A0A5K4F853_SCHMA Loading...

J domain-containing protein

AlphaFold DB (A0A5K4F4U0), UniProt , Accession A0A5K4F853, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 270 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	36	Very low	72.6	Confident	240 Å²	240	83.1 Å²	83.1	100%	1.182	43%	0.433	S	S	*	.				0	100.6	0	-60.7	178.4	-153.2	0	0	106.3	Q3	M1-Q3 PolarHBondContact O-N 3.12Å
2	E	43.4	Very low	74.1	Confident	191 Å²	191	78.7 Å²	78.7	89%	0.893	41%	0.409	S	S	*	.			trans	-69.5	115.4	-178.1	-74.1	-173.4	153.2	0	0	109.2	T4	E2-T4 PolarHBondContact O-N 2.89Å; E2-T4 VanDerWaalsContact O-N 3.14Å
3	Q	47.5	Very low	75.2	Confident	140 Å²	140	85.1 Å²	85.1	65%	0.654	43%	0.432	S	S	*	.			trans	-52	117.8	175.6	-76.1	157.1	-4.4	0	0	109.9	M1 C5	M1-Q3 PolarHBondContact O-N 3.12Å; Q3-C5 PolarHBondContact O-N 3.21Å
4	T	62.2	Low	76	Confident	48 Å²	48	89.2 Å²	89.2	29%	0.294	45%	0.446	S	S	.	.			trans	-72.5	64.9	-178.2	43.3	0	0	0	0	111.2	E2 Y6 Y67 P74	E2-T4 PolarHBondContact O-N 2.89Å; E2-T4 VanDerWaalsContact O-N 3.14Å; T4-Y6 PolarHBondContact O-N 3.01Å; T4-Y6 VanDerWaalsContact O-N 3.15Å; T4-Y67 PolarHBondContact O-OH 3.37Å; T4-Y67 VanDerWaalsContact O-OH 3.07Å; T4-P74 VanDerWaalsContact OG1-CG 3.25Å; T4-P74 WeakPolarHBondContact OG1-CG 3.36Å
5	C	79.2	Confident	76.7	Confident	25 Å²	25	91.5 Å²	91.5	17%	0.169	47%	0.466	C	S	.	.			trans	-72.1	105.7	169.1	-63.7	0	0	0	0	108.7	Q3 Y7 K8 I9 Y67	Q3-C5 PolarHBondContact O-N 3.21Å; C5-Y7 PolarHBondContact O-N 2.75Å; C5-Y7 VanDerWaalsContact O-N 3.14Å; C5-K8 HydrophobicContact CB-CB 3.96Å; C5-K8 HydrophobicContact CB-CD 3.79Å; C5-K8 HydrophobicContact CB-CG 3.66Å; C5-K8 WeakPolarHBondContact O-CA 3.36Å; C5-K8 WeakPolarHBondContact O-CB 3.39Å; C5-K8 PolarHBondContact O-N 2.84Å; C5-I9 PolarHBondContact O-N 2.76Å; C5-I9 VanDerWaalsContact O-N 3.08Å; C5-Y67 WeakPolarHBondContact CA-OH 3.36Å
6	Y	86.9	Confident	77.3	Confident	4 Å²	4	85.8 Å²	85.8	2%	0.016	44%	0.438	C	S	.	.	H	α-helix	trans	-54.9	-33.9	177.1	-66	-45.4	0	0	0	112.3	T4 K8 I9 L10 E53 A54 V57 Y67 F91	T4-Y6 PolarHBondContact O-N 3.01Å; T4-Y6 VanDerWaalsContact O-N 3.15Å; Y6-K8 VanDerWaalsContact C-N 3.35Å; Y6-K8 PolarHBondContact O-N 2.83Å; Y6-I9 HydrophobicContact CD1-CD1 4.09Å; Y6-I9 PolarHBondContact O-N 2.74Å; Y6-L10 PolarHBondContact O-N 2.77Å; Y6-E53 HydrophobicContact CE1-CB 4.45Å; Y6-E53 HydrophobicContact CE1-CG 4.08Å; Y6-E53 WeakPolarHBondContact CE1-OE1 3.4Å; Y6-E53 PolarHBondContact OH-OE1 3.08Å; Y6-A54 VanDerWaalsContact CD1-CA 3.44Å; Y6-A54 HydrophobicContact CD1-CB 3.6Å; Y6-A54 HydrophobicContact CG-CB 3.98Å; Y6-V57 HydrophobicContact CD2-CB 4.03Å; Y6-V57 HydrophobicContact CD2-CG1 3.92Å; Y6-V57 HydrophobicContact CD2-CG2 4.45Å; Y6-V57 HydrophobicContact CE2-CB 3.88Å; Y6-V57 HydrophobicContact CE2-CG1 3.8Å; Y6-V57 HydrophobicContact CE2-CG2 3.81Å; Y6-Y67 HydrophobicContact CD2-CD1 4.26Å; Y6-Y67 AromaticContact CD2-CD2 3.63Å; Y6-Y67 HydrophobicContact CD2-CD2 3.63Å; Y6-Y67 AromaticContact CD2-CE1 3.93Å; Y6-Y67 HydrophobicContact CD2-CE1 3.93Å; Y6-Y67 AromaticContact CD2-CE2 3.26Å; Y6-Y67 HydrophobicContact CD2-CE2 3.26Å; Y6-Y67 HydrophobicContact CD2-CG 4.11Å; Y6-Y67 AromaticContact CD2-CZ 3.41Å; Y6-Y67 VanDerWaalsContact CD2-CZ 3.41Å; Y6-Y67 AromaticContact CE2-CD2 3.58Å; Y6-Y67 HydrophobicContact CE2-CD2 3.58Å; Y6-Y67 AromaticContact CE2-CE2 3.38Å; Y6-Y67 HydrophobicContact CE2-CE2 3.38Å; Y6-Y67 HydrophobicContact CE2-CG 4.38Å; Y6-Y67 HydrophobicContact CG-CE2 4.26Å; Y6-Y67 PolarHBondContact N-OH 3.43Å; Y6-Y67 VanDerWaalsContact N-OH 3.1Å; Y6-F91 WeakPolarHBondContact OH-CE2 3.46Å
7	Y	89	Confident	78.1	Confident	10 Å²	10	83.9 Å²	83.9	4%	0.039	43%	0.434	C	S	.	.	H	α-helix	trans	-60.9	-38.5	172.2	-61.2	-73.8	0	0	0	113.2	C5 G11 I12 K14 L58 R64 Y67 D68	C5-Y7 PolarHBondContact O-N 2.75Å; C5-Y7 VanDerWaalsContact O-N 3.14Å; Y7-G11 PolarHBondContact O-N 3.4Å; Y7-I12 HydrophobicContact CD1-CD1 4.17Å; Y7-I12 HydrophobicContact CD1-CG1 4.09Å; Y7-I12 PolarHBondContact O-N 2.79Å; Y7-I12 VanDerWaalsContact O-O 3.13Å; Y7-K14 HydrophobicContact CD1-CG 4.37Å; Y7-K14 HydrophobicContact CD2-CG 3.78Å; Y7-K14 HydrophobicContact CE1-CB 4.41Å; Y7-K14 HydrophobicContact CE2-CB 4.43Å; Y7-K14 HydrophobicContact CE2-CG 3.99Å; Y7-K14 HydrophobicContact CG-CG 3.97Å; Y7-L58 HydrophobicContact CD1-CD1 3.99Å; Y7-L58 HydrophobicContact CD1-CD2 4.38Å; Y7-L58 HydrophobicContact CE1-CD1 4.1Å; Y7-L58 HydrophobicContact CE1-CD2 3.76Å; Y7-L58 HydrophobicContact CE2-CD2 4.01Å; Y7-L58 HydrophobicContact CG-CD1 4.39Å; Y7-R64 PolarHBondContact OH-NE 3.25Å; Y7-R64 VanDerWaalsContact OH-NE 3.08Å; Y7-Y67 HydrophobicContact CD2-CE1 4Å; Y7-Y67 HydrophobicContact CE2-CD1 4.08Å; Y7-Y67 AromaticContact CE2-CE1 3.69Å; Y7-Y67 HydrophobicContact CE2-CE1 3.69Å; Y7-D68 WeakPolarHBondContact CE2-OD1 3.4Å; Y7-D68 VanDerWaalsContact OH-CG 3.31Å; Y7-D68 PolarHBondContact OH-OD1 3.13Å; Y7-D68 PolarHBondContact OH-OD2 3.23Å; Y7-D68 VanDerWaalsContact OH-OD2 3.07Å
8	K	88.4	Confident	78.8	Confident	149 Å²	149	82.6 Å²	82.6	65%	0.648	43%	0.433	S	S	*	.	H	α-helix	trans	-71.7	-40.5	176	-68	-177.5	-173	169.7	0	111.3	C5 Y6 L10 G11	C5-K8 HydrophobicContact CB-CB 3.96Å; C5-K8 HydrophobicContact CB-CD 3.79Å; C5-K8 HydrophobicContact CB-CG 3.66Å; C5-K8 WeakPolarHBondContact O-CA 3.36Å; C5-K8 WeakPolarHBondContact O-CB 3.39Å; C5-K8 PolarHBondContact O-N 2.84Å; Y6-K8 VanDerWaalsContact C-N 3.35Å; Y6-K8 PolarHBondContact O-N 2.83Å; K8-L10 VanDerWaalsContact C-N 3.31Å; K8-L10 PolarHBondContact O-N 2.76Å; K8-G11 PolarHBondContact O-N 3.28Å
9	I	88.1	Confident	79.3	Confident	45 Å²	45	83.7 Å²	83.7	23%	0.231	44%	0.44	C	S	.	.	H	α-helix	trans	-59	-44.5	177.6	-66.4	167.6	0	0	0	110.6	C5 Y6 G11 L28 L50 I51 A54	C5-I9 PolarHBondContact O-N 2.76Å; C5-I9 VanDerWaalsContact O-N 3.08Å; Y6-I9 HydrophobicContact CD1-CD1 4.09Å; Y6-I9 PolarHBondContact O-N 2.74Å; I9-G11 VanDerWaalsContact C-N 3.3Å; I9-L28 WeakPolarHBondContact O-CD1 3.23Å; I9-L50 HydrophobicContact CD1-CB 4.41Å; I9-L50 HydrophobicContact CG2-CB 4.31Å; I9-I51 HydrophobicContact CG2-CG1 4.05Å; I9-A54 HydrophobicContact CB-CB 4.33Å; I9-A54 HydrophobicContact CG2-CB 4.14Å
10	L	89.3	Confident	79.9	Confident	1 Å²	1	84.9 Å²	84.9	1%	0.005	44%	0.443	C	S	.	.	H	α-helix	trans	-79.2	-12	176.8	-66.5	-177.6	0	0	0	113.7	Y6 K8 I12 I21 A24 L28 I51 A54 L58	Y6-L10 PolarHBondContact O-N 2.77Å; K8-L10 VanDerWaalsContact C-N 3.31Å; K8-L10 PolarHBondContact O-N 2.76Å; L10-I12 HydrophobicContact CB-CD1 3.95Å; L10-I12 HydrophobicContact CB-CG1 3.86Å; L10-I12 HydrophobicContact CB-CG2 4.35Å; L10-I12 HydrophobicContact CD1-CD1 3.94Å; L10-I21 HydrophobicContact CD1-CG2 4.04Å; L10-A24 HydrophobicContact CB-CB 4.29Å; L10-L28 HydrophobicContact CD2-CD1 4.07Å; L10-I51 HydrophobicContact CD2-CG2 4.06Å; L10-A54 HydrophobicContact CD1-CB 4.15Å; L10-A54 HydrophobicContact CD2-CB 4.21Å; L10-A54 HydrophobicContact CG-CB 3.84Å; L10-L58 HydrophobicContact CD1-CD1 3.87Å
11	G	88.9	Confident	80.4	Confident	61 Å²	61	80.9 Å²	80.9	63%	0.629	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	66	36.4	-176.5	0	0	0	0	0	113.1	Y7 K8 I9	Y7-G11 PolarHBondContact O-N 3.4Å; K8-G11 PolarHBondContact O-N 3.28Å; I9-G11 VanDerWaalsContact C-N 3.3Å
12	I	90.6	Very high	83	Confident	30 Å²	30	73.3 Å²	73.3	15%	0.154	38%	0.382	C	S	.	.			trans	-120	160.5	-177.5	60.4	176.3	0	0	0	111.2	Y7 L10 A16 I21 A24 L58	Y7-I12 HydrophobicContact CD1-CD1 4.17Å; Y7-I12 HydrophobicContact CD1-CG1 4.09Å; Y7-I12 PolarHBondContact O-N 2.79Å; Y7-I12 VanDerWaalsContact O-O 3.13Å; L10-I12 HydrophobicContact CB-CD1 3.95Å; L10-I12 HydrophobicContact CB-CG1 3.86Å; L10-I12 HydrophobicContact CB-CG2 4.35Å; L10-I12 HydrophobicContact CD1-CD1 3.94Å; I12-A16 HydrophobicContact CB-CB 4.06Å; I12-A16 HydrophobicContact CD1-CB 4.12Å; I12-A16 HydrophobicContact CG1-CB 4.43Å; I12-I21 HydrophobicContact CD1-CB 4.34Å; I12-I21 HydrophobicContact CD1-CD1 4.48Å; I12-I21 HydrophobicContact CD1-CG1 3.44Å; I12-I21 VanDerWaalsContact CD1-CG1 3.44Å; I12-A24 HydrophobicContact CG2-CB 3.52Å; I12-L58 HydrophobicContact CD1-CD1 4.25Å
13	K	88.9	Confident	85.2	Confident	162 Å²	162	71.4 Å²	71.4	70%	0.704	37%	0.371	S	S	*	.			trans	-78.7	154.6	173.9	-65.2	-178.8	179.8	177.2	0	110.4	T15 A16	K13-T15 PolarHBondContact O-N 3.16Å; K13-T15 VanDerWaalsContact O-N 3.13Å; K13-A16 WeakPolarHBondContact O-CB 3.45Å; K13-A16 PolarHBondContact O-N 3.43Å
14	K	85.2	Confident	87.4	Confident	143 Å²	143	65 Å²	65	62%	0.622	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.8	-21.5	173.5	-63.4	-172.3	176.5	-172.6	0	113.4	Y7 A16 R64	Y7-K14 HydrophobicContact CD1-CG 4.37Å; Y7-K14 HydrophobicContact CD2-CG 3.78Å; Y7-K14 HydrophobicContact CE1-CB 4.41Å; Y7-K14 HydrophobicContact CE2-CB 4.43Å; Y7-K14 HydrophobicContact CE2-CG 3.99Å; Y7-K14 HydrophobicContact CG-CG 3.97Å; K14-A16 VanDerWaalsContact C-N 3.33Å; K14-R64 PolarHBondContact O-NH2 2.76Å
15	T	86.6	Confident	88.7	Confident	123 Å²	123	62.7 Å²	62.7	76%	0.755	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.6	3.5	177	59.3	0	0	0	0	113.7	K13	K13-T15 PolarHBondContact O-N 3.16Å; K13-T15 VanDerWaalsContact O-N 3.13Å
16	A	87.5	Confident	89.2	Confident	1 Å²	1	64.4 Å²	64.4	1%	0.008	33%	0.331	C	S	.	.			trans	-63.6	143.1	-174.5	0	0	0	0	0	112.3	I12 K13 K14 E20 I21 R64	I12-A16 HydrophobicContact CB-CB 4.06Å; I12-A16 HydrophobicContact CD1-CB 4.12Å; I12-A16 HydrophobicContact CG1-CB 4.43Å; K13-A16 WeakPolarHBondContact O-CB 3.45Å; K13-A16 PolarHBondContact O-N 3.43Å; K14-A16 VanDerWaalsContact C-N 3.33Å; A16-E20 WeakPolarHBondContact CA-OE2 3.31Å; A16-E20 HydrophobicContact CB-CB 4.08Å; A16-E20 WeakPolarHBondContact CB-OE2 3.36Å; A16-I21 HydrophobicContact CB-CG1 4.47Å; A16-R64 PolarHBondContact O-NH1 3Å; A16-R64 PolarHBondContact O-NH2 2.94Å
17	S	90.1	Very high	89.3	Confident	53 Å²	53	70.8 Å²	70.8	37%	0.371	36%	0.355	S	S	.	.			trans	-73.5	164.2	175.1	73.3	0	0	0	0	111.5	D19 E20 I21	S17-D19 PolarHBondContact O-N 3.14Å; S17-D19 PolarHBondContact OG-N 2.74Å; S17-E20 PolarHBondContact N-OE2 3.42Å; S17-E20 PolarHBondContact O-N 2.94Å; S17-E20 PolarHBondContact OG-N 3.15Å; S17-I21 WeakPolarHBondContact O-CG1 3.4Å; S17-I21 PolarHBondContact O-N 3.17Å
18	S	90	Very high	89.4	Confident	61 Å²	61	71.1 Å²	71.1	43%	0.427	36%	0.357	S	S	.	.	H	α-helix	trans	-56.6	-32.8	173.9	50.8	0	0	0	0	112.6	K22	S18-K22 VanDerWaalsContact O-CG 3.31Å; S18-K22 WeakPolarHBondContact O-CG 3.39Å; S18-K22 PolarHBondContact O-N 2.78Å
19	D	89.1	Confident	89.5	Confident	104 Å²	104	64 Å²	64	56%	0.556	33%	0.327	S	S	*	.	H	α-helix	trans	-74.5	-37	-179.6	-61.5	-32	0	0	0	112	S17 K22 K23	S17-D19 PolarHBondContact O-N 3.14Å; S17-D19 PolarHBondContact OG-N 2.74Å; D19-K22 PolarHBondContact O-N 2.76Å; D19-K23 WeakPolarHBondContact O-CB 3.21Å; D19-K23 PolarHBondContact O-N 2.8Å
20	E	91.2	Very high	89.5	Confident	107 Å²	107	64.7 Å²	64.7	50%	0.5	33%	0.33	S	S	.	.	H	α-helix	trans	-64.7	-41.8	172.5	-73.2	179.3	175.9	0	0	111.5	A16 S17 K23 A24	A16-E20 WeakPolarHBondContact CA-OE2 3.31Å; A16-E20 HydrophobicContact CB-CB 4.08Å; A16-E20 WeakPolarHBondContact CB-OE2 3.36Å; S17-E20 PolarHBondContact N-OE2 3.42Å; S17-E20 PolarHBondContact O-N 2.94Å; S17-E20 PolarHBondContact OG-N 3.15Å; E20-K23 PolarHBondContact O-N 3.3Å; E20-A24 WeakPolarHBondContact O-CB 3.48Å; E20-A24 PolarHBondContact O-N 3.49Å
21	I	91.2	Very high	89.4	Confident	0 Å²	0	70.8 Å²	70.8	0%	0	36%	0.357	C	S	.	.	H	α-helix	trans	-58.9	-48.3	174.2	-68.6	159.8	0	0	0	110.3	L10 I12 A16 S17 K23 A24 Y25 Y55 L58	L10-I21 HydrophobicContact CD1-CG2 4.04Å; I12-I21 HydrophobicContact CD1-CB 4.34Å; I12-I21 HydrophobicContact CD1-CD1 4.48Å; I12-I21 HydrophobicContact CD1-CG1 3.44Å; I12-I21 VanDerWaalsContact CD1-CG1 3.44Å; A16-I21 HydrophobicContact CB-CG1 4.47Å; S17-I21 WeakPolarHBondContact O-CG1 3.4Å; S17-I21 PolarHBondContact O-N 3.17Å; I21-K23 PolarHBondContact O-N 2.78Å; I21-A24 PolarHBondContact O-N 3.17Å; I21-Y25 WeakPolarHBondContact O-CB 3.49Å; I21-Y25 PolarHBondContact O-N 2.83Å; I21-Y55 HydrophobicContact CG2-CD2 3.9Å; I21-Y55 HydrophobicContact CG2-CE2 4.25Å; I21-L58 HydrophobicContact CD1-CB 4.1Å; I21-L58 HydrophobicContact CG2-CB 4.09Å
22	K	90.2	Very high	89.5	Confident	82 Å²	82	70.9 Å²	70.9	36%	0.357	34%	0.338	S	S	.	.	H	α-helix	trans	-59.7	-44.1	175.4	-75	174.9	-179.9	-178.4	0	112.2	S18 D19 R26 Y55	S18-K22 VanDerWaalsContact O-CG 3.31Å; S18-K22 WeakPolarHBondContact O-CG 3.39Å; S18-K22 PolarHBondContact O-N 2.78Å; D19-K22 PolarHBondContact O-N 2.76Å; K22-R26 WeakPolarHBondContact O-CG 3.44Å; K22-R26 PolarHBondContact O-N 2.78Å; K22-Y55 HydrophobicContact CB-CE2 4.39Å; K22-Y55 HydrophobicContact CG-CE2 3.75Å
23	K	90.1	Very high	89.3	Confident	150 Å²	150	71.5 Å²	71.5	65%	0.652	34%	0.34	S	S	*	.	H	α-helix	trans	-65.6	-41.8	179.2	-170.6	177.2	-179.1	179.5	0	111.8	D19 E20 I21 R26 R27	D19-K23 WeakPolarHBondContact O-CB 3.21Å; D19-K23 PolarHBondContact O-N 2.8Å; E20-K23 PolarHBondContact O-N 3.3Å; I21-K23 PolarHBondContact O-N 2.78Å; K23-R26 PolarHBondContact O-N 2.74Å; K23-R27 PolarHBondContact O-N 2.77Å; K23-R27 VanDerWaalsContact O-N 3.15Å
24	A	91.9	Very high	89.1	Confident	6 Å²	6	65.2 Å²	65.2	5%	0.05	32%	0.316	C	S	.	.	H	α-helix	trans	-64.4	-45.8	177	0	0	0	0	0	111.8	L10 I12 E20 I21 R27 L28	L10-A24 HydrophobicContact CB-CB 4.29Å; I12-A24 HydrophobicContact CG2-CB 3.52Å; E20-A24 WeakPolarHBondContact O-CB 3.48Å; E20-A24 PolarHBondContact O-N 3.49Å; I21-A24 PolarHBondContact O-N 3.17Å; A24-R27 PolarHBondContact O-N 2.82Å; A24-L28 WeakPolarHBondContact O-CG 3.39Å; A24-L28 PolarHBondContact O-N 3.13Å
25	Y	91.2	Very high	89	Confident	0 Å²	0	64.4 Å²	64.4	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-56.1	-52.3	174	173.2	-101.9	0	0	0	111.3	I21 R27 L28 A29 I51 Y55 I102 F103 V106	I21-Y25 WeakPolarHBondContact O-CB 3.49Å; I21-Y25 PolarHBondContact O-N 2.83Å; Y25-R27 VanDerWaalsContact C-N 3.31Å; Y25-R27 PolarHBondContact O-N 2.75Å; Y25-L28 PolarHBondContact O-N 2.77Å; Y25-A29 HydrophobicContact CE1-CB 4.31Å; Y25-A29 HydrophobicContact CE2-CB 4.26Å; Y25-A29 WeakPolarHBondContact O-CB 3.44Å; Y25-A29 PolarHBondContact O-N 2.91Å; Y25-I51 HydrophobicContact CD2-CG2 3.55Å; Y25-I51 HydrophobicContact CE2-CG2 3.89Å; Y25-Y55 HydrophobicContact CD1-CD1 4.39Å; Y25-Y55 HydrophobicContact CD1-CD2 4.19Å; Y25-Y55 HydrophobicContact CD1-CE2 4.42Å; Y25-Y55 HydrophobicContact CD1-CG 4.17Å; Y25-Y55 VanDerWaalsContact CD2-CB 3.41Å; Y25-Y55 HydrophobicContact CD2-CD1 4.32Å; Y25-Y55 HydrophobicContact CD2-CD2 4.16Å; Y25-Y55 AromaticContact CD2-CG 3.7Å; Y25-Y55 HydrophobicContact CD2-CG 3.7Å; Y25-Y55 HydrophobicContact CE2-CD1 4.45Å; Y25-Y55 HydrophobicContact CE2-CG 4.24Å; Y25-Y55 HydrophobicContact CG-CD1 4.29Å; Y25-Y55 AromaticContact CG-CD2 3.69Å; Y25-Y55 HydrophobicContact CG-CD2 3.69Å; Y25-Y55 HydrophobicContact CG-CE2 4.32Å; Y25-Y55 AromaticContact CG-CG 3.66Å; Y25-Y55 HydrophobicContact CG-CG 3.66Å; Y25-I102 HydrophobicContact CE1-CG2 4.48Å; Y25-F103 WeakPolarHBondContact OH-CA 3.13Å; Y25-F103 PolarHBondContact OH-N 3.19Å; Y25-V106 HydrophobicContact CD1-CB 4.42Å; Y25-V106 HydrophobicContact CD1-CG1 3.98Å; Y25-V106 HydrophobicContact CD1-CG2 4.28Å; Y25-V106 HydrophobicContact CE1-CB 3.95Å; Y25-V106 HydrophobicContact CE1-CG1 3.97Å; Y25-V106 HydrophobicContact CE1-CG2 3.89Å
26	R	87.9	Confident	89	Confident	60 Å²	60	65 Å²	65	23%	0.226	31%	0.311	C	S	.	.	H	α-helix	trans	-55.5	-44.5	179.6	-73.8	-172.5	-63.1	-103.5	1.1	112.7	K22 K23 L30 V106 F107	K22-R26 WeakPolarHBondContact O-CG 3.44Å; K22-R26 PolarHBondContact O-N 2.78Å; K23-R26 PolarHBondContact O-N 2.74Å; R26-L30 WeakPolarHBondContact O-CG 3.3Å; R26-L30 PolarHBondContact O-N 3.3Å; R26-V106 HydrophobicContact CG-CG1 4.09Å; R26-F107 HydrophobicContact CB-CZ 4.05Å; R26-F107 HydrophobicContact CG-CE2 4.04Å; R26-F107 HydrophobicContact CG-CZ 3.92Å
27	R	89.8	Confident	88.9	Confident	139 Å²	139	66.9 Å²	66.9	53%	0.525	32%	0.32	S	S	.	.	H	α-helix	trans	-63.8	-45	179.1	-178.9	177	60.7	91.9	4.1	112.1	K23 A24 Y25 K31	K23-R27 PolarHBondContact O-N 2.77Å; K23-R27 VanDerWaalsContact O-N 3.15Å; A24-R27 PolarHBondContact O-N 2.82Å; Y25-R27 VanDerWaalsContact C-N 3.31Å; Y25-R27 PolarHBondContact O-N 2.75Å; R27-K31 WeakPolarHBondContact O-CB 3.24Å; R27-K31 PolarHBondContact O-N 2.76Å
28	L	91.7	Very high	88.6	Confident	17 Å²	17	68.8 Å²	68.8	9%	0.089	33%	0.332	C	S	.	.	H	α-helix	trans	-76.3	-38.2	-177	-71.2	172.7	0	0	0	112.5	I9 L10 A24 Y25 L30 K31 W32 I51	I9-L28 WeakPolarHBondContact O-CD1 3.23Å; L10-L28 HydrophobicContact CD2-CD1 4.07Å; A24-L28 WeakPolarHBondContact O-CG 3.39Å; A24-L28 PolarHBondContact O-N 3.13Å; Y25-L28 PolarHBondContact O-N 2.77Å; L28-L30 VanDerWaalsContact C-N 3.32Å; L28-L30 PolarHBondContact O-N 3.45Å; L28-K31 PolarHBondContact O-N 2.91Å; L28-K31 VanDerWaalsContact O-N 3.14Å; L28-W32 PolarHBondContact O-N 2.76Å; L28-I51 HydrophobicContact CB-CD1 3.72Å; L28-I51 HydrophobicContact CB-CG1 4.15Å; L28-I51 HydrophobicContact CB-CG2 4.02Å; L28-I51 HydrophobicContact CD1-CG1 4.41Å
29	A	89.8	Confident	88.4	Confident	0 Å²	0	73.4 Å²	73.4	0%	0	35%	0.352	C	S	.	.	H	α-helix	trans	-60.6	-41.9	175.7	0	0	0	0	0	111.5	Y25 H33 F48 F103	Y25-A29 HydrophobicContact CE1-CB 4.31Å; