A0A096NP33_PAPAN Loading...

Post-GPI attachment to proteins GalNAc transferase 4

AlphaFold DB (Q9BRR3), UniProt , Accession A0A096NP33, Species PAPAN (Papio anubis, Olive baboon), Gene PGAP4, Length 403 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	53.1	Low	236 Å²	236	109.8 Å²	109.8	100%	1.163	67%	0.674	S	S	*	*				0	99.2	0	-80.9	171.8	158.6	0	0	108.7	T3	M1-T3 PolarHBondContact O-N 3.44Å
2	S	41.3	Very low	52.9	Low	126 Å²	126	110.2 Å²	110.2	88%	0.881	67%	0.667	S	S	*	*			trans	-76.3	100.2	174.6	49.2	0	0	0	0	109	S4	S2-S4 PolarHBondContact O-N 2.82Å; S2-S4 VanDerWaalsContact O-N 3.16Å
3	T	46.9	Very low	52.8	Low	129 Å²	129	115.7 Å²	115.7	79%	0.791	67%	0.669	S	S	*	*			trans	-74.5	102.7	175.9	40.3	0	0	0	0	109.5	M1 T5	M1-T3 PolarHBondContact O-N 3.44Å; T3-T5 PolarHBondContact O-N 3.41Å
4	S	51	Low	52.7	Low	115 Å²	115	121.3 Å²	121.3	80%	0.804	67%	0.673	S	S	*	*			trans	-67.8	110.8	171.2	69.4	0	0	0	0	109.1	S2 S6	S2-S4 PolarHBondContact O-N 2.82Å; S2-S4 VanDerWaalsContact O-N 3.16Å; S4-S6 PolarHBondContact O-N 3.35Å
5	T	52	Low	52.5	Low	95 Å²	95	120.4 Å²	120.4	58%	0.583	67%	0.666	S	S	*	*			trans	-68.2	116.1	171.6	45.5	0	0	0	0	109.7	T3	T3-T5 PolarHBondContact O-N 3.41Å
6	S	61.1	Low	51.8	Low	63 Å²	63	126.7 Å²	126.7	44%	0.441	68%	0.677	S	S	.	*			trans	-56.6	137	177.3	167.7	0	0	0	0	111.6	S4 A8 A9 M10	S4-S6 PolarHBondContact O-N 3.35Å; S6-A8 PolarHBondContact O-N 3.42Å; S6-A8 VanDerWaalsContact O-N 3.16Å; S6-A8 PolarHBondContact OG-N 3.03Å; S6-A9 WeakPolarHBondContact O-CB 3.37Å; S6-A9 PolarHBondContact O-N 3.37Å; S6-M10 PolarHBondContact O-N 3.47Å
7	P	65.2	Low	51.5	Low	107 Å²	107	131.2 Å²	131.2	70%	0.695	68%	0.682	S	S	*	*	H	α-helix	trans	-58.2	-28.5	178.5	21.6	-31.6	0	0	0	112.7	A9 M10 L11	P7-A9 PolarHBondContact O-N 3.38Å; P7-M10 PolarHBondContact O-N 3Å; P7-L11 PolarHBondContact O-N 2.92Å
8	A	57.5	Low	51.3	Low	57 Å²	57	129.9 Å²	129.9	47%	0.471	68%	0.675	S	S	.	*	H	α-helix	trans	-66.1	-35.8	174.2	0	0	0	0	0	112.5	S6 L11 L12	S6-A8 PolarHBondContact O-N 3.42Å; S6-A8 VanDerWaalsContact O-N 3.16Å; S6-A8 PolarHBondContact OG-N 3.03Å; A8-L11 PolarHBondContact O-N 2.76Å; A8-L12 WeakPolarHBondContact O-CB 3.49Å; A8-L12 PolarHBondContact O-N 2.95Å
9	A	53.8	Low	51.6	Low	50 Å²	50	126.6 Å²	126.6	41%	0.413	67%	0.665	S	S	.	*	H	α-helix	trans	-72.5	-29.3	176.2	0	0	0	0	0	112.3	S6 P7 R13	S6-A9 WeakPolarHBondContact O-CB 3.37Å; S6-A9 PolarHBondContact O-N 3.37Å; P7-A9 PolarHBondContact O-N 3.38Å; A9-R13 VanDerWaalsContact O-CB 3.31Å; A9-R13 WeakPolarHBondContact O-CB 3.49Å; A9-R13 WeakPolarHBondContact O-CG 3.49Å; A9-R13 PolarHBondContact O-N 3.46Å
10	M	57.9	Low	51.9	Low	115 Å²	115	131.4 Å²	131.4	57%	0.567	67%	0.674	S	S	*	*	H	α-helix	trans	-70.5	-39.8	169.1	-86.8	-165.1	-178.6	0	0	112.2	S6 P7 R13 R14	S6-M10 PolarHBondContact O-N 3.47Å; P7-M10 PolarHBondContact O-N 3Å; M10-R13 PolarHBondContact O-N 3.2Å; M10-R14 PolarHBondContact O-N 3.46Å
11	L	57.6	Low	52.6	Low	115 Å²	115	127 Å²	127	60%	0.602	66%	0.661	S	S	*	*	H	α-helix	trans	-66.2	-45	177.5	-143.3	96	0	0	0	111.5	P7 A8 R13 R14 L15	P7-L11 PolarHBondContact O-N 2.92Å; A8-L11 PolarHBondContact O-N 2.76Å; L11-R13 PolarHBondContact O-N 3Å; L11-R14 PolarHBondContact O-N 2.92Å; L11-L15 HydrophobicContact CD2-CD1 4.27Å; L11-L15 WeakPolarHBondContact O-CB 3.08Å; L11-L15 WeakPolarHBondContact O-CG 3.14Å; L11-L15 PolarHBondContact O-N 3.41Å
12	L	51.2	Low	54.7	Low	114 Å²	114	117.5 Å²	117.5	60%	0.597	62%	0.618	S	S	*	*	H	α-helix	trans	-65.5	-33.6	174.8	-87.4	152.4	0	0	0	112.8	A8 R16	A8-L12 WeakPolarHBondContact O-CB 3.49Å; A8-L12 PolarHBondContact O-N 2.95Å; L12-R16 WeakPolarHBondContact O-CB 3.3Å; L12-R16 PolarHBondContact O-N 3.09Å
13	R	50.4	Low	56.9	Low	182 Å²	182	113.6 Å²	113.6	69%	0.687	59%	0.589	S	S	*	*	H	α-helix	trans	-71.5	-32	171.2	-88.3	-179.7	165.3	-176.9	-2.9	113.1	A9 M10 L11 R17	A9-R13 VanDerWaalsContact O-CB 3.31Å; A9-R13 WeakPolarHBondContact O-CB 3.49Å; A9-R13 WeakPolarHBondContact O-CG 3.49Å; A9-R13 PolarHBondContact O-N 3.46Å; M10-R13 PolarHBondContact O-N 3.2Å; L11-R13 PolarHBondContact O-N 3Å; R13-R17 WeakPolarHBondContact O-CG 3.31Å; R13-R17 PolarHBondContact O-N 3.34Å
14	R	52.1	Low	59	Low	194 Å²	194	110.8 Å²	110.8	73%	0.732	58%	0.578	S	S	*	*	H	α-helix	trans	-71.2	-40.6	172.2	-79.8	-173.9	-179.3	-150.9	1.7	111.4	M10 L11 R17 L18	M10-R14 PolarHBondContact O-N 3.46Å; L11-R14 PolarHBondContact O-N 2.92Å; R14-R17 PolarHBondContact O-N 2.76Å; R14-L18 PolarHBondContact O-N 3.38Å
15	L	49	Very low	60.9	Low	108 Å²	108	106.6 Å²	106.6	57%	0.565	55%	0.548	S	S	*	.	H	α-helix	trans	-68.6	-36.9	174.6	-75.2	159.4	0	0	0	112.4	L11 R17 L18	L11-L15 HydrophobicContact CD2-CD1 4.27Å; L11-L15 WeakPolarHBondContact O-CB 3.08Å; L11-L15 WeakPolarHBondContact O-CG 3.14Å; L11-L15 PolarHBondContact O-N 3.41Å; L15-R17 VanDerWaalsContact C-N 3.27Å; L15-R17 PolarHBondContact O-N 3.01Å; L15-L18 WeakPolarHBondContact O-CB 3.18Å; L15-L18 PolarHBondContact O-N 3.02Å; L15-L18 VanDerWaalsContact O-N 3.13Å
16	R	41.2	Very low	62.8	Low	221 Å²	221	104.9 Å²	104.9	83%	0.834	53%	0.533	S	S	*	.	H	α-helix	trans	-69.1	-19.1	171.2	-99.2	-178.2	170.2	-178.1	-2.8	114.3	L12 L18	L12-R16 WeakPolarHBondContact O-CB 3.3Å; L12-R16 PolarHBondContact O-N 3.09Å; R16-L18 VanDerWaalsContact C-N 3.33Å
17	R	46.9	Very low	64.4	Low	203 Å²	203	102.6 Å²	102.6	77%	0.766	52%	0.516	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.2	-9.9	170.6	-78.6	-171.4	-149.2	-157.8	4.6	113.3	R13 R14 L15 S19	R13-R17 WeakPolarHBondContact O-CG 3.31Å; R13-R17 PolarHBondContact O-N 3.34Å; R14-R17 PolarHBondContact O-N 2.76Å; L15-R17 VanDerWaalsContact C-N 3.27Å; L15-R17 PolarHBondContact O-N 3.01Å; R17-S19 PolarHBondContact O-N 3.2Å
18	L	48.1	Very low	65.8	Low	108 Å²	108	104 Å²	104	57%	0.565	51%	0.511	S	S	*	.			trans	-73	65.6	150.9	-89.1	86.4	0	0	0	107.9	R14 L15 R16 V25	R14-L18 PolarHBondContact O-N 3.38Å; L15-L18 WeakPolarHBondContact O-CB 3.18Å; L15-L18 PolarHBondContact O-N 3.02Å; L15-L18 VanDerWaalsContact O-N 3.13Å; R16-L18 VanDerWaalsContact C-N 3.33Å; L18-V25 HydrophobicContact CB-CG2 4.3Å; L18-V25 HydrophobicContact CD2-CG2 3.61Å; L18-V25 HydrophobicContact CG-CG2 3.78Å
19	S	56.4	Low	67.6	Low	68 Å²	68	104.8 Å²	104.8	48%	0.476	51%	0.507	S	S	.	.			trans	-67.7	147.3	158.8	84.6	0	0	0	0	106.7	R17 G21 S22	R17-S19 PolarHBondContact O-N 3.2Å; S19-G21 PolarHBondContact O-N 3.29Å; S19-G21 PolarHBondContact OG-N 3.45Å; S19-S22 WeakPolarHBondContact O-CB 3.49Å; S19-S22 PolarHBondContact O-N 3.33Å
20	W	57.6	Low	69.6	Low	222 Å²	222	105.1 Å²	105.1	84%	0.841	50%	0.501	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.7	-10.7	174.9	-77.7	58.9	0	0	0	113.2
21	G	67.1	Low	71.4	Confident	39 Å²	39	101.8 Å²	101.8	40%	0.402	49%	0.487	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.1	-1.7	172.6	0	0	0	0	0	115.7	S19 T23 R286	S19-G21 PolarHBondContact O-N 3.29Å; S19-G21 PolarHBondContact OG-N 3.45Å; G21-T23 PolarHBondContact O-N 3.41Å; G21-R286 PolarHBondContact O-NH2 3.33Å
22	S	83.9	Confident	73.3	Confident	37 Å²	37	99.9 Å²	99.9	26%	0.259	48%	0.481	S	S	.	.			trans	-66.2	129.4	176.4	175.1	0	0	0	0	110.8	S19 A24 V25 Q26	S19-S22 WeakPolarHBondContact O-CB 3.49Å; S19-S22 PolarHBondContact O-N 3.33Å; S22-A24 PolarHBondContact O-N 3.27Å; S22-V25 PolarHBondContact O-N 3.39Å; S22-V25 VanDerWaalsContact O-N 3.07Å; S22-Q26 WeakPolarHBondContact O-CG 3.48Å; S22-Q26 PolarHBondContact O-N 3.08Å
23	T	89.1	Confident	75.5	Confident	44 Å²	44	97.2 Å²	97.2	27%	0.27	47%	0.469	S	S	.	.	H	α-helix	trans	-49.3	-47.4	176.5	-45.6	0	0	0	0	111.4	G21 V25 Q26 L27 Y280 R286 V293	G21-T23 PolarHBondContact O-N 3.41Å; T23-V25 VanDerWaalsContact C-N 3.32Å; T23-V25 PolarHBondContact O-N 2.69Å; T23-Q26 PolarHBondContact O-N 2.99Å; T23-L27 HydrophobicContact CG2-CD1 3.88Å; T23-L27 HydrophobicContact CG2-CG 4.23Å; T23-L27 VanDerWaalsContact O-CG 3.27Å; T23-L27 WeakPolarHBondContact O-CG 3.28Å; T23-L27 PolarHBondContact O-N 3.03Å; T23-Y280 HydrophobicContact CG2-CE1 4.31Å; T23-R286 PolarHBondContact OG1-NH1 3.2Å; T23-R286 PolarHBondContact OG1-NH2 3.06Å; T23-V293 HydrophobicContact CG2-CG2 3.74Å
24	A	89.7	Confident	77.7	Confident	69 Å²	69	89.1 Å²	89.1	57%	0.57	44%	0.44	S	S	*	.	H	α-helix	trans	-62.3	-40.6	-177.5	0	0	0	0	0	112	S22 F28	S22-A24 PolarHBondContact O-N 3.27Å; A24-F28 VanDerWaalsContact O-CB 3.25Å; A24-F28 WeakPolarHBondContact O-CB 3.46Å; A24-F28 PolarHBondContact O-N 3.12Å
25	V	91	Very high	79.9	Confident	27 Å²	27	82.1 Å²	82.1	16%	0.164	42%	0.415	C	S	.	.	H	α-helix	trans	-66.9	-43.7	177.8	177.4	0	0	0	0	110.4	L18 S22 T23 F28 I29	L18-V25 HydrophobicContact CB-CG2 4.3Å; L18-V25 HydrophobicContact CD2-CG2 3.61Å; L18-V25 HydrophobicContact CG-CG2 3.78Å; S22-V25 PolarHBondContact O-N 3.39Å; S22-V25 VanDerWaalsContact O-N 3.07Å; T23-V25 VanDerWaalsContact C-N 3.32Å; T23-V25 PolarHBondContact O-N 2.69Å; V25-F28 PolarHBondContact O-N 3.36Å; V25-I29 HydrophobicContact CG1-CD1 3.78Å; V25-I29 HydrophobicContact CG1-CG1 4.4Å; V25-I29 WeakPolarHBondContact O-CB 3.37Å; V25-I29 VanDerWaalsContact O-CG1 3.26Å; V25-I29 WeakPolarHBondContact O-CG1 3.39Å; V25-I29 PolarHBondContact O-N 2.94Å
26	Q	92	Very high	82.1	Confident	59 Å²	59	79.6 Å²	79.6	28%	0.276	42%	0.415	S	S	.	.	H	α-helix	trans	-62.2	-46.3	178.1	-69	173.3	-19.4	0	0	112.2	S22 T23 I29 L30 Y280	S22-Q26 WeakPolarHBondContact O-CG 3.48Å; S22-Q26 PolarHBondContact O-N 3.08Å; T23-Q26 PolarHBondContact O-N 2.99Å; Q26-I29 PolarHBondContact O-N 3.21Å; Q26-L30 WeakPolarHBondContact O-CB 3.46Å; Q26-L30 PolarHBondContact O-N 3.2Å; Q26-Y280 PolarHBondContact OE1-OH 2.73Å
27	L	94.6	Very high	84.7	Confident	15 Å²	15	73.8 Å²	73.8	8%	0.079	40%	0.4	C	S	.	.	H	α-helix	trans	-68	-35.4	178.6	-62.9	-179	0	0	0	112	T23 L30 T31 Y280 V293 F296 F297	T23-L27 HydrophobicContact CG2-CD1 3.88Å; T23-L27 HydrophobicContact CG2-CG 4.23Å; T23-L27 VanDerWaalsContact O-CG 3.27Å; T23-L27 WeakPolarHBondContact O-CG 3.28Å; T23-L27 PolarHBondContact O-N 3.03Å; L27-L30 PolarHBondContact O-N 3.03Å; L27-T31 PolarHBondContact O-N 3.14Å; L27-T31 PolarHBondContact O-OG1 2.89Å; L27-Y280 HydrophobicContact CD2-CE2 4.2Å; L27-V293 HydrophobicContact CD1-CG2 4.5Å; L27-F296 HydrophobicContact CB-CD1 4.29Å; L27-F296 HydrophobicContact CB-CD2 4.28Å; L27-F296 HydrophobicContact CB-CE1 3.97Å; L27-F296 HydrophobicContact CB-CE2 3.93Å; L27-F296 HydrophobicContact CB-CG 4.45Å; L27-F296 HydrophobicContact CB-CZ 3.77Å; L27-F296 HydrophobicContact CD1-CB 4.16Å; L27-F296 HydrophobicContact CD1-CD1 3.84Å; L27-F296 HydrophobicContact CD1-CD2 4.22Å; L27-F296 HydrophobicContact CD1-CE1 4.35Å; L27-F296 HydrophobicContact CD1-CG 3.79Å; L27-F296 HydrophobicContact CD2-CD1 3.74Å; L27-F296 HydrophobicContact CD2-CE1 3.66Å; L27-F296 HydrophobicContact CD2-CZ 4.34Å; L27-F296 HydrophobicContact CG-CD1 4.14Å; L27-F296 HydrophobicContact CG-CE1 4.17Å; L27-F296 HydrophobicContact CG-CG 4.46Å; L27-F296 HydrophobicContact CG-CZ 4.47Å; L27-F297 HydrophobicContact CD2-CE2 4.09Å; L27-F297 HydrophobicContact CD2-CZ 3.87Å
28	F	95.3	Very high	87.1	Confident	138 Å²	138	68.6 Å²	68.6	61%	0.605	39%	0.386	S	S	*	.	H	α-helix	trans	-64.4	-48.7	172.9	179.6	-99.2	0	0	0	111.7	A24 V25 L30 T31 V32	A24-F28 VanDerWaalsContact O-CB 3.25Å; A24-F28 WeakPolarHBondContact O-CB 3.46Å; A24-F28 PolarHBondContact O-N 3.12Å; V25-F28 PolarHBondContact O-N 3.36Å; F28-L30 VanDerWaalsContact C-N 3.3Å; F28-L30 PolarHBondContact O-N 2.87Å; F28-T31 WeakPolarHBondContact O-CB 3.38Å; F28-T31 PolarHBondContact O-N 3.49Å; F28-T31 VanDerWaalsContact O-N 3.13Å; F28-V32 HydrophobicContact CD1-CG2 4.27Å; F28-V32 HydrophobicContact CE1-CG2 3.8Å; F28-V32 HydrophobicContact CE2-CG2 4.17Å; F28-V32 HydrophobicContact CZ-CG2 3.75Å; F28-V32 WeakPolarHBondContact O-CG2 3.3Å; F28-V32 PolarHBondContact O-N 3.17Å
29	I	94.9	Very high	89.4	Confident	73 Å²	73	63.8 Å²	63.8	37%	0.374	36%	0.362	S	S	.	.	H	α-helix	trans	-58.1	-45.7	175.8	-69.3	167.6	0	0	0	110.1	V25 Q26 T31 V32 V33	V25-I29 HydrophobicContact CG1-CD1 3.78Å; V25-I29 HydrophobicContact CG1-CG1 4.4Å; V25-I29 WeakPolarHBondContact O-CB 3.37Å; V25-I29 VanDerWaalsContact O-CG1 3.26Å; V25-I29 WeakPolarHBondContact O-CG1 3.39Å; V25-I29 PolarHBondContact O-N 2.94Å; Q26-I29 PolarHBondContact O-N 3.21Å; I29-T31 VanDerWaalsContact C-N 3.3Å; I29-T31 PolarHBondContact O-N 2.94Å; I29-V32 PolarHBondContact O-N 3.09Å; I29-V33 HydrophobicContact CG2-CG2 4.09Å; I29-V33 WeakPolarHBondContact O-CB 3.41Å; I29-V33 VanDerWaalsContact O-CG2 3.27Å; I29-V33 WeakPolarHBondContact O-CG2 3.25Å; I29-V33 PolarHBondContact O-N 3.43Å
30	L	95.6	Very high	91.3	Very high	57 Å²	57	62.3 Å²	62.3	30%	0.298	35%	0.351	S	S	.	.	H	α-helix	trans	-56.6	-45.6	176.1	178.4	64.8	0	0	0	111.4	Q26 L27 F28 V33 T34 F296 F297 Y300	Q26-L30 WeakPolarHBondContact O-CB 3.46Å; Q26-L30 PolarHBondContact O-N 3.2Å; L27-L30 PolarHBondContact O-N 3.03Å; F28-L30 VanDerWaalsContact C-N 3.3Å; F28-L30 PolarHBondContact O-N 2.87Å; L30-V33 PolarHBondContact O-N 3.19Å; L30-T34 WeakPolarHBondContact O-CB 3.41Å; L30-T34 PolarHBondContact O-N 3.43Å; L30-T34 PolarHBondContact O-OG1 2.94Å; L30-F296 HydrophobicContact CD2-CE1 4.39Å; L30-F297 HydrophobicContact CD2-CE1 3.71Å; L30-F297 HydrophobicContact CD2-CZ 4.17Å; L30-Y300 HydrophobicContact CD2-CE2 4.35Å; L30-Y300 HydrophobicContact CG-CE2 4.15Å
31	T	96.6	Very high	93.1	Very high	44 Å²	44	57.2 Å²	57.2	27%	0.27	34%	0.34	S	S	.	.	H	α-helix	trans	-60.8	-49.2	178.6	-54.3	0	0	0	0	111.1	L27 F28 I29 V33 T34 F35 F296	L27-T31 PolarHBondContact O-N 3.14Å; L27-T31 PolarHBondContact O-OG1 2.89Å; F28-T31 WeakPolarHBondContact O-CB 3.38Å; F28-T31 PolarHBondContact O-N 3.49Å; F28-T31 VanDerWaalsContact O-N 3.13Å; I29-T31 VanDerWaalsContact C-N 3.3Å; I29-T31 PolarHBondContact O-N 2.94Å; T31-V33 PolarHBondContact O-N 3.01Å; T31-T34 PolarHBondContact O-N 3Å; T31-F35 HydrophobicContact CG2-CD2 3.69Å; T31-F35 HydrophobicContact CG2-CE2 4.16Å; T31-F35 WeakPolarHBondContact O-CB 3.36Å; T31-F35 WeakPolarHBondContact O-CD2 3.36Å; T31-F35 PolarHBondContact O-N 3.13Å; T31-F296 VanDerWaalsContact OG1-CZ 3.3Å; T31-F296 WeakPolarHBondContact OG1-CZ 3.48Å
32	V	97	Very high	94.5	Very high	76 Å²	76	59 Å²	59	46%	0.461	35%	0.351	S	S	.	.	H	α-helix	trans	-63	-44.3	179.8	173.5	0	0	0	0	111.1	F28 I29 G36	F28-V32 HydrophobicContact CD1-CG2 4.27Å; F28-V32 HydrophobicContact CE1-CG2 3.8Å; F28-V32 HydrophobicContact CE2-CG2 4.17Å; F28-V32 HydrophobicContact CZ-CG2 3.75Å; F28-V32 WeakPolarHBondContact O-CG2 3.3Å; F28-V32 PolarHBondContact O-N 3.17Å; I29-V32 PolarHBondContact O-N 3.09Å; V32-G36 WeakPolarHBondContact O-CA 3.23Å; V32-G36 PolarHBondContact O-N 3.3Å
33	V	97.4	Very high	95	Very high	57 Å²	57	57.8 Å²	57.8	35%	0.345	34%	0.342	S	S	.	.	H	α-helix	trans	-65.7	-46.3	178.9	171.7	0	0	0	0	110.6	I29 L30 T31 L37 L38	I29-V33 HydrophobicContact CG2-CG2 4.09Å; I29-V33 WeakPolarHBondContact O-CB 3.41Å; I29-V33 VanDerWaalsContact O-CG2 3.27Å; I29-V33 WeakPolarHBondContact O-CG2 3.25Å; I29-V33 PolarHBondContact O-N 3.43Å; L30-V33 PolarHBondContact O-N 3.19Å; T31-V33 PolarHBondContact O-N 3.01Å; V33-L37 WeakPolarHBondContact O-CA 3.39Å; V33-L37 VanDerWaalsContact O-CB 3.29Å; V33-L37 WeakPolarHBondContact O-CB 3.17Å; V33-L37 PolarHBondContact O-N 3.41Å; V33-L38 HydrophobicContact CG1-CD1 3.8Å; V33-L38 HydrophobicContact CG1-CG 3.94Å; V33-L38 PolarHBondContact O-N 2.86Å
34	T	97.3	Very high	95.3	Very high	13 Å²	13	57.4 Å²	57.4	8%	0.08	34%	0.337	C	S	.	.	I	π-helix	trans	-67	-59.3	179.9	-56.7	0	0	0	0	111.6	L30 T31 L38 A39 Y300 L304	L30-T34 WeakPolarHBondContact O-CB 3.41Å; L30-T34 PolarHBondContact O-N 3.43Å; L30-T34 PolarHBondContact O-OG1 2.94Å; T31-T34 PolarHBondContact O-N 3Å; T34-L38 PolarHBondContact O-N 2.9Å; T34-A39 VanDerWaalsContact O-CB 3.22Å; T34-A39 WeakPolarHBondContact O-CB 3.36Å; T34-A39 PolarHBondContact O-N 2.87Å; T34-Y300 VanDerWaalsContact CB-OH 3.31Å; T34-Y300 WeakPolarHBondContact CB-OH 3.11Å; T34-Y300 HydrophobicContact CG2-CE2 4.21Å; T34-Y300 WeakPolarHBondContact CG2-OH 3.4Å; T34-Y300 PolarHBondContact OG1-OH 2.73Å; T34-L304 HydrophobicContact CG2-CD1 4.18Å
35	F	96.8	Very high	95.5	Very high	47 Å²	47	62 Å²	62	21%	0.206	34%	0.339	C	S	.	.	I	π-helix	trans	-83.7	-23.2	-170	-63.5	-78	0	0	0	113.4	T31 P40 F51 Y300 L304 L307	T31-F35 HydrophobicContact CG2-CD2 3.69Å; T31-F35 HydrophobicContact CG2-CE2 4.16Å; T31-F35 WeakPolarHBondContact O-CB 3.36Å; T31-F35 WeakPolarHBondContact O-CD2 3.36Å; T31-F35 PolarHBondContact O-N 3.13Å; F35-P40 VanDerWaalsContact O-CD 3.3Å; F35-P40 WeakPolarHBondContact O-CD 3.26Å; F35-P40 VanDerWaalsContact O-CG 3.27Å; F35-P40 WeakPolarHBondContact O-CG 3.41Å; F35-F51 HydrophobicContact CD1-CZ 4.27Å; F35-Y300 HydrophobicContact CD2-CE2 4.29Å; F35-Y300 AromaticContact CE2-CD2 3.45Å; F35-Y300 HydrophobicContact CE2-CD2 3.45Å; F35-Y300 VanDerWaalsContact CE2-CD2 3.45Å; F35-Y300 AromaticContact CE2-CE2 3.47Å; F35-Y300 HydrophobicContact CE2-CE2 3.47Å; F35-Y300 VanDerWaalsContact CE2-CE2 3.47Å; F35-Y300 HydrophobicContact CE2-CG 4.32Å; F35-Y300 AromaticContact CZ-CD2 3.97Å; F35-Y300 HydrophobicContact CZ-CD2 3.97Å; F35-Y300 HydrophobicContact CZ-CE2 4.06Å; F35-Y300 HydrophobicContact CZ-CG 4.43Å; F35-L304 HydrophobicContact CE1-CB 4.04Å; F35-L304 HydrophobicContact CE1-CD1 3.99Å; F35-L304 HydrophobicContact CZ-CB 4.13Å; F35-L307 HydrophobicContact CD1-CD1 3.6Å; F35-L307 HydrophobicContact CE1-CD1 3.73Å
36	G	95.8	Very high	95.6	Very high	55 Å²	55	63.3 Å²	63.3	57%	0.567	35%	0.345	S	S	*	.	I	π-helix	trans	-94.8	-21.8	179.4	0	0	0	0	0	114.6	V32	V32-G36 WeakPolarHBondContact O-CA 3.23Å; V32-G36 PolarHBondContact O-N 3.3Å
37	L	96.3	Very high	95.6	Very high	99 Å²	99	62 Å²	62	52%	0.518	34%	0.34	S	S	.	.	I	π-helix	trans	-126.2	-64.7	-177.1	-167.2	91.2	0	0	0	112.2	V33 L41	V33-L37 WeakPolarHBondContact O-CA 3.39Å; V33-L37 VanDerWaalsContact O-CB 3.29Å; V33-L37 WeakPolarHBondContact O-CB 3.17Å; V33-L37 PolarHBondContact O-N 3.41Å; L37-L41 HydrophobicContact CD1-CD1 4.32Å; L37-L41 HydrophobicContact CG-CD1 3.92Å; L37-L41 VanDerWaalsContact O-CB 3.32Å; L37-L41 WeakPolarHBondContact O-CB 3.28Å; L37-L41 WeakPolarHBondContact O-CG 3.19Å; L37-L41 PolarHBondContact O-N 2.89Å
38	L	97.1	Very high	95.4	Very high	93 Å²	93	62.8 Å²	62.8	49%	0.487	34%	0.344	S	S	.	.	I	π-helix	trans	-68.6	-49.6	-168.1	-63.2	177.9	0	0	0	112.9	V33 T34 L41 A42	V33-L38 HydrophobicContact CG1-CD1 3.8Å; V33-L38 HydrophobicContact CG1-CG 3.94Å; V33-L38 PolarHBondContact O-N 2.86Å; T34-L38 PolarHBondContact O-N 2.9Å; L38-L41 PolarHBondContact O-N 3.46Å; L38-A42 VanDerWaalsContact O-CB 3.26Å; L38-A42 WeakPolarHBondContact O-CB 3.42Å; L38-A42 PolarHBondContact O-N 3.21Å
39	A	96	Very high	95.3	Very high	7 Å²	7	56.6 Å²	56.6	6%	0.058	32%	0.317	C	S	.	.	H	α-helix	trans	-65.9	-44.3	-178.7	0	0	0	0	0	111.8	T34 L41 A42 C43 F51 L304	T34-A39 VanDerWaalsContact O-CB 3.22Å; T34-A39 WeakPolarHBondContact O-CB 3.36Å; T34-A39 PolarHBondContact O-N 2.87Å; A39-L41 PolarHBondContact O-N 3.23Å; A39-A42 PolarHBondContact O-N 3.01Å; A39-C43 WeakPolarHBondContact O-CA 3.49Å; A39-C43 WeakPolarHBondContact O-CB 3.21Å; A39-C43 PolarHBondContact O-N 3.39Å; A39-C43 PolarHBondContact O-SG 3.03Å; A39-C43 VanDerWaalsContact O-SG 3.35Å; A39-F51 HydrophobicContact CB-CD2 4.07Å; A39-F51 HydrophobicContact CB-CE1 4.33Å; A39-F51 HydrophobicContact CB-CE2 3.51Å; A39-F51 HydrophobicContact CB-CZ 3.66Å; A39-L304 HydrophobicContact CB-CD1 4.29Å
40	P	95.9	Very high	95.2	Very high	38 Å²	38	59.1 Å²	59.1	25%	0.247	32%	0.323	C	S	.	.	H	α-helix	trans	-54.2	-49.3	168.5	-26.6	33.3	0	0	0	113.1	F35 A42 C43 H44 F51	F35-P40 VanDerWaalsContact O-CD 3.3Å; F35-P40 WeakPolarHBondContact O-CD 3.26Å; F35-P40 VanDerWaalsContact O-CG 3.27Å; F35-P40 WeakPolarHBondContact O-CG 3.41Å; P40-A42 VanDerWaalsContact C-N 3.34Å; P40-A42 PolarHBondContact O-N 2.83Å; P40-C43 PolarHBondContact O-N 3.42Å; P40-H44 WeakPolarHBondContact O-CB 3.35Å; P40-H44 PolarHBondContact O-N 2.98Å; P40-F51 HydrophobicContact CB-CD1 4.14Å; P40-F51 HydrophobicContact CG-CD1 3.66Å; P40-F51 HydrophobicContact CG-CE1 3.74Å
41	L	95.8	Very high	95.2	Very high	115 Å²	115	57.9 Å²	57.9	60%	0.602	32%	0.315	S	S	*	.	H	α-helix	trans	-67.6	-30.5	-178.8	-70.9	173.9	0	0	0	113.7	L37 L38 A39 H44	L37-L41 HydrophobicContact CD1-CD1 4.32Å; L37-L41 HydrophobicContact CG-CD1 3.92Å; L37-L41 VanDerWaalsContact O-CB 3.32Å; L37-L41 WeakPolarHBondContact O-CB 3.28Å; L37-L41 WeakPolarHBondContact O-CG 3.19Å; L37-L41 PolarHBondContact O-N 2.89Å; L38-L41 PolarHBondContact O-N 3.46Å; A39-L41 PolarHBondContact O-N 3.23Å; L41-H44 PolarHBondContact O-CD2 2.85Å
42	A	95.7	Very high	95.1	Very high	76 Å²	76	57.1 Å²	57.1	63%	0.628	31%	0.308	S	S	*	.	H	α-helix	trans	-85	-33.2	178.7	0	0	0	0	0	112.6	L38 A39 P40	L38-A42 VanDerWaalsContact O-CB 3.26Å; L38-A42 WeakPolarHBondContact O-CB 3.42Å; L38-A42 PolarHBondContact O-N 3.21Å; A39-A42 PolarHBondContact O-N 3.01Å; P40-A42 VanDerWaalsContact C-N 3.34Å; P40-A42 PolarHBondContact O-N 2.83Å
43	C	96	Very high	94.9	Very high	11 Å²	11	56.9 Å²	56.9	7%	0.074	30%	0.304	C	S	.	.	H	α-helix	trans	-108.4	-0	-167.8	-54.2	0	0	0	0	113.8	A39 P40 R45 L46 F51	A39-C43 WeakPolarHBondContact O-CA 3.49Å; A39-C43 WeakPolarHBondContact O-CB 3.21Å; A39-C43 PolarHBondContact O-N 3.39Å; A39-C43 PolarHBondContact O-SG 3.03Å; A39-C43 VanDerWaalsContact O-SG 3.35Å; P40-C43 PolarHBondContact O-N 3.42Å; C43-R45 PolarHBondContact O-N 3.04Å; C43-L46 HydrophobicContact CB-CB 4.47Å; C43-L46 HydrophobicContact CB-CD1 3.84Å; C43-L46 HydrophobicContact CB-CG 4.32Å; C43-L46 WeakPolarHBondContact O-CB 3.34Å; C43-L46 PolarHBondContact O-N 2.98Å; C43-F51 HydrophobicContact CB-CB 3.85Å; C43-F51 HydrophobicContact CB-CD2 3.96Å; C43-F51 HydrophobicContact CB-CG 4.29Å
44	H	94.8	Very high	94.6	Very high	37 Å²	37	60.9 Å²	60.9	17%	0.171	31%	0.312	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62	-19.6	-176.1	71.6	93.1	0	0	0	115.1	P40 L41 F51 Y52 L53 H57	P40-H44 WeakPolarHBondContact O-CB 3.35Å; P40-H44 PolarHBondContact O-N 2.98Å; L41-H44 PolarHBondContact O-CD2 2.85Å; H44-F51 WeakPolarHBondContact CA-O 3.33Å; H44-Y52 WeakPolarHBondContact O-CD2 3.35Å; H44-L53 HydrophobicContact CB-CD1 3.88Å; H44-L53 HydrophobicContact CB-CG 3.95Å; H44-L53 PolarHBondContact O-N 2.93Å; H44-L53 VanDerWaalsContact O-N 3.1Å; H44-H57 AromaticContact CE1-CE1 3.74Å; H44-H57 AromaticContact CE1-NE2 3.38Å; H44-H57 PolarHBondContact CE1-NE2 2.93Å; H44-H57 AromaticContact CG-NE2 3.99Å; H44-H57 AromaticContact ND1-CD2 3.66Å; H44-H57 AromaticContact ND1-CE1 3.58Å; H44-H57 AromaticContact ND1-NE2 2.78Å; H44-H57 PolarHBondContact ND1-NE2 2.85Å; H44-H57 PolarHBondContact O-CD2 3.2Å
45	R	93.5	Very high	94.3	Very high	164 Å²	164	68.9 Å²	68.9	62%	0.619	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.7	-7	175.8	-55.8	-171.9	-175.2	-165.7	-4.5	113.7	C43 L47	C43-R45 PolarHBondContact O-N 3.04Å; R45-L47 PolarHBondContact O-N 2.94Å
46	L	93.8	Very high	94	Very high	55 Å²	55	75.3 Å²	75.3	29%	0.288	37%	0.371	S	S	.	.	S	Bend	trans	-78.7	104.7	-178.1	-66.2	-175.3	0	0	0	109.2	C43 H48 S49 Y52 V308 Y312	C43-L46 HydrophobicContact CB-CB 4.47Å; C43-L46 HydrophobicContact CB-CD1 3.84Å; C43-L46 HydrophobicContact CB-CG 4.32Å; C43-L46 WeakPolarHBondContact O-CB 3.34Å; C43-L46 PolarHBondContact O-N 2.98Å; L46-H48 PolarHBondContact O-N 3.5Å; L46-S49 VanDerWaalsContact O-CB 3.23Å; L46-S49 WeakPolarHBondContact O-CB 3.22Å; L46-S49 PolarHBondContact O-N 2.62Å; L46-Y52 WeakPolarHBondContact O-CB 3.35Å; L46-V308 HydrophobicContact CD1-CG1 4.25Å; L46-Y312 VanDerWaalsContact C-OH 3.23Å; L46-Y312 VanDerWaalsContact CA-OH 3.29Å; L46-Y312 WeakPolarHBondContact CA-OH 3.22Å; L46-Y312 HydrophobicContact CB-CE2 3.73Å; L46-Y312 WeakPolarHBondContact CB-OH 3.4Å; L46-Y312 HydrophobicContact CD1-CD2 4.48Å; L46-Y312 HydrophobicContact CD1-CE2 4.17Å; L46-Y312 HydrophobicContact CD2-CE1 4.1Å; L46-Y312 HydrophobicContact CG-CE2 4.35Å
47	L	91.3	Very high	93.8	Very high	32 Å²	32	73.5 Å²	73.5	17%	0.168	35%	0.348	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.5	135.4	178.9	-168.8	69.1	0	0	0	110.7	R45 S49 Y52 M61 Y312 L402 L403	R45-L47 PolarHBondContact O-N 2.94Å; L47-S49 PolarHBondContact O-N 2.68Å; L47-S49 VanDerWaalsContact O-N 3.17Å; L47-Y52 HydrophobicContact CD1-CD1 4.46Å; L47-Y52 HydrophobicContact CD1-CE1 3.89Å; L47-Y52 HydrophobicContact CD1-CE2 4.3Å; L47-M61 HydrophobicContact CB-CE 4.31Å; L47-M61 HydrophobicContact CD1-CE 3.9Å; L47-Y312 PolarHBondContact N-OH 3.33Å; L47-Y312 VanDerWaalsContact N-OH 3.1Å; L47-Y312 PolarHBondContact O-OH 2.9Å; L47-L402 HydrophobicContact CD2-CB 4.11Å; L47-L403 HydrophobicContact CD1-CD2 3.95Å; L47-L403 HydrophobicContact CD1-CG 4.2Å
48	H	90.5	Very high	93.5	Very high	32 Å²	32	69.3 Å²	69.3	15%	0.148	33%	0.326	C	S	.	.	T	Hydrogen-bonded Turn	trans	66.5	0.8	-175.3	-42	-58.5	0	0	0	116.4	L46 R250 H253 L403	L46-H48 PolarHBondContact O-N 3.5Å; H48-R250 WeakPolarHBondContact ND1-CB 3.29Å; H48-H253 PolarHBondContact O-CE1 2.85Å; H48-H253 VanDerWaalsContact O-CE1 3.26Å; H48-L403 VanDerWaalsContact CE1-CD2 3.42Å; H48-L403 WeakPolarHBondContact CE1-CD2 3.41Å
49	S	93.7	Very high	93.2	Very high	8 Å²	8	70.6 Å²	70.6	6%	0.056	33%	0.334	C	S	.	.	S	Bend	trans	-65.3	149	161.6	177.7	0	0	0	0	110.1	L46 L47 F51 Y52 L307 V308	L46-S49 VanDerWaalsContact O-CB 3.23Å; L46-S49 WeakPolarHBondContact O-CB 3.22Å; L46-S49 PolarHBondContact O-N 2.62Å; L47-S49 PolarHBondContact O-N 2.68Å; L47-S49 VanDerWaalsContact O-N 3.17Å; S49-F51 PolarHBondContact O-N 3.1Å; S49-F51 PolarHBondContact OG-N 2.86Å; S49-F51 VanDerWaalsContact OG-N 3.17Å; S49-Y52 WeakPolarHBondContact O-CB 3.49Å; S49-Y52 PolarHBondContact O-N 2.88Å; S49-L307 PolarHBondContact OG-O 3.36Å; S49-V308 WeakPolarHBondContact CA-O 3.36Å; S49-V308 WeakPolarHBondContact CB-O 3.43Å; S49-V308 PolarHBondContact OG-O 2.97Å
50	Y	93.2	Very high	93	Very high	125 Å²	125	75 Å²	75	49%	0.49	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.5	-20.5	171.1	-74.5	-102.6	0	0	0	112.6	Y52 H253 E306 L307	Y50-Y52 VanDerWaalsContact C-N 3.31Å; Y50-H253 AromaticContact CE2-CE1 3.65Å; Y50-H253 AromaticContact CE2-ND1 3.58Å; Y50-E306 WeakPolarHBondContact CD2-O 3.45Å; Y50-E306 HydrophobicContact CE2-CG 4.4Å; Y50-E306 WeakPolarHBondContact CE2-O 3.45Å; Y50-E306 PolarHBondContact OH-OE1 2.96Å; Y50-L307 HydrophobicContact CD1-CD2 4.19Å; Y50-L307 HydrophobicContact CD2-CD2 4.15Å; Y50-L307 HydrophobicContact CG-CD2 3.78Å; Y50-L307 PolarHBondContact N-O 2.84Å
51	F	94.4	Very high	92.9	Very high	31 Å²	31	75 Å²	75	14%	0.136	35%	0.35	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85	-4.6	175.7	-63.2	-64.9	0	0	0	113.5	F35 A39 P40 C43 H44 S49 L53 L307	F35-F51 HydrophobicContact CD1-CZ 4.27Å; A39-F51 HydrophobicContact CB-CD2 4.07Å; A39-F51 HydrophobicContact CB-CE1 4.33Å; A39-F51 HydrophobicContact CB-CE2 3.51Å; A39-F51 HydrophobicContact CB-CZ 3.66Å; P40-F51 HydrophobicContact CB-CD1 4.14Å; P40-F51 HydrophobicContact CG-CD1 3.66Å; P40-F51 HydrophobicContact CG-CE1 3.74Å; C43-F51 HydrophobicContact CB-CB 3.85Å; C43-F51 HydrophobicContact CB-CD2 3.96Å; C43-F51 HydrophobicContact CB-CG 4.29Å; H44-F51 WeakPolarHBondContact CA-O 3.33Å; S49-F51 PolarHBondContact O-N 3.1Å; S49-F51 PolarHBondContact OG-N 2.86Å; S49-F51 VanDerWaalsContact OG-N 3.17Å; F51-L53 PolarHBondContact O-N 2.63Å; F51-L307 HydrophobicContact CD2-CB 4.38Å; F51-L307 HydrophobicContact CE2-CB 3.59Å; F51-L307 HydrophobicContact CE2-CD1 4.38Å; F51-L307 HydrophobicContact CZ-CB 4.05Å; F51-L307 HydrophobicContact CZ-CD1 4.01Å
52	Y	94.7	Very high	92.7	Very high	29 Å²	29	69.8 Å²	69.8	11%	0.114	32%	0.324	C	S	.	.			trans	-61.7	121.3	-175.6	179.6	-115.6	0	0	0	112.6	H44 L46 L47 S49 Y50 R54 H57 L58 M61 L403	H44-Y52 WeakPolarHBondContact O-CD2 3.35Å; L46-Y52 WeakPolarHBondContact O-CB 3.35Å; L47-Y52 HydrophobicContact CD1-CD1 4.46Å; L47-Y52 HydrophobicContact CD1-CE1 3.89Å; L47-Y52 HydrophobicContact CD1-CE2 4.3Å; S49-Y52 WeakPolarHBondContact O-CB 3.49Å; S49-Y52 PolarHBondContact O-N 2.88Å; Y50-Y52 VanDerWaalsContact C-N 3.31Å; Y52-R54 HydrophobicContact CD1-CB 4.23Å; Y52-R54 VanDerWaalsContact CE1-CA 3.5Å; Y52-R54 HydrophobicContact CE1-CB 3.92Å; Y52-R54 HydrophobicContact CE1-CG 4.31Å; Y52-R54 PolarHBondContact O-N 3.42Å; Y52-R54 VanDerWaalsContact O-N 3.15Å; Y52-H57 HydrophobicContact CE2-CB 3.65Å; Y52-L58 WeakPolarHBondContact OH-CA 3.3Å; Y52-L58 PolarHBondContact OH-N 3.23Å; Y52-M61 HydrophobicContact CD2-CE 4.36Å; Y52-M61 HydrophobicContact CE2-CE 3.22Å; Y52-M61 VanDerWaalsContact CZ-CE 3.44Å; Y52-M61 WeakPolarHBondContact OH-CE 3.46Å; Y52-L403 HydrophobicContact CE1-CD1 4.15Å
53	L	92.6	Very high	92.5	Very high	71 Å²	71	72 Å²	72	37%	0.372	32%	0.321	S	S	.	.			trans	-89.2	81	179.2	-65	178.4	0	0	0	110.8	H44 F51 H55 W56 H57	H44-L53 HydrophobicContact CB-CD1 3.88Å; H44-L53 HydrophobicContact CB-CG 3.95Å; H44-L53 PolarHBondContact O-N 2.93Å; H44-L53 VanDerWaalsContact O-N 3.1Å; F51-L53 PolarHBondContact O-N 2.63Å; L53-H55 VanDerWaalsContact C-N 3.3Å; L53-H55 PolarHBondContact O-N 3.23Å; L53-W56 HydrophobicContact CB-CB 4.24Å; L53-W56 HydrophobicContact CB-CD2 4.36Å; L53-W56 HydrophobicContact CB-CE3 4.37Å; L53-W56 HydrophobicContact CB-CG 4.32Å; L53-W56 HydrophobicContact CD1-CD2 3.94Å; L53-W56 HydrophobicContact CD1-CE3 3.38Å; L53-W56 HydrophobicContact CD1-CH2 4.17Å; L53-W56 HydrophobicContact CD1-CZ3 3.5Å; L53-W56 PolarHBondContact O-N 3.17Å; L53-H57 PolarHBondContact O-N 3.25Å; L53-H57 VanDerWaalsContact O-N 3.11Å
54	R	91.1	Very high	92.4	Very high	140 Å²	140	76 Å²	76	53%	0.528	34%	0.339	S	S	.	.	H	α-helix	trans	-46.8	-48.1	-177.2	-175	-179.1	177	172	3.9	113.8	Y52 W56 H57 L58 L403	Y52-R54 HydrophobicContact CD1-CB 4.23Å; Y52-R54 VanDerWaalsContact CE1-CA 3.5Å; Y52-R54 HydrophobicContact CE1-CB 3.92Å; Y52-R54 HydrophobicContact CE1-CG 4.31Å; Y52-R54 PolarHBondContact O-N 3.42Å; Y52-R54 VanDerWaalsContact O-N 3.15Å; R54-W56 PolarHBondContact O-N 3.27Å; R54-H57 PolarHBondContact O-N 3.1Å; R54-L58 HydrophobicContact CG-CB 3.95Å; R54-L58 HydrophobicContact CG-CD2 3.83Å; R54-L58 HydrophobicContact CG-CG 4.46Å; R54-L58 WeakPolarHBondContact O-CB 3.49Å; R54-L58 PolarHBondContact O-N 3.27Å; R54-L403 HydrophobicContact CG-CD1 4.08Å
55	H	90.6	Very high	92.3	Very high	181 Å²	181	77.2 Å²	77.2	84%	0.838	34%	0.343	S	S	*	.	H	α-helix	trans	-63.5	-25.9	-177.2	-67.7	90.6	0	0	0	113.5	L53	L53-H55 VanDerWaalsContact C-N 3.3Å; L53-H55 PolarHBondContact O-N 3.23Å
56	W	90.7	Very high	92.2	Very high	182 Å²	182	71.1 Å²	71.1	69%	0.689	32%	0.323	S	S	*	.	H	α-helix	trans	-92.7	-33.5	-177.3	-66.3	1.9	0	0	0	112.1	L53 R54	L53-W56 HydrophobicContact CB-CB 4.24Å; L53-W56 HydrophobicContact CB-CD2 4.36Å; L53-W56 HydrophobicContact CB-CE3 4.37Å; L53-W56 HydrophobicContact CB-CG 4.32Å; L53-W56 HydrophobicContact CD1-CD2 3.94Å; L53-W56 HydrophobicContact CD1-CE3 3.38Å; L53-W56 HydrophobicContact CD1-CH2 4.17Å; L53-W56 HydrophobicContact CD1-CZ3 3.5Å; L53-W56 PolarHBondContact O-N 3.17Å; R54-W56 PolarHBondContact O-N 3.27Å
57	H	92.5	Very high	92.2	Very high	18 Å²	18	74.9 Å²	74.9	8%	0.083	34%	0.339	C	S	.	.	H	α-helix	trans	-114.4	-21.9	-168.4	-62.4	-56.5	0	0	0	115	H44 Y52 L53 R54 N59 Q60 M61	H44-H57 AromaticContact CE1-CE1 3.74Å; H44-H57 AromaticContact CE1-NE2 3.38Å; H44-H57 PolarHBondContact CE1-NE2 2.93Å; H44-H57 AromaticContact CG-NE2 3.99Å; H44-H57 AromaticContact ND1-CD2 3.66Å; H44-H57 AromaticContact ND1-CE1 3.58Å; H44-H57 AromaticContact ND1-NE2 2.78Å; H44-H57 PolarHBondContact ND1-NE2 2.85Å; H44-H57 PolarHBondContact O-CD2 3.2Å; Y52-H57 HydrophobicContact CE2-CB 3.65Å; L53-H57 PolarHBondContact O-N 3.25Å; L53-H57 VanDerWaalsContact O-N 3.11Å; R54-H57 PolarHBondContact O-N 3.1Å; H57-N59 PolarHBondContact O-N 3.27Å; H57-Q60 PolarHBondContact O-N 3.28Å; H57-M61 HydrophobicContact CB-CE 4.04Å; H57-M61 HydrophobicContact CB-CG 4.46Å; H57-M61 VanDerWaalsContact O-CB 3.32Å; H57-M61 WeakPolarHBondContact O-CB 3.34Å; H57-M61 WeakPolarHBondContact O-CG 3.35Å; H57-M61 PolarHBondContact O-N 3.33Å
58	L	90.7	Very high	92.4	Very high	10 Å²	10	77.5 Å²	77.5	5%	0.052	35%	0.35	C	S	.	.	H	α-helix	trans	-63.2	-49.3	-169	-179.2	64.3	0	0	0	112	Y52 R54 S62 L402 L403	Y52-L58 WeakPolarHBondContact OH-CA 3.3Å; Y52-L58 PolarHBondContact OH-N 3.23Å; R54-L58 HydrophobicContact CG-CB 3.95Å; R54-L58 HydrophobicContact CG-CD2 3.83Å; R54-L58 HydrophobicContact CG-CG 4.46Å; R54-L58 WeakPolarHBondContact O-CB 3.49Å; R54-L58 PolarHBondContact O-N 3.27Å; L58-S62 VanDerWaalsContact O-CB 3.24Å; L58-S62 WeakPolarHBondContact O-CB 3.28Å; L58-S62 PolarHBondContact O-N 2.62Å; L58-S62 PolarHBondContact O-OG 3.4Å; L58-L402 HydrophobicContact CD1-CB 4.32Å; L58-L403 HydrophobicContact CD1-CB 4.13Å; L58-L403 HydrophobicContact CD1-CD1 3.79Å; L58-L403 HydrophobicContact CD1-CG 3.69Å; L58-L403 HydrophobicContact CD2-CD1 4.12Å
59	N	89.6	Confident	92.5	Very high	121 Å²	121	76.1 Å²	76.1	65%	0.647	34%	0.344	S	S	*	.	H	α-helix	trans	-66	-44.8	-178	-67.3	-10.7	0	0	0	110.9	H57 S62 Q63	H57-N59 PolarHBondContact O-N 3.27Å; N59-S62 PolarHBondContact O-N 3.31Å; N59-Q63 WeakPolarHBondContact O-CB 3.43Å; N59-Q63 VanDerWaalsContact O-CG 3.32Å; N59-Q63 WeakPolarHBondContact O-CG 3.43Å; N59-Q63 PolarHBondContact O-N 3.5Å
60	Q	92.3	Very high	92.6	Very high	99 Å²	99	79.2 Å²	79.2	46%	0.463	36%	0.36	S	S	.	.	H	α-helix	trans	-61.4	-52.3	177.8	-178.2	-179.5	-8.2	0	0	111.1	H57 S62 Q63 E64	H57-Q60 PolarHBondContact O-N 3.28Å; Q60-S62 VanDerWaalsContact C-N 3.3Å; Q60-S62 PolarHBondContact O-N 3.37Å; Q60-Q63 PolarHBondContact O-N 2.9Å; Q60-Q63 VanDerWaalsContact O-N 3.17Å; Q60-E64 HydrophobicContact CG-CG 4.37Å; Q60-E64 VanDerWaalsContact CG-OE1 3.29Å; Q60-E64 WeakPolarHBondContact CG-OE1 3.28Å; Q60-E64 PolarHBondContact NE2-OE1 3.1Å; Q60-E64 WeakPolarHBondContact O-CB 3.47Å; Q60-E64 WeakPolarHBondContact O-CG 3.29Å; Q60-E64 PolarHBondContact O-N 3.21Å
61	M	92.9	Very high	92.8	Very high	38 Å²	38	79.9 Å²	79.9	19%	0.187	37%	0.365	C	S	.	.	H	α-helix	trans	-63.8	-35.5	179.2	-73.6	-162.9	-56.9	0	0	112.2	L47 Y52 H57 F65 L402	L47-M61 HydrophobicContact CB-CE 4.31Å; L47-M61 HydrophobicContact CD1-CE 3.9Å; Y52-M61 HydrophobicContact CD2-CE 4.36Å; Y52-M61 HydrophobicContact CE2-CE 3.22Å; Y52-M61 VanDerWaalsContact CZ-CE 3.44Å; Y52-M61 WeakPolarHBondContact OH-CE 3.46Å; H57-M61 HydrophobicContact CB-CE 4.04Å; H57-M61 HydrophobicContact CB-CG 4.46Å; H57-M61 VanDerWaalsContact O-CB 3.32Å; H57-M61 WeakPolarHBondContact O-CB 3.34Å; H57-M61 WeakPolarHBondContact O-CG 3.35Å; H57-M61 PolarHBondContact O-N 3.33Å; M61-F65 WeakPolarHBondContact O-CB 3.2Å; M61-F65 PolarHBondContact O-N 2.74Å; M61-L402 HydrophobicContact CB-CD1 3.79Å; M61-L402 WeakPolarHBondContact O-CD1 3.41Å
62	S	91.6	Very high	92.9	Very high	6 Å²	6	82.3 Å²	82.3	4%	0.042	38%	0.377	C	S	.	.	H	α-helix	trans	-66.7	-38.9	176	-55.4	0	0	0	0	111.2	L58 N59 Q60 L66 L402	L58-S62 VanDerWaalsContact O-CB 3.24Å; L58-S62 WeakPolarHBondContact O-CB 3.28Å; L58-S62 PolarHBondContact O-N 2.62Å; L58-S62 PolarHBondContact O-OG 3.4Å; N59-S62 PolarHBondContact O-N 3.31Å; Q60-S62 VanDerWaalsContact C-N 3.3Å; Q60-S62 PolarHBondContact O-N 3.37Å; S62-L66 VanDerWaalsContact O-CG 3.28Å; S62-L66 WeakPolarHBondContact O-CG 3.39Å; S62-L66 PolarHBondContact O-N 3.21Å; S62-L402 PolarHBondContact OG-N 3.49Å
63	Q	91.8	Very high	92.9	Very high	123 Å²	123	81 Å²	81	58%	0.575	37%	0.372	S	S	*	.	H	α-helix	trans	-68.1	-45	174.5	-74.6	177.6	-9.5	0	0	112.3	N59 Q60 F65 L66 Q67	N59-Q63 WeakPolarHBondContact O-CB 3.43Å; N59-Q63 VanDerWaalsContact O-CG 3.32Å; N59-Q63 WeakPolarHBondContact O-CG 3.43Å; N59-Q63 PolarHBondContact O-N 3.5Å; Q60-Q63 PolarHBondContact O-N 2.9Å; Q60-Q63 VanDerWaalsContact O-N 3.17Å; Q63-F65 VanDerWaalsContact C-N 3.28Å; Q63-F65 PolarHBondContact O-N 2.89Å; Q63-L66 PolarHBondContact O-N 3.3Å; Q63-Q67 WeakPolarHBondContact O-CG 3.49Å; Q63-Q67 PolarHBondContact O-N 2.91Å
64	E	93.6	Very high	93.1	Very high	95 Å²	95	83.2 Å²	83.2	44%	0.444	38%	0.38	S	S	.	.	H	α-helix	trans	-58.8	-42.8	174.8	-73.6	171.6	-178.3	0	0	110.7	Q60 Q67 Q68	Q60-E64 HydrophobicContact CG-CG 4.37Å; Q60-E64 VanDerWaalsContact CG-OE1 3.29Å; Q60-E64 WeakPolarHBondContact CG-OE1 3.28Å; Q60-E64 PolarHBondContact NE2-OE1 3.1Å; Q60-E64 WeakPolarHBondContact O-CB 3.47Å; Q60-E64 WeakPolarHBondContact O-CG 3.29Å; Q60-E64 PolarHBondContact O-N 3.21Å; E64-Q67 PolarHBondContact O-N 2.62Å; E64-Q68 WeakPolarHBondContact O-CB 3.44Å; E64-Q68 PolarHBondContact O-N 2.97Å
65	F	93	Very high	93.4	Very high	61 Å²	61	79 Å²	79	27%	0.268	38%	0.375	S	S	.	.	H	α-helix	trans	-63	-45.1	175.5	-174.6	-82.2	0	0	0	112.2	M61 Q63 Q67 Q68 S69 I388 L390 L402	M61-F65 WeakPolarHBondContact O-CB 3.2Å; M61-F65 PolarHBondContact O-N 2.74Å; Q63-F65 VanDerWaalsContact C-N 3.28Å; Q63-F65 PolarHBondContact O-N 2.89Å; F65-Q67 PolarHBondContact O-N 2.76Å; F65-Q68 PolarHBondContact O-N 3.47Å; F65-S69 WeakPolarHBondContact O-CB 3.47Å; F65-S69 PolarHBondContact O-N 3.37Å; F65-I388 WeakPolarHBondContact CE1-O 3.33Å; F65-I388 HydrophobicContact CZ-CB 4.24Å; F65-I388 HydrophobicContact CZ-CG2 4.46Å; F65-L390 HydrophobicContact CD1-CD1 3.35Å; F65-L390 HydrophobicContact CD1-CG 3.85Å; F65-L390 HydrophobicContact CE1-CD1 3.81Å; F65-L390 HydrophobicContact CE1-CG 3.77Å; F65-L390 HydrophobicContact CG-CD1 4.36Å; F65-L402 HydrophobicContact CB-CD1 4.14Å; F65-L402 HydrophobicContact CB-CD2 4.12Å; F65-L402 HydrophobicContact CB-CG 4.4Å; F65-L402 HydrophobicContact CD1-CD2 4.15Å; F65-L402 HydrophobicContact CD2-CD2 3.75Å; F65-L402 HydrophobicContact CE2-CD2 4.19Å; F65-L402 HydrophobicContact CG-CD2 3.72Å
66	L	91.7	Very high	93.7	Very high	36 Å²	36	70.5 Å²	70.5	19%	0.188	34%	0.336	C	S	.	.	H	α-helix	trans	-61.5	-44.1	176.7	-75.8	166.6	0	0	0	111.7	S62 Q63 S69 L70 F115 L390 F391 P400	S62-L66 VanDerWaalsContact O-CG 3.28Å; S62-L66 WeakPolarHBondContact O-CG 3.39Å; S62-L66 PolarHBondContact O-N 3.21Å; Q63-L66 PolarHBondContact O-N 3.3Å; L66-S69 PolarHBondContact O-N 2.88Å; L66-L70 WeakPolarHBondContact O-CG 3.29Å; L66-L70 PolarHBondContact O-N 3.48Å; L66-F115 HydrophobicContact CD2-CE1 3.76Å; L66-F115 HydrophobicContact CD2-CZ 3.75Å; L66-L390 HydrophobicContact CD1-CD1 4.43Å; L66-L390 HydrophobicContact CD2-CB 4.29Å; L66-L390 HydrophobicContact CD2-CD1 3.44Å; L66-L390 VanDerWaalsContact CD2-CD1 3.44Å; L66-L390 HydrophobicContact CG-CD1 3.59Å; L66-F391 HydrophobicContact CD2-CE2 3.76Å; L66-F391 HydrophobicContact CD2-CZ 4.29Å; L66-P400 HydrophobicContact CD2-CG 4.35Å
67	Q	94	Very high	94	Very high	134 Å²	134	63.2 Å²	63.2	63%	0.626	31%	0.311	S	S	*	.	H	α-helix	trans	-62.9	-43.2	176.9	-73.6	177.3	-4.5	0	0	111.7	Q63 E64 F65 L70 K71	Q63-Q67 WeakPolarHBondContact O-CG 3.49Å; Q63-Q67 PolarHBondContact O-N 2.91Å; E64-Q67 PolarHBondContact O-N 2.62Å; F65-Q67 PolarHBondContact O-N 2.76Å; Q67-L70 PolarHBondContact O-N 3.45Å; Q67-K71 PolarHBondContact O-N 2.76Å; Q67-K71 VanDerWaalsContact O-N 3.07Å
68	Q	95.1	Very high	94.2	Very high	88 Å²	88	66.4 Å²	66.4	41%	0.411	33%	0.326	S	S	.	.	H	α-helix	trans	-64.4	-44.1	176.7	-176.1	61.4	20.4	0	0	111.2	E64 F65 L70 K71 E72	E64-Q68 WeakPolarHBondContact O-CB 3.44Å; E64-Q68 PolarHBondContact O-N 2.97Å; F65-Q68 PolarHBondContact O-N 3.47Å; Q68-L70 VanDerWaalsContact C-N 3.31Å; Q68-L70 PolarHBondContact O-N 2.88Å; Q68-K71 WeakPolarHBondContact O-CB 3.46Å; Q68-K71 PolarHBondContact O-N 3.29Å; Q68-E72 HydrophobicContact CG-CG 4.46Å; Q68-E72 WeakPolarHBondContact CG-OE1 3.42Å; Q68-E72 PolarHBondContact NE2-OE1 2.8Å; Q68-E72 WeakPolarHBondContact O-CB 3.36Å; Q68-E72 WeakPolarHBondContact O-CG 3.33Å; Q68-E72 PolarHBondContact O-N 2.85Å
69	S	93.9	Very high	94.4	Very high	3 Å²	3	67.8 Å²	67.8	2%	0.021	33%	0.331	C	S	.	.	H	α-helix	trans	-63.4	-34.6	177.5	-176.1	0	0	0	0	112.6	F65 L66 G73 Q120	F65-S69 WeakPolarHBondContact O-CB 3.47Å; F65-S69 PolarHBondContact O-N 3.37Å; L66-S69 PolarHBondContact O-N 2.88Å; S69-G73 PolarHBondContact O-N 3.36Å; S69-Q120 PolarHBondContact O-NE2 2.81Å; S69-Q120 VanDerWaalsContact O-NE2 3.11Å
70	L	94.8	Very high	94.6	Very high	73 Å²	73	62 Å²	62	38%	0.382	30%	0.3	S	S	.	.	H	α-helix	trans	-66	-45.9	172.9	-76.2	169.8	0	0	0	111.1	L66 Q67 Q68 E72 G73 E74 F115	L66-L70 WeakPolarHBondContact O-CG 3.29Å; L66-L70 PolarHBondContact O-N 3.48Å; Q67-L70 PolarHBondContact O-N 3.45Å; Q68-L70 VanDerWaalsContact C-N 3.31Å; Q68-L70 PolarHBondContact O-N 2.88Å; L70-E72 VanDerWaalsContact C-N 3.34Å; L70-E72 PolarHBondContact O-N 3.11Å; L70-G73 PolarHBondContact O-N 2.86Å; L70-E74 PolarHBondContact O-N 2.81Å; L70-F115 HydrophobicContact CD1-CE1 4.41Å; L70-F115 HydrophobicContact CD1-CZ 4.5Å; L70-F115 HydrophobicContact CD2-CD1 3.82Å; L70-F115 HydrophobicContact CD2-CD2 4.29Å; L70-F115 HydrophobicContact CD2-CE1 3.72Å; L70-F115 HydrophobicContact CD2-CE2 4.19Å; L70-F115 HydrophobicContact CD2-CG 4.11Å; L70-F115 HydrophobicContact CD2-CZ 3.89Å; L70-F115 HydrophobicContact CG-CD1 4Å; L70-F115 HydrophobicContact CG-CE1 3.6Å; L70-F115 HydrophobicContact CG-CZ 4.04Å
71	K	96.9	Very high	94.5	Very high	139 Å²	139	62.5 Å²	62.5	60%	0.604	30%	0.302	S	S	*	.	H	α-helix	trans	-62.4	-41.4	178	-175.7	-178.3	177.9	-176.9	0	112.1	Q67 Q68 A75	Q67-K71 PolarHBondContact O-N 2.76Å; Q67-K71 VanDerWaalsContact O-N 3.07Å; Q68-K71 WeakPolarHBondContact O-CB 3.46Å; Q68-K71 PolarHBondContact O-N 3.29Å; K71-A75 WeakPolarHBondContact O-CB 3.44Å; K71-A75 PolarHBondContact O-N 2.99Å
72	E	96.4	Very high	94.3	Very high	82 Å²	82	68 Å²	68	38%	0.383	33%	0.327	S	S	.	.	H	α-helix	trans	-67.6	-38.3	175.9	-73.3	174.8	-176.3	0	0	111.5	Q68 L70 A75 A76 Q120	Q68-E72 HydrophobicContact CG-CG 4.46Å; Q68-E72 WeakPolarHBondContact CG-OE1 3.42Å; Q68-E72 PolarHBondContact NE2-OE1 2.8Å; Q68-E72 WeakPolarHBondContact O-CB 3.36Å; Q68-E72 WeakPolarHBondContact O-CG 3.33Å; Q68-E72 PolarHBondContact O-N 2.85Å; L70-E72 VanDerWaalsContact C-N 3.34Å; L70-E72 PolarHBondContact O-N 3.11Å; E72-A75 PolarHBondContact O-N 3.04Å; E72-A76 WeakPolarHBondContact O-CB 3.44Å; E72-A76 PolarHBondContact O-N 3.17Å; E72-Q120 HydrophobicContact CB-CG 4.43Å
73	G	96.2	Very high	94.1	Very high	0 Å²	0	68.9 Å²	68.9	0%	0	33%	0.331	C	S	.	.	H	α-helix	trans	-59.3	-49.1	172.2	0	0	0	0	0	112.8	S69 L70 A76 L77 F115	S69-G73 PolarHBondContact O-N 3.36Å; L70-G73 PolarHBondContact O-N 2.86Å; G73-A76 PolarHBondContact O-N 2.03Å; G73-L77 PolarHBondContact O-N 3.3Å; G73-F115 VanDerWaalsContact CA-O 3.26Å; G73-F115 WeakPolarHBondContact CA-O 3.39Å
74	E	96.8	Very high	93.3	Very high	118 Å²	118	68.1 Å²	68.1	55%	0.551	34%	0.337	S	S	*	.	H	α-helix	trans	-63.3	-41.5	176.9	-173.4	174.3	-159.3	0	0	111.8	L70 A76 L77 H78	L70-E74 PolarHBondContact O-N 2.81Å; E74-A76 VanDerWaalsContact C-N 3.32Å; E74-A76 PolarHBondContact O-N 2.98Å; E74-L77 PolarHBondContact O-N 3.26Å; E74-H78 PolarHBondContact O-CD2 3.01Å; E74-H78 PolarHBondContact O-N 3.49Å
75	A	97.1	Very high	91.8	Very high	51 Å²	51	66.9 Å²	66.9	42%	0.421	34%	0.339	S	S	.	.	H	α-helix	trans	-64.2	-36.2	175.1	0	0	0	0	0	112.6	K71 E72 Y79	K71-A75 WeakPolarHBondContact O-CB 3.44Å; K71-A75 PolarHBondContact O-N 2.99Å; E72-A75 PolarHBondContact O-N 3.04Å; A75-Y79 WeakPolarHBondContact O-CB 3.22Å; A75-Y79 PolarHBondContact O-N 2.77Å
76	A	97	Very high	90	Very high	3 Å²	3	65.8 Å²	65.8	3%	0.025	34%	0.341	C	S	.	.	H	α-helix	trans	-70.6	-36.7	175.5	0	0	0	0	0	112.1	E72 G73 E74 Y79 F80 L119 Q120	E72-A76 WeakPolarHBondContact O-CB 3.44Å; E72-A76 PolarHBondContact O-N 3.17Å; G73-A76 PolarHBondContact O-N 2.03Å; E74-A76 VanDerWaalsContact C-N 3.32Å; E74-A76 PolarHBondContact O-N 2.98Å; A76-Y79 WeakPolarHBondContact O-CB 3.35Å; A76-Y79 PolarHBondContact O-N 2.94Å; A76-F80 VanDerWaalsContact O-CD2 3.23Å; A76-F80 WeakPolarHBondContact O-CD2 3.43Å; A76-F80 PolarHBondContact O-N 2.83Å; A76-L119 HydrophobicContact CB-CB 3.83Å; A76-Q120 HydrophobicContact CB-CG 4.03Å
77	L	96	Very high	87.9	Confident	29 Å²	29	72.1 Å²	72.1	15%	0.152	38%	0.375	C	S	.	.	H	α-helix	trans	-60.9	-54	172.1	178	60.8	0	0	0	110.9	G73 E74 Y79 F80 E81 L119 F153 L157	G73-L77 PolarHBondContact O-N 3.3Å; E74-L77 PolarHBondContact O-N 3.26Å; L77-Y79 PolarHBondContact O-N 2.78Å; L77-F80 PolarHBondContact O-N 2.91Å; L77-F80 VanDerWaalsContact O-N 3.07Å; L77-E81 HydrophobicContact CD1-CG 4.23Å; L77-E81 HydrophobicContact CG-CG 4.48Å; L77-E81 WeakPolarHBondContact O-CG 3.01Å; L77-E81 PolarHBondContact O-N 3.48Å; L77-L119 HydrophobicContact CB-CD1 4.03Å; L77-L119 HydrophobicContact CD1-CD1 3.83Å; L77-F153 HydrophobicContact CD1-CE1 3.96Å; L77-F153 HydrophobicContact CD1-CZ 4.49Å; L77-L157 HydrophobicContact CD1-CD2 3.56Å
78	H	95.9	Very high	85.3	Confident	86 Å²	86	68.9 Å²	68.9	40%	0.398	38%	0.378	S	S	.	.	H	α-helix	trans	-54.5	-41.5	176.1	-91.8	-69.8	0	0	0	112.3	E74 F80 E81 E82	E74-H78 PolarHBondContact O-CD2 3.01Å; E74-H78 PolarHBondContact O-N 3.49Å; H78-F80 VanDerWaalsContact C-N 3.28Å; H78-F80 PolarHBondContact O-N 2.83Å; H78-E81 PolarHBondContact O-N 2.87Å; H78-E82 WeakPolarHBondContact O-CB 3.28Å; H78-E82 WeakPolarHBondContact O-CG 3.45Å; H78-E82 PolarHBondContact O-N 2.97Å
79	Y	95.6	Very high	82.6	Confident	39 Å²	39	69.7 Å²	69.7	15%	0.153	39%	0.393	C	S	.	.	H	α-helix	trans	-56.2	-41.1	178.2	178.1	-98.7	0	0	0	112.9	A75 A76 L77 L83 H126 R127	A75-Y79 WeakPolarHBondContact O-CB 3.22Å; A75-Y79 PolarHBondContact O-N 2.77Å; A76-Y79 WeakPolarHBondContact O-CB 3.35Å; A76-Y79 PolarHBondContact O-N 2.94Å; L77-Y79 PolarHBondContact O-N 2.78Å; Y79-L83 HydrophobicContact CE1-CD1 4.13Å; Y79-L83 HydrophobicContact CE2-CD1 4.33Å; Y79-L83 WeakPolarHBondContact O-CB 3.32Å; Y79-L83 PolarHBondContact O-N 2.82Å; Y79-H126 AromaticContact CE1-ND1 3.44Å; Y79-H126 WeakPolarHBondContact CE1-ND1 3.19Å; Y79-H126 AromaticContact CZ-ND1 3.48Å; Y79-H126 PolarHBondContact OH-CE1 2.6Å; Y79-H126 VanDerWaalsContact OH-CE1 3.25Å; Y79-H126 PolarHBondContact OH-ND1 3.39Å; Y79-R127 HydrophobicContact CE2-CG 4.15Å
80	F	94	Very high	80.3	Confident	0 Å²	0	72.4 Å²	72.4	0%	0	41%	0.41	C	S	.	.	H	α-helix	trans	-80.8	-34.1	177.9	-74.1	-66.7	0	0	0	113	A76 L77 H78 E82 L83 L119 V122 L157 L158 Y161	A76-F80 VanDerWaalsContact O-CD2 3.23Å; A76-F80 WeakPolarHBondContact O-CD2 3.43Å; A76-F80 PolarHBondContact O-N 2.83Å; L77-F80 PolarHBondContact O-N 2.91Å; L77-F80 VanDerWaalsContact O-N 3.07Å; H78-F80 VanDerWaalsContact C-N 3.28Å; H78-F80 PolarHBondContact O-N 2.83Å; F80-E82 VanDerWaalsContact C-N 3.33Å; F80-E82 PolarHBondContact O-N 2.85Å; F80-L83 PolarHBondContact O-N 3.01Å; F80-L119 HydrophobicContact CD2-CB 4.3Å; F80-L119 HydrophobicContact CD2-CD2 4.03Å; F80-L119 HydrophobicContact CE2-CB 4.26Å; F80-L119 HydrophobicContact CE2-CD2 4.26Å; F80-V122 HydrophobicContact CE1-CG1 4.29Å; F80-V122 HydrophobicContact CE2-CB 4.39Å; F80-V122 HydrophobicContact CE2-CG1 4.44Å; F80-V122 HydrophobicContact CZ-CB 4Å; F80-V122 HydrophobicContact CZ-CG1 3.62Å; F80-L157 HydrophobicContact CB-CD2 4.06Å; F80-L157 HydrophobicContact CB-CG 4.34Å; F80-L158 HydrophobicContact CD1-CD2 4.1Å; F80-L158 HydrophobicContact CD2-CD2 3.97Å; F80-L158 HydrophobicContact CE1-CD2 3.8Å; F80-L158 HydrophobicContact CE2-CD2 3.64Å; F80-L158 HydrophobicContact CG-CD2 4.19Å; F80-L158 HydrophobicContact CZ-CD2 3.57Å; F80-Y161 HydrophobicContact CB-CE2 4.31Å; F80-Y161 AromaticContact CD1-CD2 3.99Å; F80-Y161 HydrophobicContact CD1-CD2 3.99Å; F80-Y161 HydrophobicContact CD1-CE2 4.28Å; F80-Y161 HydrophobicContact CD1-CG 4.37Å; F80-Y161 PolarHBondContact O-OH 3.36Å
81	E	90.7	Very high	78	Confident	109 Å²	109	71.3 Å²	71.3	51%	0.509	41%	0.407	S	S	.	.	H	α-helix	trans	-65	-37	176.3	-70.3	-174.8	156.8	0	0	112.7	L77 H78	L77-E81 HydrophobicContact CD1-CG 4.23Å; L77-E81 HydrophobicContact CG-CG 4.48Å; L77-E81 WeakPolarHBondContact O-CG 3.01Å; L77-E81 PolarHBondContact O-N 3.48Å; H78-E81 PolarHBondContact O-N 2.87Å
82	E	89.3	Confident	75.7	Confident	152 Å²	152	71.6 Å²	71.6	71%	0.71	41%	0.414	S	S	*	.	H	α-helix	trans	-80.2	-18	176.8	-67.4	178.9	179.6	0	0	112.9	H78 F80 P84	H78-E82 WeakPolarHBondContact O-CB 3.28Å; H78-E82 WeakPolarHBondContact O-CG 3.45Å; H78-E82 PolarHBondContact O-N 2.97Å; F80-E82 VanDerWaalsContact C-N 3.33Å; F80-E82 PolarHBondContact O-N 2.85Å; E82-P84 WeakPolarHBondContact O-CD 3.34Å
83	L	87.2	Confident	73.5	Confident	25 Å²	25	69.4 Å²	69.4	13%	0.131	41%	0.406	C	S	.	.	S	Bend	trans	-68.2	124.6	179.9	-144.5	88.7	0	0	0	109.6	Y79 F80 S85 Y161	Y79-L83 HydrophobicContact CE1-CD1 4.13Å; Y79-L83 HydrophobicContact CE2-CD1 4.33Å; Y79-L83 WeakPolarHBondContact O-CB 3.32Å; Y79-L83 PolarHBondContact O-N 2.82Å; F80-L83 PolarHBondContact O-N 3.01Å; L83-S85 PolarHBondContact O-N 2.87Å; L83-S85 VanDerWaalsContact O-N 3.08Å; L83-Y161 HydrophobicContact CB-CE1 3.86Å; L83-Y161 HydrophobicContact CD2-CD1 3.68Å; L83-Y161 HydrophobicContact CD2-CE1 3.84Å; L83-Y161 HydrophobicContact CD2-CG 4.49Å; L83-Y161 HydrophobicContact CG-CE1 4.39Å; L83-Y161 PolarHBondContact O-OH 3.24Å; L83-Y161 VanDerWaalsContact O-OH 3.12Å
84	P	74	Confident	71.7	Confident	107 Å²	107	70.6 Å²	70.6	70%	0.695	41%	0.41	S	S	*	.	P	Polyproline II helix	trans	-54	122	177.2	-24.2	32.5	0	0	0	110.1	E82	E82-P84 WeakPolarHBondContact O-CD 3.34Å
85	S	63	Low	69.9	Low	69 Å²	69	71.3 Å²	71.3	48%	0.483	41%	0.414	S	S	.	.	P	Polyproline II helix	trans	-58.8	142.3	179	-35.2	0	0	0	0	109.3	L83 N87	L83-S85 PolarHBondContact O-N 2.87Å; L83-S85 VanDerWaalsContact O-N 3.08Å; S85-N87 PolarHBondContact O-N 3.28Å
86	A	54.7	Low	68.3	Low	39 Å²	39	72 Å²	72	32%	0.322	42%	0.419	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.9	6	-172	0	0	0	0	0	116.7	G88 K160	A86-G88 VanDerWaalsContact C-N 3.34Å; A86-G88 PolarHBondContact O-N 3.35Å; A86-K160 WeakPolarHBondContact CB-O 3.36Å
87	N	47	Very low	67	Low	168 Å²	168	73.9 Å²	73.9	90%	0.898	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.8	-4.9	176.9	-74.8	-5.8	0	0	0	114.6	S85	S85-N87 PolarHBondContact O-N 3.28Å
88	G	40.7	Very low	65.9	Low	67 Å²	67	78.7 Å²	78.7	69%	0.691	46%	0.463	S	S	*	.	S	Bend	trans	-113.4	-26.3	-176	0	0	0	0	0	116.9	A86	A86-G88 VanDerWaalsContact C-N 3.34Å; A86-G88 PolarHBondContact O-N 3.35Å
89	S	38.1	Very low	65.6	Low	104 Å²	104	83.6 Å²	83.6	73%	0.727	48%	0.478	S	S	*	.			trans	173.4	112.6	174.6	25.6	0	0	0	0	105.5	P91	S89-P91 WeakPolarHBondContact O-CD 3.43Å; S89-P91 VanDerWaalsContact O-N 3.15Å
90	V	45.5	Very low	65.5	Low	60 Å²	60	81.8 Å²	81.8	36%	0.364	47%	0.471	S	S	.	.			trans	-61.2	117.3	178.6	-177.7	0	0	0	0	107.5	I92 W94 Q95	V90-I92 PolarHBondContact O-N 3.12Å; V90-W94 HydrophobicContact CG1-CB 3.72Å; V90-Q95 HydrophobicContact CB-CG 4.33Å; V90-Q95 HydrophobicContact CG1-CG 3.91Å
91	P	46.3	Very low	65.5	Low	51 Å²	51	84 Å²	84	33%	0.331	48%	0.48	S	S	.	.			trans	-56.4	132	167.1	-17	28.7	0	0	0	107	S89 V93 W94	S89-P91 WeakPolarHBondContact O-CD 3.43Å; S89-P91 VanDerWaalsContact O-N 3.15Å; P91-V93 PolarHBondContact O-N 2.86Å; P91-W94 PolarHBondContact O-N 3.44Å
92	I	47.3	Very low	65.8	Low	144 Å²	144	78.8 Å²	78.8	74%	0.738	46%	0.456	S	S	*	.	G	3₁₀ helix	trans	-42.5	-26.4	-171.4	-67.6	162.2	0	0	0	114.1	V90 W94	V90-I92 PolarHBondContact O-N 3.12Å; I92-W94 PolarHBondContact O-N 3.48Å
93	V	51.7	Low	66.2	Low	37 Å²	37	71.6 Å²	71.6	22%	0.224	42%	0.422	C	S	.	.	G	3₁₀ helix	trans	-62.8	-20.4	-179.9	-170.4	0	0	0	0	114.5	P91 L129 Q130	P91-V93 PolarHBondContact O-N 2.86Å; V93-L129 HydrophobicContact CG1-CB 3.88Å; V93-L129 HydrophobicContact CG1-CD1 4.08Å; V93-Q130 HydrophobicContact CG2-CG 4.08Å
94	W	57.8	Low	66.7	Low	24 Å²	24	70.4 Å²	70.4	9%	0.091	42%	0.416	C	S	.	.	G	3₁₀ helix	trans	-112.8	-2.7	-168.1	-54.4	106	0	0	0	115.8	V90 P91 I92 A96 H126 L141 V162	V90-W94 HydrophobicContact CG1-CB 3.72Å; P91-W94 PolarHBondContact O-N 3.44Å; I92-W94 PolarHBondContact O-N 3.48Å; W94-A96 PolarHBondContact O-N 2.82Å; W94-H126 AromaticContact CE2-CD2 3.51Å; W94-H126 AromaticContact CE2-NE2 3.59Å; W94-H126 HydrophobicContact CH2-CB 4.43Å; W94-H126 AromaticContact CH2-CD2 3.87Å; W94-H126 HydrophobicContact CZ2-CB 4.23Å; W94-H126 AromaticContact CZ2-CD2 2.99Å; W94-H126 WeakPolarHBondContact CZ2-CD2 2.98Å; W94-H126 AromaticContact CZ2-CG 3.65Å; W94-H126 AromaticContact CZ2-NE2 3.45Å; W94-H126 WeakPolarHBondContact CZ2-NE2 3.02Å; W94-H126 AromaticContact NE1-CD2 3.65Å; W94-H126 AromaticContact NE1-NE2 3.22Å; W94-H126 PolarHBondContact NE1-NE2 2.78Å; W94-L141 HydrophobicContact CH2-CB 4.45Å; W94-L141 HydrophobicContact CH2-CD2 3.59Å; W94-L141 HydrophobicContact CZ3-CB 3.81Å; W94-L141 HydrophobicContact CZ3-CD2 3.74Å; W94-L141 HydrophobicContact CZ3-CG 4.26Å; W94-V162 HydrophobicContact CE3-CB 4.27Å; W94-V162 HydrophobicContact CE3-CG1 4.07Å; W94-V162 HydrophobicContact CH2-CB 4.19Å; W94-V162 HydrophobicContact CH2-CG1 3.2Å; W94-V162 HydrophobicContact CZ2-CG1 4.11Å; W94-V162 HydrophobicContact CZ3-CB 3.63Å; W94-V162 HydrophobicContact CZ3-CG1 3.16Å
95	Q	58.6	Low	67.8	Low	134 Å²	134	65.3 Å²	65.3	63%	0.626	38%	0.382	S	S	*	.	S	Bend	trans	-73.6	116.5	170.7	-80.5	-176.3	-14.8	0	0	108.6	V90 T97	V90-Q95 HydrophobicContact CB-CG 4.33Å; V90-Q95 HydrophobicContact CG1-CG 3.91Å; Q95-T97 PolarHBondContact O-N 2.95Å
96	A	64.3	Low	69.5	Low	65 Å²	65	62 Å²	62	54%	0.537	36%	0.36	S	S	.	.			trans	-48	109.1	177.8	0	0	0	0	0	110	W94	W94-A96 PolarHBondContact O-N 2.82Å
97	T	70	Confident	71.6	Confident	43 Å²	43	61 Å²	61	26%	0.264	35%	0.348	S	S	.	.			trans	-71.9	135.5	178	41	0	0	0	0	108.9	Q95 R99 P100 E137	Q95-T97 PolarHBondContact O-N 2.95Å; T97-R99 PolarHBondContact O-N 3.42Å; T97-P100 VanDerWaalsContact O-CD 3.31Å; T97-P100 WeakPolarHBondContact O-CD 3.46Å; T97-P100 WeakPolarHBondContact OG1-CB 3.42Å; T97-E137 WeakPolarHBondContact CG2-O 3.4Å
98	P	71.4	Confident	73.9	Confident	129 Å²	129	53 Å²	53	84%	0.838	31%	0.306	S	S	*	.	S	Bend	trans	-65.3	108.9	172.5	-16.2	28.9	0	0	0	108.5
99	R	89.5	Confident	76.4	Confident	189 Å²	189	50.8 Å²	50.8	71%	0.713	28%	0.279	S	S	*	.	S	Bend	trans	59.9	73.2	-176.1	-62.5	-179.7	173.3	174.8	-2	113.7	T97 Y202 N203	T97-R99 PolarHBondContact O-N 3.42Å; R99-Y202 WeakPolarHBondContact CA-O 3.46Å; R99-N203 PolarHBondContact NE-ND2 2.81Å
100	P	93.9	Very high	78.8	Confident	1 Å²	1	49.1 Å²	49.1	1%	0.006	26%	0.262	C	S	.	.			trans	-57.3	143.2	172.8	24.3	-32.9	0	0	0	111	T97 V103 G138 Q140 Y202 P204 D205	T97-P100 VanDerWaalsContact O-CD 3.31Å; T97-P100 WeakPolarHBondContact O-CD 3.46Å; T97-P100 WeakPolarHBondContact OG1-CB 3.42Å; P100-V103 HydrophobicContact CB-CG2 4.17Å; P100-V103 HydrophobicContact CG-CG2 3.37Å; P100-G138 CarbonylContact C-O 3.55Å; P100-G138 WeakPolarHBondContact CA-O 3.38Å; P100-G138 WeakPolarHBondContact CB-O 3.41Å; P100-Q140 HydrophobicContact CB-CB 3.79Å; P100-Q140 HydrophobicContact CG-CB 3.85Å; P100-Y202 HydrophobicContact CG-CD1 4.23Å; P100-Y202 HydrophobicContact CG-CG 4.21Å; P100-P204 HydrophobicContact CG-CB 4.27Å; P100-P204 WeakPolarHBondContact O-CA 3.34Å; P100-P204 WeakPolarHBondContact O-CB 3.43Å; P100-D205 PolarHBondContact O-N 2.97Å
101	W	95.2	Very high	80.7	Confident	47 Å²	47	48.1 Å²	48.1	18%	0.178	25%	0.252	C	S	.	.	S	Bend	trans	-63.6	-43.5	170.8	178	66.5	0	0	0	111.1	G138 H139 D205 Y206 L228	W101-G138 WeakPolarHBondContact CA-O 3.21Å; W101-G138 PolarHBondContact N-O 3.24Å; W101-H139 AromaticContact CE3-CE1 3.49Å; W101-H139 VanDerWaalsContact CE3-CE1 3.49Å; W101-H139 AromaticContact CE3-NE2 3.95Å; W101-H139 AromaticContact CZ3-CE1 3.57Å; W101-H139 AromaticContact CZ3-NE2 3.72Å; W101-D205 WeakPolarHBondContact O-CB 3.33Å; W101-D205 PolarHBondContact O-N 2.85Å; W101-Y206 HydrophobicContact CD2-CD2 4.44Å; W101-Y206 AromaticContact CE2-CD2 3.83Å; W101-Y206 AromaticContact CE2-CE2 3.83Å; W101-Y206 HydrophobicContact CZ2-CD2 4.18Å; W101-Y206 HydrophobicContact CZ2-CE2 4.05Å; W101-Y206 AromaticContact NE1-CD2 3.64Å; W101-Y206 AromaticContact NE1-CE2 3.41Å; W101-Y206 PolarHBondContact O-N 3.3Å; W101-L228 HydrophobicContact CH2-CB 4.49Å; W101-L228 HydrophobicContact CH2-CD1 3.78Å; W101-L228 HydrophobicContact CZ2-CB 4.16Å; W101-L228 HydrophobicContact CZ2-CD1 3.87Å
102	L	96.5	Very high	82.3	Confident	0 Å²	0	50.1 Å²	50.1	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	123.1	178.3	180	61.9	0	0	0	111.1	I104 G138 H139 Q140 Y206 L208 L224 L338	L102-I104 HydrophobicContact CD2-CG1 4.28Å; L102-I104 HydrophobicContact CG-CG1 4.23Å; L102-G138 PolarHBondContact N-O 2.03Å; L102-G138 VanDerWaalsContact N-O 3.1Å; L102-H139 CarbonylContact O-C 3.46Å; L102-H139 VanDerWaalsContact O-CA 3.3Å; L102-H139 WeakPolarHBondContact O-CA 3.41Å; L102-Q140 PolarHBondContact O-N 2.9Å; L102-Y206 WeakPolarHBondContact CA-O 3.33Å; L102-L208 HydrophobicContact CD1-CB 3.93Å; L102-L224 HydrophobicContact CD2-CD1 4.38Å; L102-L338 HydrophobicContact CD1-CD1 3.5Å
103	V	97.1	Very high	83.8	Confident	0 Å²	0	48.8 Å²	48.8	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	122	167	177.3	0	0	0	0	109.2	P100 Q140 F142 Y202 P204 Y206 V207 L208	P100-V103 HydrophobicContact CB-CG2 4.17Å; P100-V103 HydrophobicContact CG-CG2 3.37Å; V103-Q140 CarbonylContact C-O 3.56Å; V103-Q140 WeakPolarHBondContact CA-O 3.47Å; V103-Q140 HydrophobicContact CG2-CB 4.21Å; V103-F142 HydrophobicContact CG1-CB 4.04Å; V103-Y202 HydrophobicContact CG1-CD2 4.05Å; V103-Y202 HydrophobicContact CG1-CE2 4.43Å; V103-Y202 HydrophobicContact CG2-CD2 3.97Å; V103-Y202 HydrophobicContact CG2-CG 3.9Å; V103-P204 HydrophobicContact CB-CB 4.35Å; V103-P204 HydrophobicContact CB-CG 4.22Å; V103-P204 HydrophobicContact CG2-CB 3.59Å; V103-P204 HydrophobicContact CG2-CG 3.74Å; V103-Y206 PolarHBondContact N-O 3.07Å; V103-V207 CarbonylContact O-C 3.53Å; V103-V207 WeakPolarHBondContact O-CA 3.48Å; V103-L208 PolarHBondContact O-N 3.33Å
104	I	98.1	Very high	85.5	Confident	0 Å²	0	48.3 Å²	48.3	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	104.6	174.2	-51.9	164.6	0	0	0	106.7	L102 I106 F125 L129 Q140 L141 F142 L208 V210 F221	L102-I104 HydrophobicContact CD2-CG1 4.28Å; L102-I104 HydrophobicContact CG-CG1 4.23Å; I104-I106 HydrophobicContact CG2-CG1 4.44Å; I104-F125 HydrophobicContact CD1-CD1 3.92Å; I104-F125 HydrophobicContact CD1-CE1 4.14Å; I104-F125 HydrophobicContact CG2-CD1 4.18Å; I104-F125 HydrophobicContact CG2-CD2 4.29Å; I104-F125 HydrophobicContact CG2-CE1 3.94Å; I104-F125 HydrophobicContact CG2-CE2 4.06Å; I104-F125 HydrophobicContact CG2-CG 4.35Å; I104-F125 HydrophobicContact CG2-CZ 3.88Å; I104-L129 HydrophobicContact CD1-CD1 4.38Å; I104-L129 HydrophobicContact CD1-CD2 4.46Å; I104-Q140 PolarHBondContact N-O 2.88Å; I104-L141 HydrophobicContact CB-CD1 3.68Å; I104-L141 HydrophobicContact CD1-CD1 4.41Å; I104-L141 HydrophobicContact CG2-CD1 3.6Å; I104-F142 PolarHBondContact O-N 3.21Å; I104-L208 CarbonylContact C-O 3.58Å; I104-L208 WeakPolarHBondContact CA-O 3.44Å; I104-L208 HydrophobicContact CG1-CD2 4.38Å; I104-L208 HydrophobicContact CG2-CD2 4.28Å; I104-L208 HydrophobicContact CG2-CG 4.49Å; I104-V210 HydrophobicContact CG2-CG2 4.13Å; I104-F221 HydrophobicContact CD1-CE1 3.71Å; I104-F221 HydrophobicContact CD1-CZ 3.76Å
105	T	98.3	Very high	87.1	Confident	0 Å²	0	47.8 Å²	47.8	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	112.7	-179.5	-53	0	0	0	0	109.1	F142 C144 C194 S198 L208 M209 V210	T105-F142 CarbonylContact C-O 3.59Å; T105-F142 VanDerWaalsContact CA-O 3.31Å; T105-F142 WeakPolarHBondContact CA-O 3.31Å; T105-F142 HydrophobicContact CG2-CD1 3.79Å; T105-F142 HydrophobicContact CG2-CE1 4.25Å; T105-C144 HydrophobicContact CG2-CB 4.17Å; T105-C194 HydrophobicContact CG2-CB 4.17Å; T105-S198 WeakPolarHBondContact CG2-OG 3.31Å; T105-S198 WeakPolarHBondContact OG1-CB 3.37Å; T105-S198 PolarHBondContact OG1-OG 3.07Å; T105-L208 PolarHBondContact N-O 3.25Å; T105-M209 HydrophobicContact CG2-CE 3.96Å; T105-M209 HydrophobicContact CG2-SD 3.88Å; T105-V210 PolarHBondContact O-N 3Å
106	I	98.5	Very high	88.8	Confident	0 Å²	0	42.9 Å²	42.9	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	116.2	176.4	-61.2	164.3	0	0	0	108.2	I104 V118 V121 V122 F125 L141 F142 L143 C144 V210	I104-I106 HydrophobicContact CG2-CG1 4.44Å; I106-V118 HydrophobicContact CG2-CG2 4.03Å; I106-V121 HydrophobicContact CD1-CG1 3.86Å; I106-V121 HydrophobicContact CG1-CG1 4.22Å; I106-V121 HydrophobicContact CG2-CG1 4.35Å; I106-V122 HydrophobicContact CD1-CB 4.38Å; I106-V122 HydrophobicContact CD1-CG2 3.5Å; I106-F125 HydrophobicContact CD1-CD2 3.94Å; I106-F125 HydrophobicContact CD1-CE2 4.43Å; I106-L141 HydrophobicContact CD1-CD1 3.68Å; I106-L141 HydrophobicContact CD1-CG 4.44Å; I106-L141 HydrophobicContact CG1-CD1 4.35Å; I106-F142 PolarHBondContact N-O 2.98Å; I106-L143 HydrophobicContact CB-CD1 4.1Å; I106-L143 HydrophobicContact CG2-CD1 4.12Å; I106-C144 PolarHBondContact O-N 3.41Å; I106-V210 CarbonylContact C-O 3.56Å; I106-V210 WeakPolarHBondContact CA-O 3.48Å; I106-V210 HydrophobicContact CG1-CB 4.23Å
107	I	97.8	Very high	90.3	Very high	17 Å²	17	40 Å²	40	9%	0.087	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	128.1	175	-54.4	169.8	0	0	0	107.7	C144 V146 Y191 C194 M209 V210 D212	I107-C144 WeakPolarHBondContact CA-O 3.48Å; I107-V146 HydrophobicContact CG2-CG1 4.31Å; I107-V146 HydrophobicContact CG2-CG2 3.67Å; I107-Y191 HydrophobicContact CD1-CD2 3.54Å; I107-Y191 HydrophobicContact CD1-CE2 4.03Å; I107-Y191 HydrophobicContact CD1-CG 4.32Å; I107-C194 HydrophobicContact CD1-CB 4.25Å; I107-C194 HydrophobicContact CG1-CB 3.89Å; I107-M209 HydrophobicContact CD1-CE 3.56Å; I107-M209 HydrophobicContact CG1-CE 3.92Å; I107-V210 PolarHBondContact N-O 3.28Å; I107-D212 WeakPolarHBondContact O-CB 3.44Å; I107-D212 PolarHBondContact O-N 2.87Å
108	T	96	Very high	91.6	Very high	1 Å²	1	38 Å²	38	1%	0.006	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	146.4	-177.4	-168.4	0	0	0	0	113.4	V118 L143 C144 N145 V146 H152 A155	T108-V118 HydrophobicContact CG2-CG2 4.24Å; T108-V118 WeakPolarHBondContact OG1-CB 3.49Å; T108-V118 WeakPolarHBondContact OG1-CG2 3.26Å; T108-L143 HydrophobicContact CG2-CD1 3.75Å; T108-L143 HydrophobicContact CG2-CD2 4.34Å; T108-L143 HydrophobicContact CG2-CG 4.03Å; T108-C144 PolarHBondContact N-O 3.15Å; T108-N145 HydrophobicContact CG2-CB 4.27Å; T108-V146 WeakPolarHBondContact O-CG2 3.49Å; T108-V146 PolarHBondContact O-N 3.38Å; T108-H152 PolarHBondContact OG1-CE1 3.43Å; T108-A155 HydrophobicContact CG2-CB 4.39Å
109	V	92.7	Very high	92.8	Very high	20 Å²	20	31.9 Å²	31.9	12%	0.121	16%	0.158	C	C	.	.			trans	-130.7	160.3	172.7	-69.5	0	0	0	0	109.2	R111 V146 H152	V109-R111 HydrophobicContact CG2-CG 4.05Å; V109-R111 PolarHBondContact O-N 3.43Å; V109-V146 HydrophobicContact CG1-CG2 3.6Å; V109-H152 PolarHBondContact O-CE1 3.36Å; V109-H152 PolarHBondContact O-NE2 2.94Å
110	D	88.6	Confident	93.2	Very high	69 Å²	69	23.3 Å²	23.3	37%	0.369	13%	0.126	S	C	.	.			trans	-74.5	115	176.6	-165.4	15.6	0	0	0	109.3	E147 S151 H152	D110-E147 HydrophobicContact CB-CG 3.77Å; D110-E147 PolarHBondContact N-OE2 3.12Å; D110-S151 PolarHBondContact OD2-OG 3.04Å; D110-H152 HydrophobicContact CB-CB 4.32Å; D110-H152 IonicContact OD1-CD2 3.96Å
111	R	85.6	Confident	93.4	Very high	40 Å²	40	23.2 Å²	23.2	15%	0.151	13%	0.126	C	C	.	.			trans	-103.4	-171	-178.5	-68.5	-167.1	179.5	-143.5	16	110.4	V109 Y117 D212 D213 F391	V109-R111 HydrophobicContact CG2-CG 4.05Å; V109-R111 PolarHBondContact O-N 3.43Å; R111-Y117 HydrophobicContact CB-CD2 4.12Å; R111-Y117 VanDerWaalsContact CD-CD2 3.46Å; R111-Y117 HydrophobicContact CG-CD2 4.42Å; R111-D212 WeakPolarHBondContact CD-OD2 3.39Å; R111-D212 IonicContact CZ-OD1 2.69Å; R111-D212 VanDerWaalsContact CZ-OD1 3.27Å; R111-D212 IonicContact CZ-OD2 3.35Å; R111-D212 VanDerWaalsContact NE-CG 3.33Å; R111-D212 IonicContact NE-OD1 3.93Å; R111-D212 PolarHBondContact NE-OD1 3.31Å; R111-D212 IonicContact NE-OD2 3.91Å; R111-D212 PolarHBondContact NE-OD2 3.44Å; R111-D212 IonicContact NH2-OD1 3.16Å; R111-D212 PolarHBondContact NH2-OD1 2.73Å; R111-D212 IonicContact NH2-OD2 3.91Å; R111-D213 IonicContact CZ-OD2 3Å; R111-D213 IonicContact NH1-OD2 2.69Å; R111-D213 PolarHBondContact NH1-OD2 2.77Å; R111-D213 VanDerWaalsContact NH2-CG 3.32Å; R111-D213 IonicContact NH2-OD1 2.72Å; R111-D213 IonicContact NH2-OD2 3.5Å; R111-D213 PolarHBondContact NH2-OD2 2.95Å; R111-F391 PolarHBondContact NH1-O 3.02Å
112	Q	79.7	Confident	93.5	Very high	92 Å²	92	21 Å²	21	43%	0.43	12%	0.118	S	C	.	.	S	Bend	trans	-61.7	133.1	-179.5	-165.9	171.1	13.4	0	0	111.1	F115 F391	Q112-F115 HydrophobicContact CB-CD2 4.11Å; Q112-F115 HydrophobicContact CB-CE2 4.41Å; Q112-F115 HydrophobicContact CG-CD2 4.44Å; Q112-F115 HydrophobicContact CG-CE2 4.36Å; Q112-F391 VanDerWaalsContact OE1-CD1 3.27Å
113	P	79	Confident	93.5	Very high	116 Å²	116	21.3 Å²	21.3	75%	0.753	12%	0.119	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.6	144.3	-178.8	-25.4	32.8	0	0	0	112.9	F115	P113-F115 PolarHBondContact O-N 3.22Å
114	G	86.3	Confident	93.5	Very high	27 Å²	27	22.6 Å²	22.6	28%	0.278	13%	0.126	S	C	.	.	T	Hydrogen-bonded Turn	trans	92	-22.5	173.3	0	0	0	0	0	115.5	H116	G114-H116 PolarHBondContact O-CD2 3.48Å; G114-H116 VanDerWaalsContact O-CD2 3.26Å
115	F	92.1	Very high	93.5	Very high	13 Å²	13	22.6 Å²	22.6	6%	0.057	13%	0.126	C	C	.	.			trans	-79.3	-29.8	176.1	-68.8	-79.2	0	0	0	112.7	L66 L70 G73 Q112 P113 Y117 Q120 F391	L66-F115 HydrophobicContact CD2-CE1 3.76Å; L66-F115 HydrophobicContact CD2-CZ 3.75Å; L70-F115 HydrophobicContact CD1-CE1 4.41Å; L70-F115 HydrophobicContact CD1-CZ 4.5Å; L70-F115 HydrophobicContact CD2-CD1 3.82Å; L70-F115 HydrophobicContact CD2-CD2 4.29Å; L70-F115 HydrophobicContact CD2-CE1 3.72Å; L70-F115 HydrophobicContact CD2-CE2 4.19Å; L70-F115 HydrophobicContact CD2-CG 4.11Å; L70-F115 HydrophobicContact CD2-CZ 3.89Å; L70-F115 HydrophobicContact CG-CD1 4Å; L70-F115 HydrophobicContact CG-CE1 3.6Å; L70-F115 HydrophobicContact CG-CZ 4.04Å; G73-F115 VanDerWaalsContact CA-O 3.26Å; G73-F115 WeakPolarHBondContact CA-O 3.39Å; Q112-F115 HydrophobicContact CB-CD2 4.11Å; Q112-F115 HydrophobicContact CB-CE2 4.41Å; Q112-F115 HydrophobicContact CG-CD2 4.44Å; Q112-F115 HydrophobicContact CG-CE2 4.36Å; P113-F115 PolarHBondContact O-N 3.22Å; F115-Y117 VanDerWaalsContact C-N 3.26Å; F115-Y117 HydrophobicContact CB-CD1 4.39Å; F115-Y117 HydrophobicContact CB-CD2 4.05Å; F115-Y117 HydrophobicContact CB-CE1 4.18Å; F115-Y117 HydrophobicContact CB-CE2 3.86Å; F115-Y117 HydrophobicContact CB-CG 4.36Å; F115-Y117 HydrophobicContact CG-CE2 4.28Å; F115-Y117 PolarHBondContact O-N 2.71Å; F115-Q120 PolarHBondContact O-NE2 3.34Å; F115-F391 HydrophobicContact CD2-CD2 4.28Å; F115-F391 HydrophobicContact CD2-CE2 4.23Å; F115-F391 HydrophobicContact CE1-CE2 4.37Å; F115-F391 AromaticContact CE2-CD2 3.97Å; F115-F391 HydrophobicContact CE2-CD2 3.97Å; F115-F391 AromaticContact CE2-CE2 3.46Å; F115-F391 HydrophobicContact CE2-CE2 3.46Å; F115-F391 VanDerWaalsContact CE2-CE2 3.46Å; F115-F391 HydrophobicContact CE2-CZ 4.3Å; F115-F391 HydrophobicContact CZ-CD2 4.33Å; F115-F391 AromaticContact CZ-CE2 3.56Å; F115-F391 HydrophobicContact CZ-CE2 3.56Å; F115-F391 HydrophobicContact CZ-CZ 4.42Å
116	H	94.8	Very high	93.2	Very high	31 Å²	31	22.6 Å²	22.6	14%	0.144	13%	0.126	C	C	.	.			trans	48.4	44.8	176.5	-58.1	-69.5	0	0	0	114.2	G114 V118 L119 Q120 D154	G114-H116 PolarHBondContact O-CD2 3.48Å; G114-H116 VanDerWaalsContact O-CD2 3.26Å; H116-V118 VanDerWaalsContact C-N 3.29Å; H116-V118 PolarHBondContact O-N 3.34Å; H116-L119 HydrophobicContact CB-CB 4Å; H116-L119 HydrophobicContact CB-CD1 3.86Å; H116-L119 HydrophobicContact CB-CG 3.98Å; H116-L119 WeakPolarHBondContact O-CB 3.34Å; H116-L119 PolarHBondContact O-N 2.76Å; H116-Q120 PolarHBondContact O-N 3.13Å; H116-D154 VanDerWaalsContact CA-OD2 3.31Å; H116-D154 WeakPolarHBondContact CA-OD2 3.14Å; H116-D154 IonicContact CE1-OD1 3.52Å; H116-D154 IonicContact CG-OD1 3.94Å; H116-D154 IonicContact CG-OD2 3.85Å; H116-D154 IonicContact ND1-OD1 2.8Å; H116-D154 PolarHBondContact ND1-OD1 3.01Å; H116-D154 IonicContact ND1-OD2 3.25Å; H116-D154 PolarHBondContact ND1-OD2 3.5Å
117	Y	95.5	Very high	93.1	Very high	4 Å²	4	26.8 Å²	26.8	2%	0.016	14%	0.141	C	C	.	.	H	α-helix	trans	-51.2	-47.8	-172.8	-72.6	-57.4	0	0	0	112.3	R111 F115 L119 Q120 V121 D212 I388 L390	R111-Y117 HydrophobicContact CB-CD2 4.12Å; R111-Y117 VanDerWaalsContact CD-CD2 3.46Å; R111-Y117 HydrophobicContact CG-CD2 4.42Å; F115-Y117 VanDerWaalsContact C-N 3.26Å; F115-Y117 HydrophobicContact CB-CD1 4.39Å; F115-Y117 HydrophobicContact CB-CD2 4.05Å; F115-Y117 HydrophobicContact CB-CE1 4.18Å; F115-Y117 HydrophobicContact CB-CE2 3.86Å; F115-Y117 HydrophobicContact CB-CG 4.36Å; F115-Y117 HydrophobicContact CG-CE2 4.28Å; F115-Y117 PolarHBondContact O-N 2.71Å; Y117-L119 VanDerWaalsContact C-N 3.34Å; Y117-L119 PolarHBondContact O-N 3Å; Y117-Q120 WeakPolarHBondContact O-CB 3.35Å; Y117-Q120 PolarHBondContact O-N 2.62Å; Y117-Q120 VanDerWaalsContact O-N 3.12Å; Y117-V121 PolarHBondContact O-N 3.34Å; Y117-D212 CarbonylContact C-O 3.57Å; Y117-D212 VanDerWaalsContact CB-O 3.29Å; Y117-D212 WeakPolarHBondContact CB-O 3.45Å; Y117-D212 VanDerWaalsContact O-O 3.11Å; Y117-I388 HydrophobicContact CD1-CD1 3.59Å; Y117-I388 HydrophobicContact CD1-CG1 3.78Å; Y117-I388 HydrophobicContact CE1-CD1 4.18Å; Y117-I388 HydrophobicContact CE1-CG1 4.11Å; Y117-I388 VanDerWaalsContact CE1-O 3.24Å; Y117-I388 WeakPolarHBondContact CE1-O 3.4Å; Y117-L390 PolarHBondContact OH-N 3.27Å
