N251 PolarHBondContact OD1-ND2 2.95Å; I249-N251 PolarHBondContact O-N 3.38Å; N251-L306 PolarHBondContact ND2-O 3.4Å; N251-M308 HydrophobicContact CB-SD 4.42Å; N251-M308 WeakPolarHBondContact OD1-CB 3.01Å; N251-M308 WeakPolarHBondContact OD1-CG 3.24Å; N251-M308 PolarHBondContact OD1-N 3.23Å; N251-R309 PolarHBondContact O-NH2 3.47Å
252	H	94.6	Very high	95.5	Very high	58 Å²	58	41.3 Å²	41.3	27%	0.269	21%	0.208	S	C	.	.			trans	-64.5	137.9	-177.8	-161.8	-110.1	0	0	0	112.1	F211 S248 I249 Y254 F255 A256	F211-H252 AromaticContact CD2-CE1 3.8Å; F211-H252 AromaticContact CE2-CE1 3.61Å; F211-H252 AromaticContact CE2-ND1 3.82Å; S248-H252 WeakPolarHBondContact O-CB 3.45Å; S248-H252 PolarHBondContact O-N 2.57Å; I249-H252 WeakPolarHBondContact O-CB 3.42Å; I249-H252 PolarHBondContact O-N 2.8Å; I249-H252 VanDerWaalsContact O-N 3.07Å; H252-Y254 VanDerWaalsContact C-N 3.3Å; H252-Y254 AromaticContact CE1-CD2 3.24Å; H252-Y254 WeakPolarHBondContact CE1-CD2 3.47Å; H252-Y254 AromaticContact CE1-CG 3.97Å; H252-Y254 AromaticContact ND1-CD2 3.67Å; H252-Y254 PolarHBondContact ND1-N 3.04Å; H252-Y254 PolarHBondContact O-N 3.28Å; H252-F255 HydrophobicContact CB-CD2 3.77Å; H252-F255 HydrophobicContact CB-CE2 4.45Å; H252-F255 HydrophobicContact CB-CG 4.49Å; H252-F255 CarbonylContact O-C 3.56Å; H252-F255 PolarHBondContact O-N 3.01Å; H252-A256 PolarHBondContact O-N 2.94Å
253	R	93	Very high	95.5	Very high	191 Å²	191	41.2 Å²	41.2	72%	0.721	21%	0.207	S	C	*	.	G	3₁₀ helix	trans	-60.8	-33.2	-177.1	68.4	179.5	176.6	-174.5	-2.6	114.5	F255 A256	R253-F255 PolarHBondContact O-N 3.46Å; R253-A256 WeakPolarHBondContact O-CB 3.4Å; R253-A256 PolarHBondContact O-N 3.47Å
254	Y	92.8	Very high	95.5	Very high	124 Å²	124	40.5 Å²	40.5	49%	0.486	20%	0.203	S	C	.	.	G	3₁₀ helix	trans	-68.6	-18.4	177.5	-76.8	-97.3	0	0	0	112.5	I208 F211 H252	I208-Y254 HydrophobicContact CD1-CE2 4.31Å; F211-Y254 HydrophobicContact CB-CD1 4.48Å; F211-Y254 HydrophobicContact CD2-CG 4.42Å; H252-Y254 VanDerWaalsContact C-N 3.3Å; H252-Y254 AromaticContact CE1-CD2 3.24Å; H252-Y254 WeakPolarHBondContact CE1-CD2 3.47Å; H252-Y254 AromaticContact CE1-CG 3.97Å; H252-Y254 AromaticContact ND1-CD2 3.67Å; H252-Y254 PolarHBondContact ND1-N 3.04Å; H252-Y254 PolarHBondContact O-N 3.28Å
255	F	93.8	Very high	95.6	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	18%	0.176	C	C	.	.	G	3₁₀ helix	trans	-112.3	25.2	-178.1	-53.2	-41.9	0	0	0	111.9	L33 L35 F211 V214 I217 I249 H252 R253 T257 T258 K313	L33-F255 HydrophobicContact CD2-CE1 4.47Å; L33-F255 HydrophobicContact CD2-CZ 4.03Å; L35-F255 HydrophobicContact CD1-CE2 4.33Å; F211-F255 HydrophobicContact CB-CE1 4.11Å; F211-F255 HydrophobicContact CB-CZ 4.17Å; F211-F255 HydrophobicContact CD1-CE1 4.09Å; F211-F255 HydrophobicContact CD1-CE2 4.26Å; F211-F255 AromaticContact CD1-CZ 3.36Å; F211-F255 HydrophobicContact CD1-CZ 3.36Å; F211-F255 HydrophobicContact CD2-CE1 4.2Å; F211-F255 HydrophobicContact CD2-CE2 4.01Å; F211-F255 AromaticContact CD2-CZ 3.59Å; F211-F255 HydrophobicContact CD2-CZ 3.59Å; F211-F255 AromaticContact CE1-CE2 3.93Å; F211-F255 HydrophobicContact CE1-CE2 3.93Å; F211-F255 AromaticContact CE1-CZ 3.44Å; F211-F255 HydrophobicContact CE1-CZ 3.44Å; F211-F255 VanDerWaalsContact CE1-CZ 3.44Å; F211-F255 AromaticContact CE2-CE2 3.69Å; F211-F255 HydrophobicContact CE2-CE2 3.69Å; F211-F255 AromaticContact CE2-CZ 3.68Å; F211-F255 HydrophobicContact CE2-CZ 3.68Å; F211-F255 AromaticContact CG-CE1 3.89Å; F211-F255 HydrophobicContact CG-CE1 3.89Å; F211-F255 HydrophobicContact CG-CE2 4.29Å; F211-F255 AromaticContact CG-CZ 3.43Å; F211-F255 HydrophobicContact CG-CZ 3.43Å; F211-F255 VanDerWaalsContact CG-CZ 3.43Å; F211-F255 AromaticContact CZ-CE2 3.63Å; F211-F255 HydrophobicContact CZ-CE2 3.63Å; F211-F255 AromaticContact CZ-CZ 3.6Å; F211-F255 HydrophobicContact CZ-CZ 3.6Å; V214-F255 HydrophobicContact CG2-CE1 4.34Å; I217-F255 HydrophobicContact CD1-CB 3.96Å; I217-F255 HydrophobicContact CD1-CD1 3.53Å; I217-F255 HydrophobicContact CD1-CD2 3.43Å; I217-F255 VanDerWaalsContact CD1-CD2 3.43Å; I217-F255 HydrophobicContact CD1-CE1 3.7Å; I217-F255 HydrophobicContact CD1-CE2 3.61Å; I217-F255 HydrophobicContact CD1-CG 3.37Å; I217-F255 HydrophobicContact CD1-CZ 3.7Å; I217-F255 HydrophobicContact CG1-CE1 4.49Å; I249-F255 HydrophobicContact CD1-CE2 4.3Å; I249-F255 HydrophobicContact CG2-CD2 4.1Å; I249-F255 HydrophobicContact CG2-CE2 4.15Å; H252-F255 HydrophobicContact CB-CD2 3.77Å; H252-F255 HydrophobicContact CB-CE2 4.45Å; H252-F255 HydrophobicContact CB-CG 4.49Å; H252-F255 CarbonylContact O-C 3.56Å; H252-F255 PolarHBondContact O-N 3.01Å; R253-F255 PolarHBondContact O-N 3.46Å; F255-T257 VanDerWaalsContact C-N 3.29Å; F255-T257 PolarHBondContact O-N 3.11Å; F255-T258 HydrophobicContact CD1-CG2 4.48Å; F255-K313 PolarHBondContact O-NZ 3.3Å
256	A	90.6	Very high	95.6	Very high	28 Å²	28	35.5 Å²	35.5	23%	0.231	18%	0.179	C	C	.	.	S	Bend	trans	-56.7	-44.7	-178.9	0	0	0	0	0	111.9	H252 R253	H252-A256 PolarHBondContact O-N 2.94Å; R253-A256 WeakPolarHBondContact O-CB 3.4Å; R253-A256 PolarHBondContact O-N 3.47Å
257	T	88.5	Confident	95.6	Very high	135 Å²	135	38.1 Å²	38.1	83%	0.828	19%	0.191	S	C	*	.	S	Bend	trans	-106.5	-6.8	-179	56.2	0	0	0	0	113.1	F255	F255-T257 VanDerWaalsContact C-N 3.29Å; F255-T257 PolarHBondContact O-N 3.11Å
258	T	92.3	Very high	95.5	Very high	12 Å²	12	38.4 Å²	38.4	7%	0.074	19%	0.192	C	C	.	.	S	Bend	trans	-73.9	129.5	179.4	-53.7	0	0	0	0	110.8	V214 I217 F255 I260 K313	V214-T258 HydrophobicContact CB-CG2 4.16Å; V214-T258 HydrophobicContact CG1-CG2 3.77Å; V214-T258 WeakPolarHBondContact O-CG2 3.23Å; I217-T258 HydrophobicContact CD1-CG2 4.11Å; I217-T258 HydrophobicContact CG1-CG2 3.91Å; F255-T258 HydrophobicContact CD1-CG2 4.48Å; T258-I260 WeakPolarHBondContact O-CG1 3.41Å; T258-K313 VanDerWaalsContact O-CD 3.26Å; T258-K313 WeakPolarHBondContact O-CD 3.29Å
259	S	93.1	Very high	95.5	Very high	17 Å²	17	37 Å²	37	12%	0.119	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.1	140.7	176.1	-43.7	0	0	0	0	111.3	C216 I217 E342	C216-S259 WeakPolarHBondContact CA-O 3.28Å; I217-S259 PolarHBondContact N-O 3.37Å; S259-E342 WeakPolarHBondContact CB-OE2 3.48Å; S259-E342 VanDerWaalsContact OG-CD 3.26Å; S259-E342 PolarHBondContact OG-OE2 3.09Å
260	I	95.8	Very high	95.6	Very high	1 Å²	1	36.8 Å²	36.8	1%	0.005	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	127.2	-176.8	-54.3	-174.1	0	0	0	109.6	I217 F246 C250 T258 K313 I315 Y316	I217-I260 HydrophobicContact CB-CG1 4.28Å; I217-I260 HydrophobicContact CD1-CD1 4.44Å; I217-I260 HydrophobicContact CD1-CG1 4.4Å; I217-I260 WeakPolarHBondContact O-CA 3.11Å; F246-I260 HydrophobicContact CE2-CG2 4.22Å; C250-I260 HydrophobicContact CB-CD1 4.01Å; T258-I260 WeakPolarHBondContact O-CG1 3.41Å; I260-K313 VanDerWaalsContact CD1-NZ 3.33Å; I260-K313 HydrophobicContact CG1-CD 4.48Å; I260-I315 HydrophobicContact CB-CG1 4.36Å; I260-I315 HydrophobicContact CG2-CG2 4.38Å; I260-Y316 PolarHBondContact O-N 3.16Å
261	V	97.4	Very high	95.7	Very high	2 Å²	2	41 Å²	41	1%	0.012	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	131.4	171.1	-173.1	0	0	0	0	109.2	I217 I218 F219 F263 Y316 V335	I217-V261 PolarHBondContact O-N 3.31Å; I218-V261 CarbonylContact C-O 3.53Å; I218-V261 WeakPolarHBondContact CA-O 3.45Å; F219-V261 PolarHBondContact N-O 3.01Å; V261-F263 HydrophobicContact CG1-CD1 3.87Å; V261-F263 HydrophobicContact CG1-CE1 3.62Å; V261-Y316 CarbonylContact C-O 3.41Å; V261-Y316 WeakPolarHBondContact CA-O 3.29Å; V261-V335 HydrophobicContact CB-CG2 4.32Å; V261-V335 HydrophobicContact CG1-CG2 3.79Å; V261-V335 HydrophobicContact CG2-CG1 4.16Å; V261-V335 HydrophobicContact CG2-CG2 4.06Å
262	L	98.5	Very high	95.7	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	114.7	176.1	175.9	65.3	0	0	0	110.4	F219 A221 F246 L264 F303 L304 I315 Y316 S317 H318	F219-L262 HydrophobicContact CD1-CD1 3.86Å; F219-L262 CarbonylContact O-C 3.58Å; F219-L262 WeakPolarHBondContact O-CA 3.37Å; A221-L262 HydrophobicContact CB-CD1 4.44Å; F246-L262 HydrophobicContact CD2-CD1 4.43Å; F246-L262 HydrophobicContact CE2-CD1 4.18Å; L262-L264 HydrophobicContact CD1-CD2 4.33Å; L262-L264 HydrophobicContact CD2-CD2 4.04Å; L262-L264 HydrophobicContact CD2-CG 4.17Å; L262-L264 HydrophobicContact CG-CD2 4.16Å; L262-L264 HydrophobicContact CG-CG 4.14Å; L262-F303 HydrophobicContact CD1-CD1 4.12Å; L262-F303 HydrophobicContact CD1-CG 4.32Å; L262-F303 HydrophobicContact CD2-CB 3.43Å; L262-F303 VanDerWaalsContact CD2-CB 3.43Å; L262-F303 HydrophobicContact CD2-CD1 4.43Å; L262-F303 HydrophobicContact CD2-CD2 4.5Å; L262-F303 HydrophobicContact CD2-CG 3.9Å; L262-L304 HydrophobicContact CD2-CD2 4.5Å; L262-I315 HydrophobicContact CB-CG2 4.1Å; L262-Y316 PolarHBondContact N-O 2.93Å; L262-S317 CarbonylContact O-C 3.57Å; L262-S317 VanDerWaalsContact O-CA 3.26Å; L262-S317 WeakPolarHBondContact O-CA 3.44Å; L262-H318 PolarHBondContact O-N 3.41Å
263	F	98.8	Very high	95.7	Very high	4 Å²	4	43 Å²	43	2%	0.018	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	111.2	168	-74.7	7.3	0	0	0	109.5	I45 I218 F219 I220 A221 V261 N265 H318 T320 V331 V335	I45-F263 HydrophobicContact CD1-CD2 4.42Å; I45-F263 HydrophobicContact CD1-CE2 4.36Å; I45-F263 HydrophobicContact CG1-CD2 4.48Å; I218-F263 HydrophobicContact CD1-CZ 4.39Å; I218-F263 HydrophobicContact CG2-CD1 4.04Å; I218-F263 HydrophobicContact CG2-CD2 3.56Å; I218-F263 HydrophobicContact CG2-CE1 4.08Å; I218-F263 HydrophobicContact CG2-CE2 3.62Å; I218-F263 HydrophobicContact CG2-CG 3.77Å; I218-F263 HydrophobicContact CG2-CZ 3.87Å; F219-F263 PolarHBondContact O-N 2.86Å; I220-F263 WeakPolarHBondContact CA-O 3.49Å; I220-F263 HydrophobicContact CB-CB 4.42Å; I220-F263 HydrophobicContact CD1-CD2 4.49Å; I220-F263 HydrophobicContact CG1-CB 4.15Å; I220-F263 HydrophobicContact CG1-CD2 4.35Å; I220-F263 HydrophobicContact CG2-CB 4.17Å; A221-F263 PolarHBondContact N-O 2.77Å; V261-F263 HydrophobicContact CG1-CD1 3.87Å; V261-F263 HydrophobicContact CG1-CE1 3.62Å; F263-N265 PolarHBondContact O-N 3.46Å; F263-H318 HydrophobicContact CD1-CB 4.32Å; F263-T320 HydrophobicContact CB-CG2 4.2Å; F263-T320 HydrophobicContact CD1-CG2 4.19Å; F263-T320 HydrophobicContact CD2-CG2 4.05Å; F263-T320 HydrophobicContact CG-CG2 3.89Å; F263-V331 HydrophobicContact CD1-CG1 4.13Å; F263-V331 HydrophobicContact CE1-CG1 3.34Å; F263-V331 HydrophobicContact CE2-CG1 4.29Å; F263-V331 HydrophobicContact CZ-CG1 3.45Å; F263-V331 VanDerWaalsContact CZ-CG1 3.45Å; F263-V335 HydrophobicContact CE1-CG2 3.85Å; F263-V335 HydrophobicContact CZ-CG2 4.04Å
264	L	98.8	Very high	96	Very high	1 Å²	1	34 Å²	34	1%	0.005	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87	88.5	169.1	-66.2	172.8	0	0	0	107.6	A221 L223 L262 I299 K300 F303 H318 M319 T320	A221-L264 HydrophobicContact CB-CD2 4.33Å; A221-L264 CarbonylContact O-C 3.28Å; L223-L264 HydrophobicContact CD1-CB 3.96Å; L223-L264 HydrophobicContact CD2-CB 4Å; L223-L264 HydrophobicContact CD2-CD2 4.12Å; L223-L264 HydrophobicContact CD2-CG 4.45Å; L223-L264 HydrophobicContact CG-CB 3.9Å; L262-L264 HydrophobicContact CD1-CD2 4.33Å; L262-L264 HydrophobicContact CD2-CD2 4.04Å; L262-L264 HydrophobicContact CD2-CG 4.17Å; L262-L264 HydrophobicContact CG-CD2 4.16Å; L262-L264 HydrophobicContact CG-CG 4.14Å; L264-I299 HydrophobicContact CD2-CG2 4.39Å; L264-K300 HydrophobicContact CD1-CB 3.5Å; L264-K300 HydrophobicContact CD1-CG 3.97Å; L264-F303 HydrophobicContact CD2-CD2 3.92Å; L264-F303 HydrophobicContact CD2-CE2 4.13Å; L264-H318 PolarHBondContact N-O 3.17Å; L264-M319 HydrophobicContact CB-SD 3.59Å; L264-M319 VanDerWaalsContact CB-SD 3.59Å; L264-M319 HydrophobicContact CD1-CE 3.76Å; L264-M319 HydrophobicContact CD1-SD 3.69Å; L264-M319 HydrophobicContact CG-SD 4.3Å; L264-M319 WeakPolarHBondContact O-CA 3.16Å; L264-T320 PolarHBondContact O-N 2.83Å; L264-T320 PolarHBondContact O-OG1 3.26Å
265	N	98.7	Very high	96.1	Very high	2 Å²	2	33.8 Å²	33.8	1%	0.011	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	168.8	-167.6	-169.1	34	0	0	0	113.2	S40 I220 A221 L223 F263 K267 T320 A322	S40-N265 PolarHBondContact O-ND2 3.17Å; I220-N265 HydrophobicContact CG2-CB 3.65Å; A221-N265 PolarHBondContact O-N 3.01Å; L223-N265 WeakPolarHBondContact CB-O 3.32Å; L223-N265 PolarHBondContact N-O 3.38Å; F263-N265 PolarHBondContact O-N 3.46Å; N265-K267 VanDerWaalsContact C-N 3.28Å; N265-K267 PolarHBondContact O-N 3.28Å; N265-T320 CarbonylContact C-O 3.59Å; N265-T320 VanDerWaalsContact CA-O 3.32Å; N265-T320 WeakPolarHBondContact CA-O 3.34Å; N265-T320 WeakPolarHBondContact CA-OG1 3.05Å; N265-T320 WeakPolarHBondContact CB-OG1 3.44Å; N265-T320 PolarHBondContact N-OG1 2.92Å; N265-T320 PolarHBondContact OD1-O 3.25Å; N265-T320 PolarHBondContact OD1-OG1 3.13Å; N265-A322 PolarHBondContact OD1-N 3.46Å
266	K	98.2	Very high	96.2	Very high	27 Å²	27	41.2 Å²	41.2	12%	0.117	21%	0.207	C	C	.	.			trans	60.1	38.4	-176.9	-51.6	-175.5	-175.4	177.8	0	112.1	E39 D146 A222 S224 D268 V269 F270 T320	E39-K266 WeakPolarHBondContact O-CE 3.34Å; E39-K266 PolarHBondContact O-NZ 3.25Å; D146-K266 VanDerWaalsContact OD2-CD 3.31Å; D146-K266 WeakPolarHBondContact OD2-CD 3.47Å; D146-K266 VanDerWaalsContact OD2-CE 3.27Å; D146-K266 WeakPolarHBondContact OD2-CE 3.3Å; D146-K266 IonicContact OD2-NZ 2.66Å; D146-K266 PolarHBondContact OD2-NZ 2.89Å; A222-K266 HydrophobicContact CB-CD 3.95Å; A222-K266 HydrophobicContact CB-CG 4.47Å; S224-K266 VanDerWaalsContact OG-CD 3.32Å; S224-K266 WeakPolarHBondContact OG-CD 3.48Å; K266-D268 VanDerWaalsContact C-OD1 3.27Å; K266-D268 WeakPolarHBondContact CA-OD1 3.44Å; K266-D268 PolarHBondContact O-N 3.21Å; K266-V269 HydrophobicContact CB-CB 4.34Å; K266-V269 HydrophobicContact CB-CG2 4.41Å; K266-V269 PolarHBondContact O-N 3Å; K266-F270 WeakPolarHBondContact O-CB 3.44Å; K266-F270 PolarHBondContact O-N 3.34Å; K266-T320 PolarHBondContact N-O 2.67Å; K266-T320 VanDerWaalsContact N-O 3.07Å
267	K	98.1	Very high	96.4	Very high	54 Å²	54	40.8 Å²	40.8	24%	0.235	20%	0.203	C	C	.	.	H	α-helix	trans	-58.4	-30.7	177.9	74.3	-179.5	-177.7	177.9	0	112.3	L223 N265 F271 Y292 M319 T320 C321 N327	L223-K267 HydrophobicContact CD1-CB 4.15Å; N265-K267 VanDerWaalsContact C-N 3.28Å; N265-K267 PolarHBondContact O-N 3.28Å; K267-F271 VanDerWaalsContact O-CB 3.24Å; K267-F271 WeakPolarHBondContact O-CB 3.15Å; K267-F271 PolarHBondContact O-N 3.12Å; K267-Y292 HydrophobicContact CB-CE2 3.97Å; K267-M319 HydrophobicContact CD-CB 4.15Å; K267-T320 WeakPolarHBondContact CB-O 3.36Å; K267-T320 WeakPolarHBondContact CG-O 3.4Å; K267-T320 PolarHBondContact N-O 2.79Å; K267-T320 VanDerWaalsContact N-O 3.1Å; K267-C321 HydrophobicContact CG-CB 4.11Å; K267-N327 PolarHBondContact NZ-ND2 3.21Å
268	D	97.2	Very high	96.8	Very high	55 Å²	55	37.8 Å²	37.8	29%	0.294	18%	0.179	S	C	.	.	H	α-helix	trans	-65.7	-48.4	175.9	60.6	-44.6	0	0	0	111.9	K266 F271 E272 C321	K266-D268 VanDerWaalsContact C-OD1 3.27Å; K266-D268 WeakPolarHBondContact CA-OD1 3.44Å; K266-D268 PolarHBondContact O-N 3.21Å; D268-F271 WeakPolarHBondContact O-CB 3.49Å; D268-F271 PolarHBondContact O-N 3.29Å; D268-E272 PolarHBondContact O-N 3.44Å; D268-C321 VanDerWaalsContact CG-SG 3.58Å
269	V	97	Very high	97.1	Very high	34 Å²	34	37.2 Å²	37.2	21%	0.206	18%	0.176	C	C	.	.	H	α-helix	trans	-68.5	-40.9	177.1	-175.5	0	0	0	0	110.3	K266 F271 E272 K273	K266-V269 HydrophobicContact CB-CB 4.34Å; K266-V269 HydrophobicContact CB-CG2 4.41Å; K266-V269 PolarHBondContact O-N 3Å; V269-F271 VanDerWaalsContact C-N 3.34Å; V269-F271 PolarHBondContact O-N 3.11Å; V269-E272 PolarHBondContact O-N 2.78Å; V269-K273 HydrophobicContact CG1-CD 3.85Å; V269-K273 HydrophobicContact CG1-CG 4.32Å; V269-K273 WeakPolarHBondContact O-CG 3.19Å; V269-K273 PolarHBondContact O-N 3.01Å
270	F	98.1	Very high	97.3	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-60.3	-42.6	175.8	177.7	-110.1	0	0	0	112.3	L223 Y226 K266 E272 K273 I274 Y292 A295 I299	L223-F270 HydrophobicContact CB-CB 3.64Å; L223-F270 HydrophobicContact CB-CD1 4.19Å; L223-F270 HydrophobicContact CB-CD2 3.98Å; L223-F270 HydrophobicContact CB-CG 3.67Å; L223-F270 HydrophobicContact CD1-CD1 4.25Å; L223-F270 HydrophobicContact CD1-CG 4.49Å; L223-F270 WeakPolarHBondContact O-CD2 3.31Å; Y226-F270 AromaticContact CD1-CD2 3.84Å; Y226-F270 HydrophobicContact CD1-CD2 3.84Å; Y226-F270 AromaticContact CD1-CE2 3.82Å; Y226-F270 HydrophobicContact CD1-CE2 3.82Å; Y226-F270 AromaticContact CE1-CD2 3.81Å; Y226-F270 HydrophobicContact CE1-CD2 3.81Å; Y226-F270 AromaticContact CE1-CE2 3.83Å; Y226-F270 HydrophobicContact CE1-CE2 3.83Å; K266-F270 WeakPolarHBondContact O-CB 3.44Å; K266-F270 PolarHBondContact O-N 3.34Å; F270-E272 PolarHBondContact O-N 3.42Å; F270-K273 PolarHBondContact O-N 3.35Å; F270-I274 HydrophobicContact CE2-CB 4.23Å; F270-I274 HydrophobicContact CE2-CD1 3.9Å; F270-I274 HydrophobicContact CE2-CG1 4.32Å; F270-I274 HydrophobicContact CZ-CB 4.18Å; F270-I274 HydrophobicContact CZ-CD1 3.91Å; F270-I274 HydrophobicContact CZ-CG1 4.03Å; F270-I274 WeakPolarHBondContact O-CB 3.48Å; F270-I274 WeakPolarHBondContact O-CG2 3.24Å; F270-I274 PolarHBondContact O-N 2.69Å; F270-Y292 AromaticContact CD1-CD2 3.62Å; F270-Y292 HydrophobicContact CD1-CD2 3.62Å; F270-Y292 AromaticContact CD1-CE2 3.9Å; F270-Y292 HydrophobicContact CD1-CE2 3.9Å; F270-Y292 AromaticContact CE1-CD2 3.98Å; F270-Y292 HydrophobicContact CE1-CD2 3.98Å; F270-Y292 HydrophobicContact CE1-CE2 4.47Å; F270-A295 HydrophobicContact CE1-CB 4.46Å; F270-A295 HydrophobicContact CZ-CB 3.78Å; F270-I299 HydrophobicContact CE2-CD1 3.9Å; F270-I299 HydrophobicContact CZ-CD1 3.99Å
271	F	98	Very high	97.3	Very high	89 Å²	89	43.4 Å²	43.4	39%	0.39	21%	0.21	S	C	.	.	H	α-helix	trans	-55.8	-37	178.2	179.9	-98.2	0	0	0	112.7	K267 D268 V269 K275 Y292	K267-F271 VanDerWaalsContact O-CB 3.24Å; K267-F271 WeakPolarHBondContact O-CB 3.15Å; K267-F271 PolarHBondContact O-N 3.12Å; D268-F271 WeakPolarHBondContact O-CB 3.49Å; D268-F271 PolarHBondContact O-N 3.29Å; V269-F271 VanDerWaalsContact C-N 3.34Å; V269-F271 PolarHBondContact O-N 3.11Å; F271-K275 VanDerWaalsContact O-CE 3.25Å; F271-K275 WeakPolarHBondContact O-CE 3.4Å; F271-Y292 HydrophobicContact CB-CD2 3.91Å; F271-Y292 HydrophobicContact CB-CE2 4.41Å; F271-Y292 HydrophobicContact CD2-CD1 4.33Å; F271-Y292 AromaticContact CD2-CD2 3.87Å; F271-Y292 HydrophobicContact CD2-CD2 3.87Å; F271-Y292 AromaticContact CD2-CG 3.68Å; F271-Y292 HydrophobicContact CD2-CG 3.68Å; F271-Y292 HydrophobicContact CE2-CG 4.46Å; F271-Y292 HydrophobicContact CG-CD2 4.41Å
272	E	95.7	Very high	97.4	Very high	93 Å²	93	43.4 Å²	43.4	44%	0.435	21%	0.21	S	C	.	.	H	α-helix	trans	-81.5	-39.1	175.9	-65.6	-53.2	140.5	0	0	113.2	D268 V269 F270 K275	D268-E272 PolarHBondContact O-N 3.44Å; V269-E272 PolarHBondContact O-N 2.78Å; F270-E272 PolarHBondContact O-N 3.42Å; E272-K275 PolarHBondContact O-N 2.92Å; E272-K275 IonicContact OE1-NZ 3.85Å; E272-K275 PolarHBondContact OE1-NZ 3.33Å; E272-K275 IonicContact OE2-NZ 2.77Å; E272-K275 PolarHBondContact OE2-NZ 3.2Å
273	K	96.5	Very high	97.3	Very high	35 Å²	35	43.9 Å²	43.9	15%	0.152	21%	0.212	C	C	.	.	H	α-helix	trans	-68.2	-39.5	-177.9	-71.8	-177.5	69.5	173.5	0	112.8	S224 Y226 D227 V269 F270 K275 K276 A277	S224-K273 PolarHBondContact O-NZ 2.96Å; Y226-K273 HydrophobicContact CE1-CB 4.11Å; Y226-K273 VanDerWaalsContact OH-C 3.3Å; Y226-K273 PolarHBondContact OH-O 2.75Å; D227-K273 VanDerWaalsContact CG-NZ 3.31Å; D227-K273 WeakPolarHBondContact OD1-CE 3.38Å; D227-K273 IonicContact OD1-NZ 3.92Å; D227-K273 PolarHBondContact OD1-NZ 3.04Å; D227-K273 WeakPolarHBondContact OD2-CE 3.29Å; D227-K273 IonicContact OD2-NZ 3.82Å; D227-K273 PolarHBondContact OD2-NZ 3.24Å; V269-K273 HydrophobicContact CG1-CD 3.85Å; V269-K273 HydrophobicContact CG1-CG 4.32Å; V269-K273 WeakPolarHBondContact O-CG 3.19Å; V269-K273 PolarHBondContact O-N 3.01Å; F270-K273 PolarHBondContact O-N 3.35Å; K273-K275 PolarHBondContact O-N 3.33Å; K273-K275 VanDerWaalsContact O-N 3.14Å; K273-K276 PolarHBondContact O-N 3.1Å; K273-A277 PolarHBondContact O-N 3.44Å
274	I	97.6	Very high	97.3	Very high	2 Å²	2	48.6 Å²	48.6	1%	0.01	24%	0.243	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.1	-27.9	-178.5	-160.2	63.5	0	0	0	111.8	Y226 F270 K276 L279 N290 A295	Y226-I274 HydrophobicContact CE2-CD1 4.38Å; Y226-I274 WeakPolarHBondContact OH-CA 3.49Å; Y226-I274 PolarHBondContact OH-N 2.76Å; F270-I274 HydrophobicContact CE2-CB 4.23Å; F270-I274 HydrophobicContact CE2-CD1 3.9Å; F270-I274 HydrophobicContact CE2-CG1 4.32Å; F270-I274 HydrophobicContact CZ-CB 4.18Å; F270-I274 HydrophobicContact CZ-CD1 3.91Å; F270-I274 HydrophobicContact CZ-CG1 4.03Å; F270-I274 WeakPolarHBondContact O-CB 3.48Å; F270-I274 WeakPolarHBondContact O-CG2 3.24Å; F270-I274 PolarHBondContact O-N 2.69Å; I274-K276 PolarHBondContact O-N 3.29Å; I274-L279 HydrophobicContact CD1-CB 4.17Å; I274-N290 WeakPolarHBondContact CD1-OD1 3.44Å; I274-N290 PolarHBondContact O-ND2 2.91Å; I274-A295 HydrophobicContact CD1-CB 3.71Å; I274-A295 HydrophobicContact CG1-CB 3.87Å
275	K	96.1	Very high	97.1	Very high	118 Å²	118	55.6 Å²	55.6	51%	0.513	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.5	-21.7	174.8	-59	171.5	-167.2	162.2	0	113.6	F271 E272 K273	F271-K275 VanDerWaalsContact O-CE 3.25Å; F271-K275 WeakPolarHBondContact O-CE 3.4Å; E272-K275 PolarHBondContact O-N 2.92Å; E272-K275 IonicContact OE1-NZ 3.85Å; E272-K275 PolarHBondContact OE1-NZ 3.33Å; E272-K275 IonicContact OE2-NZ 2.77Å; E272-K275 PolarHBondContact OE2-NZ 3.2Å; K273-K275 PolarHBondContact O-N 3.33Å; K273-K275 VanDerWaalsContact O-N 3.14Å
276	K	94.9	Very high	97.1	Very high	157 Å²	157	56.3 Å²	56.3	68%	0.683	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.2	-36.1	-171.9	-58.6	-177.2	-178.3	-174.3	0	113	K273 I274	K273-K276 PolarHBondContact O-N 3.1Å; I274-K276 PolarHBondContact O-N 3.29Å
277	A	95.6	Very high	97	Very high	19 Å²	19	62.7 Å²	62.7	16%	0.157	32%	0.319	C	S	.	.	S	Bend	trans	-126.3	126.1	-174.8	0	0	0	0	0	110.6	Y226 K273 I281 N290	Y226-A277 HydrophobicContact CE2-CB 4.41Å; Y226-A277 PolarHBondContact OH-O 2.76Å; K273-A277 PolarHBondContact O-N 3.44Å; A277-I281 HydrophobicContact CB-CD1 3.94Å; A277-N290 PolarHBondContact O-ND2 3.41Å
278	H	97.3	Very high	96.8	Very high	71 Å²	71	61 Å²	61	33%	0.329	32%	0.317	S	S	.	.			trans	-68.2	140.9	-177.7	-160.7	-94	0	0	0	112.2	S280 I281 Y286 N290	H278-S280 VanDerWaalsContact ND1-CB 3.29Å; H278-S280 WeakPolarHBondContact ND1-CB 3.43Å; H278-S280 PolarHBondContact ND1-N 3.32Å; H278-S280 VanDerWaalsContact ND1-N 3.17Å; H278-S280 PolarHBondContact ND1-OG 3.38Å; H278-S280 PolarHBondContact O-N 3.5Å; H278-S280 VanDerWaalsContact O-N 3.07Å; H278-I281 WeakPolarHBondContact O-CG1 3.39Å; H278-I281 PolarHBondContact O-N 3.19Å; H278-I281 VanDerWaalsContact O-N 3.16Å; H278-Y286 AromaticContact CE1-CD1 3.89Å; H278-N290 WeakPolarHBondContact CA-ND2 3.43Å; H278-N290 WeakPolarHBondContact CA-OD1 3.37Å; H278-N290 VanDerWaalsContact CD2-CB 3.48Å; H278-N290 WeakPolarHBondContact CD2-CB 3.36Å; H278-N290 VanDerWaalsContact CD2-CG 3.42Å
279	L	98.2	Very high	96.8	Very high	0 Å²	0	62 Å²	62	0%	0	33%	0.326	C	S	.	.	G	3₁₀ helix	trans	-57.5	-25.7	178.6	-174.4	64.1	0	0	0	112.7	Y226 I274 I281 C282 F283 Y286 N290 A295 Y298 I299	Y226-L279 HydrophobicContact CD2-CD1 4.02Å; Y226-L279 HydrophobicContact CG-CD1 4.26Å; I274-L279 HydrophobicContact CD1-CB 4.17Å; L279-I281 PolarHBondContact O-N 3.2Å; L279-I281 VanDerWaalsContact O-N 3.09Å; L279-C282 PolarHBondContact O-N 2.93Å; L279-F283 HydrophobicContact CD1-CD2 3.69Å; L279-F283 HydrophobicContact CD1-CE2 4Å; L279-F283 HydrophobicContact CD2-CD2 4.25Å; L279-F283 HydrophobicContact CG-CD2 3.8Å; L279-F283 PolarHBondContact O-N 2.95Å; L279-Y286 HydrophobicContact CB-CD1 3.69Å; L279-Y286 HydrophobicContact CB-CE1 3.92Å; L279-Y286 HydrophobicContact CB-CG 4.4Å; L279-Y286 HydrophobicContact CD2-CD1 3.78Å; L279-Y286 HydrophobicContact CD2-CD2 3.96Å; L279-Y286 HydrophobicContact CD2-CE1 3.87Å; L279-Y286 HydrophobicContact CD2-CE2 4.06Å; L279-Y286 HydrophobicContact CD2-CG 3.79Å; L279-Y286 HydrophobicContact CG-CD1 4.1Å; L279-Y286 HydrophobicContact CG-CE1 4.45Å; L279-Y286 HydrophobicContact CG-CG 4.33Å; L279-N290 PolarHBondContact N-OD1 3.11Å; L279-A295 HydrophobicContact CB-CB 4.37Å; L279-A295 HydrophobicContact CD2-CB 3.84Å; L279-Y298 HydrophobicContact CD2-CD1 3.74Å; L279-Y298 HydrophobicContact CD2-CG 4.21Å; L279-I299 HydrophobicContact CD1-CD1 3.84Å; L279-I299 HydrophobicContact CD1-CG1 4.03Å; L279-I299 HydrophobicContact CD2-CG1 4.46Å
280	S	97.7	Very high	96.7	Very high	44 Å²	44	62.4 Å²	62.4	31%	0.308	33%	0.327	S	S	.	.	G	3₁₀ helix	trans	-62.2	-15.2	179.4	63.9	0	0	0	0	115.1	H278 C282 F283 P284	H278-S280 VanDerWaalsContact ND1-CB 3.29Å; H278-S280 WeakPolarHBondContact ND1-CB 3.43Å; H278-S280 PolarHBondContact ND1-N 3.32Å; H278-S280 VanDerWaalsContact ND1-N 3.17Å; H278-S280 PolarHBondContact ND1-OG 3.38Å; H278-S280 PolarHBondContact O-N 3.5Å; H278-S280 VanDerWaalsContact O-N 3.07Å; S280-C282 PolarHBondContact O-N 2.67Å; S280-F283 VanDerWaalsContact CA-O 3.29Å; S280-F283 WeakPolarHBondContact CA-O 3.44Å; S280-F283 CarbonylContact O-C 3.59Å; S280-P284 WeakPolarHBondContact O-CA 3.09Å
281	I	96.1	Very high	96.7	Very high	105 Å²	105	64.9 Å²	64.9	54%	0.538	34%	0.342	S	S	.	.	G	3₁₀ helix	trans	-59.3	-38.4	168.7	-65.1	170.4	0	0	0	110.7	A277 H278 L279	A277-I281 HydrophobicContact CB-CD1 3.94Å; H278-I281 WeakPolarHBondContact O-CG1 3.39Å; H278-I281 PolarHBondContact O-N 3.19Å; H278-I281 VanDerWaalsContact O-N 3.16Å; L279-I281 PolarHBondContact O-N 3.2Å; L279-I281 VanDerWaalsContact O-N 3.09Å
282	C	97.8	Very high	96.7	Very high	2 Å²	2	62.9 Å²	62.9	1%	0.014	33%	0.332	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.6	-39.8	177.2	-169.8	0	0	0	0	112.1	Y226 H240 L279 S280 P284	Y226-C282 HydrophobicContact CD2-CB 4.36Å; Y226-C282 VanDerWaalsContact O-CB 3.23Å; Y226-C282 WeakPolarHBondContact O-CB 3.43Å; H240-C282 PolarHBondContact NE2-O 3.32Å; L279-C282 PolarHBondContact O-N 2.93Å; S280-C282 PolarHBondContact O-N 2.67Å; C282-P284 WeakPolarHBondContact O-CD 3.16Å
283	F	98.1	Very high	96.8	Very high	10 Å²	10	64.2 Å²	64.2	4%	0.044	34%	0.339	C	S	.	.			trans	-124.5	83	-173.8	-59.7	-81.4	0	0	0	109.9	M239 L243 L279 S280 D285 Y286 Y298 I299 Q302	M239-F283 HydrophobicContact CG-CE2 4.07Å; M239-F283 HydrophobicContact CG-CZ 3.79Å; L243-F283 HydrophobicContact CD1-CE1 3.77Å; L243-F283 HydrophobicContact CD1-CZ 3.9Å; L279-F283 HydrophobicContact CD1-CD2 3.69Å; L279-F283 HydrophobicContact CD1-CE2 4Å; L279-F283 HydrophobicContact CD2-CD2 4.25Å; L279-F283 HydrophobicContact CG-CD2 3.8Å; L279-F283 PolarHBondContact O-N 2.95Å; S280-F283 VanDerWaalsContact CA-O 3.29Å; S280-F283 WeakPolarHBondContact CA-O 3.44Å; S280-F283 CarbonylContact O-C 3.59Å; F283-D285 PolarHBondContact O-N 3.22Å; F283-Y286 VanDerWaalsContact O-CB 3.24Å; F283-Y286 WeakPolarHBondContact O-CB 3.41Å; F283-Y286 PolarHBondContact O-N 3.42Å; F283-Y298 HydrophobicContact CB-CE1 3.78Å; F283-Y298 AromaticContact CD1-CE1 3.87Å; F283-Y298 HydrophobicContact CD1-CE1 3.87Å; F283-Y298 HydrophobicContact CD2-CD1 4.41Å; F283-Y298 HydrophobicContact CD2-CE1 4.15Å; F283-Y298 HydrophobicContact CE1-CE1 4.5Å; F283-Y298 HydrophobicContact CG-CD1 4.37Å; F283-Y298 AromaticContact CG-CE1 3.67Å; F283-Y298 HydrophobicContact CG-CE1 3.67Å; F283-I299 HydrophobicContact CE2-CG1 3.92Å; F283-Q302 HydrophobicContact CD1-CG 4.28Å; F283-Q302 HydrophobicContact CE1-CB 4.37Å; F283-Q302 HydrophobicContact CE1-CG 3.83Å; F283-Q302 HydrophobicContact CZ-CG 4.28Å
284	P	97.4	Very high	96.9	Very high	102 Å²	102	66 Å²	66	66%	0.662	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.5	-28.3	-173.4	-29.2	36.6	0	0	0	114.8	S280 C282 Y286	S280-P284 WeakPolarHBondContact O-CA 3.09Å; C282-P284 WeakPolarHBondContact O-CD 3.16Å; P284-Y286 VanDerWaalsContact C-N 3.28Å; P284-Y286 PolarHBondContact O-N 2.88Å
