A0A096NU79_PAPAN Loading...

small monomeric GTPase

AlphaFold DB (Q4R379), UniProt , Accession A0A096NU79, Species PAPAN (Papio anubis, Olive baboon), Gene RALB, Length 206 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	51	Low	49.1	Very low	253 Å²	253	144.3 Å²	144.3	100%	1.246	85%	0.854	S	S	*	*				0	107.9	0	-73.8	178.3	175	0	0	107.6
2	A	43.7	Very low	52.6	Low	108 Å²	108	136.6 Å²	136.6	89%	0.893	81%	0.806	S	S	*	*			trans	-102.9	138.3	-176.5	0	0	0	0	0	109.8
3	A	46.6	Very low	55.9	Low	94 Å²	94	129.2 Å²	129.2	78%	0.777	77%	0.769	S	S	*	*			trans	-152.7	109.5	158.8	0	0	0	0	0	108.6
4	N	46.4	Very low	58.8	Low	140 Å²	140	123.1 Å²	123.1	75%	0.749	73%	0.731	S	S	*	*				76.7	130.8	88.3	-119.5	2.3	0	0	0	111.7
5	K	42	Very low	61.5	Low	171 Å²	171	115.1 Å²	115.1	74%	0.743	68%	0.683	S	S	*	*			cis	-156.6	145.2	19.6	-78	176.5	177.6	177.4	0	109.7
6	S	39.3	Very low	63.7	Low	120 Å²	120	112.4 Å²	112.4	84%	0.839	66%	0.66	S	S	*	*	P	Polyproline II helix	trans	-62.8	125.7	160.8	43.1	0	0	0	0	110.6
7	K	43.4	Very low	65.8	Low	207 Å²	207	105.8 Å²	105.8	90%	0.9	62%	0.621	S	S	*	*	P	Polyproline II helix	trans	-77.1	120.6	165.9	-76.4	-176.9	176.4	179.2	0	107.8	Q9	K7-Q9 PolarHBondContact O-N 3.4Å
8	G	41.3	Very low	67.5	Low	75 Å²	75	100.1 Å²	100.1	77%	0.773	59%	0.588	S	S	*	*	P	Polyproline II helix	trans	-57.6	134.4	175.1	0	0	0	0	0	111	S10	G8-S10 PolarHBondContact O-N 3.03Å
9	Q	44.3	Very low	69.1	Low	196 Å²	196	94.8 Å²	94.8	92%	0.916	56%	0.557	S	S	*	*			trans	-55.5	111.3	167.7	-85.3	174.6	-34.6	0	0	108.4	K7 S11	K7-Q9 PolarHBondContact O-N 3.4Å; Q9-S11 PolarHBondContact O-N 3.47Å; Q9-S11 VanDerWaalsContact O-N 3.16Å
10	S	60.3	Low	70.4	Confident	110 Å²	110	90.2 Å²	90.2	77%	0.769	53%	0.529	S	S	*	.			trans	-62.8	114.6	164.4	53.9	0	0	0	0	107.6	G8 L12	G8-S10 PolarHBondContact O-N 3.03Å; S10-L12 PolarHBondContact O-N 3.48Å
11	S	82	Confident	71.6	Confident	113 Å²	113	86 Å²	86	79%	0.79	51%	0.505	S	S	*	.	P	Polyproline II helix	trans	-61.4	129.5	173.1	55	0	0	0	0	109.5	Q9	Q9-S11 PolarHBondContact O-N 3.47Å; Q9-S11 VanDerWaalsContact O-N 3.16Å
12	L	91.2	Very high	73.5	Confident	52 Å²	52	75 Å²	75	27%	0.272	45%	0.453	S	S	.	.	P	Polyproline II helix	trans	-54.8	144.9	174.3	-61.1	174.6	0	0	0	110.4	S10 L14 K54 E61	S10-L12 PolarHBondContact O-N 3.48Å; L12-L14 PolarHBondContact O-N 3.49Å; L12-K54 HydrophobicContact CD1-CD 3.8Å; L12-K54 HydrophobicContact CD1-CG 4.21Å; L12-E61 HydrophobicContact CD1-CG 4.1Å; L12-E61 HydrophobicContact CD2-CB 4.06Å; L12-E61 HydrophobicContact CD2-CG 3.97Å; L12-E61 WeakPolarHBondContact CD2-O 3.18Å
13	A	95.2	Very high	75.8	Confident	40 Å²	40	71 Å²	71	33%	0.331	42%	0.422	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.4	127	173.2	0	0	0	0	0	109.6	V62 Q63	A13-V62 HydrophobicContact CB-CG1 4.13Å; A13-Q63 PolarHBondContact O-N 3.27Å
14	L	97.2	Very high	78	Confident	44 Å²	44	67.7 Å²	67.7	23%	0.23	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	131.4	176.6	-174.6	65.9	0	0	0	109.6	L12 K16 Q63 D65 K180	L12-L14 PolarHBondContact O-N 3.49Å; L14-K16 HydrophobicContact CD2-CG 4.36Å; L14-K16 HydrophobicContact CG-CG 4.41Å; L14-Q63 CarbonylContact C-O 3.52Å; L14-Q63 VanDerWaalsContact CA-O 3.29Å; L14-Q63 WeakPolarHBondContact CA-O 3.33Å; L14-Q63 HydrophobicContact CD1-CB 3.88Å; L14-Q63 HydrophobicContact CD1-CG 3.75Å; L14-D65 HydrophobicContact CD1-CB 3.93Å; L14-K180 PolarHBondContact O-NZ 3.32Å
15	H	98	Very high	80.3	Confident	3 Å²	3	61 Å²	61	1%	0.014	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	113.4	173.9	-64.9	-46.8	0	0	0	110	Q63 I64 D65 E87 M173 I176	H15-Q63 PolarHBondContact N-O 2.93Å; H15-I64 WeakPolarHBondContact O-CA 3.5Å; H15-D65 PolarHBondContact O-N 3.44Å; H15-E87 WeakPolarHBondContact CA-OE2 3.4Å; H15-M173 HydrophobicContact CB-CG 4.04Å; H15-M173 HydrophobicContact CB-SD 4.49Å; H15-I176 HydrophobicContact CB-CD1 4.31Å; H15-I176 HydrophobicContact CB-CG2 4.49Å; H15-I176 WeakPolarHBondContact ND1-CG2 3.13Å
16	K	98.1	Very high	82.9	Confident	73 Å²	73	53.6 Å²	53.6	32%	0.317	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	107.9	-178.8	-61.4	-179.3	179.4	-178.1	0	111.3	L14 D65 S85 E87 G88	L14-K16 HydrophobicContact CD2-CG 4.36Å; L14-K16 HydrophobicContact CG-CG 4.41Å; K16-D65 CarbonylContact C-O 3.38Å; K16-D65 WeakPolarHBondContact CA-O 3.49Å; K16-D65 HydrophobicContact CG-CB 4.39Å; K16-S85 VanDerWaalsContact CD-O 3.29Å; K16-S85 WeakPolarHBondContact CD-O 3.47Å; K16-E87 HydrophobicContact CB-CB 4.32Å; K16-E87 HydrophobicContact CB-CG 4.03Å; K16-E87 PolarHBondContact N-OE2 3.45Å; K16-E87 WeakPolarHBondContact O-CA 3.44Å; K16-E87 PolarHBondContact O-N 2.91Å; K16-G88 PolarHBondContact O-N 3.33Å; K16-G88 VanDerWaalsContact O-N 3.1Å
17	V	98.3	Very high	85.5	Confident	0 Å²	0	48.3 Å²	48.3	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	133.6	179.5	172.8	0	0	0	0	109.4	M19 I64 D65 I66 L67 G88 L90 F169 L172 I176	V17-M19 HydrophobicContact CG1-SD 4.4Å; V17-I64 HydrophobicContact CB-CD1 4.5Å; V17-I64 HydrophobicContact CG2-CD1 3.96Å; V17-I64 HydrophobicContact CG2-CG1 4.13Å; V17-D65 PolarHBondContact N-O 3.12Å; V17-I66 HydrophobicContact CB-CG1 4.5Å; V17-I66 CarbonylContact O-C 3.47Å; V17-I66 WeakPolarHBondContact O-CA 3.45Å; V17-L67 PolarHBondContact O-N 2.89Å; V17-G88 WeakPolarHBondContact CA-O 3.46Å; V17-L90 HydrophobicContact CG1-CD1 4.43Å; V17-L90 HydrophobicContact CG1-CG 4.21Å; V17-F169 HydrophobicContact CG1-CD1 4.46Å; V17-F169 HydrophobicContact CG1-CE1 4.38Å; V17-L172 HydrophobicContact CB-CD2 4.24Å; V17-L172 HydrophobicContact CG1-CD2 3.58Å; V17-L172 HydrophobicContact CG2-CD2 3.77Å; V17-L172 HydrophobicContact CG2-CG 4.39Å; V17-I176 HydrophobicContact CG2-CD1 3.95Å
18	I	97.2	Very high	88	Confident	3 Å²	3	39.6 Å²	39.6	2%	0.015	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	127.7	173.9	-45.5	-60.4	0	0	0	108.8	V20 L67 T69 F83 G86 G88 F89 L90	I18-V20 HydrophobicContact CB-CG2 4.35Å; I18-V20 HydrophobicContact CG2-CG2 3.9Å; I18-L67 HydrophobicContact CD1-CB 3.62Å; I18-L67 HydrophobicContact CD1-CD2 3.86Å; I18-L67 HydrophobicContact CD1-CG 4.39Å; I18-L67 HydrophobicContact CG2-CD2 4.45Å; I18-T69 HydrophobicContact CG2-CG2 3.91Å; I18-F83 HydrophobicContact CG2-CD1 4.44Å; I18-G86 VanDerWaalsContact CG1-CA 3.47Å; I18-G88 PolarHBondContact N-O 3.15Å; I18-F89 HydrophobicContact CB-CD1 3.85Å; I18-F89 HydrophobicContact CB-CE1 4.07Å; I18-F89 HydrophobicContact CG1-CD1 4.21Å; I18-F89 HydrophobicContact CG1-CE1 3.97Å; I18-F89 WeakPolarHBondContact O-CA 3.32Å; I18-L90 PolarHBondContact O-N 3.47Å
19	M	96.8	Very high	90.6	Very high	0 Å²	0	37 Å²	37	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82	125	170.6	-54.1	-59	-74.1	0	0	108.8	V17 K27 L30 I66 L67 T69 L90 V92 F169	V17-M19 HydrophobicContact CG1-SD 4.4Å; M19-K27 HydrophobicContact CB-CB 3.99Å; M19-K27 HydrophobicContact CB-CD 3.95Å; M19-K27 HydrophobicContact CB-CG 4.17Å; M19-L30 HydrophobicContact CE-CB 4.09Å; M19-L30 HydrophobicContact CE-CD1 4.37Å; M19-I66 HydrophobicContact CG-CG2 3.74Å; M19-I66 HydrophobicContact SD-CG2 4.05Å; M19-L67 PolarHBondContact N-O 3.48Å; M19-T69 WeakPolarHBondContact O-CG2 3.47Å; M19-T69 PolarHBondContact O-OG1 2.99Å; M19-T69 VanDerWaalsContact O-OG1 3.11Å; M19-L90 HydrophobicContact CE-CB 4.33Å; M19-L90 HydrophobicContact CE-CD1 4.07Å; M19-L90 HydrophobicContact SD-CB 3.99Å; M19-L90 HydrophobicContact SD-CD1 3.78Å; M19-L90 HydrophobicContact SD-CG 4.3Å; M19-V92 HydrophobicContact CE-CG2 3.97Å; M19-F169 HydrophobicContact CE-CE1 4.43Å; M19-F169 HydrophobicContact CE-CZ 3.97Å; M19-F169 HydrophobicContact SD-CE1 3.78Å; M19-F169 HydrophobicContact SD-CZ 3.9Å
20	V	95.2	Very high	93.1	Very high	2 Å²	2	27.6 Å²	27.6	1%	0.012	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	140.7	-176.7	-170.3	0	0	0	0	109.7	I18 F83 F89 L90 L91 V92 F107 I111	I18-V20 HydrophobicContact CB-CG2 4.35Å; I18-V20 HydrophobicContact CG2-CG2 3.9Å; V20-F83 HydrophobicContact CG1-CE1 4.02Å; V20-F83 HydrophobicContact CG1-CZ 3.92Å; V20-F83 HydrophobicContact CG2-CD1 4.43Å; V20-F83 HydrophobicContact CG2-CE1 3.66Å; V20-F83 HydrophobicContact CG2-CZ 4.37Å; V20-F89 HydrophobicContact CG2-CD1 3.94Å; V20-L90 PolarHBondContact N-O 3.26Å; V20-L91 HydrophobicContact CB-CD1 4.24Å; V20-L91 HydrophobicContact CG1-CD1 4.1Å; V20-L91 CarbonylContact O-C 3.59Å; V20-L91 WeakPolarHBondContact O-CA 3.35Å; V20-V92 PolarHBondContact O-N 2.8Å; V20-F107 HydrophobicContact CG1-CB 3.72Å; V20-F107 HydrophobicContact CG1-CD1 3.49Å; V20-F107 VanDerWaalsContact CG1-CD1 3.49Å; V20-F107 HydrophobicContact CG1-CD2 4.5Å; V20-F107 HydrophobicContact CG1-CE1 4.23Å; V20-F107 HydrophobicContact CG1-CG 3.66Å; V20-I111 HydrophobicContact CG1-CD1 4.38Å; V20-I111 HydrophobicContact CG2-CD1 4.25Å
21	G	95.2	Very high	94.8	Very high	2 Å²	2	22.4 Å²	22.4	2%	0.021	15%	0.151	C	C	.	.			trans	147.6	166.1	-179.1	0	0	0	0	0	112	K27 G71 V92	G21-K27 PolarHBondContact O-NZ 2.92Å; G21-G71 WeakPolarHBondContact O-CA 3.32Å; G21-V92 WeakPolarHBondContact CA-O 3.46Å
22	S	92.9	Very high	95.5	Very high	23 Å²	23	18.8 Å²	18.8	16%	0.161	12%	0.123	C	C	.	.			trans	-58	167.8	-178	-55.4	0	0	0	0	113.5	V25 K27 G71 A103	S22-V25 VanDerWaalsContact O-CG2 3.28Å; S22-V25 WeakPolarHBondContact O-CG2 3.35Å; S22-K27 PolarHBondContact O-NZ 3.48Å; S22-G71 CarbonylContact C-O 3.46Å; S22-A103 WeakPolarHBondContact OG-CB 3.19Å
23	G	91.4	Very high	95.8	Very high	22 Å²	22	17 Å²	17	23%	0.227	11%	0.113	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.4	149.7	169.4	0	0	0	0	0	111.6	V25 G71	G23-V25 PolarHBondContact O-N 3.3Å; G23-G71 PolarHBondContact N-O 3.5Å; G23-G71 VanDerWaalsContact N-O 3.08Å
24	G	91.8	Very high	95.9	Very high	25 Å²	25	15.1 Å²	15.1	26%	0.258	10%	0.097	S	C	.	.	T	Hydrogen-bonded Turn	trans	70.7	-2.7	172.6	0	0	0	0	0	117.3	G26 Y43 K129	G24-G26 PolarHBondContact O-N 3.06Å; G24-Y43 PolarHBondContact N-OH 3.26Å; G24-Y43 VanDerWaalsContact N-OH 3.17Å; G24-K129 WeakPolarHBondContact O-CE 3.38Å; G24-K129 PolarHBondContact O-NZ 3.03Å
25	V	95.3	Very high	95.8	Very high	0 Å²	0	13.7 Å²	13.7	0%	0	9%	0.09	C	C	.	.	S	Bend	trans	-71.7	-17.1	179.8	-55.6	0	0	0	0	113.7	S22 G23 K27 V92 N128	S22-V25 VanDerWaalsContact O-CG2 3.28Å; S22-V25 WeakPolarHBondContact O-CG2 3.35Å; G23-V25 PolarHBondContact O-N 3.3Å; V25-K27 HydrophobicContact CG2-CG 3.77Å; V25-V92 HydrophobicContact CB-CG1 4.39Å; V25-V92 HydrophobicContact CG2-CB 4.07Å; V25-V92 HydrophobicContact CG2-CG1 3.93Å; V25-N128 PolarHBondContact O-ND2 3.41Å
26	G	95.6	Very high	95.7	Very high	15 Å²	15	19.5 Å²	19.5	16%	0.155	11%	0.112	C	C	.	.	S	Bend	trans	99.3	27.2	177.4	0	0	0	0	0	115.6	G24 A29 L30	G24-G26 PolarHBondContact O-N 3.06Å; G26-A29 PolarHBondContact O-N 3.28Å; G26-L30 WeakPolarHBondContact O-CG 3.5Å; G26-L30 PolarHBondContact O-N 2.79Å
27	K	95.8	Very high	95.5	Very high	10 Å²	10	20.9 Å²	20.9	4%	0.043	12%	0.123	C	C	.	.	H	α-helix	trans	-52.5	-53.9	172.9	-63.5	-172.9	-60.4	-70.9	0	111.9	M19 G21 S22 V25 A29 L30 T31 D68 T69 V92	M19-K27 HydrophobicContact CB-CB 3.99Å; M19-K27 HydrophobicContact CB-CD 3.95Å; M19-K27 HydrophobicContact CB-CG 4.17Å; G21-K27 PolarHBondContact O-NZ 2.92Å; S22-K27 PolarHBondContact O-NZ 3.48Å; V25-K27 HydrophobicContact CG2-CG 3.77Å; K27-A29 PolarHBondContact O-N 3.13Å; K27-L30 PolarHBondContact O-N 3.13Å; K27-T31 PolarHBondContact O-N 3.26Å; K27-T31 PolarHBondContact O-OG1 3.3Å; K27-D68 VanDerWaalsContact CB-OD1 3.31Å; K27-D68 WeakPolarHBondContact CB-OD1 3.17Å; K27-T69 WeakPolarHBondContact CE-O 3.21Å; K27-V92 HydrophobicContact CG-CB 4.27Å; K27-V92 HydrophobicContact CG-CG2 4.38Å
28	S	94.6	Very high	95.2	Very high	23 Å²	23	26.2 Å²	26.2	16%	0.161	15%	0.148	C	C	.	.	H	α-helix	trans	-64	-40.9	178.5	-46.7	0	0	0	0	112.6	L30 T31 L32 T46 D68	S28-L30 VanDerWaalsContact C-N 3.33Å; S28-L30 PolarHBondContact O-N 3.12Å; S28-T31 PolarHBondContact O-N 3.07Å; S28-L32 WeakPolarHBondContact O-CB 3.37Å; S28-L32 VanDerWaalsContact O-CG 3.29Å; S28-L32 WeakPolarHBondContact O-CG 3.42Å; S28-L32 PolarHBondContact O-N 3.09Å; S28-T46 PolarHBondContact OG-OG1 2.71Å; S28-D68 WeakPolarHBondContact CA-OD2 3.02Å; S28-D68 WeakPolarHBondContact CB-OD2 3.5Å; S28-D68 PolarHBondContact N-OD1 3.17Å; S28-D68 PolarHBondContact OG-OD2 3.32Å
29	A	95.7	Very high	94.8	Very high	20 Å²	20	29.7 Å²	29.7	17%	0.165	16%	0.163	C	C	.	.	H	α-helix	trans	-61.5	-41.2	176.6	0	0	0	0	0	111.9	G26 K27 Q33 F39 A159	G26-A29 PolarHBondContact O-N 3.28Å; K27-A29 PolarHBondContact O-N 3.13Å; A29-Q33 WeakPolarHBondContact O-CB 3.42Å; A29-Q33 PolarHBondContact O-N 3.27Å; A29-F39 HydrophobicContact CB-CD2 4.42Å; A29-F39 HydrophobicContact CB-CE2 4.26Å; A29-A159 HydrophobicContact CB-CB 3.64Å
30	L	97.7	Very high	94.2	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-65.7	-44.1	173.9	-72	171.8	0	0	0	111.9	M19 G26 K27 S28 F34 V92 V126 N128 A159 V165 F169	M19-L30 HydrophobicContact CE-CB 4.09Å; M19-L30 HydrophobicContact CE-CD1 4.37Å; G26-L30 WeakPolarHBondContact O-CG 3.5Å; G26-L30 PolarHBondContact O-N 2.79Å; K27-L30 PolarHBondContact O-N 3.13Å; S28-L30 VanDerWaalsContact C-N 3.33Å; S28-L30 PolarHBondContact O-N 3.12Å; L30-F34 WeakPolarHBondContact O-CB 3.37Å; L30-F34 PolarHBondContact O-N 2.81Å; L30-V92 HydrophobicContact CD1-CG1 3.83Å; L30-V92 HydrophobicContact CD1-CG2 4.19Å; L30-V126 HydrophobicContact CD1-CG1 4.25Å; L30-N128 HydrophobicContact CD1-CB 4.3Å; L30-A159 HydrophobicContact CD2-CB 3.94Å; L30-A159 HydrophobicContact CG-CB 4.22Å; L30-V165 HydrophobicContact CD2-CG1 4.46Å; L30-V165 HydrophobicContact CD2-CG2 3.76Å; L30-F169 HydrophobicContact CB-CE2 4.49Å
31	T	96.6	Very high	93.5	Very high	0 Å²	0	40 Å²	40	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-60.5	-51.9	178.1	-59.6	0	0	0	0	111.2	K27 S28 Q33 F34 M35 Y51 I66 D68	K27-T31 PolarHBondContact O-N 3.26Å; K27-T31 PolarHBondContact O-OG1 3.3Å; S28-T31 PolarHBondContact O-N 3.07Å; T31-Q33 PolarHBondContact O-N 3.22Å; T31-F34 PolarHBondContact O-N 3.02Å; T31-M35 HydrophobicContact CG2-CG 4.2Å; T31-M35 VanDerWaalsContact O-CB 3.3Å; T31-M35 WeakPolarHBondContact O-CB 3.46Å; T31-M35 WeakPolarHBondContact O-CG 3.46Å; T31-M35 PolarHBondContact O-N 3.44Å; T31-Y51 HydrophobicContact CG2-CD2 3.4Å; T31-Y51 VanDerWaalsContact CG2-CD2 3.4Å; T31-Y51 HydrophobicContact CG2-CE2 3.82Å; T31-Y51 HydrophobicContact CG2-CG 3.91Å; T31-I66 HydrophobicContact CG2-CB 4.32Å; T31-I66 HydrophobicContact CG2-CD1 4.37Å; T31-I66 HydrophobicContact CG2-CG2 3.85Å; T31-D68 HydrophobicContact CG2-CB 4.43Å
32	L	95.3	Very high	92.7	Very high	37 Å²	37	46.5 Å²	46.5	19%	0.194	25%	0.251	C	S	.	.	H	α-helix	trans	-64.3	-41.6	-179.9	-66.7	176	0	0	0	111.9	S28 F34 M35 Y36 V40 Y51	S28-L32 WeakPolarHBondContact O-CB 3.37Å; S28-L32 VanDerWaalsContact O-CG 3.29Å; S28-L32 WeakPolarHBondContact O-CG 3.42Å; S28-L32 PolarHBondContact O-N 3.09Å; L32-F34 VanDerWaalsContact C-N 3.34Å; L32-F34 PolarHBondContact O-N 2.69Å; L32-M35 PolarHBondContact O-N 3.24Å; L32-Y36 HydrophobicContact CD2-CD2 3.88Å; L32-Y36 HydrophobicContact CD2-CE2 3.93Å; L32-Y36 PolarHBondContact O-N 3.23Å; L32-V40 HydrophobicContact CD1-CG2 4.46Å; L32-Y51 HydrophobicContact CD2-CE1 4.07Å
33	Q	97.2	Very high	91.7	Very high	14 Å²	14	51.5 Å²	51.5	7%	0.065	27%	0.267	C	S	.	.	H	α-helix	trans	-59.8	-45.5	175.6	-178.3	64.2	-91.6	0	0	110.7	A29 T31 D37 E38 A159 R162 V165	A29-Q33 WeakPolarHBondContact O-CB 3.42Å; A29-Q33 PolarHBondContact O-N 3.27Å; T31-Q33 PolarHBondContact O-N 3.22Å; Q33-D37 VanDerWaalsContact O-CA 3.26Å; Q33-D37 WeakPolarHBondContact O-CA 3.44Å; Q33-D37 PolarHBondContact O-N 2.84Å; Q33-D37 VanDerWaalsContact OE1-C 3.27Å; Q33-E38 VanDerWaalsContact CA-O 3.23Å; Q33-E38 WeakPolarHBondContact CA-O 3.31Å; Q33-E38 PolarHBondContact N-O 3.28Å; Q33-A159 PolarHBondContact NE2-O 3.27Å; Q33-R162 HydrophobicContact CG-CB 4.28Å; Q33-R162 HydrophobicContact CG-CG 3.85Å; Q33-R162 PolarHBondContact O-NH1 2.87Å; Q33-V165 HydrophobicContact CB-CG1 4.23Å; Q33-V165 HydrophobicContact CG-CB 4.34Å; Q33-V165 HydrophobicContact CG-CG1 4Å; Q33-V165 HydrophobicContact CG-CG2 4.04Å