118	V	96.5	Very high	93	Very high	3 Å²	3	26.1 Å²	26.1	2%	0.018	14%	0.138	C	C	.	.	H	α-helix	trans	-63.7	-37	178.5	69.9	0	0	0	0	112.5	I106 T108 H116 Q120 V121 V122 L143 D154 L158 D212	I106-V118 HydrophobicContact CG2-CG2 4.03Å; T108-V118 HydrophobicContact CG2-CG2 4.24Å; T108-V118 WeakPolarHBondContact OG1-CB 3.49Å; T108-V118 WeakPolarHBondContact OG1-CG2 3.26Å; H116-V118 VanDerWaalsContact C-N 3.29Å; H116-V118 PolarHBondContact O-N 3.34Å; V118-Q120 VanDerWaalsContact C-N 3.31Å; V118-Q120 PolarHBondContact O-N 2.88Å; V118-V121 PolarHBondContact O-N 2.95Å; V118-V122 HydrophobicContact CG2-CG2 4.04Å; V118-V122 WeakPolarHBondContact O-CB 3.36Å; V118-V122 WeakPolarHBondContact O-CG2 3.32Å; V118-V122 PolarHBondContact O-N 3.36Å; V118-L143 HydrophobicContact CG2-CD1 3.74Å; V118-D154 HydrophobicContact CG1-CB 3.4Å; V118-L158 HydrophobicContact CG1-CD1 4.16Å; V118-L158 HydrophobicContact CG2-CD1 3.9Å; V118-D212 HydrophobicContact CB-CB 3.98Å; V118-D212 HydrophobicContact CG2-CB 4.35Å; V118-D212 PolarHBondContact N-O 2.98Å
119	L	97.1	Very high	92.8	Very high	0 Å²	0	26.4 Å²	26.4	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-64.7	-38.9	175.7	-57.2	-172.8	0	0	0	110.6	A76 L77 F80 H116 Y117 S123 D154 L157 L158	A76-L119 HydrophobicContact CB-CB 3.83Å; L77-L119 HydrophobicContact CB-CD1 4.03Å; L77-L119 HydrophobicContact CD1-CD1 3.83Å; F80-L119 HydrophobicContact CD2-CB 4.3Å; F80-L119 HydrophobicContact CD2-CD2 4.03Å; F80-L119 HydrophobicContact CE2-CB 4.26Å; F80-L119 HydrophobicContact CE2-CD2 4.26Å; H116-L119 HydrophobicContact CB-CB 4Å; H116-L119 HydrophobicContact CB-CD1 3.86Å; H116-L119 HydrophobicContact CB-CG 3.98Å; H116-L119 WeakPolarHBondContact O-CB 3.34Å; H116-L119 PolarHBondContact O-N 2.76Å; Y117-L119 VanDerWaalsContact C-N 3.34Å; Y117-L119 PolarHBondContact O-N 3Å; L119-S123 WeakPolarHBondContact O-CB 3.41Å; L119-S123 PolarHBondContact O-N 2.97Å; L119-S123 PolarHBondContact O-OG 2.92Å; L119-D154 HydrophobicContact CD2-CB 3.92Å; L119-D154 HydrophobicContact CG-CB 4.01Å; L119-L157 HydrophobicContact CD1-CD2 4.15Å; L119-L157 HydrophobicContact CD2-CD2 4.41Å; L119-L158 HydrophobicContact CD2-CD1 3.78Å; L119-L158 HydrophobicContact CD2-CD2 3.7Å; L119-L158 HydrophobicContact CD2-CG 3.53Å
120	Q	97.6	Very high	92.7	Very high	8 Å²	8	29.8 Å²	29.8	4%	0.037	15%	0.154	C	C	.	.	H	α-helix	trans	-61.4	-47.6	175.5	-61.6	-176.5	47.4	0	0	111.4	S69 E72 A76 F115 H116 Y117 V118 S123 Q124 V215 I388	S69-Q120 PolarHBondContact O-NE2 2.81Å; S69-Q120 VanDerWaalsContact O-NE2 3.11Å; E72-Q120 HydrophobicContact CB-CG 4.43Å; A76-Q120 HydrophobicContact CB-CG 4.03Å; F115-Q120 PolarHBondContact O-NE2 3.34Å; H116-Q120 PolarHBondContact O-N 3.13Å; Y117-Q120 WeakPolarHBondContact O-CB 3.35Å; Y117-Q120 PolarHBondContact O-N 2.62Å; Y117-Q120 VanDerWaalsContact O-N 3.12Å; V118-Q120 VanDerWaalsContact C-N 3.31Å; V118-Q120 PolarHBondContact O-N 2.88Å; Q120-S123 PolarHBondContact O-OG 2.94Å; Q120-Q124 WeakPolarHBondContact O-CB 3.05Å; Q120-Q124 PolarHBondContact O-N 3.29Å; Q120-Q124 VanDerWaalsContact O-N 3.12Å; Q120-V215 HydrophobicContact CB-CG2 4.28Å; Q120-I388 HydrophobicContact CB-CD1 4.07Å; Q120-I388 HydrophobicContact CG-CD1 4.49Å; Q120-I388 VanDerWaalsContact OE1-CD1 3.26Å
121	V	98	Very high	92.9	Very high	0 Å²	0	33 Å²	33	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-62.2	-50.8	178.6	177.2	0	0	0	0	111.5	I106 Y117 V118 Q124 F125 V210 D212 A214 V215	I106-V121 HydrophobicContact CD1-CG1 3.86Å; I106-V121 HydrophobicContact CG1-CG1 4.22Å; I106-V121 HydrophobicContact CG2-CG1 4.35Å; Y117-V121 PolarHBondContact O-N 3.34Å; V118-V121 PolarHBondContact O-N 2.95Å; V121-Q124 PolarHBondContact O-N 3.44Å; V121-F125 HydrophobicContact CG1-CD2 3.78Å; V121-F125 HydrophobicContact CG1-CE2 3.77Å; V121-F125 WeakPolarHBondContact O-CD2 3.28Å; V121-F125 PolarHBondContact O-N 2.88Å; V121-V210 HydrophobicContact CG1-CG1 4.29Å; V121-D212 WeakPolarHBondContact CG2-O 3.37Å; V121-A214 WeakPolarHBondContact CG1-O 3.35Å; V121-V215 HydrophobicContact CG2-CG2 3.83Å
122	V	97.3	Very high	93.1	Very high	1 Å²	1	32.5 Å²	32.5	1%	0.006	17%	0.169	C	C	.	.	H	α-helix	trans	-66.8	-41.8	-177.2	-179.6	0	0	0	0	111	F80 I106 V118 Q124 F125 H126 L141 L143 L158 V162	F80-V122 HydrophobicContact CE1-CG1 4.29Å; F80-V122 HydrophobicContact CE2-CB 4.39Å; F80-V122 HydrophobicContact CE2-CG1 4.44Å; F80-V122 HydrophobicContact CZ-CB 4Å; F80-V122 HydrophobicContact CZ-CG1 3.62Å; I106-V122 HydrophobicContact CD1-CB 4.38Å; I106-V122 HydrophobicContact CD1-CG2 3.5Å; V118-V122 HydrophobicContact CG2-CG2 4.04Å; V118-V122 WeakPolarHBondContact O-CB 3.36Å; V118-V122 WeakPolarHBondContact O-CG2 3.32Å; V118-V122 PolarHBondContact O-N 3.36Å; V122-Q124 VanDerWaalsContact C-N 3.31Å; V122-Q124 PolarHBondContact O-N 3.47Å; V122-F125 PolarHBondContact O-N 3.43Å; V122-H126 VanDerWaalsContact O-CB 3.26Å; V122-H126 WeakPolarHBondContact O-CB 3.24Å; V122-H126 PolarHBondContact O-N 2.8Å; V122-L141 HydrophobicContact CG1-CD2 3.73Å; V122-L143 HydrophobicContact CG2-CD1 4.49Å; V122-L158 HydrophobicContact CB-CD1 4.3Å; V122-L158 HydrophobicContact CB-CD2 4.12Å; V122-L158 HydrophobicContact CG1-CD2 3.76Å; V122-L158 HydrophobicContact CG2-CD1 3.76Å; V122-L158 HydrophobicContact CG2-CD2 4.44Å; V122-V162 HydrophobicContact CG1-CG1 4.11Å
123	S	96.7	Very high	93.2	Very high	5 Å²	5	29.6 Å²	29.6	4%	0.035	16%	0.163	C	C	.	.	H	α-helix	trans	-62.8	-40.2	179.2	63.3	0	0	0	0	111.4	L119 Q120 H126 R127	L119-S123 WeakPolarHBondContact O-CB 3.41Å; L119-S123 PolarHBondContact O-N 2.97Å; L119-S123 PolarHBondContact O-OG 2.92Å; Q120-S123 PolarHBondContact O-OG 2.94Å; S123-H126 PolarHBondContact O-N 3.08Å; S123-R127 VanDerWaalsContact O-CG 3.32Å; S123-R127 WeakPolarHBondContact O-CG 2.96Å; S123-R127 PolarHBondContact O-N 3.41Å
124	Q	97.5	Very high	93.5	Very high	28 Å²	28	28.9 Å²	28.9	13%	0.131	16%	0.159	C	C	.	.	H	α-helix	trans	-66.7	-48.4	176.5	-171.9	67.7	1.3	0	0	111.5	Q120 V121 V122 H126 R127 L128 V215 P216 E218	Q120-Q124 WeakPolarHBondContact O-CB 3.05Å; Q120-Q124 PolarHBondContact O-N 3.29Å; Q120-Q124 VanDerWaalsContact O-N 3.12Å; V121-Q124 PolarHBondContact O-N 3.44Å; V122-Q124 VanDerWaalsContact C-N 3.31Å; V122-Q124 PolarHBondContact O-N 3.47Å; Q124-H126 VanDerWaalsContact C-N 3.28Å; Q124-H126 PolarHBondContact O-N 3.34Å; Q124-R127 PolarHBondContact O-N 3.24Å; Q124-L128 HydrophobicContact CG-CD1 4.16Å; Q124-L128 VanDerWaalsContact O-CG 3.28Å; Q124-L128 WeakPolarHBondContact O-CG 3.31Å; Q124-L128 PolarHBondContact O-N 2.9Å; Q124-V215 HydrophobicContact CB-CG1 3.97Å; Q124-V215 HydrophobicContact CG-CG1 3.85Å; Q124-P216 HydrophobicContact CB-CG 4.1Å; Q124-P216 HydrophobicContact CG-CG 3.73Å; Q124-E218 PolarHBondContact NE2-OE1 3.26Å
125	F	97.1	Very high	93.4	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-56.9	-43.4	174.2	-87.4	-64.6	0	0	0	112.2	I104 I106 V121 V122 L128 L129 L141 L208 V210 P216 I220 F221	I104-F125 HydrophobicContact CD1-CD1 3.92Å; I104-F125 HydrophobicContact CD1-CE1 4.14Å; I104-F125 HydrophobicContact CG2-CD1 4.18Å; I104-F125 HydrophobicContact CG2-CD2 4.29Å; I104-F125 HydrophobicContact CG2-CE1 3.94Å; I104-F125 HydrophobicContact CG2-CE2 4.06Å; I104-F125 HydrophobicContact CG2-CG 4.35Å; I104-F125 HydrophobicContact CG2-CZ 3.88Å; I106-F125 HydrophobicContact CD1-CD2 3.94Å; I106-F125 HydrophobicContact CD1-CE2 4.43Å; V121-F125 HydrophobicContact CG1-CD2 3.78Å; V121-F125 HydrophobicContact CG1-CE2 3.77Å; V121-F125 WeakPolarHBondContact O-CD2 3.28Å; V121-F125 PolarHBondContact O-N 2.88Å; V122-F125 PolarHBondContact O-N 3.43Å; F125-L128 PolarHBondContact O-N 3.04Å; F125-L129 WeakPolarHBondContact O-CB 3.42Å; F125-L129 VanDerWaalsContact O-CG 3.28Å; F125-L129 WeakPolarHBondContact O-CG 3.39Å; F125-L129 PolarHBondContact O-N 2.79Å; F125-L141 HydrophobicContact CB-CD1 4.18Å; F125-L141 HydrophobicContact CB-CD2 4.41Å; F125-L141 HydrophobicContact CG-CD1 4.39Å; F125-L208 HydrophobicContact CE1-CD2 4.39Å; F125-L208 HydrophobicContact CZ-CD2 4.3Å; F125-V210 HydrophobicContact CE2-CG1 4.18Å; F125-V210 HydrophobicContact CE2-CG2 4.16Å; F125-V210 HydrophobicContact CZ-CG2 4.06Å; F125-P216 HydrophobicContact CD1-CB 4.21Å; F125-P216 HydrophobicContact CD1-CG 3.77Å; F125-P216 HydrophobicContact CD2-CG 3.73Å; F125-P216 HydrophobicContact CE1-CB 3.72Å; F125-P216 HydrophobicContact CE1-CG 3.74Å; F125-P216 HydrophobicContact CE2-CB 4.15Å; F125-P216 HydrophobicContact CE2-CG 3.69Å; F125-P216 HydrophobicContact CG-CG 3.77Å; F125-P216 HydrophobicContact CZ-CB 3.68Å; F125-P216 HydrophobicContact CZ-CG 3.69Å; F125-I220 HydrophobicContact CE1-CD1 3.97Å; F125-I220 HydrophobicContact CZ-CD1 4.14Å; F125-F221 AromaticContact CD1-CZ 3.93Å; F125-F221 HydrophobicContact CD1-CZ 3.93Å; F125-F221 HydrophobicContact CE1-CZ 4.35Å
126	H	93.9	Very high	93.4	Very high	0 Å²	0	34 Å²	34	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-61.5	-45.7	179.3	178.6	-123	0	0	0	111.9	Y79 W94 V122 S123 Q124 L128 L129 Q130	Y79-H126 AromaticContact CE1-ND1 3.44Å; Y79-H126 WeakPolarHBondContact CE1-ND1 3.19Å; Y79-H126 AromaticContact CZ-ND1 3.48Å; Y79-H126 PolarHBondContact OH-CE1 2.6Å; Y79-H126 VanDerWaalsContact OH-CE1 3.25Å; Y79-H126 PolarHBondContact OH-ND1 3.39Å; W94-H126 AromaticContact CE2-CD2 3.51Å; W94-H126 AromaticContact CE2-NE2 3.59Å; W94-H126 HydrophobicContact CH2-CB 4.43Å; W94-H126 AromaticContact CH2-CD2 3.87Å; W94-H126 HydrophobicContact CZ2-CB 4.23Å; W94-H126 AromaticContact CZ2-CD2 2.99Å; W94-H126 WeakPolarHBondContact CZ2-CD2 2.98Å; W94-H126 AromaticContact CZ2-CG 3.65Å; W94-H126 AromaticContact CZ2-NE2 3.45Å; W94-H126 WeakPolarHBondContact CZ2-NE2 3.02Å; W94-H126 AromaticContact NE1-CD2 3.65Å; W94-H126 AromaticContact NE1-NE2 3.22Å; W94-H126 PolarHBondContact NE1-NE2 2.78Å; V122-H126 VanDerWaalsContact O-CB 3.26Å; V122-H126 WeakPolarHBondContact O-CB 3.24Å; V122-H126 PolarHBondContact O-N 2.8Å; S123-H126 PolarHBondContact O-N 3.08Å; Q124-H126 VanDerWaalsContact C-N 3.28Å; Q124-H126 PolarHBondContact O-N 3.34Å; H126-L128 PolarHBondContact O-N 3.22Å; H126-L129 PolarHBondContact O-N 3.41Å; H126-Q130 PolarHBondContact CE1-NE2 2.94Å; H126-Q130 PolarHBondContact NE2-NE2 2.96Å; H126-Q130 WeakPolarHBondContact O-CG 3.5Å; H126-Q130 PolarHBondContact O-N 2.78Å
127	R	94.5	Very high	92.9	Very high	87 Å²	87	38.3 Å²	38.3	33%	0.328	20%	0.197	S	C	.	.	H	α-helix	trans	-60	-45.2	175.1	-72.1	172.7	-170.3	170.5	4.2	111.7	Y79 S123 Q124 L129 Q130 Q131	Y79-R127 HydrophobicContact CE2-CG 4.15Å; S123-R127 VanDerWaalsContact O-CG 3.32Å; S123-R127 WeakPolarHBondContact O-CG 2.96Å; S123-R127 PolarHBondContact O-N 3.41Å; Q124-R127 PolarHBondContact O-N 3.24Å; R127-L129 PolarHBondContact O-N 3.08Å; R127-Q130 PolarHBondContact O-N 2.8Å; R127-Q131 VanDerWaalsContact O-CG 3.26Å; R127-Q131 WeakPolarHBondContact O-CG 3.48Å; R127-Q131 PolarHBondContact O-N 2.84Å
128	L	95.7	Very high	92.8	Very high	4 Å²	4	39.5 Å²	39.5	2%	0.021	21%	0.21	C	C	.	.	H	α-helix	trans	-65.7	-39.1	-179.5	-65.4	177.1	0	0	0	112.2	Q124 F125 H126 Q131 C132 P216 E218 I220 F221	Q124-L128 HydrophobicContact CG-CD1 4.16Å; Q124-L128 VanDerWaalsContact O-CG 3.28Å; Q124-L128 WeakPolarHBondContact O-CG 3.31Å; Q124-L128 PolarHBondContact O-N 2.9Å; F125-L128 PolarHBondContact O-N 3.04Å; H126-L128 PolarHBondContact O-N 3.22Å; L128-Q131 PolarHBondContact O-N 2.88Å; L128-C132 VanDerWaalsContact O-CB 3.24Å; L128-C132 WeakPolarHBondContact O-CB 3.47Å; L128-C132 PolarHBondContact O-N 3.23Å; L128-P216 HydrophobicContact CD1-CB 4.06Å; L128-P216 HydrophobicContact CD1-CG 3.92Å; L128-E218 WeakPolarHBondContact CD2-OE2 3.38Å; L128-I220 HydrophobicContact CD1-CG2 3.89Å; L128-F221 HydrophobicContact CB-CD2 3.99Å; L128-F221 HydrophobicContact CB-CE2 3.56Å
129	L	93.6	Very high	92.7	Very high	7 Å²	7	40 Å²	40	4%	0.037	21%	0.212	C	C	.	.	H	α-helix	trans	-64.5	-41.9	174.9	-73.9	170.5	0	0	0	111.4	V93 I104 F125 H126 R127 C132 G133 C136 H139 L141 F221	V93-L129 HydrophobicContact CG1-CB 3.88Å; V93-L129 HydrophobicContact CG1-CD1 4.08Å; I104-L129 HydrophobicContact CD1-CD1 4.38Å; I104-L129 HydrophobicContact CD1-CD2 4.46Å; F125-L129 WeakPolarHBondContact O-CB 3.42Å; F125-L129 VanDerWaalsContact O-CG 3.28Å; F125-L129 WeakPolarHBondContact O-CG 3.39Å; F125-L129 PolarHBondContact O-N 2.79Å; H126-L129 PolarHBondContact O-N 3.41Å; R127-L129 PolarHBondContact O-N 3.08Å; L129-C132 PolarHBondContact O-N 3.03Å; L129-G133 PolarHBondContact O-N 3.02Å; L129-C136 HydrophobicContact CD2-CB 3.87Å; L129-H139 HydrophobicContact CD2-CB 3.64Å; L129-L141 HydrophobicContact CD1-CB 4.4Å; L129-F221 HydrophobicContact CD2-CE1 4.1Å; L129-F221 HydrophobicContact CD2-CE2 3.69Å; L129-F221 HydrophobicContact CD2-CZ 3.42Å; L129-F221 VanDerWaalsContact CD2-CZ 3.42Å; L129-F221 HydrophobicContact CG-CE2 3.83Å; L129-F221 HydrophobicContact CG-CZ 3.72Å
130	Q	89.4	Confident	92.5	Very high	90 Å²	90	40 Å²	40	42%	0.421	21%	0.213	S	C	.	.	H	α-helix	trans	-62	-42.5	174.9	-73.6	-176.3	-19.5	0	0	112.2	V93 H126 R127	V93-Q130 HydrophobicContact CG2-CG 4.08Å; H126-Q130 PolarHBondContact CE1-NE2 2.94Å; H126-Q130 PolarHBondContact NE2-NE2 2.96Å; H126-Q130 WeakPolarHBondContact O-CG 3.5Å; H126-Q130 PolarHBondContact O-N 2.78Å; R127-Q130 PolarHBondContact O-N 2.8Å
131	Q	92.2	Very high	92.4	Very high	138 Å²	138	39.8 Å²	39.8	65%	0.645	21%	0.212	S	C	*	.	H	α-helix	trans	-70.5	-35.2	179.7	-70.5	171.2	16.1	0	0	112.9	R127 L128 G133	R127-Q131 VanDerWaalsContact O-CG 3.26Å; R127-Q131 WeakPolarHBondContact O-CG 3.48Å; R127-Q131 PolarHBondContact O-N 2.84Å; L128-Q131 PolarHBondContact O-N 2.88Å; Q131-G133 VanDerWaalsContact C-N 3.27Å; Q131-G133 PolarHBondContact O-N 2.81Å
132	C	89.8	Confident	92.3	Very high	29 Å²	29	40.1 Å²	40.1	20%	0.196	21%	0.213	C	C	.	.	H	α-helix	trans	-65.6	-30.4	178.1	-179.3	0	0	0	0	112.7	L128 L129 C136 F221	L128-C132 VanDerWaalsContact O-CB 3.24Å; L128-C132 WeakPolarHBondContact O-CB 3.47Å; L128-C132 PolarHBondContact O-N 3.23Å; L129-C132 PolarHBondContact O-N 3.03Å; C132-C136 HydrophobicContact CB-CB 3.62Å; C132-C136 WeakPolarHBondContact CB-SG 3.37Å; C132-C136 WeakPolarHBondContact SG-CB 3.31Å; C132-C136 PolarHBondContact SG-N 2.95Å; C132-C136 VanDerWaalsContact SG-N 3.43Å; C132-C136 CovalentContact SG-SG 2.03Å; C132-C136 PolarHBondContact SG-SG 3.05Å; C132-F221 HydrophobicContact CB-CD2 4.46Å
133	G	83.5	Confident	92.3	Very high	30 Å²	30	40.1 Å²	40.1	31%	0.309	21%	0.213	S	C	.	.	G	3₁₀ helix	trans	62.1	-136	174.5	0	0	0	0	0	112.8	L129 Q131 Q135 C136	L129-G133 PolarHBondContact O-N 3.02Å; Q131-G133 VanDerWaalsContact C-N 3.27Å; Q131-G133 PolarHBondContact O-N 2.81Å; G133-Q135 PolarHBondContact O-N 2.87Å; G133-Q135 VanDerWaalsContact O-N 3.1Å; G133-C136 PolarHBondContact O-N 2.87Å
134	P	84.9	Confident	92.3	Very high	102 Å²	102	39.9 Å²	39.9	66%	0.662	21%	0.211	S	C	*	.	G	3₁₀ helix	trans	-58.3	-27.9	-172.5	-25.4	33.8	0	0	0	114.9	C136 E137	P134-C136 PolarHBondContact O-N 2.82Å; P134-E137 PolarHBondContact O-N 3.37Å
135	Q	84.7	Confident	92.3	Very high	136 Å²	136	39.2 Å²	39.2	64%	0.636	21%	0.209	S	C	*	.	G	3₁₀ helix	trans	-64.4	-26.5	178.5	-67.4	-179.4	-7.9	0	0	112.2	G133	G133-Q135 PolarHBondContact O-N 2.87Å; G133-Q135 VanDerWaalsContact O-N 3.1Å
136	C	90.6	Very high	92.1	Very high	10 Å²	10	39.3 Å²	39.3	7%	0.068	21%	0.209	C	C	.	.	G	3₁₀ helix	trans	-102.4	11.3	-179.9	-70.7	0	0	0	0	113.9	L129 C132 G133 P134 G138 H139	L129-C136 HydrophobicContact CD2-CB 3.87Å; C132-C136 HydrophobicContact CB-CB 3.62Å; C132-C136 WeakPolarHBondContact CB-SG 3.37Å; C132-C136 WeakPolarHBondContact SG-CB 3.31Å; C132-C136 PolarHBondContact SG-N 2.95Å; C132-C136 VanDerWaalsContact SG-N 3.43Å; C132-C136 CovalentContact SG-SG 2.03Å; C132-C136 PolarHBondContact SG-SG 3.05Å; G133-C136 PolarHBondContact O-N 2.87Å; P134-C136 PolarHBondContact O-N 2.82Å; C136-G138 PolarHBondContact O-N 3.45Å; C136-G138 VanDerWaalsContact O-N 3.17Å; C136-H139 WeakPolarHBondContact CA-ND1 3.48Å; C136-H139 HydrophobicContact CB-CB 4.45Å; C136-H139 VanDerWaalsContact O-CB 3.29Å; C136-H139 WeakPolarHBondContact O-CB 3.46Å; C136-H139 PolarHBondContact O-N 3.4Å; C136-H139 PolarHBondContact O-ND1 2.9Å
137	E	85.9	Confident	92	Very high	123 Å²	123	40.6 Å²	40.6	58%	0.575	22%	0.215	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.1	-32.5	176.2	-81.2	174.7	-168	0	0	112.6	T97 P134 H139	T97-E137 WeakPolarHBondContact CG2-O 3.4Å; P134-E137 PolarHBondContact O-N 3.37Å; E137-H139 PolarHBondContact O-N 3.34Å
138	G	92	Very high	91.4	Very high	28 Å²	28	39.2 Å²	39.2	29%	0.289	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.3	11.7	175.3	0	0	0	0	0	115.1	P100 W101 L102 C136	P100-G138 CarbonylContact C-O 3.55Å; P100-G138 WeakPolarHBondContact CA-O 3.38Å; P100-G138 WeakPolarHBondContact CB-O 3.41Å; W101-G138 WeakPolarHBondContact CA-O 3.21Å; W101-G138 PolarHBondContact N-O 3.24Å; L102-G138 PolarHBondContact N-O 2.03Å; L102-G138 VanDerWaalsContact N-O 3.1Å; C136-G138 PolarHBondContact O-N 3.45Å; C136-G138 VanDerWaalsContact O-N 3.17Å
139	H	94.7	Very high	90.5	Very high	14 Å²	14	40.3 Å²	40.3	7%	0.065	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	140.3	-178.5	-63.6	49.5	0	0	0	110.6	W101 L102 L129 C136 E137 F221	W101-H139 AromaticContact CE3-CE1 3.49Å; W101-H139 VanDerWaalsContact CE3-CE1 3.49Å; W101-H139 AromaticContact CE3-NE2 3.95Å; W101-H139 AromaticContact CZ3-CE1 3.57Å; W101-H139 AromaticContact CZ3-NE2 3.72Å; L102-H139 CarbonylContact O-C 3.46Å; L102-H139 VanDerWaalsContact O-CA 3.3Å; L102-H139 WeakPolarHBondContact O-CA 3.41Å; L129-H139 HydrophobicContact CD2-CB 3.64Å; C136-H139 WeakPolarHBondContact CA-ND1 3.48Å; C136-H139 HydrophobicContact CB-CB 4.45Å; C136-H139 VanDerWaalsContact O-CB 3.29Å; C136-H139 WeakPolarHBondContact O-CB 3.46Å; C136-H139 PolarHBondContact O-N 3.4Å; C136-H139 PolarHBondContact O-ND1 2.9Å; E137-H139 PolarHBondContact O-N 3.34Å; H139-F221 AromaticContact CD2-CD1 3.69Å; H139-F221 AromaticContact CD2-CE1 3.6Å; H139-F221 AromaticContact NE2-CD1 3.71Å
140	Q	93.9	Very high	89.6	Confident	1 Å²	1	46 Å²	46	1%	0.005	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	125.8	176.8	178.8	62.8	55.9	0	0	110	P100 L102 V103 I104 Y202	P100-Q140 HydrophobicContact CB-CB 3.79Å; P100-Q140 HydrophobicContact CG-CB 3.85Å; L102-Q140 PolarHBondContact O-N 2.9Å; V103-Q140 CarbonylContact C-O 3.56Å; V103-Q140 WeakPolarHBondContact CA-O 3.47Å; V103-Q140 HydrophobicContact CG2-CB 4.21Å; I104-Q140 PolarHBondContact N-O 2.88Å; Q140-Y202 HydrophobicContact CG-CD1 4.01Å; Q140-Y202 HydrophobicContact CG-CE1 3.61Å; Q140-Y202 HydrophobicContact CG-CE2 4.36Å
141	L	95.1	Very high	89.1	Confident	3 Å²	3	45.1 Å²	45.1	2%	0.016	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	136.5	170.1	-166.7	65.8	0	0	0	110	W94 I104 I106 V122 F125 L129 V162	W94-L141 HydrophobicContact CH2-CB 4.45Å; W94-L141 HydrophobicContact CH2-CD2 3.59Å; W94-L141 HydrophobicContact CZ3-CB 3.81Å; W94-L141 HydrophobicContact CZ3-CD2 3.74Å; W94-L141 HydrophobicContact CZ3-CG 4.26Å; I104-L141 HydrophobicContact CB-CD1 3.68Å; I104-L141 HydrophobicContact CD1-CD1 4.41Å; I104-L141 HydrophobicContact CG2-CD1 3.6Å; I106-L141 HydrophobicContact CD1-CD1 3.68Å; I106-L141 HydrophobicContact CD1-CG 4.44Å; I106-L141 HydrophobicContact CG1-CD1 4.35Å; V122-L141 HydrophobicContact CG1-CD2 3.73Å; F125-L141 HydrophobicContact CB-CD1 4.18Å; F125-L141 HydrophobicContact CB-CD2 4.41Å; F125-L141 HydrophobicContact CG-CD1 4.39Å; L129-L141 HydrophobicContact CD1-CB 4.4Å; L141-V162 HydrophobicContact CD2-CG1 4.34Å
142	F	95.6	Very high	89	Confident	6 Å²	6	38.9 Å²	38.9	3%	0.026	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142	131	-176.3	175.7	-126	0	0	0	109.7	V103 I104 T105 I106 P163 A165 S198 Y202	V103-F142 HydrophobicContact CG1-CB 4.04Å; I104-F142 PolarHBondContact O-N 3.21Å; T105-F142 CarbonylContact C-O 3.59Å; T105-F142 VanDerWaalsContact CA-O 3.31Å; T105-F142 WeakPolarHBondContact CA-O 3.31Å; T105-F142 HydrophobicContact CG2-CD1 3.79Å; T105-F142 HydrophobicContact CG2-CE1 4.25Å; I106-F142 PolarHBondContact N-O 2.98Å; F142-P163 HydrophobicContact CD2-CB 4.22Å; F142-P163 WeakPolarHBondContact CD2-O 3.46Å; F142-A165 HydrophobicContact CE1-CB 4.48Å; F142-A165 HydrophobicContact CE2-CB 3.88Å; F142-A165 HydrophobicContact CZ-CB 3.44Å; F142-A165 VanDerWaalsContact CZ-CB 3.44Å; F142-S198 VanDerWaalsContact CD1-OG 3.22Å; F142-S198 WeakPolarHBondContact CD1-OG 3.13Å; F142-S198 WeakPolarHBondContact CE1-OG 3.48Å; F142-Y202 HydrophobicContact CB-CE2 4.02Å; F142-Y202 HydrophobicContact CD1-CE2 4.28Å; F142-Y202 AromaticContact CD2-CE2 3.88Å; F142-Y202 HydrophobicContact CD2-CE2 3.88Å; F142-Y202 HydrophobicContact CE2-CE2 4.36Å; F142-Y202 AromaticContact CG-CE2 3.81Å; F142-Y202 HydrophobicContact CG-CE2 3.81Å
143	L	97	Very high	89.1	Confident	1 Å²	1	42.8 Å²	42.8	1%	0.005	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	131.5	178.2	-171.3	71.1	0	0	0	109.9	I106 T108 V118 V122 A155 L158 V162 P163 V164 A165	I106-L143 HydrophobicContact CB-CD1 4.1Å; I106-L143 HydrophobicContact CG2-CD1 4.12Å; T108-L143 HydrophobicContact CG2-CD1 3.75Å; T108-L143 HydrophobicContact CG2-CD2 4.34Å; T108-L143 HydrophobicContact CG2-CG 4.03Å; V118-L143 HydrophobicContact CG2-CD1 3.74Å; V122-L143 HydrophobicContact CG2-CD1 4.49Å; L143-A155 HydrophobicContact CD2-CB 4.11Å; L143-L158 HydrophobicContact CD1-CD1 4.29Å; L143-L158 HydrophobicContact CD2-CB 3.83Å; L143-L158 HydrophobicContact CD2-CD1 3.81Å; L143-V162 HydrophobicContact CB-CG2 3.63Å; L143-V162 HydrophobicContact CD2-CG2 4.33Å; L143-P163 PolarHBondContact N-O 2.62Å; L143-V164 HydrophobicContact CB-CB 4.48Å; L143-V164 HydrophobicContact CB-CG1 4.29Å; L143-V164 HydrophobicContact CB-CG2 4.07Å; L143-V164 HydrophobicContact CD2-CG1 4.13Å; L143-V164 HydrophobicContact CD2-CG2 3.96Å; L143-V164 HydrophobicContact CG-CG1 4.33Å; L143-V164 CarbonylContact O-C 3.54Å; L143-V164 VanDerWaalsContact O-CA 3.26Å; L143-V164 WeakPolarHBondContact O-CA 3.28Å; L143-A165 PolarHBondContact O-N 2.98Å
144	C	97.5	Very high	89.6	Confident	0 Å²	0	42.1 Å²	42.1	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	103	174.1	-172.3	0	0	0	0	109.2	T105 I106 I107 T108 A165 C194	T105-C144 HydrophobicContact CG2-CB 4.17Å; I106-C144 PolarHBondContact O-N 3.41Å; I107-C144 WeakPolarHBondContact CA-O 3.48Å; T108-C144 PolarHBondContact N-O 3.15Å; C144-A165 WeakPolarHBondContact CA-O 3.37Å; C144-C194 HydrophobicContact CB-CB 3.59Å; C144-C194 WeakPolarHBondContact CB-SG 3.42Å; C144-C194 WeakPolarHBondContact SG-CA 3.49Å; C144-C194 WeakPolarHBondContact SG-CB 3.47Å; C144-C194 CovalentContact SG-SG 2.03Å; C144-C194 PolarHBondContact SG-SG 3.05Å
145	N	95.8	Very high	90.1	Very high	15 Å²	15	37.5 Å²	37.5	8%	0.08	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	115.7	177.3	179.2	28	0	0	0	109.8	T108 E147 H152 A155 V164 A165 N166 R167	T108-N145 HydrophobicContact CG2-CB 4.27Å; N145-E147 WeakPolarHBondContact OD1-CB 3.35Å; N145-E147 PolarHBondContact OD1-N 2.88Å; N145-H152 PolarHBondContact OD1-ND1 3.15Å; N145-A155 HydrophobicContact CB-CB 4.22Å; N145-V164 HydrophobicContact CB-CG1 4.18Å; N145-A165 PolarHBondContact N-O 3.19Å; N145-N166 WeakPolarHBondContact CB-OD1 3.28Å; N145-N166 PolarHBondContact ND2-OD1 3.22Å; N145-N166 WeakPolarHBondContact O-CA 3.44Å; N145-R167 PolarHBondContact O-N 3.02Å
146	V	94.4	Very high	90.4	Very high	1 Å²	1	38.3 Å²	38.3	1%	0.006	20%	0.202	C	C	.	.			trans	-116.4	19.1	-179.5	-60.3	0	0	0	0	112.1	I107 T108 V109 R167 Y168 K186 D190 Y193 C194	I107-V146 HydrophobicContact CG2-CG1 4.31Å; I107-V146 HydrophobicContact CG2-CG2 3.67Å; T108-V146 WeakPolarHBondContact O-CG2 3.49Å; T108-V146 PolarHBondContact O-N 3.38Å; V109-V146 HydrophobicContact CG1-CG2 3.6Å; V146-R167 HydrophobicContact CG1-CB 4.16Å; V146-Y168 VanDerWaalsContact O-CE2 3.3Å; V146-Y168 WeakPolarHBondContact O-CE2 3.35Å; V146-K186 PolarHBondContact O-NZ 2.71Å; V146-D190 HydrophobicContact CB-CB 3.9Å; V146-D190 WeakPolarHBondContact CB-OD1 3.48Å; V146-D190 HydrophobicContact CG1-CB 3.89Å; V146-D190 HydrophobicContact CG2-CB 3.88Å; V146-Y193 HydrophobicContact CG1-CD1 4.48Å; V146-C194 WeakPolarHBondContact CG1-SG 3.5Å
147	E	90.2	Very high	90.5	Very high	28 Å²	28	38.3 Å²	38.3	13%	0.131	20%	0.202	C	C	.	.			trans	-74.4	139.7	167.1	-172.6	50.2	-114.2	0	0	110.4	D110 N145 S149 H152 Y168	D110-E147 HydrophobicContact CB-CG 3.77Å; D110-E147 PolarHBondContact N-OE2 3.12Å; N145-E147 WeakPolarHBondContact OD1-CB 3.35Å; N145-E147 PolarHBondContact OD1-N 2.88Å; E147-S149 PolarHBondContact OE1-N 2.88Å; E147-H152 HydrophobicContact CB-CB 4.2Å; E147-H152 HydrophobicContact CG-CB 4.22Å; E147-Y168 WeakPolarHBondContact O-CD2 3.35Å
148	R	83.7	Confident	90.9	Very high	58 Å²	58	32.5 Å²	32.5	22%	0.219	17%	0.174	C	C	.	.	S	Bend	trans	-80.6	-38.8	174.6	-72.2	-173.3	-178.2	172.7	8	111.4	Y168 D177	R148-Y168 HydrophobicContact CB-CD2 4.47Å; R148-Y168 HydrophobicContact CG-CD1 4.04Å; R148-Y168 HydrophobicContact CG-CD2 3.76Å; R148-Y168 HydrophobicContact CG-CE1 4.08Å; R148-Y168 HydrophobicContact CG-CE2 3.81Å; R148-Y168 HydrophobicContact CG-CG 3.88Å; R148-D177 WeakPolarHBondContact CD-OD1 3.41Å; R148-D177 IonicContact CZ-OD1 3.57Å; R148-D177 IonicContact NE-OD1 2.88Å; R148-D177 PolarHBondContact NE-OD1 3.28Å; R148-D177 IonicContact NH1-OD1 3.45Å; R148-D177 IonicContact NH2-OD1 3.84Å
149	S	75.7	Confident	90.9	Very high	27 Å²	27	34.3 Å²	34.3	19%	0.189	18%	0.183	C	C	.	.	S	Bend	trans	-63.7	138.2	178.5	178.7	0	0	0	0	111.9	E147 S151	E147-S149 PolarHBondContact OE1-N 2.88Å; S149-S151 PolarHBondContact O-N 3.3Å; S149-S151 WeakPolarHBondContact OG-CB 3.17Å; S149-S151 PolarHBondContact OG-N 3.42Å; S149-S151 VanDerWaalsContact OG-N 3.07Å; S149-S151 PolarHBondContact OG-OG 2.84Å
150	V	74	Confident	90.8	Very high	125 Å²	125	39.2 Å²	39.2	76%	0.758	20%	0.204	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70.3	-8.4	172.6	-151.9	0	0	0	0	112	H152	V150-H152 VanDerWaalsContact C-N 3.34Å; V150-H152 PolarHBondContact O-N 3.34Å
151	S	79.6	Confident	90.6	Very high	73 Å²	73	40 Å²	40	51%	0.51	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81	0.1	-173.2	69.9	0	0	0	0	115.9	D110 S149 F153	D110-S151 PolarHBondContact OD2-OG 3.04Å; S149-S151 PolarHBondContact O-N 3.3Å; S149-S151 WeakPolarHBondContact OG-CB 3.17Å; S149-S151 PolarHBondContact OG-N 3.42Å; S149-S151 VanDerWaalsContact OG-N 3.07Å; S149-S151 PolarHBondContact OG-OG 2.84Å; S151-F153 VanDerWaalsContact C-N 3.31Å; S151-F153 PolarHBondContact O-N 3.33Å
152	H	90.2	Very high	90.4	Very high	7 Å²	7	40 Å²	40	3%	0.032	21%	0.207	C	C	.	.			trans	-66.4	87.3	-173.3	-167.6	-178.9	0	0	0	112.2	T108 V109 D110 N145 E147 V150 D154 A155 K156	T108-H152 PolarHBondContact OG1-CE1 3.43Å; V109-H152 PolarHBondContact O-CE1 3.36Å; V109-H152 PolarHBondContact O-NE2 2.94Å; D110-H152 HydrophobicContact CB-CB 4.32Å; D110-H152 IonicContact OD1-CD2 3.96Å; N145-H152 PolarHBondContact OD1-ND1 3.15Å; E147-H152 HydrophobicContact CB-CB 4.2Å; E147-H152 HydrophobicContact CG-CB 4.22Å; V150-H152 VanDerWaalsContact C-N 3.34Å; V150-H152 PolarHBondContact O-N 3.34Å; H152-D154 PolarHBondContact O-N 3.36Å; H152-A155 HydrophobicContact CB-CB 4.3Å; H152-A155 PolarHBondContact O-N 3.38Å; H152-K156 PolarHBondContact O-N 3.25Å; H152-K156 VanDerWaalsContact O-N 3.15Å
153	F	92.3	Very high	90.2	Very high	110 Å²	110	41.9 Å²	41.9	48%	0.482	22%	0.22	S	C	.	.	H	α-helix	trans	-61.1	-46	-169.8	171.4	-97	0	0	0	112	L77 S151 A155 K156 L157	L77-F153 HydrophobicContact CD1-CE1 3.96Å; L77-F153 HydrophobicContact CD1-CZ 4.49Å; S151-F153 VanDerWaalsContact C-N 3.31Å; S151-F153 PolarHBondContact O-N 3.33Å; F153-A155 PolarHBondContact O-N 3.47Å; F153-K156 CarbonylContact O-C 3.57Å; F153-K156 PolarHBondContact O-N 2.71Å; F153-K156 VanDerWaalsContact O-N 3.15Å; F153-L157 HydrophobicContact CE1-CD2 4.46Å; F153-L157 PolarHBondContact O-N 2.91Å
154	D	94.5	Very high	90	Very high	17 Å²	17	43.8 Å²	43.8	9%	0.091	23%	0.231	C	C	.	.	H	α-helix	trans	-61.5	-45.7	-177.7	-69.8	-5	0	0	0	111.2	H116 V118 L119 H152 K156 L157 L158	H116-D154 VanDerWaalsContact CA-OD2 3.31Å; H116-D154 WeakPolarHBondContact CA-OD2 3.14Å; H116-D154 IonicContact CE1-OD1 3.52Å; H116-D154 IonicContact CG-OD1 3.94Å; H116-D154 IonicContact CG-OD2 3.85Å; H116-D154 IonicContact ND1-OD1 2.8Å; H116-D154 PolarHBondContact ND1-OD1 3.01Å; H116-D154 IonicContact ND1-OD2 3.25Å; H116-D154 PolarHBondContact ND1-OD2 3.5Å; V118-D154 HydrophobicContact CG1-CB 3.4Å; L119-D154 HydrophobicContact CD2-CB 3.92Å; L119-D154 HydrophobicContact CG-CB 4.01Å; H152-D154 PolarHBondContact O-N 3.36Å; D154-K156 VanDerWaalsContact C-N 3.3Å; D154-K156 PolarHBondContact O-N 2.81Å; D154-L157 PolarHBondContact O-N 2.96Å; D154-L158 WeakPolarHBondContact O-CB 3.01Å; D154-L158 VanDerWaalsContact O-CG 3.25Å; D154-L158 WeakPolarHBondContact O-CG 3.38Å; D154-L158 PolarHBondContact O-N 3.3Å
155	A	94	Very high	89.9	Confident	4 Å²	4	44.6 Å²	44.6	3%	0.033	24%	0.238	C	C	.	.	H	α-helix	trans	-61.5	-38.7	176.2	0	0	0	0	0	112.3	T108 L143 N145 H152 F153 L158 S159	T108-A155 HydrophobicContact CG2-CB 4.39Å; L143-A155 HydrophobicContact CD2-CB 4.11Å; N145-A155 HydrophobicContact CB-CB 4.22Å; H152-A155 HydrophobicContact CB-CB 4.3Å; H152-A155 PolarHBondContact O-N 3.38Å; F153-A155 PolarHBondContact O-N 3.47Å; A155-L158 PolarHBondContact O-N 3.07Å; A155-S159 PolarHBondContact O-N 3Å
156	K	92.1	Very high	89.8	Confident	153 Å²	153	46.2 Å²	46.2	67%	0.665	25%	0.247	S	C	*	.	H	α-helix	trans	-70	-32.4	176.3	-174.6	175.1	-177.3	176.2	0	113.1	H152 F153 D154 S159	H152-K156 PolarHBondContact O-N 3.25Å; H152-K156 VanDerWaalsContact O-N 3.15Å; F153-K156 CarbonylContact O-C 3.57Å; F153-K156 PolarHBondContact O-N 2.71Å; F153-K156 VanDerWaalsContact O-N 3.15Å; D154-K156 VanDerWaalsContact C-N 3.3Å; D154-K156 PolarHBondContact O-N 2.81Å; K156-S159 PolarHBondContact O-OG 3.08Å
157	L	93	Very high	89.7	Confident	11 Å²	11	49 Å²	49	6%	0.058	26%	0.257	C	S	.	.	H	α-helix	trans	-67.6	-47.5	171.9	176.1	60.3	0	0	0	110.2	L77 F80 L119 F153 D154 S159 K160 Y161	L77-L157 HydrophobicContact CD1-CD2 3.56Å; F80-L157 HydrophobicContact CB-CD2 4.06Å; F80-L157 HydrophobicContact CB-CG 4.34Å; L119-L157 HydrophobicContact CD1-CD2 4.15Å; L119-L157 HydrophobicContact CD2-CD2 4.41Å; F153-L157 HydrophobicContact CE1-CD2 4.46Å; F153-L157 PolarHBondContact O-N 2.91Å; D154-L157 PolarHBondContact O-N 2.96Å; L157-S159 VanDerWaalsContact C-N 3.29Å; L157-S159 PolarHBondContact O-N 3.12Å; L157-K160 HydrophobicContact CD1-CD 4.45Å; L157-K160 WeakPolarHBondContact O-CB 3.23Å; L157-K160 WeakPolarHBondContact O-CG 3.38Å; L157-K160 PolarHBondContact O-N 2.84Å; L157-Y161 HydrophobicContact CD1-CE2 4.34Å; L157-Y161 WeakPolarHBondContact O-CD2 3.3Å
158	L	94.2	Very high	89.6	Confident	0 Å²	0	49.5 Å²	49.5	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-65	-29	-178.4	-72.3	175.4	0	0	0	113.6	F80 V118 L119 V122 L143 D154 A155 K160 Y161 V162	F80-L158 HydrophobicContact CD1-CD2 4.1Å; F80-L158 HydrophobicContact CD2-CD2 3.97Å; F80-L158 HydrophobicContact CE1-CD2 3.8Å; F80-L158 HydrophobicContact CE2-CD2 3.64Å; F80-L158 HydrophobicContact CG-CD2 4.19Å; F80-L158 HydrophobicContact CZ-CD2 3.57Å; V118-L158 HydrophobicContact CG1-CD1 4.16Å; V118-L158 HydrophobicContact CG2-CD1 3.9Å; L119-L158 HydrophobicContact CD2-CD1 3.78Å; L119-L158 HydrophobicContact CD2-CD2 3.7Å; L119-L158 HydrophobicContact CD2-CG 3.53Å; V122-L158 HydrophobicContact CB-CD1 4.3Å; V122-L158 HydrophobicContact CB-CD2 4.12Å; V122-L158 HydrophobicContact CG1-CD2 3.76Å; V122-L158 HydrophobicContact CG2-CD1 3.76Å; V122-L158 HydrophobicContact CG2-CD2 4.44Å; L143-L158 HydrophobicContact CD1-CD1 4.29Å; L143-L158 HydrophobicContact CD2-CB 3.83Å; L143-L158 HydrophobicContact CD2-CD1 3.81Å; D154-L158 WeakPolarHBondContact O-CB 3.01Å; D154-L158 VanDerWaalsContact O-CG 3.25Å; D154-L158 WeakPolarHBondContact O-CG 3.38Å; D154-L158 PolarHBondContact O-N 3.3Å; A155-L158 PolarHBondContact O-N 3.07Å; L158-K160 PolarHBondContact O-N 2.97Å; L158-Y161 PolarHBondContact O-N 3.14Å; L158-V162 HydrophobicContact CB-CG2 4.25Å; L158-V162 PolarHBondContact O-N 3.29Å
159	S	92.1	Very high	89.5	Confident	66 Å²	66	53.8 Å²	53.8	46%	0.462	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.7	-15.1	178.9	72.5	0	0	0	0	114.7	A155 K156 L157 Y161	A155-S159 PolarHBondContact O-N 3Å; K156-S159 PolarHBondContact O-OG 3.08Å; L157-S159 VanDerWaalsContact C-N 3.29Å; L157-S159 PolarHBondContact O-N 3.12Å; S159-Y161 VanDerWaalsContact C-N 3.27Å
160	K	90.8	Very high	89.4	Confident	117 Å²	117	56.3 Å²	56.3	51%	0.509	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.9	-17.4	172.1	-57.9	174.6	-173	171	0	113.3	A86 L157 L158	A86-K160 WeakPolarHBondContact CB-O 3.36Å; L157-K160 HydrophobicContact CD1-CD 4.45Å; L157-K160 WeakPolarHBondContact O-CB 3.23Å; L157-K160 WeakPolarHBondContact O-CG 3.38Å; L157-K160 PolarHBondContact O-N 2.84Å; L158-K160 PolarHBondContact O-N 2.97Å
161	Y	89.6	Confident	89.2	Confident	17 Å²	17	53.8 Å²	53.8	7%	0.067	30%	0.296	C	S	.	.	T	Hydrogen-bonded Turn	trans	-122.4	-34.9	-170.6	-54.4	-77.7	0	0	0	112.2	F80 L83 L157 L158 S159	F80-Y161 HydrophobicContact CB-CE2 4.31Å; F80-Y161 AromaticContact CD1-CD2 3.99Å; F80-Y161 HydrophobicContact CD1-CD2 3.99Å; F80-Y161 HydrophobicContact CD1-CE2 4.28Å; F80-Y161 HydrophobicContact CD1-CG 4.37Å; F80-Y161 PolarHBondContact O-OH 3.36Å; L83-Y161 HydrophobicContact CB-CE1 3.86Å; L83-Y161 HydrophobicContact CD2-CD1 3.68Å; L83-Y161 HydrophobicContact CD2-CE1 3.84Å; L83-Y161 HydrophobicContact CD2-CG 4.49Å; L83-Y161 HydrophobicContact CG-CE1 4.39Å; L83-Y161 PolarHBondContact O-OH 3.24Å; L83-Y161 VanDerWaalsContact O-OH 3.12Å; L157-Y161 HydrophobicContact CD1-CE2 4.34Å; L157-Y161 WeakPolarHBondContact O-CD2 3.3Å; L158-Y161 PolarHBondContact O-N 3.14Å; S159-Y161 VanDerWaalsContact C-N 3.27Å
162	V	91.1	Very high	88.1	Confident	5 Å²	5	59.5 Å²	59.5	3%	0.03	32%	0.315	C	S	.	.	S	Bend	trans	-125	142.3	-172.2	-35.3	0	0	0	0	109.9	W94 V122 L141 L143 L158 V164	W94-V162 HydrophobicContact CE3-CB 4.27Å; W94-V162 HydrophobicContact CE3-CG1 4.07Å; W94-V162 HydrophobicContact CH2-CB 4.19Å; W94-V162 HydrophobicContact CH2-CG1 3.2Å; W94-V162 HydrophobicContact CZ2-CG1 4.11Å; W94-V162 HydrophobicContact CZ3-CB 3.63Å; W94-V162 HydrophobicContact CZ3-CG1 3.16Å; V122-V162 HydrophobicContact CG1-CG1 4.11Å; L141-V162 HydrophobicContact CD2-CG1 4.34Å; L143-V162 HydrophobicContact CB-CG2 3.63Å; L143-V162 HydrophobicContact CD2-CG2 4.33Å; L158-V162 HydrophobicContact CB-CG2 4.25Å; L158-V162 PolarHBondContact O-N 3.29Å; V162-V164 HydrophobicContact CG2-CG2 4.16Å; V162-V164 VanDerWaalsContact O-CG2 3.32Å; V162-V164 WeakPolarHBondContact O-CG2 3.41Å; V162-V164 PolarHBondContact O-N 3.29Å
163	P	93	Very high	86.5	Confident	45 Å²	45	64.4 Å²	64.4	29%	0.292	34%	0.341	S	S	.	.			trans	-60.3	134.5	171.5	-21.7	32.9	0	0	0	110.7	F142 L143 Y202	F142-P163 HydrophobicContact CD2-CB 4.22Å; F142-P163 WeakPolarHBondContact CD2-O 3.46Å; L143-P163 PolarHBondContact N-O 2.62Å; P163-Y202 VanDerWaalsContact CB-OH 3.28Å; P163-Y202 WeakPolarHBondContact CB-OH 3.19Å
164	V	93.1	Very high	84.8	Confident	40 Å²	40	63.7 Å²	63.7	24%	0.242	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	134.7	-177.6	-169.7	0	0	0	0	110.2	L143 N145 V162	L143-V164 HydrophobicContact CB-CB 4.48Å; L143-V164 HydrophobicContact CB-CG1 4.29Å; L143-V164 HydrophobicContact CB-CG2 4.07Å; L143-V164 HydrophobicContact CD2-CG1 4.13Å; L143-V164 HydrophobicContact CD2-CG2 3.96Å; L143-V164 HydrophobicContact CG-CG1 4.33Å; L143-V164 CarbonylContact O-C 3.54Å; L143-V164 VanDerWaalsContact O-CA 3.26Å; L143-V164 WeakPolarHBondContact O-CA 3.28Å; N145-V164 HydrophobicContact CB-CG1 4.18Å; V162-V164 HydrophobicContact CG2-CG2 4.16Å; V162-V164 VanDerWaalsContact O-CG2 3.32Å; V162-V164 WeakPolarHBondContact O-CG2 3.41Å; V162-V164 PolarHBondContact O-N 3.29Å
165	A	94	Very high	82.9	Confident	18 Å²	18	72.9 Å²	72.9	15%	0.149	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	130.3	160.9	0	0	0	0	0	109.8	F142 L143 C144 N145	F142-A165 HydrophobicContact CE1-CB 4.48Å; F142-A165 HydrophobicContact CE2-CB 3.88Å; F142-A165 HydrophobicContact CZ-CB 3.44Å; F142-A165 VanDerWaalsContact CZ-CB 3.44Å; L143-A165 PolarHBondContact O-N 2.98Å; C144-A165 WeakPolarHBondContact CA-O 3.37Å; N145-A165 PolarHBondContact N-O 3.19Å
166	N	93.5	Very high	81.2	Confident	48 Å²	48	74.9 Å²	74.9	26%	0.257	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	125.7	174.1	-61.9	-63.7	0	0	0	108.6	N145 E169 Y193	N145-N166 WeakPolarHBondContact CB-OD1 3.28Å; N145-N166 PolarHBondContact ND2-OD1 3.22Å; N145-N166 WeakPolarHBondContact O-CA 3.44Å; N166-E169 HydrophobicContact CB-CB 3.57Å; N166-E169 PolarHBondContact ND2-OE2 2.87Å; N166-Y193 PolarHBondContact O-OH 2.9Å
167	R	92.5	Very high	79.9	Confident	61 Å²	61	71 Å²	71	23%	0.23	39%	0.385	C	S	.	.	S	Bend	trans	-70.1	-35.9	178.7	-176.7	176.7	173.5	-165.7	-4.9	112.7	N145 V146 Q189 D190 Y193	N145-R167 PolarHBondContact O-N 3.02Å; V146-R167 HydrophobicContact CG1-CB 4.16Å; R167-Q189 VanDerWaalsContact NH1-CB 3.32Å; R167-Q189 VanDerWaalsContact NH2-OE1 3.1Å; R167-D190 WeakPolarHBondContact CD-OD1 3.3Å; R167-D190 IonicContact CZ-OD1 2.63Å; R167-D190 IonicContact NE-OD1 3.65Å; R167-D190 VanDerWaalsContact NH1-N 3.13Å; R167-D190 IonicContact NH1-OD1 2.79Å; R167-D190 PolarHBondContact NH1-OD1 3Å; R167-Y193 HydrophobicContact CB-CD1 3.66Å; R167-Y193 HydrophobicContact CB-CE1 3.54Å; R167-Y193 HydrophobicContact CB-CG 4.24Å; R167-Y193 HydrophobicContact CG-CD1 3.83Å; R167-Y193 HydrophobicContact CG-CD2 4.16Å; R167-Y193 HydrophobicContact CG-CE1 4.05Å; R167-Y193 HydrophobicContact CG-CE2 4.37Å; R167-Y193 HydrophobicContact CG-CG 3.88Å
168	Y	88.4	Confident	78.6	Confident	38 Å²	38	74.4 Å²	74.4	15%	0.149	40%	0.403	C	S	.	.	S	Bend	trans	-111.3	19.2	-170.7	-58.9	-76.1	0	0	0	112.7	V146 E147 R148 G170 T171 D190	V146-Y168 VanDerWaalsContact O-CE2 3.3Å; V146-Y168 WeakPolarHBondContact O-CE2 3.35Å; E147-Y168 WeakPolarHBondContact O-CD2 3.35Å; R148-Y168 HydrophobicContact CB-CD2 4.47Å; R148-Y168 HydrophobicContact CG-CD1 4.04Å; R148-Y168 HydrophobicContact CG-CD2 3.76Å; R148-Y168 HydrophobicContact CG-CE1 4.08Å; R148-Y168 HydrophobicContact CG-CE2 3.81Å; R148-Y168 HydrophobicContact CG-CG 3.88Å; Y168-G170 PolarHBondContact O-N 3.25Å; Y168-T171 WeakPolarHBondContact CB-OG1 3.46Å; Y168-T171 PolarHBondContact O-N 2.9Å; Y168-T171 PolarHBondContact O-OG1 2.91Å; Y168-D190 PolarHBondContact OH-OD1 3.19Å
169	E	82	Confident	77.1	Confident	147 Å²	147	80.7 Å²	80.7	69%	0.687	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.4	122.4	176.8	-177.9	166.6	-162	0	0	110.4	N166	N166-E169 HydrophobicContact CB-CB 3.57Å; N166-E169 PolarHBondContact ND2-OE2 2.87Å
170	G	72.7	Confident	76	Confident	80 Å²	80	82 Å²	82	83%	0.825	45%	0.453	S	S	*	.	T	Hydrogen-bonded Turn	trans	86.6	2.5	-178.4	0	0	0	0	0	115.4	Y168	Y168-G170 PolarHBondContact O-N 3.25Å
171	T	71.1	Confident	75.4	Confident	73 Å²	73	78.5 Å²	78.5	45%	0.448	44%	0.442	S	S	.	.			trans	-87	124.8	166.9	49	0	0	0	0	109.8	Y168 D173	Y168-T171 WeakPolarHBondContact CB-OG1 3.46Å; Y168-T171 PolarHBondContact O-N 2.9Å; Y168-T171 PolarHBondContact O-OG1 2.91Å; T171-D173 PolarHBondContact O-N 2.79Å; T171-D173 VanDerWaalsContact O-N 3.08Å
172	E	56.2	Low	75.4	Confident	193 Å²	193	79.6 Å²	79.6	90%	0.902	45%	0.449	S	S	*	.	S	Bend	trans	-69	-0.1	-178.5	-69.5	-172.6	160.3	0	0	114.2	D174	E172-D174 PolarHBondContact O-N 3.16Å
173	D	57	Low	75.3	Confident	109 Å²	109	81.5 Å²	81.5	58%	0.583	46%	0.462	S	S	*	.			trans	-77.8	66.4	178.4	-65.3	-31.6	0	0	0	111.1	T171 Y175	T171-D173 PolarHBondContact O-N 2.79Å; T171-D173 VanDerWaalsContact O-N 3.08Å; D173-Y175 PolarHBondContact O-N 3.12Å
174	D	56.2	Low	75.3	Confident	96 Å²	96	81.4 Å²	81.4	51%	0.513	46%	0.457	S	S	.	.			trans	-76.2	-4.4	171.9	-166.6	35.7	0	0	0	112.3	E172 G176	E172-D174 PolarHBondContact O-N 3.16Å; D174-G176 PolarHBondContact O-N 3.09Å; D174-G176 VanDerWaalsContact O-N 3.1Å
175	Y	54	Low	75.4	Confident	210 Å²	210	80.4 Å²	80.4	82%	0.824	45%	0.45	S	S	*	.	S	Bend	trans	-74.3	104.5	169.1	-70	-79.7	0	0	0	107.6	D173	D173-Y175 PolarHBondContact O-N 3.12Å
176	G	58.4	Low	75.4	Confident	46 Å²	46	80.2 Å²	80.2	47%	0.474	45%	0.446	S	S	.	.			trans	-44.3	161.8	179.9	0	0	0	0	0	113.8	D174 D178	D174-G176 PolarHBondContact O-N 3.09Å; D174-G176 VanDerWaalsContact O-N 3.1Å; G176-D178 PolarHBondContact O-N 2.74Å; G176-D178 VanDerWaalsContact O-N 3.12Å
177	D	64.2	Low	75.4	Confident	71 Å²	71	79.8 Å²	79.8	38%	0.38	44%	0.442	S	S	.	.			trans	-35.4	115.2	-167	-84.1	-20.5	0	0	0	114.2	R148 P179 K186	R148-D177 WeakPolarHBondContact CD-OD1 3.41Å; R148-D177 IonicContact CZ-OD1 3.57Å; R148-D177 IonicContact NE-OD1 2.88Å; R148-D177 PolarHBondContact NE-OD1 3.28Å; R148-D177 IonicContact NH1-OD1 3.45Å; R148-D177 IonicContact NH2-OD1 3.84Å; D177-P179 WeakPolarHBondContact O-CD 3.23Å; D177-K186 WeakPolarHBondContact OD1-CE 3.34Å; D177-K186 WeakPolarHBondContact OD2-CD 3.27Å; D177-K186 WeakPolarHBondContact OD2-CE 3.47Å; D177-K186 IonicContact OD2-NZ 2.6Å
178	D	65.6	Low	75.5	Confident	82 Å²	82	77.2 Å²	77.2	44%	0.439	43%	0.433	S	S	.	.			trans	-54.2	125.2	173.7	169.9	5.8	0	0	0	108.1	G176 S180 T181	G176-D178 PolarHBondContact O-N 2.74Å; G176-D178 VanDerWaalsContact O-N 3.12Å; D178-S180 PolarHBondContact O-N 2.95Å; D178-S180 WeakPolarHBondContact OD1-CB 3.19Å; D178-S180 PolarHBondContact OD1-N 3.25Å; D178-S180 PolarHBondContact OD1-OG 2.96Å; D178-S180 PolarHBondContact OD2-OG 3.1Å; D178-T181 WeakPolarHBondContact O-CA 3.43Å; D178-T181 WeakPolarHBondContact O-CB 3.37Å; D178-T181 PolarHBondContact O-N 2.84Å; D178-T181 PolarHBondContact O-OG1 3.4Å
179	P	64	Low	75.9	Confident	132 Å²	132	79 Å²	79	86%	0.857	44%	0.442	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.9	-23.2	177.8	-24.3	30.5	0	0	0	114.3	D177 T181	D177-P179 WeakPolarHBondContact O-CD 3.23Å; P179-T181 VanDerWaalsContact C-N 3.29Å
180	S	69.5	Low	76.6	Confident	95 Å²	95	72.3 Å²	72.3	66%	0.664	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.4	-16.3	176.1	92.1	0	0	0	0	113.5	D178 N182	D178-S180 PolarHBondContact O-N 2.95Å; D178-S180 WeakPolarHBondContact OD1-CB 3.19Å; D178-S180 PolarHBondContact OD1-N 3.25Å; D178-S180 PolarHBondContact OD1-OG 2.96Å; D178-S180 PolarHBondContact OD2-OG 3.1Å; S180-N182 PolarHBondContact O-N 2.82Å
181	T	78.1	Confident	77.7	Confident	43 Å²	43	68.6 Å²	68.6	26%	0.264	37%	0.372	S	S	.	.	S	Bend	trans	-65.3	122.3	179.9	-52	0	0	0	0	109.6	D178 P179 S183 K186	D178-T181 WeakPolarHBondContact O-CA 3.43Å; D178-T181 WeakPolarHBondContact O-CB 3.37Å; D178-T181 PolarHBondContact O-N 2.84Å; D178-T181 PolarHBondContact O-OG1 3.4Å; P179-T181 VanDerWaalsContact C-N 3.29Å; T181-S183 PolarHBondContact O-N 2.72Å; T181-K186 HydrophobicContact CG2-CB 4.31Å
182	N	89	Confident	79	Confident	40 Å²	40	66.2 Å²	66.2	21%	0.214	36%	0.357	C	S	.	.			trans	-65.5	100.7	173.2	178.1	-5.8	0	0	0	109.7	S180 F184 E185 K186 Y355 C356	S180-N182 PolarHBondContact O-N 2.82Å; N182-F184 VanDerWaalsContact C-N 3.25Å; N182-F184 PolarHBondContact O-N 3.1Å; N182-F184 WeakPolarHBondContact OD1-CB 3.34Å; N182-F184 PolarHBondContact OD1-N 2.83Å; N182-E185 HydrophobicContact CB-CB 4.02Å; N182-E185 WeakPolarHBondContact O-CB 3.41Å; N182-E185 PolarHBondContact O-N 2.69Å; N182-E185 PolarHBondContact OD1-N 2.67Å; N182-K186 PolarHBondContact O-N 2.7Å; N182-Y355 WeakPolarHBondContact ND2-CE1 3.43Å; N182-Y355 PolarHBondContact ND2-OH 3.01Å; N182-C356 PolarHBondContact ND2-O 2.81Å
183	S	89.7	Confident	81	Confident	44 Å²	44	60 Å²	60	31%	0.308	33%	0.326	S	S	.	.	H	α-helix	trans	-59.6	-33.2	-175.9	58.8	0	0	0	0	113.4	T181 E185 K186 E187	T181-S183 PolarHBondContact O-N 2.72Å; S183-E185 VanDerWaalsContact C-N 3.34Å; S183-K186 PolarHBondContact O-N 3.07Å; S183-E187 VanDerWaalsContact O-CB 3.31Å; S183-E187 WeakPolarHBondContact O-CB 3.18Å; S183-E187 PolarHBondContact O-N 3.28Å
184	F	92.4	Very high	82.9	Confident	43 Å²	43	54.9 Å²	54.9	19%	0.189	30%	0.299	C	S	.	.	H	α-helix	trans	-67	-35.9	175.6	-63.2	-84.8	0	0	0	112.2	N182 K188 C356 K358 L394	N182-F184 VanDerWaalsContact C-N 3.25Å; N182-F184 PolarHBondContact O-N 3.1Å; N182-F184 WeakPolarHBondContact OD1-CB 3.34Å; N182-F184 PolarHBondContact OD1-N 2.83Å; F184-K188 PolarHBondContact O-N 3.16Å; F184-C356 HydrophobicContact CB-CB 4.12Å; F184-C356 WeakPolarHBondContact O-CB 3.49Å; F184-K358 HydrophobicContact CD2-CB 4.33Å; F184-K358 HydrophobicContact CE2-CB 3.89Å; F184-K358 HydrophobicContact CE2-CG 4.07Å; F184-K358 HydrophobicContact CZ-CG 4.4Å; F184-L394 HydrophobicContact CE1-CD1 4.38Å
185	E	94.7	Very high	84.9	Confident	20 Å²	20	50.3 Å²	50.3	9%	0.093	27%	0.274	C	S	.	.	H	α-helix	trans	-74.6	-41.4	175.3	178.8	59.4	-163.5	0	0	111.1	N182 S183 E187 K188 Q189 Y355 C356	N182-E185 HydrophobicContact CB-CB 4.02Å; N182-E185 WeakPolarHBondContact O-CB 3.41Å; N182-E185 PolarHBondContact O-N 2.69Å; N182-E185 PolarHBondContact OD1-N 2.67Å; S183-E185 VanDerWaalsContact C-N 3.34Å; E185-E187 PolarHBondContact O-N 3.07Å; E185-K188 PolarHBondContact O-N 2.94Å; E185-K188 WeakPolarHBondContact OE1-CE 3.26Å; E185-K188 IonicContact OE1-NZ 3.17Å; E185-K188 PolarHBondContact OE1-NZ 2.96Å; E185-K188 WeakPolarHBondContact OE2-CE 3.45Å; E185-K188 IonicContact OE2-NZ 3.87Å; E185-K188 PolarHBondContact OE2-NZ 2.95Å; E185-Q189 VanDerWaalsContact O-CG 3.29Å; E185-Q189 WeakPolarHBondContact O-CG 3.47Å; E185-Q189 PolarHBondContact O-N 3.33Å; E185-Q189 PolarHBondContact OE1-NE2 3.06Å; E185-Y355 HydrophobicContact CB-CE2 4.28Å; E185-Y355 HydrophobicContact CG-CD2 4.12Å; E185-Y355 HydrophobicContact CG-CE2 3.77Å; E185-C356 PolarHBondContact OE2-N 3.49Å
186	K	93.2	Very high	87	Confident	14 Å²	14	44.2 Å²	44.2	6%	0.061	25%	0.253	C	S	.	.	H	α-helix	trans	-55.2	-51.3	172.6	-179.3	-176.2	179.7	-68.4	0	110.8	V146 D177 T181 N182 S183 K188 Q189 D190	V146-K186 PolarHBondContact O-NZ 2.71Å; D177-K186 WeakPolarHBondContact OD1-CE 3.34Å; D177-K186 WeakPolarHBondContact OD2-CD 3.27Å; D177-K186 WeakPolarHBondContact OD2-CE 3.47Å; D177-K186 IonicContact OD2-NZ 2.6Å; T181-K186 HydrophobicContact CG2-CB 4.31Å; N182-K186 PolarHBondContact O-N 2.7Å; S183-K186 PolarHBondContact O-N 3.07Å; K186-K188 VanDerWaalsContact C-N 3.32Å; K186-K188 PolarHBondContact O-N 3.39Å; K186-Q189 PolarHBondContact O-N 2.88Å; K186-Q189 VanDerWaalsContact O-N 3.08Å; K186-D190 WeakPolarHBondContact CG-OD2 3.26Å; K186-D190 IonicContact NZ-OD1 3.23Å; K186-D190 IonicContact NZ-OD2 3.27Å; K186-D190 PolarHBondContact NZ-OD2 3.4Å; K186-D190 WeakPolarHBondContact O-CB 3.48Å; K186-D190 VanDerWaalsContact O-CG 3.27Å; K186-D190 PolarHBondContact O-N 3.01Å
187	E	93.6	Very high	88.8	Confident	39 Å²	39	42.7 Å²	42.7	18%	0.182	24%	0.235	C	C	.	.	H	α-helix	trans	-57.8	-42.1	179.9	-169.9	-162.7	-169	0	0	112.2	S183 E185 Y191 K362 L394	S183-E187 VanDerWaalsContact O-CB 3.31Å; S183-E187 WeakPolarHBondContact O-CB 3.18Å; S183-E187 PolarHBondContact O-N 3.28Å; E185-E187 PolarHBondContact O-N 3.07Å; E187-Y191 WeakPolarHBondContact O-CB 3.34Å; E187-Y191 PolarHBondContact O-N 3.36Å; E187-K362 HydrophobicContact CG-CD 3.9Å; E187-K362 WeakPolarHBondContact OE1-CE 3.31Å; E187-K362 IonicContact OE1-NZ 3.49Å; E187-K362 PolarHBondContact OE1-NZ 3.38Å; E187-L394 HydrophobicContact CB-CD2 4.47Å
188	K	96	Very high	90.4	Very high	7 Å²	7	39.3 Å²	39.3	3%	0.03	22%	0.217	C	C	.	.	H	α-helix	trans	-64.6	-43.9	175	-174.7	-146.4	72.7	-166.4	0	111.5	F184 E185 K186 Y191 V192 L351 V354 C356 K362	F184-K188 PolarHBondContact O-N 3.16Å; E185-K188 PolarHBondContact O-N 2.94Å; E185-K188 WeakPolarHBondContact OE1-CE 3.26Å; E185-K188 IonicContact OE1-NZ 3.17Å; E185-K188 PolarHBondContact OE1-NZ 2.96Å; E185-K188 WeakPolarHBondContact OE2-CE 3.45Å; E185-K188 IonicContact OE2-NZ 3.87Å; E185-K188 PolarHBondContact OE2-NZ 2.95Å; K186-K188 VanDerWaalsContact C-N 3.32Å; K186-K188 PolarHBondContact O-N 3.39Å; K188-Y191 WeakPolarHBondContact O-CB 3.43Å; K188-Y191 PolarHBondContact O-N 3.5Å; K188-V192 WeakPolarHBondContact O-CG2 3.45Å; K188-V192 PolarHBondContact O-N 3.23Å; K188-L351 WeakPolarHBondContact CD-O 3.23Å; K188-L351 WeakPolarHBondContact CE-O 3.5Å; K188-L351 HydrophobicContact CG-CB 4.45Å; K188-L351 HydrophobicContact CG-CD2 4.3Å; K188-L351 PolarHBondContact NZ-O 2.66Å; K188-V354 PolarHBondContact NZ-O 2.82Å; K188-C356 HydrophobicContact CB-CB 4.32Å; K188-C356 HydrophobicContact CD-CB 4.44Å; K188-K362 HydrophobicContact CB-CB 4.19Å; K188-K362 HydrophobicContact CG-CB 4.38Å
189	Q	96.2	Very high	91.9	Very high	74 Å²	74	36 Å²	36	35%	0.346	20%	0.2	S	C	.	.	H	α-helix	trans	-68.1	-39	179.6	-69.2	176.3	3.6	0	0	112.4	R167 E185 K186 Y191 V192 Y193	R167-Q189 VanDerWaalsContact NH1-CB 3.32Å; R167-Q189 VanDerWaalsContact NH2-OE1 3.1Å; E185-Q189 VanDerWaalsContact O-CG 3.29Å; E185-Q189 WeakPolarHBondContact O-CG 3.47Å; E185-Q189 PolarHBondContact O-N 3.33Å; E185-Q189 PolarHBondContact OE1-NE2 3.06Å; K186-Q189 PolarHBondContact O-N 2.88Å; K186-Q189 VanDerWaalsContact O-N 3.08Å; Q189-Y191 VanDerWaalsContact C-N 3.29Å; Q189-Y191 PolarHBondContact O-N 2.81Å; Q189-V192 PolarHBondContact O-N 3.39Å; Q189-Y193 WeakPolarHBondContact O-CB 2.99Å; Q189-Y193 PolarHBondContact O-N 3.17Å
190	D	96	Very high	93.4	Very high	8 Å²	8	36.4 Å²	36.4	4%	0.043	19%	0.19	C	C	.	.	H	α-helix	trans	-58.2	-46.6	173.3	-74.1	-21.9	0	0	0	109.5	V146 R167 Y168 K186 V192 Y193 C194	V146-D190 HydrophobicContact CB-CB 3.9Å; V146-D190 WeakPolarHBondContact CB-OD1 3.48Å; V146-D190 HydrophobicContact CG1-CB 3.89Å; V146-D190 HydrophobicContact CG2-CB 3.88Å; R167-D190 WeakPolarHBondContact CD-OD1 3.3Å; R167-D190 IonicContact CZ-OD1 2.63Å; R167-D190 IonicContact NE-OD1 3.65Å; R167-D190 VanDerWaalsContact NH1-N 3.13Å; R167-D190 IonicContact NH1-OD1 2.79Å; R167-D190 PolarHBondContact NH1-OD1 3Å; Y168-D190 PolarHBondContact OH-OD1 3.19Å; K186-D190 WeakPolarHBondContact CG-OD2 3.26Å; K186-D190 IonicContact NZ-OD1 3.23Å; K186-D190 IonicContact NZ-OD2 3.27Å; K186-D190 PolarHBondContact NZ-OD2 3.4Å; K186-D190 WeakPolarHBondContact O-CB 3.48Å; K186-D190 VanDerWaalsContact O-CG 3.27Å; K186-D190 PolarHBondContact O-N 3.01Å; D190-V192 PolarHBondContact O-N 2.72Å; D190-Y193 PolarHBondContact O-N 3.49Å; D190-C194 PolarHBondContact O-N 2.89Å; D190-C194 PolarHBondContact O-SG 3.34Å
191	Y	97.2	Very high	94.6	Very high	2 Å²	2	36 Å²	36	1%	0.008	18%	0.184	C	C	.	.	H	α-helix	trans	-60.2	-45.2	176.5	-166.9	-86.6	0	0	0	113.1	I107 E187 K188 Q189 L195 M209 M337 F339 L351 K362	I107-Y191 HydrophobicContact CD1-CD2 3.54Å; I107-Y191 HydrophobicContact CD1-CE2 4.03Å; I107-Y191 HydrophobicContact CD1-CG 4.32Å; E187-Y191 WeakPolarHBondContact O-CB 3.34Å; E187-Y191 PolarHBondContact O-N 3.36Å; K188-Y191 WeakPolarHBondContact O-CB 3.43Å; K188-Y191 PolarHBondContact O-N 3.5Å; Q189-Y191 VanDerWaalsContact C-N 3.29Å; Q189-Y191 PolarHBondContact O-N 2.81Å; Y191-L195 HydrophobicContact CE1-CD2 4.25Å; Y191-L195 WeakPolarHBondContact O-CB 3.37Å; Y191-L195 PolarHBondContact O-N 2.95Å; Y191-M209 HydrophobicContact CD2-CE 4.48Å; Y191-M209 HydrophobicContact CE2-CB 3.93Å; Y191-M209 HydrophobicContact CE2-CE 4.23Å; Y191-M209 HydrophobicContact CE2-CG 4.34Å; Y191-M209 VanDerWaalsContact OH-CB 3.23Å; Y191-M209 WeakPolarHBondContact OH-CB 3.4Å; Y191-M209 WeakPolarHBondContact OH-CG 3.46Å; Y191-M337 HydrophobicContact CE1-CE 4.25Å; Y191-M337 HydrophobicContact CE2-CE 3.81Å; Y191-M337 VanDerWaalsContact CZ-CE 3.45Å; Y191-M337 WeakPolarHBondContact OH-CE 3.12Å; Y191-F339 HydrophobicContact CE1-CZ 4.5Å; Y191-F339 WeakPolarHBondContact OH-CE2 3.14Å; Y191-F339 WeakPolarHBondContact OH-CZ 3.48Å; Y191-L351 HydrophobicContact CD1-CD1 4.14Å; Y191-K362 HydrophobicContact CD2-CD 4.26Å; Y191-K362 HydrophobicContact CG-CD 4.42Å
192	V	97.7	Very high	95.4	Very high	22 Å²	22	35 Å²	35	13%	0.133	18%	0.175	C	C	.	.	H	α-helix	trans	-61.6	-48.2	177.1	166	0	0	0	0	110.8	K188 Q189 D190 C194 L195 E196 L348 L351	K188-V192 WeakPolarHBondContact O-CG2 3.45Å; K188-V192 PolarHBondContact O-N 3.23Å; Q189-V192 PolarHBondContact O-N 3.39Å; D190-V192 PolarHBondContact O-N 2.72Å; V192-C194 PolarHBondContact O-N 3.2Å; V192-L195 PolarHBondContact O-N 3.42Å; V192-E196 VanDerWaalsContact O-CB 3.3Å; V192-E196 WeakPolarHBondContact O-CB 3.44Å; V192-E196 PolarHBondContact O-N 2.97Å; V192-L348 HydrophobicContact CB-CD2 4.22Å; V192-L348 HydrophobicContact CG1-CD2 3.81Å; V192-L348 HydrophobicContact CG2-CD2 4.45Å; V192-L348 VanDerWaalsContact O-CD2 3.23Å; V192-L348 WeakPolarHBondContact O-CD2 3.44Å; V192-L351 HydrophobicContact CG2-CB 3.53Å; V192-L351 HydrophobicContact CG2-CD1 4.05Å; V192-L351 HydrophobicContact CG2-CG 4.47Å
193	Y	97.6	Very high	95.6	Very high	64 Å²	64	36.1 Å²	36.1	25%	0.251	18%	0.181	S	C	.	.	H	α-helix	trans	-56.3	-53	177.6	173.3	-99.9	0	0	0	111	V146 N166 R167 Q189 D190 L195 E196 S197	V146-Y193 HydrophobicContact CG1-CD1 4.48Å; N166-Y193 PolarHBondContact O-OH 2.9Å; R167-Y193 HydrophobicContact CB-CD1 3.66Å; R167-Y193 HydrophobicContact CB-CE1 3.54Å; R167-Y193 HydrophobicContact CB-CG 4.24Å; R167-Y193 HydrophobicContact CG-CD1 3.83Å; R167-Y193 HydrophobicContact CG-CD2 4.16Å; R167-Y193 HydrophobicContact CG-CE1 4.05Å; R167-Y193 HydrophobicContact CG-CE2 4.37Å; R167-Y193 HydrophobicContact CG-CG 3.88Å; Q189-Y193 WeakPolarHBondContact O-CB 2.99Å; Q189-Y193 PolarHBondContact O-N 3.17Å; D190-Y193 PolarHBondContact O-N 3.49Å; Y193-L195 PolarHBondContact O-N 2.91Å; Y193-E196 PolarHBondContact O-N 3.46Å; Y193-S197 PolarHBondContact O-N 2.86Å; Y193-S197 PolarHBondContact O-OG 3.01Å
194	C	98.3	Very high	96	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-63	-43.1	-177.3	-62.5	0	0	0	0	112.7	T105 I107 C144 V146 D190 V192 E196 S197 S198 M209	T105-C194 HydrophobicContact CG2-CB 4.17Å; I107-C194 HydrophobicContact CD1-CB 4.25Å; I107-C194 HydrophobicContact CG1-CB 3.89Å; C144-C194 HydrophobicContact CB-CB 3.59Å; C144-C194 WeakPolarHBondContact CB-SG 3.42Å; C144-C194 WeakPolarHBondContact SG-CA 3.49Å; C144-C194 WeakPolarHBondContact SG-CB 3.47Å; C144-C194 CovalentContact SG-SG 2.03Å; C144-C194 PolarHBondContact SG-SG 3.05Å; V146-C194 WeakPolarHBondContact CG1-SG 3.5Å; D190-C194 PolarHBondContact O-N 2.89Å; D190-C194 PolarHBondContact O-SG 3.34Å; V192-C194 PolarHBondContact O-N 3.2Å; C194-E196 VanDerWaalsContact C-N 3.31Å; C194-E196 PolarHBondContact O-N 3.45Å; C194-S197 PolarHBondContact O-N 3.21Å; C194-S198 PolarHBondContact O-N 3.4Å; C194-S198 PolarHBondContact O-OG 3.02Å; C194-M209 HydrophobicContact CB-CE 3.76Å
195	L	98.2	Very high	96.1	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-64.1	-39	177.6	179.2	61.6	0	0	0	111.5	Y191 V192 Y193 L199 V207 M209 A344 T347 L348	Y191-L195 HydrophobicContact CE1-CD2 4.25Å; Y191-L195 WeakPolarHBondContact O-CB 3.37Å; Y191-L195 PolarHBondContact O-N 2.95Å; V192-L195 PolarHBondContact O-N 3.42Å; Y193-L195 PolarHBondContact O-N 2.91Å; L195-L199 WeakPolarHBondContact O-CG 3.4Å; L195-L199 PolarHBondContact O-N 3.38Å; L195-V207 HydrophobicContact CD1-CB 4.09Å; L195-V207 HydrophobicContact CD1-CG1 3.84Å; L195-V207 HydrophobicContact CD1-CG2 4.43Å; L195-M209 HydrophobicContact CB-CE 3.96Å; L195-M209 HydrophobicContact CB-SD 3.98Å; L195-M209 HydrophobicContact CD1-CG 3.92Å; L195-M209 HydrophobicContact CD1-SD 3.71Å; L195-M209 HydrophobicContact CG-SD 4.47Å; L195-A344 HydrophobicContact CD1-CB 3.89Å; L195-A344 HydrophobicContact CD2-CB 4.2Å; L195-A344 HydrophobicContact CG-CB 4.28Å; L195-T347 HydrophobicContact CD2-CG2 4.35Å; L195-L348 HydrophobicContact CB-CD2 3.96Å; L195-L348 HydrophobicContact CD2-CD2 3.9Å; L195-L348 HydrophobicContact CD2-CG 3.91Å; L195-L348 HydrophobicContact CG-CD1 4.37Å; L195-L348 HydrophobicContact CG-CD2 3.99Å; L195-L348 HydrophobicContact CG-CG 4.11Å
196	E	97.9	Very high	96.3	Very high	83 Å²	83	38.2 Å²	38.2	39%	0.388	19%	0.188	S	C	.	.	H	α-helix	trans	-65.9	-48	174.9	179.8	165	-135.1	0	0	111.9	V192 Y193 C194 S198 L199 Q200 L348	V192-E196 VanDerWaalsContact O-CB 3.3Å; V192-E196 WeakPolarHBondContact O-CB 3.44Å; V192-E196 PolarHBondContact O-N 2.97Å; Y193-E196 PolarHBondContact O-N 3.46Å; C194-E196 VanDerWaalsContact C-N 3.31Å; C194-E196 PolarHBondContact O-N 3.45Å; E196-S198 VanDerWaalsContact C-N 3.27Å; E196-S198 PolarHBondContact O-N 3.39Å; E196-L199 PolarHBondContact O-N 2.92Å; E196-L199 VanDerWaalsContact O-N 3.13Å; E196-Q200 VanDerWaalsContact CD-NE2 3.3Å; E196-Q200 HydrophobicContact CG-CG 4.09Å; E196-Q200 WeakPolarHBondContact O-CB 2.8Å; E196-Q200 WeakPolarHBondContact O-CG 3.33Å; E196-Q200 PolarHBondContact O-N 3.21Å; E196-Q200 PolarHBondContact OE1-NE2 3.43Å; E196-L348 HydrophobicContact CB-CD1 3.98Å; E196-L348 HydrophobicContact CB-CD2 4.15Å
197	S	96.8	Very high	96.5	Very high	13 Å²	13	37.5 Å²	37.5	9%	0.091	19%	0.185	C	C	.	.	H	α-helix	trans	-55.4	-42.8	176.9	-59.8	0	0	0	0	111.6	Y193 C194 L199 Q200 T201	Y193-S197 PolarHBondContact O-N 2.86Å; Y193-S197 PolarHBondContact O-OG 3.01Å; C194-S197 PolarHBondContact O-N 3.21Å; S197-L199 PolarHBondContact O-N 3.38Å; S197-Q200 PolarHBondContact O-N 2.98Å; S197-T201 WeakPolarHBondContact O-CB 3.33Å; S197-T201 PolarHBondContact O-N 3.26Å; S197-T201 PolarHBondContact O-OG1 3.43Å
198	S	96.7	Very high	96.7	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-63.8	-43	178.2	-58.5	0	0	0	0	112.5	T105 F142 C194 E196 Y202	T105-S198 WeakPolarHBondContact CG2-OG 3.31Å; T105-S198 WeakPolarHBondContact OG1-CB 3.37Å; T105-S198 PolarHBondContact OG1-OG 3.07Å; F142-S198 VanDerWaalsContact CD1-OG 3.22Å; F142-S198 WeakPolarHBondContact CD1-OG 3.13Å; F142-S198 WeakPolarHBondContact CE1-OG 3.48Å; C194-S198 PolarHBondContact O-N 3.4Å; C194-S198 PolarHBondContact O-OG 3.02Å; E196-S198 VanDerWaalsContact C-N 3.27Å; E196-S198 PolarHBondContact O-N 3.39Å; S198-Y202 PolarHBondContact O-N 3.12Å
199	L	97.1	Very high	96.9	Very high	13 Å²	13	35.4 Å²	35.4	7%	0.068	18%	0.176	C	C	.	.	H	α-helix	trans	-67.3	-43.1	178.6	-71.8	173.4	0	0	0	112.2	L195 E196 S197 N203 V207 A341 A344 R345 L348	L195-L199 WeakPolarHBondContact O-CG 3.4Å; L195-L199 PolarHBondContact O-N 3.38Å; E196-L199 PolarHBondContact O-N 2.92Å; E196-L199 VanDerWaalsContact O-N 3.13Å; S197-L199 PolarHBondContact O-N 3.38Å; L199-N203 VanDerWaalsContact O-CA 3.3Å; L199-N203 WeakPolarHBondContact O-CA 3.16Å; L199-N203 PolarHBondContact O-N 3.03Å; L199-V207 HydrophobicContact CD2-CG2 3.84Å; L199-V207 HydrophobicContact CG-CG2 4.37Å; L199-A341 HydrophobicContact CD2-CB 3.87Å; L199-A344 HydrophobicContact CD1-CB 3.83Å; L199-A344 HydrophobicContact CD2-CB 4.18Å; L199-A344 HydrophobicContact CG-CB 4.41Å; L199-R345 HydrophobicContact CD1-CG 3.93Å; L199-L348 HydrophobicContact CD1-CD1 3.62Å
200	Q	95.3	Very high	97	Very high	140 Å²	140	31.9 Å²	31.9	65%	0.654	16%	0.159	S	C	*	.	H	α-helix	trans	-70.7	-39.9	-178.2	-69.4	-178.4	2.9	0	0	111.9	E196 S197	E196-Q200 VanDerWaalsContact CD-NE2 3.3Å; E196-Q200 HydrophobicContact CG-CG 4.09Å; E196-Q200 WeakPolarHBondContact O-CB 2.8Å; E196-Q200 WeakPolarHBondContact O-CG 3.33Å; E196-Q200 PolarHBondContact O-N 3.21Å; E196-Q200 PolarHBondContact OE1-NE2 3.43Å; S197-Q200 PolarHBondContact O-N 2.98Å
201	T	94.1	Very high	97	Very high	87 Å²	87	32.9 Å²	32.9	53%	0.534	16%	0.164	S	C	.	.	H	α-helix	trans	-74.3	-40.7	-175.5	-54.2	0	0	0	0	112.1	S197	S197-T201 WeakPolarHBondContact O-CB 3.33Å; S197-T201 PolarHBondContact O-N 3.26Å; S197-T201 PolarHBondContact O-OG1 3.43Å
202	Y	94.9	Very high	97	Very high	23 Å²	23	33.1 Å²	33.1	9%	0.09	17%	0.165	C	C	.	.	H	α-helix	trans	-115.1	-22.1	-168.6	-62.4	-71.7	0	0	0	114.5	R99 P100 V103 Q140 F142 P163 S198	R99-Y202 WeakPolarHBondContact CA-O 3.46Å; P100-Y202 HydrophobicContact CG-CD1 4.23Å; P100-Y202 HydrophobicContact CG-CG 4.21Å; V103-Y202 HydrophobicContact CG1-CD2 4.05Å; V103-Y202 HydrophobicContact CG1-CE2 4.43Å; V103-Y202 HydrophobicContact CG2-CD2 3.97Å; V103-Y202 HydrophobicContact CG2-CG 3.9Å; Q140-Y202 HydrophobicContact CG-CD1 4.01Å; Q140-Y202 HydrophobicContact CG-CE1 3.61Å; Q140-Y202 HydrophobicContact CG-CE2 4.36Å; F142-Y202 HydrophobicContact CB-CE2 4.02Å; F142-Y202 HydrophobicContact CD1-CE2 4.28Å; F142-Y202 AromaticContact CD2-CE2 3.88Å; F142-Y202 HydrophobicContact CD2-CE2 3.88Å; F142-Y202 HydrophobicContact CE2-CE2 4.36Å; F142-Y202 AromaticContact CG-CE2 3.81Å; F142-Y202 HydrophobicContact CG-CE2 3.81Å; P163-Y202 VanDerWaalsContact CB-OH 3.28Å; P163-Y202 WeakPolarHBondContact CB-OH 3.19Å; S198-Y202 PolarHBondContact O-N 3.12Å
203	N	95.1	Very high	96.9	Very high	62 Å²	62	32.3 Å²	32.3	33%	0.332	16%	0.16	S	C	.	.			trans	43.3	60.7	-170.1	-176	75.4	0	0	0	112.8	R99 L199 R345	R99-N203 PolarHBondContact NE-ND2 2.81Å; L199-N203 VanDerWaalsContact O-CA 3.3Å; L199-N203 WeakPolarHBondContact O-CA 3.16Å; L199-N203 PolarHBondContact O-N 3.03Å; N203-R345 PolarHBondContact OD1-NH2 3.38Å
204	P	96.8	Very high	96.9	Very high	4 Å²	4	29.3 Å²	29.3	3%	0.026	15%	0.148	C	C	.	.			trans	-82.2	171.8	-175.2	35.7	-36.7	0	0	0	113.3	P100 V103 V207 A341	P100-P204 HydrophobicContact CG-CB 4.27Å; P100-P204 WeakPolarHBondContact O-CA 3.34Å; P100-P204 WeakPolarHBondContact O-CB 3.43Å; V103-P204 HydrophobicContact CB-CB 4.35Å; V103-P204 HydrophobicContact CB-CG 4.22Å; V103-P204 HydrophobicContact CG2-CB 3.59Å; V103-P204 HydrophobicContact CG2-CG 3.74Å; P204-V207 HydrophobicContact CG-CG2 3.58Å; P204-A341 WeakPolarHBondContact O-CB 3.35Å
205	D	95.6	Very high	96.8	Very high	99 Å²	99	30.4 Å²	30.4	53%	0.529	16%	0.155	S	C	.	.	S	Bend	trans	-78.2	-39.7	168.7	-72.4	-10.2	0	0	0	111.2	P100 W101 A341	P100-D205 PolarHBondContact O-N 2.97Å; W101-D205 WeakPolarHBondContact O-CB 3.33Å; W101-D205 PolarHBondContact O-N 2.85Å; D205-A341 PolarHBondContact O-N 2.81Å
206	Y	97.4	Very high	96.8	Very high	48 Å²	48	30.6 Å²	30.6	19%	0.188	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132	145	179.7	-60.1	-83.1	0	0	0	112.1	W101 L102 V103 L228 L338 F339 P340	W101-Y206 HydrophobicContact CD2-CD2 4.44Å; W101-Y206 AromaticContact CE2-CD2 3.83Å; W101-Y206 AromaticContact CE2-CE2 3.83Å; W101-Y206 HydrophobicContact CZ2-CD2 4.18Å; W101-Y206 HydrophobicContact CZ2-CE2 4.05Å; W101-Y206 AromaticContact NE1-CD2 3.64Å; W101-Y206 AromaticContact NE1-CE2 3.41Å; W101-Y206 PolarHBondContact O-N 3.3Å; L102-Y206 WeakPolarHBondContact CA-O 3.33Å; V103-Y206 PolarHBondContact N-O 3.07Å; Y206-L228 HydrophobicContact CD1-CD1 4.32Å; Y206-L228 HydrophobicContact CD1-CD2 4.19Å; Y206-L228 HydrophobicContact CD2-CD1 4.33Å; Y206-L228 HydrophobicContact CE1-CD1 4.39Å; Y206-L228 HydrophobicContact CE1-CD2 3.76Å; Y206-L228 HydrophobicContact CE2-CD1 4.4Å; Y206-L228 HydrophobicContact CG-CD1 4.29Å; Y206-L338 HydrophobicContact CD1-CD2 4.49Å; Y206-F339 CarbonylContact C-O 3.47Å; Y206-F339 WeakPolarHBondContact CA-O 3.22Å; Y206-P340 HydrophobicContact CD1-CB 4.34Å; Y206-P340 HydrophobicContact CD1-CG 4.38Å; Y206-P340 HydrophobicContact CE1-CB 4.2Å; Y206-P340 HydrophobicContact CE1-CG 4.15Å
207	V	98.2	Very high	96.8	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	118.8	171.4	-173	0	0	0	0	108.7	V103 L195 L199 P204 M209 L338 F339	V103-V207 CarbonylContact O-C 3.53Å; V103-V207 WeakPolarHBondContact O-CA 3.48Å; L195-V207 HydrophobicContact CD1-CB 4.09Å; L195-V207 HydrophobicContact CD1-CG1 3.84Å; L195-V207 HydrophobicContact CD1-CG2 4.43Å; L199-V207 HydrophobicContact CD2-CG2 3.84Å; L199-V207 HydrophobicContact CG-CG2 4.37Å; P204-V207 HydrophobicContact CG-CG2 3.58Å; V207-M209 HydrophobicContact CG1-CG 4.12Å; V207-M209 HydrophobicContact CG1-SD 3.6Å; V207-M209 VanDerWaalsContact CG1-SD 3.6Å; V207-L338 CarbonylContact O-C 3.54Å; V207-L338 WeakPolarHBondContact O-CA 3.14Å; V207-F339 PolarHBondContact N-O 3.28Å; V207-F339 PolarHBondContact O-N 3.48Å
208	L	98.6	Very high	96.8	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95	105.4	168.7	173.8	56.2	0	0	0	108.7	L102 V103 I104 T105 F125 V210 I220 L224 L245 A336 L338	L102-L208 HydrophobicContact CD1-CB 3.93Å; V103-L208 PolarHBondContact O-N 3.33Å; I104-L208 CarbonylContact C-O 3.58Å; I104-L208 WeakPolarHBondContact CA-O 3.44Å; I104-L208 HydrophobicContact CG1-CD2 4.38Å; I104-L208 HydrophobicContact CG2-CD2 4.28Å; I104-L208 HydrophobicContact CG2-CG 4.49Å; T105-L208 PolarHBondContact N-O 3.25Å; F125-L208 HydrophobicContact CE1-CD2 4.39Å; F125-L208 HydrophobicContact CZ-CD2 4.3Å; L208-V210 HydrophobicContact CD1-CG2 4.05Å; L208-V210 HydrophobicContact CD2-CG2 4.09Å; L208-V210 HydrophobicContact CG-CG2 3.61Å; L208-I220 HydrophobicContact CD2-CD1 4.36Å; L208-L224 HydrophobicContact CD2-CD1 4.25Å; L208-L245 HydrophobicContact CD1-CD1 3.55Å; L208-L245 HydrophobicContact CD1-CG 4.34Å; L208-L245 HydrophobicContact CD2-CD1 4.27Å; L208-A336 HydrophobicContact CD1-CB 4.48Å; L208-L338 HydrophobicContact CB-CD1 3.82Å; L208-L338 HydrophobicContact CD1-CB 4.27Å
209	M	98.5	Very high	96.7	Very high	1 Å²	1	34.1 Å²	34.1	1%	0.005	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	122.6	173.7	-60.8	-62.6	-63.5	0	0	108.9	T105 I107 Y191 C194 L195 V207 A336 M337 F339	T105-M209 HydrophobicContact CG2-CE 3.96Å; T105-M209 HydrophobicContact CG2-SD 3.88Å; I107-M209 HydrophobicContact CD1-CE 3.56Å; I107-M209 HydrophobicContact CG1-CE 3.92Å; Y191-M209 HydrophobicContact CD2-CE 4.48Å; Y191-M209 HydrophobicContact CE2-CB 3.93Å; Y191-M209 HydrophobicContact CE2-CE 4.23Å; Y191-M209 HydrophobicContact CE2-CG 4.34Å; Y191-M209 VanDerWaalsContact OH-CB 3.23Å; Y191-M209 WeakPolarHBondContact OH-CB 3.4Å; Y191-M209 WeakPolarHBondContact OH-CG 3.46Å; C194-M209 HydrophobicContact CB-CE 3.76Å; L195-M209 HydrophobicContact CB-CE 3.96Å; L195-M209 HydrophobicContact CB-SD 3.98Å; L195-M209 HydrophobicContact CD1-CG 3.92Å; L195-M209 HydrophobicContact CD1-SD 3.71Å; L195-M209 HydrophobicContact CG-SD 4.47Å; V207-M209 HydrophobicContact CG1-CG 4.12Å; V207-M209 HydrophobicContact CG1-SD 3.6Å; V207-M209 VanDerWaalsContact CG1-SD 3.6Å; M209-A336 CarbonylContact O-C 3.6Å; M209-A336 VanDerWaalsContact O-CA 3.3Å; M209-A336 WeakPolarHBondContact O-CA 3.06Å; M209-M337 PolarHBondContact N-O 3.42Å; M209-M337 PolarHBondContact O-N 3.46Å; M209-F339 HydrophobicContact CG-CD2 4.19Å; M209-F339 HydrophobicContact CG-CE2 4.19Å
210	V	98.5	Very high	96.7	Very high	1 Å²	1	33.5 Å²	33.5	1%	0.006	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	138.1	-177.8	-165.2	0	0	0	0	109.3	I104 T105 I106 I107 V121 F125 L208 A214 P335 A336	I104-V210 HydrophobicContact CG2-CG2 4.13Å; T105-V210 PolarHBondContact O-N 3Å; I106-V210 CarbonylContact C-O 3.56Å; I106-V210 WeakPolarHBondContact CA-O 3.48Å; I106-V210 HydrophobicContact CG1-CB 4.23Å; I107-V210 PolarHBondContact N-O 3.28Å; V121-V210 HydrophobicContact CG1-CG1 4.29Å; F125-V210 HydrophobicContact CE2-CG1 4.18Å; F125-V210 HydrophobicContact CE2-CG2 4.16Å; F125-V210 HydrophobicContact CZ-CG2 4.06Å; L208-V210 HydrophobicContact CD1-CG2 4.05Å; L208-V210 HydrophobicContact CD2-CG2 4.09Å; L208-V210 HydrophobicContact CG-CG2 3.61Å; V210-A214 HydrophobicContact CG1-CB 3.62Å; V210-A214 WeakPolarHBondContact CG1-O 3.33Å; V210-P335 CarbonylContact C-O 3.2Å; V210-P335 WeakPolarHBondContact CA-O 3.19Å; V210-A336 HydrophobicContact CG1-CB 4.4Å
211	E	97.2	Very high	96.7	Very high	29 Å²	29	27.2 Å²	27.2	14%	0.136	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	153.4	171.3	-66.4	174.7	-167.2	0	0	109.6	D213 A214 T334 P335 K362	E211-D213 PolarHBondContact O-N 3.49Å; E211-A214 PolarHBondContact O-N 3.45Å; E211-T334 PolarHBondContact OE1-OG1 3.2Å; E211-P335 HydrophobicContact CB-CB 4.42Å; E211-P335 PolarHBondContact N-O 3.28Å; E211-K362 WeakPolarHBondContact OE1-CE 3.36Å; E211-K362 IonicContact OE1-NZ 2.79Å; E211-K362 PolarHBondContact OE1-NZ 2.78Å
212	D	96.2	Very high	96.7	Very high	7 Å²	7	26 Å²	26	4%	0.037	13%	0.132	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.9	-9.3	-178.2	55.8	-18.7	0	0	0	114.7	I107 R111 Y117 V118 V121	I107-D212 WeakPolarHBondContact O-CB 3.44Å; I107-D212 PolarHBondContact O-N 2.87Å; R111-D212 WeakPolarHBondContact CD-OD2 3.39Å; R111-D212 IonicContact CZ-OD1 2.69Å; R111-D212 VanDerWaalsContact CZ-OD1 3.27Å; R111-D212 IonicContact CZ-OD2 3.35Å; R111-D212 VanDerWaalsContact NE-CG 3.33Å; R111-D212 IonicContact NE-OD1 3.93Å; R111-D212 PolarHBondContact NE-OD1 3.31Å; R111-D212 IonicContact NE-OD2 3.91Å; R111-D212 PolarHBondContact NE-OD2 3.44Å; R111-D212 IonicContact NH2-OD1 3.16Å; R111-D212 PolarHBondContact NH2-OD1 2.73Å; R111-D212 IonicContact NH2-OD2 3.91Å; Y117-D212 CarbonylContact C-O 3.57Å; Y117-D212 VanDerWaalsContact CB-O 3.29Å; Y117-D212 WeakPolarHBondContact CB-O 3.45Å; Y117-D212 VanDerWaalsContact O-O 3.11Å; V118-D212 HydrophobicContact CB-CB 3.98Å; V118-D212 HydrophobicContact CG2-CB 4.35Å; V118-D212 PolarHBondContact N-O 2.98Å; V121-D212 WeakPolarHBondContact CG2-O 3.37Å
213	D	95.6	Very high	96.8	Very high	5 Å²	5	25 Å²	25	3%	0.027	13%	0.128	C	C	.	.	T	Hydrogen-bonded Turn	trans	-115	18.7	176.6	61.4	10	0	0	0	114.1	R111 E211 H387 I388	R111-D213 IonicContact CZ-OD2 3Å; R111-D213 IonicContact NH1-OD2 2.69Å; R111-D213 PolarHBondContact NH1-OD2 2.77Å; R111-D213 VanDerWaalsContact NH2-CG 3.32Å; R111-D213 IonicContact NH2-OD1 2.72Å; R111-D213 IonicContact NH2-OD2 3.5Å; R111-D213 PolarHBondContact NH2-OD2 2.95Å; E211-D213 PolarHBondContact O-N 3.49Å; D213-H387 CarbonylContact O-C 3.6Å; D213-H387 WeakPolarHBondContact O-CA 3.47Å; D213-H387 IonicContact OD1-CD2 2.67Å; D213-H387 IonicContact OD1-NE2 2.74Å; D213-H387 IonicContact OD2-NE2 3.5Å; D213-H387 PolarHBondContact OD2-NE2 3.16Å; D213-I388 HydrophobicContact CB-CG1 4.26Å; D213-I388 WeakPolarHBondContact O-CG1 3.48Å; D213-I388 PolarHBondContact O-N 3.18Å
214	A	97.2	Very high	96.8	Very high	0 Å²	0	22 Å²	22	0%	0	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	93.5	174.5	0	0	0	0	0	112.7	V121 V210 E211 P335 V385 K386	V121-A214 WeakPolarHBondContact CG1-O 3.35Å; V210-A214 HydrophobicContact CG1-CB 3.62Å; V210-A214 WeakPolarHBondContact CG1-O 3.33Å; E211-A214 PolarHBondContact O-N 3.45Å; A214-P335 HydrophobicContact CB-CB 3.93Å; A214-P335 WeakPolarHBondContact CB-O 3.4Å; A214-V385 HydrophobicContact CB-CB 4.16Å; A214-V385 HydrophobicContact CB-CG2 3.99Å; A214-K386 CarbonylContact C-O 3.45Å; A214-K386 WeakPolarHBondContact CA-O 3.4Å
215	V	98	Very high	96.7	Very high	23 Å²	23	24.1 Å²	24.1	14%	0.139	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	128	179.1	176.9	0	0	0	0	110.4	Q120 V121 Q124 V385 K386 I388	Q120-V215 HydrophobicContact CB-CG2 4.28Å; V121-V215 HydrophobicContact CG2-CG2 3.83Å; Q124-V215 HydrophobicContact CB-CG1 3.97Å; Q124-V215 HydrophobicContact CG-CG1 3.85Å; V215-V385 CarbonylContact O-C 3.03Å; V215-V385 WeakPolarHBondContact O-CA 3.49Å; V215-V385 WeakPolarHBondContact O-CB 3.16Å; V215-K386 PolarHBondContact N-O 3.38Å; V215-K386 PolarHBondContact O-N 3.21Å; V215-I388 HydrophobicContact CG2-CD1 3.47Å; V215-I388 VanDerWaalsContact CG2-CD1 3.47Å; V215-I388 HydrophobicContact CG2-CG1 3.97Å; V215-I388 HydrophobicContact CG2-CG2 4.1Å
216	P	98.2	Very high	96.6	Very high	4 Å²	4	22.2 Å²	22.2	3%	0.026	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	145.1	179.5	29.9	-36.6	0	0	0	113.4	Q124 F125 L128 I220	Q124-P216 HydrophobicContact CB-CG 4.1Å; Q124-P216 HydrophobicContact CG-CG 3.73Å; F125-P216 HydrophobicContact CD1-CB 4.21Å; F125-P216 HydrophobicContact CD1-CG 3.77Å; F125-P216 HydrophobicContact CD2-CG 3.73Å; F125-P216 HydrophobicContact CE1-CB 3.72Å; F125-P216 HydrophobicContact CE1-CG 3.74Å; F125-P216 HydrophobicContact CE2-CB 4.15Å; F125-P216 HydrophobicContact CE2-CG 3.69Å; F125-P216 HydrophobicContact CG-CG 3.77Å; F125-P216 HydrophobicContact CZ-CB 3.68Å; F125-P216 HydrophobicContact CZ-CG 3.69Å; L128-P216 HydrophobicContact CD1-CB 4.06Å; L128-P216 HydrophobicContact CD1-CG 3.92Å; P216-I220 HydrophobicContact CB-CB 4.29Å; P216-I220 HydrophobicContact CB-CD1 3.65Å; P216-I220 HydrophobicContact CB-CG2 4.01Å
217	E	97.1	Very high	96.5	Very high	22 Å²	22	19.9 Å²	19.9	10%	0.103	10%	0.1	C	C	.	.	P	Polyproline II helix	trans	-72.9	153.6	168.4	-64.8	-80.1	-160.1	0	0	111.1	Q219 I220 R318 L384 K386	E217-Q219 PolarHBondContact O-N 2.89Å; E217-Q219 VanDerWaalsContact O-N 3.07Å; E217-I220 WeakPolarHBondContact O-CB 3.42Å; E217-I220 WeakPolarHBondContact O-CG2 3.49Å; E217-I220 PolarHBondContact O-N 3.33Å; E217-R318 IonicContact OE1-CZ 3.18Å; E217-R318 IonicContact OE1-NH1 3.55Å; E217-R318 IonicContact OE1-NH2 3.36Å; E217-R318 PolarHBondContact OE1-NH2 2.91Å; E217-L384 PolarHBondContact N-O 2.85Å; E217-K386 WeakPolarHBondContact OE1-CE 3.45Å; E217-K386 IonicContact OE1-NZ 3.88Å; E217-K386 WeakPolarHBondContact OE2-CE 3.47Å; E217-K386 IonicContact OE2-NZ 3.23Å; E217-K386 PolarHBondContact OE2-NZ 3.44Å
218	E	95.6	Very high	96.3	Very high	107 Å²	107	20.5 Å²	20.5	50%	0.5	10%	0.103	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.9	-34.2	-176.4	-61.4	-66.2	148.9	0	0	113.5	Q124 L128	Q124-E218 PolarHBondContact NE2-OE1 3.26Å; L128-E218 WeakPolarHBondContact CD2-OE2 3.38Å
219	Q	94.6	Very high	96	Very high	41 Å²	41	27.8 Å²	27.8	19%	0.192	13%	0.131	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.4	10.2	-176.8	67.1	-86.1	24.8	0	0	114.4	E217 F221 P222 V223 R318 Y324 L384	E217-Q219 PolarHBondContact O-N 2.89Å; E217-Q219 VanDerWaalsContact O-N 3.07Å; Q219-F221 VanDerWaalsContact C-N 3.35Å; Q219-F221 PolarHBondContact O-N 3.19Å; Q219-P222 HydrophobicContact CB-CG 4.29Å; Q219-P222 VanDerWaalsContact O-CD 3.27Å; Q219-P222 WeakPolarHBondContact O-CD 3.3Å; Q219-P222 WeakPolarHBondContact O-CG 3.44Å; Q219-V223 HydrophobicContact CB-CG2 4.12Å; Q219-V223 HydrophobicContact CG-CG2 3.86Å; Q219-V223 WeakPolarHBondContact O-CB 3.38Å; Q219-V223 WeakPolarHBondContact O-CG2 3.42Å; Q219-V223 PolarHBondContact O-N 3.18Å; Q219-V223 VanDerWaalsContact O-N 3.12Å; Q219-R318 VanDerWaalsContact NE2-CD 3.31Å; Q219-Y324 VanDerWaalsContact CG-OH 3.3Å; Q219-Y324 WeakPolarHBondContact CG-OH 3.38Å; Q219-Y324 PolarHBondContact NE2-OH 3.35Å; Q219-L384 HydrophobicContact CG-CD2 4.43Å
220	I	97.2	Very high	95.7	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-53.1	-48.9	-173.8	-168.8	165.6	0	0	0	112.6	F125 L128 L208 P216 E217 L224 L245 L384 V385	F125-I220 HydrophobicContact CE1-CD1 3.97Å; F125-I220 HydrophobicContact CZ-CD1 4.14Å; L128-I220 HydrophobicContact CD1-CG2 3.89Å; L208-I220 HydrophobicContact CD2-CD1 4.36Å; P216-I220 HydrophobicContact CB-CB 4.29Å; P216-I220 HydrophobicContact CB-CD1 3.65Å; P216-I220 HydrophobicContact CB-CG2 4.01Å; E217-I220 WeakPolarHBondContact O-CB 3.42Å; E217-I220 WeakPolarHBondContact O-CG2 3.49Å; E217-I220 PolarHBondContact O-N 3.33Å; I220-L224 HydrophobicContact CD1-CD1 4.48Å; I220-L224 HydrophobicContact CG1-CD1 3.85Å; I220-L224 HydrophobicContact CG1-CG 4.24Å; I220-L224 WeakPolarHBondContact O-CB 3.25Å; I220-L224 VanDerWaalsContact O-CG 3.23Å; I220-L224 WeakPolarHBondContact O-CG 3.32Å; I220-L224 PolarHBondContact O-N 3.44Å; I220-L245 HydrophobicContact CD1-CD1 4.34Å; I220-L384 HydrophobicContact CG1-CB 4.23Å; I220-V385 HydrophobicContact CD1-CG1 4.2Å
221	F	95.9	Very high	95.2	Very high	9 Å²	9	33.2 Å²	33.2	4%	0.039	16%	0.161	C	C	.	.	H	α-helix	trans	-67.9	-52.7	-176.8	-62.9	-52.4	0	0	0	114.2	I104 F125 L128 L129 C132 H139 Q219 V223 L224 E225	I104-F221 HydrophobicContact CD1-CE1 3.71Å; I104-F221 HydrophobicContact CD1-CZ 3.76Å; F125-F221 AromaticContact CD1-CZ 3.93Å; F125-F221 HydrophobicContact CD1-CZ 3.93Å; F125-F221 HydrophobicContact CE1-CZ 4.35Å; L128-F221 HydrophobicContact CB-CD2 3.99Å; L128-F221 HydrophobicContact CB-CE2 3.56Å; L129-F221 HydrophobicContact CD2-CE1 4.1Å; L129-F221 HydrophobicContact CD2-CE2 3.69Å; L129-F221 HydrophobicContact CD2-CZ 3.42Å; L129-F221 VanDerWaalsContact CD2-CZ 3.42Å; L129-F221 HydrophobicContact CG-CE2 3.83Å; L129-F221 HydrophobicContact CG-CZ 3.72Å; C132-F221 HydrophobicContact CB-CD2 4.46Å; H139-F221 AromaticContact CD2-CD1 3.69Å; H139-F221 AromaticContact CD2-CE1 3.6Å; H139-F221 AromaticContact NE2-CD1 3.71Å; Q219-F221 VanDerWaalsContact C-N 3.35Å; Q219-F221 PolarHBondContact O-N 3.19Å; F221-V223 PolarHBondContact O-N 3.08Å; F221-L224 PolarHBondContact O-N 2.77Å; F221-E225 WeakPolarHBondContact O-CB 3.28Å; F221-E225 PolarHBondContact O-N 2.94Å
222	P	94.5	Very high	94.9	Very high	61 Å²	61	32.7 Å²	32.7	40%	0.396	16%	0.158	S	C	.	.	H	α-helix	trans	-61.5	-31.8	178.3	21.6	-32.5	0	0	0	112.5	Q219 H226 P321	Q219-P222 HydrophobicContact CB-CG 4.29Å; Q219-P222 VanDerWaalsContact O-CD 3.27Å; Q219-P222 WeakPolarHBondContact O-CD 3.3Å; Q219-P222 WeakPolarHBondContact O-CG 3.44Å; P222-H226 WeakPolarHBondContact O-CB 3.44Å; P222-H226 PolarHBondContact O-N 3.38Å; P222-H226 VanDerWaalsContact O-N 3.12Å; P222-P321 HydrophobicContact CB-CG 4.46Å
223	V	96	Very high	94.5	Very high	1 Å²	1	35.8 Å²	35.8	1%	0.006	18%	0.18	C	C	.	.	H	α-helix	trans	-71.2	-48.2	174.7	-179.3	0	0	0	0	111.4	Q219 F221 E225 H226 L227 P321 Y324 L384	Q219-V223 HydrophobicContact CB-CG2 4.12Å; Q219-V223 HydrophobicContact CG-CG2 3.86Å; Q219-V223 WeakPolarHBondContact O-CB 3.38Å; Q219-V223 WeakPolarHBondContact O-CG2 3.42Å; Q219-V223 PolarHBondContact O-N 3.18Å; Q219-V223 VanDerWaalsContact O-N 3.12Å; F221-V223 PolarHBondContact O-N 3.08Å; V223-E225 VanDerWaalsContact C-N 3.33Å; V223-E225 PolarHBondContact O-N 3.12Å; V223-H226 PolarHBondContact O-N 2.84Å; V223-L227 HydrophobicContact CG1-CD1 3.87Å; V223-L227 HydrophobicContact CG1-CG 4.15Å; V223-L227 WeakPolarHBondContact O-CB 3.32Å; V223-L227 VanDerWaalsContact O-CG 3.28Å; V223-L227 WeakPolarHBondContact O-CG 3.13Å; V223-L227 PolarHBondContact O-N 3.1Å; V223-P321 HydrophobicContact CG2-CB 4.19Å; V223-P321 HydrophobicContact CG2-CG 4.22Å; V223-Y324 HydrophobicContact CG1-CD1 3.9Å; V223-Y324 HydrophobicContact CG1-CD2 3.96Å; V223-Y324 HydrophobicContact CG1-CE1 4.16Å; V223-Y324 HydrophobicContact CG1-CE2 4.24Å; V223-Y324 HydrophobicContact CG1-CG 3.76Å; V223-Y324 HydrophobicContact CG2-CD2 3.95Å; V223-Y324 HydrophobicContact CG2-CE1 4.43Å; V223-Y324 HydrophobicContact CG2-CE2 3.54Å; V223-L384 HydrophobicContact CB-CD1 4.07Å; V223-L384 HydrophobicContact CB-CD2 4.01Å; V223-L384 HydrophobicContact CG1-CD1 3.76Å; V223-L384 HydrophobicContact CG1-CD2 3.99Å; V223-L384 HydrophobicContact CG1-CG 4.43Å; V223-L384 HydrophobicContact CG2-CD2 4.13Å
224	L	96	Very high	94.2	Very high	1 Å²	1	38.5 Å²	38.5	1%	0.005	19%	0.193	C	C	.	.	H	α-helix	trans	-60.2	-43.5	177.8	-74.7	-179.2	0	0	0	111.7	L102 L208 I220 F221 H226 L227 L228 L245 L338 L384	L102-L224 HydrophobicContact CD2-CD1 4.38Å; L208-L224 HydrophobicContact CD2-CD1 4.25Å; I220-L224 HydrophobicContact CD1-CD1 4.48Å; I220-L224 HydrophobicContact CG1-CD1 3.85Å; I220-L224 HydrophobicContact CG1-CG 4.24Å; I220-L224 WeakPolarHBondContact O-CB 3.25Å; I220-L224 VanDerWaalsContact O-CG 3.23Å; I220-L224 WeakPolarHBondContact O-CG 3.32Å; I220-L224 PolarHBondContact O-N 3.44Å; F221-L224 PolarHBondContact O-N 2.77Å; L224-H226 PolarHBondContact O-N 3.44Å; L224-L227 PolarHBondContact O-N 3.45Å; L224-L228 WeakPolarHBondContact O-CB 3.23Å; L224-L228 WeakPolarHBondContact O-CG 3.47Å; L224-L228 PolarHBondContact O-N 3.47Å; L224-L245 HydrophobicContact CD1-CD1 4.32Å; L224-L245 HydrophobicContact CD2-CD1 4.09Å; L224-L245 HydrophobicContact CD2-CD2 3.87Å; L224-L338 HydrophobicContact CD2-CD2 4.36Å; L224-L384 HydrophobicContact CD2-CD1 4.08Å; L224-L384 HydrophobicContact CG-CD1 4.24Å
225	E	93.8	Very high	93.7	Very high	47 Å²	47	43.9 Å²	43.9	22%	0.22	23%	0.228	C	C	.	.	H	α-helix	trans	-60	-47.6	176.8	-172.8	179.7	177.8	0	0	111.4	F221 V223 L228 R229	F221-E225 WeakPolarHBondContact O-CB 3.28Å; F221-E225 PolarHBondContact O-N 2.94Å; V223-E225 VanDerWaalsContact C-N 3.33Å; V223-E225 PolarHBondContact O-N 3.12Å; E225-L228 PolarHBondContact O-N 2.88Å; E225-R229 HydrophobicContact CG-CG 4.39Å; E225-R229 WeakPolarHBondContact O-CB 3.49Å; E225-R229 WeakPolarHBondContact O-CG 3.5Å; E225-R229 PolarHBondContact O-N 2.89Å; E225-R229 IonicContact OE1-CZ 3.48Å; E225-R229 IonicContact OE1-NE 3.88Å; E225-R229 IonicContact OE1-NH1 3.03Å; E225-R229 PolarHBondContact OE1-NH1 3.49Å; E225-R229 IonicContact OE1-NH2 2.76Å
226	H	94.7	Very high	93.2	Very high	59 Å²	59	47.4 Å²	47.4	27%	0.273	24%	0.242	S	C	.	.	H	α-helix	trans	-59.7	-48.9	176.6	-179.8	70.3	0	0	0	111.8	P222 V223 L224 A230 P321	P222-H226 WeakPolarHBondContact O-CB 3.44Å; P222-H226 PolarHBondContact O-N 3.38Å; P222-H226 VanDerWaalsContact O-N 3.12Å; V223-H226 PolarHBondContact O-N 2.84Å; L224-H226 PolarHBondContact O-N 3.44Å; H226-A230 WeakPolarHBondContact O-CA 3.4Å; H226-A230 WeakPolarHBondContact O-CB 3.31Å; H226-A230 PolarHBondContact O-N 3.3Å; H226-P321 HydrophobicContact CB-CB 3.79Å; H226-P321 PolarHBondContact CD2-O 3.17Å
227	L	95.8	Very high	92.7	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	24%	0.243	C	C	.	.	I	π-helix	trans	-60.8	-49.8	-179.7	-70.5	178.5	0	0	0	111	V223 L224 R231 F232 L243 V326 V380	V223-L227 HydrophobicContact CG1-CD1 3.87Å; V223-L227 HydrophobicContact CG1-CG 4.15Å; V223-L227 WeakPolarHBondContact O-CB 3.32Å; V223-L227 VanDerWaalsContact O-CG 3.28Å; V223-L227 WeakPolarHBondContact O-CG 3.13Å; V223-L227 PolarHBondContact O-N 3.1Å; L224-L227 PolarHBondContact O-N 3.45Å; L227-R231 HydrophobicContact CD2-CB 4.49Å; L227-R231 HydrophobicContact CD2-CG 4.16Å; L227-R231 CarbonylContact O-C 3.55Å; L227-R231 WeakPolarHBondContact O-CA 3.44Å; L227-R231 WeakPolarHBondContact O-CB 3.41Å; L227-R231 PolarHBondContact O-N 2.94Å; L227-F232 HydrophobicContact CB-CD2 4.42Å; L227-F232 WeakPolarHBondContact O-CD2 3.48Å; L227-F232 PolarHBondContact O-N 2.88Å; L227-L243 HydrophobicContact CD1-CD2 4.26Å; L227-V326 HydrophobicContact CD2-CG2 3.64Å; L227-V380 HydrophobicContact CD1-CB 4.41Å; L227-V380 HydrophobicContact CD1-CG1 3.94Å; L227-V380 HydrophobicContact CD1-CG2 3.51Å
228	L	94.1	Very high	92.2	Very high	12 Å²	12	54.7 Å²	54.7	6%	0.063	27%	0.269	C	S	.	.	I	π-helix	trans	-70.3	-39.8	-173.8	-64.2	170.6	0	0	0	112.8	W101 Y206 L224 E225 L338	W101-L228 HydrophobicContact CH2-CB 4.49Å; W101-L228 HydrophobicContact CH2-CD1 3.78Å; W101-L228 HydrophobicContact CZ2-CB 4.16Å; W101-L228 HydrophobicContact CZ2-CD1 3.87Å; Y206-L228 HydrophobicContact CD1-CD1 4.32Å; Y206-L228 HydrophobicContact CD1-CD2 4.19Å; Y206-L228 HydrophobicContact CD2-CD1 4.33Å; Y206-L228 HydrophobicContact CE1-CD1 4.39Å; Y206-L228 HydrophobicContact CE1-CD2 3.76Å; Y206-L228 HydrophobicContact CE2-CD1 4.4Å; Y206-L228 HydrophobicContact CG-CD1 4.29Å; L224-L228 WeakPolarHBondContact O-CB 3.23Å; L224-L228 WeakPolarHBondContact O-CG 3.47Å; L224-L228 PolarHBondContact O-N 3.47Å; E225-L228 PolarHBondContact O-N 2.88Å; L228-L338 HydrophobicContact CD1-CD2 3.77Å; L228-L338 HydrophobicContact CD2-CD2 3.52Å; L228-L338 HydrophobicContact CG-CD2 4.08Å
229	R	91.8	Very high	92	Very high	153 Å²	153	54.7 Å²	54.7	58%	0.577	27%	0.272	S	S	*	.	I	π-helix	trans	-81.7	-42.6	-179.3	-64.5	-176.3	176.4	-176.6	-4.7	112.6	E225 S233	E225-R229 HydrophobicContact CG-CG 4.39Å; E225-R229 WeakPolarHBondContact O-CB 3.49Å; E225-R229 WeakPolarHBondContact O-CG 3.5Å; E225-R229 PolarHBondContact O-N 2.89Å; E225-R229 IonicContact OE1-CZ 3.48Å; E225-R229 IonicContact OE1-NE 3.88Å; E225-R229 IonicContact OE1-NH1 3.03Å; E225-R229 PolarHBondContact OE1-NH1 3.49Å; E225-R229 IonicContact OE1-NH2 2.76Å; R229-S233 WeakPolarHBondContact O-CB 3.5Å; R229-S233 PolarHBondContact O-OG 3.18Å
230	A	91.4	Very high	92	Very high	43 Å²	43	52.9 Å²	52.9	36%	0.355	26%	0.264	S	S	.	.	I	π-helix	trans	-93.6	-41.2	-172.1	0	0	0	0	0	113.3	H226 S233	H226-A230 WeakPolarHBondContact O-CA 3.4Å; H226-A230 WeakPolarHBondContact O-CB 3.31Å; H226-A230 PolarHBondContact O-N 3.3Å; A230-S233 PolarHBondContact O-OG 2.9Å
231	R	89.2	Confident	91.9	Very high	74 Å²	74	52.9 Å²	52.9	28%	0.279	26%	0.264	S	S	.	.	I	π-helix	trans	-96.2	-46.6	-172.7	-59	-64.4	-66.4	-81.9	-4.4	112.6	L227 S233 E234 L237	L227-R231 HydrophobicContact CD2-CB 4.49Å; L227-R231 HydrophobicContact CD2-CG 4.16Å; L227-R231 CarbonylContact O-C 3.55Å; L227-R231 WeakPolarHBondContact O-CA 3.44Å; L227-R231 WeakPolarHBondContact O-CB 3.41Å; L227-R231 PolarHBondContact O-N 2.94Å; R231-S233 PolarHBondContact O-N 2.81Å; R231-E234 IonicContact NE-OE1 3.65Å; R231-E234 PolarHBondContact NE-OE1 3.36Å; R231-E234 WeakPolarHBondContact O-CB 3.4Å; R231-E234 VanDerWaalsContact O-CG 3.28Å; R231-E234 WeakPolarHBondContact O-CG 3.26Å; R231-E234 PolarHBondContact O-N 3.24Å; R231-L237 HydrophobicContact CB-CD1 4.2Å
232	F	90.9	Very high	92	Very high	18 Å²	18	52.5 Å²	52.5	8%	0.079	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.6	-0.9	178.7	-77.9	-99.3	0	0	0	113.6	L227 E234 L237 R238 A240 L243 V326 Y378	L227-F232 HydrophobicContact CB-CD2 4.42Å; L227-F232 WeakPolarHBondContact O-CD2 3.48Å; L227-F232 PolarHBondContact O-N 2.88Å; F232-E234 VanDerWaalsContact C-N 3.27Å; F232-L237 HydrophobicContact CD1-CB 3.95Å; F232-L237 VanDerWaalsContact CD1-O 3.25Å; F232-L237 WeakPolarHBondContact CD1-O 3.26Å; F232-L237 HydrophobicContact CE1-CB 4.2Å; F232-L237 HydrophobicContact CG-CB 4.23Å; F232-R238 WeakPolarHBondContact O-CA 3.47Å; F232-R238 WeakPolarHBondContact O-CB 3.46Å; F232-A240 HydrophobicContact CD1-CB 4.26Å; F232-A240 HydrophobicContact CE1-CB 3.67Å; F232-L243 HydrophobicContact CE2-CD1 4.25Å; F232-L243 HydrophobicContact CE2-CD2 3.9Å; F232-L243 HydrophobicContact CZ-CB 4.44Å; F232-L243 HydrophobicContact CZ-CD1 3.83Å; F232-L243 HydrophobicContact CZ-CD2 4.08Å; F232-L243 HydrophobicContact CZ-CG 4.35Å; F232-V326 HydrophobicContact CE2-CG1 4.13Å; F232-V326 HydrophobicContact CE2-CG2 4.24Å; F232-V326 HydrophobicContact CZ-CG1 3.95Å; F232-Y378 AromaticContact CE1-CD2 3.99Å; F232-Y378 HydrophobicContact CE1-CD2 3.99Å; F232-Y378 HydrophobicContact CZ-CD2 4.1Å
233	S	87.8	Confident	92.1	Very high	72 Å²	72	49.8 Å²	49.8	50%	0.503	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.9	-16.9	163.1	56.2	0	0	0	0	112.7	R229 A230 R231	R229-S233 WeakPolarHBondContact O-CB 3.5Å; R229-S233 PolarHBondContact O-OG 3.18Å; A230-S233 PolarHBondContact O-OG 2.9Å; R231-S233 PolarHBondContact O-N 2.81Å
234	E	88.9	Confident	92.1	Very high	62 Å²	62	49.8 Å²	49.8	29%	0.29	25%	0.245	S	C	.	.	S	Bend	trans	-69.7	136.9	177.3	-61.7	169.6	-161.7	0	0	111	R231 F232 H236 L237 R238	R231-E234 IonicContact NE-OE1 3.65Å; R231-E234 PolarHBondContact NE-OE1 3.36Å; R231-E234 WeakPolarHBondContact O-CB 3.4Å; R231-E234 VanDerWaalsContact O-CG 3.28Å; R231-E234 WeakPolarHBondContact O-CG 3.26Å; R231-E234 PolarHBondContact O-N 3.24Å; F232-E234 VanDerWaalsContact C-N 3.27Å; E234-H236 PolarHBondContact O-N 2.87Å; E234-H236 IonicContact OE2-CE1 2.76Å; E234-H236 PolarHBondContact OE2-CE1 3.36Å; E234-H236 IonicContact OE2-ND1 3.34Å; E234-H236 IonicContact OE2-NE2 2.62Å; E234-H236 PolarHBondContact OE2-NE2 3.11Å; E234-L237 PolarHBondContact O-N 2.8Å; E234-R238 PolarHBondContact O-N 3.32Å
235	P	86.8	Confident	92.2	Very high	113 Å²	113	49.8 Å²	49.8	73%	0.734	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.3	-29.6	-172.7	-27.8	33.9	0	0	0	115.1
236	H	86	Confident	92.3	Very high	96 Å²	96	48.6 Å²	48.6	44%	0.444	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.5	-12	-178.7	66.8	-85.2	0	0	0	113.3	E234 R376 Y378	E234-H236 PolarHBondContact O-N 2.87Å; E234-H236 IonicContact OE2-CE1 2.76Å; E234-H236 PolarHBondContact OE2-CE1 3.36Å; E234-H236 IonicContact OE2-ND1 3.34Å; E234-H236 IonicContact OE2-NE2 2.62Å; E234-H236 PolarHBondContact OE2-NE2 3.11Å; H236-R376 PolarHBondContact O-NH1 3.48Å; H236-R376 PolarHBondContact O-NH2 2.84Å; H236-Y378 PolarHBondContact O-OH 3.07Å
237	L	89.5	Confident	92.1	Very high	7 Å²	7	46 Å²	46	4%	0.037	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	-109.4	-26.7	177.5	-61.6	-177.8	0	0	0	112.6	R231 F232 E234 D239 A240 V326 Y378	R231-L237 HydrophobicContact CB-CD1 4.2Å; F232-L237 HydrophobicContact CD1-CB 3.95Å; F232-L237 VanDerWaalsContact CD1-O 3.25Å; F232-L237 WeakPolarHBondContact CD1-O 3.26Å; F232-L237 HydrophobicContact CE1-CB 4.2Å; F232-L237 HydrophobicContact CG-CB 4.23Å; E234-L237 PolarHBondContact O-N 2.8Å; L237-D239 VanDerWaalsContact C-N 3.34Å; L237-D239 PolarHBondContact O-N 2.65Å; L237-A240 WeakPolarHBondContact O-CB 3.46Å; L237-A240 PolarHBondContact O-N 2.83Å; L237-A240 VanDerWaalsContact O-N 3.09Å; L237-V326 HydrophobicContact CD2-CG1 4.47Å; L237-Y378 HydrophobicContact CD2-CD1 4.22Å; L237-Y378 HydrophobicContact CD2-CD2 4.12Å; L237-Y378 HydrophobicContact CD2-CE1 3.68Å; L237-Y378 HydrophobicContact CD2-CE2 3.55Å; L237-Y378 HydrophobicContact CD2-CG 4.43Å
238	R	86.8	Confident	91.9	Very high	173 Å²	173	46.5 Å²	46.5	65%	0.653	23%	0.23	S	C	*	.	T	Hydrogen-bonded Turn	trans	-50.4	-42.7	-170.6	-171.6	177.1	179.3	179.1	0.2	116.1	F232 E234 A240	F232-R238 WeakPolarHBondContact O-CA 3.47Å; F232-R238 WeakPolarHBondContact O-CB 3.46Å; E234-R238 PolarHBondContact O-N 3.32Å; R238-A240 VanDerWaalsContact C-N 3.31Å; R238-A240 PolarHBondContact O-N 2.72Å
239	D	90	Very high	91.7	Very high	107 Å²	107	48.5 Å²	48.5	57%	0.572	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	-96	29.5	-176.4	-61.6	-39.4	0	0	0	113	L237	L237-D239 VanDerWaalsContact C-N 3.34Å; L237-D239 PolarHBondContact O-N 2.65Å
240	A	94.9	Very high	91.5	Very high	3 Å²	3	47.5 Å²	47.5	3%	0.025	24%	0.235	C	C	.	.			trans	-62.3	138.9	174.4	0	0	0	0	0	111.4	F232 L237 R238 R376 Y378	F232-A240 HydrophobicContact CD1-CB 4.26Å; F232-A240 HydrophobicContact CE1-CB 3.67Å; L237-A240 WeakPolarHBondContact O-CB 3.46Å; L237-A240 PolarHBondContact O-N 2.83Å; L237-A240 VanDerWaalsContact O-N 3.09Å; R238-A240 VanDerWaalsContact C-N 3.31Å; R238-A240 PolarHBondContact O-N 2.72Å; A240-R376 CarbonylContact C-O 3.57Å; A240-R376 WeakPolarHBondContact CA-O 3.39Å; A240-Y378 HydrophobicContact CB-CD2 3.7Å; A240-Y378 HydrophobicContact CB-CE2 3.78Å
241	L	96.1	Very high	91.3	Very high	0 Å²	0	48.2 Å²	48.2	0%	0	23%	0.232	C	C	.	.	S	Bend	trans	-67.5	-44.7	175.7	-173.3	72.6	0	0	0	111.1	F339 A343 T347 L369 L370 E375 R376	L241-F339 VanDerWaalsContact O-CD1 3.28Å; L241-F339 WeakPolarHBondContact O-CD1 3.37Å; L241-A343 HydrophobicContact CD1-CB 4.28Å; L241-A343 VanDerWaalsContact O-CB 3.26Å; L241-A343 WeakPolarHBondContact O-CB 3.32Å; L241-T347 WeakPolarHBondContact CD1-OG1 3.43Å; L241-L369 HydrophobicContact CD1-CD2 4.27Å; L241-L369 HydrophobicContact CD2-CB 4.48Å; L241-L369 HydrophobicContact CD2-CD2 3.53Å; L241-L369 HydrophobicContact CD2-CG 3.85Å; L241-L370 HydrophobicContact CB-CD2 4.29Å; L241-L370 HydrophobicContact CD2-CD2 3.75Å; L241-E375 HydrophobicContact CB-CB 4.26Å; L241-E375 HydrophobicContact CD1-CG 4.44Å; L241-E375 HydrophobicContact CD2-CB 4.36Å; L241-R376 PolarHBondContact N-O 3.23Å
242	Y	96.9	Very high	91.2	Very high	1 Å²	1	44.9 Å²	44.9	0%	0.004	22%	0.22	C	C	.	.			trans	-156.8	162.8	176	58.4	-101.7	0	0	0	112.2	K244 A329 M337 L338 F339 L366 L370 A377 Y378	Y242-K244 HydrophobicContact CD2-CG 3.87Å; Y242-K244 HydrophobicContact CE2-CD 4.09Å; Y242-K244 HydrophobicContact CE2-CG 3.71Å; Y242-A329 HydrophobicContact CE2-CB 3.9Å; Y242-M337 HydrophobicContact CD2-SD 4.48Å; Y242-L338 CarbonylContact C-O 3.55Å; Y242-L338 WeakPolarHBondContact CA-O 2.98Å; Y242-L338 WeakPolarHBondContact CB-O 3.21Å; Y242-F339 AromaticContact CD1-CE1 3.95Å; Y242-F339 HydrophobicContact CD1-CE1 3.95Å; Y242-F339 HydrophobicContact CD1-CZ 4.36Å; Y242-F339 HydrophobicContact CG-CE1 4.11Å; Y242-F339 HydrophobicContact CG-CZ 4.3Å; Y242-L366 HydrophobicContact CE1-CB 4.14Å; Y242-L370 HydrophobicContact CE1-CD2 4.17Å; Y242-A377 HydrophobicContact CD1-CB 3.97Å; Y242-A377 HydrophobicContact CD2-CB 3.57Å; Y242-A377 HydrophobicContact CE1-CB 3.75Å; Y242-A377 HydrophobicContact CE2-CB 3.3Å; Y242-A377 HydrophobicContact CG-CB 3.89Å; Y242-A377 VanDerWaalsContact CZ-CB 3.4Å; Y242-A377 WeakPolarHBondContact O-CA 3.25Å; Y242-A377 WeakPolarHBondContact O-CB 3.26Å; Y242-Y378 PolarHBondContact O-N 2.79Å; Y242-Y378 VanDerWaalsContact O-N 3.11Å
243	L	96.7	Very high	91.2	Very high	4 Å²	4	45.3 Å²	45.3	2%	0.021	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	113.7	170.5	-178.9	62.2	0	0	0	109.2	L227 F232 L245 V326 L338 Y378 V380	L227-L243 HydrophobicContact CD1-CD2 4.26Å; F232-L243 HydrophobicContact CE2-CD1 4.25Å; F232-L243 HydrophobicContact CE2-CD2 3.9Å; F232-L243 HydrophobicContact CZ-CB 4.44Å; F232-L243 HydrophobicContact CZ-CD1 3.83Å; F232-L243 HydrophobicContact CZ-CD2 4.08Å; F232-L243 HydrophobicContact CZ-CG 4.35Å; L243-L245 HydrophobicContact CD2-CD2 4.24Å; L243-L245 HydrophobicContact CG-CD2 4.04Å; L243-V326 HydrophobicContact CD1-CG1 4.43Å; L243-L338 HydrophobicContact CB-CB 4.25Å; L243-L338 HydrophobicContact CB-CD2 4.46Å; L243-L338 HydrophobicContact CD2-CD2 4.28Å; L243-L338 PolarHBondContact N-O 3.23Å; L243-L338 PolarHBondContact O-N 2.85Å; L243-Y378 CarbonylContact C-O 3.52Å; L243-Y378 WeakPolarHBondContact CA-O 3.47Å; L243-V380 HydrophobicContact CD1-CG2 3.47Å; L243-V380 VanDerWaalsContact CD1-CG2 3.47Å; L243-V380 HydrophobicContact CD2-CG2 3.63Å; L243-V380 HydrophobicContact CG-CG2 3.61Å
244	K	96.9	Very high	91.2	Very high	1 Å²	1	41.9 Å²	41.9	0%	0.004	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	135.8	173.3	-71.1	-173.2	173.2	-170.3	0	110	Y242 A329 S330 Q331 C332 C333 M337 Y378 V379 V380	Y242-K244 HydrophobicContact CD2-CG 3.87Å; Y242-K244 HydrophobicContact CE2-CD 4.09Å; Y242-K244 HydrophobicContact CE2-CG 3.71Å; K244-A329 HydrophobicContact CD-CB 4.32Å; K244-S330 PolarHBondContact NZ-O 2.86Å; K244-Q331 PolarHBondContact NZ-O 3.17Å; K244-C332 PolarHBondContact NZ-O 2.93Å; K244-C333 VanDerWaalsContact CE-O 3.28Å; K244-C333 WeakPolarHBondContact CE-O 3.37Å; K244-C333 PolarHBondContact NZ-O 3.06Å; K244-M337 HydrophobicContact CG-CG 4.19Å; K244-M337 HydrophobicContact CG-SD 4.35Å; K244-Y378 PolarHBondContact N-O 2.87Å; K244-V379 HydrophobicContact CB-CB 3.96Å; K244-V379 HydrophobicContact CB-CG2 3.82Å; K244-V379 WeakPolarHBondContact O-CA 3.14Å; K244-V380 PolarHBondContact O-N 2.66Å
245	L	97.3	Very high	90.9	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	21%	0.213	C	C	.	.			trans	-104.5	0.3	179.3	-54	-166.7	0	0	0	113.1	L208 I220 L224 L243 A336 V380 N383 L384	L208-L245 HydrophobicContact CD1-CD1 3.55Å; L208-L245 HydrophobicContact CD1-CG 4.34Å; L208-L245 HydrophobicContact CD2-CD1 4.27Å; I220-L245 HydrophobicContact CD1-CD1 4.34Å; L224-L245 HydrophobicContact CD1-CD1 4.32Å; L224-L245 HydrophobicContact CD2-CD1 4.09Å; L224-L245 HydrophobicContact CD2-CD2 3.87Å; L243-L245 HydrophobicContact CD2-CD2 4.24Å; L243-L245 HydrophobicContact CG-CD2 4.04Å; L245-A336 HydrophobicContact CB-CB 3.87Å; L245-A336 HydrophobicContact CD1-CB 4.4Å; L245-A336 HydrophobicContact CG-CB 4.39Å; L245-A336 PolarHBondContact N-O 3.41Å; L245-V380 HydrophobicContact CD2-CG2 3.95Å; L245-N383 WeakPolarHBondContact O-CA 3.38Å; L245-L384 HydrophobicContact CB-CB 4.25Å; L245-L384 HydrophobicContact CD2-CD1 4.29Å; L245-L384 PolarHBondContact O-N 2.98Å
246	Y	95.7	Very high	90.5	Very high	22 Å²	22	41.1 Å²	41.1	9%	0.086	19%	0.189	C	C	.	.			trans	-142.5	139.3	178.2	-177.5	-100.3	0	0	0	111.5	P248 E249 P335 N383 V385 H387	Y246-P248 HydrophobicContact CE1-CG 3.96Å; Y246-E249 PolarHBondContact OH-OE2 2.94Å; Y246-E249 VanDerWaalsContact OH-OE2 3.07Å; Y246-P335 HydrophobicContact CD1-CG 3.32Å; Y246-P335 HydrophobicContact CE1-CG 4.16Å; Y246-P335 HydrophobicContact CG-CG 3.62Å; Y246-N383 WeakPolarHBondContact CA-OD1 3.18Å; Y246-N383 HydrophobicContact CD2-CB 4.1Å; Y246-N383 WeakPolarHBondContact CD2-ND2 3.39Å; Y246-N383 WeakPolarHBondContact CE2-ND2 3.29Å; Y246-V385 HydrophobicContact CD2-CG2 4.27Å; Y246-V385 WeakPolarHBondContact CD2-O 3.32Å; Y246-V385 HydrophobicContact CG-CG2 4.31Å; Y246-H387 HydrophobicContact CE1-CB 4.2Å; Y246-H387 HydrophobicContact CE2-CB 3.97Å
247	H	91.6	Very high	89.9	Confident	5 Å²	5	42.5 Å²	42.5	2%	0.023	21%	0.206	C	C	.	.			trans	-141.7	133.8	165	-172.5	56.6	0	0	0	109.4	E249 Q252 S330 V379 N383	H247-E249 PolarHBondContact O-N 2.91Å; H247-Q252 PolarHBondContact O-NE2 3.01Å; H247-S330 PolarHBondContact CE1-OG 2.84Å; H247-S330 PolarHBondContact ND1-OG 2.82Å; H247-V379 HydrophobicContact CB-CG2 4.09Å; H247-N383 PolarHBondContact N-OD1 2.8Å; H247-N383 PolarHBondContact O-ND2 3.33Å; H247-N383 PolarHBondContact O-OD1 3.18Å
248	P	90.7	Very high	89.5	Confident	11 Å²	11	44 Å²	44	7%	0.071	21%	0.213	C	C	.	.			trans	-56.4	130.6	-176.9	-26	33.1	0	0	0	113.1	Y246 R250 L251 C333	Y246-P248 HydrophobicContact CE1-CG 3.96Å; P248-R250 HydrophobicContact CB-CG 4.23Å; P248-R250 PolarHBondContact O-N 2.9Å; P248-L251 HydrophobicContact CB-CD1 4.37Å; P248-L251 HydrophobicContact CB-CG 4.37Å; P248-L251 HydrophobicContact CG-CD1 4.35Å; P248-L251 PolarHBondContact O-N 3.4Å; P248-C333 WeakPolarHBondContact CG-SG 3.34Å
249	E	90	Very high	89.4	Confident	53 Å²	53	40.1 Å²	40.1	25%	0.248	21%	0.21	C	C	.	.	G	3₁₀ helix	trans	-59.2	-35.9	-175.4	-65.7	75.3	-167.1	0	0	111.4	Y246 H247 L251 Q252 H311 N383	Y246-E249 PolarHBondContact OH-OE2 2.94Å; Y246-E249 VanDerWaalsContact OH-OE2 3.07Å; H247-E249 PolarHBondContact O-N 2.91Å; E249-L251 PolarHBondContact O-N 3.17Å; E249-L251 VanDerWaalsContact O-N 3.15Å; E249-Q252 WeakPolarHBondContact O-CB 3.27Å; E249-Q252 PolarHBondContact O-N 3.02Å; E249-Q252 VanDerWaalsContact O-N 3.08Å; E249-H311 HydrophobicContact CB-CB 4.19Å; E249-H311 HydrophobicContact CG-CB 4.29Å; E249-N383 PolarHBondContact OE1-ND2 3.33Å
250	R	87.2	Confident	89.2	Confident	133 Å²	133	40.7 Å²	40.7	50%	0.502	21%	0.211	S	C	.	.	G	3₁₀ helix	trans	-62	-18.7	175.4	75.3	-172.4	179.9	100.2	-1.2	114.9	H48 P248 H253	H48-R250 WeakPolarHBondContact ND1-CB 3.29Å; P248-R250 HydrophobicContact CB-CG 4.23Å; P248-R250 PolarHBondContact O-N 2.9Å; R250-H253 PolarHBondContact O-CD2 3.49Å
251	L	87.1	Confident	89	Confident	57 Å²	57	40.7 Å²	40.7	30%	0.298	21%	0.21	S	C	.	.	G	3₁₀ helix	trans	-102.5	-1.6	179.3	-59.7	-179.3	0	0	0	112.1	P248 E249 H253 N256 R261	P248-L251 HydrophobicContact CB-CD1 4.37Å; P248-L251 HydrophobicContact CB-CG 4.37Å; P248-L251 HydrophobicContact CG-CD1 4.35Å; P248-L251 PolarHBondContact O-N 3.4Å; E249-L251 PolarHBondContact O-N 3.17Å; E249-L251 VanDerWaalsContact O-N 3.15Å; L251-H253 PolarHBondContact O-N 3.12Å; L251-N256 PolarHBondContact O-ND2 3Å; L251-R261 PolarHBondContact O-NH1 3.17Å
252	Q	88.3	Confident	88.8	Confident	4 Å²	4	44.5 Å²	44.5	2%	0.019	23%	0.23	C	C	.	.			trans	-88.3	9.1	-173.9	-76	177.2	-20.4	0	0	114.4	H247 E249 R310 H311	H247-Q252 PolarHBondContact O-NE2 3.01Å; E249-Q252 WeakPolarHBondContact O-CB 3.27Å; E249-Q252 PolarHBondContact O-N 3.02Å; E249-Q252 VanDerWaalsContact O-N 3.08Å; Q252-R310 VanDerWaalsContact O-CB 3.23Å; Q252-R310 WeakPolarHBondContact O-CB 3.45Å; Q252-R310 WeakPolarHBondContact O-CD 3.27Å; Q252-R310 WeakPolarHBondContact O-CG 3.31Å; Q252-H311 HydrophobicContact CB-CB 4.4Å; Q252-H311 VanDerWaalsContact OE1-CB 3.31Å
253	H	89.1	Confident	88.6	Confident	27 Å²	27	49.9 Å²	49.9	13%	0.125	26%	0.258	C	S	.	.			trans	-60	157.2	177.4	-68.1	-74.1	0	0	0	113.7	H48 Y50 R250 L251 N256 R261 E306	H48-H253 PolarHBondContact O-CE1 2.85Å; H48-H253 VanDerWaalsContact O-CE1 3.26Å; Y50-H253 AromaticContact CE2-CE1 3.65Å; Y50-H253 AromaticContact CE2-ND1 3.58Å; R250-H253 PolarHBondContact O-CD2 3.49Å; L251-H253 PolarHBondContact O-N 3.12Å; H253-N256 WeakPolarHBondContact O-CB 3.32Å; H253-R261 PolarHBondContact O-NH1 3.25Å; H253-E306 WeakPolarHBondContact CB-OE1 3.42Å; H253-E306 IonicContact CG-OE1 3.84Å; H253-E306 IonicContact ND1-OE1 3.75Å
254	Y	89.1	Confident	88.4	Confident	0 Å²	0	51.3 Å²	51.3	0%	0	26%	0.264	C	S	.	.	S	Bend	trans	-70.6	-32.5	177.2	-68.7	-71.8	0	0	0	112	N256 R261 E264 W265 V305 E306 R310 F313	Y254-N256 PolarHBondContact O-N 3.28Å; Y254-R261 HydrophobicContact CD1-CB 4.47Å; Y254-R261 VanDerWaalsContact CD1-O 3.26Å; Y254-R261 WeakPolarHBondContact CD1-O 3.13Å; Y254-E264 HydrophobicContact CE1-CB 4.07Å; Y254-E264 HydrophobicContact CE1-CG 3.8Å; Y254-W265 HydrophobicContact CD1-CB 3.48Å; Y254-W265 VanDerWaalsContact CD1-CB 3.48Å; Y254-W265 AromaticContact CD1-CG 3.94Å; Y254-W265 HydrophobicContact CD1-CG 3.94Å; Y254-W265 HydrophobicContact CD2-CB 4.46Å; Y254-W265 AromaticContact CD2-CD1 3.56Å; Y254-W265 HydrophobicContact CD2-CG 4.05Å; Y254-W265 AromaticContact CD2-NE1 3.98Å; Y254-W265 HydrophobicContact CE1-CB 3.97Å; Y254-W265 AromaticContact CE2-CD1 3.93Å; Y254-W265 HydrophobicContact CG-CB 3.75Å; Y254-W265 AromaticContact CG-CD1 3.67Å; Y254-W265 HydrophobicContact CG-CD2 4.33Å; Y254-W265 AromaticContact CG-CG 3.67Å; Y254-W265 HydrophobicContact CG-CG 3.67Å; Y254-V305 HydrophobicContact CD2-CG2 4.2Å; Y254-V305 HydrophobicContact CE2-CB 4.1Å; Y254-V305 HydrophobicContact CE2-CG2 3.6Å; Y254-E306 WeakPolarHBondContact CA-OE2 3.25Å; Y254-E306 WeakPolarHBondContact CB-OE2 3.35Å; Y254-E306 HydrophobicContact CD2-CB 4.31Å; Y254-E306 WeakPolarHBondContact CD2-OE2 3.34Å; Y254-E306 PolarHBondContact N-OE2 2.91Å; Y254-R310 HydrophobicContact CD1-CG 4.32Å; Y254-R310 HydrophobicContact CD2-CB 3.88Å; Y254-R310 HydrophobicContact CD2-CG 4.41Å; Y254-R310 HydrophobicContact CE1-CB 4.43Å; Y254-R310 VanDerWaalsContact CE1-CD 3.42Å; Y254-R310 HydrophobicContact CE1-CG 3.93Å; Y254-R310 HydrophobicContact CE2-CB 3.66Å; Y254-R310 HydrophobicContact CE2-CG 3.98Å; Y254-R310 HydrophobicContact CG-CB 4.33Å; Y254-F313 WeakPolarHBondContact OH-CD1 3.4Å
255	I	83.1	Confident	88.3	Confident	119 Å²	119	53.8 Å²	53.8	61%	0.61	27%	0.274	S	S	*	.	S	Bend	trans	-78.4	66.2	174.1	-52.2	174.5	0	0	0	108.9	W265 E306	I255-W265 HydrophobicContact CG1-CH2 4.35Å; I255-W265 HydrophobicContact CG1-CZ3 4.46Å; I255-E306 HydrophobicContact CD1-CG 3.86Å; I255-E306 HydrophobicContact CG1-CG 4.04Å
256	N	78.3	Confident	88.2	Confident	41 Å²	41	56.1 Å²	56.1	22%	0.219	29%	0.288	C	S	.	.	S	Bend	trans	-136	142.8	174.5	-167.4	-38.2	0	0	0	106.9	L251 H253 Y254 E258 R261	L251-N256 PolarHBondContact O-ND2 3Å; H253-N256 WeakPolarHBondContact O-CB 3.32Å; Y254-N256 PolarHBondContact O-N 3.28Å; N256-E258 PolarHBondContact O-N 2.69Å; N256-R261 PolarHBondContact ND2-NH1 2.8Å; N256-R261 VanDerWaalsContact ND2-NH1 3.18Å
257	P	73.4	Confident	88.3	Confident	124 Å²	124	56.8 Å²	56.8	81%	0.805	30%	0.301	S	S	*	.	S	Bend	trans	-52.7	-1.1	-176.1	15.3	-34.5	0	0	0	118.5	P259	P257-P259 WeakPolarHBondContact O-CD 3.14Å
258	E	80.6	Confident	88.4	Confident	38 Å²	38	57.1 Å²	57.1	18%	0.178	30%	0.304	C	S	.	.			trans	-79.7	117.2	-179.8	-69.7	178.5	-170.2	0	0	112.2	N256 M260 R261	N256-E258 PolarHBondContact O-N 2.69Å; E258-M260 VanDerWaalsContact C-N 3.26Å; E258-M260 PolarHBondContact O-N 3.03Å; E258-M260 VanDerWaalsContact O-N 3.16Å; E258-R261 HydrophobicContact CB-CG 4.07Å; E258-R261 PolarHBondContact O-N 3.22Å; E258-R261 VanDerWaalsContact O-N 3.08Å; E258-R261 IonicContact OE1-NH2 3.41Å; E258-R261 IonicContact OE2-CZ 3.52Å; E258-R261 VanDerWaalsContact OE2-CZ 3.23Å; E258-R261 IonicContact OE2-NE 3.99Å; E258-R261 PolarHBondContact OE2-NE 2.78Å; E258-R261 IonicContact OE2-NH2 2.66Å; E258-R261 PolarHBondContact OE2-NH2 3.23Å; E258-R261 VanDerWaalsContact OE2-NH2 3.09Å
259	P	84	Confident	88.7	Confident	92 Å²	92	56.6 Å²	56.6	60%	0.597	30%	0.301	S	S	*	.	H	α-helix	trans	-58.3	-35.6	-175.1	-25.8	34.2	0	0	0	114	P257 R261 I262 L263	P257-P259 WeakPolarHBondContact O-CD 3.14Å; P259-R261 VanDerWaalsContact C-N 3.26Å; P259-R261 PolarHBondContact O-N 3.12Å; P259-I262 PolarHBondContact O-N 2.76Å; P259-L263 WeakPolarHBondContact O-CG 3.31Å; P259-L263 PolarHBondContact O-N 3.41Å
260	M	86.9	Confident	89.1	Confident	120 Å²	120	60.5 Å²	60.5	59%	0.591	32%	0.32	S	S	*	.	H	α-helix	trans	-62.7	-33.9	-179.2	-66.7	-61.6	179.4	0	0	112.3	E258 L263 E264	E258-M260 VanDerWaalsContact C-N 3.26Å; E258-M260 PolarHBondContact O-N 3.03Å; E258-M260 VanDerWaalsContact O-N 3.16Å; M260-L263 PolarHBondContact O-N 3.31Å; M260-L263 HydrophobicContact SD-CD1 4.28Å; M260-E264 WeakPolarHBondContact O-CB 3.42Å; M260-E264 PolarHBondContact O-N 2.99Å
261	R	90.5	Very high	89.5	Confident	2 Å²	2	60.2 Å²	60.2	1%	0.008	33%	0.328	C	S	.	.	H	α-helix	trans	-69.8	-41.7	176.6	-60.4	-175.5	-171	-171.1	2.4	110.8	L251 H253 Y254 N256 E258 P259 L263 E264 W265 E381	L251-R261 PolarHBondContact O-NH1 3.17Å; H253-R261 PolarHBondContact O-NH1 3.25Å; Y254-R261 HydrophobicContact CD1-CB 4.47Å; Y254-R261 VanDerWaalsContact CD1-O 3.26Å; Y254-R261 WeakPolarHBondContact CD1-O 3.13Å; N256-R261 PolarHBondContact ND2-NH1 2.8Å; N256-R261 VanDerWaalsContact ND2-NH1 3.18Å; E258-R261 HydrophobicContact CB-CG 4.07Å; E258-R261 PolarHBondContact O-N 3.22Å; E258-R261 VanDerWaalsContact O-N 3.08Å; E258-R261 IonicContact OE1-NH2 3.41Å; E258-R261 IonicContact OE2-CZ 3.52Å; E258-R261 VanDerWaalsContact OE2-CZ 3.23Å; E258-R261 IonicContact OE2-NE 3.99Å; E258-R261 PolarHBondContact OE2-NE 2.78Å; E258-R261 IonicContact OE2-NH2 2.66Å; E258-R261 PolarHBondContact OE2-NH2 3.23Å; E258-R261 VanDerWaalsContact OE2-NH2 3.09Å; P259-R261 VanDerWaalsContact C-N 3.26Å; P259-R261 PolarHBondContact O-N 3.12Å; R261-L263 VanDerWaalsContact C-N 3.31Å; R261-L263 PolarHBondContact O-N 3.24Å; R261-E264 PolarHBondContact O-N 3.25Å; R261-W265 WeakPolarHBondContact O-CB 2.96Å; R261-W265 PolarHBondContact O-N 2.79Å; R261-E381 IonicContact NH2-OE1 3.33Å
262	I	91.2	Very high	90	Very high	80 Å²	80	60 Å²	60	41%	0.41	33%	0.327	S	S	.	.	H	α-helix	trans	-62.7	-41.8	175.8	-58.8	173.9	0	0	0	110.4	P259 W265 V266	P259-I262 PolarHBondContact O-N 2.76Å; I262-W265 WeakPolarHBondContact O-CB 3.39Å; I262-W265 PolarHBondContact O-N 2.93Å; I262-V266 HydrophobicContact CG2-CG2 4.42Å; I262-V266 WeakPolarHBondContact O-CB 3.38Å; I262-V266 VanDerWaalsContact O-CG2 3.31Å; I262-V266 WeakPolarHBondContact O-CG2 3.47Å; I262-V266 PolarHBondContact O-N 3.29Å
263	L	92.8	Very high	90.4	Very high	114 Å²	114	59.8 Å²	59.8	60%	0.597	33%	0.326	S	S	*	.	H	α-helix	trans	-63.8	-43.3	176.2	-69.2	175.9	0	0	0	112.2	P259 M260 R261 W265 V266 G267	P259-L263 WeakPolarHBondContact O-CG 3.31Å; P259-L263 PolarHBondContact O-N 3.41Å; M260-L263 PolarHBondContact O-N 3.31Å; M260-L263 HydrophobicContact SD-CD1 4.28Å; R261-L263 VanDerWaalsContact C-N 3.31Å; R261-L263 PolarHBondContact O-N 3.24Å; L263-W265 VanDerWaalsContact C-N 3.31Å; L263-W265 PolarHBondContact O-N 2.89Å; L263-V266 PolarHBondContact O-N 3.44Å; L263-G267 PolarHBondContact O-N 3.47Å
264	E	93.4	Very high	90.8	Very high	34 Å²	34	60.9 Å²	60.9	16%	0.159	34%	0.335	C	S	.	.	H	α-helix	trans	-57.9	-46	172.5	-178.6	-178.4	-170.4	0	0	110.9	Y254 M260 R261 V266 G267 V268 R310 R317	Y254-E264 HydrophobicContact CE1-CB 4.07Å; Y254-E264 HydrophobicContact CE1-CG 3.8Å; M260-E264 WeakPolarHBondContact O-CB 3.42Å; M260-E264 PolarHBondContact O-N 2.99Å; R261-E264 PolarHBondContact O-N 3.25Å; E264-V266 PolarHBondContact O-N 2.95Å; E264-G267 CarbonylContact O-C 3.54Å; E264-G267 WeakPolarHBondContact O-CA 3.43Å; E264-G267 PolarHBondContact O-N 3.15Å; E264-G267 VanDerWaalsContact O-N 3.1Å; E264-V268 WeakPolarHBondContact O-CG2 3.35Å; E264-V268 PolarHBondContact O-N 2.96Å; E264-R310 IonicContact OE2-CZ 3.88Å; E264-R310 VanDerWaalsContact OE2-CZ 3.3Å; E264-R310 IonicContact OE2-NE 3.09Å; E264-R310 PolarHBondContact OE2-NE 2.95Å; E264-R310 IonicContact OE2-NH2 3.22Å; E264-R310 PolarHBondContact OE2-NH2 3.1Å; E264-R317 IonicContact OE1-CZ 3.3Å; E264-R317 IonicContact OE1-NE 2.81Å; E264-R317 IonicContact OE1-NH2 3.85Å; E264-R317 PolarHBondContact OE1-NH2 2.97Å; E264-R317 IonicContact OE2-NH2 3.81Å; E264-R317 PolarHBondContact OE2-NH2 2.86Å
265	W	94.9	Very high	91.1	Very high	53 Å²	53	65 Å²	65	20%	0.201	36%	0.357	C	S	.	.	H	α-helix	trans	-61	-47.4	-179.8	-165.7	34.3	0	0	0	112.5	Y254 I255 R261 I262 L263 G267 V268 G269 M302 E306	Y254-W265 HydrophobicContact CD1-CB 3.48Å; Y254-W265 VanDerWaalsContact CD1-CB 3.48Å; Y254-W265 AromaticContact CD1-CG 3.94Å; Y254-W265 HydrophobicContact CD1-CG 3.94Å; Y254-W265 HydrophobicContact CD2-CB 4.46Å; Y254-W265 AromaticContact CD2-CD1 3.56Å; Y254-W265 HydrophobicContact CD2-CG 4.05Å; Y254-W265 AromaticContact CD2-NE1 3.98Å; Y254-W265 HydrophobicContact CE1-CB 3.97Å; Y254-W265 AromaticContact CE2-CD1 3.93Å; Y254-W265 HydrophobicContact CG-CB 3.75Å; Y254-W265 AromaticContact CG-CD1 3.67Å; Y254-W265 HydrophobicContact CG-CD2 4.33Å; Y254-W265 AromaticContact CG-CG 3.67Å; Y254-W265 HydrophobicContact CG-CG 3.67Å; I255-W265 HydrophobicContact CG1-CH2 4.35Å; I255-W265 HydrophobicContact CG1-CZ3 4.46Å; R261-W265 WeakPolarHBondContact O-CB 2.96Å; R261-W265 PolarHBondContact O-N 2.79Å; I262-W265 WeakPolarHBondContact O-CB 3.39Å; I262-W265 PolarHBondContact O-N 2.93Å; L263-W265 VanDerWaalsContact C-N 3.31Å; L263-W265 PolarHBondContact O-N 2.89Å; W265-G267 VanDerWaalsContact C-N 3.28Å; W265-G267 PolarHBondContact O-N 2.93Å; W265-V268 WeakPolarHBondContact O-CB 3.34Å; W265-V268 PolarHBondContact O-N 3.37Å; W265-G269 PolarHBondContact O-N 3.47Å; W265-G269 VanDerWaalsContact O-N 3.1Å; W265-M302 HydrophobicContact CD2-CB 4.43Å; W265-M302 HydrophobicContact CD2-CE 3.65Å; W265-M302 HydrophobicContact CE3-CE 3.78Å; W265-M302 HydrophobicContact CG-CE 4.06Å; W265-M302 HydrophobicContact CG-CG 4.49Å; W265-M302 HydrophobicContact CH2-CE 4.47Å; W265-M302 HydrophobicContact CZ2-CB 4Å; W265-M302 HydrophobicContact CZ2-CE 4.36Å; W265-M302 HydrophobicContact CZ3-CE 4.2Å; W265-M302 VanDerWaalsContact NE1-CA 3.32Å; W265-M302 PolarHBondContact NE1-O 3.36Å; W265-M302 WeakPolarHBondContact O-CG 3.49Å; W265-E306 HydrophobicContact CZ2-CB 4.05Å; W265-E306 HydrophobicContact CZ2-CG 4.44Å
266	V	95.3	Very high	91.8	Very high	50 Å²	50	61.6 Å²	61.6	30%	0.303	34%	0.34	S	S	.	.	H	α-helix	trans	-61.3	-40.4	174	171.3	0	0	0	0	110.2	I262 L263 E264 V268 G269 M270 M302	I262-V266 HydrophobicContact CG2-CG2 4.42Å; I262-V266 WeakPolarHBondContact O-CB 3.38Å; I262-V266 VanDerWaalsContact O-CG2 3.31Å; I262-V266 WeakPolarHBondContact O-CG2 3.47Å; I262-V266 PolarHBondContact O-N 3.29Å; L263-V266 PolarHBondContact O-N 3.44Å; E264-V266 PolarHBondContact O-N 2.95Å; V266-V268 PolarHBondContact O-N 3.24Å; V266-G269 CarbonylContact O-C 3.57Å; V266-G269 PolarHBondContact O-N 3.35Å; V266-G269 VanDerWaalsContact O-N 3.16Å; V266-M270 HydrophobicContact CG1-CE 3.59Å; V266-M270 HydrophobicContact CG1-CG 4.19Å; V266-M270 HydrophobicContact CG1-SD 3.97Å; V266-M270 WeakPolarHBondContact O-CB 3.44Å; V266-M270 WeakPolarHBondContact O-CG 3.39Å; V266-M270 PolarHBondContact O-N 3.27Å; V266-M302 HydrophobicContact CG2-CE 4.06Å
267	G	95.9	Very high	92.6	Very high	35 Å²	35	59.7 Å²	59.7	36%	0.361	33%	0.33	S	S	.	.	H	α-helix	trans	-58.6	-42.8	174.8	0	0	0	0	0	113	L263 E264 W265 G269 M270 L271	L263-G267 PolarHBondContact O-N 3.47Å; E264-G267 CarbonylContact O-C 3.54Å; E264-G267 WeakPolarHBondContact O-CA 3.43Å; E264-G267 PolarHBondContact O-N 3.15Å; E264-G267 VanDerWaalsContact O-N 3.1Å; W265-G267 VanDerWaalsContact C-N 3.28Å; W265-G267 PolarHBondContact O-N 2.93Å; G267-G269 VanDerWaalsContact C-N 3.35Å; G267-G269 PolarHBondContact O-N 2.86Å; G267-M270 PolarHBondContact O-N 3.16Å; G267-L271 WeakPolarHBondContact O-CB 3.34Å; G267-L271 PolarHBondContact O-N 3.1Å
268	V	95.5	Very high	93.6	Very high	12 Å²	12	60.9 Å²	60.9	7%	0.073	32%	0.318	C	S	.	.	H	α-helix	trans	-59.8	-46.3	173.3	173.4	0	0	0	0	110.7	E264 W265 V266 M270 L271 L272 V305 F313	E264-V268 WeakPolarHBondContact O-CG2 3.35Å; E264-V268 PolarHBondContact O-N 2.96Å; W265-V268 WeakPolarHBondContact O-CB 3.34Å; W265-V268 PolarHBondContact O-N 3.37Å; V266-V268 PolarHBondContact O-N 3.24Å; V268-M270 PolarHBondContact O-N 3.49Å; V268-L271 PolarHBondContact O-N 3.46Å; V268-L272 HydrophobicContact CG1-CD1 3.71Å; V268-L272 HydrophobicContact CG1-CG 4.28Å; V268-L272 WeakPolarHBondContact O-CB 3.2Å; V268-L272 PolarHBondContact O-N 3.24Å; V268-V305 HydrophobicContact CG1-CG1 4.04Å; V268-V305 HydrophobicContact CG1-CG2 4.07Å; V268-F313 HydrophobicContact CG2-CD1 4.47Å; V268-F313 HydrophobicContact CG2-CE1 3.76Å; V268-F313 HydrophobicContact CG2-CZ 4.12Å
269	G	97.2	Very high	94.2	Very high	1 Å²	1	62 Å²	62	1%	0.01	33%	0.325	C	S	.	.	H	α-helix	trans	-60.3	-43.9	175.4	0	0	0	0	0	112.8	W265 V266 G267 L271 G273 S298	W265-G269 PolarHBondContact O-N 3.47Å; W265-G269 VanDerWaalsContact O-N 3.1Å; V266-G269 CarbonylContact O-C 3.57Å; V266-G269 PolarHBondContact O-N 3.35Å; V266-G269 VanDerWaalsContact O-N 3.16Å; G267-G269 VanDerWaalsContact C-N 3.35Å; G267-G269 PolarHBondContact O-N 2.86Å; G269-L271 VanDerWaalsContact C-N 3.33Å; G269-L271 PolarHBondContact O-N 3.45Å; G269-G273 VanDerWaalsContact O-CA 3.31Å; G269-G273 WeakPolarHBondContact O-CA 3.45Å; G269-G273 PolarHBondContact O-N 2.81Å; G269-S298 WeakPolarHBondContact O-CB 3.44Å; G269-S298 PolarHBondContact O-OG 3.5Å
270	M	97	Very high	94.7	Very high	134 Å²	134	59.1 Å²	59.1	66%	0.66	30%	0.302	S	S	*	.	H	α-helix	trans	-67.6	-29.4	179.2	-74.2	-177.7	173.9	0	0	113.3	V266 G267 V268 P274	V266-M270 HydrophobicContact CG1-CE 3.59Å; V266-M270 HydrophobicContact CG1-CG 4.19Å; V266-M270 HydrophobicContact CG1-SD 3.97Å; V266-M270 WeakPolarHBondContact O-CB 3.44Å; V266-M270 WeakPolarHBondContact O-CG 3.39Å; V266-M270 PolarHBondContact O-N 3.27Å; G267-M270 PolarHBondContact O-N 3.16Å; V268-M270 PolarHBondContact O-N 3.49Å; M270-P274 WeakPolarHBondContact O-CD 3.43Å; M270-P274 WeakPolarHBondContact O-CG 3.47Å
271	L	96.6	Very high	94.9	Very high	127 Å²	127	54.5 Å²	54.5	67%	0.665	28%	0.279	S	S	*	.	H	α-helix	trans	-84.2	-52.1	177.2	-176.9	67.9	0	0	0	111.7	G267 V268 G269	G267-L271 WeakPolarHBondContact O-CB 3.34Å; G267-L271 PolarHBondContact O-N 3.1Å; V268-L271 PolarHBondContact O-N 3.46Å; G269-L271 VanDerWaalsContact C-N 3.33Å; G269-L271 PolarHBondContact O-N 3.45Å
272	L	97.2	Very high	94.8	Very high	52 Å²	52	62.5 Å²	62.5	27%	0.272	31%	0.31	S	S	.	.	H	α-helix	trans	-77.5	-30.2	-174.4	-64.3	-177.3	0	0	0	112.6	V268 L275 L276 S301	V268-L272 HydrophobicContact CG1-CD1 3.71Å; V268-L272 HydrophobicContact CG1-CG 4.28Å; V268-L272 WeakPolarHBondContact O-CB 3.2Å; V268-L272 PolarHBondContact O-N 3.24Å; L272-L275 HydrophobicContact CD2-CD2 4.36Å; L272-L275 PolarHBondContact O-N 2.92Å; L272-L276 VanDerWaalsContact O-CB 3.31Å; L272-L276 WeakPolarHBondContact O-CB 3.47Å; L272-L276 VanDerWaalsContact O-CG 3.27Å; L272-L276 WeakPolarHBondContact O-CG 3.46Å; L272-L276 PolarHBondContact O-N 3.08Å; L272-S301 WeakPolarHBondContact CB-OG 3.23Å
273	G	97.3	Very high	94.7	Very high	0 Å²	0	67.2 Å²	67.2	0%	0	33%	0.327	C	S	.	.	H	α-helix	trans	-57.5	-57.6	179.2	0	0	0	0	0	113.6	G269 L275 T277	G269-G273 VanDerWaalsContact O-CA 3.31Å; G269-G273 WeakPolarHBondContact O-CA 3.45Å; G269-G273 PolarHBondContact O-N 2.81Å; G273-L275 VanDerWaalsContact C-N 3.34Å; G273-L275 PolarHBondContact O-N 2.89Å; G273-T277 WeakPolarHBondContact O-CB 3.42Å; G273-T277 PolarHBondContact O-N 2.9Å; G273-T277 PolarHBondContact O-OG1 2.92Å
274	P	96.4	Very high	94.5	Very high	50 Å²	50	63.4 Å²	63.4	33%	0.325	31%	0.312	S	S	.	.	H	α-helix	trans	-60.4	-40.7	175.3	-19.4	28.3	0	0	0	112.9	M270 T277 W278 M294	M270-P274 WeakPolarHBondContact O-CD 3.43Å; M270-P274 WeakPolarHBondContact O-CG 3.47Å; P274-T277 WeakPolarHBondContact O-CB 3.23Å; P274-T277 PolarHBondContact O-N 3.21Å; P274-W278 WeakPolarHBondContact O-CB 3.31Å; P274-W278 PolarHBondContact O-N 3.35Å; P274-M294 HydrophobicContact CB-SD 3.99Å; P274-M294 HydrophobicContact CG-CG 4.25Å; P274-M294 HydrophobicContact CG-SD 3.65Å
275	L	96.5	Very high	94	Very high	86 Å²	86	66.9 Å²	66.9	45%	0.45	34%	0.34	S	S	.	.	H	α-helix	trans	-61.4	-52.4	179.6	177.9	62.3	0	0	0	111.6	L272 G273 T277 W278 I279	L272-L275 HydrophobicContact CD2-CD2 4.36Å; L272-L275 PolarHBondContact O-N 2.92Å; G273-L275 VanDerWaalsContact C-N 3.34Å; G273-L275 PolarHBondContact O-N 2.89Å; L275-T277 VanDerWaalsContact C-N 3.28Å; L275-T277 PolarHBondContact O-N 3.41Å; L275-W278 WeakPolarHBondContact O-CB 3.48Å; L275-W278 PolarHBondContact O-N 3.29Å; L275-I279 HydrophobicContact CD1-CD1 4.33Å; L275-I279 HydrophobicContact CG-CD1 4.2Å; L275-I279 WeakPolarHBondContact O-CG1 3.14Å; L275-I279 PolarHBondContact O-N 3.25Å
276	L	96.5	Very high	93.2	Very high	49 Å²	49	67.4 Å²	67.4	26%	0.257	34%	0.342	S	S	.	.	H	α-helix	trans	-65.3	-33.7	178.2	-69.3	177.6	0	0	0	111.8	L272 I279 Y280 F297 Y300 S301	L272-L276 VanDerWaalsContact O-CB 3.31Å; L272-L276 WeakPolarHBondContact O-CB 3.47Å; L272-L276 VanDerWaalsContact O-CG 3.27Å; L272-L276 WeakPolarHBondContact O-CG 3.46Å; L272-L276 PolarHBondContact O-N 3.08Å; L276-I279 HydrophobicContact CD2-CD1 4.45Å; L276-I279 PolarHBondContact O-N 3.29Å; L276-Y280 VanDerWaalsContact O-CB 3.22Å; L276-Y280 WeakPolarHBondContact O-CB 3.14Å; L276-Y280 PolarHBondContact O-N 3.23Å; L276-F297 HydrophobicContact CB-CB 3.93Å; L276-F297 HydrophobicContact CB-CD1 3.68Å; L276-F297 HydrophobicContact CB-CD2 4.3Å; L276-F297 HydrophobicContact CB-CE1 4.25Å; L276-F297 HydrophobicContact CB-CG 3.71Å; L276-F297 HydrophobicContact CD1-CD1 3.98Å; L276-F297 HydrophobicContact CG-CD1 4.47Å; L276-Y300 HydrophobicContact CD1-CD1 4.42Å; L276-S301 VanDerWaalsContact CD1-OG 3.22Å; L276-S301 WeakPolarHBondContact CD1-OG 3.47Å
277	T	95.7	Very high	92.3	Very high	1 Å²	1	71.1 Å²	71.1	1%	0.006	37%	0.368	C	S	.	.	H	α-helix	trans	-62.9	-47	172.7	-59.8	0	0	0	0	111.3	G273 P274 L275 I279 Y280 M281 V293 M294	G273-T277 WeakPolarHBondContact O-CB 3.42Å; G273-T277 PolarHBondContact O-N 2.9Å; G273-T277 PolarHBondContact O-OG1 2.92Å; P274-T277 WeakPolarHBondContact O-CB 3.23Å; P274-T277 PolarHBondContact O-N 3.21Å; L275-T277 VanDerWaalsContact C-N 3.28Å; L275-T277 PolarHBondContact O-N 3.41Å; T277-I279 VanDerWaalsContact C-N 3.34Å; T277-I279 PolarHBondContact O-N 3.36Å; T277-Y280 PolarHBondContact O-N 3.18Å; T277-M281 HydrophobicContact CG2-CG 4.14Å; T277-M281 WeakPolarHBondContact O-CB 3.44Å; T277-M281 WeakPolarHBondContact O-CG 3.38Å; T277-M281 PolarHBondContact O-N 3.11Å; T277-V293 HydrophobicContact CG2-CB 4.35Å; T277-V293 HydrophobicContact CG2-CG1 3.99Å; T277-M294 HydrophobicContact CG2-CB 4.26Å; T277-M294 WeakPolarHBondContact OG1-CA 3.33Å; T277-M294 PolarHBondContact OG1-N 3.32Å
278	W	94	Very high	91.4	Very high	148 Å²	148	72.2 Å²	72.2	56%	0.561	38%	0.379	S	S	*	.	H	α-helix	trans	-59	-47.2	177	174.9	82.8	0	0	0	111	P274 L275 Y280 M281 R282	P274-W278 WeakPolarHBondContact O-CB 3.31Å; P274-W278 PolarHBondContact O-N 3.35Å; L275-W278 WeakPolarHBondContact O-CB 3.48Å; L275-W278 PolarHBondContact O-N 3.29Å; W278-Y280 PolarHBondContact O-N 3.29Å; W278-M281 PolarHBondContact O-N 2.94Å; W278-R282 HydrophobicContact CD2-CG 4.4Å; W278-R282 HydrophobicContact CZ2-CG 4.35Å; W278-R282 WeakPolarHBondContact O-CB 3.45Å; W278-R282 VanDerWaalsContact O-CG 3.23Å; W278-R282 WeakPolarHBondContact O-CG 3.46Å; W278-R282 PolarHBondContact O-N 2.85Å
279	I	94.1	Very high	90.8	Very high	61 Å²	61	77.3 Å²	77.3	31%	0.313	40%	0.4	S	S	.	.	H	α-helix	trans	-57.2	-51	175.2	-67.6	171.3	0	0	0	110.6	L275 L276 T277 M281 R282 F283	L275-I279 HydrophobicContact CD1-CD1 4.33Å; L275-I279 HydrophobicContact CG-CD1 4.2Å; L275-I279 WeakPolarHBondContact O-CG1 3.14Å; L275-I279 PolarHBondContact O-N 3.25Å; L276-I279 HydrophobicContact CD2-CD1 4.45Å; L276-I279 PolarHBondContact O-N 3.29Å; T277-I279 VanDerWaalsContact C-N 3.34Å; T277-I279 PolarHBondContact O-N 3.36Å; I279-M281 PolarHBondContact O-N 3.26Å; I279-R282 WeakPolarHBondContact O-CB 3.11Å; I279-R282 PolarHBondContact O-N 3.46Å; I279-F283 HydrophobicContact CG2-CD2 3.7Å; I279-F283 HydrophobicContact CG2-CE2 3.79Å; I279-F283 VanDerWaalsContact O-CD2 3.27Å; I279-F283 WeakPolarHBondContact O-CD2 3Å; I279-F283 PolarHBondContact O-N 3.28Å
280	Y	93.8	Very high	90.4	Very high	33 Å²	33	78.9 Å²	78.9	13%	0.129	41%	0.411	C	S	.	.	H	α-helix	trans	-61.2	-45.5	-178.8	172.6	-100.4	0	0	0	112.6	T23 Q26 L27 L276 T277 W278 R282 F283 A284 R286 V293 F297	T23-Y280 HydrophobicContact CG2-CE1 4.31Å; Q26-Y280 PolarHBondContact OE1-OH 2.73Å; L27-Y280 HydrophobicContact CD2-CE2 4.2Å; L276-Y280 VanDerWaalsContact O-CB 3.22Å; L276-Y280 WeakPolarHBondContact O-CB 3.14Å; L276-Y280 PolarHBondContact O-N 3.23Å; T277-Y280 PolarHBondContact O-N 3.18Å; W278-Y280 PolarHBondContact O-N 3.29Å; Y280-R282 VanDerWaalsContact C-N 3.29Å; Y280-R282 PolarHBondContact O-N 3.41Å; Y280-F283 PolarHBondContact O-N 2.97Å; Y280-A284 HydrophobicContact CE1-CB 4.43Å; Y280-A284 HydrophobicContact CE2-CB 4.36Å; Y280-A284 WeakPolarHBondContact O-CB 3.35Å; Y280-A284 PolarHBondContact O-N 2.92Å; Y280-R286 PolarHBondContact OH-NH1 3.09Å; Y280-V293 HydrophobicContact CD1-CG1 3.68Å; Y280-V293 HydrophobicContact CE1-CG1 3.96Å; Y280-F297 VanDerWaalsContact CB-CE2 3.48Å; Y280-F297 AromaticContact CD1-CE2 3.98Å; Y280-F297 HydrophobicContact CD1-CE2 3.98Å; Y280-F297 HydrophobicContact CD2-CE2 4.25Å; Y280-F297 HydrophobicContact CD2-CZ 4.01Å; Y280-F297 AromaticContact CG-CE2 3.64Å; Y280-F297 HydrophobicContact CG-CE2 3.64Å; Y280-F297 AromaticContact CG-CZ 3.84Å; Y280-F297 HydrophobicContact CG-CZ 3.84Å
281	M	90.8	Very high	90.2	Very high	22 Å²	22	81.1 Å²	81.1	11%	0.108	41%	0.412	C	S	.	.	H	α-helix	trans	-65.5	-34.9	-179.9	-65.5	-58.2	-81.9	0	0	111.6	T277 W278 I279 S285 R286 G288	T277-M281 HydrophobicContact CG2-CG 4.14Å; T277-M281 WeakPolarHBondContact O-CB 3.44Å; T277-M281 WeakPolarHBondContact O-CG 3.38Å; T277-M281 PolarHBondContact O-N 3.11Å; W278-M281 PolarHBondContact O-N 2.94Å; I279-M281 PolarHBondContact O-N 3.26Å; M281-S285 PolarHBondContact O-N 3.49Å; M281-R286 HydrophobicContact CE-CB 3.41Å; M281-R286 VanDerWaalsContact CE-CB 3.41Å; M281-R286 PolarHBondContact O-N 2.75Å; M281-R286 HydrophobicContact SD-CB 3.9Å; M281-G288 WeakPolarHBondContact CE-O 3.24Å
282	R	89.3	Confident	90.1	Very high	170 Å²	170	79.6 Å²	79.6	64%	0.642	41%	0.41	S	S	*	.	H	α-helix	trans	-62	-51.3	172.3	-72.4	-68.2	-160.8	137.4	1.9	111.7	W278 I279 Y280 S285	W278-R282 HydrophobicContact CD2-CG 4.4Å; W278-R282 HydrophobicContact CZ2-CG 4.35Å; W278-R282 WeakPolarHBondContact O-CB 3.45Å; W278-R282 VanDerWaalsContact O-CG 3.23Å; W278-R282 WeakPolarHBondContact O-CG 3.46Å; W278-R282 PolarHBondContact O-N 2.85Å; I279-R282 WeakPolarHBondContact O-CB 3.11Å; I279-R282 PolarHBondContact O-N 3.46Å; Y280-R282 VanDerWaalsContact C-N 3.29Å; Y280-R282 PolarHBondContact O-N 3.41Å; R282-S285 PolarHBondContact O-N 3.24Å
283	F	89	Confident	90	Very high	179 Å²	179	77.3 Å²	77.3	79%	0.785	40%	0.398	S	S	*	.	H	α-helix	trans	-71.5	-34.8	-178.3	-80.8	-70.5	0	0	0	113.7	I279 Y280 S285	I279-F283 HydrophobicContact CG2-CD2 3.7Å; I279-F283 HydrophobicContact CG2-CE2 3.79Å; I279-F283 VanDerWaalsContact O-CD2 3.27Å; I279-F283 WeakPolarHBondContact O-CD2 3Å; I279-F283 PolarHBondContact O-N 3.28Å; Y280-F283 PolarHBondContact O-N 2.97Å; F283-S285 PolarHBondContact O-N 3.47Å
284	A	87.2	Confident	89.9	Confident	34 Å²	34	78.6 Å²	78.6	28%	0.281	41%	0.405	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.9	1.8	176.5	0	0	0	0	0	113	Y280 R286	Y280-A284 HydrophobicContact CE1-CB 4.43Å; Y280-A284 HydrophobicContact CE2-CB 4.36Å; Y280-A284 WeakPolarHBondContact O-CB 3.35Å; Y280-A284 PolarHBondContact O-N 2.92Å; A284-R286 HydrophobicContact CB-CG 3.97Å; A284-R286 WeakPolarHBondContact O-CG 3.41Å; A284-R286 PolarHBondContact O-N 3.03Å; A284-R286 VanDerWaalsContact O-N 3.1Å
285	S	83.7	Confident	90	Very high	107 Å²	107	81.2 Å²	81.2	75%	0.748	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	47.6	37.5	-176.4	-55.6	0	0	0	0	113	M281 R282 F283	M281-S285 PolarHBondContact O-N 3.49Å; R282-S285 PolarHBondContact O-N 3.24Å; F283-S285 PolarHBondContact O-N 3.47Å
286	R	78.6	Confident	90	Very high	64 Å²	64	79.6 Å²	79.6	24%	0.242	41%	0.405	C	S	.	.			trans	-94	127.1	-178.3	-67.6	-141.1	-174.4	99.8	3.4	110.3	G21 T23 Y280 M281 A284	G21-R286 PolarHBondContact O-NH2 3.33Å; T23-R286 PolarHBondContact OG1-NH1 3.2Å; T23-R286 PolarHBondContact OG1-NH2 3.06Å; Y280-R286 PolarHBondContact OH-NH1 3.09Å; M281-R286 HydrophobicContact CE-CB 3.41Å; M281-R286 VanDerWaalsContact CE-CB 3.41Å; M281-R286 PolarHBondContact O-N 2.75Å; M281-R286 HydrophobicContact SD-CB 3.9Å; A284-R286 HydrophobicContact CB-CG 3.97Å; A284-R286 WeakPolarHBondContact O-CG 3.41Å; A284-R286 PolarHBondContact O-N 3.03Å; A284-R286 VanDerWaalsContact O-N 3.1Å
287	P	75.8	Confident	90.1	Very high	129 Å²	129	77.8 Å²	77.8	84%	0.838	40%	0.395	S	S	*	.			trans	-73.4	135.7	177.4	28.2	-31.8	0	0	0	110.7
288	G	76.3	Confident	90.2	Very high	57 Å²	57	78.5 Å²	78.5	59%	0.588	40%	0.4	S	S	*	.	S	Bend	trans	92.4	169.9	169.7	0	0	0	0	0	115.5	M281	M281-G288 WeakPolarHBondContact CE-O 3.24Å
289	F	84.1	Confident	90.4	Very high	119 Å²	119	76.3 Å²	76.3	52%	0.522	40%	0.399	S	S	.	.			trans	-91.4	137.8	175.9	173.9	-97.3	0	0	0	110	W291 M294	F289-W291 AromaticContact CE1-CD1 3.85Å; F289-W291 AromaticContact CE1-CD2 3.74Å; F289-W291 HydrophobicContact CE1-CD2 3.74Å; F289-W291 AromaticContact CE1-CE2 3.65Å; F289-W291 HydrophobicContact CE1-CE3 4.39Å; F289-W291 AromaticContact CE1-CG 3.86Å; F289-W291 HydrophobicContact CE1-CG 3.86Å; F289-W291 HydrophobicContact CE1-CZ2 4.18Å; F289-W291 AromaticContact CE1-NE1 3.72Å; F289-W291 HydrophobicContact CZ-CD2 4.31Å; F289-M294 HydrophobicContact CE2-CB 4.2Å; F289-M294 HydrophobicContact CE2-CG 4.36Å; F289-M294 HydrophobicContact CE2-SD 3.69Å; F289-M294 HydrophobicContact CZ-CB 4.03Å; F289-M294 HydrophobicContact CZ-CE 4.03Å; F289-M294 HydrophobicContact CZ-CG 4.29Å; F289-M294 HydrophobicContact CZ-SD 3.39Å; F289-M294 WeakPolarHBondContact CZ-SD 3.26Å
290	S	88.6	Confident	90.5	Very high	35 Å²	35	74.9 Å²	74.9	25%	0.245	39%	0.39	C	S	.	.			trans	-123.4	109.5	-177.8	179.2	0	0	0	0	110.9	V293 M294	S290-V293 PolarHBondContact O-N 2.69Å; S290-V293 WeakPolarHBondContact OG-CG2 3.46Å; S290-M294 PolarHBondContact O-N 2.86Å
291	W	93.1	Very high	90.7	Very high	180 Å²	180	73.6 Å²	73.6	68%	0.682	39%	0.385	S	S	*	.	H	α-helix	trans	-55	-45.1	176.9	-85	108	0	0	0	113.7	F289 V293 M294 L295	F289-W291 AromaticContact CE1-CD1 3.85Å; F289-W291 AromaticContact CE1-CD2 3.74Å; F289-W291 HydrophobicContact CE1-CD2 3.74Å; F289-W291 AromaticContact CE1-CE2 3.65Å; F289-W291 HydrophobicContact CE1-CE3 4.39Å; F289-W291 AromaticContact CE1-CG 3.86Å; F289-W291 HydrophobicContact CE1-CG 3.86Å; F289-W291 HydrophobicContact CE1-CZ2 4.18Å; F289-W291 AromaticContact CE1-NE1 3.72Å; F289-W291 HydrophobicContact CZ-CD2 4.31Å; W291-V293 VanDerWaalsContact C-N 3.31Å; W291-V293 PolarHBondContact O-N 2.88Å; W291-M294 HydrophobicContact CD2-CE 4.49Å; W291-M294 HydrophobicContact CE3-CE 3.44Å; W291-M294 VanDerWaalsContact CE3-CE 3.44Å; W291-M294 HydrophobicContact CH2-CE 3.85Å; W291-M294 HydrophobicContact CZ3-CE 3.06Å; W291-M294 PolarHBondContact O-N 3.23Å; W291-L295 PolarHBondContact O-N 3.3Å
292	P	94.2	Very high	91	Very high	96 Å²	96	73.7 Å²	73.7	62%	0.623	39%	0.386	S	S	*	.	H	α-helix	trans	-61.6	-37	176.9	-25.5	34.6	0	0	0	113.6	F296	P292-F296 WeakPolarHBondContact O-CB 3.44Å; P292-F296 PolarHBondContact O-N 3.38Å
293	V	94.4	Very high	91.3	Very high	4 Å²	4	66.7 Å²	66.7	2%	0.024	37%	0.366	C	S	.	.	H	α-helix	trans	-70.3	-39.1	177.9	178.1	0	0	0	0	110.2	T23 L27 T277 Y280 S290 W291 F296 F297	T23-V293 HydrophobicContact CG2-CG2 3.74Å; L27-V293 HydrophobicContact CD1-CG2 4.5Å; T277-V293 HydrophobicContact CG2-CB 4.35Å; T277-V293 HydrophobicContact CG2-CG1 3.99Å; Y280-V293 HydrophobicContact CD1-CG1 3.68Å; Y280-V293 HydrophobicContact CE1-CG1 3.96Å; S290-V293 PolarHBondContact O-N 2.69Å; S290-V293 WeakPolarHBondContact OG-CG2 3.46Å; W291-V293 VanDerWaalsContact C-N 3.31Å; W291-V293 PolarHBondContact O-N 2.88Å; V293-F296 WeakPolarHBondContact O-CB 3.45Å; V293-F296 PolarHBondContact O-N 3.46Å; V293-F297 HydrophobicContact CG1-CD2 3.69Å; V293-F297 HydrophobicContact CG1-CE2 3.58Å; V293-F297 WeakPolarHBondContact O-CD2 3.48Å; V293-F297 PolarHBondContact O-N 3.4Å
294	M	96.4	Very high	91.7	Very high	27 Å²	27	60.4 Å²	60.4	13%	0.133	34%	0.341	C	S	.	.	H	α-helix	trans	-64.5	-44.4	174.3	-167.4	-174.6	75.1	0	0	113.2	P274 T277 F289 S290 W291 F296 F297 S298	P274-M294 HydrophobicContact CB-SD 3.99Å; P274-M294 HydrophobicContact CG-CG 4.25Å; P274-M294 HydrophobicContact CG-SD 3.65Å; T277-M294 HydrophobicContact CG2-CB 4.26Å; T277-M294 WeakPolarHBondContact OG1-CA 3.33Å; T277-M294 PolarHBondContact OG1-N 3.32Å; F289-M294 HydrophobicContact CE2-CB 4.2Å; F289-M294 HydrophobicContact CE2-CG 4.36Å; F289-M294 HydrophobicContact CE2-SD 3.69Å; F289-M294 HydrophobicContact CZ-CB 4.03Å; F289-M294 HydrophobicContact CZ-CE 4.03Å; F289-M294 HydrophobicContact CZ-CG 4.29Å; F289-M294 HydrophobicContact CZ-SD 3.39Å; F289-M294 WeakPolarHBondContact CZ-SD 3.26Å; S290-M294 PolarHBondContact O-N 2.86Å; W291-M294 HydrophobicContact CD2-CE 4.49Å; W291-M294 HydrophobicContact CE3-CE 3.44Å; W291-M294 VanDerWaalsContact CE3-CE 3.44Å; W291-M294 HydrophobicContact CH2-CE 3.85Å; W291-M294 HydrophobicContact CZ3-CE 3.06Å; W291-M294 PolarHBondContact O-N 3.23Å; M294-F296 VanDerWaalsContact C-N 3.29Å; M294-F296 PolarHBondContact O-N 3.39Å; M294-F297 PolarHBondContact O-N 3.01Å; M294-S298 WeakPolarHBondContact O-CB 3.39Å; M294-S298 PolarHBondContact O-N 3.32Å; M294-S298 PolarHBondContact O-OG 3.42Å
295	L	97.1	Very high	92.1	Very high	105 Å²	105	59.8 Å²	59.8	55%	0.55	33%	0.333	S	S	.	.	H	α-helix	trans	-60.4	-43.5	175.1	-178.2	62.2	0	0	0	110.8	W291 S298 L299	W291-L295 PolarHBondContact O-N 3.3Å; L295-S298 PolarHBondContact O-N 3.49Å; L295-L299 HydrophobicContact CD1-CD1 4.25Å; L295-L299 HydrophobicContact CD1-CG 4.3Å; L295-L299 HydrophobicContact CG-CD1 4.19Å; L295-L299 WeakPolarHBondContact O-CG 3.41Å; L295-L299 PolarHBondContact O-N 3.44Å
296	F	97.5	Very high	92.6	Very high	52 Å²	52	55 Å²	55	23%	0.228	30%	0.299	C	S	.	.	H	α-helix	trans	-56.4	-52.7	174.7	172.5	-88.4	0	0	0	111.5	L27 L30 T31 P292 V293 M294 S298 L299 Y300	L27-F296 HydrophobicContact CB-CD1 4.29Å; L27-F296 HydrophobicContact CB-CD2 4.28Å; L27-F296 HydrophobicContact CB-CE1 3.97Å; L27-F296 HydrophobicContact CB-CE2 3.93Å; L27-F296 HydrophobicContact CB-CG 4.45Å; L27-F296 HydrophobicContact CB-CZ 3.77Å; L27-F296 HydrophobicContact CD1-CB 4.16Å; L27-F296 HydrophobicContact CD1-CD1 3.84Å; L27-F296 HydrophobicContact CD1-CD2 4.22Å; L27-F296 HydrophobicContact CD1-CE1 4.35Å; L27-F296 HydrophobicContact CD1-CG 3.79Å; L27-F296 HydrophobicContact CD2-CD1 3.74Å; L27-F296 HydrophobicContact CD2-CE1 3.66Å; L27-F296 HydrophobicContact CD2-CZ 4.34Å; L27-F296 HydrophobicContact CG-CD1 4.14Å; L27-F296 HydrophobicContact CG-CE1 4.17Å; L27-F296 HydrophobicContact CG-CG 4.46Å; L27-F296 HydrophobicContact CG-CZ 4.47Å; L30-F296 HydrophobicContact CD2-CE1 4.39Å; T31-F296 VanDerWaalsContact OG1-CZ 3.3Å; T31-F296 WeakPolarHBondContact OG1-CZ 3.48Å; P292-F296 WeakPolarHBondContact O-CB 3.44Å; P292-F296 PolarHBondContact O-N 3.38Å; V293-F296 WeakPolarHBondContact O-CB 3.45Å; V293-F296 PolarHBondContact O-N 3.46Å; M294-F296 VanDerWaalsContact C-N 3.29Å; M294-F296 PolarHBondContact O-N 3.39Å; F296-S298 VanDerWaalsContact C-N 3.3Å; F296-S298 PolarHBondContact O-N 3.12Å; F296-L299 PolarHBondContact O-N 3.04Å; F296-Y300 HydrophobicContact CE1-CD2 4.17Å; F296-Y300 HydrophobicContact CE1-CG 4.38Å; F296-Y300 HydrophobicContact CZ-CD2 4.08Å; F296-Y300 WeakPolarHBondContact O-CB 3.4Å; F296-Y300 PolarHBondContact O-N 3.01Å
297	F	98	Very high	93.4	Very high	10 Å²	10	54.2 Å²	54.2	4%	0.044	30%	0.3	C	S	.	.	H	α-helix	trans	-66.9	-32.1	-178.6	-80.4	-61.5	0	0	0	113	L27 L30 L276 Y280 V293 M294 Y300 S301	L27-F297 HydrophobicContact CD2-CE2 4.09Å; L27-F297 HydrophobicContact CD2-CZ 3.87Å; L30-F297 HydrophobicContact CD2-CE1 3.71Å; L30-F297 HydrophobicContact CD2-CZ 4.17Å; L276-F297 HydrophobicContact CB-CB 3.93Å; L276-F297 HydrophobicContact CB-CD1 3.68Å; L276-F297 HydrophobicContact CB-CD2 4.3Å; L276-F297 HydrophobicContact CB-CE1 4.25Å; L276-F297 HydrophobicContact CB-CG 3.71Å; L276-F297 HydrophobicContact CD1-CD1 3.98Å; L276-F297 HydrophobicContact CG-CD1 4.47Å; Y280-F297 VanDerWaalsContact CB-CE2 3.48Å; Y280-F297 AromaticContact CD1-CE2 3.98Å; Y280-F297 HydrophobicContact CD1-CE2 3.98Å; Y280-F297 HydrophobicContact CD2-CE2 4.25Å; Y280-F297 HydrophobicContact CD2-CZ 4.01Å; Y280-F297 AromaticContact CG-CE2 3.64Å; Y280-F297 HydrophobicContact CG-CE2 3.64Å; Y280-F297 AromaticContact CG-CZ 3.84Å; Y280-F297 HydrophobicContact CG-CZ 3.84Å; V293-F297 HydrophobicContact CG1-CD2 3.69Å; V293-F297 HydrophobicContact CG1-CE2 3.58Å; V293-F297 WeakPolarHBondContact O-CD2 3.48Å; V293-F297 PolarHBondContact O-N 3.4Å; M294-F297 PolarHBondContact O-N 3.01Å; F297-Y300 HydrophobicContact CD1-CD1 4.43Å; F297-Y300 PolarHBondContact O-N 2.91Å; F297-S301 WeakPolarHBondContact O-CB 3.34Å; F297-S301 PolarHBondContact O-N 3.37Å; F297-S301 PolarHBondContact O-OG 2.85Å; F297-S301 VanDerWaalsContact O-OG 3.12Å
298	S	97.9	Very high	94.3	Very high	16 Å²	16	49.7 Å²	49.7	11%	0.112	27%	0.27	C	S	.	.	H	α-helix	trans	-61.8	-51.5	174.3	-52.9	0	0	0	0	110.5	G269 M294 L295 F296 S301 M302	G269-S298 WeakPolarHBondContact O-CB 3.44Å; G269-S298 PolarHBondContact O-OG 3.5Å; M294-S298 WeakPolarHBondContact O-CB 3.39Å; M294-S298 PolarHBondContact O-N 3.32Å; M294-S298 PolarHBondContact O-OG 3.42Å; L295-S298 PolarHBondContact O-N 3.49Å; F296-S298 VanDerWaalsContact C-N 3.3Å; F296-S298 PolarHBondContact O-N 3.12Å; S298-S301 PolarHBondContact O-N 3.15Å; S298-M302 WeakPolarHBondContact O-CB 3.39Å; S298-M302 VanDerWaalsContact O-CG 3.23Å; S298-M302 WeakPolarHBondContact O-CG 3.29Å; S298-M302 PolarHBondContact O-N 3.3Å
299	L	97.5	Very high	95.1	Very high	102 Å²	102	47.1 Å²	47.1	53%	0.534	24%	0.243	S	C	.	.	H	α-helix	trans	-67	-37.2	178.3	-65.7	175.5	0	0	0	112.4	L295 F296 M302 G303	L295-L299 HydrophobicContact CD1-CD1 4.25Å; L295-L299 HydrophobicContact CD1-CG 4.3Å; L295-L299 HydrophobicContact CG-CD1 4.19Å; L295-L299 WeakPolarHBondContact O-CG 3.41Å; L295-L299 PolarHBondContact O-N 3.44Å; F296-L299 PolarHBondContact O-N 3.04Å; L299-M302 HydrophobicContact CD2-SD 4.4Å; L299-M302 PolarHBondContact O-N 3Å; L299-G303 PolarHBondContact O-N 3.39Å
300	Y	97.8	Very high	95.6	Very high	32 Å²	32	41.6 Å²	41.6	13%	0.125	22%	0.219	C	C	.	.	H	α-helix	trans	-59.8	-49.3	174.8	172.5	-84.1	0	0	0	111	L30 T34 F35 L276 F296 F297 G303 L304	L30-Y300 HydrophobicContact CD2-CE2 4.35Å; L30-Y300 HydrophobicContact CG-CE2 4.15Å; T34-Y300 VanDerWaalsContact CB-OH 3.31Å; T34-Y300 WeakPolarHBondContact CB-OH 3.11Å; T34-Y300 HydrophobicContact CG2-CE2 4.21Å; T34-Y300 WeakPolarHBondContact CG2-OH 3.4Å; T34-Y300 PolarHBondContact OG1-OH 2.73Å; F35-Y300 HydrophobicContact CD2-CE2 4.29Å; F35-Y300 AromaticContact CE2-CD2 3.45Å; F35-Y300 HydrophobicContact CE2-CD2 3.45Å; F35-Y300 VanDerWaalsContact CE2-CD2 3.45Å; F35-Y300 AromaticContact CE2-CE2 3.47Å; F35-Y300 HydrophobicContact CE2-CE2 3.47Å; F35-Y300 VanDerWaalsContact CE2-CE2 3.47Å; F35-Y300 HydrophobicContact CE2-CG 4.32Å; F35-Y300 AromaticContact CZ-CD2 3.97Å; F35-Y300 HydrophobicContact CZ-CD2 3.97Å; F35-Y300 HydrophobicContact CZ-CE2 4.06Å; F35-Y300 HydrophobicContact CZ-CG 4.43Å; L276-Y300 HydrophobicContact CD1-CD1 4.42Å; F296-Y300 HydrophobicContact CE1-CD2 4.17Å; F296-Y300 HydrophobicContact CE1-CG 4.38Å; F296-Y300 HydrophobicContact CZ-CD2 4.08Å; F296-Y300 WeakPolarHBondContact O-CB 3.4Å; F296-Y300 PolarHBondContact O-N 3.01Å; F297-Y300 HydrophobicContact CD1-CD1 4.43Å; F297-Y300 PolarHBondContact O-N 2.91Å; Y300-G303 PolarHBondContact O-N 2.97Å; Y300-L304 HydrophobicContact CE1-CD2 4.41Å; Y300-L304 WeakPolarHBondContact O-CB 3.41Å; Y300-L304 PolarHBondContact O-N 2.93Å
301	S	97.4	Very high	95.8	Very high	5 Å²	5	40.7 Å²	40.7	4%	0.035	21%	0.21	C	C	.	.	H	α-helix	trans	-64	-44	178.2	-69.6	0	0	0	0	111.9	L272 L276 F297 S298 L304 V305	L272-S301 WeakPolarHBondContact CB-OG 3.23Å; L276-S301 VanDerWaalsContact CD1-OG 3.22Å; L276-S301 WeakPolarHBondContact CD1-OG 3.47Å; F297-S301 WeakPolarHBondContact O-CB 3.34Å; F297-S301 PolarHBondContact O-N 3.37Å; F297-S301 PolarHBondContact O-OG 2.85Å; F297-S301 VanDerWaalsContact O-OG 3.12Å; S298-S301 PolarHBondContact O-N 3.15Å; S301-L304 PolarHBondContact O-N 3.31Å; S301-V305 WeakPolarHBondContact O-CG2 3.42Å; S301-V305 PolarHBondContact O-N 3.45Å
302	M	96.9	Very high	95.8	Very high	24 Å²	24	35.7 Å²	35.7	12%	0.118	19%	0.192	C	C	.	.	H	α-helix	trans	-56.5	-52.6	174.2	-74.3	173	73.4	0	0	111.2	W265 V266 S298 L299 L304 V305 E306	W265-M302 HydrophobicContact CD2-CB 4.43Å; W265-M302 HydrophobicContact CD2-CE 3.65Å; W265-M302 HydrophobicContact CE3-CE 3.78Å; W265-M302 HydrophobicContact CG-CE 4.06Å; W265-M302 HydrophobicContact CG-CG 4.49Å; W265-M302 HydrophobicContact CH2-CE 4.47Å; W265-M302 HydrophobicContact CZ2-CB 4Å; W265-M302 HydrophobicContact CZ2-CE 4.36Å; W265-M302 HydrophobicContact CZ3-CE 4.2Å; W265-M302 VanDerWaalsContact NE1-CA 3.32Å; W265-M302 PolarHBondContact NE1-O 3.36Å; W265-M302 WeakPolarHBondContact O-CG 3.49Å; V266-M302 HydrophobicContact CG2-CE 4.06Å; S298-M302 WeakPolarHBondContact O-CB 3.39Å; S298-M302 VanDerWaalsContact O-CG 3.23Å; S298-M302 WeakPolarHBondContact O-CG 3.29Å; S298-M302 PolarHBondContact O-N 3.3Å; L299-M302 HydrophobicContact CD2-SD 4.4Å; L299-M302 PolarHBondContact O-N 3Å; M302-L304 VanDerWaalsContact C-N 3.31Å; M302-L304 PolarHBondContact O-N 3.4Å; M302-V305 VanDerWaalsContact O-CG2 3.29Å; M302-V305 WeakPolarHBondContact O-CG2 3.47Å; M302-V305 PolarHBondContact O-N 2.96Å; M302-E306 PolarHBondContact O-N 3.46Å; M302-E306 VanDerWaalsContact O-N 3.15Å