285	D	96	Very high	96.9	Very high	149 Å²	149	66 Å²	66	80%	0.797	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.1	-3.6	178.3	-58.4	-37.4	0	0	0	113.9	F283 D287	F283-D285 PolarHBondContact O-N 3.22Å; D285-D287 PolarHBondContact O-N 3.49Å
286	Y	97.6	Very high	97.1	Very high	17 Å²	17	60.4 Å²	60.4	7%	0.067	33%	0.326	C	S	.	.			trans	-77.6	113.5	177	-179	-104.1	0	0	0	111.5	H278 L279 F283 P284 G288 P289 D294 A295 Y298	H278-Y286 AromaticContact CE1-CD1 3.89Å; L279-Y286 HydrophobicContact CB-CD1 3.69Å; L279-Y286 HydrophobicContact CB-CE1 3.92Å; L279-Y286 HydrophobicContact CB-CG 4.4Å; L279-Y286 HydrophobicContact CD2-CD1 3.78Å; L279-Y286 HydrophobicContact CD2-CD2 3.96Å; L279-Y286 HydrophobicContact CD2-CE1 3.87Å; L279-Y286 HydrophobicContact CD2-CE2 4.06Å; L279-Y286 HydrophobicContact CD2-CG 3.79Å; L279-Y286 HydrophobicContact CG-CD1 4.1Å; L279-Y286 HydrophobicContact CG-CE1 4.45Å; L279-Y286 HydrophobicContact CG-CG 4.33Å; F283-Y286 VanDerWaalsContact O-CB 3.24Å; F283-Y286 WeakPolarHBondContact O-CB 3.41Å; F283-Y286 PolarHBondContact O-N 3.42Å; P284-Y286 VanDerWaalsContact C-N 3.28Å; P284-Y286 PolarHBondContact O-N 2.88Å; Y286-G288 VanDerWaalsContact CE1-O 3.24Å; Y286-G288 WeakPolarHBondContact CE1-O 3.45Å; Y286-P289 PolarHBondContact OH-O 2.91Å; Y286-D294 WeakPolarHBondContact OH-CB 3.35Å; Y286-A295 PolarHBondContact OH-N 3.31Å; Y286-Y298 AromaticContact CD2-CD1 3.88Å; Y286-Y298 HydrophobicContact CD2-CD1 3.88Å; Y286-Y298 AromaticContact CD2-CD2 3.37Å; Y286-Y298 HydrophobicContact CD2-CD2 3.37Å; Y286-Y298 HydrophobicContact CD2-CE1 4.14Å; Y286-Y298 AromaticContact CD2-CE2 3.65Å; Y286-Y298 HydrophobicContact CD2-CE2 3.65Å; Y286-Y298 AromaticContact CD2-CG 3.47Å; Y286-Y298 HydrophobicContact CD2-CG 3.47Å; Y286-Y298 VanDerWaalsContact CD2-CG 3.47Å; Y286-Y298 HydrophobicContact CE2-CD1 4.39Å; Y286-Y298 AromaticContact CE2-CD2 3.7Å; Y286-Y298 HydrophobicContact CE2-CD2 3.7Å; Y286-Y298 HydrophobicContact CE2-CE2 4.41Å; Y286-Y298 AromaticContact CE2-CG 3.66Å; Y286-Y298 HydrophobicContact CE2-CG 3.66Å; Y286-Y298 HydrophobicContact CG-CG 4.49Å
287	D	95.2	Very high	97.2	Very high	160 Å²	160	57.1 Å²	57.1	86%	0.856	32%	0.316	S	S	*	.			trans	-109.1	5.7	179.3	65.7	-13.7	0	0	0	113.6	D285	D285-D287 PolarHBondContact O-N 3.49Å
288	G	95.3	Very high	97.4	Very high	19 Å²	19	59 Å²	59	20%	0.196	32%	0.319	C	S	.	.	S	Bend	trans	-78.3	172.3	-177.8	0	0	0	0	0	114.7	Y286	Y286-G288 VanDerWaalsContact CE1-O 3.24Å; Y286-G288 WeakPolarHBondContact CE1-O 3.45Å
289	P	96.6	Very high	97.4	Very high	76 Å²	76	55.6 Å²	55.6	49%	0.494	30%	0.303	S	S	.	.			trans	-63.9	138	176.7	-19.4	31.9	0	0	0	112.2	Y286 T291 D294	Y286-P289 PolarHBondContact OH-O 2.91Å; P289-T291 HydrophobicContact CB-CG2 4.04Å; P289-T291 PolarHBondContact O-N 3.38Å; P289-D294 HydrophobicContact CB-CB 4.39Å; P289-D294 VanDerWaalsContact O-CB 3.32Å; P289-D294 WeakPolarHBondContact O-CB 3.38Å
290	N	95.9	Very high	97.4	Very high	43 Å²	43	58.6 Å²	58.6	23%	0.23	32%	0.316	C	S	.	.			trans	-82.1	45.4	-179.1	-154	47.4	0	0	0	113.2	I274 A277 H278 L279	I274-N290 WeakPolarHBondContact CD1-OD1 3.44Å; I274-N290 PolarHBondContact O-ND2 2.91Å; A277-N290 PolarHBondContact O-ND2 3.41Å; H278-N290 WeakPolarHBondContact CA-ND2 3.43Å; H278-N290 WeakPolarHBondContact CA-OD1 3.37Å; H278-N290 VanDerWaalsContact CD2-CB 3.48Å; H278-N290 WeakPolarHBondContact CD2-CB 3.36Å; H278-N290 VanDerWaalsContact CD2-CG 3.42Å; L279-N290 PolarHBondContact N-OD1 3.11Å
291	T	97.6	Very high	97.5	Very high	52 Å²	52	58.8 Å²	58.8	32%	0.319	32%	0.316	S	S	.	.	S	Bend	trans	-90.4	162.3	175.9	74.1	0	0	0	0	110.1	P289 E293 D294 A295	P289-T291 HydrophobicContact CB-CG2 4.04Å; P289-T291 PolarHBondContact O-N 3.38Å; T291-E293 VanDerWaalsContact C-N 3.3Å; T291-E293 PolarHBondContact O-N 2.9Å; T291-D294 WeakPolarHBondContact OG1-CB 3.17Å; T291-D294 VanDerWaalsContact OG1-CG 3.27Å; T291-D294 PolarHBondContact OG1-N 3.04Å; T291-D294 PolarHBondContact OG1-OD2 3.19Å; T291-A295 WeakPolarHBondContact O-CB 3.33Å; T291-A295 PolarHBondContact O-N 3.4Å; T291-A295 VanDerWaalsContact O-N 3.08Å
292	Y	97.9	Very high	97.6	Very high	46 Å²	46	56.2 Å²	56.2	18%	0.18	30%	0.301	C	S	.	.	H	α-helix	trans	-59.9	-42.9	175.6	166.1	-97	0	0	0	111.9	K267 F270 F271 G296	K267-Y292 HydrophobicContact CB-CE2 3.97Å; F270-Y292 AromaticContact CD1-CD2 3.62Å; F270-Y292 HydrophobicContact CD1-CD2 3.62Å; F270-Y292 AromaticContact CD1-CE2 3.9Å; F270-Y292 HydrophobicContact CD1-CE2 3.9Å; F270-Y292 AromaticContact CE1-CD2 3.98Å; F270-Y292 HydrophobicContact CE1-CD2 3.98Å; F270-Y292 HydrophobicContact CE1-CE2 4.47Å; F271-Y292 HydrophobicContact CB-CD2 3.91Å; F271-Y292 HydrophobicContact CB-CE2 4.41Å; F271-Y292 HydrophobicContact CD2-CD1 4.33Å; F271-Y292 AromaticContact CD2-CD2 3.87Å; F271-Y292 HydrophobicContact CD2-CD2 3.87Å; F271-Y292 AromaticContact CD2-CG 3.68Å; F271-Y292 HydrophobicContact CD2-CG 3.68Å; F271-Y292 HydrophobicContact CE2-CG 4.46Å; F271-Y292 HydrophobicContact CG-CD2 4.41Å; Y292-G296 WeakPolarHBondContact O-CA 3.39Å; Y292-G296 PolarHBondContact O-N 2.87Å
293	E	98	Very high	97.6	Very high	122 Å²	122	56.1 Å²	56.1	57%	0.57	30%	0.301	S	S	*	.	H	α-helix	trans	-67.3	-51.5	-177.2	-66.8	73.9	-164.4	0	0	111.5	T291 N297	T291-E293 VanDerWaalsContact C-N 3.3Å; T291-E293 PolarHBondContact O-N 2.9Å; E293-N297 WeakPolarHBondContact O-CB 3.49Å; E293-N297 PolarHBondContact O-N 3.25Å
294	D	98.3	Very high	97.6	Very high	73 Å²	73	57.7 Å²	57.7	39%	0.39	31%	0.309	S	S	.	.	H	α-helix	trans	-68.7	-48.6	-175.7	-66	-63.8	0	0	0	111.2	Y286 P289 T291 N297 Y298	Y286-D294 WeakPolarHBondContact OH-CB 3.35Å; P289-D294 HydrophobicContact CB-CB 4.39Å; P289-D294 VanDerWaalsContact O-CB 3.32Å; P289-D294 WeakPolarHBondContact O-CB 3.38Å; T291-D294 WeakPolarHBondContact OG1-CB 3.17Å; T291-D294 VanDerWaalsContact OG1-CG 3.27Å; T291-D294 PolarHBondContact OG1-N 3.04Å; T291-D294 PolarHBondContact OG1-OD2 3.19Å; D294-N297 PolarHBondContact O-N 3.25Å; D294-Y298 WeakPolarHBondContact O-CB 2.93Å; D294-Y298 PolarHBondContact O-N 2.91Å
295	A	98.4	Very high	97.6	Very high	0 Å²	0	57.4 Å²	57.4	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-68.9	-41.8	-179.5	0	0	0	0	0	111.7	F270 I274 L279 Y286 T291 Y298 I299	F270-A295 HydrophobicContact CE1-CB 4.46Å; F270-A295 HydrophobicContact CZ-CB 3.78Å; I274-A295 HydrophobicContact CD1-CB 3.71Å; I274-A295 HydrophobicContact CG1-CB 3.87Å; L279-A295 HydrophobicContact CB-CB 4.37Å; L279-A295 HydrophobicContact CD2-CB 3.84Å; Y286-A295 PolarHBondContact OH-N 3.31Å; T291-A295 WeakPolarHBondContact O-CB 3.33Å; T291-A295 PolarHBondContact O-N 3.4Å; T291-A295 VanDerWaalsContact O-N 3.08Å; A295-Y298 PolarHBondContact O-N 3.46Å; A295-I299 WeakPolarHBondContact O-CG1 3.14Å; A295-I299 PolarHBondContact O-N 2.94Å
296	G	98.4	Very high	97.7	Very high	1 Å²	1	52.5 Å²	52.5	1%	0.01	27%	0.273	C	S	.	.	H	α-helix	trans	-62.8	-42.2	176.1	0	0	0	0	0	112	Y292 I299 K300 M319	Y292-G296 WeakPolarHBondContact O-CA 3.39Å; Y292-G296 PolarHBondContact O-N 2.87Å; G296-I299 PolarHBondContact O-N 2.94Å; G296-K300 WeakPolarHBondContact O-CB 3.32Å; G296-K300 PolarHBondContact O-N 3.34Å; G296-M319 WeakPolarHBondContact O-CE 3.43Å
297	N	98.3	Very high	97.6	Very high	88 Å²	88	52 Å²	52	47%	0.471	27%	0.271	S	S	.	.	H	α-helix	trans	-67.2	-37.2	175.6	-172.1	58.6	0	0	0	112.2	E293 D294 K300 V301	E293-N297 WeakPolarHBondContact O-CB 3.49Å; E293-N297 PolarHBondContact O-N 3.25Å; D294-N297 PolarHBondContact O-N 3.25Å; N297-K300 WeakPolarHBondContact O-CB 3.32Å; N297-K300 PolarHBondContact O-N 3.44Å; N297-V301 WeakPolarHBondContact O-CG2 3.36Å; N297-V301 PolarHBondContact O-N 2.89Å
298	Y	98.6	Very high	97.6	Very high	58 Å²	58	50.9 Å²	50.9	23%	0.227	26%	0.263	C	S	.	.	H	α-helix	trans	-60.3	-50	173.8	-175.7	-90.3	0	0	0	111.6	L279 F283 Y286 D294 A295 K300 V301 Q302	L279-Y298 HydrophobicContact CD2-CD1 3.74Å; L279-Y298 HydrophobicContact CD2-CG 4.21Å; F283-Y298 HydrophobicContact CB-CE1 3.78Å; F283-Y298 AromaticContact CD1-CE1 3.87Å; F283-Y298 HydrophobicContact CD1-CE1 3.87Å; F283-Y298 HydrophobicContact CD2-CD1 4.41Å; F283-Y298 HydrophobicContact CD2-CE1 4.15Å; F283-Y298 HydrophobicContact CE1-CE1 4.5Å; F283-Y298 HydrophobicContact CG-CD1 4.37Å; F283-Y298 AromaticContact CG-CE1 3.67Å; F283-Y298 HydrophobicContact CG-CE1 3.67Å; Y286-Y298 AromaticContact CD2-CD1 3.88Å; Y286-Y298 HydrophobicContact CD2-CD1 3.88Å; Y286-Y298 AromaticContact CD2-CD2 3.37Å; Y286-Y298 HydrophobicContact CD2-CD2 3.37Å; Y286-Y298 HydrophobicContact CD2-CE1 4.14Å; Y286-Y298 AromaticContact CD2-CE2 3.65Å; Y286-Y298 HydrophobicContact CD2-CE2 3.65Å; Y286-Y298 AromaticContact CD2-CG 3.47Å; Y286-Y298 HydrophobicContact CD2-CG 3.47Å; Y286-Y298 VanDerWaalsContact CD2-CG 3.47Å; Y286-Y298 HydrophobicContact CE2-CD1 4.39Å; Y286-Y298 AromaticContact CE2-CD2 3.7Å; Y286-Y298 HydrophobicContact CE2-CD2 3.7Å; Y286-Y298 HydrophobicContact CE2-CE2 4.41Å; Y286-Y298 AromaticContact CE2-CG 3.66Å; Y286-Y298 HydrophobicContact CE2-CG 3.66Å; Y286-Y298 HydrophobicContact CG-CG 4.49Å; D294-Y298 WeakPolarHBondContact O-CB 2.93Å; D294-Y298 PolarHBondContact O-N 2.91Å; A295-Y298 PolarHBondContact O-N 3.46Å; Y298-K300 VanDerWaalsContact C-N 3.28Å; Y298-K300 PolarHBondContact O-N 3.07Å; Y298-V301 PolarHBondContact O-N 2.84Å; Y298-V301 VanDerWaalsContact O-N 3.1Å; Y298-Q302 HydrophobicContact CD1-CG 3.94Å; Y298-Q302 HydrophobicContact CE1-CG 3.65Å; Y298-Q302 WeakPolarHBondContact O-CG 3.13Å; Y298-Q302 PolarHBondContact O-N 3.17Å
299	I	98.7	Very high	97.4	Very high	0 Å²	0	53.7 Å²	53.7	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-57.6	-44.1	176.1	-64.4	167.8	0	0	0	110.6	L223 M239 L264 F270 L279 F283 A295 G296 V301 Q302 F303	L223-I299 HydrophobicContact CD2-CB 4.15Å; L223-I299 HydrophobicContact CD2-CD1 3.93Å; L223-I299 HydrophobicContact CD2-CG2 3.86Å; M239-I299 HydrophobicContact CE-CD1 4.25Å; M239-I299 HydrophobicContact CE-CG2 3.99Å; M239-I299 HydrophobicContact SD-CG2 3.95Å; L264-I299 HydrophobicContact CD2-CG2 4.39Å; F270-I299 HydrophobicContact CE2-CD1 3.9Å; F270-I299 HydrophobicContact CZ-CD1 3.99Å; L279-I299 HydrophobicContact CD1-CD1 3.84Å; L279-I299 HydrophobicContact CD1-CG1 4.03Å; L279-I299 HydrophobicContact CD2-CG1 4.46Å; F283-I299 HydrophobicContact CE2-CG1 3.92Å; A295-I299 WeakPolarHBondContact O-CG1 3.14Å; A295-I299 PolarHBondContact O-N 2.94Å; G296-I299 PolarHBondContact O-N 2.94Å; I299-V301 VanDerWaalsContact C-N 3.32Å; I299-V301 PolarHBondContact O-N 3.44Å; I299-Q302 WeakPolarHBondContact O-CB 3.4Å; I299-Q302 PolarHBondContact O-N 3.25Å; I299-F303 HydrophobicContact CG2-CD2 3.91Å; I299-F303 HydrophobicContact CG2-CE2 3.77Å; I299-F303 WeakPolarHBondContact O-CD2 3.44Å; I299-F303 PolarHBondContact O-N 3.11Å; I299-F303 VanDerWaalsContact O-N 3.12Å
300	K	98.6	Very high	97.1	Very high	63 Å²	63	57 Å²	57	27%	0.274	27%	0.27	S	S	.	.	H	α-helix	trans	-54.4	-48.5	175.5	173.4	178.7	158.5	165.9	0	111.7	L264 G296 N297 Y298 Q302 F303 L304 S317 M319	L264-K300 HydrophobicContact CD1-CB 3.5Å; L264-K300 HydrophobicContact CD1-CG 3.97Å; G296-K300 WeakPolarHBondContact O-CB 3.32Å; G296-K300 PolarHBondContact O-N 3.34Å; N297-K300 WeakPolarHBondContact O-CB 3.32Å; N297-K300 PolarHBondContact O-N 3.44Å; Y298-K300 VanDerWaalsContact C-N 3.28Å; Y298-K300 PolarHBondContact O-N 3.07Å; K300-Q302 VanDerWaalsContact C-N 3.35Å; K300-F303 PolarHBondContact O-N 3Å; K300-L304 HydrophobicContact CD-CD1 4.48Å; K300-L304 HydrophobicContact CG-CD1 3.89Å; K300-L304 HydrophobicContact CG-CG 4.35Å; K300-L304 WeakPolarHBondContact O-CG 3.41Å; K300-L304 PolarHBondContact O-N 3.17Å; K300-S317 WeakPolarHBondContact CE-OG 3.25Å; K300-S317 PolarHBondContact NZ-OG 3.38Å; K300-M319 HydrophobicContact CB-CE 4.38Å
301	V	98	Very high	96.7	Very high	49 Å²	49	61.9 Å²	61.9	30%	0.297	30%	0.296	S	S	.	.	H	α-helix	trans	-60.3	-45.4	178.2	170.5	0	0	0	0	110.6	N297 Y298 I299 F303 L304 E305	N297-V301 WeakPolarHBondContact O-CG2 3.36Å; N297-V301 PolarHBondContact O-N 2.89Å; Y298-V301 PolarHBondContact O-N 2.84Å; Y298-V301 VanDerWaalsContact O-N 3.1Å; I299-V301 VanDerWaalsContact C-N 3.32Å; I299-V301 PolarHBondContact O-N 3.44Å; V301-F303 VanDerWaalsContact C-N 3.27Å; V301-F303 PolarHBondContact O-N 2.93Å; V301-L304 PolarHBondContact O-N 2.74Å; V301-L304 VanDerWaalsContact O-N 3.14Å; V301-E305 HydrophobicContact CG1-CG 3.92Å; V301-E305 WeakPolarHBondContact O-CB 3.46Å; V301-E305 WeakPolarHBondContact O-CG 3.33Å; V301-E305 PolarHBondContact O-N 3.43Å
302	Q	98.4	Very high	96.2	Very high	50 Å²	50	64.6 Å²	64.6	23%	0.234	31%	0.312	C	S	.	.	H	α-helix	trans	-54.1	-42.6	177.1	-66.1	-61.6	-53.7	0	0	112.4	L243 F283 Y298 I299 K300 L306	L243-Q302 HydrophobicContact CD2-CB 4.05Å; F283-Q302 HydrophobicContact CD1-CG 4.28Å; F283-Q302 HydrophobicContact CE1-CB 4.37Å; F283-Q302 HydrophobicContact CE1-CG 3.83Å; F283-Q302 HydrophobicContact CZ-CG 4.28Å; Y298-Q302 HydrophobicContact CD1-CG 3.94Å; Y298-Q302 HydrophobicContact CE1-CG 3.65Å; Y298-Q302 WeakPolarHBondContact O-CG 3.13Å; Y298-Q302 PolarHBondContact O-N 3.17Å; I299-Q302 WeakPolarHBondContact O-CB 3.4Å; I299-Q302 PolarHBondContact O-N 3.25Å; K300-Q302 VanDerWaalsContact C-N 3.35Å; Q302-L306 WeakPolarHBondContact O-CG 3.38Å
303	F	98.7	Very high	95.6	Very high	0 Å²	0	63.1 Å²	63.1	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-68.2	-50.9	174.9	-82.7	-84.4	0	0	0	112.6	F219 A221 M239 L243 F246 L262 L264 I299 K300 V301 E305 L306	F219-F303 HydrophobicContact CE1-CE1 4.15Å; A221-F303 HydrophobicContact CB-CE1 3.98Å; A221-F303 HydrophobicContact CB-CE2 4.02Å; A221-F303 HydrophobicContact CB-CZ 3.52Å; M239-F303 HydrophobicContact SD-CE2 3.58Å; M239-F303 VanDerWaalsContact SD-CE2 3.58Å; M239-F303 HydrophobicContact SD-CZ 3.84Å; L243-F303 HydrophobicContact CD2-CB 4.46Å; L243-F303 HydrophobicContact CD2-CD1 3.82Å; L243-F303 HydrophobicContact CD2-CD2 3.76Å; L243-F303 HydrophobicContact CD2-CE1 3.85Å; L243-F303 HydrophobicContact CD2-CE2 3.79Å; L243-F303 HydrophobicContact CD2-CG 3.75Å; L243-F303 HydrophobicContact CD2-CZ 3.82Å; L243-F303 HydrophobicContact CG-CE1 4.27Å; L243-F303 HydrophobicContact CG-CE2 4.24Å; L243-F303 HydrophobicContact CG-CZ 4.01Å; F246-F303 HydrophobicContact CB-CD1 3.69Å; F246-F303 HydrophobicContact CB-CE1 3.72Å; F246-F303 HydrophobicContact CD1-CB 4.33Å; F246-F303 AromaticContact CD1-CD1 3.66Å; F246-F303 HydrophobicContact CD1-CD1 3.66Å; F246-F303 HydrophobicContact CD1-CG 4.49Å; F246-F303 HydrophobicContact CD2-CD1 4.28Å; F246-F303 HydrophobicContact CE1-CB 4.3Å; F246-F303 HydrophobicContact CE1-CD1 4.32Å; F246-F303 WeakPolarHBondContact CE1-O 3.38Å; F246-F303 AromaticContact CG-CD1 3.61Å; F246-F303 HydrophobicContact CG-CD1 3.61Å; F246-F303 HydrophobicContact CG-CE1 4.12Å; L262-F303 HydrophobicContact CD1-CD1 4.12Å; L262-F303 HydrophobicContact CD1-CG 4.32Å; L262-F303 HydrophobicContact CD2-CB 3.43Å; L262-F303 VanDerWaalsContact CD2-CB 3.43Å; L262-F303 HydrophobicContact CD2-CD1 4.43Å; L262-F303 HydrophobicContact CD2-CD2 4.5Å; L262-F303 HydrophobicContact CD2-CG 3.9Å; L264-F303 HydrophobicContact CD2-CD2 3.92Å; L264-F303 HydrophobicContact CD2-CE2 4.13Å; I299-F303 HydrophobicContact CG2-CD2 3.91Å; I299-F303 HydrophobicContact CG2-CE2 3.77Å; I299-F303 WeakPolarHBondContact O-CD2 3.44Å; I299-F303 PolarHBondContact O-N 3.11Å; I299-F303 VanDerWaalsContact O-N 3.12Å; K300-F303 PolarHBondContact O-N 3Å; V301-F303 VanDerWaalsContact C-N 3.27Å; V301-F303 PolarHBondContact O-N 2.93Å; F303-E305 PolarHBondContact O-N 3.06Å; F303-L306 WeakPolarHBondContact O-CB 3.44Å; F303-L306 PolarHBondContact O-N 3.45Å; F303-L306 VanDerWaalsContact O-N 3.11Å
304	L	98	Very high	95.3	Very high	43 Å²	43	63.2 Å²	63.2	23%	0.225	31%	0.307	C	S	.	.	H	α-helix	trans	-62	-28.7	-176.8	-67	-179.8	0	0	0	111.9	L262 K300 V301 L306 N307 I315	L262-L304 HydrophobicContact CD2-CD2 4.5Å; K300-L304 HydrophobicContact CD-CD1 4.48Å; K300-L304 HydrophobicContact CG-CD1 3.89Å; K300-L304 HydrophobicContact CG-CG 4.35Å; K300-L304 WeakPolarHBondContact O-CG 3.41Å; K300-L304 PolarHBondContact O-N 3.17Å; V301-L304 PolarHBondContact O-N 2.74Å; V301-L304 VanDerWaalsContact O-N 3.14Å; L304-L306 PolarHBondContact O-N 3.08Å; L304-N307 WeakPolarHBondContact O-CB 3.48Å; L304-N307 PolarHBondContact O-N 2.81Å; L304-I315 HydrophobicContact CD2-CB 3.89Å; L304-I315 HydrophobicContact CD2-CG2 3.81Å; L304-I315 WeakPolarHBondContact CD2-O 3.4Å
305	E	97.1	Very high	95.2	Very high	97 Å²	97	60.3 Å²	60.3	45%	0.453	29%	0.291	S	S	.	.	H	α-helix	trans	-69.5	-22.4	179.2	-77.2	-175.5	161	0	0	114.1	V301 F303 N307 R310	V301-E305 HydrophobicContact CG1-CG 3.92Å; V301-E305 WeakPolarHBondContact O-CB 3.46Å; V301-E305 WeakPolarHBondContact O-CG 3.33Å; V301-E305 PolarHBondContact O-N 3.43Å; F303-E305 PolarHBondContact O-N 3.06Å; E305-N307 PolarHBondContact O-N 3.45Å; E305-R310 VanDerWaalsContact C-NH2 3.32Å; E305-R310 PolarHBondContact O-NH2 3.3Å
306	L	97.8	Very high	95	Very high	45 Å²	45	63.2 Å²	63.2	24%	0.236	30%	0.303	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.8	-16.1	176.9	-62.7	168.3	0	0	0	113.1	L243 F246 N247 N251 Q302 F303 L304 M308	L243-L306 HydrophobicContact CB-CD1 4.11Å; L243-L306 HydrophobicContact CD2-CD1 3.7Å; L243-L306 WeakPolarHBondContact O-CD1 3.36Å; F246-L306 HydrophobicContact CD1-CB 4.2Å; F246-L306 HydrophobicContact CD1-CD1 4.01Å; N247-L306 HydrophobicContact CB-CB 4.26Å; N247-L306 HydrophobicContact CB-CD1 4.09Å; N247-L306 HydrophobicContact CB-CD2 4.12Å; N247-L306 HydrophobicContact CB-CG 4.38Å; N251-L306 PolarHBondContact ND2-O 3.4Å; Q302-L306 WeakPolarHBondContact O-CG 3.38Å; F303-L306 WeakPolarHBondContact O-CB 3.44Å; F303-L306 PolarHBondContact O-N 3.45Å; F303-L306 VanDerWaalsContact O-N 3.11Å; L304-L306 PolarHBondContact O-N 3.08Å; L306-M308 PolarHBondContact O-N 3.36Å
307	N	96.9	Very high	95	Very high	7 Å²	7	64.4 Å²	64.4	4%	0.037	31%	0.311	C	S	.	.			trans	-69.5	112.5	175.3	-178.3	13.5	0	0	0	110.2	L304 E305 R309 R310 K313 I315	L304-N307 WeakPolarHBondContact O-CB 3.48Å; L304-N307 PolarHBondContact O-N 2.81Å; E305-N307 PolarHBondContact O-N 3.45Å; N307-R309 VanDerWaalsContact C-N 3.31Å; N307-R309 PolarHBondContact OD1-N 3.14Å; N307-R310 HydrophobicContact CB-CG 4.12Å; N307-R310 WeakPolarHBondContact O-CG 3.24Å; N307-R310 PolarHBondContact O-NE 2.7Å; N307-R310 VanDerWaalsContact O-NE 3.13Å; N307-K313 PolarHBondContact ND2-O 3.41Å; N307-I315 HydrophobicContact CB-CD1 3.73Å; N307-I315 HydrophobicContact CB-CG1 4.42Å
308	M	94.9	Very high	94.9	Very high	137 Å²	137	62.1 Å²	62.1	68%	0.675	30%	0.298	S	S	*	.	S	Bend	trans	-82.9	-7.6	179.8	-60.2	177.7	-172.2	0	0	113.2	N251 L306	N251-M308 HydrophobicContact CB-SD 4.42Å; N251-M308 WeakPolarHBondContact OD1-CB 3.01Å; N251-M308 WeakPolarHBondContact OD1-CG 3.24Å; N251-M308 PolarHBondContact OD1-N 3.23Å; L306-M308 PolarHBondContact O-N 3.36Å
309	R	91.3	Very high	94.9	Very high	78 Å²	78	61.9 Å²	61.9	29%	0.294	30%	0.299	S	S	.	.			trans	-119.6	40.5	-174.1	-52.3	-177	-163.3	-160.6	4.3	111.7	N251 N307 D311 V312 K313	N251-R309 PolarHBondContact O-NH2 3.47Å; N307-R309 VanDerWaalsContact C-N 3.31Å; N307-R309 PolarHBondContact OD1-N 3.14Å; R309-D311 VanDerWaalsContact C-OD1 3.31Å; R309-D311 PolarHBondContact O-N 3.26Å; R309-V312 HydrophobicContact CB-CB 4.35Å; R309-V312 PolarHBondContact O-N 3.49Å; R309-K313 PolarHBondContact O-N 2.74Å
310	R	89.2	Confident	94.9	Very high	146 Å²	146	61.9 Å²	61.9	55%	0.551	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.2	-22.6	-173.5	-49.7	-168.8	-161.9	169.2	14.9	113.3	E305 N307	E305-R310 VanDerWaalsContact C-NH2 3.32Å; E305-R310 PolarHBondContact O-NH2 3.3Å; N307-R310 HydrophobicContact CB-CG 4.12Å; N307-R310 WeakPolarHBondContact O-CG 3.24Å; N307-R310 PolarHBondContact O-NE 2.7Å; N307-R310 VanDerWaalsContact O-NE 3.13Å
311	D	88.4	Confident	94.9	Very high	144 Å²	144	59.3 Å²	59.3	77%	0.77	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.2	-24.9	173.8	60.1	-48.1	0	0	0	113.2	R309	R309-D311 VanDerWaalsContact C-OD1 3.31Å; R309-D311 PolarHBondContact O-N 3.26Å
312	V	86	Confident	94.9	Very high	109 Å²	109	57.1 Å²	57.1	66%	0.661	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105	-37.6	-177.4	-176.2	0	0	0	0	112.2	R309	R309-V312 HydrophobicContact CB-CB 4.35Å; R309-V312 PolarHBondContact O-N 3.49Å
313	K	86.7	Confident	94.8	Very high	15 Å²	15	56 Å²	56	7%	0.065	27%	0.273	C	S	.	.			trans	-138.4	114.9	-170.2	-178.4	173.2	62.2	175	0	110.5	C250 F255 T258 I260 N307 R309	C250-K313 PolarHBondContact O-NZ 2.97Å; C250-K313 VanDerWaalsContact O-NZ 3.13Å; F255-K313 PolarHBondContact O-NZ 3.3Å; T258-K313 VanDerWaalsContact O-CD 3.26Å; T258-K313 WeakPolarHBondContact O-CD 3.29Å; I260-K313 VanDerWaalsContact CD1-NZ 3.33Å; I260-K313 HydrophobicContact CG1-CD 4.48Å; N307-K313 PolarHBondContact ND2-O 3.41Å; R309-K313 PolarHBondContact O-N 2.74Å
314	E	91	Very high	94.8	Very high	124 Å²	124	59.1 Å²	59.1	58%	0.579	29%	0.289	S	S	*	.			trans	-78	142.7	169.8	-172.6	173.7	-158.5	0	0	110.1	Y316	E314-Y316 HydrophobicContact CG-CE1 4.22Å; E314-Y316 WeakPolarHBondContact OE2-CE1 3.39Å; E314-Y316 VanDerWaalsContact OE2-CZ 3.3Å; E314-Y316 PolarHBondContact OE2-OH 3.07Å
315	I	95.5	Very high	94.8	Very high	12 Å²	12	58.5 Å²	58.5	6%	0.062	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	113.7	172.2	-62.2	-174.5	0	0	0	108.1	F246 C250 I260 L262 L304 N307	F246-I315 HydrophobicContact CE1-CD1 4.15Å; F246-I315 HydrophobicContact CZ-CD1 3.62Å; F246-I315 HydrophobicContact CZ-CG2 4.15Å; C250-I315 HydrophobicContact CB-CD1 3.91Å; I260-I315 HydrophobicContact CB-CG1 4.36Å; I260-I315 HydrophobicContact CG2-CG2 4.38Å; L262-I315 HydrophobicContact CB-CG2 4.1Å; L304-I315 HydrophobicContact CD2-CB 3.89Å; L304-I315 HydrophobicContact CD2-CG2 3.81Å; L304-I315 WeakPolarHBondContact CD2-O 3.4Å; N307-I315 HydrophobicContact CB-CD1 3.73Å; N307-I315 HydrophobicContact CB-CG1 4.42Å
316	Y	94.6	Very high	94.9	Very high	62 Å²	62	60.1 Å²	60.1	24%	0.243	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	141.8	174.8	-61	-75.5	0	0	0	109.9	I260 V261 L262 E314 I338	I260-Y316 PolarHBondContact O-N 3.16Å; V261-Y316 CarbonylContact C-O 3.41Å; V261-Y316 WeakPolarHBondContact CA-O 3.29Å; L262-Y316 PolarHBondContact N-O 2.93Å; E314-Y316 HydrophobicContact CG-CE1 4.22Å; E314-Y316 WeakPolarHBondContact OE2-CE1 3.39Å; E314-Y316 VanDerWaalsContact OE2-CZ 3.3Å; E314-Y316 PolarHBondContact OE2-OH 3.07Å; Y316-I338 HydrophobicContact CD1-CD1 3.94Å; Y316-I338 HydrophobicContact CD2-CD1 3.77Å; Y316-I338 HydrophobicContact CD2-CG1 4.36Å; Y316-I338 HydrophobicContact CD2-CG2 3.78Å; Y316-I338 HydrophobicContact CE1-CD1 4.49Å; Y316-I338 HydrophobicContact CE2-CD1 4.3Å; Y316-I338 HydrophobicContact CE2-CG1 4.42Å; Y316-I338 HydrophobicContact CE2-CG2 3.6Å; Y316-I338 HydrophobicContact CG-CD1 3.57Å; Y316-I338 HydrophobicContact CG-CG1 4.49Å
317	S	97.4	Very high	94.9	Very high	25 Å²	25	59 Å²	59	18%	0.175	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	138	-177.5	53.8	0	0	0	0	112.2	L262 K300	L262-S317 CarbonylContact O-C 3.57Å; L262-S317 VanDerWaalsContact O-CA 3.26Å; L262-S317 WeakPolarHBondContact O-CA 3.44Å; K300-S317 WeakPolarHBondContact CE-OG 3.25Å; K300-S317 PolarHBondContact NZ-OG 3.38Å
318	H	98	Very high	94.9	Very high	41 Å²	41	58.8 Å²	58.8	19%	0.19	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	134.1	-179.4	-63.8	-89.1	0	0	0	111.3	L262 F263 L264 T320 V331	L262-H318 PolarHBondContact O-N 3.41Å; F263-H318 HydrophobicContact CD1-CB 4.32Å; L264-H318 PolarHBondContact N-O 3.17Å; H318-T320 HydrophobicContact CB-CG2 4.18Å; H318-V331 HydrophobicContact CB-CG1 3.64Å; H318-V331 HydrophobicContact CB-CG2 4.09Å
319	M	98	Very high	95.1	Very high	52 Å²	52	56.4 Å²	56.4	26%	0.256	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	121.4	166.7	-60.8	-59	-173.4	0	0	108.9	L223 L264 K267 G296 K300	L223-M319 HydrophobicContact CD1-SD 3.8Å; L264-M319 HydrophobicContact CB-SD 3.59Å; L264-M319 VanDerWaalsContact CB-SD 3.59Å; L264-M319 HydrophobicContact CD1-CE 3.76Å; L264-M319 HydrophobicContact CD1-SD 3.69Å; L264-M319 HydrophobicContact CG-SD 4.3Å; L264-M319 WeakPolarHBondContact O-CA 3.16Å; K267-M319 HydrophobicContact CD-CB 4.15Å; G296-M319 WeakPolarHBondContact O-CE 3.43Å; K300-M319 HydrophobicContact CB-CE 4.38Å
320	T	98.5	Very high	95.3	Very high	1 Å²	1	59.5 Å²	59.5	1%	0.006	29%	0.29	C	S	.	.			trans	-125.3	150.8	-171.6	50.8	0	0	0	0	113	F263 L264 N265 K266 K267 H318 N327 V331	F263-T320 HydrophobicContact CB-CG2 4.2Å; F263-T320 HydrophobicContact CD1-CG2 4.19Å; F263-T320 HydrophobicContact CD2-CG2 4.05Å; F263-T320 HydrophobicContact CG-CG2 3.89Å; L264-T320 PolarHBondContact O-N 2.83Å; L264-T320 PolarHBondContact O-OG1 3.26Å; N265-T320 CarbonylContact C-O 3.59Å; N265-T320 VanDerWaalsContact CA-O 3.32Å; N265-T320 WeakPolarHBondContact CA-O 3.34Å; N265-T320 WeakPolarHBondContact CA-OG1 3.05Å; N265-T320 WeakPolarHBondContact CB-OG1 3.44Å; N265-T320 PolarHBondContact N-OG1 2.92Å; N265-T320 PolarHBondContact OD1-O 3.25Å; N265-T320 PolarHBondContact OD1-OG1 3.13Å; K266-T320 PolarHBondContact N-O 2.67Å; K266-T320 VanDerWaalsContact N-O 3.07Å; K267-T320 WeakPolarHBondContact CB-O 3.36Å; K267-T320 WeakPolarHBondContact CG-O 3.4Å; K267-T320 PolarHBondContact N-O 2.79Å; K267-T320 VanDerWaalsContact N-O 3.1Å; H318-T320 HydrophobicContact CB-CG2 4.18Å; T320-N327 WeakPolarHBondContact CA-OD1 3.43Å; T320-V331 HydrophobicContact CG2-CB 4.31Å; T320-V331 HydrophobicContact CG2-CG1 3.94Å; T320-V331 HydrophobicContact CG2-CG2 4.06Å
321	C	98.2	Very high	95.7	Very high	8 Å²	8	52.7 Å²	52.7	5%	0.054	27%	0.265	C	S	.	.			trans	-126.6	101	162.6	175.2	0	0	0	0	106.8	K267 D268 T323 D324 N327	K267-C321 HydrophobicContact CG-CB 4.11Å; D268-C321 VanDerWaalsContact CG-SG 3.58Å; C321-T323 PolarHBondContact O-N 3.19Å; C321-T323 VanDerWaalsContact O-N 3.09Å; C321-T323 PolarHBondContact SG-OG1 3.39Å; C321-D324 HydrophobicContact CB-CB 3.9Å; C321-D324 WeakPolarHBondContact O-CB 3.33Å; C321-D324 PolarHBondContact O-N 2.92Å; C321-N327 PolarHBondContact N-OD1 3.32Å
322	A	98.1	Very high	96.1	Very high	4 Å²	4	46 Å²	46	3%	0.033	23%	0.229	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-21	-175.4	0	0	0	0	0	113.3	T44 I45 Q48 N265	T44-A322 HydrophobicContact CG2-CB 3.63Å; T44-A322 WeakPolarHBondContact CG2-O 3.32Å; I45-A322 HydrophobicContact CD1-CB 3.71Å; I45-A322 HydrophobicContact CG1-CB 4.23Å; Q48-A322 VanDerWaalsContact CG-O 3.26Å; Q48-A322 WeakPolarHBondContact CG-O 3.44Å; Q48-A322 PolarHBondContact NE2-O 2.87Å; N265-A322 PolarHBondContact OD1-N 3.46Å
323	T	97.5	Very high	96.5	Very high	26 Å²	26	43.5 Å²	43.5	16%	0.16	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.9	-3	174.6	53.9	0	0	0	0	113.8	T44 Q168 L171 R172 C321	T44-T323 HydrophobicContact CG2-CG2 4.17Å; Q168-T323 PolarHBondContact OE1-O 3.24Å; L171-T323 HydrophobicContact CB-CG2 4.35Å; R172-T323 HydrophobicContact CG-CG2 4.06Å; C321-T323 PolarHBondContact O-N 3.19Å; C321-T323 VanDerWaalsContact O-N 3.09Å; C321-T323 PolarHBondContact SG-OG1 3.39Å
324	D	98.2	Very high	96.9	Very high	65 Å²	65	44 Å²	44	35%	0.348	22%	0.218	S	C	.	.			trans	-100.6	103.7	173.9	175.1	-9.8	0	0	0	109.4	C321 Q326 N327 V328	C321-D324 HydrophobicContact CB-CB 3.9Å; C321-D324 WeakPolarHBondContact O-CB 3.33Å; C321-D324 PolarHBondContact O-N 2.92Å; D324-Q326 VanDerWaalsContact C-N 3.27Å; D324-Q326 PolarHBondContact O-N 2.81Å; D324-Q326 PolarHBondContact OD1-N 2.74Å; D324-N327 HydrophobicContact CB-CB 3.88Å; D324-N327 VanDerWaalsContact CG-CB 3.48Å; D324-N327 PolarHBondContact O-N 3.46Å; D324-N327 PolarHBondContact OD1-N 2.74Å; D324-N327 WeakPolarHBondContact OD2-CB 3.22Å; D324-V328 WeakPolarHBondContact O-CG2 3.48Å; D324-V328 PolarHBondContact O-N 3.4Å
325	T	98.1	Very high	97	Very high	30 Å²	30	38.1 Å²	38.1	18%	0.184	19%	0.191	C	C	.	.	H	α-helix	trans	-60.2	-34.3	-177.1	-51.9	0	0	0	0	112.7	Q48 I51 I52 K329	Q48-T325 PolarHBondContact NE2-OG1 2.8Å; Q48-T325 PolarHBondContact OE1-OG1 2.68Å; I51-T325 HydrophobicContact CG2-CG2 4.1Å; I52-T325 HydrophobicContact CD1-CG2 4.35Å; I52-T325 HydrophobicContact CG1-CG2 3.93Å; T325-K329 HydrophobicContact CG2-CD 4.45Å; T325-K329 WeakPolarHBondContact O-CB 3.21Å; T325-K329 VanDerWaalsContact O-CG 3.26Å; T325-K329 WeakPolarHBondContact O-CG 3.36Å; T325-K329 PolarHBondContact O-N 3.13Å
326	Q	98	Very high	97	Very high	132 Å²	132	37.5 Å²	37.5	62%	0.617	19%	0.188	S	C	*	.	H	α-helix	trans	-72.7	-41.6	179.1	-65.1	-61.8	-21.9	0	0	111.1	D324 V328 K329 F330	D324-Q326 VanDerWaalsContact C-N 3.27Å; D324-Q326 PolarHBondContact O-N 2.81Å; D324-Q326 PolarHBondContact OD1-N 2.74Å; Q326-V328 VanDerWaalsContact C-N 3.34Å; Q326-V328 PolarHBondContact O-N 2.87Å; Q326-K329 PolarHBondContact O-N 3.3Å; Q326-F330 WeakPolarHBondContact O-CB 3.48Å; Q326-F330 PolarHBondContact O-N 3.4Å
327	N	98.1	Very high	96.9	Very high	20 Å²	20	38.3 Å²	38.3	11%	0.107	20%	0.196	C	C	.	.	H	α-helix	trans	-61.5	-43.1	174.1	178.2	-111.6	0	0	0	111.8	K267 T320 C321 D324 F330 V331	K267-N327 PolarHBondContact NZ-ND2 3.21Å; T320-N327 WeakPolarHBondContact CA-OD1 3.43Å; C321-N327 PolarHBondContact N-OD1 3.32Å; D324-N327 HydrophobicContact CB-CB 3.88Å; D324-N327 VanDerWaalsContact CG-CB 3.48Å; D324-N327 PolarHBondContact O-N 3.46Å; D324-N327 PolarHBondContact OD1-N 2.74Å; D324-N327 WeakPolarHBondContact OD2-CB 3.22Å; N327-F330 PolarHBondContact O-N 3.41Å; N327-V331 WeakPolarHBondContact O-CB 3.36Å; N327-V331 WeakPolarHBondContact O-CG2 3.48Å; N327-V331 PolarHBondContact O-N 2.96Å
328	V	98.2	Very high	96.4	Very high	3 Å²	3	38.4 Å²	38.4	2%	0.018	19%	0.194	C	C	.	.	H	α-helix	trans	-67.6	-42.1	178.5	177.3	0	0	0	0	111.7	I45 Q48 M49 I52 D324 Q326 F330 V331 F332	I45-V328 HydrophobicContact CD1-CG1 4.13Å; I45-V328 HydrophobicContact CD1-CG2 3.85Å; Q48-V328 HydrophobicContact CB-CB 4.4Å; Q48-V328 HydrophobicContact CB-CG1 3.76Å; Q48-V328 HydrophobicContact CG-CB 4.28Å; Q48-V328 HydrophobicContact CG-CG1 4.11Å; Q48-V328 HydrophobicContact CG-CG2 4.11Å; M49-V328 HydrophobicContact CE-CG1 3.81Å; I52-V328 HydrophobicContact CD1-CB 4.22Å; I52-V328 HydrophobicContact CD1-CG1 3.84Å; D324-V328 WeakPolarHBondContact O-CG2 3.48Å; D324-V328 PolarHBondContact O-N 3.4Å; Q326-V328 VanDerWaalsContact C-N 3.34Å; Q326-V328 PolarHBondContact O-N 2.87Å; V328-F330 PolarHBondContact O-N 3.03Å; V328-V331 PolarHBondContact O-N 2.7Å; V328-F332 WeakPolarHBondContact O-CB 3.48Å; V328-F332 PolarHBondContact O-N 2.87Å
329	K	97.3	Very high	96	Very high	88 Å²	88	36.5 Å²	36.5	38%	0.383	19%	0.186	S	C	.	.	H	α-helix	trans	-53.7	-52.6	172.7	-79.7	179.4	-179.8	-175.7	0	111.5	I52 T325 Q326 D333	I52-K329 HydrophobicContact CB-CG 4.34Å; I52-K329 HydrophobicContact CD1-CB 4.46Å; I52-K329 HydrophobicContact CD1-CG 3.56Å; I52-K329 HydrophobicContact CG1-CD 4.35Å; I52-K329 HydrophobicContact CG1-CG 3.68Å; I52-K329 HydrophobicContact CG2-CD 4.32Å; I52-K329 HydrophobicContact CG2-CG 3.69Å; T325-K329 HydrophobicContact CG2-CD 4.45Å; T325-K329 WeakPolarHBondContact O-CB 3.21Å; T325-K329 VanDerWaalsContact O-CG 3.26Å; T325-K329 WeakPolarHBondContact O-CG 3.36Å; T325-K329 PolarHBondContact O-N 3.13Å; Q326-K329 PolarHBondContact O-N 3.3Å; K329-D333 WeakPolarHBondContact O-CB 3.25Å; K329-D333 PolarHBondContact O-N 2.99Å
330	F	97.3	Very high	95.6	Very high	142 Å²	142	36.4 Å²	36.4	62%	0.623	19%	0.186	S	C	*	.	H	α-helix	trans	-61.9	-47.3	-178.6	174.6	-97.5	0	0	0	112.6	Q326 N327 V328 D333 A334	Q326-F330 WeakPolarHBondContact O-CB 3.48Å; Q326-F330 PolarHBondContact O-N 3.4Å; N327-F330 PolarHBondContact O-N 3.41Å; V328-F330 PolarHBondContact O-N 3.03Å; F330-D333 PolarHBondContact O-N 2.82Å; F330-A334 PolarHBondContact O-N 3.18Å
331	V	96.3	Very high	95	Very high	4 Å²	4	41.7 Å²	41.7	2%	0.024	21%	0.209	C	C	.	.	H	α-helix	trans	-69.4	-40.1	-177.7	173.3	0	0	0	0	111.1	F263 H318 T320 N327 V328 D333 A334 V335	F263-V331 HydrophobicContact CD1-CG1 4.13Å; F263-V331 HydrophobicContact CE1-CG1 3.34Å; F263-V331 HydrophobicContact CE2-CG1 4.29Å; F263-V331 HydrophobicContact CZ-CG1 3.45Å; F263-V331 VanDerWaalsContact CZ-CG1 3.45Å; H318-V331 HydrophobicContact CB-CG1 3.64Å; H318-V331 HydrophobicContact CB-CG2 4.09Å; T320-V331 HydrophobicContact CG2-CB 4.31Å; T320-V331 HydrophobicContact CG2-CG1 3.94Å; T320-V331 HydrophobicContact CG2-CG2 4.06Å; N327-V331 WeakPolarHBondContact O-CB 3.36Å; N327-V331 WeakPolarHBondContact O-CG2 3.48Å; N327-V331 PolarHBondContact O-N 2.96Å; V328-V331 PolarHBondContact O-N 2.7Å; V331-D333 VanDerWaalsContact C-N 3.33Å; V331-D333 PolarHBondContact O-N 3.45Å; V331-A334 PolarHBondContact O-N 3.16Å; V331-V335 WeakPolarHBondContact O-CG2 3.49Å; V331-V335 PolarHBondContact O-N 3.49Å
332	F	96.2	Very high	94.2	Very high	3 Å²	3	43.5 Å²	43.5	1%	0.013	22%	0.216	C	C	.	.	H	α-helix	trans	-67.8	-34.3	178.9	-166.4	-96.6	0	0	0	112.5	L32 M49 H53 F185 F187 F192 M194 I218 V328 V335 T336	L32-F332 HydrophobicContact CD1-CE2 3.63Å; L32-F332 HydrophobicContact CD1-CZ 3.71Å; M49-F332 HydrophobicContact CE-CB 4.36Å; M49-F332 HydrophobicContact CE-CD1 4.45Å; M49-F332 HydrophobicContact CE-CD2 4.07Å; M49-F332 HydrophobicContact CE-CG 4.02Å; M49-F332 HydrophobicContact SD-CD1 4.04Å; M49-F332 HydrophobicContact SD-CD2 3.84Å; M49-F332 HydrophobicContact SD-CE1 3.95Å; M49-F332 HydrophobicContact SD-CE2 3.74Å; M49-F332 HydrophobicContact SD-CG 3.99Å; M49-F332 HydrophobicContact SD-CZ 3.81Å; H53-F332 AromaticContact NE2-CD1 3.87Å; F185-F332 AromaticContact CE2-CE1 3.77Å; F185-F332 HydrophobicContact CE2-CE1 3.77Å; F185-F332 AromaticContact CE2-CZ 3.77Å; F185-F332 HydrophobicContact CE2-CZ 3.77Å; F185-F332 HydrophobicContact CZ-CE1 4.07Å; F185-F332 HydrophobicContact CZ-CE2 4.35Å; F185-F332 AromaticContact CZ-CZ 3.59Å; F185-F332 HydrophobicContact CZ-CZ 3.59Å; F187-F332 HydrophobicContact CD1-CD1 4.17Å; F187-F332 AromaticContact CD1-CE1 3.97Å; F187-F332 HydrophobicContact CD1-CE1 3.97Å; F187-F332 HydrophobicContact CE1-CD1 4.27Å; F187-F332 HydrophobicContact CE1-CE1 4.49Å; F192-F332 HydrophobicContact CD1-CZ 4.09Å; F192-F332 HydrophobicContact CE1-CE1 4.43Å; F192-F332 AromaticContact CE1-CZ 3.98Å; F192-F332 HydrophobicContact CE1-CZ 3.98Å; F192-F332 HydrophobicContact CZ-CE1 4.35Å; F192-F332 HydrophobicContact CZ-CZ 4.34Å; M194-F332 HydrophobicContact CE-CE2 3.81Å; M194-F332 HydrophobicContact CE-CZ 4.34Å; I218-F332 HydrophobicContact CD1-CE2 4.4Å; V328-F332 WeakPolarHBondContact O-CB 3.48Å; V328-F332 PolarHBondContact O-N 2.87Å; F332-V335 PolarHBondContact O-N 3.26Å; F332-T336 WeakPolarHBondContact O-CB 3.37Å; F332-T336 PolarHBondContact O-N 2.9Å; F332-T336 PolarHBondContact O-OG1 3.13Å
333	D	96.1	Very high	93.3	Very high	57 Å²	57	46 Å²	46	31%	0.305	23%	0.229	S	C	.	.	H	α-helix	trans	-60.2	-47.8	171.7	-168.2	50.6	0	0	0	111.7	F187 K188 K329 F330 V331 V335 T336 D337	F187-D333 HydrophobicContact CZ-CB 4.47Å; F187-D333 VanDerWaalsContact CZ-OD1 3.29Å; F187-D333 WeakPolarHBondContact CZ-OD1 3.37Å; K188-D333 WeakPolarHBondContact CE-OD1 3.49Å; K188-D333 IonicContact NZ-OD1 2.74Å; K188-D333 PolarHBondContact NZ-OD1 3.18Å; K188-D333 IonicContact NZ-OD2 3.03Å; K329-D333 WeakPolarHBondContact O-CB 3.25Å; K329-D333 PolarHBondContact O-N 2.99Å; F330-D333 PolarHBondContact O-N 2.82Å; V331-D333 VanDerWaalsContact C-N 3.33Å; V331-D333 PolarHBondContact O-N 3.45Å; D333-V335 PolarHBondContact O-N 3.47Å; D333-T336 WeakPolarHBondContact O-CB 3.48Å; D333-T336 PolarHBondContact O-N 3.47Å; D333-T336 VanDerWaalsContact O-N 3.15Å; D333-D337 PolarHBondContact O-N 3.37Å
334	A	94.5	Very high	92.2	Very high	25 Å²	25	48 Å²	48	21%	0.207	24%	0.239	C	C	.	.	H	α-helix	trans	-61.8	-40.1	176.1	0	0	0	0	0	112.8	F330 V331 T336 D337 I338	F330-A334 PolarHBondContact O-N 3.18Å; V331-A334 PolarHBondContact O-N 3.16Å; A334-T336 VanDerWaalsContact C-N 3.33Å; A334-D337 PolarHBondContact O-N 3.05Å; A334-I338 WeakPolarHBondContact O-CG1 3.42Å; A334-I338 PolarHBondContact O-N 2.89Å; A334-I338 VanDerWaalsContact O-N 3.16Å
335	V	93.9	Very high	90.9	Very high	0 Å²	0	50.2 Å²	50.2	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-62.8	-41.5	174	170.6	0	0	0	0	111.2	I218 V261 F263 V331 F332 D333 D337 I338 I339	I218-V335 HydrophobicContact CD1-CG1 4.4Å; V261-V335 HydrophobicContact CB-CG2 4.32Å; V261-V335 HydrophobicContact CG1-CG2 3.79Å; V261-V335 HydrophobicContact CG2-CG1 4.16Å; V261-V335 HydrophobicContact CG2-CG2 4.06Å; F263-V335 HydrophobicContact CE1-CG2 3.85Å; F263-V335 HydrophobicContact CZ-CG2 4.04Å; V331-V335 WeakPolarHBondContact O-CG2 3.49Å; V331-V335 PolarHBondContact O-N 3.49Å; F332-V335 PolarHBondContact O-N 3.26Å; D333-V335 PolarHBondContact O-N 3.47Å; V335-D337 VanDerWaalsContact C-N 3.33Å; V335-D337 PolarHBondContact O-N 3.25Å; V335-I338 WeakPolarHBondContact O-CB 3.41Å; V335-I338 PolarHBondContact O-N 3.27Å; V335-I339 HydrophobicContact CG1-CD1 3.86Å; V335-I339 WeakPolarHBondContact O-CG1 3.22Å; V335-I339 PolarHBondContact O-N 3.14Å
336	T	94.5	Very high	89.5	Confident	0 Å²	0	55.5 Å²	55.5	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-63.5	-40.9	178.4	-59.9	0	0	0	0	111.3	F187 K188 L190 F192 F332 D333 A334 I338 I339 I340	F187-T336 HydrophobicContact CD1-CG2 3.88Å; F187-T336 HydrophobicContact CE1-CG2 3.9Å; F187-T336 WeakPolarHBondContact CE1-OG1 3.32Å; K188-T336 HydrophobicContact CB-CG2 4.38Å; K188-T336 HydrophobicContact CD-CG2 3.85Å; L190-T336 HydrophobicContact CD1-CG2 4.25Å; F192-T336 HydrophobicContact CE2-CG2 4.5Å; F192-T336 HydrophobicContact CZ-CG2 3.9Å; F332-T336 WeakPolarHBondContact O-CB 3.37Å; F332-T336 PolarHBondContact O-N 2.9Å; F332-T336 PolarHBondContact O-OG1 3.13Å; D333-T336 WeakPolarHBondContact O-CB 3.48Å; D333-T336 PolarHBondContact O-N 3.47Å; D333-T336 VanDerWaalsContact O-N 3.15Å; A334-T336 VanDerWaalsContact C-N 3.33Å; T336-I338 VanDerWaalsContact C-N 3.33Å; T336-I338 PolarHBondContact O-N 2.98Å; T336-I339 PolarHBondContact O-N 3.14Å; T336-I340 HydrophobicContact CG2-CD1 3.81Å; T336-I340 HydrophobicContact CG2-CG1 4.38Å; T336-I340 VanDerWaalsContact O-CG1 3.31Å; T336-I340 WeakPolarHBondContact O-CG1 3.44Å; T336-I340 PolarHBondContact O-N 2.65Å
337	D	92.1	Very high	87.8	Confident	79 Å²	79	53.7 Å²	53.7	42%	0.422	27%	0.273	S	S	.	.	H	α-helix	trans	-64.4	-36.3	176.7	-72.4	-17	0	0	0	112.7	K188 D333 A334 V335 K341	K188-D337 IonicContact NZ-OD1 2.57Å; K188-D337 PolarHBondContact NZ-OD1 3.47Å; K188-D337 IonicContact NZ-OD2 2.92Å; K188-D337 PolarHBondContact NZ-OD2 2.91Å; D333-D337 PolarHBondContact O-N 3.37Å; A334-D337 PolarHBondContact O-N 3.05Å; V335-D337 VanDerWaalsContact C-N 3.33Å; V335-D337 PolarHBondContact O-N 3.25Å; D337-K341 VanDerWaalsContact O-CB 3.29Å; D337-K341 WeakPolarHBondContact O-CB 3.32Å; D337-K341 PolarHBondContact O-N 2.87Å
338	I	88.1	Confident	85.6	Confident	26 Å²	26	55.8 Å²	55.8	13%	0.133	30%	0.299	C	S	.	.	H	α-helix	trans	-62.6	-48.7	173	-68	160.3	0	0	0	110.2	Y316 A334 V335 T336 I340 K341 E342	Y316-I338 HydrophobicContact CD1-CD1 3.94Å; Y316-I338 HydrophobicContact CD2-CD1 3.77Å; Y316-I338 HydrophobicContact CD2-CG1 4.36Å; Y316-I338 HydrophobicContact CD2-CG2 3.78Å; Y316-I338 HydrophobicContact CE1-CD1 4.49Å; Y316-I338 HydrophobicContact CE2-CD1 4.3Å; Y316-I338 HydrophobicContact CE2-CG1 4.42Å; Y316-I338 HydrophobicContact CE2-CG2 3.6Å; Y316-I338 HydrophobicContact CG-CD1 3.57Å; Y316-I338 HydrophobicContact CG-CG1 4.49Å; A334-I338 WeakPolarHBondContact O-CG1 3.42Å; A334-I338 PolarHBondContact O-N 2.89Å; A334-I338 VanDerWaalsContact O-N 3.16Å; V335-I338 WeakPolarHBondContact O-CB 3.41Å; V335-I338 PolarHBondContact O-N 3.27Å; T336-I338 VanDerWaalsContact C-N 3.33Å; T336-I338 PolarHBondContact O-N 2.98Å; I338-I340 PolarHBondContact O-N 2.86Å; I338-K341 PolarHBondContact O-N 3.37Å; I338-E342 WeakPolarHBondContact O-CG 3.5Å; I338-E342 PolarHBondContact O-N 3.41Å
339	I	89.5	Confident	83.3	Confident	2 Å²	2	61.7 Å²	61.7	1%	0.01	33%	0.33	C	S	.	.	H	α-helix	trans	-60.8	-45.3	180	-67.5	166.5	0	0	0	111	V30 L32 F192 T215 C216 V335 T336 K341 E342 N343	V30-I339 HydrophobicContact CG1-CD1 4.15Å; V30-I339 HydrophobicContact CG1-CG2 4.07Å; V30-I339 HydrophobicContact CG2-CG2 4.04Å; L32-I339 HydrophobicContact CD2-CD1 3.71Å; F192-I339 HydrophobicContact CE1-CD1 4.48Å; T215-I339 HydrophobicContact CG2-CG2 3.99Å; C216-I339 HydrophobicContact CB-CD1 3.78Å; C216-I339 HydrophobicContact CB-CG1 3.95Å; V335-I339 HydrophobicContact CG1-CD1 3.86Å; V335-I339 WeakPolarHBondContact O-CG1 3.22Å; V335-I339 PolarHBondContact O-N 3.14Å; T336-I339 PolarHBondContact O-N 3.14Å; I339-K341 VanDerWaalsContact C-N 3.34Å; I339-K341 PolarHBondContact O-N 3.12Å; I339-E342 PolarHBondContact O-N 3.47Å; I339-N343 WeakPolarHBondContact O-CB 3.3Å; I339-N343 PolarHBondContact O-N 3.27Å
340	I	89	Confident	80.7	Confident	50 Å²	50	67.5 Å²	67.5	26%	0.256	36%	0.356	S	S	.	.	H	α-helix	trans	-60.6	-45.9	177.2	-70.2	167.1	0	0	0	110.2	K188 L190 T336 I338 E342 N343 L344	K188-I340 HydrophobicContact CB-CD1 4.43Å; K188-I340 HydrophobicContact CD-CD1 4.31Å; L190-I340 HydrophobicContact CD1-CD1 4.03Å; L190-I340 HydrophobicContact CD1-CG1 3.68Å; T336-I340 HydrophobicContact CG2-CD1 3.81Å; T336-I340 HydrophobicContact CG2-CG1 4.38Å; T336-I340 VanDerWaalsContact O-CG1 3.31Å; T336-I340 WeakPolarHBondContact O-CG1 3.44Å; T336-I340 PolarHBondContact O-N 2.65Å; I338-I340 PolarHBondContact O-N 2.86Å; I340-E342 VanDerWaalsContact C-N 3.33Å; I340-E342 PolarHBondContact O-N 2.6Å; I340-N343 PolarHBondContact O-N 2.78Å; I340-L344 HydrophobicContact CG2-CD1 3.86Å; I340-L344 HydrophobicContact CG2-CG 4.35Å; I340-L344 WeakPolarHBondContact O-CB 3.32Å; I340-L344 VanDerWaalsContact O-CG 3.26Å; I340-L344 WeakPolarHBondContact O-CG 3.36Å; I340-L344 PolarHBondContact O-N 3.16Å
341	K	85.6	Confident	79.9	Confident	111 Å²	111	63.8 Å²	63.8	48%	0.483	34%	0.342	S	S	.	.	H	α-helix	trans	-61.2	-40	179.6	-177.2	-179	178.6	-176.8	0	112.3	D337 I338 I339 K345	D337-K341 VanDerWaalsContact O-CB 3.29Å; D337-K341 WeakPolarHBondContact O-CB 3.32Å; D337-K341 PolarHBondContact O-N 2.87Å; I338-K341 PolarHBondContact O-N 3.37Å; I339-K341 VanDerWaalsContact C-N 3.34Å; I339-K341 PolarHBondContact O-N 3.12Å; K341-K345 WeakPolarHBondContact O-CG 3.29Å; K341-K345 PolarHBondContact O-N 2.91Å
342	E	81.5	Confident	79	Confident	47 Å²	47	66.9 Å²	66.9	22%	0.22	36%	0.359	C	S	.	.	H	α-helix	trans	-71.5	-44.3	178.3	-72.3	176	154.9	0	0	111.8	S259 I338 I339 I340 L344 K345 D346	S259-E342 WeakPolarHBondContact CB-OE2 3.48Å; S259-E342 VanDerWaalsContact OG-CD 3.26Å; S259-E342 PolarHBondContact OG-OE2 3.09Å; I338-E342 WeakPolarHBondContact O-CG 3.5Å; I338-E342 PolarHBondContact O-N 3.41Å; I339-E342 PolarHBondContact O-N 3.47Å; I340-E342 VanDerWaalsContact C-N 3.33Å; I340-E342 PolarHBondContact O-N 2.6Å; E342-L344 VanDerWaalsContact C-N 3.27Å; E342-L344 PolarHBondContact O-N 3.32Å; E342-K345 WeakPolarHBondContact O-CB 3.44Å; E342-K345 PolarHBondContact O-N 3.25Å; E342-K345 VanDerWaalsContact O-N 3.11Å; E342-D346 PolarHBondContact O-N 2.77Å
343	N	78.4	Confident	78	Confident	56 Å²	56	70.5 Å²	70.5	30%	0.299	38%	0.378	S	S	.	.	H	α-helix	trans	-59.6	-37.1	174.6	-75.2	-18	0	0	0	112.4	I339 I340 D346 C347	I339-N343 WeakPolarHBondContact O-CB 3.3Å; I339-N343 PolarHBondContact O-N 3.27Å; I340-N343 PolarHBondContact O-N 2.78Å; N343-D346 PolarHBondContact O-N 2.87Å; N343-C347 PolarHBondContact O-N 2.94Å; N343-C347 PolarHBondContact O-SG 3.06Å
344	L	75.3	Confident	77	Confident	69 Å²	69	71.3 Å²	71.3	36%	0.361	38%	0.383	S	S	.	.	H	α-helix	trans	-69.8	-34	176.4	-72.3	173.5	0	0	0	113	I340 E342 C347 G348 L349	I340-L344 HydrophobicContact CG2-CD1 3.86Å; I340-L344 HydrophobicContact CG2-CG 4.35Å; I340-L344 WeakPolarHBondContact O-CB 3.32Å; I340-L344 VanDerWaalsContact O-CG 3.26Å; I340-L344 WeakPolarHBondContact O-CG 3.36Å; I340-L344 PolarHBondContact O-N 3.16Å; E342-L344 VanDerWaalsContact C-N 3.27Å; E342-L344 PolarHBondContact O-N 3.32Å; L344-C347 PolarHBondContact O-N 3.41Å; L344-G348 PolarHBondContact O-N 2.96Å; L344-L349 HydrophobicContact CD2-CD1 4.04Å; L344-L349 PolarHBondContact O-N 2.91Å
345	K	71.2	Confident	75.9	Confident	111 Å²	111	74.2 Å²	74.2	48%	0.483	39%	0.394	S	S	.	.	H	α-helix	trans	-64.4	-43	172.8	-75.4	174.4	176.8	-176.7	0	111.1	K341 E342 C347 G348 F350	K341-K345 WeakPolarHBondContact O-CG 3.29Å; K341-K345 PolarHBondContact O-N 2.91Å; E342-K345 WeakPolarHBondContact O-CB 3.44Å; E342-K345 PolarHBondContact O-N 3.25Å; E342-K345 VanDerWaalsContact O-N 3.11Å; K345-C347 PolarHBondContact O-N 3.3Å; K345-G348 PolarHBondContact O-N 2.89Å; K345-F350 HydrophobicContact CG-CB 4.19Å
346	D	67.4	Low	74.7	Confident	141 Å²	141	79.1 Å²	79.1	75%	0.754	42%	0.42	S	S	*	.	H	α-helix	trans	-63.7	-27.1	177.6	-71.9	-13	0	0	0	112.4	E342 N343 G348	E342-D346 PolarHBondContact O-N 2.77Å; N343-D346 PolarHBondContact O-N 2.87Å; D346-G348 VanDerWaalsContact C-N 3.31Å; D346-G348 PolarHBondContact O-N 2.91Å
347	C	62.6	Low	73.3	Confident	94 Å²	94	84.8 Å²	84.8	64%	0.635	45%	0.45	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.4	-2.4	173.7	-62.4	0	0	0	0	114.5	N343 L344 K345 L349	N343-C347 PolarHBondContact O-N 2.94Å; N343-C347 PolarHBondContact O-SG 3.06Å; L344-C347 PolarHBondContact O-N 3.41Å; K345-C347 PolarHBondContact O-N 3.3Å; C347-L349 HydrophobicContact CB-CD1 4.3Å; C347-L349 HydrophobicContact CB-CG 4.45Å
348	G	51.9	Low	71.8	Confident	63 Å²	63	85.2 Å²	85.2	65%	0.649	45%	0.452	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.9	22	-178.8	0	0	0	0	0	114.8	L344 K345 D346 F350	L344-G348 PolarHBondContact O-N 2.96Å; K345-G348 PolarHBondContact O-N 2.89Å; D346-G348 VanDerWaalsContact C-N 3.31Å; D346-G348 PolarHBondContact O-N 2.91Å; G348-F350 VanDerWaalsContact C-N 3.35Å
349	L	51.5	Low	70.5	Confident	128 Å²	128	90.2 Å²	90.2	67%	0.67	48%	0.479	S	S	*	.			trans	-93.4	14.4	179.7	-70.7	169.3	0	0	0	113.4	L344 C347	L344-L349 HydrophobicContact CD2-CD1 4.04Å; L344-L349 PolarHBondContact O-N 2.91Å; C347-L349 HydrophobicContact CB-CD1 4.3Å; C347-L349 HydrophobicContact CB-CG 4.45Å
350	F	41.6	Very low	68.7	Low	210 Å²	210	98.2 Å²	98.2	92%	0.921	52%	0.521	S	S	*	.			trans	-138.2	0	177.6	-118.9	-79.1	0	0	0	113.5	K345 G348	K345-F350 HydrophobicContact CG-CB 4.19Å; G348-F350 VanDerWaalsContact C-N 3.35Å

Retrieved 350 of 350 residues in 74.4 ms (Link to these results)

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