34	F	97.9	Very high	90.9	Very high	2 Å²	2	58.1 Å²	58.1	1%	0.009	29%	0.292	C	S	.	.	H	α-helix	trans	-67.6	-37	176.2	179	-103.3	0	0	0	113.6	L30 T31 L32 K53 V55 I64 I66 V165 D166 F169 F170	L30-F34 WeakPolarHBondContact O-CB 3.37Å; L30-F34 PolarHBondContact O-N 2.81Å; T31-F34 PolarHBondContact O-N 3.02Å; L32-F34 VanDerWaalsContact C-N 3.34Å; L32-F34 PolarHBondContact O-N 2.69Å; F34-K53 PolarHBondContact O-NZ 3.47Å; F34-V55 HydrophobicContact CZ-CG1 4.25Å; F34-I64 HydrophobicContact CE1-CD1 4.07Å; F34-I64 HydrophobicContact CE1-CG2 3.94Å; F34-I64 HydrophobicContact CZ-CD1 4.47Å; F34-I66 HydrophobicContact CD1-CD1 3.62Å; F34-I66 HydrophobicContact CE1-CD1 3.98Å; F34-V165 HydrophobicContact CB-CG1 3.91Å; F34-D166 WeakPolarHBondContact CD2-OD1 3.39Å; F34-F169 HydrophobicContact CB-CD2 3.57Å; F34-F169 HydrophobicContact CB-CE2 3.44Å; F34-F169 VanDerWaalsContact CB-CE2 3.44Å; F34-F169 HydrophobicContact CB-CG 4.44Å; F34-F169 HydrophobicContact CB-CZ 4.21Å; F34-F169 HydrophobicContact CD1-CB 4.47Å; F34-F169 HydrophobicContact CD1-CD1 4.33Å; F34-F169 AromaticContact CD1-CD2 3.98Å; F34-F169 HydrophobicContact CD1-CD2 3.98Å; F34-F169 HydrophobicContact CD1-CE2 4.3Å; F34-F169 HydrophobicContact CD1-CG 4.01Å; F34-F169 HydrophobicContact CD2-CB 3.94Å; F34-F169 AromaticContact CD2-CD2 3.54Å; F34-F169 HydrophobicContact CD2-CD2 3.54Å; F34-F169 HydrophobicContact CD2-CE2 4.32Å; F34-F169 AromaticContact CD2-CG 3.93Å; F34-F169 HydrophobicContact CD2-CG 3.93Å; F34-F169 HydrophobicContact CE1-CB 4.25Å; F34-F169 HydrophobicContact CE1-CG 4.22Å; F34-F169 HydrophobicContact CE2-CB 3.68Å; F34-F169 HydrophobicContact CE2-CD2 4.2Å; F34-F169 HydrophobicContact CE2-CG 4.14Å; F34-F169 HydrophobicContact CG-CB 4.31Å; F34-F169 AromaticContact CG-CD2 3.39Å; F34-F169 HydrophobicContact CG-CD2 3.39Å; F34-F169 AromaticContact CG-CE2 3.77Å; F34-F169 HydrophobicContact CG-CE2 3.77Å; F34-F169 AromaticContact CG-CG 3.85Å; F34-F169 HydrophobicContact CG-CG 3.85Å; F34-F169 HydrophobicContact CG-CZ 4.48Å; F34-F169 HydrophobicContact CZ-CB 3.84Å; F34-F169 HydrophobicContact CZ-CG 4.27Å; F34-F170 HydrophobicContact CE2-CD2 4.25Å; F34-F170 AromaticContact CE2-CE2 3.96Å; F34-F170 HydrophobicContact CE2-CE2 3.96Å; F34-F170 HydrophobicContact CZ-CE2 4.44Å
35	M	96	Very high	90.3	Very high	13 Å²	13	61.1 Å²	61.1	6%	0.064	31%	0.307	C	S	.	.	H	α-helix	trans	-75	-48.8	-176	-74	-63.2	-56.8	0	0	112.4	T31 L32 Y51 K53 I66	T31-M35 HydrophobicContact CG2-CG 4.2Å; T31-M35 VanDerWaalsContact O-CB 3.3Å; T31-M35 WeakPolarHBondContact O-CB 3.46Å; T31-M35 WeakPolarHBondContact O-CG 3.46Å; T31-M35 PolarHBondContact O-N 3.44Å; L32-M35 PolarHBondContact O-N 3.24Å; M35-Y51 HydrophobicContact CG-CD1 4.42Å; M35-Y51 HydrophobicContact CG-CG 4.27Å; M35-K53 HydrophobicContact CE-CB 3.74Å; M35-K53 HydrophobicContact CE-CD 4.45Å; M35-K53 PolarHBondContact O-NZ 3.01Å; M35-K53 HydrophobicContact SD-CB 3.68Å; M35-K53 HydrophobicContact SD-CD 4.16Å; M35-I66 HydrophobicContact CG-CD1 4.41Å; M35-I66 HydrophobicContact SD-CD1 4.14Å
36	Y	95.1	Very high	89.2	Confident	126 Å²	126	62.7 Å²	62.7	49%	0.494	32%	0.316	S	S	.	.	H	α-helix	trans	-125.1	-0.8	-165	-54	-59.2	0	0	0	114.5	L32 E38 Y51	L32-Y36 HydrophobicContact CD2-CD2 3.88Å; L32-Y36 HydrophobicContact CD2-CE2 3.93Å; L32-Y36 PolarHBondContact O-N 3.23Å; Y36-E38 PolarHBondContact O-N 3.09Å; Y36-Y51 HydrophobicContact CE2-CD1 4.08Å; Y36-Y51 HydrophobicContact CE2-CE1 4.14Å
37	D	94.9	Very high	88.3	Confident	102 Å²	102	71 Å²	71	55%	0.545	35%	0.348	S	S	.	.	S	Bend	trans	60.7	33.5	-175.7	-48.3	-28.9	0	0	0	112.7	Q33 R162	Q33-D37 VanDerWaalsContact O-CA 3.26Å; Q33-D37 WeakPolarHBondContact O-CA 3.44Å; Q33-D37 PolarHBondContact O-N 2.84Å; Q33-D37 VanDerWaalsContact OE1-C 3.27Å; D37-R162 IonicContact OD1-CZ 3.11Å; D37-R162 IonicContact OD1-NH1 2.68Å; D37-R162 PolarHBondContact OD1-NH1 3.23Å; D37-R162 IonicContact OD1-NH2 3.99Å; D37-R162 PolarHBondContact OD1-NH2 2.67Å
38	E	90.8	Very high	87.6	Confident	112 Å²	112	71.9 Å²	71.9	52%	0.523	36%	0.358	S	S	.	.			trans	-116.9	144	-177.6	-70	-178	177.3	0	0	112.1	Q33 Y36	Q33-E38 VanDerWaalsContact CA-O 3.23Å; Q33-E38 WeakPolarHBondContact CA-O 3.31Å; Q33-E38 PolarHBondContact N-O 3.28Å; Y36-E38 PolarHBondContact O-N 3.09Å
39	F	90.1	Very high	87.4	Confident	76 Å²	76	74.7 Å²	74.7	33%	0.333	37%	0.371	S	S	.	.			trans	-123.5	113.5	170.4	178.6	-111.2	0	0	0	109.6	A29 E41 A159 K160	A29-F39 HydrophobicContact CB-CD2 4.42Å; A29-F39 HydrophobicContact CB-CE2 4.26Å; F39-E41 HydrophobicContact CD1-CG 3.93Å; F39-E41 HydrophobicContact CE1-CG 3.41Å; F39-E41 VanDerWaalsContact CE1-CG 3.41Å; F39-E41 HydrophobicContact CZ-CG 4.24Å; F39-A159 HydrophobicContact CD2-CB 4.12Å; F39-A159 WeakPolarHBondContact CD2-O 3.46Å; F39-A159 HydrophobicContact CE2-CB 4.08Å; F39-K160 HydrophobicContact CD1-CB 4.2Å; F39-K160 HydrophobicContact CD1-CG 3.98Å; F39-K160 HydrophobicContact CD2-CB 4.37Å; F39-K160 HydrophobicContact CE1-CB 3.78Å; F39-K160 HydrophobicContact CE1-CD 3.99Å; F39-K160 HydrophobicContact CE1-CG 3.62Å; F39-K160 HydrophobicContact CE2-CB 4Å; F39-K160 HydrophobicContact CG-CB 4.46Å; F39-K160 HydrophobicContact CZ-CB 3.7Å; F39-K160 HydrophobicContact CZ-CD 4.38Å; F39-K160 HydrophobicContact CZ-CG 4.06Å
40	V	83.7	Confident	87.2	Confident	79 Å²	79	76.4 Å²	76.4	48%	0.479	38%	0.381	S	S	.	.			trans	-97.3	117.2	176.5	-176.5	0	0	0	0	108.2	L32	L32-V40 HydrophobicContact CD1-CG2 4.46Å
41	E	79.4	Confident	87.2	Confident	138 Å²	138	78 Å²	78	65%	0.645	39%	0.388	S	S	*	.			trans	-74.5	-34	-178.8	-76.8	-168	168.7	0	0	112.8	F39 Y43 K160	F39-E41 HydrophobicContact CD1-CG 3.93Å; F39-E41 HydrophobicContact CE1-CG 3.41Å; F39-E41 VanDerWaalsContact CE1-CG 3.41Å; F39-E41 HydrophobicContact CZ-CG 4.24Å; E41-Y43 PolarHBondContact O-N 3.06Å; E41-K160 IonicContact OE1-NZ 2.78Å
42	D	79.5	Confident	87.2	Confident	139 Å²	139	84.8 Å²	84.8	74%	0.743	41%	0.413	S	S	*	.	S	Bend	trans	-71.6	118.7	-179.2	-68.1	-36.8	0	0	0	110.6	E44	D42-E44 PolarHBondContact O-N 3.48Å
43	Y	70.9	Confident	87.2	Confident	129 Å²	129	85.9 Å²	85.9	51%	0.506	42%	0.416	S	S	.	.			trans	-82	104.9	177.9	179.2	-105.5	0	0	0	110.7	G24 E41 P45	G24-Y43 PolarHBondContact N-OH 3.26Å; G24-Y43 VanDerWaalsContact N-OH 3.17Å; E41-Y43 PolarHBondContact O-N 3.06Å; Y43-P45 HydrophobicContact CD1-CG 4.43Å; Y43-P45 HydrophobicContact CE1-CB 4.45Å; Y43-P45 HydrophobicContact CE1-CG 3.83Å
44	E	75.4	Confident	87.2	Confident	161 Å²	161	91.1 Å²	91.1	75%	0.752	44%	0.439	S	S	*	.	P	Polyproline II helix	trans	-97.9	123.3	161.7	-65	-167.9	159.6	0	0	109.3	D42 T46	D42-E44 PolarHBondContact O-N 3.48Å; E44-T46 PolarHBondContact O-N 3.27Å; E44-T46 VanDerWaalsContact O-N 3.1Å
45	P	78.6	Confident	87.2	Confident	88 Å²	88	91.8 Å²	91.8	57%	0.571	44%	0.443	S	S	*	.	P	Polyproline II helix	trans	-54.7	118.6	173.9	-26.2	33.8	0	0	0	111.8	Y43 K47	Y43-P45 HydrophobicContact CD1-CG 4.43Å; Y43-P45 HydrophobicContact CE1-CB 4.45Å; Y43-P45 HydrophobicContact CE1-CG 3.83Å; P45-K47 PolarHBondContact O-N 2.96Å
46	T	73.3	Confident	87.3	Confident	32 Å²	32	95.7 Å²	95.7	20%	0.196	47%	0.468	C	S	.	.	P	Polyproline II helix	trans	-70.6	130.9	-172.5	-46.5	0	0	0	0	112.3	S28 E44 D68 A70	S28-T46 PolarHBondContact OG-OG1 2.71Å; E44-T46 PolarHBondContact O-N 3.27Å; E44-T46 VanDerWaalsContact O-N 3.1Å; T46-D68 WeakPolarHBondContact CG2-OD2 3.38Å; T46-A70 WeakPolarHBondContact O-CA 3.34Å; T46-A70 VanDerWaalsContact O-CB 3.26Å; T46-A70 WeakPolarHBondContact O-CB 3.34Å
47	K	76.5	Confident	87.4	Confident	190 Å²	190	89.7 Å²	89.7	83%	0.826	44%	0.444	S	S	*	.	P	Polyproline II helix	trans	-79.2	134.3	156.1	-175.5	178.7	-179.6	-177.7	0	107.5	P45 D49	P45-K47 PolarHBondContact O-N 2.96Å; K47-D49 PolarHBondContact O-N 3.29Å
48	A	81	Confident	87.5	Confident	29 Å²	29	89 Å²	89	24%	0.24	44%	0.441	C	S	.	.	P	Polyproline II helix	trans	-51.3	128	-176	0	0	0	0	0	112.1	D68 Y82	A48-D68 CarbonylContact C-O 3.57Å; A48-D68 WeakPolarHBondContact CA-O 3.19Å; A48-Y82 HydrophobicContact CB-CE2 4.23Å
49	D	89.6	Confident	87.8	Confident	82 Å²	82	87.1 Å²	87.1	44%	0.439	45%	0.451	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	153.2	-175.4	-157.6	3.2	0	0	0	111.7	K47 Y51 D68	K47-D49 PolarHBondContact O-N 3.29Å; D49-Y51 HydrophobicContact CB-CE2 3.91Å; D49-Y51 PolarHBondContact OD2-OH 3.34Å; D49-D68 PolarHBondContact N-O 3.16Å; D49-D68 PolarHBondContact O-N 3.4Å
50	S	92.8	Very high	88.1	Confident	55 Å²	55	87.8 Å²	87.8	39%	0.385	46%	0.455	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	124.1	-177.2	167.3	0	0	0	0	110.9	D65 I66	S50-D65 PolarHBondContact OG-OD1 2.73Å; S50-I66 CarbonylContact C-O 3.54Å; S50-I66 WeakPolarHBondContact CA-O 3.36Å
51	Y	96.2	Very high	88.7	Confident	34 Å²	34	88.7 Å²	88.7	13%	0.133	45%	0.454	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	132.3	-178.7	-60.9	-88.9	0	0	0	110.4	T31 L32 M35 Y36 D49 D65 I66 D68	T31-Y51 HydrophobicContact CG2-CD2 3.4Å; T31-Y51 VanDerWaalsContact CG2-CD2 3.4Å; T31-Y51 HydrophobicContact CG2-CE2 3.82Å; T31-Y51 HydrophobicContact CG2-CG 3.91Å; L32-Y51 HydrophobicContact CD2-CE1 4.07Å; M35-Y51 HydrophobicContact CG-CD1 4.42Å; M35-Y51 HydrophobicContact CG-CG 4.27Å; Y36-Y51 HydrophobicContact CE2-CD1 4.08Å; Y36-Y51 HydrophobicContact CE2-CE1 4.14Å; D49-Y51 HydrophobicContact CB-CE2 3.91Å; D49-Y51 PolarHBondContact OD2-OH 3.34Å; Y51-D65 CarbonylContact O-C 3.58Å; Y51-D65 WeakPolarHBondContact O-CA 3.33Å; Y51-I66 PolarHBondContact N-O 3.35Å; Y51-I66 PolarHBondContact O-N 2.81Å; Y51-D68 HydrophobicContact CD2-CB 4.43Å; Y51-D68 HydrophobicContact CE2-CB 4.06Å
52	R	97.2	Very high	89.6	Confident	143 Å²	143	82.1 Å²	82.1	54%	0.54	42%	0.423	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	128.5	179.1	-70.5	-176.9	179.1	179.3	1.7	112.3	I64 D65	R52-I64 VanDerWaalsContact CA-O 3.3Å; R52-I64 WeakPolarHBondContact CA-O 3.46Å; R52-D65 HydrophobicContact CG-CB 4Å; R52-D65 IonicContact CZ-OD2 2.67Å; R52-D65 IonicContact NE-OD1 3.5Å; R52-D65 IonicContact NE-OD2 3.98Å; R52-D65 PolarHBondContact NE-OD2 3.11Å; R52-D65 IonicContact NH2-OD2 3.38Å; R52-D65 PolarHBondContact NH2-OD2 2.98Å
53	K	95.9	Very high	90.5	Very high	59 Å²	59	78 Å²	78	26%	0.257	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	144.9	177.5	-173.7	168.1	177.5	169.9	0	110.1	F34 M35 V55 Q63 I64	F34-K53 PolarHBondContact O-NZ 3.47Å; M35-K53 HydrophobicContact CE-CB 3.74Å; M35-K53 HydrophobicContact CE-CD 4.45Å; M35-K53 PolarHBondContact O-NZ 3.01Å; M35-K53 HydrophobicContact SD-CB 3.68Å; M35-K53 HydrophobicContact SD-CD 4.16Å; K53-V55 HydrophobicContact CD-CG1 4.32Å; K53-V55 HydrophobicContact CG-CG1 4Å; K53-Q63 WeakPolarHBondContact O-CA 3.35Å; K53-I64 HydrophobicContact CB-CG2 4.1Å; K53-I64 PolarHBondContact N-O 2.85Å; K53-I64 VanDerWaalsContact N-O 3.13Å; K53-I64 WeakPolarHBondContact O-CG2 3.41Å; K53-I64 PolarHBondContact O-N 3.45Å
54	K	97.6	Very high	91.8	Very high	125 Å²	125	71.9 Å²	71.9	54%	0.543	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	134.7	167.1	-64.7	-172.2	177.2	-169.8	0	108.9	L12 E61 V62	L12-K54 HydrophobicContact CD1-CD 3.8Å; L12-K54 HydrophobicContact CD1-CG 4.21Å; K54-E61 WeakPolarHBondContact CD-OE1 3.46Å; K54-E61 IonicContact NZ-OE1 2.78Å; K54-V62 WeakPolarHBondContact CA-O 3.4Å
55	V	97.7	Very high	92.9	Very high	16 Å²	16	64.9 Å²	64.9	10%	0.097	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	158.8	-177.9	-62.7	0	0	0	0	110	F34 K53 V62 F170 M173	F34-V55 HydrophobicContact CZ-CG1 4.25Å; K53-V55 HydrophobicContact CD-CG1 4.32Å; K53-V55 HydrophobicContact CG-CG1 4Å; V55-V62 HydrophobicContact CG2-CG2 3.67Å; V55-V62 PolarHBondContact N-O 3.17Å; V55-V62 PolarHBondContact O-N 3.31Å; V55-F170 HydrophobicContact CB-CE1 4.35Å; V55-F170 HydrophobicContact CB-CZ 4.12Å; V55-F170 HydrophobicContact CG1-CZ 4.5Å; V55-F170 HydrophobicContact CG2-CE1 4.34Å; V55-M173 HydrophobicContact CG2-CE 3.94Å; V55-M173 HydrophobicContact CG2-SD 4.04Å
56	V	97.9	Very high	93.8	Very high	95 Å²	95	60.7 Å²	60.7	58%	0.576	32%	0.316	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98.3	106.2	173	179.7	0	0	0	0	108.5	E60 F170	V56-E60 CarbonylContact C-O 3.57Å; V56-E60 WeakPolarHBondContact CA-O 3.43Å; V56-F170 WeakPolarHBondContact O-CE1 3.49Å
57	L	97.6	Very high	94.9	Very high	0 Å²	0	60.4 Å²	60.4	0%	0	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	104.9	177.9	178.2	67.1	0	0	0	109.7	G59 E60 V62 F170 M173 R174	L57-G59 PolarHBondContact O-N 3.4Å; L57-E60 PolarHBondContact N-O 3.49Å; L57-E60 PolarHBondContact O-N 2.92Å; L57-E60 VanDerWaalsContact O-N 3.09Å; L57-V62 HydrophobicContact CB-CG1 4.34Å; L57-V62 HydrophobicContact CB-CG2 3.64Å; L57-V62 HydrophobicContact CD2-CG2 4.32Å; L57-F170 HydrophobicContact CD1-CD1 3.64Å; L57-F170 HydrophobicContact CD1-CE1 4.33Å; L57-M173 HydrophobicContact CD1-CB 4.22Å; L57-M173 HydrophobicContact CD2-CB 3.87Å; L57-R174 HydrophobicContact CD1-CG 3.89Å
58	D	96.7	Very high	95.7	Very high	88 Å²	88	51.4 Å²	51.4	47%	0.471	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.2	41.3	179.8	-47.5	-38.3	0	0	0	113.1	R174 R177	D58-R174 IonicContact OD1-CZ 2.84Å; D58-R174 IonicContact OD1-NE 3.93Å; D58-R174 PolarHBondContact OD1-NE 3.44Å; D58-R174 VanDerWaalsContact OD1-NE 3.11Å; D58-R174 IonicContact OD1-NH2 3.21Å; D58-R174 PolarHBondContact OD1-NH2 3.19Å; D58-R174 IonicContact OD2-NE 2.89Å; D58-R174 PolarHBondContact OD2-NE 3.07Å; D58-R177 IonicContact OD2-CZ 3.44Å; D58-R177 IonicContact OD2-NH1 3.44Å; D58-R177 PolarHBondContact OD2-NH1 2.87Å; D58-R177 IonicContact OD2-NH2 2.69Å; D58-R177 PolarHBondContact OD2-NH2 2.89Å
59	G	96.5	Very high	96.1	Very high	71 Å²	71	50.5 Å²	50.5	73%	0.732	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	90.9	-5.5	179	0	0	0	0	0	115.7	L57	L57-G59 PolarHBondContact O-N 3.4Å
60	E	95.8	Very high	95.6	Very high	91 Å²	91	47.6 Å²	47.6	43%	0.425	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	130.1	177.3	-172.3	-179.7	176.2	0	0	111	V56 L57 V62	V56-E60 CarbonylContact C-O 3.57Å; V56-E60 WeakPolarHBondContact CA-O 3.43Å; L57-E60 PolarHBondContact N-O 3.49Å; L57-E60 PolarHBondContact O-N 2.92Å; L57-E60 VanDerWaalsContact O-N 3.09Å; E60-V62 HydrophobicContact CB-CG1 4.49Å; E60-V62 HydrophobicContact CG-CG1 4.13Å; E60-V62 PolarHBondContact O-N 3.48Å
61	E	97.5	Very high	94.3	Very high	97 Å²	97	45.9 Å²	45.9	45%	0.453	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	120.4	171.7	-168.9	-175.7	-175	0	0	109.4	L12 K54	L12-E61 HydrophobicContact CD1-CG 4.1Å; L12-E61 HydrophobicContact CD2-CB 4.06Å; L12-E61 HydrophobicContact CD2-CG 3.97Å; L12-E61 WeakPolarHBondContact CD2-O 3.18Å; K54-E61 WeakPolarHBondContact CD-OE1 3.46Å; K54-E61 IonicContact NZ-OE1 2.78Å
62	V	97.7	Very high	92.7	Very high	0 Å²	0	50.8 Å²	50.8	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	164.5	178.1	-57.3	0	0	0	0	109.9	A13 K54 V55 L57 E60 M173	A13-V62 HydrophobicContact CB-CG1 4.13Å; K54-V62 WeakPolarHBondContact CA-O 3.4Å; V55-V62 HydrophobicContact CG2-CG2 3.67Å; V55-V62 PolarHBondContact N-O 3.17Å; V55-V62 PolarHBondContact O-N 3.31Å; L57-V62 HydrophobicContact CB-CG1 4.34Å; L57-V62 HydrophobicContact CB-CG2 3.64Å; L57-V62 HydrophobicContact CD2-CG2 4.32Å; E60-V62 HydrophobicContact CB-CG1 4.49Å; E60-V62 HydrophobicContact CG-CG1 4.13Å; E60-V62 PolarHBondContact O-N 3.48Å; V62-M173 HydrophobicContact CG2-SD 4.37Å
63	Q	97.8	Very high	91	Very high	53 Å²	53	52.7 Å²	52.7	25%	0.248	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	130.6	172.2	-170.4	170.8	24.4	0	0	109.4	A13 L14 H15 K53	A13-Q63 PolarHBondContact O-N 3.27Å; L14-Q63 CarbonylContact C-O 3.52Å; L14-Q63 VanDerWaalsContact CA-O 3.29Å; L14-Q63 WeakPolarHBondContact CA-O 3.33Å; L14-Q63 HydrophobicContact CD1-CB 3.88Å; L14-Q63 HydrophobicContact CD1-CG 3.75Å; H15-Q63 PolarHBondContact N-O 2.93Å; K53-Q63 WeakPolarHBondContact O-CA 3.35Å
64	I	98.3	Very high	89.3	Confident	0 Å²	0	51.4 Å²	51.4	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	139.3	168.6	-171.4	177.3	0	0	0	109	H15 V17 F34 R52 K53 I66 F169 M173	H15-I64 WeakPolarHBondContact O-CA 3.5Å; V17-I64 HydrophobicContact CB-CD1 4.5Å; V17-I64 HydrophobicContact CG2-CD1 3.96Å; V17-I64 HydrophobicContact CG2-CG1 4.13Å; F34-I64 HydrophobicContact CE1-CD1 4.07Å; F34-I64 HydrophobicContact CE1-CG2 3.94Å; F34-I64 HydrophobicContact CZ-CD1 4.47Å; R52-I64 VanDerWaalsContact CA-O 3.3Å; R52-I64 WeakPolarHBondContact CA-O 3.46Å; K53-I64 HydrophobicContact CB-CG2 4.1Å; K53-I64 PolarHBondContact N-O 2.85Å; K53-I64 VanDerWaalsContact N-O 3.13Å; K53-I64 WeakPolarHBondContact O-CG2 3.41Å; K53-I64 PolarHBondContact O-N 3.45Å; I64-I66 HydrophobicContact CD1-CD1 4.01Å; I64-I66 HydrophobicContact CD1-CG1 3.75Å; I64-I66 HydrophobicContact CG1-CD1 4.5Å; I64-I66 HydrophobicContact CG1-CG1 3.86Å; I64-F169 HydrophobicContact CD1-CB 4.42Å; I64-F169 HydrophobicContact CD1-CD1 3.96Å; I64-M173 HydrophobicContact CB-SD 3.8Å; I64-M173 HydrophobicContact CD1-CE 4.3Å; I64-M173 HydrophobicContact CD1-CG 4.09Å; I64-M173 HydrophobicContact CD1-SD 3.83Å; I64-M173 HydrophobicContact CG1-CG 4.45Å; I64-M173 HydrophobicContact CG1-SD 4.04Å
65	D	98	Very high	87.8	Confident	15 Å²	15	54.5 Å²	54.5	8%	0.08	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	109	171.8	-173.7	-15.3	0	0	0	107.4	L14 H15 K16 V17 S50 Y51 R52	L14-D65 HydrophobicContact CD1-CB 3.93Å; H15-D65 PolarHBondContact O-N 3.44Å; K16-D65 CarbonylContact C-O 3.38Å; K16-D65 WeakPolarHBondContact CA-O 3.49Å; K16-D65 HydrophobicContact CG-CB 4.39Å; V17-D65 PolarHBondContact N-O 3.12Å; S50-D65 PolarHBondContact OG-OD1 2.73Å; Y51-D65 CarbonylContact O-C 3.58Å; Y51-D65 WeakPolarHBondContact O-CA 3.33Å; R52-D65 HydrophobicContact CG-CB 4Å; R52-D65 IonicContact CZ-OD2 2.67Å; R52-D65 IonicContact NE-OD1 3.5Å; R52-D65 IonicContact NE-OD2 3.98Å; R52-D65 PolarHBondContact NE-OD2 3.11Å; R52-D65 IonicContact NH2-OD2 3.38Å; R52-D65 PolarHBondContact NH2-OD2 2.98Å
66	I	97.9	Very high	86.6	Confident	0 Å²	0	56.4 Å²	56.4	0%	0	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	116.1	-178.3	-54.9	168.5	0	0	0	107.5	V17 M19 T31 F34 M35 S50 Y51 I64 F169	V17-I66 HydrophobicContact CB-CG1 4.5Å; V17-I66 CarbonylContact O-C 3.47Å; V17-I66 WeakPolarHBondContact O-CA 3.45Å; M19-I66 HydrophobicContact CG-CG2 3.74Å; M19-I66 HydrophobicContact SD-CG2 4.05Å; T31-I66 HydrophobicContact CG2-CB 4.32Å; T31-I66 HydrophobicContact CG2-CD1 4.37Å; T31-I66 HydrophobicContact CG2-CG2 3.85Å; F34-I66 HydrophobicContact CD1-CD1 3.62Å; F34-I66 HydrophobicContact CE1-CD1 3.98Å; M35-I66 HydrophobicContact CG-CD1 4.41Å; M35-I66 HydrophobicContact SD-CD1 4.14Å; S50-I66 CarbonylContact C-O 3.54Å; S50-I66 WeakPolarHBondContact CA-O 3.36Å; Y51-I66 PolarHBondContact N-O 3.35Å; Y51-I66 PolarHBondContact O-N 2.81Å; I64-I66 HydrophobicContact CD1-CD1 4.01Å; I64-I66 HydrophobicContact CD1-CG1 3.75Å; I64-I66 HydrophobicContact CG1-CD1 4.5Å; I64-I66 HydrophobicContact CG1-CG1 3.86Å; I66-F169 HydrophobicContact CD1-CD1 3.89Å; I66-F169 HydrophobicContact CD1-CE1 3.5Å; I66-F169 VanDerWaalsContact CD1-CE1 3.5Å; I66-F169 HydrophobicContact CD1-CZ 4.08Å; I66-F169 HydrophobicContact CG1-CD1 4.37Å; I66-F169 HydrophobicContact CG1-CE1 4.02Å; I66-F169 HydrophobicContact CG2-CE1 4.19Å
67	L	96	Very high	85.5	Confident	26 Å²	26	55.1 Å²	55.1	14%	0.136	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	108.9	165.4	-173.8	72.1	0	0	0	108.8	V17 I18 M19 T69 Y82	V17-L67 PolarHBondContact O-N 2.89Å; I18-L67 HydrophobicContact CD1-CB 3.62Å; I18-L67 HydrophobicContact CD1-CD2 3.86Å; I18-L67 HydrophobicContact CD1-CG 4.39Å; I18-L67 HydrophobicContact CG2-CD2 4.45Å; M19-L67 PolarHBondContact N-O 3.48Å; L67-T69 HydrophobicContact CD2-CG2 4.22Å; L67-T69 HydrophobicContact CG-CG2 4.29Å; L67-Y82 HydrophobicContact CD2-CD1 3.4Å; L67-Y82 VanDerWaalsContact CD2-CD1 3.4Å; L67-Y82 HydrophobicContact CD2-CD2 4.18Å; L67-Y82 HydrophobicContact CD2-CE1 4.03Å; L67-Y82 HydrophobicContact CD2-CG 3.49Å; L67-Y82 VanDerWaalsContact CD2-CG 3.49Å
68	D	93.3	Very high	84.7	Confident	0 Å²	0	58.2 Å²	58.2	0%	0	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	117.2	170	-174.1	27.3	0	0	0	109	K27 S28 T31 T46 A48 D49 Y51	K27-D68 VanDerWaalsContact CB-OD1 3.31Å; K27-D68 WeakPolarHBondContact CB-OD1 3.17Å; S28-D68 WeakPolarHBondContact CA-OD2 3.02Å; S28-D68 WeakPolarHBondContact CB-OD2 3.5Å; S28-D68 PolarHBondContact N-OD1 3.17Å; S28-D68 PolarHBondContact OG-OD2 3.32Å; T31-D68 HydrophobicContact CG2-CB 4.43Å; T46-D68 WeakPolarHBondContact CG2-OD2 3.38Å; A48-D68 CarbonylContact C-O 3.57Å; A48-D68 WeakPolarHBondContact CA-O 3.19Å; D49-D68 PolarHBondContact N-O 3.16Å; D49-D68 PolarHBondContact O-N 3.4Å; Y51-D68 HydrophobicContact CD2-CB 4.43Å; Y51-D68 HydrophobicContact CE2-CB 4.06Å
69	T	89.8	Confident	84	Confident	11 Å²	11	55.9 Å²	55.9	7%	0.067	31%	0.306	C	S	.	.	P	Polyproline II helix	trans	-95.8	155.4	-176.4	75.8	0	0	0	0	111.3	I18 M19 K27 L67 G71 Y82	I18-T69 HydrophobicContact CG2-CG2 3.91Å; M19-T69 WeakPolarHBondContact O-CG2 3.47Å; M19-T69 PolarHBondContact O-OG1 2.99Å; M19-T69 VanDerWaalsContact O-OG1 3.11Å; K27-T69 WeakPolarHBondContact CE-O 3.21Å; L67-T69 HydrophobicContact CD2-CG2 4.22Å; L67-T69 HydrophobicContact CG-CG2 4.29Å; T69-G71 PolarHBondContact O-N 2.89Å; T69-Y82 HydrophobicContact CG2-CD2 4.05Å
70	A	80.4	Confident	83.7	Confident	21 Å²	21	54.2 Å²	54.2	17%	0.174	28%	0.28	C	S	.	.	P	Polyproline II helix	trans	-58.3	137.8	161.6	0	0	0	0	0	108.7	T46 Q72	T46-A70 WeakPolarHBondContact O-CA 3.34Å; T46-A70 VanDerWaalsContact O-CB 3.26Å; T46-A70 WeakPolarHBondContact O-CB 3.34Å; A70-Q72 VanDerWaalsContact C-N 3.25Å
71	G	64.5	Low	83.4	Confident	18 Å²	18	54.3 Å²	54.3	19%	0.186	28%	0.283	C	S	.	.	S	Bend	trans	-83.4	-3.4	173	0	0	0	0	0	113.9	G21 S22 G23 T69	G21-G71 WeakPolarHBondContact O-CA 3.32Å; S22-G71 CarbonylContact C-O 3.46Å; G23-G71 PolarHBondContact N-O 3.5Å; G23-G71 VanDerWaalsContact N-O 3.08Å; T69-G71 PolarHBondContact O-N 2.89Å
72	Q	62.7	Low	83.1	Confident	138 Å²	138	52.3 Å²	52.3	65%	0.645	27%	0.272	S	S	*	.	S	Bend	trans	-97.3	161.6	173.9	-68.1	-171.3	-6.7	0	0	109.5	A70 D74	A70-Q72 VanDerWaalsContact C-N 3.25Å; Q72-D74 VanDerWaalsContact C-N 3.28Å; Q72-D74 PolarHBondContact O-N 2.89Å
73	E	60.4	Low	82.9	Confident	182 Å²	182	52.5 Å²	52.5	85%	0.85	27%	0.273	S	S	*	.			trans	-56.3	79.6	-169.9	-60.7	176.4	-171.8	0	0	113.8	Y75	E73-Y75 PolarHBondContact O-N 3Å
74	D	61.1	Low	82.7	Confident	33 Å²	33	56.1 Å²	56.1	18%	0.176	28%	0.284	C	S	.	.			trans	-51.5	131.4	155.6	-77.6	-37.1	0	0	0	106.7	Q72 A76 I78 R79 Y82	Q72-D74 VanDerWaalsContact C-N 3.28Å; Q72-D74 PolarHBondContact O-N 2.89Å; D74-A76 PolarHBondContact O-N 3.49Å; D74-I78 HydrophobicContact CB-CB 4.49Å; D74-I78 HydrophobicContact CB-CG2 4.45Å; D74-R79 HydrophobicContact CB-CB 4.38Å; D74-R79 PolarHBondContact O-NH1 3.2Å; D74-R79 PolarHBondContact O-NH2 3.15Å; D74-Y82 WeakPolarHBondContact OD2-CE2 3.41Å
75	Y	66.9	Low	82.5	Confident	190 Å²	190	58.9 Å²	58.9	75%	0.745	30%	0.304	S	S	*	.			trans	-43	130.7	173.5	-78	-88.2	0	0	0	108.5	E73 A77 I78 R79	E73-Y75 PolarHBondContact O-N 3Å; Y75-A77 PolarHBondContact O-N 2.92Å; Y75-I78 HydrophobicContact CD2-CD1 4.24Å; Y75-I78 WeakPolarHBondContact O-CA 3.23Å; Y75-I78 WeakPolarHBondContact O-CB 3.41Å; Y75-I78 PolarHBondContact O-N 3.41Å; Y75-R79 PolarHBondContact O-N 3.3Å
76	A	71.8	Confident	82.3	Confident	55 Å²	55	58.2 Å²	58.2	46%	0.455	30%	0.3	S	S	.	.	H	α-helix	trans	-48.8	-35.6	-171.5	0	0	0	0	0	113.1	D74 R79 D80	D74-A76 PolarHBondContact O-N 3.49Å; A76-R79 PolarHBondContact O-N 2.95Å; A76-D80 WeakPolarHBondContact O-CB 3.38Å; A76-D80 PolarHBondContact O-N 3.08Å
77	A	74.6	Confident	82.3	Confident	68 Å²	68	60.5 Å²	60.5	56%	0.562	31%	0.311	S	S	*	.	H	α-helix	trans	-64.3	-37	175.5	0	0	0	0	0	114.7	Y75 N81	Y75-A77 PolarHBondContact O-N 2.92Å; A77-N81 PolarHBondContact O-N 2.79Å; A77-N81 PolarHBondContact O-ND2 2.81Å
78	I	80.5	Confident	82.4	Confident	66 Å²	66	59.3 Å²	59.3	34%	0.338	31%	0.305	S	S	.	.	H	α-helix	trans	-68.2	-46.4	176.3	-62.6	176.9	0	0	0	109.4	D74 Y75 D80 N81 Y82	D74-I78 HydrophobicContact CB-CB 4.49Å; D74-I78 HydrophobicContact CB-CG2 4.45Å; Y75-I78 HydrophobicContact CD2-CD1 4.24Å; Y75-I78 WeakPolarHBondContact O-CA 3.23Å; Y75-I78 WeakPolarHBondContact O-CB 3.41Å; Y75-I78 PolarHBondContact O-N 3.41Å; I78-D80 VanDerWaalsContact C-N 3.35Å; I78-D80 PolarHBondContact O-N 2.55Å; I78-N81 WeakPolarHBondContact O-CB 3.28Å; I78-N81 PolarHBondContact O-N 3.12Å; I78-N81 VanDerWaalsContact O-N 3.08Å; I78-Y82 HydrophobicContact CG2-CD2 4.21Å; I78-Y82 HydrophobicContact CG2-CE1 4.07Å; I78-Y82 HydrophobicContact CG2-CE2 3.48Å; I78-Y82 VanDerWaalsContact CG2-CE2 3.48Å; I78-Y82 WeakPolarHBondContact CG2-OH 3.25Å; I78-Y82 PolarHBondContact O-N 3.16Å
79	R	83.2	Confident	82.7	Confident	39 Å²	39	59.3 Å²	59.3	15%	0.147	31%	0.305	C	S	.	.	H	α-helix	trans	-60.7	-42.6	177.3	177.9	161.6	50.1	-125.9	-6.6	112.2	D74 Y75 A76 N81 Y82 F83	D74-R79 HydrophobicContact CB-CB 4.38Å; D74-R79 PolarHBondContact O-NH1 3.2Å; D74-R79 PolarHBondContact O-NH2 3.15Å; Y75-R79 PolarHBondContact O-N 3.3Å; A76-R79 PolarHBondContact O-N 2.95Å; R79-N81 VanDerWaalsContact C-N 3.25Å; R79-N81 PolarHBondContact O-N 3Å; R79-Y82 WeakPolarHBondContact O-CB 3.02Å; R79-Y82 PolarHBondContact O-N 3.02Å; R79-F83 HydrophobicContact CG-CD1 4.46Å; R79-F83 HydrophobicContact CG-CD2 3.96Å; R79-F83 HydrophobicContact CG-CE1 3.93Å; R79-F83 HydrophobicContact CG-CE2 3.36Å; R79-F83 HydrophobicContact CG-CG 4.49Å; R79-F83 HydrophobicContact CG-CZ 3.36Å; R79-F83 WeakPolarHBondContact O-CG 3.35Å; R79-F83 PolarHBondContact O-N 3.23Å
80	D	89.1	Confident	83.1	Confident	35 Å²	35	58.8 Å²	58.8	19%	0.187	30%	0.301	C	S	.	.	H	α-helix	trans	-60.2	-35.2	174.6	-79.4	3.8	0	0	0	112.1	A76 I78 R84 R113 V114	A76-D80 WeakPolarHBondContact O-CB 3.38Å; A76-D80 PolarHBondContact O-N 3.08Å; I78-D80 VanDerWaalsContact C-N 3.35Å; I78-D80 PolarHBondContact O-N 2.55Å; D80-R84 VanDerWaalsContact O-CB 3.28Å; D80-R84 WeakPolarHBondContact O-CB 3.29Å; D80-R84 PolarHBondContact O-N 3.36Å; D80-R113 IonicContact OD1-NH2 3.58Å; D80-R113 PolarHBondContact OD1-NH2 2.87Å; D80-V114 HydrophobicContact CB-CG2 3.98Å; D80-V114 WeakPolarHBondContact O-CG1 3.35Å; D80-V114 VanDerWaalsContact OD1-CG2 3.29Å; D80-V114 WeakPolarHBondContact OD1-CG2 3.38Å
81	N	90	Very high	83.9	Confident	94 Å²	94	57.8 Å²	57.8	50%	0.503	29%	0.293	S	S	.	.	H	α-helix	trans	-68.9	-43.2	175.9	-71.5	-23.9	0	0	0	112.1	A77 I78 R79 F83 R84 S85	A77-N81 PolarHBondContact O-N 2.79Å; A77-N81 PolarHBondContact O-ND2 2.81Å; I78-N81 WeakPolarHBondContact O-CB 3.28Å; I78-N81 PolarHBondContact O-N 3.12Å; I78-N81 VanDerWaalsContact O-N 3.08Å; R79-N81 VanDerWaalsContact C-N 3.25Å; R79-N81 PolarHBondContact O-N 3Å; N81-F83 VanDerWaalsContact C-N 3.33Å; N81-F83 PolarHBondContact O-N 3.12Å; N81-R84 PolarHBondContact O-N 2.8Å; N81-R84 PolarHBondContact OD1-NH1 2.67Å; N81-S85 WeakPolarHBondContact O-CB 3.24Å; N81-S85 PolarHBondContact O-N 2.96Å; N81-S85 PolarHBondContact O-OG 2.68Å
82	Y	91.3	Very high	85.5	Confident	55 Å²	55	56.9 Å²	56.9	22%	0.216	28%	0.284	C	S	.	.	H	α-helix	trans	-57.1	-50	173	-61.9	-27.6	0	0	0	110.6	A48 L67 T69 D74 I78 R79 R84 S85 G86	A48-Y82 HydrophobicContact CB-CE2 4.23Å; L67-Y82 HydrophobicContact CD2-CD1 3.4Å; L67-Y82 VanDerWaalsContact CD2-CD1 3.4Å; L67-Y82 HydrophobicContact CD2-CD2 4.18Å; L67-Y82 HydrophobicContact CD2-CE1 4.03Å; L67-Y82 HydrophobicContact CD2-CG 3.49Å; L67-Y82 VanDerWaalsContact CD2-CG 3.49Å; T69-Y82 HydrophobicContact CG2-CD2 4.05Å; D74-Y82 WeakPolarHBondContact OD2-CE2 3.41Å; I78-Y82 HydrophobicContact CG2-CD2 4.21Å; I78-Y82 HydrophobicContact CG2-CE1 4.07Å; I78-Y82 HydrophobicContact CG2-CE2 3.48Å; I78-Y82 VanDerWaalsContact CG2-CE2 3.48Å; I78-Y82 WeakPolarHBondContact CG2-OH 3.25Å; I78-Y82 PolarHBondContact O-N 3.16Å; R79-Y82 WeakPolarHBondContact O-CB 3.02Å; R79-Y82 PolarHBondContact O-N 3.02Å; Y82-R84 PolarHBondContact O-N 2.68Å; Y82-S85 PolarHBondContact O-N 2.99Å; Y82-S85 PolarHBondContact O-OG 2.9Å; Y82-G86 PolarHBondContact O-N 2.85Å
83	F	93	Very high	87.2	Confident	3 Å²	3	50.3 Å²	50.3	1%	0.013	25%	0.254	C	S	.	.	H	α-helix	trans	-60.7	-48.4	179.6	-64.9	-13.8	0	0	0	111.7	I18 V20 R79 N81 S85 G86 F89 Q110 I111 V114 K115	I18-F83 HydrophobicContact CG2-CD1 4.44Å; V20-F83 HydrophobicContact CG1-CE1 4.02Å; V20-F83 HydrophobicContact CG1-CZ 3.92Å; V20-F83 HydrophobicContact CG2-CD1 4.43Å; V20-F83 HydrophobicContact CG2-CE1 3.66Å; V20-F83 HydrophobicContact CG2-CZ 4.37Å; R79-F83 HydrophobicContact CG-CD1 4.46Å; R79-F83 HydrophobicContact CG-CD2 3.96Å; R79-F83 HydrophobicContact CG-CE1 3.93Å; R79-F83 HydrophobicContact CG-CE2 3.36Å; R79-F83 HydrophobicContact CG-CG 4.49Å; R79-F83 HydrophobicContact CG-CZ 3.36Å; R79-F83 WeakPolarHBondContact O-CG 3.35Å; R79-F83 PolarHBondContact O-N 3.23Å; N81-F83 VanDerWaalsContact C-N 3.33Å; N81-F83 PolarHBondContact O-N 3.12Å; F83-S85 PolarHBondContact O-N 3.49Å; F83-G86 PolarHBondContact O-N 3.44Å; F83-G86 VanDerWaalsContact O-N 3.1Å; F83-F89 HydrophobicContact CB-CE1 4.12Å; F83-F89 HydrophobicContact CB-CZ 4.35Å; F83-F89 HydrophobicContact CD1-CD1 4.39Å; F83-F89 AromaticContact CD1-CE1 3.78Å; F83-F89 HydrophobicContact CD1-CE1 3.78Å; F83-F89 HydrophobicContact CG-CE1 4.18Å; F83-F89 WeakPolarHBondContact O-CZ 3.44Å; F83-Q110 HydrophobicContact CD2-CB 4.38Å; F83-Q110 HydrophobicContact CE2-CB 3.82Å; F83-I111 HydrophobicContact CD1-CG1 4.28Å; F83-I111 HydrophobicContact CD2-CG1 4.05Å; F83-I111 HydrophobicContact CE1-CG1 4.26Å; F83-I111 HydrophobicContact CE2-CG1 4.02Å; F83-I111 HydrophobicContact CG-CG1 4.17Å; F83-I111 HydrophobicContact CZ-CG1 4.12Å; F83-V114 HydrophobicContact CB-CB 4.14Å; F83-V114 HydrophobicContact CB-CG1 3.86Å; F83-V114 HydrophobicContact CB-CG2 4.39Å; F83-V114 HydrophobicContact CD2-CG2 4.37Å; F83-K115 WeakPolarHBondContact O-CE 3.29Å
84	R	94	Very high	89.1	Confident	130 Å²	130	41.7 Å²	41.7	49%	0.491	21%	0.213	S	C	.	.	H	α-helix	trans	-56.9	-38.6	178.5	-168	174.6	-61.5	99.7	5.4	112.6	D80 N81 Y82 V114 K115	D80-R84 VanDerWaalsContact O-CB 3.28Å; D80-R84 WeakPolarHBondContact O-CB 3.29Å; D80-R84 PolarHBondContact O-N 3.36Å; N81-R84 PolarHBondContact O-N 2.8Å; N81-R84 PolarHBondContact OD1-NH1 2.67Å; Y82-R84 PolarHBondContact O-N 2.68Å; R84-V114 HydrophobicContact CB-CG1 3.81Å; R84-K115 PolarHBondContact O-NZ 3.03Å
85	S	93	Very high	90.8	Very high	58 Å²	58	40.1 Å²	40.1	41%	0.406	21%	0.205	S	C	.	.	H	α-helix	trans	-76.1	-23	-179.5	77	0	0	0	0	114.7	K16 N81 Y82 F83	K16-S85 VanDerWaalsContact CD-O 3.29Å; K16-S85 WeakPolarHBondContact CD-O 3.47Å; N81-S85 WeakPolarHBondContact O-CB 3.24Å; N81-S85 PolarHBondContact O-N 2.96Å; N81-S85 PolarHBondContact O-OG 2.68Å; Y82-S85 PolarHBondContact O-N 2.99Å; Y82-S85 PolarHBondContact O-OG 2.9Å; F83-S85 PolarHBondContact O-N 3.49Å
86	G	95.5	Very high	92.3	Very high	1 Å²	1	32.2 Å²	32.2	1%	0.01	18%	0.176	C	C	.	.			trans	-71	143.9	179.3	0	0	0	0	0	113.2	I18 Y82 F83 K115	I18-G86 VanDerWaalsContact CG1-CA 3.47Å; Y82-G86 PolarHBondContact O-N 2.85Å; F83-G86 PolarHBondContact O-N 3.44Å; F83-G86 VanDerWaalsContact O-N 3.1Å; G86-K115 WeakPolarHBondContact O-CE 3.33Å; G86-K115 PolarHBondContact O-NZ 3.25Å
87	E	97.4	Very high	93.6	Very high	48 Å²	48	32.9 Å²	32.9	22%	0.224	17%	0.17	C	C	.	.	S	Bend	trans	-102.2	-24.7	174.3	-65.1	175.2	148.3	0	0	112	H15 K16 P122 I176 K180	H15-E87 WeakPolarHBondContact CA-OE2 3.4Å; K16-E87 HydrophobicContact CB-CB 4.32Å; K16-E87 HydrophobicContact CB-CG 4.03Å; K16-E87 PolarHBondContact N-OE2 3.45Å; K16-E87 WeakPolarHBondContact O-CA 3.44Å; K16-E87 PolarHBondContact O-N 2.91Å; E87-P122 WeakPolarHBondContact O-CD 3.28Å; E87-P122 WeakPolarHBondContact O-CG 3.33Å; E87-I176 HydrophobicContact CB-CD1 4.26Å; E87-I176 HydrophobicContact CB-CG1 4.36Å; E87-I176 HydrophobicContact CB-CG2 3.85Å; E87-K180 WeakPolarHBondContact OE1-CE 3.48Å; E87-K180 IonicContact OE1-NZ 2.73Å; E87-K180 PolarHBondContact OE1-NZ 3.49Å; E87-K180 VanDerWaalsContact OE2-CE 3.23Å; E87-K180 WeakPolarHBondContact OE2-CE 3.29Å; E87-K180 IonicContact OE2-NZ 3.44Å; E87-K180 PolarHBondContact OE2-NZ 2.52Å
88	G	98.2	Very high	94.7	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.2	163.1	169.6	0	0	0	0	0	112.4	K16 V17 I18 P122	K16-G88 PolarHBondContact O-N 3.33Å; K16-G88 VanDerWaalsContact O-N 3.1Å; V17-G88 WeakPolarHBondContact CA-O 3.46Å; I18-G88 PolarHBondContact N-O 3.15Å; G88-P122 CarbonylContact C-O 3.53Å; G88-P122 WeakPolarHBondContact CA-O 3.48Å
89	F	98.4	Very high	95.5	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	129.9	-169	-58.9	-89.8	0	0	0	111.2	I18 V20 F83 I111 K115 I121 P122 L123 L124	I18-F89 HydrophobicContact CB-CD1 3.85Å; I18-F89 HydrophobicContact CB-CE1 4.07Å; I18-F89 HydrophobicContact CG1-CD1 4.21Å; I18-F89 HydrophobicContact CG1-CE1 3.97Å; I18-F89 WeakPolarHBondContact O-CA 3.32Å; V20-F89 HydrophobicContact CG2-CD1 3.94Å; F83-F89 HydrophobicContact CB-CE1 4.12Å; F83-F89 HydrophobicContact CB-CZ 4.35Å; F83-F89 HydrophobicContact CD1-CD1 4.39Å; F83-F89 AromaticContact CD1-CE1 3.78Å; F83-F89 HydrophobicContact CD1-CE1 3.78Å; F83-F89 HydrophobicContact CG-CE1 4.18Å; F83-F89 WeakPolarHBondContact O-CZ 3.44Å; F89-I111 HydrophobicContact CB-CD1 4.08Å; F89-I111 HydrophobicContact CD1-CD1 3.74Å; F89-I111 HydrophobicContact CD1-CG1 3.97Å; F89-I111 HydrophobicContact CD1-CG2 4.32Å; F89-I111 HydrophobicContact CD2-CG2 3.79Å; F89-I111 HydrophobicContact CE1-CD1 4.34Å; F89-I111 HydrophobicContact CE1-CG1 4.04Å; F89-I111 HydrophobicContact CE1-CG2 4.16Å; F89-I111 HydrophobicContact CE2-CG2 3.64Å; F89-I111 HydrophobicContact CG-CD1 3.89Å; F89-I111 HydrophobicContact CG-CG1 4.38Å; F89-I111 HydrophobicContact CG-CG2 4.14Å; F89-I111 HydrophobicContact CZ-CG2 3.83Å; F89-K115 HydrophobicContact CE2-CG 4.3Å; F89-K115 HydrophobicContact CZ-CG 4.29Å; F89-I121 HydrophobicContact CD2-CG2 3.7Å; F89-I121 HydrophobicContact CE2-CG2 3.72Å; F89-P122 PolarHBondContact N-O 2.78Å; F89-L123 HydrophobicContact CB-CD1 3.6Å; F89-L123 WeakPolarHBondContact O-CA 3.48Å; F89-L124 PolarHBondContact O-N 2.8Å
90	L	98.6	Very high	96.1	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	111	163.3	-68.2	-175.6	0	0	0	108.1	V17 I18 M19 V20 V92 L124 V126 V168 F169 L172	V17-L90 HydrophobicContact CG1-CD1 4.43Å; V17-L90 HydrophobicContact CG1-CG 4.21Å; I18-L90 PolarHBondContact O-N 3.47Å; M19-L90 HydrophobicContact CE-CB 4.33Å; M19-L90 HydrophobicContact CE-CD1 4.07Å; M19-L90 HydrophobicContact SD-CB 3.99Å; M19-L90 HydrophobicContact SD-CD1 3.78Å; M19-L90 HydrophobicContact SD-CG 4.3Å; V20-L90 PolarHBondContact N-O 3.26Å; L90-V92 HydrophobicContact CB-CG2 4.19Å; L90-V92 PolarHBondContact O-N 3.29Å; L90-L124 HydrophobicContact CD2-CB 3.65Å; L90-L124 HydrophobicContact CD2-CD2 4.02Å; L90-L124 HydrophobicContact CD2-CG 4.49Å; L90-V126 HydrophobicContact CB-CG2 4.45Å; L90-V126 HydrophobicContact CD2-CG2 4.02Å; L90-V168 HydrophobicContact CD1-CB 4.39Å; L90-V168 HydrophobicContact CD1-CG2 4.09Å; L90-V168 HydrophobicContact CD2-CB 4.19Å; L90-F169 HydrophobicContact CD1-CD1 3.8Å; L90-F169 HydrophobicContact CD1-CE1 3.63Å; L90-F169 HydrophobicContact CD1-CE2 4.43Å; L90-F169 HydrophobicContact CD1-CG 4.29Å; L90-F169 HydrophobicContact CD1-CZ 3.97Å; L90-L172 HydrophobicContact CD2-CB 4.06Å; L90-L172 HydrophobicContact CD2-CD2 3.68Å; L90-L172 HydrophobicContact CD2-CG 4.39Å; L90-L172 HydrophobicContact CG-CD2 3.67Å
91	L	97.9	Very high	96.6	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	94	178.5	-176.2	57.8	0	0	0	109	V20 T104 F107 R108 L123 L124 V125 V126 W150	V20-L91 HydrophobicContact CB-CD1 4.24Å; V20-L91 HydrophobicContact CG1-CD1 4.1Å; V20-L91 CarbonylContact O-C 3.59Å; V20-L91 WeakPolarHBondContact O-CA 3.35Å; L91-T104 HydrophobicContact CD1-CG2 4.26Å; L91-T104 HydrophobicContact CG-CG2 4.04Å; L91-F107 HydrophobicContact CD1-CB 3.61Å; L91-F107 HydrophobicContact CD1-CD2 4.36Å; L91-F107 HydrophobicContact CD1-CG 4.28Å; L91-R108 HydrophobicContact CD2-CB 4.15Å; L91-L123 HydrophobicContact CB-CD1 3.86Å; L91-L123 HydrophobicContact CD2-CD1 4.39Å; L91-L124 PolarHBondContact N-O 2.93Å; L91-V125 HydrophobicContact CD2-CG2 4.46Å; L91-V126 PolarHBondContact O-N 3.02Å; L91-W150 HydrophobicContact CD2-CZ3 4.05Å
92	V	98.4	Very high	96.9	Very high	0 Å²	0	32 Å²	32	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	131.9	-169.9	-168.5	0	0	0	0	110.6	M19 V20 G21 V25 K27 L30 L90 V126 N128	M19-V92 HydrophobicContact CE-CG2 3.97Å; V20-V92 PolarHBondContact O-N 2.8Å; G21-V92 WeakPolarHBondContact CA-O 3.46Å; V25-V92 HydrophobicContact CB-CG1 4.39Å; V25-V92 HydrophobicContact CG2-CB 4.07Å; V25-V92 HydrophobicContact CG2-CG1 3.93Å; K27-V92 HydrophobicContact CG-CB 4.27Å; K27-V92 HydrophobicContact CG-CG2 4.38Å; L30-V92 HydrophobicContact CD1-CG1 3.83Å; L30-V92 HydrophobicContact CD1-CG2 4.19Å; L90-V92 HydrophobicContact CB-CG2 4.19Å; L90-V92 PolarHBondContact O-N 3.29Å; V92-V126 WeakPolarHBondContact CA-O 3.21Å; V92-V126 HydrophobicContact CG1-CG1 4.48Å; V92-V126 HydrophobicContact CG2-CB 4.24Å; V92-N128 HydrophobicContact CG1-CB 3.91Å
93	F	98.5	Very high	97.1	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	169.8	166.5	71.8	-85.4	0	0	0	110.1	I95 F101 T104 V125 V126 N128 V138 A143 Y154	F93-I95 HydrophobicContact CE2-CG2 4.12Å; F93-F101 HydrophobicContact CB-CB 4.43Å; F93-F101 AromaticContact CD1-CD2 3.97Å; F93-F101 HydrophobicContact CD1-CD2 3.97Å; F93-F101 HydrophobicContact CD2-CB 3.7Å; F93-F101 AromaticContact CD2-CD2 3.99Å; F93-F101 HydrophobicContact CD2-CD2 3.99Å; F93-F101 HydrophobicContact CD2-CG 4.29Å; F93-F101 AromaticContact CE1-CD2 3.81Å; F93-F101 HydrophobicContact CE1-CD2 3.81Å; F93-F101 HydrophobicContact CE1-CE2 4.3Å; F93-F101 HydrophobicContact CE2-CB 4.12Å; F93-F101 AromaticContact CE2-CD2 3.84Å; F93-F101 HydrophobicContact CE2-CD2 3.84Å; F93-F101 HydrophobicContact CE2-CG 4.3Å; F93-F101 HydrophobicContact CG-CB 4.09Å; F93-F101 HydrophobicContact CG-CD2 4.05Å; F93-F101 AromaticContact CZ-CD2 3.75Å; F93-F101 HydrophobicContact CZ-CD2 3.75Å; F93-F101 HydrophobicContact CZ-CE2 4.29Å; F93-T104 HydrophobicContact CB-CG2 3.84Å; F93-T104 HydrophobicContact CD1-CG2 4.2Å; F93-T104 HydrophobicContact CG-CG2 4.35Å; F93-V125 HydrophobicContact CD1-CG1 4.19Å; F93-V125 HydrophobicContact CE1-CG1 3.79Å; F93-V126 VanDerWaalsContact CD1-O 3.29Å; F93-V126 WeakPolarHBondContact CD1-O 3.41Å; F93-V126 PolarHBondContact N-O 3.23Å; F93-N128 WeakPolarHBondContact O-CB 3.42Å; F93-N128 PolarHBondContact O-N 3.38Å; F93-V138 HydrophobicContact CD2-CG2 4.4Å; F93-V138 HydrophobicContact CE2-CB 4.04Å; F93-V138 HydrophobicContact CE2-CG1 3.87Å; F93-V138 HydrophobicContact CE2-CG2 4.12Å; F93-V138 HydrophobicContact CZ-CG1 4.33Å; F93-A143 HydrophobicContact CE1-CB 4.42Å; F93-A143 HydrophobicContact CZ-CB 3.79Å; F93-Y154 HydrophobicContact CE1-CD2 4.48Å; F93-Y154 AromaticContact CE1-CE2 3.82Å; F93-Y154 HydrophobicContact CE1-CE2 3.82Å; F93-Y154 AromaticContact CZ-CE2 3.78Å; F93-Y154 HydrophobicContact CZ-CE2 3.78Å
94	S	98.4	Very high	97.3	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	126.4	175.1	179.7	0	0	0	0	109.4	T96 E97 S100 K129	S94-T96 PolarHBondContact O-N 2.94Å; S94-T96 PolarHBondContact OG-OG1 2.82Å; S94-E97 PolarHBondContact O-N 2.78Å; S94-E97 VanDerWaalsContact O-N 3.09Å; S94-S100 PolarHBondContact N-OG 3.39Å; S94-S100 PolarHBondContact O-OG 3.37Å; S94-K129 VanDerWaalsContact OG-CD 3.26Å; S94-K129 WeakPolarHBondContact OG-CD 3.4Å; S94-K129 VanDerWaalsContact OG-CE 3.32Å; S94-K129 WeakPolarHBondContact OG-CE 3.27Å; S94-K129 PolarHBondContact OG-NZ 3.33Å
95	I	98.8	Very high	97.4	Very high	0 Å²	0	26 Å²	26	0%	0	15%	0.146	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-18	177.5	66.2	159.4	0	0	0	112.7	F93 N128 K129 R136 Q137 V138	F93-I95 HydrophobicContact CE2-CG2 4.12Å; I95-N128 PolarHBondContact N-O 3.18Å; I95-K129 WeakPolarHBondContact CD1-O 3.08Å; I95-K129 WeakPolarHBondContact CG1-O 3.2Å; I95-R136 HydrophobicContact CD1-CB 4.39Å; I95-R136 HydrophobicContact CD1-CG 4.5Å; I95-Q137 PolarHBondContact O-N 3.41Å; I95-V138 PolarHBondContact O-N 2.85Å
96	T	98.5	Very high	97.5	Very high	25 Å²	25	28.8 Å²	28.8	15%	0.153	15%	0.152	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.7	6.3	179.9	73.8	0	0	0	0	114	S94 K129 L132 R135 Q137	S94-T96 PolarHBondContact O-N 2.94Å; S94-T96 PolarHBondContact OG-OG1 2.82Å; T96-K129 HydrophobicContact CG2-CB 4.48Å; T96-L132 HydrophobicContact CG2-CB 3.65Å; T96-L132 HydrophobicContact CG2-CD1 4Å; T96-L132 HydrophobicContact CG2-CG 4.47Å; T96-R135 WeakPolarHBondContact CA-O 3.34Å; T96-R135 WeakPolarHBondContact CB-O 3.42Å; T96-R135 HydrophobicContact CG2-CB 3.89Å; T96-Q137 PolarHBondContact O-NE2 2.97Å; T96-Q137 PolarHBondContact O-OE1 3.03Å
97	E	97.6	Very high	97.4	Very high	68 Å²	68	30 Å²	30	32%	0.318	16%	0.157	S	C	.	.			trans	-144.3	98.7	-175.8	-174.3	-178.9	178.6	0	0	109.4	S94 E99 S100	S94-E97 PolarHBondContact O-N 2.78Å; S94-E97 VanDerWaalsContact O-N 3.09Å; E97-E99 VanDerWaalsContact C-N 3.29Å; E97-E99 PolarHBondContact O-N 3.04Å; E97-S100 WeakPolarHBondContact O-CB 3.45Å; E97-S100 PolarHBondContact O-N 2.91Å; E97-S100 VanDerWaalsContact O-N 3.12Å; E97-S100 PolarHBondContact O-OG 3.17Å
98	H	98.2	Very high	97.3	Very high	60 Å²	60	30.2 Å²	30.2	28%	0.278	16%	0.156	S	C	.	.	H	α-helix	trans	-62.8	-34.9	-174.7	-169.6	-77.9	0	0	0	112.6	S100 F101 T102 Q137 V138 E142	H98-S100 PolarHBondContact O-N 2.89Å; H98-F101 WeakPolarHBondContact O-CB 3.39Å; H98-F101 PolarHBondContact O-N 3.36Å; H98-T102 PolarHBondContact CE1-OG1 3.37Å; H98-T102 PolarHBondContact ND1-OG1 2.92Å; H98-T102 PolarHBondContact O-N 3.22Å; H98-T102 PolarHBondContact O-OG1 3.02Å; H98-Q137 HydrophobicContact CB-CB 4.3Å; H98-Q137 VanDerWaalsContact N-OE1 3.12Å; H98-V138 HydrophobicContact CB-CG2 4.41Å; H98-E142 IonicContact CE1-OE1 2.77Å; H98-E142 IonicContact NE2-OE1 3.2Å; H98-E142 PolarHBondContact NE2-OE1 2.73Å; H98-E142 IonicContact NE2-OE2 2.81Å
99	E	97.2	Very high	97.2	Very high	128 Å²	128	36.4 Å²	36.4	60%	0.598	19%	0.185	S	C	*	.	H	α-helix	trans	-58.8	-38.1	175.9	-65.2	77.3	-170.8	0	0	111.5	E97 F101 T102 A103	E97-E99 VanDerWaalsContact C-N 3.29Å; E97-E99 PolarHBondContact O-N 3.04Å; E99-F101 VanDerWaalsContact C-N 3.3Å; E99-F101 PolarHBondContact O-N 3.37Å; E99-T102 PolarHBondContact O-N 3.04Å; E99-A103 WeakPolarHBondContact O-CB 3.31Å; E99-A103 PolarHBondContact O-N 3.43Å
100	S	97	Very high	96.9	Very high	1 Å²	1	37.2 Å²	37.2	1%	0.007	19%	0.189	C	C	.	.	H	α-helix	trans	-66.1	-33.4	177.4	80.3	0	0	0	0	112.5	S94 E97 H98 T104	S94-S100 PolarHBondContact N-OG 3.39Å; S94-S100 PolarHBondContact O-OG 3.37Å; E97-S100 WeakPolarHBondContact O-CB 3.45Å; E97-S100 PolarHBondContact O-N 2.91Å; E97-S100 VanDerWaalsContact O-N 3.12Å; E97-S100 PolarHBondContact O-OG 3.17Å; H98-S100 PolarHBondContact O-N 2.89Å; S100-T104 WeakPolarHBondContact O-CG2 3.3Å
101	F	98.5	Very high	96.8	Very high	12 Å²	12	37.3 Å²	37.3	5%	0.053	19%	0.189	C	C	.	.	H	α-helix	trans	-71.6	-45.4	173.6	174.1	-109.8	0	0	0	111.1	F93 H98 E99 A103 T104 V138 E142 A143 K146	F93-F101 HydrophobicContact CB-CB 4.43Å; F93-F101 AromaticContact CD1-CD2 3.97Å; F93-F101 HydrophobicContact CD1-CD2 3.97Å; F93-F101 HydrophobicContact CD2-CB 3.7Å; F93-F101 AromaticContact CD2-CD2 3.99Å; F93-F101 HydrophobicContact CD2-CD2 3.99Å; F93-F101 HydrophobicContact CD2-CG 4.29Å; F93-F101 AromaticContact CE1-CD2 3.81Å; F93-F101 HydrophobicContact CE1-CD2 3.81Å; F93-F101 HydrophobicContact CE1-CE2 4.3Å; F93-F101 HydrophobicContact CE2-CB 4.12Å; F93-F101 AromaticContact CE2-CD2 3.84Å; F93-F101 HydrophobicContact CE2-CD2 3.84Å; F93-F101 HydrophobicContact CE2-CG 4.3Å; F93-F101 HydrophobicContact CG-CB 4.09Å; F93-F101 HydrophobicContact CG-CD2 4.05Å; F93-F101 AromaticContact CZ-CD2 3.75Å; F93-F101 HydrophobicContact CZ-CD2 3.75Å; F93-F101 HydrophobicContact CZ-CE2 4.29Å; H98-F101 WeakPolarHBondContact O-CB 3.39Å; H98-F101 PolarHBondContact O-N 3.36Å; E99-F101 VanDerWaalsContact C-N 3.3Å; E99-F101 PolarHBondContact O-N 3.37Å; F101-A103 VanDerWaalsContact C-N 3.28Å; F101-A103 PolarHBondContact O-N 2.9Å; F101-T104 VanDerWaalsContact O-CB 3.3Å; F101-T104 WeakPolarHBondContact O-CB 3.38Å; F101-T104 WeakPolarHBondContact O-CG2 3.29Å; F101-T104 PolarHBondContact O-N 3.03Å; F101-T104 PolarHBondContact O-OG1 2.95Å; F101-V138 HydrophobicContact CB-CG1 4.23Å; F101-V138 HydrophobicContact CB-CG2 3.68Å; F101-V138 HydrophobicContact CD1-CG1 3.96Å; F101-V138 HydrophobicContact CD2-CG1 4.11Å; F101-V138 HydrophobicContact CE1-CG1 4.35Å; F101-V138 HydrophobicContact CE2-CG1 4.48Å; F101-V138 HydrophobicContact CG-CG1 3.83Å; F101-V138 HydrophobicContact CG-CG2 4.19Å; F101-E142 HydrophobicContact CE1-CG 3.8Å; F101-E142 WeakPolarHBondContact CE1-OE1 3.49Å; F101-E142 HydrophobicContact CZ-CG 4.23Å; F101-A143 HydrophobicContact CE2-CB 3.86Å; F101-A143 HydrophobicContact CZ-CB 4.31Å; F101-K146 HydrophobicContact CE2-CB 4.42Å; F101-K146 HydrophobicContact CZ-CB 3.84Å; F101-K146 HydrophobicContact CZ-CG 4.14Å
102	T	97.4	Very high	96.6	Very high	84 Å²	84	40.4 Å²	40.4	52%	0.515	21%	0.206	S	C	.	.	H	α-helix	trans	-58.5	-40.8	177.5	-60.5	0	0	0	0	111.7	H98 E99 T104 A105	H98-T102 PolarHBondContact CE1-OG1 3.37Å; H98-T102 PolarHBondContact ND1-OG1 2.92Å; H98-T102 PolarHBondContact O-N 3.22Å; H98-T102 PolarHBondContact O-OG1 3.02Å; E99-T102 PolarHBondContact O-N 3.04Å; T102-T104 PolarHBondContact O-N 2.73Å; T102-A105 PolarHBondContact O-N 3.43Å
103	A	95.6	Very high	96.5	Very high	25 Å²	25	47.3 Å²	47.3	21%	0.207	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-21.1	177.5	0	0	0	0	0	114	S22 E99 F101 A105 E106 F107	S22-A103 WeakPolarHBondContact OG-CB 3.19Å; E99-A103 WeakPolarHBondContact O-CB 3.31Å; E99-A103 PolarHBondContact O-N 3.43Å; F101-A103 VanDerWaalsContact C-N 3.28Å; F101-A103 PolarHBondContact O-N 2.9Å; A103-A105 PolarHBondContact O-N 3.24Å; A103-E106 PolarHBondContact O-N 3.22Å; A103-F107 HydrophobicContact CB-CD2 4.47Å; A103-F107 HydrophobicContact CB-CE2 4.17Å; A103-F107 WeakPolarHBondContact O-CD2 3.39Å; A103-F107 PolarHBondContact O-N 3.1Å
104	T	96.5	Very high	96.3	Very high	2 Å²	2	48.4 Å²	48.4	1%	0.012	24%	0.238	C	C	.	.	H	α-helix	trans	-60	-31.1	179.5	64.5	0	0	0	0	112.7	L91 F93 S100 F101 T102 F107 R108 W150	L91-T104 HydrophobicContact CD1-CG2 4.26Å; L91-T104 HydrophobicContact CG-CG2 4.04Å; F93-T104 HydrophobicContact CB-CG2 3.84Å; F93-T104 HydrophobicContact CD1-CG2 4.2Å; F93-T104 HydrophobicContact CG-CG2 4.35Å; S100-T104 WeakPolarHBondContact O-CG2 3.3Å; F101-T104 VanDerWaalsContact O-CB 3.3Å; F101-T104 WeakPolarHBondContact O-CB 3.38Å; F101-T104 WeakPolarHBondContact O-CG2 3.29Å; F101-T104 PolarHBondContact O-N 3.03Å; F101-T104 PolarHBondContact O-OG1 2.95Å; T102-T104 PolarHBondContact O-N 2.73Å; T104-F107 PolarHBondContact O-N 2.83Å; T104-R108 WeakPolarHBondContact O-CB 3.2Å; T104-R108 PolarHBondContact O-N 3.1Å; T104-W150 WeakPolarHBondContact OG1-CH2 3.4Å
105	A	96.8	Very high	96.1	Very high	34 Å²	34	49 Å²	49	28%	0.281	24%	0.241	S	C	.	.	H	α-helix	trans	-62.2	-45.3	177.2	0	0	0	0	0	111.8	T102 A103 R108 E109 W150	T102-A105 PolarHBondContact O-N 3.43Å; A103-A105 PolarHBondContact O-N 3.24Å; A105-R108 PolarHBondContact O-N 3.08Å; A105-E109 WeakPolarHBondContact O-CG 3.4Å; A105-E109 PolarHBondContact O-N 2.93Å; A105-W150 HydrophobicContact CB-CH2 4.31Å; A105-W150 HydrophobicContact CB-CZ2 3.94Å
106	E	93.9	Very high	95.9	Very high	116 Å²	116	52.9 Å²	52.9	54%	0.542	27%	0.273	S	S	.	.	H	α-helix	trans	-64.2	-45.8	178.7	-168.5	-167.2	155.1	0	0	111.2	A103 R108 E109 Q110	A103-E106 PolarHBondContact O-N 3.22Å; E106-R108 VanDerWaalsContact C-N 3.3Å; E106-R108 PolarHBondContact O-N 2.89Å; E106-E109 PolarHBondContact O-N 2.66Å; E106-Q110 WeakPolarHBondContact O-CG 3.28Å; E106-Q110 PolarHBondContact O-N 2.85Å; E106-Q110 PolarHBondContact OE1-NE2 3Å
107	F	94.2	Very high	95.5	Very high	27 Å²	27	61.2 Å²	61.2	12%	0.118	31%	0.31	C	S	.	.	H	α-helix	trans	-58.6	-43	175.9	-74.6	-61.4	0	0	0	111.9	V20 L91 A103 T104 Q110 I111	V20-F107 HydrophobicContact CG1-CB 3.72Å; V20-F107 HydrophobicContact CG1-CD1 3.49Å; V20-F107 VanDerWaalsContact CG1-CD1 3.49Å; V20-F107 HydrophobicContact CG1-CD2 4.5Å; V20-F107 HydrophobicContact CG1-CE1 4.23Å; V20-F107 HydrophobicContact CG1-CG 3.66Å; L91-F107 HydrophobicContact CD1-CB 3.61Å; L91-F107 HydrophobicContact CD1-CD2 4.36Å; L91-F107 HydrophobicContact CD1-CG 4.28Å; A103-F107 HydrophobicContact CB-CD2 4.47Å; A103-F107 HydrophobicContact CB-CE2 4.17Å; A103-F107 WeakPolarHBondContact O-CD2 3.39Å; A103-F107 PolarHBondContact O-N 3.1Å; T104-F107 PolarHBondContact O-N 2.83Å; F107-Q110 PolarHBondContact O-N 2.83Å; F107-I111 VanDerWaalsContact O-CG1 3.31Å; F107-I111 WeakPolarHBondContact O-CG1 3.49Å; F107-I111 PolarHBondContact O-N 2.96Å
108	R	95.6	Very high	95.2	Very high	52 Å²	52	60.5 Å²	60.5	20%	0.196	31%	0.307	C	S	.	.	H	α-helix	trans	-60.5	-48.5	176.1	179.1	179.6	177.4	-88.5	5.2	111.2	L91 T104 A105 E106 Q110 I111 L112 L123 W150	L91-R108 HydrophobicContact CD2-CB 4.15Å; T104-R108 WeakPolarHBondContact O-CB 3.2Å; T104-R108 PolarHBondContact O-N 3.1Å; A105-R108 PolarHBondContact O-N 3.08Å; E106-R108 VanDerWaalsContact C-N 3.3Å; E106-R108 PolarHBondContact O-N 2.89Å; R108-Q110 VanDerWaalsContact C-N 3.29Å; R108-Q110 PolarHBondContact O-N 3.06Å; R108-I111 PolarHBondContact O-N 3.21Å; R108-I111 VanDerWaalsContact O-N 3.17Å; R108-L112 HydrophobicContact CG-CD1 4.31Å; R108-L112 HydrophobicContact CG-CG 4.33Å; R108-L112 WeakPolarHBondContact O-CG 3.3Å; R108-L112 PolarHBondContact O-N 3.03Å; R108-L123 HydrophobicContact CG-CD2 4.11Å; R108-W150 VanDerWaalsContact CD-CE2 3.43Å; R108-W150 VanDerWaalsContact CZ-CD1 3.41Å
109	E	94.8	Very high	94.6	Very high	131 Å²	131	66 Å²	66	61%	0.612	34%	0.338	S	S	*	.	H	α-helix	trans	-58.6	-41.1	178.6	-74.1	-179.3	178.4	0	0	112.1	A105 E106 L112 R113	A105-E109 WeakPolarHBondContact O-CG 3.4Å; A105-E109 PolarHBondContact O-N 2.93Å; E106-E109 PolarHBondContact O-N 2.66Å; E109-L112 PolarHBondContact O-N 2.99Å; E109-R113 WeakPolarHBondContact O-CB 3.44Å; E109-R113 PolarHBondContact O-N 2.82Å
110	Q	93	Very high	94.3	Very high	17 Å²	17	65 Å²	65	8%	0.079	33%	0.332	C	S	.	.	H	α-helix	trans	-63.4	-43.7	175.5	-66.8	178.5	22	0	0	112	F83 E106 F107 R108 R113 V114	F83-Q110 HydrophobicContact CD2-CB 4.38Å; F83-Q110 HydrophobicContact CE2-CB 3.82Å; E106-Q110 WeakPolarHBondContact O-CG 3.28Å; E106-Q110 PolarHBondContact O-N 2.85Å; E106-Q110 PolarHBondContact OE1-NE2 3Å; F107-Q110 PolarHBondContact O-N 2.83Å; R108-Q110 VanDerWaalsContact C-N 3.29Å; R108-Q110 PolarHBondContact O-N 3.06Å; Q110-R113 PolarHBondContact O-N 3.27Å; Q110-V114 WeakPolarHBondContact O-CG2 3.46Å; Q110-V114 PolarHBondContact O-N 3.42Å
111	I	95.2	Very high	94.2	Very high	1 Å²	1	66.2 Å²	66.2	1%	0.005	34%	0.338	C	S	.	.	H	α-helix	trans	-59.1	-50.3	175.2	-68.3	162.6	0	0	0	110.1	V20 F83 F89 F107 R108 R113 V114 K115 I121 L123	V20-I111 HydrophobicContact CG1-CD1 4.38Å; V20-I111 HydrophobicContact CG2-CD1 4.25Å; F83-I111 HydrophobicContact CD1-CG1 4.28Å; F83-I111 HydrophobicContact CD2-CG1 4.05Å; F83-I111 HydrophobicContact CE1-CG1 4.26Å; F83-I111 HydrophobicContact CE2-CG1 4.02Å; F83-I111 HydrophobicContact CG-CG1 4.17Å; F83-I111 HydrophobicContact CZ-CG1 4.12Å; F89-I111 HydrophobicContact CB-CD1 4.08Å; F89-I111 HydrophobicContact CD1-CD1 3.74Å; F89-I111 HydrophobicContact CD1-CG1 3.97Å; F89-I111 HydrophobicContact CD1-CG2 4.32Å; F89-I111 HydrophobicContact CD2-CG2 3.79Å; F89-I111 HydrophobicContact CE1-CD1 4.34Å; F89-I111 HydrophobicContact CE1-CG1 4.04Å; F89-I111 HydrophobicContact CE1-CG2 4.16Å; F89-I111 HydrophobicContact CE2-CG2 3.64Å; F89-I111 HydrophobicContact CG-CD1 3.89Å; F89-I111 HydrophobicContact CG-CG1 4.38Å; F89-I111 HydrophobicContact CG-CG2 4.14Å; F89-I111 HydrophobicContact CZ-CG2 3.83Å; F107-I111 VanDerWaalsContact O-CG1 3.31Å; F107-I111 WeakPolarHBondContact O-CG1 3.49Å; F107-I111 PolarHBondContact O-N 2.96Å; R108-I111 PolarHBondContact O-N 3.21Å; R108-I111 VanDerWaalsContact O-N 3.17Å; I111-R113 VanDerWaalsContact C-N 3.31Å; I111-R113 PolarHBondContact O-N 3.28Å; I111-V114 PolarHBondContact O-N 3.22Å; I111-K115 HydrophobicContact CG2-CG 4.34Å; I111-K115 VanDerWaalsContact O-CB 3.27Å; I111-K115 WeakPolarHBondContact O-CB 3.42Å; I111-K115 WeakPolarHBondContact O-CG 3.38Å; I111-K115 PolarHBondContact O-N 3.23Å; I111-I121 HydrophobicContact CG2-CG2 3.91Å; I111-L123 HydrophobicContact CD1-CD1 4.33Å
112	L	95.6	Very high	94.2	Very high	65 Å²	65	65.7 Å²	65.7	34%	0.34	34%	0.336	S	S	.	.	H	α-helix	trans	-59.1	-41.9	179.8	-67.1	-175.5	0	0	0	111.8	R108 E109 K115 A116 I121	R108-L112 HydrophobicContact CG-CD1 4.31Å; R108-L112 HydrophobicContact CG-CG 4.33Å; R108-L112 WeakPolarHBondContact O-CG 3.3Å; R108-L112 PolarHBondContact O-N 3.03Å; E109-L112 PolarHBondContact O-N 2.99Å; L112-K115 CarbonylContact O-C 3.4Å; L112-K115 PolarHBondContact O-N 2.93Å; L112-A116 WeakPolarHBondContact O-CA 3.37Å; L112-A116 PolarHBondContact O-N 2.79Å; L112-I121 HydrophobicContact CD2-CD1 3.49Å; L112-I121 VanDerWaalsContact CD2-CD1 3.49Å
113	R	94.9	Very high	94.3	Very high	145 Å²	145	62.3 Å²	62.3	55%	0.547	32%	0.315	S	S	.	.	H	α-helix	trans	-61.6	-45.8	177	-176.3	-175.8	69.6	-146.8	0.3	111.9	D80 E109 Q110 I111 K115	D80-R113 IonicContact OD1-NH2 3.58Å; D80-R113 PolarHBondContact OD1-NH2 2.87Å; E109-R113 WeakPolarHBondContact O-CB 3.44Å; E109-R113 PolarHBondContact O-N 2.82Å; Q110-R113 PolarHBondContact O-N 3.27Å; I111-R113 VanDerWaalsContact C-N 3.31Å; I111-R113 PolarHBondContact O-N 3.28Å; R113-K115 VanDerWaalsContact C-N 3.31Å
114	V	94.4	Very high	94.4	Very high	23 Å²	23	61.2 Å²	61.2	14%	0.139	31%	0.305	C	S	.	.	H	α-helix	trans	-71.3	-29.8	-179.2	173.7	0	0	0	0	111.8	D80 F83 R84 Q110 I111	D80-V114 HydrophobicContact CB-CG2 3.98Å; D80-V114 WeakPolarHBondContact O-CG1 3.35Å; D80-V114 VanDerWaalsContact OD1-CG2 3.29Å; D80-V114 WeakPolarHBondContact OD1-CG2 3.38Å; F83-V114 HydrophobicContact CB-CB 4.14Å; F83-V114 HydrophobicContact CB-CG1 3.86Å; F83-V114 HydrophobicContact CB-CG2 4.39Å; F83-V114 HydrophobicContact CD2-CG2 4.37Å; R84-V114 HydrophobicContact CB-CG1 3.81Å; Q110-V114 WeakPolarHBondContact O-CG2 3.46Å; Q110-V114 PolarHBondContact O-N 3.42Å; I111-V114 PolarHBondContact O-N 3.22Å
115	K	95.3	Very high	94.5	Very high	13 Å²	13	61.2 Å²	61.2	6%	0.057	31%	0.305	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102.4	22.2	-178.1	-64.3	-57.4	-150.7	164.1	0	113.8	F83 R84 G86 F89 I111 L112 R113 E117 E118 I121	F83-K115 WeakPolarHBondContact O-CE 3.29Å; R84-K115 PolarHBondContact O-NZ 3.03Å; G86-K115 WeakPolarHBondContact O-CE 3.33Å; G86-K115 PolarHBondContact O-NZ 3.25Å; F89-K115 HydrophobicContact CE2-CG 4.3Å; F89-K115 HydrophobicContact CZ-CG 4.29Å; I111-K115 HydrophobicContact CG2-CG 4.34Å; I111-K115 VanDerWaalsContact O-CB 3.27Å; I111-K115 WeakPolarHBondContact O-CB 3.42Å; I111-K115 WeakPolarHBondContact O-CG 3.38Å; I111-K115 PolarHBondContact O-N 3.23Å; L112-K115 CarbonylContact O-C 3.4Å; L112-K115 PolarHBondContact O-N 2.93Å; R113-K115 VanDerWaalsContact C-N 3.31Å; K115-E117 PolarHBondContact O-N 3.12Å; K115-E118 HydrophobicContact CD-CG 4.49Å; K115-E118 WeakPolarHBondContact CD-OE1 3.44Å; K115-E118 WeakPolarHBondContact CE-OE1 3.3Å; K115-E118 IonicContact NZ-OE1 3.33Å; K115-E118 PolarHBondContact NZ-OE1 2.94Å; K115-E118 IonicContact NZ-OE2 2.66Å; K115-E118 WeakPolarHBondContact O-CB 3.36Å; K115-E118 PolarHBondContact O-N 3.02Å; K115-I121 HydrophobicContact CB-CD1 3.41Å; K115-I121 VanDerWaalsContact CB-CD1 3.41Å; K115-I121 HydrophobicContact CB-CG1 3.76Å; K115-I121 HydrophobicContact CG-CD1 4.35Å; K115-I121 HydrophobicContact CG-CG1 4.42Å
116	A	93.5	Very high	94.6	Very high	82 Å²	82	59.6 Å²	59.6	68%	0.678	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59	-19.2	-173.7	0	0	0	0	0	115.1	L112 E118	L112-A116 WeakPolarHBondContact O-CA 3.37Å; L112-A116 PolarHBondContact O-N 2.79Å; A116-E118 VanDerWaalsContact C-N 3.34Å
117	E	91	Very high	94.8	Very high	199 Å²	199	54 Å²	54	93%	0.93	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.5	-6.6	175.7	-61.4	-177.2	-176.8	0	0	113.7	K115	K115-E117 PolarHBondContact O-N 3.12Å
118	E	90	Very high	95.1	Very high	54 Å²	54	52.9 Å²	52.9	25%	0.252	26%	0.261	S	S	.	.			trans	-100.7	123.6	-177.2	-58.2	-178	177.7	0	0	111.3	K115 A116 K120 I121 K179	K115-E118 HydrophobicContact CD-CG 4.49Å; K115-E118 WeakPolarHBondContact CD-OE1 3.44Å; K115-E118 WeakPolarHBondContact CE-OE1 3.3Å; K115-E118 IonicContact NZ-OE1 3.33Å; K115-E118 PolarHBondContact NZ-OE1 2.94Å; K115-E118 IonicContact NZ-OE2 2.66Å; K115-E118 WeakPolarHBondContact O-CB 3.36Å; K115-E118 PolarHBondContact O-N 3.02Å; A116-E118 VanDerWaalsContact C-N 3.34Å; E118-K120 VanDerWaalsContact C-N 3.27Å; E118-K120 PolarHBondContact O-N 3.13Å; E118-I121 HydrophobicContact CB-CG1 4.18Å; E118-K179 IonicContact OE1-NZ 2.95Å; E118-K179 IonicContact OE2-NZ 3.55Å; E118-K179 PolarHBondContact OE2-NZ 3.33Å
119	D	86.3	Confident	95.2	Very high	174 Å²	174	52.9 Å²	52.9	93%	0.93	26%	0.262	S	S	*	.	S	Bend	trans	-65.1	-30.3	-179.9	-64.8	-37.1	0	0	0	113.2
120	K	90.8	Very high	95.4	Very high	107 Å²	107	48 Å²	48	47%	0.465	24%	0.242	S	C	.	.			trans	-138.3	130.1	178	-174.2	176.4	176.7	-173.4	0	109.8	E118 E175 K179	E118-K120 VanDerWaalsContact C-N 3.27Å; E118-K120 PolarHBondContact O-N 3.13Å; K120-E175 WeakPolarHBondContact CE-OE2 3.17Å; K120-E175 IonicContact NZ-OE2 2.93Å; K120-E175 PolarHBondContact NZ-OE2 3.24Å; K120-K179 WeakPolarHBondContact O-CD 3.38Å; K120-K179 WeakPolarHBondContact O-CE 3.31Å; K120-K179 PolarHBondContact O-NZ 2.95Å
121	I	96	Very high	95.6	Very high	28 Å²	28	50 Å²	50	14%	0.144	25%	0.254	C	S	.	.			trans	-112.4	112.5	177.9	-62.6	156.4	0	0	0	108.2	F89 I111 L112 K115 E118 L123	F89-I121 HydrophobicContact CD2-CG2 3.7Å; F89-I121 HydrophobicContact CE2-CG2 3.72Å; I111-I121 HydrophobicContact CG2-CG2 3.91Å; L112-I121 HydrophobicContact CD2-CD1 3.49Å; L112-I121 VanDerWaalsContact CD2-CD1 3.49Å; K115-I121 HydrophobicContact CB-CD1 3.41Å; K115-I121 VanDerWaalsContact CB-CD1 3.41Å; K115-I121 HydrophobicContact CB-CG1 3.76Å; K115-I121 HydrophobicContact CG-CD1 4.35Å; K115-I121 HydrophobicContact CG-CG1 4.42Å; E118-I121 HydrophobicContact CB-CG1 4.18Å; I121-L123 PolarHBondContact O-N 2.95Å; I121-L123 VanDerWaalsContact O-N 3.08Å
122	P	97.9	Very high	95.7	Very high	1 Å²	1	52.4 Å²	52.4	1%	0.006	27%	0.266	C	S	.	.			trans	-59.7	111.7	174.1	-25.2	36.6	0	0	0	110	E87 G88 F89 L172 E175 I176 K179	E87-P122 WeakPolarHBondContact O-CD 3.28Å; E87-P122 WeakPolarHBondContact O-CG 3.33Å; G88-P122 CarbonylContact C-O 3.53Å; G88-P122 WeakPolarHBondContact CA-O 3.48Å; F89-P122 PolarHBondContact N-O 2.78Å; P122-L172 HydrophobicContact CB-CD1 3.87Å; P122-E175 HydrophobicContact CB-CB 3.87Å; P122-I176 HydrophobicContact CB-CG1 3.82Å; P122-I176 HydrophobicContact CG-CG1 4.02Å; P122-K179 HydrophobicContact CG-CB 4.3Å; P122-K179 HydrophobicContact CG-CD 3.76Å
123	L	98.3	Very high	95.9	Very high	13 Å²	13	54.2 Å²	54.2	7%	0.068	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	133.5	-174.6	176.5	68.9	0	0	0	108.4	F89 L91 R108 I111 I121 V152	F89-L123 HydrophobicContact CB-CD1 3.6Å; F89-L123 WeakPolarHBondContact O-CA 3.48Å; L91-L123 HydrophobicContact CB-CD1 3.86Å; L91-L123 HydrophobicContact CD2-CD1 4.39Å; R108-L123 HydrophobicContact CG-CD2 4.11Å; I111-L123 HydrophobicContact CD1-CD1 4.33Å; I121-L123 PolarHBondContact O-N 2.95Å; I121-L123 VanDerWaalsContact O-N 3.08Å; L123-V152 HydrophobicContact CB-CG1 3.99Å; L123-V152 HydrophobicContact CD2-CG1 4.03Å; L123-V152 HydrophobicContact CG-CG1 4.11Å
124	L	98.5	Very high	96	Very high	2 Å²	2	56.9 Å²	56.9	1%	0.01	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	134.5	173.7	-147.4	74.7	0	0	0	109.3	F89 L90 L91 V126 Q153 V155 V168	F89-L124 PolarHBondContact O-N 2.8Å; L90-L124 HydrophobicContact CD2-CB 3.65Å; L90-L124 HydrophobicContact CD2-CD2 4.02Å; L90-L124 HydrophobicContact CD2-CG 4.49Å; L91-L124 PolarHBondContact N-O 2.93Å; L124-V126 HydrophobicContact CD2-CG2 4.43Å; L124-Q153 HydrophobicContact CD1-CB 3.61Å; L124-Q153 HydrophobicContact CD1-CG 4.06Å; L124-V155 HydrophobicContact CD2-CG2 4.18Å; L124-V168 HydrophobicContact CD2-CB 3.82Å; L124-V168 HydrophobicContact CD2-CG1 3.85Å
125	V	98.7	Very high	96.2	Very high	1 Å²	1	64.1 Å²	64.1	1%	0.006	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	127.5	172.7	177.7	0	0	0	0	108.4	L91 F93 A147 W150 V152 Q153 Y154 V155	L91-V125 HydrophobicContact CD2-CG2 4.46Å; F93-V125 HydrophobicContact CD1-CG1 4.19Å; F93-V125 HydrophobicContact CE1-CG1 3.79Å; V125-A147 HydrophobicContact CB-CB 4.36Å; V125-A147 HydrophobicContact CG2-CB 4.34Å; V125-W150 HydrophobicContact CG2-CE3 3.93Å; V125-W150 HydrophobicContact CG2-CZ3 3.99Å; V125-V152 HydrophobicContact CG2-CG2 3.61Å; V125-Q153 PolarHBondContact N-O 2.86Å; V125-Y154 HydrophobicContact CB-CD2 4.38Å; V125-Y154 HydrophobicContact CG1-CD2 3.96Å; V125-Y154 WeakPolarHBondContact O-CA 3.25Å; V125-V155 PolarHBondContact O-N 2.82Å
126	V	98.9	Very high	96.3	Very high	0 Å²	0	65.9 Å²	65.9	0%	0	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	113.7	-173.4	-176.4	0	0	0	0	110.6	L30 L90 L91 V92 F93 L124 N128 V155 T157 V168	L30-V126 HydrophobicContact CD1-CG1 4.25Å; L90-V126 HydrophobicContact CB-CG2 4.45Å; L90-V126 HydrophobicContact CD2-CG2 4.02Å; L91-V126 PolarHBondContact O-N 3.02Å; V92-V126 WeakPolarHBondContact CA-O 3.21Å; V92-V126 HydrophobicContact CG1-CG1 4.48Å; V92-V126 HydrophobicContact CG2-CB 4.24Å; F93-V126 VanDerWaalsContact CD1-O 3.29Å; F93-V126 WeakPolarHBondContact CD1-O 3.41Å; F93-V126 PolarHBondContact N-O 3.23Å; L124-V126 HydrophobicContact CD2-CG2 4.43Å; V126-N128 PolarHBondContact O-N 2.99Å; V126-V155 VanDerWaalsContact CA-O 3.31Å; V126-V155 WeakPolarHBondContact CA-O 3.41Å; V126-T157 HydrophobicContact CG1-CG2 3.63Å; V126-T157 WeakPolarHBondContact CG1-OG1 3.34Å; V126-V168 HydrophobicContact CG1-CG1 4.3Å; V126-V168 HydrophobicContact CG2-CB 4.2Å; V126-V168 HydrophobicContact CG2-CG1 3.93Å
127	G	98.9	Very high	96.6	Very high	0 Å²	0	67 Å²	67	0%	0	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	97.2	172.8	0	0	0	0	0	110.3	V155 E156 T157	G127-V155 PolarHBondContact N-O 2.81Å; G127-E156 CarbonylContact O-C 3.52Å; G127-E156 WeakPolarHBondContact O-CA 3.48Å; G127-T157 PolarHBondContact O-N 2.97Å
128	N	98.8	Very high	96.9	Very high	3 Å²	3	57.5 Å²	57.5	2%	0.016	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	165.5	-177.5	-168.3	36.3	0	0	0	112.4	V25 L30 V92 F93 I95 V126 T157 A159	V25-N128 PolarHBondContact O-ND2 3.41Å; L30-N128 HydrophobicContact CD1-CB 4.3Å; V92-N128 HydrophobicContact CG1-CB 3.91Å; F93-N128 WeakPolarHBondContact O-CB 3.42Å; F93-N128 PolarHBondContact O-N 3.38Å; I95-N128 PolarHBondContact N-O 3.18Å; V126-N128 PolarHBondContact O-N 2.99Å; N128-T157 CarbonylContact C-O 3.43Å; N128-T157 VanDerWaalsContact CA-O 3.32Å; N128-T157 WeakPolarHBondContact CA-O 3.3Å; N128-T157 WeakPolarHBondContact CA-OG1 3.29Å; N128-T157 PolarHBondContact OD1-O 2.58Å; N128-T157 PolarHBondContact OD1-OG1 3.3Å; N128-A159 PolarHBondContact OD1-N 3.3Å
129	K	98.3	Very high	97.3	Very high	51 Å²	51	58 Å²	58	22%	0.222	28%	0.278	C	S	.	.			trans	70.4	35.8	-177.2	-44.7	-172.8	-164.8	164.3	0	113.4	G24 S94 I95 T96 D131 L132 T157	G24-K129 WeakPolarHBondContact O-CE 3.38Å; G24-K129 PolarHBondContact O-NZ 3.03Å; S94-K129 VanDerWaalsContact OG-CD 3.26Å; S94-K129 WeakPolarHBondContact OG-CD 3.4Å; S94-K129 VanDerWaalsContact OG-CE 3.32Å; S94-K129 WeakPolarHBondContact OG-CE 3.27Å; S94-K129 PolarHBondContact OG-NZ 3.33Å; I95-K129 WeakPolarHBondContact CD1-O 3.08Å; I95-K129 WeakPolarHBondContact CG1-O 3.2Å; T96-K129 HydrophobicContact CG2-CB 4.48Å; K129-D131 PolarHBondContact O-N 3.36Å; K129-D131 VanDerWaalsContact O-N 3.08Å; K129-L132 HydrophobicContact CB-CD1 4.09Å; K129-L132 HydrophobicContact CB-CG 4.32Å; K129-L132 HydrophobicContact CD-CD1 4.11Å; K129-L132 WeakPolarHBondContact O-CB 3.48Å; K129-L132 PolarHBondContact O-N 3.21Å; K129-T157 PolarHBondContact N-O 3.02Å
130	S	98.6	Very high	97.9	Very high	28 Å²	28	51.7 Å²	51.7	20%	0.196	25%	0.245	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.7	-12.6	175.6	72.5	0	0	0	0	114	L132 T157	S130-L132 VanDerWaalsContact C-N 3.26Å; S130-T157 WeakPolarHBondContact CB-O 3.26Å; S130-T157 PolarHBondContact N-O 3.26Å; S130-T157 VanDerWaalsContact OG-C 3.29Å; S130-T157 PolarHBondContact OG-O 2.8Å
131	D	98.3	Very high	98.3	Very high	59 Å²	59	52.2 Å²	52.2	32%	0.316	25%	0.25	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.2	-15.1	170	57.3	-73.1	0	0	0	113.6	K129 S158 T161	K129-D131 PolarHBondContact O-N 3.36Å; K129-D131 VanDerWaalsContact O-N 3.08Å; D131-S158 WeakPolarHBondContact CB-OG 3.43Å; D131-S158 VanDerWaalsContact OD1-CB 3.27Å; D131-S158 WeakPolarHBondContact OD1-CB 3.41Å; D131-S158 PolarHBondContact OD1-OG 3.44Å; D131-T161 HydrophobicContact CB-CG2 4.06Å
132	L	97.7	Very high	98.4	Very high	52 Å²	52	54.5 Å²	54.5	27%	0.272	26%	0.26	S	S	.	.			trans	-101.7	44.4	-178.9	-57.2	-177.6	0	0	0	112.2	T96 K129 S130 E134 R135 R136	T96-L132 HydrophobicContact CG2-CB 3.65Å; T96-L132 HydrophobicContact CG2-CD1 4Å; T96-L132 HydrophobicContact CG2-CG 4.47Å; K129-L132 HydrophobicContact CB-CD1 4.09Å; K129-L132 HydrophobicContact CB-CG 4.32Å; K129-L132 HydrophobicContact CD-CD1 4.11Å; K129-L132 WeakPolarHBondContact O-CB 3.48Å; K129-L132 PolarHBondContact O-N 3.21Å; S130-L132 VanDerWaalsContact C-N 3.26Å; L132-E134 VanDerWaalsContact C-N 3.26Å; L132-E134 PolarHBondContact O-N 3.36Å; L132-R135 HydrophobicContact CB-CB 4.45Å; L132-R135 WeakPolarHBondContact O-CA 3.44Å; L132-R135 PolarHBondContact O-N 2.59Å; L132-R136 PolarHBondContact O-N 3.32Å
133	E	98	Very high	98.4	Very high	104 Å²	104	54.5 Å²	54.5	49%	0.486	26%	0.259	S	S	.	.	G	3₁₀ helix	trans	-55.2	-38.4	-174.9	-170	59.7	-150	0	0	113	R135 R136	E133-R135 PolarHBondContact O-N 3.03Å; E133-R135 VanDerWaalsContact O-N 3.1Å; E133-R136 VanDerWaalsContact CD-NE 3.27Å; E133-R136 VanDerWaalsContact O-CB 3.25Å; E133-R136 WeakPolarHBondContact O-CB 3.2Å; E133-R136 PolarHBondContact O-N 2.94Å; E133-R136 VanDerWaalsContact O-N 3.08Å; E133-R136 IonicContact OE1-CZ 3.64Å; E133-R136 IonicContact OE1-NE 2.68Å; E133-R136 PolarHBondContact OE1-NE 3.45Å; E133-R136 IonicContact OE1-NH2 2.81Å; E133-R136 IonicContact OE2-CZ 2.55Å; E133-R136 IonicContact OE2-NE 2.8Å; E133-R136 PolarHBondContact OE2-NE 3.27Å; E133-R136 VanDerWaalsContact OE2-NE 3.1Å; E133-R136 IonicContact OE2-NH2 3.12Å; E133-R136 PolarHBondContact OE2-NH2 3Å
134	E	98	Very high	98.4	Very high	200 Å²	200	58.6 Å²	58.6	94%	0.935	27%	0.274	S	S	*	.	G	3₁₀ helix	trans	-63.2	-17.3	177.1	-61.4	-178.4	174.1	0	0	113.8	L132	L132-E134 VanDerWaalsContact C-N 3.26Å; L132-E134 PolarHBondContact O-N 3.36Å
135	R	98.1	Very high	98.4	Very high	176 Å²	176	62 Å²	62	66%	0.664	30%	0.298	S	S	*	.	G	3₁₀ helix	trans	-109.6	10.9	179.4	-57.9	-177.1	-175.5	178.4	1.4	112.4	T96 L132 E133 Q137	T96-R135 WeakPolarHBondContact CA-O 3.34Å; T96-R135 WeakPolarHBondContact CB-O 3.42Å; T96-R135 HydrophobicContact CG2-CB 3.89Å; L132-R135 HydrophobicContact CB-CB 4.45Å; L132-R135 WeakPolarHBondContact O-CA 3.44Å; L132-R135 PolarHBondContact O-N 2.59Å; E133-R135 PolarHBondContact O-N 3.03Å; E133-R135 VanDerWaalsContact O-N 3.1Å; R135-Q137 PolarHBondContact O-N 2.89Å
136	R	98.6	Very high	98.4	Very high	49 Å²	49	64.8 Å²	64.8	19%	0.185	31%	0.31	C	S	.	.			trans	-59.4	126.6	180	179.1	-179.6	-69.3	-82.7	3.5	110.6	I95 L132 E133 V138 E156	I95-R136 HydrophobicContact CD1-CB 4.39Å; I95-R136 HydrophobicContact CD1-CG 4.5Å; L132-R136 PolarHBondContact O-N 3.32Å; E133-R136 VanDerWaalsContact CD-NE 3.27Å; E133-R136 VanDerWaalsContact O-CB 3.25Å; E133-R136 WeakPolarHBondContact O-CB 3.2Å; E133-R136 PolarHBondContact O-N 2.94Å; E133-R136 VanDerWaalsContact O-N 3.08Å; E133-R136 IonicContact OE1-CZ 3.64Å; E133-R136 IonicContact OE1-NE 2.68Å; E133-R136 PolarHBondContact OE1-NE 3.45Å; E133-R136 IonicContact OE1-NH2 2.81Å; E133-R136 IonicContact OE2-CZ 2.55Å; E133-R136 IonicContact OE2-NE 2.8Å; E133-R136 PolarHBondContact OE2-NE 3.27Å; E133-R136 VanDerWaalsContact OE2-NE 3.1Å; E133-R136 IonicContact OE2-NH2 3.12Å; E133-R136 PolarHBondContact OE2-NH2 3Å; R136-V138 WeakPolarHBondContact CD-O 3.37Å; R136-V138 WeakPolarHBondContact CG-O 3.36Å; R136-V138 PolarHBondContact NH1-O 2.76Å; R136-E156 IonicContact CZ-OE1 3.77Å; R136-E156 IonicContact CZ-OE2 2.79Å; R136-E156 IonicContact NH1-OE1 3.89Å; R136-E156 PolarHBondContact NH1-OE1 2.77Å; R136-E156 VanDerWaalsContact NH2-CD 3.29Å; R136-E156 IonicContact NH2-OE1 3.33Å; R136-E156 PolarHBondContact NH2-OE1 2.72Å; R136-E156 IonicContact NH2-OE2 3.82Å; R136-E156 PolarHBondContact NH2-OE2 3.46Å
137	Q	98.7	Very high	98.4	Very high	105 Å²	105	64.9 Å²	64.9	49%	0.491	31%	0.311	S	S	.	.			trans	-110.7	-21.2	172.2	-62.8	-175.9	0.8	0	0	112.2	I95 T96 H98 R135 P139	I95-Q137 PolarHBondContact O-N 3.41Å; T96-Q137 PolarHBondContact O-NE2 2.97Å; T96-Q137 PolarHBondContact O-OE1 3.03Å; H98-Q137 HydrophobicContact CB-CB 4.3Å; H98-Q137 VanDerWaalsContact N-OE1 3.12Å; R135-Q137 PolarHBondContact O-N 2.89Å; Q137-P139 WeakPolarHBondContact O-CD 3.47Å
138	V	98.6	Very high	98.3	Very high	0 Å²	0	71.3 Å²	71.3	0%	0	34%	0.341	C	S	.	.	S	Bend	trans	-106.2	109.4	178.4	-174.4	0	0	0	0	109.4	F93 I95 H98 F101 R136 A143	F93-V138 HydrophobicContact CD2-CG2 4.4Å; F93-V138 HydrophobicContact CE2-CB 4.04Å; F93-V138 HydrophobicContact CE2-CG1 3.87Å; F93-V138 HydrophobicContact CE2-CG2 4.12Å; F93-V138 HydrophobicContact CZ-CG1 4.33Å; I95-V138 PolarHBondContact O-N 2.85Å; H98-V138 HydrophobicContact CB-CG2 4.41Å; F101-V138 HydrophobicContact CB-CG1 4.23Å; F101-V138 HydrophobicContact CB-CG2 3.68Å; F101-V138 HydrophobicContact CD1-CG1 3.96Å; F101-V138 HydrophobicContact CD2-CG1 4.11Å; F101-V138 HydrophobicContact CE1-CG1 4.35Å; F101-V138 HydrophobicContact CE2-CG1 4.48Å; F101-V138 HydrophobicContact CG-CG1 3.83Å; F101-V138 HydrophobicContact CG-CG2 4.19Å; R136-V138 WeakPolarHBondContact CD-O 3.37Å; R136-V138 WeakPolarHBondContact CG-O 3.36Å; R136-V138 PolarHBondContact NH1-O 2.76Å; V138-A143 HydrophobicContact CG1-CB 4.19Å
139	P	98.3	Very high	98.3	Very high	66 Å²	66	77.2 Å²	77.2	43%	0.429	37%	0.368	S	S	.	.			trans	-58.8	139.4	172.9	-23.2	34	0	0	0	112	Q137 E141 E142 A143	Q137-P139 WeakPolarHBondContact O-CD 3.47Å; P139-E141 PolarHBondContact O-N 3.5Å; P139-E142 HydrophobicContact CB-CB 4.27Å; P139-E142 WeakPolarHBondContact CD-OE2 3.32Å; P139-E142 WeakPolarHBondContact O-CB 3.46Å; P139-E142 PolarHBondContact O-N 3.39Å; P139-E142 VanDerWaalsContact O-N 3.08Å; P139-A143 PolarHBondContact O-N 2.88Å
140	V	98.4	Very high	98.2	Very high	40 Å²	40	76 Å²	76	24%	0.242	36%	0.363	C	S	.	.	H	α-helix	trans	-54.8	-40.8	179.1	178.6	0	0	0	0	111.7	A143 R144 Y154	V140-A143 PolarHBondContact O-N 3.1Å; V140-R144 WeakPolarHBondContact O-CB 3.28Å; V140-R144 PolarHBondContact O-N 3.44Å; V140-Y154 HydrophobicContact CG1-CE1 4.16Å
141	E	98.1	Very high	98.1	Very high	119 Å²	119	78 Å²	78	56%	0.556	39%	0.388	S	S	*	.	H	α-helix	trans	-69.5	-32.1	-178.8	-59.3	-51.7	139.3	0	0	112.8	P139 R144 S145	P139-E141 PolarHBondContact O-N 3.5Å; E141-R144 VanDerWaalsContact CD-NH1 3.35Å; E141-R144 IonicContact OE1-CZ 2.95Å; E141-R144 IonicContact OE1-NH1 3.92Å; E141-R144 PolarHBondContact OE1-NH1 2.8Å; E141-R144 IonicContact OE2-NH1 3.77Å; E141-R144 PolarHBondContact OE2-NH1 3.2Å; E141-R144 VanDerWaalsContact OE2-NH1 3.12Å; E141-S145 WeakPolarHBondContact O-CB 3.49Å; E141-S145 PolarHBondContact O-N 3.49Å
142	E	98.3	Very high	98.1	Very high	76 Å²	76	76.5 Å²	76.5	36%	0.355	38%	0.38	S	S	.	.	H	α-helix	trans	-64.7	-49	174.4	-175.2	-178.5	164.2	0	0	110.2	H98 F101 P139 S145 K146	H98-E142 IonicContact CE1-OE1 2.77Å; H98-E142 IonicContact NE2-OE1 3.2Å; H98-E142 PolarHBondContact NE2-OE1 2.73Å; H98-E142 IonicContact NE2-OE2 2.81Å; F101-E142 HydrophobicContact CE1-CG 3.8Å; F101-E142 WeakPolarHBondContact CE1-OE1 3.49Å; F101-E142 HydrophobicContact CZ-CG 4.23Å; P139-E142 HydrophobicContact CB-CB 4.27Å; P139-E142 WeakPolarHBondContact CD-OE2 3.32Å; P139-E142 WeakPolarHBondContact O-CB 3.46Å; P139-E142 PolarHBondContact O-N 3.39Å; P139-E142 VanDerWaalsContact O-N 3.08Å; E142-S145 PolarHBondContact O-N 2.8Å; E142-K146 WeakPolarHBondContact O-CB 3.38Å; E142-K146 PolarHBondContact O-N 3.05Å
143	A	98.5	Very high	98.1	Very high	0 Å²	0	78.1 Å²	78.1	0%	0	39%	0.386	C	S	.	.	H	α-helix	trans	-65.7	-40.9	178.6	0	0	0	0	0	112.7	F93 F101 V138 P139 V140 K146 A147 Y154	F93-A143 HydrophobicContact CE1-CB 4.42Å; F93-A143 HydrophobicContact CZ-CB 3.79Å; F101-A143 HydrophobicContact CE2-CB 3.86Å; F101-A143 HydrophobicContact CZ-CB 4.31Å; V138-A143 HydrophobicContact CG1-CB 4.19Å; P139-A143 PolarHBondContact O-N 2.88Å; V140-A143 PolarHBondContact O-N 3.1Å; A143-K146 PolarHBondContact O-N 2.88Å; A143-A147 WeakPolarHBondContact O-CB 3.38Å; A143-A147 PolarHBondContact O-N 2.91Å; A143-Y154 HydrophobicContact CB-CD1 4.25Å; A143-Y154 HydrophobicContact CB-CD2 4.3Å; A143-Y154 HydrophobicContact CB-CE1 3.69Å; A143-Y154 HydrophobicContact CB-CE2 3.77Å; A143-Y154 VanDerWaalsContact CB-CZ 3.41Å
144	R	98.5	Very high	98.1	Very high	100 Å²	100	74.8 Å²	74.8	38%	0.377	37%	0.37	S	S	.	.	H	α-helix	trans	-64.6	-48.5	176.3	-173.2	-178.1	-67	138.1	2	111.5	V140 E141 K146 A147 E148 Y154	V140-R144 WeakPolarHBondContact O-CB 3.28Å; V140-R144 PolarHBondContact O-N 3.44Å; E141-R144 VanDerWaalsContact CD-NH1 3.35Å; E141-R144 IonicContact OE1-CZ 2.95Å; E141-R144 IonicContact OE1-NH1 3.92Å; E141-R144 PolarHBondContact OE1-NH1 2.8Å; E141-R144 IonicContact OE2-NH1 3.77Å; E141-R144 PolarHBondContact OE2-NH1 3.2Å; E141-R144 VanDerWaalsContact OE2-NH1 3.12Å; R144-K146 PolarHBondContact O-N 2.79Å; R144-A147 PolarHBondContact O-N 2.95Å; R144-A147 VanDerWaalsContact O-N 3.16Å; R144-E148 WeakPolarHBondContact O-CG 3.19Å; R144-E148 PolarHBondContact O-N 2.85Å; R144-Y154 HydrophobicContact CB-CD1 4.03Å
145	S	98.5	Very high	98.1	Very high	73 Å²	73	65.7 Å²	65.7	51%	0.51	33%	0.328	S	S	.	.	H	α-helix	trans	-59.1	-38	178.3	-177.8	0	0	0	0	111.5	E141 E142 E148 E149	E141-S145 WeakPolarHBondContact O-CB 3.49Å; E141-S145 PolarHBondContact O-N 3.49Å; E142-S145 PolarHBondContact O-N 2.8Å; S145-E148 PolarHBondContact O-N 2.95Å; S145-E149 PolarHBondContact O-N 2.85Å
146	K	98.2	Very high	98.2	Very high	59 Å²	59	59.1 Å²	59.1	26%	0.257	31%	0.305	S	S	.	.	H	α-helix	trans	-69.1	-40.1	177.1	-164.1	69.1	-173.9	165.8	0	112.8	F101 E142 A143 R144 E149 W150	F101-K146 HydrophobicContact CE2-CB 4.42Å; F101-K146 HydrophobicContact CZ-CB 3.84Å; F101-K146 HydrophobicContact CZ-CG 4.14Å; E142-K146 WeakPolarHBondContact O-CB 3.38Å; E142-K146 PolarHBondContact O-N 3.05Å; A143-K146 PolarHBondContact O-N 2.88Å; R144-K146 PolarHBondContact O-N 2.79Å; K146-E149 WeakPolarHBondContact CD-OE2 3.27Å; K146-E149 IonicContact NZ-OE1 3.03Å; K146-E149 PolarHBondContact NZ-OE1 2.97Å; K146-E149 IonicContact NZ-OE2 3.7Å; K146-E149 PolarHBondContact NZ-OE2 2.93Å; K146-E149 WeakPolarHBondContact O-CB 3.48Å; K146-E149 PolarHBondContact O-N 3.23Å; K146-W150 HydrophobicContact CD-CZ2 4.15Å; K146-W150 HydrophobicContact CG-CD2 4.29Å; K146-W150 HydrophobicContact CG-CE3 4.4Å; K146-W150 HydrophobicContact CG-CH2 3.93Å; K146-W150 HydrophobicContact CG-CZ2 3.8Å; K146-W150 HydrophobicContact CG-CZ3 4.23Å; K146-W150 PolarHBondContact O-N 3.19Å; K146-W150 VanDerWaalsContact O-N 3.15Å
147	A	98.3	Very high	98.2	Very high	2 Å²	2	56.8 Å²	56.8	2%	0.017	30%	0.296	C	S	.	.	H	α-helix	trans	-65.2	-39.1	175.3	0	0	0	0	0	112.1	V125 A143 R144 W150 G151 V152	V125-A147 HydrophobicContact CB-CB 4.36Å; V125-A147 HydrophobicContact CG2-CB 4.34Å; A143-A147 WeakPolarHBondContact O-CB 3.38Å; A143-A147 PolarHBondContact O-N 2.91Å; R144-A147 PolarHBondContact O-N 2.95Å; R144-A147 VanDerWaalsContact O-N 3.16Å; A147-W150 CarbonylContact O-C 3.52Å; A147-W150 PolarHBondContact O-N 3.04Å; A147-G151 PolarHBondContact O-N 2.95Å; A147-V152 CarbonylContact C-O 3.58Å; A147-V152 HydrophobicContact CB-CG2 4.07Å; A147-V152 WeakPolarHBondContact CB-O 3.33Å; A147-V152 PolarHBondContact O-N 3.03Å; A147-V152 VanDerWaalsContact O-O 3.1Å
148	E	97.9	Very high	98.2	Very high	135 Å²	135	51.8 Å²	51.8	63%	0.631	27%	0.272	S	S	*	.	H	α-helix	trans	-62.5	-45.1	173.3	-74.3	176.8	-168.7	0	0	112.2	R144 S145 W150 G151	R144-E148 WeakPolarHBondContact O-CG 3.19Å; R144-E148 PolarHBondContact O-N 2.85Å; S145-E148 PolarHBondContact O-N 2.95Å; E148-W150 PolarHBondContact O-N 3.3Å; E148-G151 PolarHBondContact O-N 3.22Å
149	E	97.8	Very high	98.2	Very high	128 Å²	128	52 Å²	52	60%	0.598	27%	0.274	S	S	*	.	H	α-helix	trans	-54.1	-38.2	173.1	-176.1	-161.8	131.8	0	0	111.5	S145 K146	S145-E149 PolarHBondContact O-N 2.85Å; K146-E149 WeakPolarHBondContact CD-OE2 3.27Å; K146-E149 IonicContact NZ-OE1 3.03Å; K146-E149 PolarHBondContact NZ-OE1 2.97Å; K146-E149 IonicContact NZ-OE2 3.7Å; K146-E149 PolarHBondContact NZ-OE2 2.93Å; K146-E149 WeakPolarHBondContact O-CB 3.48Å; K146-E149 PolarHBondContact O-N 3.23Å
150	W	97.1	Very high	98.1	Very high	26 Å²	26	53.7 Å²	53.7	10%	0.098	28%	0.275	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.9	-7.2	179.7	-68	-13	0	0	0	114.8	L91 T104 A105 R108 V125 K146 A147 E148 V152	L91-W150 HydrophobicContact CD2-CZ3 4.05Å; T104-W150 WeakPolarHBondContact OG1-CH2 3.4Å; A105-W150 HydrophobicContact CB-CH2 4.31Å; A105-W150 HydrophobicContact CB-CZ2 3.94Å; R108-W150 VanDerWaalsContact CD-CE2 3.43Å; R108-W150 VanDerWaalsContact CZ-CD1 3.41Å; V125-W150 HydrophobicContact CG2-CE3 3.93Å; V125-W150 HydrophobicContact CG2-CZ3 3.99Å; K146-W150 HydrophobicContact CD-CZ2 4.15Å; K146-W150 HydrophobicContact CG-CD2 4.29Å; K146-W150 HydrophobicContact CG-CE3 4.4Å; K146-W150 HydrophobicContact CG-CH2 3.93Å; K146-W150 HydrophobicContact CG-CZ2 3.8Å; K146-W150 HydrophobicContact CG-CZ3 4.23Å; K146-W150 PolarHBondContact O-N 3.19Å; K146-W150 VanDerWaalsContact O-N 3.15Å; A147-W150 CarbonylContact O-C 3.52Å; A147-W150 PolarHBondContact O-N 3.04Å; E148-W150 PolarHBondContact O-N 3.3Å; W150-V152 HydrophobicContact CB-CG2 3.93Å; W150-V152 HydrophobicContact CE3-CG2 4.47Å
151	G	97	Very high	98.1	Very high	70 Å²	70	56 Å²	56	72%	0.722	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.1	30.7	-176.7	0	0	0	0	0	113.9	A147 E148	A147-G151 PolarHBondContact O-N 2.95Å; E148-G151 PolarHBondContact O-N 3.22Å
152	V	97.7	Very high	98.1	Very high	26 Å²	26	53.3 Å²	53.3	16%	0.158	27%	0.273	C	S	.	.			trans	-124.4	158.5	-178.8	-61.5	0	0	0	0	111.3	L123 V125 A147 W150	L123-V152 HydrophobicContact CB-CG1 3.99Å; L123-V152 HydrophobicContact CD2-CG1 4.03Å; L123-V152 HydrophobicContact CG-CG1 4.11Å; V125-V152 HydrophobicContact CG2-CG2 3.61Å; A147-V152 CarbonylContact C-O 3.58Å; A147-V152 HydrophobicContact CB-CG2 4.07Å; A147-V152 WeakPolarHBondContact CB-O 3.33Å; A147-V152 PolarHBondContact O-N 3.03Å; A147-V152 VanDerWaalsContact O-O 3.1Å; W150-V152 HydrophobicContact CB-CG2 3.93Å; W150-V152 HydrophobicContact CE3-CG2 4.47Å
153	Q	97.3	Very high	98.1	Very high	86 Å²	86	51.4 Å²	51.4	40%	0.402	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81	148.5	176.6	-40	176.9	12.3	0	0	110.6	L124 V125	L124-Q153 HydrophobicContact CD1-CB 3.61Å; L124-Q153 HydrophobicContact CD1-CG 4.06Å; V125-Q153 PolarHBondContact N-O 2.86Å
154	Y	98.7	Very high	98.1	Very high	35 Å²	35	55 Å²	55	14%	0.137	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	133.8	171.3	171.1	-127.8	0	0	0	110.5	F93 V125 V140 A143 R144 E156	F93-Y154 HydrophobicContact CE1-CD2 4.48Å; F93-Y154 AromaticContact CE1-CE2 3.82Å; F93-Y154 HydrophobicContact CE1-CE2 3.82Å; F93-Y154 AromaticContact CZ-CE2 3.78Å; F93-Y154 HydrophobicContact CZ-CE2 3.78Å; V125-Y154 HydrophobicContact CB-CD2 4.38Å; V125-Y154 HydrophobicContact CG1-CD2 3.96Å; V125-Y154 WeakPolarHBondContact O-CA 3.25Å; V140-Y154 HydrophobicContact CG1-CE1 4.16Å; A143-Y154 HydrophobicContact CB-CD1 4.25Å; A143-Y154 HydrophobicContact CB-CD2 4.3Å; A143-Y154 HydrophobicContact CB-CE1 3.69Å; A143-Y154 HydrophobicContact CB-CE2 3.77Å; A143-Y154 VanDerWaalsContact CB-CZ 3.41Å; R144-Y154 HydrophobicContact CB-CD1 4.03Å; Y154-E156 HydrophobicContact CE1-CG 4.07Å; Y154-E156 HydrophobicContact CE2-CG 4.19Å; Y154-E156 WeakPolarHBondContact OH-CG 3.23Å; Y154-E156 PolarHBondContact OH-OE1 3.2Å
155	V	98.8	Very high	98.1	Very high	9 Å²	9	50.3 Å²	50.3	6%	0.055	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	132.7	176.3	-176.4	0	0	0	0	109.4	L124 V125 V126 G127 T157 N164 K167 V168	L124-V155 HydrophobicContact CD2-CG2 4.18Å; V125-V155 PolarHBondContact O-N 2.82Å; V126-V155 VanDerWaalsContact CA-O 3.31Å; V126-V155 WeakPolarHBondContact CA-O 3.41Å; G127-V155 PolarHBondContact N-O 2.81Å; V155-T157 HydrophobicContact CG1-CG2 4.4Å; V155-N164 HydrophobicContact CG1-CB 3.79Å; V155-K167 HydrophobicContact CG1-CD 4.14Å; V155-V168 HydrophobicContact CB-CG1 3.71Å; V155-V168 HydrophobicContact CG1-CG1 3.64Å; V155-V168 HydrophobicContact CG2-CG1 4.25Å
156	E	98.9	Very high	98.1	Very high	38 Å²	38	49.5 Å²	49.5	18%	0.178	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	138.8	168.5	-66.4	-161.8	149.2	0	0	111.5	G127 R136 Y154 N164	G127-E156 CarbonylContact O-C 3.52Å; G127-E156 WeakPolarHBondContact O-CA 3.48Å; R136-E156 IonicContact CZ-OE1 3.77Å; R136-E156 IonicContact CZ-OE2 2.79Å; R136-E156 IonicContact NH1-OE1 3.89Å; R136-E156 PolarHBondContact NH1-OE1 2.77Å; R136-E156 VanDerWaalsContact NH2-CD 3.29Å; R136-E156 IonicContact NH2-OE1 3.33Å; R136-E156 PolarHBondContact NH2-OE1 2.72Å; R136-E156 IonicContact NH2-OE2 3.82Å; R136-E156 PolarHBondContact NH2-OE2 3.46Å; Y154-E156 HydrophobicContact CE1-CG 4.07Å; Y154-E156 HydrophobicContact CE2-CG 4.19Å; Y154-E156 WeakPolarHBondContact OH-CG 3.23Å; Y154-E156 PolarHBondContact OH-OE1 3.2Å; E156-N164 VanDerWaalsContact O-CB 3.3Å; E156-N164 WeakPolarHBondContact O-CB 3.1Å; E156-N164 PolarHBondContact O-ND2 3.37Å
157	T	98.9	Very high	98.1	Very high	0 Å²	0	50.5 Å²	50.5	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	156.5	-178.8	60.7	0	0	0	0	111.7	V126 G127 N128 K129 S130 V155 A163 N164 V168	V126-T157 HydrophobicContact CG1-CG2 3.63Å; V126-T157 WeakPolarHBondContact CG1-OG1 3.34Å; G127-T157 PolarHBondContact O-N 2.97Å; N128-T157 CarbonylContact C-O 3.43Å; N128-T157 VanDerWaalsContact CA-O 3.32Å; N128-T157 WeakPolarHBondContact CA-O 3.3Å; N128-T157 WeakPolarHBondContact CA-OG1 3.29Å; N128-T157 PolarHBondContact OD1-O 2.58Å; N128-T157 PolarHBondContact OD1-OG1 3.3Å; K129-T157 PolarHBondContact N-O 3.02Å; S130-T157 WeakPolarHBondContact CB-O 3.26Å; S130-T157 PolarHBondContact N-O 3.26Å; S130-T157 VanDerWaalsContact OG-C 3.29Å; S130-T157 PolarHBondContact OG-O 2.8Å; V155-T157 HydrophobicContact CG1-CG2 4.4Å; T157-A163 VanDerWaalsContact CA-O 3.28Å; T157-A163 WeakPolarHBondContact CA-O 3.15Å; T157-N164 HydrophobicContact CG2-CB 3.95Å; T157-V168 HydrophobicContact CG2-CG1 3.61Å; T157-V168 HydrophobicContact CG2-CG2 4.12Å
158	S	98.6	Very high	98.1	Very high	0 Å²	0	50.4 Å²	50.4	0%	0	27%	0.265	C	S	.	.			trans	-127.3	111.8	162.2	172.4	0	0	0	0	108.8	D131 K160 T161 R162 A163	D131-S158 WeakPolarHBondContact CB-OG 3.43Å; D131-S158 VanDerWaalsContact OD1-CB 3.27Å; D131-S158 WeakPolarHBondContact OD1-CB 3.41Å; D131-S158 PolarHBondContact OD1-OG 3.44Å; S158-K160 PolarHBondContact O-N 2.93Å; S158-K160 PolarHBondContact OG-N 3.29Å; S158-T161 WeakPolarHBondContact CB-OG1 3.47Å; S158-T161 PolarHBondContact OG-N 2.99Å; S158-T161 PolarHBondContact OG-OG1 3.5Å; S158-R162 CarbonylContact O-C 3.54Å; S158-R162 VanDerWaalsContact O-CA 3.25Å; S158-R162 WeakPolarHBondContact O-CA 3.2Å; S158-R162 PolarHBondContact O-N 2.97Å; S158-A163 PolarHBondContact N-O 2.93Å; S158-A163 PolarHBondContact O-N 2.77Å
159	A	97.9	Very high	98.2	Very high	3 Å²	3	44 Å²	44	3%	0.025	24%	0.235	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.9	-28.9	169.3	0	0	0	0	0	111.7	A29 L30 Q33 F39 N128	A29-A159 HydrophobicContact CB-CB 3.64Å; L30-A159 HydrophobicContact CD2-CB 3.94Å; L30-A159 HydrophobicContact CG-CB 4.22Å; Q33-A159 PolarHBondContact NE2-O 3.27Å; F39-A159 HydrophobicContact CD2-CB 4.12Å; F39-A159 WeakPolarHBondContact CD2-O 3.46Å; F39-A159 HydrophobicContact CE2-CB 4.08Å; N128-A159 PolarHBondContact OD1-N 3.3Å
160	K	97.3	Very high	98.2	Very high	103 Å²	103	39.8 Å²	39.8	45%	0.448	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.8	-48	179.8	-176.5	170	-173.3	161.8	0	112.9	F39 E41 S158	F39-K160 HydrophobicContact CD1-CB 4.2Å; F39-K160 HydrophobicContact CD1-CG 3.98Å; F39-K160 HydrophobicContact CD2-CB 4.37Å; F39-K160 HydrophobicContact CE1-CB 3.78Å; F39-K160 HydrophobicContact CE1-CD 3.99Å; F39-K160 HydrophobicContact CE1-CG 3.62Å; F39-K160 HydrophobicContact CE2-CB 4Å; F39-K160 HydrophobicContact CG-CB 4.46Å; F39-K160 HydrophobicContact CZ-CB 3.7Å; F39-K160 HydrophobicContact CZ-CD 4.38Å; F39-K160 HydrophobicContact CZ-CG 4.06Å; E41-K160 IonicContact OE1-NZ 2.78Å; S158-K160 PolarHBondContact O-N 2.93Å; S158-K160 PolarHBondContact OG-N 3.29Å
161	T	97.4	Very high	98.3	Very high	87 Å²	87	39.7 Å²	39.7	53%	0.534	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.8	0.2	-176.6	67.8	0	0	0	0	113.4	D131 S158 A163	D131-T161 HydrophobicContact CB-CG2 4.06Å; S158-T161 WeakPolarHBondContact CB-OG1 3.47Å; S158-T161 PolarHBondContact OG-N 2.99Å; S158-T161 PolarHBondContact OG-OG1 3.5Å; T161-A163 PolarHBondContact O-N 3.02Å; T161-A163 WeakPolarHBondContact OG1-CB 3.47Å; T161-A163 PolarHBondContact OG1-N 2.83Å
162	R	97.9	Very high	98.4	Very high	64 Å²	64	36.4 Å²	36.4	24%	0.242	18%	0.183	C	C	.	.			trans	63.5	9.5	-170.6	-154.8	-167	178.3	85.4	-3.8	114.3	Q33 D37 S158 N164 V165 D166	Q33-R162 HydrophobicContact CG-CB 4.28Å; Q33-R162 HydrophobicContact CG-CG 3.85Å; Q33-R162 PolarHBondContact O-NH1 2.87Å; D37-R162 IonicContact OD1-CZ 3.11Å; D37-R162 IonicContact OD1-NH1 2.68Å; D37-R162 PolarHBondContact OD1-NH1 3.23Å; D37-R162 IonicContact OD1-NH2 3.99Å; D37-R162 PolarHBondContact OD1-NH2 2.67Å; S158-R162 CarbonylContact O-C 3.54Å; S158-R162 VanDerWaalsContact O-CA 3.25Å; S158-R162 WeakPolarHBondContact O-CA 3.2Å; S158-R162 PolarHBondContact O-N 2.97Å; R162-N164 PolarHBondContact O-N 3.38Å; R162-N164 VanDerWaalsContact O-N 3.12Å; R162-V165 HydrophobicContact CG-CB 4.11Å; R162-V165 HydrophobicContact CG-CG2 4.3Å; R162-V165 PolarHBondContact O-N 3.3Å; R162-D166 IonicContact CZ-OD1 3.69Å; R162-D166 IonicContact CZ-OD2 3.66Å; R162-D166 IonicContact NE-OD1 2.79Å; R162-D166 IonicContact NE-OD2 2.88Å; R162-D166 PolarHBondContact NE-OD2 3.04Å; R162-D166 IonicContact NH2-OD1 3.1Å; R162-D166 PolarHBondContact NH2-OD1 3.33Å; R162-D166 IonicContact NH2-OD2 2.73Å; R162-D166 PolarHBondContact NH2-OD2 3.28Å
163	A	98.7	Very high	98.4	Very high	35 Å²	35	35.2 Å²	35.2	29%	0.289	18%	0.175	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.1	122.9	179.6	0	0	0	0	0	110.6	T157 S158 T161 V165	T157-A163 VanDerWaalsContact CA-O 3.28Å; T157-A163 WeakPolarHBondContact CA-O 3.15Å; S158-A163 PolarHBondContact N-O 2.93Å; S158-A163 PolarHBondContact O-N 2.77Å; T161-A163 PolarHBondContact O-N 3.02Å; T161-A163 WeakPolarHBondContact OG1-CB 3.47Å; T161-A163 PolarHBondContact OG1-N 2.83Å; A163-V165 PolarHBondContact O-N 2.95Å
164	N	98.7	Very high	98.4	Very high	77 Å²	77	35 Å²	35	41%	0.412	17%	0.171	S	C	.	.	T	Hydrogen-bonded Turn	trans	56.9	12.2	179.2	-63.2	-38.7	0	0	0	116.5	V155 E156 T157 R162 K167 V168	V155-N164 HydrophobicContact CG1-CB 3.79Å; E156-N164 VanDerWaalsContact O-CB 3.3Å; E156-N164 WeakPolarHBondContact O-CB 3.1Å; E156-N164 PolarHBondContact O-ND2 3.37Å; T157-N164 HydrophobicContact CG2-CB 3.95Å; R162-N164 PolarHBondContact O-N 3.38Å; R162-N164 VanDerWaalsContact O-N 3.12Å; N164-K167 HydrophobicContact CB-CB 4.19Å; N164-K167 HydrophobicContact CB-CD 4.41Å; N164-K167 WeakPolarHBondContact O-CB 3.39Å; N164-K167 PolarHBondContact O-N 3.43Å; N164-V168 PolarHBondContact O-N 3.44Å; N164-V168 VanDerWaalsContact O-N 3.15Å
165	V	98.7	Very high	98.4	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-62.8	-52.7	-180	175.8	0	0	0	0	110.6	L30 Q33 F34 R162 A163 K167 V168 F169	L30-V165 HydrophobicContact CD2-CG1 4.46Å; L30-V165 HydrophobicContact CD2-CG2 3.76Å; Q33-V165 HydrophobicContact CB-CG1 4.23Å; Q33-V165 HydrophobicContact CG-CB 4.34Å; Q33-V165 HydrophobicContact CG-CG1 4Å; Q33-V165 HydrophobicContact CG-CG2 4.04Å; F34-V165 HydrophobicContact CB-CG1 3.91Å; R162-V165 HydrophobicContact CG-CB 4.11Å; R162-V165 HydrophobicContact CG-CG2 4.3Å; R162-V165 PolarHBondContact O-N 3.3Å; A163-V165 PolarHBondContact O-N 2.95Å; V165-K167 VanDerWaalsContact C-N 3.27Å; V165-K167 PolarHBondContact O-N 3.18Å; V165-V168 WeakPolarHBondContact O-CG2 3.46Å; V165-V168 PolarHBondContact O-N 2.92Å; V165-F169 HydrophobicContact CG1-CD2 4.38Å; V165-F169 HydrophobicContact CG1-CE2 4.23Å; V165-F169 VanDerWaalsContact O-CD2 3.28Å; V165-F169 WeakPolarHBondContact O-CD2 3.42Å
166	D	98.4	Very high	98.3	Very high	56 Å²	56	35.1 Å²	35.1	30%	0.299	17%	0.172	S	C	.	.	H	α-helix	trans	-60.7	-40.5	176.3	-62.6	-54.1	0	0	0	110.9	F34 R162 V168 F169 F170	F34-D166 WeakPolarHBondContact CD2-OD1 3.39Å; R162-D166 IonicContact CZ-OD1 3.69Å; R162-D166 IonicContact CZ-OD2 3.66Å; R162-D166 IonicContact NE-OD1 2.79Å; R162-D166 IonicContact NE-OD2 2.88Å; R162-D166 PolarHBondContact NE-OD2 3.04Å; R162-D166 IonicContact NH2-OD1 3.1Å; R162-D166 PolarHBondContact NH2-OD1 3.33Å; R162-D166 IonicContact NH2-OD2 2.73Å; R162-D166 PolarHBondContact NH2-OD2 3.28Å; D166-V168 PolarHBondContact O-N 3.45Å; D166-F169 PolarHBondContact O-N 2.91Å; D166-F170 HydrophobicContact CB-CD2 4.12Å; D166-F170 HydrophobicContact CB-CE2 4.35Å; D166-F170 WeakPolarHBondContact O-CB 3.37Å; D166-F170 VanDerWaalsContact O-CD2 3.24Å; D166-F170 WeakPolarHBondContact O-CD2 3.49Å; D166-F170 PolarHBondContact O-N 3.2Å
167	K	98.6	Very high	98.2	Very high	80 Å²	80	35.7 Å²	35.7	35%	0.348	17%	0.173	S	C	.	.	H	α-helix	trans	-53.5	-50.6	-178.4	-176.4	-176.1	-175.4	-57.1	0	111.9	V155 N164 V165 F169 F170 D171	V155-K167 HydrophobicContact CG1-CD 4.14Å; N164-K167 HydrophobicContact CB-CB 4.19Å; N164-K167 HydrophobicContact CB-CD 4.41Å; N164-K167 WeakPolarHBondContact O-CB 3.39Å; N164-K167 PolarHBondContact O-N 3.43Å; V165-K167 VanDerWaalsContact C-N 3.27Å; V165-K167 PolarHBondContact O-N 3.18Å; K167-F169 PolarHBondContact O-N 2.97Å; K167-F170 PolarHBondContact O-N 3.31Å; K167-D171 VanDerWaalsContact CG-OD2 3.28Å; K167-D171 WeakPolarHBondContact CG-OD2 3.44Å; K167-D171 IonicContact NZ-OD2 3.06Å; K167-D171 PolarHBondContact NZ-OD2 3.23Å; K167-D171 VanDerWaalsContact O-CB 3.25Å; K167-D171 WeakPolarHBondContact O-CB 3.25Å; K167-D171 PolarHBondContact O-N 3.42Å
168	V	98.8	Very high	98	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-65.8	-39.2	-175.9	-64.6	0	0	0	0	112.7	L90 L124 V126 V155 T157 N164 V165 D166 L172	L90-V168 HydrophobicContact CD1-CB 4.39Å; L90-V168 HydrophobicContact CD1-CG2 4.09Å; L90-V168 HydrophobicContact CD2-CB 4.19Å; L124-V168 HydrophobicContact CD2-CB 3.82Å; L124-V168 HydrophobicContact CD2-CG1 3.85Å; V126-V168 HydrophobicContact CG1-CG1 4.3Å; V126-V168 HydrophobicContact CG2-CB 4.2Å; V126-V168 HydrophobicContact CG2-CG1 3.93Å; V155-V168 HydrophobicContact CB-CG1 3.71Å; V155-V168 HydrophobicContact CG1-CG1 3.64Å; V155-V168 HydrophobicContact CG2-CG1 4.25Å; T157-V168 HydrophobicContact CG2-CG1 3.61Å; T157-V168 HydrophobicContact CG2-CG2 4.12Å; N164-V168 PolarHBondContact O-N 3.44Å; N164-V168 VanDerWaalsContact O-N 3.15Å; V165-V168 WeakPolarHBondContact O-CG2 3.46Å; V165-V168 PolarHBondContact O-N 2.92Å; D166-V168 PolarHBondContact O-N 3.45Å; V168-L172 WeakPolarHBondContact O-CB 3.36Å; V168-L172 PolarHBondContact O-N 3.06Å; V168-L172 VanDerWaalsContact O-N 3.12Å
169	F	98.7	Very high	97.9	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-69.5	-45	177.1	-74	-74	0	0	0	111.8	V17 M19 L30 F34 I64 I66 L90 V165 D166 K167 M173	V17-F169 HydrophobicContact CG1-CD1 4.46Å; V17-F169 HydrophobicContact CG1-CE1 4.38Å; M19-F169 HydrophobicContact CE-CE1 4.43Å; M19-F169 HydrophobicContact CE-CZ 3.97Å; M19-F169 HydrophobicContact SD-CE1 3.78Å; M19-F169 HydrophobicContact SD-CZ 3.9Å; L30-F169 HydrophobicContact CB-CE2 4.49Å; F34-F169 HydrophobicContact CB-CD2 3.57Å; F34-F169 HydrophobicContact CB-CE2 3.44Å; F34-F169 VanDerWaalsContact CB-CE2 3.44Å; F34-F169 HydrophobicContact CB-CG 4.44Å; F34-F169 HydrophobicContact CB-CZ 4.21Å; F34-F169 HydrophobicContact CD1-CB 4.47Å; F34-F169 HydrophobicContact CD1-CD1 4.33Å; F34-F169 AromaticContact CD1-CD2 3.98Å; F34-F169 HydrophobicContact CD1-CD2 3.98Å; F34-F169 HydrophobicContact CD1-CE2 4.3Å; F34-F169 HydrophobicContact CD1-CG 4.01Å; F34-F169 HydrophobicContact CD2-CB 3.94Å; F34-F169 AromaticContact CD2-CD2 3.54Å; F34-F169 HydrophobicContact CD2-CD2 3.54Å; F34-F169 HydrophobicContact CD2-CE2 4.32Å; F34-F169 AromaticContact CD2-CG 3.93Å; F34-F169 HydrophobicContact CD2-CG 3.93Å; F34-F169 HydrophobicContact CE1-CB 4.25Å; F34-F169 HydrophobicContact CE1-CG 4.22Å; F34-F169 HydrophobicContact CE2-CB 3.68Å; F34-F169 HydrophobicContact CE2-CD2 4.2Å; F34-F169 HydrophobicContact CE2-CG 4.14Å; F34-F169 HydrophobicContact CG-CB 4.31Å; F34-F169 AromaticContact CG-CD2 3.39Å; F34-F169 HydrophobicContact CG-CD2 3.39Å; F34-F169 AromaticContact CG-CE2 3.77Å; F34-F169 HydrophobicContact CG-CE2 3.77Å; F34-F169 AromaticContact CG-CG 3.85Å; F34-F169 HydrophobicContact CG-CG 3.85Å; F34-F169 HydrophobicContact CG-CZ 4.48Å; F34-F169 HydrophobicContact CZ-CB 3.84Å; F34-F169 HydrophobicContact CZ-CG 4.27Å; I64-F169 HydrophobicContact CD1-CB 4.42Å; I64-F169 HydrophobicContact CD1-CD1 3.96Å; I66-F169 HydrophobicContact CD1-CD1 3.89Å; I66-F169 HydrophobicContact CD1-CE1 3.5Å; I66-F169 VanDerWaalsContact CD1-CE1 3.5Å; I66-F169 HydrophobicContact CD1-CZ 4.08Å; I66-F169 HydrophobicContact CG1-CD1 4.37Å; I66-F169 HydrophobicContact CG1-CE1 4.02Å; I66-F169 HydrophobicContact CG2-CE1 4.19Å; L90-F169 HydrophobicContact CD1-CD1 3.8Å; L90-F169 HydrophobicContact CD1-CE1 3.63Å; L90-F169 HydrophobicContact CD1-CE2 4.43Å; L90-F169 HydrophobicContact CD1-CG 4.29Å; L90-F169 HydrophobicContact CD1-CZ 3.97Å; V165-F169 HydrophobicContact CG1-CD2 4.38Å; V165-F169 HydrophobicContact CG1-CE2 4.23Å; V165-F169 VanDerWaalsContact O-CD2 3.28Å; V165-F169 WeakPolarHBondContact O-CD2 3.42Å; D166-F169 PolarHBondContact O-N 2.91Å; K167-F169 PolarHBondContact O-N 2.97Å; F169-M173 WeakPolarHBondContact O-CG 3.28Å; F169-M173 PolarHBondContact O-N 3.3Å
170	F	98.6	Very high	97.7	Very high	40 Å²	40	42.6 Å²	42.6	18%	0.175	21%	0.209	C	C	.	.	H	α-helix	trans	-66.7	-43.3	178.4	-82.7	-81	0	0	0	112.5	F34 V55 V56 L57 D166 K167 L172 M173 R174	F34-F170 HydrophobicContact CE2-CD2 4.25Å; F34-F170 AromaticContact CE2-CE2 3.96Å; F34-F170 HydrophobicContact CE2-CE2 3.96Å; F34-F170 HydrophobicContact CZ-CE2 4.44Å; V55-F170 HydrophobicContact CB-CE1 4.35Å; V55-F170 HydrophobicContact CB-CZ 4.12Å; V55-F170 HydrophobicContact CG1-CZ 4.5Å; V55-F170 HydrophobicContact CG2-CE1 4.34Å; V56-F170 WeakPolarHBondContact O-CE1 3.49Å; L57-F170 HydrophobicContact CD1-CD1 3.64Å; L57-F170 HydrophobicContact CD1-CE1 4.33Å; D166-F170 HydrophobicContact CB-CD2 4.12Å; D166-F170 HydrophobicContact CB-CE2 4.35Å; D166-F170 WeakPolarHBondContact O-CB 3.37Å; D166-F170 VanDerWaalsContact O-CD2 3.24Å; D166-F170 WeakPolarHBondContact O-CD2 3.49Å; D166-F170 PolarHBondContact O-N 3.2Å; K167-F170 PolarHBondContact O-N 3.31Å; F170-L172 PolarHBondContact O-N 3.06Å; F170-M173 HydrophobicContact CB-CE 4.4Å; F170-M173 HydrophobicContact CD1-CE 3.62Å; F170-M173 HydrophobicContact CD2-CE 4.48Å; F170-M173 HydrophobicContact CE1-CE 3.92Å; F170-M173 HydrophobicContact CG-CE 3.92Å; F170-M173 HydrophobicContact CZ-CE 4.48Å; F170-M173 PolarHBondContact O-N 2.96Å; F170-R174 WeakPolarHBondContact O-CG 3.01Å; F170-R174 PolarHBondContact O-N 2.84Å
171	D	98.5	Very high	97.4	Very high	25 Å²	25	42.5 Å²	42.5	13%	0.134	21%	0.211	C	C	.	.	H	α-helix	trans	-63.2	-42.3	177.9	-72.7	-14.2	0	0	0	111.7	K167 M173 R174 E175	K167-D171 VanDerWaalsContact CG-OD2 3.28Å; K167-D171 WeakPolarHBondContact CG-OD2 3.44Å; K167-D171 IonicContact NZ-OD2 3.06Å; K167-D171 PolarHBondContact NZ-OD2 3.23Å; K167-D171 VanDerWaalsContact O-CB 3.25Å; K167-D171 WeakPolarHBondContact O-CB 3.25Å; K167-D171 PolarHBondContact O-N 3.42Å; D171-M173 PolarHBondContact O-N 3.23Å; D171-R174 WeakPolarHBondContact O-CB 3.48Å; D171-R174 PolarHBondContact O-N 3.34Å; D171-R174 IonicContact OD1-CZ 3.24Å; D171-R174 IonicContact OD1-NH1 2.71Å; D171-R174 PolarHBondContact OD1-NH1 3.32Å; D171-E175 PolarHBondContact O-N 3.08Å; D171-E175 VanDerWaalsContact O-N 3.07Å
172	L	98.6	Very high	97	Very high	1 Å²	1	41.1 Å²	41.1	1%	0.005	21%	0.205	C	C	.	.	H	α-helix	trans	-64.1	-41.5	175	-176.9	64.2	0	0	0	111.9	V17 L90 P122 V168 F170 R174 E175 I176	V17-L172 HydrophobicContact CB-CD2 4.24Å; V17-L172 HydrophobicContact CG1-CD2 3.58Å; V17-L172 HydrophobicContact CG2-CD2 3.77Å; V17-L172 HydrophobicContact CG2-CG 4.39Å; L90-L172 HydrophobicContact CD2-CB 4.06Å; L90-L172 HydrophobicContact CD2-CD2 3.68Å; L90-L172 HydrophobicContact CD2-CG 4.39Å; L90-L172 HydrophobicContact CG-CD2 3.67Å; P122-L172 HydrophobicContact CB-CD1 3.87Å; V168-L172 WeakPolarHBondContact O-CB 3.36Å; V168-L172 PolarHBondContact O-N 3.06Å; V168-L172 VanDerWaalsContact O-N 3.12Å; F170-L172 PolarHBondContact O-N 3.06Å; L172-R174 VanDerWaalsContact C-N 3.27Å; L172-R174 PolarHBondContact O-N 2.67Å; L172-E175 WeakPolarHBondContact O-CB 3.31Å; L172-E175 PolarHBondContact O-N 2.79Å; L172-I176 HydrophobicContact CG-CD1 4.18Å; L172-I176 WeakPolarHBondContact O-CG1 3.32Å; L172-I176 PolarHBondContact O-N 2.96Å
173	M	98.4	Very high	96.6	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-60.3	-36.7	174.3	-75.5	-171.9	-70.5	0	0	112.2	H15 V55 L57 V62 I64 F169 F170 D171 I176 R177	H15-M173 HydrophobicContact CB-CG 4.04Å; H15-M173 HydrophobicContact CB-SD 4.49Å; V55-M173 HydrophobicContact CG2-CE 3.94Å; V55-M173 HydrophobicContact CG2-SD 4.04Å; L57-M173 HydrophobicContact CD1-CB 4.22Å; L57-M173 HydrophobicContact CD2-CB 3.87Å; V62-M173 HydrophobicContact CG2-SD 4.37Å; I64-M173 HydrophobicContact CB-SD 3.8Å; I64-M173 HydrophobicContact CD1-CE 4.3Å; I64-M173 HydrophobicContact CD1-CG 4.09Å; I64-M173 HydrophobicContact CD1-SD 3.83Å; I64-M173 HydrophobicContact CG1-CG 4.45Å; I64-M173 HydrophobicContact CG1-SD 4.04Å; F169-M173 WeakPolarHBondContact O-CG 3.28Å; F169-M173 PolarHBondContact O-N 3.3Å; F170-M173 HydrophobicContact CB-CE 4.4Å; F170-M173 HydrophobicContact CD1-CE 3.62Å; F170-M173 HydrophobicContact CD2-CE 4.48Å; F170-M173 HydrophobicContact CE1-CE 3.92Å; F170-M173 HydrophobicContact CG-CE 3.92Å; F170-M173 HydrophobicContact CZ-CE 4.48Å; F170-M173 PolarHBondContact O-N 2.96Å; D171-M173 PolarHBondContact O-N 3.23Å; M173-I176 PolarHBondContact O-N 3.32Å; M173-R177 VanDerWaalsContact O-CB 3.31Å; M173-R177 WeakPolarHBondContact O-CB 3.26Å; M173-R177 PolarHBondContact O-N 3.12Å
174	R	98.2	Very high	95.9	Very high	81 Å²	81	44.1 Å²	44.1	31%	0.306	22%	0.219	S	C	.	.	H	α-helix	trans	-63.8	-41.3	174.1	-67.9	175.7	-175.7	111.4	5	112.1	L57 D58 F170 D171 L172 R177 T178	L57-R174 HydrophobicContact CD1-CG 3.89Å; D58-R174 IonicContact OD1-CZ 2.84Å; D58-R174 IonicContact OD1-NE 3.93Å; D58-R174 PolarHBondContact OD1-NE 3.44Å; D58-R174 VanDerWaalsContact OD1-NE 3.11Å; D58-R174 IonicContact OD1-NH2 3.21Å; D58-R174 PolarHBondContact OD1-NH2 3.19Å; D58-R174 IonicContact OD2-NE 2.89Å; D58-R174 PolarHBondContact OD2-NE 3.07Å; F170-R174 WeakPolarHBondContact O-CG 3.01Å; F170-R174 PolarHBondContact O-N 2.84Å; D171-R174 WeakPolarHBondContact O-CB 3.48Å; D171-R174 PolarHBondContact O-N 3.34Å; D171-R174 IonicContact OD1-CZ 3.24Å; D171-R174 IonicContact OD1-NH1 2.71Å; D171-R174 PolarHBondContact OD1-NH1 3.32Å; L172-R174 VanDerWaalsContact C-N 3.27Å; L172-R174 PolarHBondContact O-N 2.67Å; R174-R177 PolarHBondContact O-N 3.11Å; R174-T178 WeakPolarHBondContact O-CB 3.09Å; R174-T178 PolarHBondContact O-N 3.08Å; R174-T178 PolarHBondContact O-OG1 3.1Å
175	E	97.5	Very high	95	Very high	45 Å²	45	48 Å²	48	21%	0.21	23%	0.232	C	C	.	.	H	α-helix	trans	-63.7	-45.7	174.7	-71.6	-68.4	160.1	0	0	111.5	K120 P122 D171 L172 R177 T178 K179	K120-E175 WeakPolarHBondContact CE-OE2 3.17Å; K120-E175 IonicContact NZ-OE2 2.93Å; K120-E175 PolarHBondContact NZ-OE2 3.24Å; P122-E175 HydrophobicContact CB-CB 3.87Å; D171-E175 PolarHBondContact O-N 3.08Å; D171-E175 VanDerWaalsContact O-N 3.07Å; L172-E175 WeakPolarHBondContact O-CB 3.31Å; L172-E175 PolarHBondContact O-N 2.79Å; E175-R177 PolarHBondContact O-N 3.04Å; E175-T178 PolarHBondContact O-N 3.09Å; E175-K179 PolarHBondContact O-N 2.9Å
176	I	97.6	Very high	94	Very high	2 Å²	2	52.5 Å²	52.5	1%	0.01	26%	0.256	C	S	.	.	H	α-helix	trans	-58.8	-48.5	175.1	-64.8	168.1	0	0	0	110.5	H15 V17 E87 P122 L172 M173 T178 K179 K180	H15-I176 HydrophobicContact CB-CD1 4.31Å; H15-I176 HydrophobicContact CB-CG2 4.49Å; H15-I176 WeakPolarHBondContact ND1-CG2 3.13Å; V17-I176 HydrophobicContact CG2-CD1 3.95Å; E87-I176 HydrophobicContact CB-CD1 4.26Å; E87-I176 HydrophobicContact CB-CG1 4.36Å; E87-I176 HydrophobicContact CB-CG2 3.85Å; P122-I176 HydrophobicContact CB-CG1 3.82Å; P122-I176 HydrophobicContact CG-CG1 4.02Å; L172-I176 HydrophobicContact CG-CD1 4.18Å; L172-I176 WeakPolarHBondContact O-CG1 3.32Å; L172-I176 PolarHBondContact O-N 2.96Å; M173-I176 PolarHBondContact O-N 3.32Å; I176-T178 VanDerWaalsContact C-N 3.34Å; I176-T178 PolarHBondContact O-N 3.41Å; I176-K179 PolarHBondContact O-N 3.21Å; I176-K180 HydrophobicContact CG2-CD 4.21Å; I176-K180 HydrophobicContact CG2-CG 4.46Å; I176-K180 WeakPolarHBondContact O-CG 3.49Å; I176-K180 PolarHBondContact O-N 2.93Å
177	R	96.5	Very high	92.9	Very high	50 Å²	50	55.7 Å²	55.7	19%	0.189	27%	0.267	C	S	.	.	H	α-helix	trans	-59	-45.7	178.8	-175.9	179.3	70.1	-171.8	-7.5	111.3	D58 M173 R174 E175 K179 K180 M181	D58-R177 IonicContact OD2-CZ 3.44Å; D58-R177 IonicContact OD2-NH1 3.44Å; D58-R177 PolarHBondContact OD2-NH1 2.87Å; D58-R177 IonicContact OD2-NH2 2.69Å; D58-R177 PolarHBondContact OD2-NH2 2.89Å; M173-R177 VanDerWaalsContact O-CB 3.31Å; M173-R177 WeakPolarHBondContact O-CB 3.26Å; M173-R177 PolarHBondContact O-N 3.12Å; R174-R177 PolarHBondContact O-N 3.11Å; E175-R177 PolarHBondContact O-N 3.04Å; R177-K179 PolarHBondContact O-N 2.92Å; R177-K180 PolarHBondContact O-N 3.42Å; R177-M181 HydrophobicContact CG-CE 3.57Å; R177-M181 HydrophobicContact CG-SD 4.37Å; R177-M181 WeakPolarHBondContact O-CG 3.4Å; R177-M181 PolarHBondContact O-N 2.86Å
178	T	95.6	Very high	91.6	Very high	77 Å²	77	57.2 Å²	57.2	47%	0.472	28%	0.279	S	S	.	.	H	α-helix	trans	-60.3	-45.4	179.3	-61.5	0	0	0	0	111.5	R174 E175 I176 M181 S182	R174-T178 WeakPolarHBondContact O-CB 3.09Å; R174-T178 PolarHBondContact O-N 3.08Å; R174-T178 PolarHBondContact O-OG1 3.1Å; E175-T178 PolarHBondContact O-N 3.09Å; I176-T178 VanDerWaalsContact C-N 3.34Å; I176-T178 PolarHBondContact O-N 3.41Å; T178-M181 PolarHBondContact O-N 2.97Å; T178-S182 PolarHBondContact O-N 3.23Å; T178-S182 VanDerWaalsContact O-N 3.12Å
179	K	94.8	Very high	89.9	Confident	17 Å²	17	59.2 Å²	59.2	7%	0.074	30%	0.3	C	S	.	.	H	α-helix	trans	-61.6	-46.7	174.8	175.2	-177.1	170.2	-168.8	0	112.8	E118 K120 P122 E175 I176 R177 M181 S182 E183	E118-K179 IonicContact OE1-NZ 2.95Å; E118-K179 IonicContact OE2-NZ 3.55Å; E118-K179 PolarHBondContact OE2-NZ 3.33Å; K120-K179 WeakPolarHBondContact O-CD 3.38Å; K120-K179 WeakPolarHBondContact O-CE 3.31Å; K120-K179 PolarHBondContact O-NZ 2.95Å; P122-K179 HydrophobicContact CG-CB 4.3Å; P122-K179 HydrophobicContact CG-CD 3.76Å; E175-K179 PolarHBondContact O-N 2.9Å; I176-K179 PolarHBondContact O-N 3.21Å; R177-K179 PolarHBondContact O-N 2.92Å; K179-M181 PolarHBondContact O-N 3.08Å; K179-S182 PolarHBondContact O-N 2.81Å; K179-S182 VanDerWaalsContact O-N 3.13Å; K179-S182 PolarHBondContact O-OG 3.44Å; K179-E183 WeakPolarHBondContact CE-OE1 3.39Å; K179-E183 PolarHBondContact O-N 3.27Å; K179-E183 VanDerWaalsContact O-N 3.07Å
180	K	93.4	Very high	88.1	Confident	55 Å²	55	67.1 Å²	67.1	24%	0.239	33%	0.334	C	S	.	.	H	α-helix	trans	-59.1	-36.4	177.4	-73.2	-176.6	178.5	-166.2	0	111.9	L14 E87 I176 R177 N184	L14-K180 PolarHBondContact O-NZ 3.32Å; E87-K180 WeakPolarHBondContact OE1-CE 3.48Å; E87-K180 IonicContact OE1-NZ 2.73Å; E87-K180 PolarHBondContact OE1-NZ 3.49Å; E87-K180 VanDerWaalsContact OE2-CE 3.23Å; E87-K180 WeakPolarHBondContact OE2-CE 3.29Å; E87-K180 IonicContact OE2-NZ 3.44Å; E87-K180 PolarHBondContact OE2-NZ 2.52Å; I176-K180 HydrophobicContact CG2-CD 4.21Å; I176-K180 HydrophobicContact CG2-CG 4.46Å; I176-K180 WeakPolarHBondContact O-CG 3.49Å; I176-K180 PolarHBondContact O-N 2.93Å; R177-K180 PolarHBondContact O-N 3.42Å; K180-N184 PolarHBondContact O-N 2.9Å; K180-N184 PolarHBondContact O-ND2 3.48Å
181	M	91.3	Very high	86.2	Confident	100 Å²	100	73 Å²	73	49%	0.493	36%	0.36	S	S	.	.	H	α-helix	trans	-68	-38.3	176.3	-71.3	177.8	-177.7	0	0	112.7	R177 T178 K179 K185	R177-M181 HydrophobicContact CG-CE 3.57Å; R177-M181 HydrophobicContact CG-SD 4.37Å; R177-M181 WeakPolarHBondContact O-CG 3.4Å; R177-M181 PolarHBondContact O-N 2.86Å; T178-M181 PolarHBondContact O-N 2.97Å; K179-M181 PolarHBondContact O-N 3.08Å; M181-K185 WeakPolarHBondContact O-CG 3.26Å; M181-K185 PolarHBondContact O-N 3.33Å
182	S	90.6	Very high	84.2	Confident	58 Å²	58	76 Å²	76	41%	0.406	38%	0.383	S	S	.	.	H	α-helix	trans	-67.1	-45.4	176.2	55.6	0	0	0	0	111.8	T178 K179 N184 K185 D186	T178-S182 PolarHBondContact O-N 3.23Å; T178-S182 VanDerWaalsContact O-N 3.12Å; K179-S182 PolarHBondContact O-N 2.81Å; K179-S182 VanDerWaalsContact O-N 3.13Å; K179-S182 PolarHBondContact O-OG 3.44Å; S182-N184 VanDerWaalsContact C-N 3.28Å; S182-N184 PolarHBondContact O-N 3.36Å; S182-K185 WeakPolarHBondContact O-CB 3.34Å; S182-K185 PolarHBondContact O-N 3.38Å; S182-K185 VanDerWaalsContact O-N 3.09Å; S182-D186 PolarHBondContact O-N 3.28Å; S182-D186 VanDerWaalsContact O-N 3.12Å
183	E	87.8	Confident	82	Confident	70 Å²	70	78.8 Å²	78.8	33%	0.327	41%	0.411	S	S	.	.	H	α-helix	trans	-61.1	-35.6	178.7	-69.3	176.4	-172	0	0	113.2	K179 D186 K187	K179-E183 WeakPolarHBondContact CE-OE1 3.39Å; K179-E183 PolarHBondContact O-N 3.27Å; K179-E183 VanDerWaalsContact O-N 3.07Å; E183-D186 PolarHBondContact O-N 3.33Å; E183-K187 VanDerWaalsContact O-CG 3.32Å; E183-K187 WeakPolarHBondContact O-CG 3.41Å; E183-K187 PolarHBondContact O-N 3.39Å; E183-K187 VanDerWaalsContact O-N 3.13Å
184	N	83.9	Confident	79.9	Confident	93 Å²	93	87.5 Å²	87.5	50%	0.497	45%	0.449	S	S	.	.	H	α-helix	trans	-70.2	-34.4	176.9	-77.2	-23.2	0	0	0	112.4	K180 S182 N188	K180-N184 PolarHBondContact O-N 2.9Å; K180-N184 PolarHBondContact O-ND2 3.48Å; S182-N184 VanDerWaalsContact C-N 3.28Å; S182-N184 PolarHBondContact O-N 3.36Å; N184-N188 PolarHBondContact O-N 3.21Å
185	K	81.7	Confident	77.7	Confident	158 Å²	158	91.1 Å²	91.1	69%	0.687	48%	0.475	S	S	*	.	H	α-helix	trans	-65.8	-42.2	174.2	-73.9	177.6	179.8	178.5	0	111.1	M181 S182 K187 N188 G189	M181-K185 WeakPolarHBondContact O-CG 3.26Å; M181-K185 PolarHBondContact O-N 3.33Å; S182-K185 WeakPolarHBondContact O-CB 3.34Å; S182-K185 PolarHBondContact O-N 3.38Å; S182-K185 VanDerWaalsContact O-N 3.09Å; K185-K187 PolarHBondContact O-N 2.68Å; K185-N188 PolarHBondContact O-N 3.2Å; K185-G189 PolarHBondContact O-N 2.75Å
186	D	77.3	Confident	75.5	Confident	94 Å²	94	98.3 Å²	98.3	50%	0.503	51%	0.505	S	S	.	.	H	α-helix	trans	-66.4	-38.3	179.3	-65.6	-30.1	0	0	0	112.7	S182 E183 G189 K190	S182-D186 PolarHBondContact O-N 3.28Å; S182-D186 VanDerWaalsContact O-N 3.12Å; E183-D186 PolarHBondContact O-N 3.33Å; D186-G189 PolarHBondContact O-N 3.08Å; D186-K190 WeakPolarHBondContact O-CG 3.48Å; D186-K190 PolarHBondContact O-N 3.17Å
187	K	75.5	Confident	73.2	Confident	123 Å²	123	107.9 Å²	107.9	54%	0.535	55%	0.547	S	S	.	.	H	α-helix	trans	-64.2	-39.1	174.6	-73.6	170.4	-175.4	165.9	0	112.1	E183 K185 K191	E183-K187 VanDerWaalsContact O-CG 3.32Å; E183-K187 WeakPolarHBondContact O-CG 3.41Å; E183-K187 PolarHBondContact O-N 3.39Å; E183-K187 VanDerWaalsContact O-N 3.13Å; K185-K187 PolarHBondContact O-N 2.68Å; K187-K191 PolarHBondContact O-N 2.62Å
188	N	69.7	Low	70.8	Confident	113 Å²	113	111 Å²	111	60%	0.604	58%	0.576	S	S	*	*	H	α-helix	trans	-74.5	-36.9	177.6	-79.4	-13.2	0	0	0	112.7	N184 K185 K191 S192	N184-N188 PolarHBondContact O-N 3.21Å; K185-N188 PolarHBondContact O-N 3.2Å; N188-K191 PolarHBondContact O-N 3.1Å; N188-S192 PolarHBondContact O-N 3.5Å
189	G	64.5	Low	68.5	Low	42 Å²	42	117.2 Å²	117.2	43%	0.433	60%	0.597	S	S	.	*	H	α-helix	trans	-64.6	-37.6	174.7	0	0	0	0	0	113.4	K185 D186 K191 S192 G193	K185-G189 PolarHBondContact O-N 2.75Å; D186-G189 PolarHBondContact O-N 3.08Å; G189-K191 VanDerWaalsContact C-N 3.34Å; G189-K191 PolarHBondContact O-N 2.86Å; G189-S192 PolarHBondContact O-N 3.02Å; G189-S192 PolarHBondContact O-OG 3.3Å; G189-G193 PolarHBondContact O-N 3.3Å
190	K	61	Low	66.6	Low	165 Å²	165	125.1 Å²	125.1	72%	0.717	63%	0.632	S	S	*	*	H	α-helix	trans	-69.1	-28.8	175.4	-76.1	176.2	-179.5	169.8	0	113.2	D186	D186-K190 WeakPolarHBondContact O-CG 3.48Å; D186-K190 PolarHBondContact O-N 3.17Å
191	K	58.4	Low	64.7	Low	164 Å²	164	130 Å²	130	71%	0.713	66%	0.655	S	S	*	*	H	α-helix	trans	-74.8	-34.3	176.3	-78.1	-177.4	178.6	177.3	0	112.9	K187 N188 G189	K187-K191 PolarHBondContact O-N 2.62Å; N188-K191 PolarHBondContact O-N 3.1Å; G189-K191 VanDerWaalsContact C-N 3.34Å; G189-K191 PolarHBondContact O-N 2.86Å
192	S	56.5	Low	62.5	Low	88 Å²	88	137.3 Å²	137.3	62%	0.615	68%	0.677	S	S	*	*	H	α-helix	trans	-75.5	-24.4	178.5	57.6	0	0	0	0	113.6	N188 G189	N188-S192 PolarHBondContact O-N 3.5Å; G189-S192 PolarHBondContact O-N 3.02Å; G189-S192 PolarHBondContact O-OG 3.3Å
193	G	52.8	Low	60.4	Low	59 Å²	59	140.7 Å²	140.7	61%	0.608	70%	0.699	S	S	*	*	H	α-helix	trans	-76.8	-19.2	178	0	0	0	0	0	116.1	G189	G189-G193 PolarHBondContact O-N 3.3Å
194	K	53.6	Low	58.4	Low	184 Å²	184	143 Å²	143	80%	0.8	72%	0.722	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85	-10.4	-177.3	-85.7	-176.5	175.5	177	0	115.1
195	N	51.3	Low	56.7	Low	156 Å²	156	146.5 Å²	146.5	83%	0.834	74%	0.74	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.3	17	-177.3	-94.2	6.3	0	0	0	115.6
196	K	51.9	Low	55.1	Low	196 Å²	196	150.7 Å²	150.7	85%	0.852	77%	0.768	S	S	*	*	S	Bend	trans	-119.1	17.1	-177.2	-98.2	-176.2	177.7	178.3	0	116.7
197	K	48.8	Very low	54	Low	204 Å²	204	153.6 Å²	153.6	89%	0.887	78%	0.782	S	S	*	*	S	Bend	trans	-128.2	90.6	173.9	-80.1	-174.6	175.8	179	0	111.6
198	S	46.9	Very low	52.9	Low	115 Å²	115	155.2 Å²	155.2	80%	0.804	80%	0.795	S	S	*	*			trans	158.6	78.3	149.9	171.4	0	0	0	0	111.1
199	F	48	Very low	52	Low	207 Å²	207	157.5 Å²	157.5	91%	0.908	81%	0.805	S	S	*	*			trans	-159.3	89.3	149.4	-143.8	-99.1	0	0	0	107.8
200	K	54.6	Low	51.2	Low	184 Å²	184	164.3 Å²	164.3	80%	0.8	83%	0.827	S	S	*	*			trans	-129.9	100.7	167.9	-138.9	-178.2	179.9	-173	0	108.8
201	E	53.7	Low	50.6	Low	156 Å²	156	164.3 Å²	164.3	73%	0.729	83%	0.834	S	S	*	*			trans	59.1	94.1	145.9	-67.7	163.1	160.4	0	0	118.1
202	R	45.3	Very low	50.1	Low	255 Å²	255	164.3 Å²	164.3	96%	0.962	84%	0.842	S	S	*	*			trans	-99.6	116.3	134.7	-75.3	-175.5	-167.1	-172.2	3.2	107.8
203	C	45.6	Very low	49.7	Very low	128 Å²	128	169.7 Å²	169.7	87%	0.865	86%	0.858	S	S	*	*			trans	-134	118.4	157.3	-120.1	0	0	0	0	107.8
204	C	46.1	Very low	49.4	Very low	120 Å²	120	178.2 Å²	178.2	81%	0.811	88%	0.878	S	S	*	*			trans	-60.2	155.6	167.7	-63.9	0	0	0	0	110.9
205	L	48.2	Very low	49.1	Very low	166 Å²	166	177.8 Å²	177.8	87%	0.869	88%	0.884	S	S	*	*				-173.8	122.6	125.6	-96.4	151.3	0	0	0	109.9
206	L	48.6	Very low	48.9	Very low	246 Å²	246	179.7 Å²	179.7	100%	1.288	89%	0.889	S	S	*	*			trans	73	0	171.4	-62.5	168.1	0	0	0	118.5

Retrieved 206 of 206 residues in 61.1 ms (Link to these results)

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