303	G	95.9	Very high	95.8	Very high	23 Å²	23	34.5 Å²	34.5	24%	0.237	18%	0.177	C	C	.	.	H	α-helix	trans	-58.9	-42.3	178	0	0	0	0	0	112.5	L299 Y300 E306 L307	L299-G303 PolarHBondContact O-N 3.39Å; Y300-G303 PolarHBondContact O-N 2.97Å; G303-E306 PolarHBondContact O-N 2.7Å; G303-L307 WeakPolarHBondContact O-CB 3.45Å; G303-L307 WeakPolarHBondContact O-CG 3.29Å; G303-L307 PolarHBondContact O-N 3.41Å
304	L	96.5	Very high	95.7	Very high	48 Å²	48	34.3 Å²	34.3	25%	0.251	18%	0.176	S	C	.	.	H	α-helix	trans	-62.2	-49.8	179.6	-174.6	63	0	0	0	112.4	T34 F35 A39 Y300 S301 M302 E306 L307 V308	T34-L304 HydrophobicContact CG2-CD1 4.18Å; F35-L304 HydrophobicContact CE1-CB 4.04Å; F35-L304 HydrophobicContact CE1-CD1 3.99Å; F35-L304 HydrophobicContact CZ-CB 4.13Å; A39-L304 HydrophobicContact CB-CD1 4.29Å; Y300-L304 HydrophobicContact CE1-CD2 4.41Å; Y300-L304 WeakPolarHBondContact O-CB 3.41Å; Y300-L304 PolarHBondContact O-N 2.93Å; S301-L304 PolarHBondContact O-N 3.31Å; M302-L304 VanDerWaalsContact C-N 3.31Å; M302-L304 PolarHBondContact O-N 3.4Å; L304-E306 VanDerWaalsContact C-N 3.31Å; L304-E306 PolarHBondContact O-N 2.87Å; L304-L307 PolarHBondContact O-N 3.46Å; L304-V308 HydrophobicContact CD1-CG2 4.11Å; L304-V308 HydrophobicContact CG-CG2 4.41Å; L304-V308 WeakPolarHBondContact O-CB 3.49Å; L304-V308 VanDerWaalsContact O-CG2 3.29Å; L304-V308 WeakPolarHBondContact O-CG2 3.42Å; L304-V308 PolarHBondContact O-N 3.26Å
305	V	95.3	Very high	95.6	Very high	20 Å²	20	37.2 Å²	37.2	12%	0.121	19%	0.189	C	C	.	.	H	α-helix	trans	-67.2	-32.4	-178.3	-62.8	0	0	0	0	112.8	Y254 V268 S301 M302 G309	Y254-V305 HydrophobicContact CD2-CG2 4.2Å; Y254-V305 HydrophobicContact CE2-CB 4.1Å; Y254-V305 HydrophobicContact CE2-CG2 3.6Å; V268-V305 HydrophobicContact CG1-CG1 4.04Å; V268-V305 HydrophobicContact CG1-CG2 4.07Å; S301-V305 WeakPolarHBondContact O-CG2 3.42Å; S301-V305 PolarHBondContact O-N 3.45Å; M302-V305 VanDerWaalsContact O-CG2 3.29Å; M302-V305 WeakPolarHBondContact O-CG2 3.47Å; M302-V305 PolarHBondContact O-N 2.96Å; V305-G309 CarbonylContact O-C 3.55Å; V305-G309 PolarHBondContact O-N 3.21Å
306	E	95.1	Very high	95.5	Very high	6 Å²	6	36.9 Å²	36.9	3%	0.028	19%	0.188	C	C	.	.	H	α-helix	trans	-68.3	-43.8	174.7	174	56.5	-165.5	0	0	111.6	Y50 H253 Y254 I255 W265 M302 G303 L304 G309	Y50-E306 WeakPolarHBondContact CD2-O 3.45Å; Y50-E306 HydrophobicContact CE2-CG 4.4Å; Y50-E306 WeakPolarHBondContact CE2-O 3.45Å; Y50-E306 PolarHBondContact OH-OE1 2.96Å; H253-E306 WeakPolarHBondContact CB-OE1 3.42Å; H253-E306 IonicContact CG-OE1 3.84Å; H253-E306 IonicContact ND1-OE1 3.75Å; Y254-E306 WeakPolarHBondContact CA-OE2 3.25Å; Y254-E306 WeakPolarHBondContact CB-OE2 3.35Å; Y254-E306 HydrophobicContact CD2-CB 4.31Å; Y254-E306 WeakPolarHBondContact CD2-OE2 3.34Å; Y254-E306 PolarHBondContact N-OE2 2.91Å; I255-E306 HydrophobicContact CD1-CG 3.86Å; I255-E306 HydrophobicContact CG1-CG 4.04Å; W265-E306 HydrophobicContact CZ2-CB 4.05Å; W265-E306 HydrophobicContact CZ2-CG 4.44Å; M302-E306 PolarHBondContact O-N 3.46Å; M302-E306 VanDerWaalsContact O-N 3.15Å; G303-E306 PolarHBondContact O-N 2.7Å; L304-E306 VanDerWaalsContact C-N 3.31Å; L304-E306 PolarHBondContact O-N 2.87Å; E306-G309 PolarHBondContact O-N 3.34Å
307	L	94.9	Very high	95.3	Very high	49 Å²	49	36.7 Å²	36.7	26%	0.257	19%	0.185	S	C	.	.	H	α-helix	trans	-71.1	-36.8	-178.7	-69.4	172.3	0	0	0	112.8	F35 S49 Y50 F51 G303 L304	F35-L307 HydrophobicContact CD1-CD1 3.6Å; F35-L307 HydrophobicContact CE1-CD1 3.73Å; S49-L307 PolarHBondContact OG-O 3.36Å; Y50-L307 HydrophobicContact CD1-CD2 4.19Å; Y50-L307 HydrophobicContact CD2-CD2 4.15Å; Y50-L307 HydrophobicContact CG-CD2 3.78Å; Y50-L307 PolarHBondContact N-O 2.84Å; F51-L307 HydrophobicContact CD2-CB 4.38Å; F51-L307 HydrophobicContact CE2-CB 3.59Å; F51-L307 HydrophobicContact CE2-CD1 4.38Å; F51-L307 HydrophobicContact CZ-CB 4.05Å; F51-L307 HydrophobicContact CZ-CD1 4.01Å; G303-L307 WeakPolarHBondContact O-CB 3.45Å; G303-L307 WeakPolarHBondContact O-CG 3.29Å; G303-L307 PolarHBondContact O-N 3.41Å; L304-L307 PolarHBondContact O-N 3.46Å
308	V	94.9	Very high	95.2	Very high	34 Å²	34	38.5 Å²	38.5	21%	0.206	19%	0.192	C	C	.	.	H	α-helix	trans	-67.3	-44.2	172.3	174.8	0	0	0	0	109.8	L46 S49 L304 Y312	L46-V308 HydrophobicContact CD1-CG1 4.25Å; S49-V308 WeakPolarHBondContact CA-O 3.36Å; S49-V308 WeakPolarHBondContact CB-O 3.43Å; S49-V308 PolarHBondContact OG-O 2.97Å; L304-V308 HydrophobicContact CD1-CG2 4.11Å; L304-V308 HydrophobicContact CG-CG2 4.41Å; L304-V308 WeakPolarHBondContact O-CB 3.49Å; L304-V308 VanDerWaalsContact O-CG2 3.29Å; L304-V308 WeakPolarHBondContact O-CG2 3.42Å; L304-V308 PolarHBondContact O-N 3.26Å; V308-Y312 HydrophobicContact CG1-CD2 4.08Å; V308-Y312 WeakPolarHBondContact O-CD2 3.36Å
309	G	93.2	Very high	95.1	Very high	2 Å²	2	44.9 Å²	44.9	2%	0.021	22%	0.224	C	C	.	.			trans	122	127.8	178.4	0	0	0	0	0	111.4	V305 E306 H311 Y312	V305-G309 CarbonylContact O-C 3.55Å; V305-G309 PolarHBondContact O-N 3.21Å; E306-G309 PolarHBondContact O-N 3.34Å; G309-H311 VanDerWaalsContact C-N 3.27Å; G309-H311 PolarHBondContact O-N 3.21Å; G309-Y312 PolarHBondContact O-N 2.82Å
310	R	94.1	Very high	95	Very high	4 Å²	4	42 Å²	42	2%	0.015	21%	0.212	C	C	.	.	H	α-helix	trans	-57.5	-37	179.8	172.1	170.2	178.2	-95.3	2.2	113	Q252 Y254 E264 Y312 F313 L314 E381	Q252-R310 VanDerWaalsContact O-CB 3.23Å; Q252-R310 WeakPolarHBondContact O-CB 3.45Å; Q252-R310 WeakPolarHBondContact O-CD 3.27Å; Q252-R310 WeakPolarHBondContact O-CG 3.31Å; Y254-R310 HydrophobicContact CD1-CG 4.32Å; Y254-R310 HydrophobicContact CD2-CB 3.88Å; Y254-R310 HydrophobicContact CD2-CG 4.41Å; Y254-R310 HydrophobicContact CE1-CB 4.43Å; Y254-R310 VanDerWaalsContact CE1-CD 3.42Å; Y254-R310 HydrophobicContact CE1-CG 3.93Å; Y254-R310 HydrophobicContact CE2-CB 3.66Å; Y254-R310 HydrophobicContact CE2-CG 3.98Å; Y254-R310 HydrophobicContact CG-CB 4.33Å; E264-R310 IonicContact OE2-CZ 3.88Å; E264-R310 VanDerWaalsContact OE2-CZ 3.3Å; E264-R310 IonicContact OE2-NE 3.09Å; E264-R310 PolarHBondContact OE2-NE 2.95Å; E264-R310 IonicContact OE2-NH2 3.22Å; E264-R310 PolarHBondContact OE2-NH2 3.1Å; R310-Y312 VanDerWaalsContact C-N 3.27Å; R310-Y312 PolarHBondContact O-N 3.36Å; R310-F313 CarbonylContact O-C 3.39Å; R310-F313 WeakPolarHBondContact O-CA 3.35Å; R310-F313 WeakPolarHBondContact O-CB 3.29Å; R310-F313 PolarHBondContact O-N 3.49Å; R310-L314 HydrophobicContact CG-CD1 4.27Å; R310-L314 HydrophobicContact CG-CG 4.07Å; R310-L314 PolarHBondContact O-N 3.24Å; R310-E381 IonicContact CZ-OE1 3.64Å; R310-E381 IonicContact CZ-OE2 3.54Å; R310-E381 IonicContact NH1-OE1 3.28Å; R310-E381 PolarHBondContact NH1-OE1 2.92Å; R310-E381 IonicContact NH1-OE2 3.67Å; R310-E381 PolarHBondContact NH1-OE2 3.4Å; R310-E381 VanDerWaalsContact NH1-OE2 3.16Å; R310-E381 IonicContact NH2-OE1 3.23Å; R310-E381 IonicContact NH2-OE2 2.91Å; R310-E381 PolarHBondContact NH2-OE2 2.86Å
311	H	93	Very high	94.8	Very high	16 Å²	16	42.4 Å²	42.4	7%	0.074	22%	0.219	C	C	.	.	H	α-helix	trans	-60.4	-35.6	-177.4	66.4	-85.7	0	0	0	112.6	E249 Q252 G309 F313 L314 E315	E249-H311 HydrophobicContact CB-CB 4.19Å; E249-H311 HydrophobicContact CG-CB 4.29Å; Q252-H311 HydrophobicContact CB-CB 4.4Å; Q252-H311 VanDerWaalsContact OE1-CB 3.31Å; G309-H311 VanDerWaalsContact C-N 3.27Å; G309-H311 PolarHBondContact O-N 3.21Å; H311-F313 VanDerWaalsContact C-N 3.29Å; H311-F313 PolarHBondContact O-N 3.41Å; H311-L314 WeakPolarHBondContact O-CB 3.49Å; H311-L314 PolarHBondContact O-N 2.96Å; H311-E315 PolarHBondContact O-N 2.98Å
312	Y	93.9	Very high	94.6	Very high	74 Å²	74	45.2 Å²	45.2	29%	0.29	24%	0.238	S	C	.	.	H	α-helix	trans	-64.7	-33.7	171.8	-65.6	-62.4	0	0	0	113.2	L46 L47 V308 G309 R310 E315	L46-Y312 VanDerWaalsContact C-OH 3.23Å; L46-Y312 VanDerWaalsContact CA-OH 3.29Å; L46-Y312 WeakPolarHBondContact CA-OH 3.22Å; L46-Y312 HydrophobicContact CB-CE2 3.73Å; L46-Y312 WeakPolarHBondContact CB-OH 3.4Å; L46-Y312 HydrophobicContact CD1-CD2 4.48Å; L46-Y312 HydrophobicContact CD1-CE2 4.17Å; L46-Y312 HydrophobicContact CD2-CE1 4.1Å; L46-Y312 HydrophobicContact CG-CE2 4.35Å; L47-Y312 PolarHBondContact N-OH 3.33Å; L47-Y312 VanDerWaalsContact N-OH 3.1Å; L47-Y312 PolarHBondContact O-OH 2.9Å; V308-Y312 HydrophobicContact CG1-CD2 4.08Å; V308-Y312 WeakPolarHBondContact O-CD2 3.36Å; G309-Y312 PolarHBondContact O-N 2.82Å; R310-Y312 VanDerWaalsContact C-N 3.27Å; R310-Y312 PolarHBondContact O-N 3.36Å; Y312-E315 WeakPolarHBondContact O-CB 3.19Å
313	F	93.2	Very high	94.5	Very high	71 Å²	71	48.2 Å²	48.2	31%	0.311	25%	0.254	S	S	.	.	H	α-helix	trans	-74.4	-33.7	176.2	-164.4	-107.9	0	0	0	111.7	Y254 V268 R310 H311 E315 L316	Y254-F313 WeakPolarHBondContact OH-CD1 3.4Å; V268-F313 HydrophobicContact CG2-CD1 4.47Å; V268-F313 HydrophobicContact CG2-CE1 3.76Å; V268-F313 HydrophobicContact CG2-CZ 4.12Å; R310-F313 CarbonylContact O-C 3.39Å; R310-F313 WeakPolarHBondContact O-CA 3.35Å; R310-F313 WeakPolarHBondContact O-CB 3.29Å; R310-F313 PolarHBondContact O-N 3.49Å; H311-F313 VanDerWaalsContact C-N 3.29Å; H311-F313 PolarHBondContact O-N 3.41Å; F313-E315 PolarHBondContact O-N 2.91Å; F313-L316 HydrophobicContact CD2-CD1 3.69Å; F313-L316 HydrophobicContact CE2-CD1 3.52Å; F313-L316 HydrophobicContact CG-CD1 4.38Å; F313-L316 HydrophobicContact CZ-CD1 4.09Å; F313-L316 WeakPolarHBondContact O-CB 3.28Å; F313-L316 WeakPolarHBondContact O-CG 3.32Å; F313-L316 PolarHBondContact O-N 3.39Å
314	L	93.8	Very high	94.5	Very high	1 Å²	1	47.2 Å²	47.2	1%	0.005	24%	0.244	C	C	.	.	H	α-helix	trans	-62.1	-27.8	175.7	-71.1	177	0	0	0	113	R310 H311 L316 R317 E381 P382	R310-L314 HydrophobicContact CG-CD1 4.27Å; R310-L314 HydrophobicContact CG-CG 4.07Å; R310-L314 PolarHBondContact O-N 3.24Å; H311-L314 WeakPolarHBondContact O-CB 3.49Å; H311-L314 PolarHBondContact O-N 2.96Å; L314-L316 PolarHBondContact O-N 3.39Å; L314-L316 VanDerWaalsContact O-N 3.12Å; L314-R317 VanDerWaalsContact CD2-CZ 3.46Å; L314-R317 VanDerWaalsContact O-CB 3.27Å; L314-R317 WeakPolarHBondContact O-CB 3.42Å; L314-R317 PolarHBondContact O-N 2.98Å; L314-E381 HydrophobicContact CD1-CB 4.09Å; L314-E381 HydrophobicContact CD2-CB 4.45Å; L314-P382 HydrophobicContact CB-CB 4.17Å
315	E	94.1	Very high	94.3	Very high	88 Å²	88	46 Å²	46	41%	0.411	24%	0.239	S	C	.	.	G	3₁₀ helix	trans	-57.2	-27	176.1	-67.4	-63	120.8	0	0	112.7	H311 Y312 F313 R317 R318	H311-E315 PolarHBondContact O-N 2.98Å; Y312-E315 WeakPolarHBondContact O-CB 3.19Å; F313-E315 PolarHBondContact O-N 2.91Å; E315-R317 PolarHBondContact O-N 3.5Å; E315-R318 VanDerWaalsContact O-CB 3.32Å; E315-R318 WeakPolarHBondContact O-CB 3.47Å; E315-R318 WeakPolarHBondContact O-CG 3.4Å; E315-R318 PolarHBondContact O-N 2.94Å; E315-R318 IonicContact OE1-CZ 3.91Å; E315-R318 IonicContact OE1-NE 2.8Å; E315-R318 PolarHBondContact OE1-NE 2.8Å; E315-R318 IonicContact OE1-NH2 2.9Å; E315-R318 PolarHBondContact OE1-NH2 2.93Å; E315-R318 WeakPolarHBondContact OE2-CD 3.43Å; E315-R318 IonicContact OE2-CZ 2.88Å; E315-R318 IonicContact OE2-NE 3.2Å; E315-R318 PolarHBondContact OE2-NE 3.34Å; E315-R318 IonicContact OE2-NH2 3.65Å
316	L	93.7	Very high	94.2	Very high	98 Å²	98	46.1 Å²	46.1	51%	0.513	24%	0.24	S	C	.	.	G	3₁₀ helix	trans	-62	-23.8	174.2	-62.4	175.6	0	0	0	112.9	F313 L314 R318 L319	F313-L316 HydrophobicContact CD2-CD1 3.69Å; F313-L316 HydrophobicContact CE2-CD1 3.52Å; F313-L316 HydrophobicContact CG-CD1 4.38Å; F313-L316 HydrophobicContact CZ-CD1 4.09Å; F313-L316 WeakPolarHBondContact O-CB 3.28Å; F313-L316 WeakPolarHBondContact O-CG 3.32Å; F313-L316 PolarHBondContact O-N 3.39Å; L314-L316 PolarHBondContact O-N 3.39Å; L314-L316 VanDerWaalsContact O-N 3.12Å; L316-R318 PolarHBondContact O-N 3.18Å; L316-L319 WeakPolarHBondContact O-CD1 3.34Å; L316-L319 VanDerWaalsContact O-CG 3.25Å; L316-L319 WeakPolarHBondContact O-CG 3.49Å; L316-L319 PolarHBondContact O-N 3.07Å
317	R	95.1	Very high	94.1	Very high	48 Å²	48	46.5 Å²	46.5	18%	0.181	24%	0.242	C	C	.	.	G	3₁₀ helix	trans	-74.1	-14	176.8	-63.5	175.5	178.7	-177.2	0.2	112.6	E264 L314 E315 L319 S320 L323 S325 P382	E264-R317 IonicContact OE1-CZ 3.3Å; E264-R317 IonicContact OE1-NE 2.81Å; E264-R317 IonicContact OE1-NH2 3.85Å; E264-R317 PolarHBondContact OE1-NH2 2.97Å; E264-R317 IonicContact OE2-NH2 3.81Å; E264-R317 PolarHBondContact OE2-NH2 2.86Å; L314-R317 VanDerWaalsContact CD2-CZ 3.46Å; L314-R317 VanDerWaalsContact O-CB 3.27Å; L314-R317 WeakPolarHBondContact O-CB 3.42Å; L314-R317 PolarHBondContact O-N 2.98Å; E315-R317 PolarHBondContact O-N 3.5Å; R317-L319 PolarHBondContact O-N 3.18Å; R317-L319 VanDerWaalsContact O-N 3.17Å; R317-S320 VanDerWaalsContact O-O 3.11Å; R317-L323 HydrophobicContact CB-CB 4.04Å; R317-L323 WeakPolarHBondContact CB-O 3.33Å; R317-L323 VanDerWaalsContact CD-O 3.26Å; R317-L323 WeakPolarHBondContact CD-O 3.5Å; R317-L323 HydrophobicContact CG-CB 4.39Å; R317-L323 WeakPolarHBondContact CG-O 3.19Å; R317-L323 WeakPolarHBondContact O-CB 3.18Å; R317-S325 PolarHBondContact NH1-OG 2.67Å; R317-P382 HydrophobicContact CB-CG 4.49Å
318	R	95.4	Very high	93.9	Very high	48 Å²	48	47.7 Å²	47.7	18%	0.181	25%	0.253	C	S	.	.	G	3₁₀ helix	trans	-67.3	-12.6	175.6	-59.6	-171.6	-179.8	-89.1	4	113.4	E217 Q219 E315 L316 S320 Y324 P382 N383	E217-R318 IonicContact OE1-CZ 3.18Å; E217-R318 IonicContact OE1-NH1 3.55Å; E217-R318 IonicContact OE1-NH2 3.36Å; E217-R318 PolarHBondContact OE1-NH2 2.91Å; Q219-R318 VanDerWaalsContact NE2-CD 3.31Å; E315-R318 VanDerWaalsContact O-CB 3.32Å; E315-R318 WeakPolarHBondContact O-CB 3.47Å; E315-R318 WeakPolarHBondContact O-CG 3.4Å; E315-R318 PolarHBondContact O-N 2.94Å; E315-R318 IonicContact OE1-CZ 3.91Å; E315-R318 IonicContact OE1-NE 2.8Å; E315-R318 PolarHBondContact OE1-NE 2.8Å; E315-R318 IonicContact OE1-NH2 2.9Å; E315-R318 PolarHBondContact OE1-NH2 2.93Å; E315-R318 WeakPolarHBondContact OE2-CD 3.43Å; E315-R318 IonicContact OE2-CZ 2.88Å; E315-R318 IonicContact OE2-NE 3.2Å; E315-R318 PolarHBondContact OE2-NE 3.34Å; E315-R318 IonicContact OE2-NH2 3.65Å; L316-R318 PolarHBondContact O-N 3.18Å; R318-S320 PolarHBondContact O-N 2.84Å; R318-Y324 PolarHBondContact NH1-OH 3.05Å; R318-P382 HydrophobicContact CG-CG 3.6Å; R318-N383 PolarHBondContact NH1-O 3.19Å; R318-N383 PolarHBondContact NH2-O 3.47Å
319	L	95.1	Very high	93.8	Very high	150 Å²	150	46.4 Å²	46.4	79%	0.785	25%	0.246	S	C	*	.	G	3₁₀ helix	trans	-59.2	-27.1	178.1	-68.4	174.9	0	0	0	113.7	L316 R317 L323	L316-L319 WeakPolarHBondContact O-CD1 3.34Å; L316-L319 VanDerWaalsContact O-CG 3.25Å; L316-L319 WeakPolarHBondContact O-CG 3.49Å; L316-L319 PolarHBondContact O-N 3.07Å; R317-L319 PolarHBondContact O-N 3.18Å; R317-L319 VanDerWaalsContact O-N 3.17Å; L319-L323 HydrophobicContact CB-CD1 4.11Å
320	S	94.8	Very high	93.5	Very high	41 Å²	41	47.3 Å²	47.3	29%	0.287	25%	0.252	S	S	.	.			trans	-154.9	142.3	176	176.6	0	0	0	0	110.8	R317 R318 S322 L323	R317-S320 VanDerWaalsContact O-O 3.11Å; R318-S320 PolarHBondContact O-N 2.84Å; S320-S322 PolarHBondContact O-N 3.07Å; S320-S322 PolarHBondContact OG-N 3.05Å; S320-S322 PolarHBondContact OG-OG 3.17Å; S320-L323 WeakPolarHBondContact O-CB 3.46Å; S320-L323 PolarHBondContact O-N 3.06Å
321	P	94	Very high	93.1	Very high	41 Å²	41	51.3 Å²	51.3	27%	0.266	27%	0.271	S	S	.	.	G	3₁₀ helix	trans	-50.1	-31.9	171.5	-30.8	37.6	0	0	0	114.6	P222 V223 H226 L323 Y324	P222-P321 HydrophobicContact CB-CG 4.46Å; V223-P321 HydrophobicContact CG2-CB 4.19Å; V223-P321 HydrophobicContact CG2-CG 4.22Å; H226-P321 HydrophobicContact CB-CB 3.79Å; H226-P321 PolarHBondContact CD2-O 3.17Å; P321-L323 VanDerWaalsContact C-N 3.26Å; P321-L323 PolarHBondContact O-N 3.23Å; P321-Y324 PolarHBondContact O-N 3.34Å
322	S	94	Very high	92.8	Very high	64 Å²	64	52.3 Å²	52.3	45%	0.448	28%	0.279	S	S	.	.	G	3₁₀ helix	trans	-69.2	-20.3	179.9	63.4	0	0	0	0	114.5	S320	S320-S322 PolarHBondContact O-N 3.07Å; S320-S322 PolarHBondContact OG-N 3.05Å; S320-S322 PolarHBondContact OG-OG 3.17Å
323	L	95.1	Very high	92.4	Very high	86 Å²	86	50.2 Å²	50.2	45%	0.45	28%	0.275	S	S	.	.	G	3₁₀ helix	trans	-88.6	-9.8	-178.2	-62.9	175.2	0	0	0	112.7	R317 L319 S320 P321 S325	R317-L323 HydrophobicContact CB-CB 4.04Å; R317-L323 WeakPolarHBondContact CB-O 3.33Å; R317-L323 VanDerWaalsContact CD-O 3.26Å; R317-L323 WeakPolarHBondContact CD-O 3.5Å; R317-L323 HydrophobicContact CG-CB 4.39Å; R317-L323 WeakPolarHBondContact CG-O 3.19Å; R317-L323 WeakPolarHBondContact O-CB 3.18Å; L319-L323 HydrophobicContact CB-CD1 4.11Å; S320-L323 WeakPolarHBondContact O-CB 3.46Å; S320-L323 PolarHBondContact O-N 3.06Å; P321-L323 VanDerWaalsContact C-N 3.26Å; P321-L323 PolarHBondContact O-N 3.23Å; L323-S325 PolarHBondContact O-N 2.95Å
324	Y	95.5	Very high	92.4	Very high	3 Å²	3	47.2 Å²	47.2	1%	0.012	26%	0.262	C	S	.	.			trans	-64.5	134.8	173.9	-81.4	-102.8	0	0	0	110.5	Q219 V223 R318 P321 V380 P382 L384	Q219-Y324 VanDerWaalsContact CG-OH 3.3Å; Q219-Y324 WeakPolarHBondContact CG-OH 3.38Å; Q219-Y324 PolarHBondContact NE2-OH 3.35Å; V223-Y324 HydrophobicContact CG1-CD1 3.9Å; V223-Y324 HydrophobicContact CG1-CD2 3.96Å; V223-Y324 HydrophobicContact CG1-CE1 4.16Å; V223-Y324 HydrophobicContact CG1-CE2 4.24Å; V223-Y324 HydrophobicContact CG1-CG 3.76Å; V223-Y324 HydrophobicContact CG2-CD2 3.95Å; V223-Y324 HydrophobicContact CG2-CE1 4.43Å; V223-Y324 HydrophobicContact CG2-CE2 3.54Å; R318-Y324 PolarHBondContact NH1-OH 3.05Å; P321-Y324 PolarHBondContact O-N 3.34Å; Y324-V380 HydrophobicContact CD1-CG1 3.52Å; Y324-V380 HydrophobicContact CE1-CG1 4.26Å; Y324-V380 HydrophobicContact CG-CG1 4.39Å; Y324-P382 HydrophobicContact CD1-CG 4.17Å; Y324-P382 HydrophobicContact CE1-CG 3.59Å; Y324-P382 WeakPolarHBondContact CE1-O 3.27Å; Y324-L384 HydrophobicContact CD1-CD2 4.28Å; Y324-L384 HydrophobicContact CE1-CD2 3.42Å; Y324-L384 VanDerWaalsContact CE1-CD2 3.42Å; Y324-L384 HydrophobicContact CE1-CG 4.21Å
325	S	92.8	Very high	92.4	Very high	21 Å²	21	47.4 Å²	47.4	15%	0.147	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	146.9	175.1	65.9	0	0	0	0	111.4	R317 L323 V380 E381	R317-S325 PolarHBondContact NH1-OG 2.67Å; L323-S325 PolarHBondContact O-N 2.95Å; S325-V380 WeakPolarHBondContact O-CA 3.39Å; S325-E381 PolarHBondContact N-O 3.21Å; S325-E381 PolarHBondContact O-N 3.36Å; S325-E381 WeakPolarHBondContact OG-CB 3.18Å; S325-E381 PolarHBondContact OG-O 3.36Å
326	V	92.9	Very high	92.6	Very high	24 Å²	24	43.2 Å²	43.2	15%	0.145	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	111.8	168.9	-178.7	0	0	0	0	106.5	L227 F232 L237 L243 Y378	L227-V326 HydrophobicContact CD2-CG2 3.64Å; F232-V326 HydrophobicContact CE2-CG1 4.13Å; F232-V326 HydrophobicContact CE2-CG2 4.24Å; F232-V326 HydrophobicContact CZ-CG1 3.95Å; L237-V326 HydrophobicContact CD2-CG1 4.47Å; L243-V326 HydrophobicContact CD1-CG1 4.43Å; V326-Y378 VanDerWaalsContact CG1-CB 3.45Å; V326-Y378 HydrophobicContact CG1-CD1 3.94Å; V326-Y378 HydrophobicContact CG1-CD2 4.43Å; V326-Y378 HydrophobicContact CG1-CG 3.69Å
327	V	91.6	Very high	92.8	Very high	13 Å²	13	38.6 Å²	38.6	8%	0.079	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	158.2	-179.6	-59.1	0	0	0	0	110	A329 Y378 V379 E381	V327-A329 PolarHBondContact O-N 3.39Å; V327-Y378 CarbonylContact O-C 3.53Å; V327-Y378 WeakPolarHBondContact O-CA 3.23Å; V327-Y378 WeakPolarHBondContact O-CB 3.49Å; V327-V379 HydrophobicContact CG2-CG1 3.39Å; V327-V379 PolarHBondContact N-O 2.87Å; V327-V379 PolarHBondContact O-N 2.87Å; V327-E381 HydrophobicContact CG2-CG 4.2Å
328	P	91.9	Very high	92.9	Very high	74 Å²	74	36.4 Å²	36.4	48%	0.481	21%	0.212	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-54.1	137.5	178.3	-26.9	36.2	0	0	0	112.2
329	A	91.8	Very high	93.1	Very high	8 Å²	8	34.1 Å²	34.1	7%	0.066	20%	0.203	C	C	.	.			trans	-67.3	150.5	179.8	0	0	0	0	0	111.5	Y242 K244 V327 Y367 A377	Y242-A329 HydrophobicContact CE2-CB 3.9Å; K244-A329 HydrophobicContact CD-CB 4.32Å; V327-A329 PolarHBondContact O-N 3.39Å; A329-Y367 WeakPolarHBondContact O-CE2 3.22Å; A329-A377 HydrophobicContact CB-CB 3.92Å; A329-A377 PolarHBondContact N-O 2.92Å
330	S	88	Confident	93.1	Very high	20 Å²	20	28.4 Å²	28.4	14%	0.14	18%	0.175	C	C	.	.			trans	-106.2	172.4	172.9	66.5	0	0	0	0	111.8	K244 H247	K244-S330 PolarHBondContact NZ-O 2.86Å; H247-S330 PolarHBondContact CE1-OG 2.84Å; H247-S330 PolarHBondContact ND1-OG 2.82Å
331	Q	86.4	Confident	93.2	Very high	88 Å²	88	26.9 Å²	26.9	41%	0.411	17%	0.165	S	C	.	.	S	Bend	trans	-61.8	-47.2	-174.7	-77.7	172.3	26.9	0	0	113.4	K244 Y367	K244-Q331 PolarHBondContact NZ-O 3.17Å; Q331-Y367 HydrophobicContact CB-CD1 4.4Å; Q331-Y367 HydrophobicContact CB-CD2 4.39Å; Q331-Y367 HydrophobicContact CB-CG 4.16Å; Q331-Y367 HydrophobicContact CG-CD1 3.17Å; Q331-Y367 HydrophobicContact CG-CD2 3.81Å; Q331-Y367 HydrophobicContact CG-CE1 3.44Å; Q331-Y367 VanDerWaalsContact CG-CE1 3.44Å; Q331-Y367 HydrophobicContact CG-CE2 4.05Å; Q331-Y367 HydrophobicContact CG-CG 3.35Å
332	C	85.3	Confident	93.3	Very high	38 Å²	38	29 Å²	29	26%	0.257	18%	0.179	S	C	.	.	S	Bend	trans	-70.6	143.8	-168.5	-167.2	0	0	0	0	113.1	K244	K244-C332 PolarHBondContact NZ-O 2.93Å
333	C	86.8	Confident	93.4	Very high	29 Å²	29	26.1 Å²	26.1	20%	0.196	16%	0.159	C	C	.	.			trans	75.1	144.7	147.5	-47.4	0	0	0	0	114.2	K244 P248 D363	K244-C333 VanDerWaalsContact CE-O 3.28Å; K244-C333 WeakPolarHBondContact CE-O 3.37Å; K244-C333 PolarHBondContact NZ-O 3.06Å; P248-C333 WeakPolarHBondContact CG-SG 3.34Å; C333-D363 PolarHBondContact N-OD2 2.96Å; C333-D363 VanDerWaalsContact N-OD2 3.1Å
334	T	92.1	Very high	93.5	Very high	8 Å²	8	22 Å²	22	5%	0.049	14%	0.137	C	C	.	.			trans	-141.7	22.3	-169.7	53.1	0	0	0	0	115.4	E211 A336 M337 K362 D363 L366	E211-T334 PolarHBondContact OE1-OG1 3.2Å; T334-A336 PolarHBondContact O-N 3.05Å; T334-M337 VanDerWaalsContact CB-CE 3.45Å; T334-M337 HydrophobicContact CG2-CE 3.42Å; T334-M337 VanDerWaalsContact CG2-CE 3.42Å; T334-M337 HydrophobicContact CG2-SD 3.56Å; T334-M337 VanDerWaalsContact CG2-SD 3.56Å; T334-K362 HydrophobicContact CG2-CG 4.39Å; T334-K362 WeakPolarHBondContact OG1-CE 3.1Å; T334-D363 HydrophobicContact CG2-CB 3.68Å; T334-L366 HydrophobicContact CG2-CD1 4.09Å
335	P	95.1	Very high	93.6	Very high	5 Å²	5	28.3 Å²	28.3	3%	0.032	16%	0.161	C	C	.	.	S	Bend	trans	-66	-22.5	-168.3	32.1	-38.6	0	0	0	113	V210 E211 A214 Y246	V210-P335 CarbonylContact C-O 3.2Å; V210-P335 WeakPolarHBondContact CA-O 3.19Å; E211-P335 HydrophobicContact CB-CB 4.42Å; E211-P335 PolarHBondContact N-O 3.28Å; A214-P335 HydrophobicContact CB-CB 3.93Å; A214-P335 WeakPolarHBondContact CB-O 3.4Å; Y246-P335 HydrophobicContact CD1-CG 3.32Å; Y246-P335 HydrophobicContact CE1-CG 4.16Å; Y246-P335 HydrophobicContact CG-CG 3.62Å
336	A	97.8	Very high	93.7	Very high	1 Å²	1	31.7 Å²	31.7	1%	0.008	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	122.2	165.4	0	0	0	0	0	111.1	L208 M209 V210 L245 T334 V385	L208-A336 HydrophobicContact CD1-CB 4.48Å; M209-A336 CarbonylContact O-C 3.6Å; M209-A336 VanDerWaalsContact O-CA 3.3Å; M209-A336 WeakPolarHBondContact O-CA 3.06Å; V210-A336 HydrophobicContact CG1-CB 4.4Å; L245-A336 HydrophobicContact CB-CB 3.87Å; L245-A336 HydrophobicContact CD1-CB 4.4Å; L245-A336 HydrophobicContact CG-CB 4.39Å; L245-A336 PolarHBondContact N-O 3.41Å; T334-A336 PolarHBondContact O-N 3.05Å; A336-V385 HydrophobicContact CB-CB 4.35Å; A336-V385 HydrophobicContact CB-CG1 3.7Å; A336-V385 HydrophobicContact CB-CG2 3.68Å
337	M	97.7	Very high	93.9	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	125.9	-179.1	-65.4	-164.1	-65.9	0	0	111.3	Y191 M209 Y242 K244 T334 F339 L366	Y191-M337 HydrophobicContact CE1-CE 4.25Å; Y191-M337 HydrophobicContact CE2-CE 3.81Å; Y191-M337 VanDerWaalsContact CZ-CE 3.45Å; Y191-M337 WeakPolarHBondContact OH-CE 3.12Å; M209-M337 PolarHBondContact N-O 3.42Å; M209-M337 PolarHBondContact O-N 3.46Å; Y242-M337 HydrophobicContact CD2-SD 4.48Å; K244-M337 HydrophobicContact CG-CG 4.19Å; K244-M337 HydrophobicContact CG-SD 4.35Å; T334-M337 VanDerWaalsContact CB-CE 3.45Å; T334-M337 HydrophobicContact CG2-CE 3.42Å; T334-M337 VanDerWaalsContact CG2-CE 3.42Å; T334-M337 HydrophobicContact CG2-SD 3.56Å; T334-M337 VanDerWaalsContact CG2-SD 3.56Å; M337-F339 HydrophobicContact CB-CD2 4.41Å; M337-F339 HydrophobicContact CB-CE2 3.51Å; M337-F339 HydrophobicContact CB-CZ 4.05Å; M337-F339 HydrophobicContact CE-CE2 4.26Å; M337-F339 HydrophobicContact CE-CZ 4Å; M337-F339 HydrophobicContact SD-CZ 4.32Å; M337-L366 HydrophobicContact CE-CD1 3.26Å; M337-L366 HydrophobicContact SD-CD1 3.83Å
338	L	98	Very high	94.2	Very high	2 Å²	2	30.9 Å²	30.9	1%	0.01	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	132.9	176.2	-177.9	85.5	0	0	0	110.5	L102 Y206 V207 L208 L224 L228 Y242 L243	L102-L338 HydrophobicContact CD1-CD1 3.5Å; Y206-L338 HydrophobicContact CD1-CD2 4.49Å; V207-L338 CarbonylContact O-C 3.54Å; V207-L338 WeakPolarHBondContact O-CA 3.14Å; L208-L338 HydrophobicContact CB-CD1 3.82Å; L208-L338 HydrophobicContact CD1-CB 4.27Å; L224-L338 HydrophobicContact CD2-CD2 4.36Å; L228-L338 HydrophobicContact CD1-CD2 3.77Å; L228-L338 HydrophobicContact CD2-CD2 3.52Å; L228-L338 HydrophobicContact CG-CD2 4.08Å; Y242-L338 CarbonylContact C-O 3.55Å; Y242-L338 WeakPolarHBondContact CA-O 2.98Å; Y242-L338 WeakPolarHBondContact CB-O 3.21Å; L243-L338 HydrophobicContact CB-CB 4.25Å; L243-L338 HydrophobicContact CB-CD2 4.46Å; L243-L338 HydrophobicContact CD2-CD2 4.28Å; L243-L338 PolarHBondContact N-O 3.23Å; L243-L338 PolarHBondContact O-N 2.85Å
339	F	97.7	Very high	94.4	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	131.7	176.9	-62.6	-98.9	0	0	0	110.6	Y191 Y206 V207 M209 L241 Y242 M337 A344 T347	Y191-F339 HydrophobicContact CE1-CZ 4.5Å; Y191-F339 WeakPolarHBondContact OH-CE2 3.14Å; Y191-F339 WeakPolarHBondContact OH-CZ 3.48Å; Y206-F339 CarbonylContact C-O 3.47Å; Y206-F339 WeakPolarHBondContact CA-O 3.22Å; V207-F339 PolarHBondContact N-O 3.28Å; V207-F339 PolarHBondContact O-N 3.48Å; M209-F339 HydrophobicContact CG-CD2 4.19Å; M209-F339 HydrophobicContact CG-CE2 4.19Å; L241-F339 VanDerWaalsContact O-CD1 3.28Å; L241-F339 WeakPolarHBondContact O-CD1 3.37Å; Y242-F339 AromaticContact CD1-CE1 3.95Å; Y242-F339 HydrophobicContact CD1-CE1 3.95Å; Y242-F339 HydrophobicContact CD1-CZ 4.36Å; Y242-F339 HydrophobicContact CG-CE1 4.11Å; Y242-F339 HydrophobicContact CG-CZ 4.3Å; M337-F339 HydrophobicContact CB-CD2 4.41Å; M337-F339 HydrophobicContact CB-CE2 3.51Å; M337-F339 HydrophobicContact CB-CZ 4.05Å; M337-F339 HydrophobicContact CE-CE2 4.26Å; M337-F339 HydrophobicContact CE-CZ 4Å; M337-F339 HydrophobicContact SD-CZ 4.32Å; F339-A344 HydrophobicContact CB-CB 3.83Å; F339-A344 HydrophobicContact CG-CB 4.4Å; F339-T347 HydrophobicContact CE1-CG2 3.92Å
340	P	96.7	Very high	94.6	Very high	30 Å²	30	32.6 Å²	32.6	20%	0.195	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.9	140	155.6	-19.1	30.9	0	0	0	109.9	Y206 P342 A343 A344	Y206-P340 HydrophobicContact CD1-CB 4.34Å; Y206-P340 HydrophobicContact CD1-CG 4.38Å; Y206-P340 HydrophobicContact CE1-CB 4.2Å; Y206-P340 HydrophobicContact CE1-CG 4.15Å; P340-P342 VanDerWaalsContact C-CD 3.49Å; P340-A343 HydrophobicContact CB-CB 4.21Å; P340-A343 HydrophobicContact CG-CB 4.31Å; P340-A343 CarbonylContact O-C 3.44Å; P340-A343 WeakPolarHBondContact O-CA 3.44Å; P340-A343 WeakPolarHBondContact O-CB 3.35Å; P340-A343 PolarHBondContact O-N 3.43Å; P340-A344 PolarHBondContact O-N 2.95Å
341	A	96.6	Very high	95	Very high	10 Å²	10	31.6 Å²	31.6	8%	0.083	16%	0.163	C	C	.	.	H	α-helix	trans	-55.7	-39.8	-176.5	0	0	0	0	0	114.8	L199 P204 D205 A343 A344 R345	L199-A341 HydrophobicContact CD2-CB 3.87Å; P204-A341 WeakPolarHBondContact O-CB 3.35Å; D205-A341 PolarHBondContact O-N 2.81Å; A341-A343 VanDerWaalsContact C-N 3.29Å; A341-A343 PolarHBondContact O-N 3.03Å; A341-A344 PolarHBondContact O-N 3.47Å; A341-R345 PolarHBondContact O-N 3.13Å
342	P	95.7	Very high	95.4	Very high	86 Å²	86	31.3 Å²	31.3	56%	0.558	17%	0.171	S	C	*	.	H	α-helix	trans	-61.9	-36.1	172.9	-23.4	34.6	0	0	0	113	P340 R346	P340-P342 VanDerWaalsContact C-CD 3.49Å; P342-R346 WeakPolarHBondContact O-CG 3.24Å; P342-R346 PolarHBondContact O-N 3.43Å; P342-R346 PolarHBondContact O-NH1 3.49Å
343	A	96.6	Very high	95.8	Very high	2 Å²	2	36.7 Å²	36.7	2%	0.017	19%	0.192	C	C	.	.	H	α-helix	trans	-74.2	-38.5	178.3	0	0	0	0	0	111.9	L241 P340 A341 R345 R346 T347	L241-A343 HydrophobicContact CD1-CB 4.28Å; L241-A343 VanDerWaalsContact O-CB 3.26Å; L241-A343 WeakPolarHBondContact O-CB 3.32Å; P340-A343 HydrophobicContact CB-CB 4.21Å; P340-A343 HydrophobicContact CG-CB 4.31Å; P340-A343 CarbonylContact O-C 3.44Å; P340-A343 WeakPolarHBondContact O-CA 3.44Å; P340-A343 WeakPolarHBondContact O-CB 3.35Å; P340-A343 PolarHBondContact O-N 3.43Å; A341-A343 VanDerWaalsContact C-N 3.29Å; A341-A343 PolarHBondContact O-N 3.03Å; A343-R345 VanDerWaalsContact C-N 3.3Å; A343-R345 PolarHBondContact O-N 3.2Å; A343-R346 PolarHBondContact O-N 2.89Å; A343-R346 VanDerWaalsContact O-N 3.12Å; A343-T347 PolarHBondContact O-N 3.47Å; A343-T347 PolarHBondContact O-OG1 2.77Å
344	A	97.5	Very high	96.2	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-55.4	-44.1	172.9	0	0	0	0	0	111.9	L195 L199 F339 P340 A341 R346 T347 L348	L195-A344 HydrophobicContact CD1-CB 3.89Å; L195-A344 HydrophobicContact CD2-CB 4.2Å; L195-A344 HydrophobicContact CG-CB 4.28Å; L199-A344 HydrophobicContact CD1-CB 3.83Å; L199-A344 HydrophobicContact CD2-CB 4.18Å; L199-A344 HydrophobicContact CG-CB 4.41Å; F339-A344 HydrophobicContact CB-CB 3.83Å; F339-A344 HydrophobicContact CG-CB 4.4Å; P340-A344 PolarHBondContact O-N 2.95Å; A341-A344 PolarHBondContact O-N 3.47Å; A344-R346 PolarHBondContact O-N 2.86Å; A344-T347 WeakPolarHBondContact O-CB 3.45Å; A344-T347 PolarHBondContact O-N 3.43Å; A344-L348 WeakPolarHBondContact O-CG 3.48Å; A344-L348 PolarHBondContact O-N 3.28Å
345	R	96.9	Very high	96.3	Very high	136 Å²	136	42.9 Å²	42.9	51%	0.513	21%	0.214	S	C	.	.	H	α-helix	trans	-62	-39.3	176	-67	179	-174.7	-171.9	2.7	112.9	L199 N203 A341 A343 T349	L199-R345 HydrophobicContact CD1-CG 3.93Å; N203-R345 PolarHBondContact OD1-NH2 3.38Å; A341-R345 PolarHBondContact O-N 3.13Å; A343-R345 VanDerWaalsContact C-N 3.3Å; A343-R345 PolarHBondContact O-N 3.2Å; R345-T349 PolarHBondContact O-N 3.15Å; R345-T349 VanDerWaalsContact O-N 3.08Å; R345-T349 PolarHBondContact O-OG1 3.44Å
346	R	95.5	Very high	96.4	Very high	92 Å²	92	42.6 Å²	42.6	35%	0.347	21%	0.212	S	C	.	.	H	α-helix	trans	-66.1	-41.7	174.7	-63.1	-165.1	-53.5	-85.5	10.7	111.3	P342 A343 A344 T349 Y350 E375	P342-R346 WeakPolarHBondContact O-CG 3.24Å; P342-R346 PolarHBondContact O-N 3.43Å; P342-R346 PolarHBondContact O-NH1 3.49Å; A343-R346 PolarHBondContact O-N 2.89Å; A343-R346 VanDerWaalsContact O-N 3.12Å; A344-R346 PolarHBondContact O-N 2.86Å; R346-T349 PolarHBondContact O-N 3.18Å; R346-Y350 PolarHBondContact O-N 2.95Å; R346-Y350 VanDerWaalsContact O-N 3.09Å; R346-E375 IonicContact CZ-OE1 3.86Å; R346-E375 IonicContact CZ-OE2 3.93Å; R346-E375 IonicContact NE-OE1 3.75Å; R346-E375 PolarHBondContact NE-OE1 2.84Å; R346-E375 IonicContact NE-OE2 3.93Å; R346-E375 IonicContact NH2-OE1 2.83Å; R346-E375 PolarHBondContact NH2-OE1 3.18Å; R346-E375 IonicContact NH2-OE2 2.65Å; R346-E375 PolarHBondContact NH2-OE2 3.03Å
347	T	96.8	Very high	96.1	Very high	0 Å²	0	47 Å²	47	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-60.3	-46.9	175.2	-64	0	0	0	0	111.8	L195 L241 F339 A343 A344 T349 Y350 L351 L366	L195-T347 HydrophobicContact CD2-CG2 4.35Å; L241-T347 WeakPolarHBondContact CD1-OG1 3.43Å; F339-T347 HydrophobicContact CE1-CG2 3.92Å; A343-T347 PolarHBondContact O-N 3.47Å; A343-T347 PolarHBondContact O-OG1 2.77Å; A344-T347 WeakPolarHBondContact O-CB 3.45Å; A344-T347 PolarHBondContact O-N 3.43Å; T347-T349 PolarHBondContact O-N 3.23Å; T347-Y350 PolarHBondContact O-N 2.96Å; T347-L351 HydrophobicContact CG2-CD1 3.76Å; T347-L351 HydrophobicContact CG2-CG 4.17Å; T347-L351 WeakPolarHBondContact O-CB 3.27Å; T347-L351 WeakPolarHBondContact O-CG 3.37Å; T347-L351 PolarHBondContact O-N 2.8Å; T347-L366 HydrophobicContact CG2-CD2 3.41Å; T347-L366 VanDerWaalsContact CG2-CD2 3.41Å
348	L	97.4	Very high	95.7	Very high	19 Å²	19	55.6 Å²	55.6	10%	0.099	27%	0.27	C	S	.	.	H	α-helix	trans	-57	-47.6	174.9	-72.9	173.8	0	0	0	112	V192 L195 E196 L199 A344 Y350 L351 S352	V192-L348 HydrophobicContact CB-CD2 4.22Å; V192-L348 HydrophobicContact CG1-CD2 3.81Å; V192-L348 HydrophobicContact CG2-CD2 4.45Å; V192-L348 VanDerWaalsContact O-CD2 3.23Å; V192-L348 WeakPolarHBondContact O-CD2 3.44Å; L195-L348 HydrophobicContact CB-CD2 3.96Å; L195-L348 HydrophobicContact CD2-CD2 3.9Å; L195-L348 HydrophobicContact CD2-CG 3.91Å; L195-L348 HydrophobicContact CG-CD1 4.37Å; L195-L348 HydrophobicContact CG-CD2 3.99Å; L195-L348 HydrophobicContact CG-CG 4.11Å; E196-L348 HydrophobicContact CB-CD1 3.98Å; E196-L348 HydrophobicContact CB-CD2 4.15Å; L199-L348 HydrophobicContact CD1-CD1 3.62Å; A344-L348 WeakPolarHBondContact O-CG 3.48Å; A344-L348 PolarHBondContact O-N 3.28Å; L348-Y350 PolarHBondContact O-N 3.11Å; L348-L351 PolarHBondContact O-N 3.1Å; L348-S352 WeakPolarHBondContact O-CB 3.3Å; L348-S352 PolarHBondContact O-N 2.69Å; L348-S352 PolarHBondContact O-OG 2.98Å
349	T	95.8	Very high	95.2	Very high	82 Å²	82	58.1 Å²	58.1	50%	0.503	30%	0.296	S	S	.	.	H	α-helix	trans	-58.6	-37.5	178.9	-53.3	0	0	0	0	112	R345 R346 T347 S352 Q353	R345-T349 PolarHBondContact O-N 3.15Å; R345-T349 VanDerWaalsContact O-N 3.08Å; R345-T349 PolarHBondContact O-OG1 3.44Å; R346-T349 PolarHBondContact O-N 3.18Å; T347-T349 PolarHBondContact O-N 3.23Å; T349-S352 PolarHBondContact O-OG 2.82Å; T349-Q353 WeakPolarHBondContact O-CG 3.27Å
350	Y	96.3	Very high	95	Very high	36 Å²	36	60.5 Å²	60.5	14%	0.141	31%	0.307	C	S	.	.	H	α-helix	trans	-76.8	-48.9	178.5	178	-102.9	0	0	0	112.6	R346 T347 L348 S352 Q353 V354 A365 S368 L369	R346-Y350 PolarHBondContact O-N 2.95Å; R346-Y350 VanDerWaalsContact O-N 3.09Å; T347-Y350 PolarHBondContact O-N 2.96Å; L348-Y350 PolarHBondContact O-N 3.11Å; Y350-S352 PolarHBondContact O-N 3.43Å; Y350-Q353 PolarHBondContact O-N 3.36Å; Y350-V354 HydrophobicContact CD1-CG2 4.14Å; Y350-V354 HydrophobicContact CD2-CG2 4.2Å; Y350-V354 HydrophobicContact CE1-CG2 3.66Å; Y350-V354 HydrophobicContact CE2-CG2 3.75Å; Y350-V354 HydrophobicContact CG-CG2 4.41Å; Y350-V354 VanDerWaalsContact CZ-CG2 3.47Å; Y350-V354 PolarHBondContact O-N 3.29Å; Y350-A365 VanDerWaalsContact CE1-O 3.28Å; Y350-A365 WeakPolarHBondContact CE1-O 3.44Å; Y350-S368 PolarHBondContact OH-OG 3.44Å; Y350-L369 HydrophobicContact CD1-CB 3.79Å; Y350-L369 HydrophobicContact CD1-CD1 4.12Å; Y350-L369 HydrophobicContact CD1-CD2 3.79Å; Y350-L369 HydrophobicContact CD1-CG 4.11Å; Y350-L369 HydrophobicContact CD2-CD1 3.7Å; Y350-L369 HydrophobicContact CE1-CB 3.68Å; Y350-L369 HydrophobicContact CE1-CG 4.46Å; Y350-L369 HydrophobicContact CE2-CB 4.49Å; Y350-L369 HydrophobicContact CE2-CD1 4.12Å; Y350-L369 HydrophobicContact CG-CB 4.24Å; Y350-L369 HydrophobicContact CG-CD1 3.67Å; Y350-L369 HydrophobicContact CG-CD2 3.87Å; Y350-L369 HydrophobicContact CG-CG 4.14Å
351	L	96.5	Very high	94.9	Very high	0 Å²	0	59.3 Å²	59.3	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-65.4	-26.9	-176.1	-71	-178.6	0	0	0	112.7	K188 Y191 V192 T347 L348 Q353 A365 L366	K188-L351 WeakPolarHBondContact CD-O 3.23Å; K188-L351 WeakPolarHBondContact CE-O 3.5Å; K188-L351 HydrophobicContact CG-CB 4.45Å; K188-L351 HydrophobicContact CG-CD2 4.3Å; K188-L351 PolarHBondContact NZ-O 2.66Å; Y191-L351 HydrophobicContact CD1-CD1 4.14Å; V192-L351 HydrophobicContact CG2-CB 3.53Å; V192-L351 HydrophobicContact CG2-CD1 4.05Å; V192-L351 HydrophobicContact CG2-CG 4.47Å; T347-L351 HydrophobicContact CG2-CD1 3.76Å; T347-L351 HydrophobicContact CG2-CG 4.17Å; T347-L351 WeakPolarHBondContact O-CB 3.27Å; T347-L351 WeakPolarHBondContact O-CG 3.37Å; T347-L351 PolarHBondContact O-N 2.8Å; L348-L351 PolarHBondContact O-N 3.1Å; L351-Q353 PolarHBondContact O-N 2.76Å; L351-A365 HydrophobicContact CD2-CB 3.85Å; L351-L366 HydrophobicContact CD1-CD2 4Å; L351-L366 HydrophobicContact CD1-CG 4.46Å; L351-L366 HydrophobicContact CD2-CD2 4.29Å; L351-L366 HydrophobicContact CD2-CG 4.35Å; L351-L366 HydrophobicContact CG-CD2 4.34Å
352	S	93.8	Very high	94.8	Very high	82 Å²	82	59.2 Å²	59.2	57%	0.573	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.1	-20.5	173	64.6	0	0	0	0	113.6	L348 T349 Y350	L348-S352 WeakPolarHBondContact O-CB 3.3Å; L348-S352 PolarHBondContact O-N 2.69Å; L348-S352 PolarHBondContact O-OG 2.98Å; T349-S352 PolarHBondContact O-OG 2.82Å; Y350-S352 PolarHBondContact O-N 3.43Å
353	Q	94.5	Very high	94.7	Very high	151 Å²	151	56.8 Å²	56.8	71%	0.706	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.9	-13.5	-178	-64.3	176.1	-1.6	0	0	113.6	T349 Y350 L351	T349-Q353 WeakPolarHBondContact O-CG 3.27Å; Y350-Q353 PolarHBondContact O-N 3.36Å; L351-Q353 PolarHBondContact O-N 2.76Å
354	V	95	Very high	94.6	Very high	25 Å²	25	59.9 Å²	59.9	15%	0.152	30%	0.295	C	S	.	.	P	Polyproline II helix	trans	-102	138.4	-176.6	173.1	0	0	0	0	109.9	K188 Y350 F360 A365	K188-V354 PolarHBondContact NZ-O 2.82Å; Y350-V354 HydrophobicContact CD1-CG2 4.14Å; Y350-V354 HydrophobicContact CD2-CG2 4.2Å; Y350-V354 HydrophobicContact CE1-CG2 3.66Å; Y350-V354 HydrophobicContact CE2-CG2 3.75Å; Y350-V354 HydrophobicContact CG-CG2 4.41Å; Y350-V354 VanDerWaalsContact CZ-CG2 3.47Å; Y350-V354 PolarHBondContact O-N 3.29Å; V354-F360 HydrophobicContact CG1-CE1 3.62Å; V354-F360 HydrophobicContact CG1-CZ 4.32Å; V354-A365 HydrophobicContact CG1-CB 4.12Å
355	Y	95.2	Very high	94.5	Very high	141 Å²	141	59.9 Å²	59.9	55%	0.553	30%	0.295	S	S	*	.	P	Polyproline II helix	trans	-99.3	125.1	174.1	-172.8	-97.6	0	0	0	110.5	N182 E185 H357	N182-Y355 WeakPolarHBondContact ND2-CE1 3.43Å; N182-Y355 PolarHBondContact ND2-OH 3.01Å; E185-Y355 HydrophobicContact CB-CE2 4.28Å; E185-Y355 HydrophobicContact CG-CD2 4.12Å; E185-Y355 HydrophobicContact CG-CE2 3.77Å; Y355-H357 HydrophobicContact CE1-CB 4.38Å
356	C	95.4	Very high	94.4	Very high	0 Å²	0	53.5 Å²	53.5	0%	0	27%	0.271	C	S	.	.	P	Polyproline II helix	trans	-89.2	148.3	176.5	-75.8	0	0	0	0	111.1	N182 F184 E185 K188 F360	N182-C356 PolarHBondContact ND2-O 2.81Å; F184-C356 HydrophobicContact CB-CB 4.12Å; F184-C356 WeakPolarHBondContact O-CB 3.49Å; E185-C356 PolarHBondContact OE2-N 3.49Å; K188-C356 HydrophobicContact CB-CB 4.32Å; K188-C356 HydrophobicContact CD-CB 4.44Å; C356-F360 WeakPolarHBondContact CA-O 3.35Å; C356-F360 WeakPolarHBondContact CB-O 3.4Å
357	H	93.3	Very high	94.4	Very high	93 Å²	93	51.8 Å²	51.8	43%	0.431	27%	0.265	S	S	.	.	B	Isolated β-bridge	trans	-152.3	176.6	179.1	61.4	75.4	0	0	0	110.9	Y355 G359 F360	Y355-H357 HydrophobicContact CE1-CB 4.38Å; H357-G359 PolarHBondContact O-N 3.41Å; H357-G359 VanDerWaalsContact O-N 3.14Å; H357-F360 VanDerWaalsContact CE1-CB 3.49Å; H357-F360 WeakPolarHBondContact CE1-CB 3.3Å; H357-F360 PolarHBondContact N-O 3.33Å; H357-F360 CarbonylContact O-C 3.58Å; H357-F360 WeakPolarHBondContact O-CA 3.27Å; H357-F360 PolarHBondContact O-N 3.44Å
358	K	88.9	Confident	94.3	Very high	180 Å²	180	52.9 Å²	52.9	78%	0.783	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.6	123.3	175.9	-170.5	175.4	-177.8	176.2	0	110.6	F184 F360	F184-K358 HydrophobicContact CD2-CB 4.33Å; F184-K358 HydrophobicContact CE2-CB 3.89Å; F184-K358 HydrophobicContact CE2-CG 4.07Å; F184-K358 HydrophobicContact CZ-CG 4.4Å; K358-F360 VanDerWaalsContact C-N 3.34Å
359	G	88.2	Confident	94.1	Very high	55 Å²	55	52.2 Å²	52.2	57%	0.567	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	86.1	-2	-176.1	0	0	0	0	0	115.1	H357	H357-G359 PolarHBondContact O-N 3.41Å; H357-G359 VanDerWaalsContact O-N 3.14Å
360	F	93.4	Very high	94.1	Very high	51 Å²	51	49.2 Å²	49.2	22%	0.224	25%	0.249	C	C	.	.	B	Isolated β-bridge	trans	-142.4	79.9	173.5	-170.4	-98.3	0	0	0	109.2	V354 C356 H357 K358 M364 A365	V354-F360 HydrophobicContact CG1-CE1 3.62Å; V354-F360 HydrophobicContact CG1-CZ 4.32Å; C356-F360 WeakPolarHBondContact CA-O 3.35Å; C356-F360 WeakPolarHBondContact CB-O 3.4Å; H357-F360 VanDerWaalsContact CE1-CB 3.49Å; H357-F360 WeakPolarHBondContact CE1-CB 3.3Å; H357-F360 PolarHBondContact N-O 3.33Å; H357-F360 CarbonylContact O-C 3.58Å; H357-F360 WeakPolarHBondContact O-CA 3.27Å; H357-F360 PolarHBondContact O-N 3.44Å; K358-F360 VanDerWaalsContact C-N 3.34Å; F360-M364 HydrophobicContact CD2-CB 3.72Å; F360-M364 HydrophobicContact CD2-SD 4.33Å; F360-M364 HydrophobicContact CE2-CB 3.89Å; F360-M364 HydrophobicContact CG-CB 4.34Å; F360-A365 HydrophobicContact CE1-CB 3.88Å; F360-A365 HydrophobicContact CZ-CB 4.07Å
361	G	93.1	Very high	93.8	Very high	4 Å²	4	56.2 Å²	56.2	4%	0.041	28%	0.275	C	S	.	.			trans	-83.6	-178	178.2	0	0	0	0	0	113	D363 M364 A365	G361-D363 PolarHBondContact O-N 3.18Å; G361-M364 PolarHBondContact O-N 3.43Å; G361-A365 PolarHBondContact O-N 3.1Å
362	K	94.9	Very high	93.5	Very high	9 Å²	9	59.4 Å²	59.4	4%	0.039	30%	0.302	C	S	.	.	H	α-helix	trans	-57.8	-33.4	179.4	80	-167.4	-179.9	-150.4	0	112.8	E187 K188 Y191 E211 T334 A365 L366	E187-K362 HydrophobicContact CG-CD 3.9Å; E187-K362 WeakPolarHBondContact OE1-CE 3.31Å; E187-K362 IonicContact OE1-NZ 3.49Å; E187-K362 PolarHBondContact OE1-NZ 3.38Å; K188-K362 HydrophobicContact CB-CB 4.19Å; K188-K362 HydrophobicContact CG-CB 4.38Å; Y191-K362 HydrophobicContact CD2-CD 4.26Å; Y191-K362 HydrophobicContact CG-CD 4.42Å; E211-K362 WeakPolarHBondContact OE1-CE 3.36Å; E211-K362 IonicContact OE1-NZ 2.79Å; E211-K362 PolarHBondContact OE1-NZ 2.78Å; T334-K362 HydrophobicContact CG2-CG 4.39Å; T334-K362 WeakPolarHBondContact OG1-CE 3.1Å; K362-A365 PolarHBondContact O-N 3.3Å; K362-L366 WeakPolarHBondContact O-CB 3.42Å; K362-L366 VanDerWaalsContact O-CG 3.31Å; K362-L366 WeakPolarHBondContact O-CG 3.15Å; K362-L366 PolarHBondContact O-N 3.33Å
363	D	93.9	Very high	93.4	Very high	34 Å²	34	62.6 Å²	62.6	18%	0.182	31%	0.305	C	S	.	.	H	α-helix	trans	-66.2	-44.4	179	66.5	-26.6	0	0	0	111.9	C333 T334 G361 L366 Y367	C333-D363 PolarHBondContact N-OD2 2.96Å; C333-D363 VanDerWaalsContact N-OD2 3.1Å; T334-D363 HydrophobicContact CG2-CB 3.68Å; G361-D363 PolarHBondContact O-N 3.18Å; D363-L366 PolarHBondContact O-N 3.19Å; D363-Y367 WeakPolarHBondContact O-CB 3.41Å; D363-Y367 PolarHBondContact O-N 2.82Å
364	M	94.3	Very high	93.3	Very high	68 Å²	68	58.6 Å²	58.6	34%	0.335	31%	0.305	S	S	.	.	H	α-helix	trans	-66.7	-38.8	172.9	-64	-156.2	-174.9	0	0	111.9	F360 G361 Y367 S368	F360-M364 HydrophobicContact CD2-CB 3.72Å; F360-M364 HydrophobicContact CD2-SD 4.33Å; F360-M364 HydrophobicContact CE2-CB 3.89Å; F360-M364 HydrophobicContact CG-CB 4.34Å; G361-M364 PolarHBondContact O-N 3.43Å; M364-Y367 PolarHBondContact O-N 3.3Å; M364-S368 VanDerWaalsContact O-CB 3.31Å; M364-S368 WeakPolarHBondContact O-CB 3.26Å; M364-S368 PolarHBondContact O-N 3.38Å; M364-S368 PolarHBondContact O-OG 3.24Å
365	A	95.2	Very high	93.2	Very high	0 Å²	0	59.3 Å²	59.3	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-59.8	-51.1	174.1	0	0	0	0	0	110.7	Y350 L351 V354 F360 G361 K362 Y367 S368 L369	Y350-A365 VanDerWaalsContact CE1-O 3.28Å; Y350-A365 WeakPolarHBondContact CE1-O 3.44Å; L351-A365 HydrophobicContact CD2-CB 3.85Å; V354-A365 HydrophobicContact CG1-CB 4.12Å; F360-A365 HydrophobicContact CE1-CB 3.88Å; F360-A365 HydrophobicContact CZ-CB 4.07Å; G361-A365 PolarHBondContact O-N 3.1Å; K362-A365 PolarHBondContact O-N 3.3Å; A365-Y367 VanDerWaalsContact C-N 3.31Å; A365-Y367 PolarHBondContact O-N 2.76Å; A365-S368 WeakPolarHBondContact CA-OG 3.22Å; A365-S368 PolarHBondContact O-N 3.07Å; A365-S368 VanDerWaalsContact O-N 3.13Å; A365-S368 PolarHBondContact O-OG 3.46Å; A365-L369 PolarHBondContact O-N 3Å; A365-L369 VanDerWaalsContact O-N 3.1Å
366	L	95.7	Very high	93.2	Very high	1 Å²	1	57.6 Å²	57.6	1%	0.005	30%	0.299	C	S	.	.	H	α-helix	trans	-59.5	-39.3	176.2	-74.4	170.1	0	0	0	113	Y242 T334 M337 T347 L351 K362 D363 L369	Y242-L366 HydrophobicContact CE1-CB 4.14Å; T334-L366 HydrophobicContact CG2-CD1 4.09Å; M337-L366 HydrophobicContact CE-CD1 3.26Å; M337-L366 HydrophobicContact SD-CD1 3.83Å; T347-L366 HydrophobicContact CG2-CD2 3.41Å; T347-L366 VanDerWaalsContact CG2-CD2 3.41Å; L351-L366 HydrophobicContact CD1-CD2 4Å; L351-L366 HydrophobicContact CD1-CG 4.46Å; L351-L366 HydrophobicContact CD2-CD2 4.29Å; L351-L366 HydrophobicContact CD2-CG 4.35Å; L351-L366 HydrophobicContact CG-CD2 4.34Å; K362-L366 WeakPolarHBondContact O-CB 3.42Å; K362-L366 VanDerWaalsContact O-CG 3.31Å; K362-L366 WeakPolarHBondContact O-CG 3.15Å; K362-L366 PolarHBondContact O-N 3.33Å; D363-L366 PolarHBondContact O-N 3.19Å; L366-L369 WeakPolarHBondContact O-CB 3.32Å; L366-L369 PolarHBondContact O-N 3.37Å
367	Y	94.5	Very high	93.2	Very high	57 Å²	57	57.9 Å²	57.9	22%	0.224	30%	0.301	C	S	.	.	H	α-helix	trans	-70.1	-36.6	176.2	-170.3	-92.8	0	0	0	112.5	A329 Q331 D363 M364 A365 L369 L370	A329-Y367 WeakPolarHBondContact O-CE2 3.22Å; Q331-Y367 HydrophobicContact CB-CD1 4.4Å; Q331-Y367 HydrophobicContact CB-CD2 4.39Å; Q331-Y367 HydrophobicContact CB-CG 4.16Å; Q331-Y367 HydrophobicContact CG-CD1 3.17Å; Q331-Y367 HydrophobicContact CG-CD2 3.81Å; Q331-Y367 HydrophobicContact CG-CE1 3.44Å; Q331-Y367 VanDerWaalsContact CG-CE1 3.44Å; Q331-Y367 HydrophobicContact CG-CE2 4.05Å; Q331-Y367 HydrophobicContact CG-CG 3.35Å; D363-Y367 WeakPolarHBondContact O-CB 3.41Å; D363-Y367 PolarHBondContact O-N 2.82Å; M364-Y367 PolarHBondContact O-N 3.3Å; A365-Y367 VanDerWaalsContact C-N 3.31Å; A365-Y367 PolarHBondContact O-N 2.76Å; Y367-L369 VanDerWaalsContact C-N 3.26Å; Y367-L369 PolarHBondContact O-N 2.94Å; Y367-L370 HydrophobicContact CD2-CD1 3.92Å; Y367-L370 HydrophobicContact CE2-CD1 4.18Å; Y367-L370 WeakPolarHBondContact O-CB 3.21Å; Y367-L370 PolarHBondContact O-N 2.89Å
368	S	94.6	Very high	93.3	Very high	22 Å²	22	54.5 Å²	54.5	15%	0.154	29%	0.285	C	S	.	.	H	α-helix	trans	-64.1	-33	177.2	70.7	0	0	0	0	112.2	Y350 M364 A365 L370 R371 A372	Y350-S368 PolarHBondContact OH-OG 3.44Å; M364-S368 VanDerWaalsContact O-CB 3.31Å; M364-S368 WeakPolarHBondContact O-CB 3.26Å; M364-S368 PolarHBondContact O-N 3.38Å; M364-S368 PolarHBondContact O-OG 3.24Å; A365-S368 WeakPolarHBondContact CA-OG 3.22Å; A365-S368 PolarHBondContact O-N 3.07Å; A365-S368 VanDerWaalsContact O-N 3.13Å; A365-S368 PolarHBondContact O-OG 3.46Å; S368-L370 VanDerWaalsContact C-N 3.26Å; S368-L370 PolarHBondContact O-N 3.24Å; S368-R371 PolarHBondContact O-N 2.92Å; S368-A372 WeakPolarHBondContact O-CB 3.29Å; S368-A372 PolarHBondContact O-N 3.28Å
369	L	94.5	Very high	93.6	Very high	5 Å²	5	46 Å²	46	3%	0.026	25%	0.248	C	C	.	.	H	α-helix	trans	-57.2	-38.6	174	177.6	52.1	0	0	0	112.3	L241 Y350 A365 L366 Y367 R371 A372 K373	L241-L369 HydrophobicContact CD1-CD2 4.27Å; L241-L369 HydrophobicContact CD2-CB 4.48Å; L241-L369 HydrophobicContact CD2-CD2 3.53Å; L241-L369 HydrophobicContact CD2-CG 3.85Å; Y350-L369 HydrophobicContact CD1-CB 3.79Å; Y350-L369 HydrophobicContact CD1-CD1 4.12Å; Y350-L369 HydrophobicContact CD1-CD2 3.79Å; Y350-L369 HydrophobicContact CD1-CG 4.11Å; Y350-L369 HydrophobicContact CD2-CD1 3.7Å; Y350-L369 HydrophobicContact CE1-CB 3.68Å; Y350-L369 HydrophobicContact CE1-CG 4.46Å; Y350-L369 HydrophobicContact CE2-CB 4.49Å; Y350-L369 HydrophobicContact CE2-CD1 4.12Å; Y350-L369 HydrophobicContact CG-CB 4.24Å; Y350-L369 HydrophobicContact CG-CD1 3.67Å; Y350-L369 HydrophobicContact CG-CD2 3.87Å; Y350-L369 HydrophobicContact CG-CG 4.14Å; A365-L369 PolarHBondContact O-N 3Å; A365-L369 VanDerWaalsContact O-N 3.1Å; L366-L369 WeakPolarHBondContact O-CB 3.32Å; L366-L369 PolarHBondContact O-N 3.37Å; Y367-L369 VanDerWaalsContact C-N 3.26Å; Y367-L369 PolarHBondContact O-N 2.94Å; L369-R371 VanDerWaalsContact C-N 3.32Å; L369-R371 PolarHBondContact O-N 2.95Å; L369-A372 PolarHBondContact O-N 3.41Å; L369-K373 HydrophobicContact CD1-CB 3.94Å; L369-K373 HydrophobicContact CD1-CG 3.41Å; L369-K373 VanDerWaalsContact CD1-CG 3.41Å; L369-K373 PolarHBondContact O-N 3.41Å
370	L	94.5	Very high	93.9	Very high	19 Å²	19	43.4 Å²	43.4	10%	0.099	22%	0.221	C	C	.	.	H	α-helix	trans	-56.3	-47.9	178.2	-54.1	-177.2	0	0	0	111.4	L241 Y242 Y367 S368 G374 E375 A377	L241-L370 HydrophobicContact CB-CD2 4.29Å; L241-L370 HydrophobicContact CD2-CD2 3.75Å; Y242-L370 HydrophobicContact CE1-CD2 4.17Å; Y367-L370 HydrophobicContact CD2-CD1 3.92Å; Y367-L370 HydrophobicContact CE2-CD1 4.18Å; Y367-L370 WeakPolarHBondContact O-CB 3.21Å; Y367-L370 PolarHBondContact O-N 2.89Å; S368-L370 VanDerWaalsContact C-N 3.26Å; S368-L370 PolarHBondContact O-N 3.24Å; L370-G374 CarbonylContact O-C 3.53Å; L370-G374 VanDerWaalsContact O-CA 3.28Å; L370-G374 WeakPolarHBondContact O-CA 3.46Å; L370-G374 PolarHBondContact O-N 2.88Å; L370-E375 HydrophobicContact CD2-CB 4.06Å; L370-E375 PolarHBondContact O-N 2.91Å; L370-A377 HydrophobicContact CD1-CB 3.88Å; L370-A377 HydrophobicContact CD2-CB 3.67Å; L370-A377 HydrophobicContact CG-CB 4.42Å
371	R	91.2	Very high	94	Very high	183 Å²	183	41 Å²	41	69%	0.691	21%	0.211	S	C	*	.	H	α-helix	trans	-73.8	-41.5	178	-72.1	-171.8	-75.2	172.4	-3.7	112.3	S368 L369 K373	S368-R371 PolarHBondContact O-N 2.92Å; L369-R371 VanDerWaalsContact C-N 3.32Å; L369-R371 PolarHBondContact O-N 2.95Å; R371-K373 VanDerWaalsContact C-N 3.32Å; R371-K373 PolarHBondContact O-N 2.85Å
372	A	90.4	Very high	94.1	Very high	67 Å²	67	41 Å²	41	55%	0.554	21%	0.21	S	C	*	.	H	α-helix	trans	-67.6	-30.5	-174.9	0	0	0	0	0	113.4	S368 L369	S368-A372 WeakPolarHBondContact O-CB 3.29Å; S368-A372 PolarHBondContact O-N 3.28Å; L369-A372 PolarHBondContact O-N 3.41Å
373	K	91.9	Very high	94.1	Very high	149 Å²	149	40.8 Å²	40.8	65%	0.648	21%	0.209	S	C	*	.	H	α-helix	trans	-118	2.7	-177.3	-62.9	-65	-174.4	178.6	0	114.1	L369 R371 E375	L369-K373 HydrophobicContact CD1-CB 3.94Å; L369-K373 HydrophobicContact CD1-CG 3.41Å; L369-K373 VanDerWaalsContact CD1-CG 3.41Å; L369-K373 PolarHBondContact O-N 3.41Å; R371-K373 VanDerWaalsContact C-N 3.32Å; R371-K373 PolarHBondContact O-N 2.85Å; K373-E375 HydrophobicContact CB-CG 3.83Å; K373-E375 PolarHBondContact O-N 2.85Å
374	G	91.3	Very high	94.3	Very high	67 Å²	67	39.2 Å²	39.2	69%	0.691	20%	0.201	S	C	*	.	T	Hydrogen-bonded Turn	trans	66	24.6	-175.7	0	0	0	0	0	113.1	L370	L370-G374 CarbonylContact O-C 3.53Å; L370-G374 VanDerWaalsContact O-CA 3.28Å; L370-G374 WeakPolarHBondContact O-CA 3.46Å; L370-G374 PolarHBondContact O-N 2.88Å
375	E	93.7	Very high	94.4	Very high	40 Å²	40	36 Å²	36	19%	0.187	19%	0.185	C	C	.	.			trans	-78.6	156.8	178.4	-65.7	-86.1	-169.2	0	0	110.1	L241 R346 L370 K373	L241-E375 HydrophobicContact CB-CB 4.26Å; L241-E375 HydrophobicContact CD1-CG 4.44Å; L241-E375 HydrophobicContact CD2-CB 4.36Å; R346-E375 IonicContact CZ-OE1 3.86Å; R346-E375 IonicContact CZ-OE2 3.93Å; R346-E375 IonicContact NE-OE1 3.75Å; R346-E375 PolarHBondContact NE-OE1 2.84Å; R346-E375 IonicContact NE-OE2 3.93Å; R346-E375 IonicContact NH2-OE1 2.83Å; R346-E375 PolarHBondContact NH2-OE1 3.18Å; R346-E375 IonicContact NH2-OE2 2.65Å; R346-E375 PolarHBondContact NH2-OE2 3.03Å; L370-E375 HydrophobicContact CD2-CB 4.06Å; L370-E375 PolarHBondContact O-N 2.91Å; K373-E375 HydrophobicContact CB-CG 3.83Å; K373-E375 PolarHBondContact O-N 2.85Å
376	R	94.9	Very high	94.4	Very high	105 Å²	105	41.3 Å²	41.3	40%	0.396	21%	0.208	S	C	.	.			trans	-117.5	143.7	177.2	-66.6	177.4	-68.2	164.8	4.8	109.7	H236 A240 L241 Y378	H236-R376 PolarHBondContact O-NH1 3.48Å; H236-R376 PolarHBondContact O-NH2 2.84Å; A240-R376 CarbonylContact C-O 3.57Å; A240-R376 WeakPolarHBondContact CA-O 3.39Å; L241-R376 PolarHBondContact N-O 3.23Å; R376-Y378 HydrophobicContact CB-CE2 4.32Å
377	A	95.6	Very high	94.3	Very high	6 Å²	6	44.7 Å²	44.7	5%	0.05	22%	0.224	C	C	.	.			trans	-140.7	157.8	171.6	0	0	0	0	0	109.9	Y242 A329 L370	Y242-A377 HydrophobicContact CD1-CB 3.97Å; Y242-A377 HydrophobicContact CD2-CB 3.57Å; Y242-A377 HydrophobicContact CE1-CB 3.75Å; Y242-A377 HydrophobicContact CE2-CB 3.3Å; Y242-A377 HydrophobicContact CG-CB 3.89Å; Y242-A377 VanDerWaalsContact CZ-CB 3.4Å; Y242-A377 WeakPolarHBondContact O-CA 3.25Å; Y242-A377 WeakPolarHBondContact O-CB 3.26Å; A329-A377 HydrophobicContact CB-CB 3.92Å; A329-A377 PolarHBondContact N-O 2.92Å; L370-A377 HydrophobicContact CD1-CB 3.88Å; L370-A377 HydrophobicContact CD2-CB 3.67Å; L370-A377 HydrophobicContact CG-CB 4.42Å
378	Y	95.2	Very high	94.2	Very high	23 Å²	23	42.6 Å²	42.6	9%	0.09	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132	163.8	-173.3	-57.8	-79.3	0	0	0	111.3	F232 H236 L237 A240 Y242 L243 K244 V326 V327 R376	F232-Y378 AromaticContact CE1-CD2 3.99Å; F232-Y378 HydrophobicContact CE1-CD2 3.99Å; F232-Y378 HydrophobicContact CZ-CD2 4.1Å; H236-Y378 PolarHBondContact O-OH 3.07Å; L237-Y378 HydrophobicContact CD2-CD1 4.22Å; L237-Y378 HydrophobicContact CD2-CD2 4.12Å; L237-Y378 HydrophobicContact CD2-CE1 3.68Å; L237-Y378 HydrophobicContact CD2-CE2 3.55Å; L237-Y378 HydrophobicContact CD2-CG 4.43Å; A240-Y378 HydrophobicContact CB-CD2 3.7Å; A240-Y378 HydrophobicContact CB-CE2 3.78Å; Y242-Y378 PolarHBondContact O-N 2.79Å; Y242-Y378 VanDerWaalsContact O-N 3.11Å; L243-Y378 CarbonylContact C-O 3.52Å; L243-Y378 WeakPolarHBondContact CA-O 3.47Å; K244-Y378 PolarHBondContact N-O 2.87Å; V326-Y378 VanDerWaalsContact CG1-CB 3.45Å; V326-Y378 HydrophobicContact CG1-CD1 3.94Å; V326-Y378 HydrophobicContact CG1-CD2 4.43Å; V326-Y378 HydrophobicContact CG1-CG 3.69Å; V327-Y378 CarbonylContact O-C 3.53Å; V327-Y378 WeakPolarHBondContact O-CA 3.23Å; V327-Y378 WeakPolarHBondContact O-CB 3.49Å; R376-Y378 HydrophobicContact CB-CE2 4.32Å
379	V	94.3	Very high	93.8	Very high	2 Å²	2	42.1 Å²	42.1	1%	0.012	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	141.3	171.1	62	0	0	0	0	109.2	K244 H247 V327	K244-V379 HydrophobicContact CB-CB 3.96Å; K244-V379 HydrophobicContact CB-CG2 3.82Å; K244-V379 WeakPolarHBondContact O-CA 3.14Å; H247-V379 HydrophobicContact CB-CG2 4.09Å; V327-V379 HydrophobicContact CG2-CG1 3.39Å; V327-V379 PolarHBondContact N-O 2.87Å; V327-V379 PolarHBondContact O-N 2.87Å
380	V	95	Very high	93.3	Very high	0 Å²	0	43 Å²	43	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	132.9	173.9	-178	0	0	0	0	109.1	L227 L243 K244 L245 Y324 S325 L384	L227-V380 HydrophobicContact CD1-CB 4.41Å; L227-V380 HydrophobicContact CD1-CG1 3.94Å; L227-V380 HydrophobicContact CD1-CG2 3.51Å; L243-V380 HydrophobicContact CD1-CG2 3.47Å; L243-V380 VanDerWaalsContact CD1-CG2 3.47Å; L243-V380 HydrophobicContact CD2-CG2 3.63Å; L243-V380 HydrophobicContact CG-CG2 3.61Å; K244-V380 PolarHBondContact O-N 2.66Å; L245-V380 HydrophobicContact CD2-CG2 3.95Å; Y324-V380 HydrophobicContact CD1-CG1 3.52Å; Y324-V380 HydrophobicContact CE1-CG1 4.26Å; Y324-V380 HydrophobicContact CG-CG1 4.39Å; S325-V380 WeakPolarHBondContact O-CA 3.39Å; V380-L384 HydrophobicContact CG1-CD1 4.14Å; V380-L384 HydrophobicContact CG1-CG 4.15Å
381	E	94.3	Very high	92.4	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	130.4	171.7	-55.9	-179.4	131.8	0	0	110.7	R261 R310 L314 S325 V327	R261-E381 IonicContact NH2-OE1 3.33Å; R310-E381 IonicContact CZ-OE1 3.64Å; R310-E381 IonicContact CZ-OE2 3.54Å; R310-E381 IonicContact NH1-OE1 3.28Å; R310-E381 PolarHBondContact NH1-OE1 2.92Å; R310-E381 IonicContact NH1-OE2 3.67Å; R310-E381 PolarHBondContact NH1-OE2 3.4Å; R310-E381 VanDerWaalsContact NH1-OE2 3.16Å; R310-E381 IonicContact NH2-OE1 3.23Å; R310-E381 IonicContact NH2-OE2 2.91Å; R310-E381 PolarHBondContact NH2-OE2 2.86Å; L314-E381 HydrophobicContact CD1-CB 4.09Å; L314-E381 HydrophobicContact CD2-CB 4.45Å; S325-E381 PolarHBondContact N-O 3.21Å; S325-E381 PolarHBondContact O-N 3.36Å; S325-E381 WeakPolarHBondContact OG-CB 3.18Å; S325-E381 PolarHBondContact OG-O 3.36Å; V327-E381 HydrophobicContact CG2-CG 4.2Å
382	P	95.5	Very high	91.5	Very high	3 Å²	3	37.9 Å²	37.9	2%	0.019	21%	0.209	C	C	.	.	S	Bend	cis	-71.9	170.4	1.9	29.3	-36.1	0	0	0	113.9	L314 R317 R318 Y324	L314-P382 HydrophobicContact CB-CB 4.17Å; R317-P382 HydrophobicContact CB-CG 4.49Å; R318-P382 HydrophobicContact CG-CG 3.6Å; Y324-P382 HydrophobicContact CD1-CG 4.17Å; Y324-P382 HydrophobicContact CE1-CG 3.59Å; Y324-P382 WeakPolarHBondContact CE1-O 3.27Å
383	N	96	Very high	90.4	Very high	6 Å²	6	38.4 Å²	38.4	3%	0.032	21%	0.208	C	C	.	.			trans	-58.5	138.6	-179.3	-66.8	-25.2	0	0	0	111.1	L245 Y246 H247 E249 R318	L245-N383 WeakPolarHBondContact O-CA 3.38Å; Y246-N383 WeakPolarHBondContact CA-OD1 3.18Å; Y246-N383 HydrophobicContact CD2-CB 4.1Å; Y246-N383 WeakPolarHBondContact CD2-ND2 3.39Å; Y246-N383 WeakPolarHBondContact CE2-ND2 3.29Å; H247-N383 PolarHBondContact N-OD1 2.8Å; H247-N383 PolarHBondContact O-ND2 3.33Å; H247-N383 PolarHBondContact O-OD1 3.18Å; E249-N383 PolarHBondContact OE1-ND2 3.33Å; R318-N383 PolarHBondContact NH1-O 3.19Å; R318-N383 PolarHBondContact NH2-O 3.47Å
384	L	97.4	Very high	89.3	Confident	0 Å²	0	33.8 Å²	33.8	0%	0	19%	0.19	C	C	.	.	S	Bend	trans	-97.5	-2.8	174.8	-67.6	-178.2	0	0	0	113.3	E217 Q219 I220 V223 L224 L245 Y324 V380	E217-L384 PolarHBondContact N-O 2.85Å; Q219-L384 HydrophobicContact CG-CD2 4.43Å; I220-L384 HydrophobicContact CG1-CB 4.23Å; V223-L384 HydrophobicContact CB-CD1 4.07Å; V223-L384 HydrophobicContact CB-CD2 4.01Å; V223-L384 HydrophobicContact CG1-CD1 3.76Å; V223-L384 HydrophobicContact CG1-CD2 3.99Å; V223-L384 HydrophobicContact CG1-CG 4.43Å; V223-L384 HydrophobicContact CG2-CD2 4.13Å; L224-L384 HydrophobicContact CD2-CD1 4.08Å; L224-L384 HydrophobicContact CG-CD1 4.24Å; L245-L384 HydrophobicContact CB-CB 4.25Å; L245-L384 HydrophobicContact CD2-CD1 4.29Å; L245-L384 PolarHBondContact O-N 2.98Å; Y324-L384 HydrophobicContact CD1-CD2 4.28Å; Y324-L384 HydrophobicContact CE1-CD2 3.42Å; Y324-L384 VanDerWaalsContact CE1-CD2 3.42Å; Y324-L384 HydrophobicContact CE1-CG 4.21Å; V380-L384 HydrophobicContact CG1-CD1 4.14Å; V380-L384 HydrophobicContact CG1-CG 4.15Å
385	V	97.1	Very high	88	Confident	0 Å²	0	39.6 Å²	39.6	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	152.7	169.4	-55.7	0	0	0	0	109.7	A214 V215 I220 Y246 A336	A214-V385 HydrophobicContact CB-CB 4.16Å; A214-V385 HydrophobicContact CB-CG2 3.99Å; V215-V385 CarbonylContact O-C 3.03Å; V215-V385 WeakPolarHBondContact O-CA 3.49Å; V215-V385 WeakPolarHBondContact O-CB 3.16Å; I220-V385 HydrophobicContact CD1-CG1 4.2Å; Y246-V385 HydrophobicContact CD2-CG2 4.27Å; Y246-V385 WeakPolarHBondContact CD2-O 3.32Å; Y246-V385 HydrophobicContact CG-CG2 4.31Å; A336-V385 HydrophobicContact CB-CB 4.35Å; A336-V385 HydrophobicContact CB-CG1 3.7Å; A336-V385 HydrophobicContact CB-CG2 3.68Å
386	K	94.7	Very high	86.3	Confident	112 Å²	112	47.2 Å²	47.2	49%	0.487	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	131.7	168.9	-64.3	177.2	-171.6	158.6	0	108.7	A214 V215 E217	A214-K386 CarbonylContact C-O 3.45Å; A214-K386 WeakPolarHBondContact CA-O 3.4Å; V215-K386 PolarHBondContact N-O 3.38Å; V215-K386 PolarHBondContact O-N 3.21Å; E217-K386 WeakPolarHBondContact OE1-CE 3.45Å; E217-K386 IonicContact OE1-NZ 3.88Å; E217-K386 WeakPolarHBondContact OE2-CE 3.47Å; E217-K386 IonicContact OE2-NZ 3.23Å; E217-K386 PolarHBondContact OE2-NZ 3.44Å
387	H	93.3	Very high	84.7	Confident	73 Å²	73	46.1 Å²	46.1	34%	0.338	22%	0.222	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-85	113.5	173.2	-178.8	-93.4	0	0	0	109.6	D213 Y246 G389	D213-H387 CarbonylContact O-C 3.6Å; D213-H387 WeakPolarHBondContact O-CA 3.47Å; D213-H387 IonicContact OD1-CD2 2.67Å; D213-H387 IonicContact OD1-NE2 2.74Å; D213-H387 IonicContact OD2-NE2 3.5Å; D213-H387 PolarHBondContact OD2-NE2 3.16Å; Y246-H387 HydrophobicContact CE1-CB 4.2Å; Y246-H387 HydrophobicContact CE2-CB 3.97Å; H387-G389 PolarHBondContact CE1-O 3.13Å
388	I	93.1	Very high	82.9	Confident	12 Å²	12	53.2 Å²	53.2	6%	0.062	25%	0.252	C	S	.	.			trans	-102.4	-5.7	-175.9	62.5	164.4	0	0	0	114.1	F65 Y117 Q120 D213 V215 L390	F65-I388 WeakPolarHBondContact CE1-O 3.33Å; F65-I388 HydrophobicContact CZ-CB 4.24Å; F65-I388 HydrophobicContact CZ-CG2 4.46Å; Y117-I388 HydrophobicContact CD1-CD1 3.59Å; Y117-I388 HydrophobicContact CD1-CG1 3.78Å; Y117-I388 HydrophobicContact CE1-CD1 4.18Å; Y117-I388 HydrophobicContact CE1-CG1 4.11Å; Y117-I388 VanDerWaalsContact CE1-O 3.24Å; Y117-I388 WeakPolarHBondContact CE1-O 3.4Å; Q120-I388 HydrophobicContact CB-CD1 4.07Å; Q120-I388 HydrophobicContact CG-CD1 4.49Å; Q120-I388 VanDerWaalsContact OE1-CD1 3.26Å; D213-I388 HydrophobicContact CB-CG1 4.26Å; D213-I388 WeakPolarHBondContact O-CG1 3.48Å; D213-I388 PolarHBondContact O-N 3.18Å; V215-I388 HydrophobicContact CG2-CD1 3.47Å; V215-I388 VanDerWaalsContact CG2-CD1 3.47Å; V215-I388 HydrophobicContact CG2-CG1 3.97Å; V215-I388 HydrophobicContact CG2-CG2 4.1Å; I388-L390 PolarHBondContact O-N 3.24Å
389	G	86.5	Confident	81.4	Confident	12 Å²	12	59.9 Å²	59.9	12%	0.124	28%	0.283	C	S	.	.			trans	-73.9	109.6	-175.7	0	0	0	0	0	111.9	H387	H387-G389 PolarHBondContact CE1-O 3.13Å
390	L	82.6	Confident	80.4	Confident	25 Å²	25	60.3 Å²	60.3	13%	0.131	29%	0.287	C	S	.	.	S	Bend	trans	-92.5	-28.4	168.3	-83.2	-175.3	0	0	0	111.9	F65 L66 Y117 I388 P400 L402	F65-L390 HydrophobicContact CD1-CD1 3.35Å; F65-L390 HydrophobicContact CD1-CG 3.85Å; F65-L390 HydrophobicContact CE1-CD1 3.81Å; F65-L390 HydrophobicContact CE1-CG 3.77Å; F65-L390 HydrophobicContact CG-CD1 4.36Å; L66-L390 HydrophobicContact CD1-CD1 4.43Å; L66-L390 HydrophobicContact CD2-CB 4.29Å; L66-L390 HydrophobicContact CD2-CD1 3.44Å; L66-L390 VanDerWaalsContact CD2-CD1 3.44Å; L66-L390 HydrophobicContact CG-CD1 3.59Å; Y117-L390 PolarHBondContact OH-N 3.27Å; I388-L390 PolarHBondContact O-N 3.24Å; L390-P400 HydrophobicContact CB-CB 3.76Å; L390-P400 HydrophobicContact CB-CG 3.87Å; L390-P400 HydrophobicContact CD1-CG 4.46Å; L390-P400 HydrophobicContact CD2-CB 4.32Å; L390-P400 HydrophobicContact CG-CB 4.45Å; L390-P400 WeakPolarHBondContact O-CB 3.47Å; L390-L402 HydrophobicContact CD2-CD2 4.23Å
391	F	76.9	Confident	79.3	Confident	35 Å²	35	62.4 Å²	62.4	15%	0.154	30%	0.301	C	S	.	.	S	Bend	trans	-99.8	114.3	175.6	-62.9	-80.7	0	0	0	109.7	L66 R111 Q112 F115 N397 P400	L66-F391 HydrophobicContact CD2-CE2 3.76Å; L66-F391 HydrophobicContact CD2-CZ 4.29Å; R111-F391 PolarHBondContact NH1-O 3.02Å; Q112-F391 VanDerWaalsContact OE1-CD1 3.27Å; F115-F391 HydrophobicContact CD2-CD2 4.28Å; F115-F391 HydrophobicContact CD2-CE2 4.23Å; F115-F391 HydrophobicContact CE1-CE2 4.37Å; F115-F391 AromaticContact CE2-CD2 3.97Å; F115-F391 HydrophobicContact CE2-CD2 3.97Å; F115-F391 AromaticContact CE2-CE2 3.46Å; F115-F391 HydrophobicContact CE2-CE2 3.46Å; F115-F391 VanDerWaalsContact CE2-CE2 3.46Å; F115-F391 HydrophobicContact CE2-CZ 4.3Å; F115-F391 HydrophobicContact CZ-CD2 4.33Å; F115-F391 AromaticContact CZ-CE2 3.56Å; F115-F391 HydrophobicContact CZ-CE2 3.56Å; F115-F391 HydrophobicContact CZ-CZ 4.42Å; F391-N397 WeakPolarHBondContact CE1-O 3.31Å; F391-P400 HydrophobicContact CD1-CG 4.13Å; F391-P400 HydrophobicContact CD2-CG 4.41Å; F391-P400 HydrophobicContact CE1-CG 3.58Å; F391-P400 HydrophobicContact CE2-CG 3.88Å; F391-P400 HydrophobicContact CZ-CG 3.44Å; F391-P400 VanDerWaalsContact CZ-CG 3.44Å
392	S	71.8	Confident	78.3	Confident	58 Å²	58	64.5 Å²	64.5	41%	0.406	31%	0.312	S	S	.	.			trans	-90.8	139.2	179	179.2	0	0	0	0	110.9	L394 R395	S392-L394 PolarHBondContact O-N 3.16Å; S392-L394 PolarHBondContact OG-N 3.4Å; S392-L394 VanDerWaalsContact OG-N 3.12Å; S392-R395 PolarHBondContact O-N 3.3Å
393	S	68.3	Low	77.2	Confident	79 Å²	79	68.4 Å²	68.4	55%	0.552	33%	0.332	S	S	*	.	S	Bend	trans	-66.9	-20.8	168.7	55	0	0	0	0	113.1
394	L	66.9	Low	76.3	Confident	51 Å²	51	71.5 Å²	71.5	27%	0.267	35%	0.347	S	S	.	.	S	Bend	trans	-89	-21.9	179.6	-63.6	177.7	0	0	0	113.5	F184 E187 S392	F184-L394 HydrophobicContact CE1-CD1 4.38Å; E187-L394 HydrophobicContact CB-CD2 4.47Å; S392-L394 PolarHBondContact O-N 3.16Å; S392-L394 PolarHBondContact OG-N 3.4Å; S392-L394 VanDerWaalsContact OG-N 3.12Å
395	R	64.9	Low	75.1	Confident	189 Å²	189	75.3 Å²	75.3	71%	0.713	37%	0.365	S	S	*	.	S	Bend	trans	-139.3	113.9	-173	-63.1	-175	-173.2	-177	3.4	110.7	S392 N397	S392-R395 PolarHBondContact O-N 3.3Å; R395-N397 PolarHBondContact O-N 3.3Å
396	Y	58.1	Low	73.9	Confident	201 Å²	201	79.4 Å²	79.4	79%	0.788	39%	0.386	S	S	*	.			trans	-67.5	116.7	172.8	-144.7	-81.8	0	0	0	110	F398	Y396-F398 HydrophobicContact CD1-CD2 4.04Å; Y396-F398 HydrophobicContact CD1-CE1 4.49Å; Y396-F398 AromaticContact CD1-CE2 3.64Å; Y396-F398 HydrophobicContact CD1-CE2 3.64Å; Y396-F398 AromaticContact CD1-CZ 3.92Å; Y396-F398 HydrophobicContact CD1-CZ 3.92Å; Y396-F398 HydrophobicContact CE1-CD1 4.13Å; Y396-F398 HydrophobicContact CE1-CD2 4.08Å; Y396-F398 AromaticContact CE1-CE1 3.6Å; Y396-F398 HydrophobicContact CE1-CE1 3.6Å; Y396-F398 AromaticContact CE1-CE2 3.52Å; Y396-F398 HydrophobicContact CE1-CE2 3.52Å; Y396-F398 HydrophobicContact CE1-CG 4.37Å; Y396-F398 AromaticContact CE1-CZ 3.28Å; Y396-F398 HydrophobicContact CE1-CZ 3.28Å
397	N	61.9	Low	72.7	Confident	81 Å²	81	77.5 Å²	77.5	43%	0.433	38%	0.38	S	S	.	.			trans	-138.1	114.8	177	-163.1	0.4	0	0	0	110.5	F391 R395 H399	F391-N397 WeakPolarHBondContact CE1-O 3.31Å; R395-N397 PolarHBondContact O-N 3.3Å; N397-H399 VanDerWaalsContact C-N 3.3Å; N397-H399 PolarHBondContact OD1-N 3.06Å
398	F	57.7	Low	71.4	Confident	156 Å²	156	77.8 Å²	77.8	68%	0.684	38%	0.382	S	S	*	.	S	Bend	trans	-75.9	-19.4	179.6	-71.1	-83.5	0	0	0	113	Y396	Y396-F398 HydrophobicContact CD1-CD2 4.04Å; Y396-F398 HydrophobicContact CD1-CE1 4.49Å; Y396-F398 AromaticContact CD1-CE2 3.64Å; Y396-F398 HydrophobicContact CD1-CE2 3.64Å; Y396-F398 AromaticContact CD1-CZ 3.92Å; Y396-F398 HydrophobicContact CD1-CZ 3.92Å; Y396-F398 HydrophobicContact CE1-CD1 4.13Å; Y396-F398 HydrophobicContact CE1-CD2 4.08Å; Y396-F398 AromaticContact CE1-CE1 3.6Å; Y396-F398 HydrophobicContact CE1-CE1 3.6Å; Y396-F398 AromaticContact CE1-CE2 3.52Å; Y396-F398 HydrophobicContact CE1-CE2 3.52Å; Y396-F398 HydrophobicContact CE1-CG 4.37Å; Y396-F398 AromaticContact CE1-CZ 3.28Å; Y396-F398 HydrophobicContact CE1-CZ 3.28Å
399	H	63.8	Low	70	Confident	162 Å²	162	82.2 Å²	82.2	75%	0.75	40%	0.404	S	S	*	.	S	Bend	trans	-133.4	74.2	-178.9	-63.1	-47.2	0	0	0	109.8	N397	N397-H399 VanDerWaalsContact C-N 3.3Å; N397-H399 PolarHBondContact OD1-N 3.06Å
400	P	72.1	Confident	68.8	Low	12 Å²	12	87.2 Å²	87.2	8%	0.078	42%	0.424	C	S	.	.			trans	-69.2	142.4	179.6	32.5	-37.2	0	0	0	111	L66 L390 F391	L66-P400 HydrophobicContact CD2-CG 4.35Å; L390-P400 HydrophobicContact CB-CB 3.76Å; L390-P400 HydrophobicContact CB-CG 3.87Å; L390-P400 HydrophobicContact CD1-CG 4.46Å; L390-P400 HydrophobicContact CD2-CB 4.32Å; L390-P400 HydrophobicContact CG-CB 4.45Å; L390-P400 WeakPolarHBondContact O-CB 3.47Å; F391-P400 HydrophobicContact CD1-CG 4.13Å; F391-P400 HydrophobicContact CD2-CG 4.41Å; F391-P400 HydrophobicContact CE1-CG 3.58Å; F391-P400 HydrophobicContact CE2-CG 3.88Å; F391-P400 HydrophobicContact CZ-CG 3.44Å; F391-P400 VanDerWaalsContact CZ-CG 3.44Å
401	S	72.9	Confident	67.7	Low	44 Å²	44	92 Å²	92	31%	0.308	45%	0.446	S	S	.	.			trans	-122.1	154.4	176	58	0	0	0	0	110.6	L403	S401-L403 PolarHBondContact O-N 2.94Å; S401-L403 PolarHBondContact OG-O 2.93Å; S401-L403 VanDerWaalsContact OG-O 3.09Å
402	L	74	Confident	67	Low	43 Å²	43	96.8 Å²	96.8	23%	0.225	47%	0.471	C	S	.	.			trans	-64.7	3.2	175.1	-70.6	168.9	0	0	0	115	L47 L58 M61 S62 F65 L390	L47-L402 HydrophobicContact CD2-CB 4.11Å; L58-L402 HydrophobicContact CD1-CB 4.32Å; M61-L402 HydrophobicContact CB-CD1 3.79Å; M61-L402 WeakPolarHBondContact O-CD1 3.41Å; S62-L402 PolarHBondContact OG-N 3.49Å; F65-L402 HydrophobicContact CB-CD1 4.14Å; F65-L402 HydrophobicContact CB-CD2 4.12Å; F65-L402 HydrophobicContact CB-CG 4.4Å; F65-L402 HydrophobicContact CD1-CD2 4.15Å; F65-L402 HydrophobicContact CD2-CD2 3.75Å; F65-L402 HydrophobicContact CE2-CD2 4.19Å; F65-L402 HydrophobicContact CG-CD2 3.72Å; L390-L402 HydrophobicContact CD2-CD2 4.23Å
403	L	71.3	Confident	66.5	Low	85 Å²	85	100.3 Å²	100.3	45%	0.445	48%	0.477	S	S	.	.			trans	-126.1	0	-178.6	-72.2	-177.3	0	0	0	112.3	L47 H48 Y52 R54 L58 S401	L47-L403 HydrophobicContact CD1-CD2 3.95Å; L47-L403 HydrophobicContact CD1-CG 4.2Å; H48-L403 VanDerWaalsContact CE1-CD2 3.42Å; H48-L403 WeakPolarHBondContact CE1-CD2 3.41Å; Y52-L403 HydrophobicContact CE1-CD1 4.15Å; R54-L403 HydrophobicContact CG-CD1 4.08Å; L58-L403 HydrophobicContact CD1-CB 4.13Å; L58-L403 HydrophobicContact CD1-CD1 3.79Å; L58-L403 HydrophobicContact CD1-CG 3.69Å; L58-L403 HydrophobicContact CD2-CD1 4.12Å; S401-L403 PolarHBondContact O-N 2.94Å; S401-L403 PolarHBondContact OG-O 2.93Å; S401-L403 VanDerWaalsContact OG-O 3.09Å

Retrieved 403 of 403 residues in 336.5 ms (Link to these results)

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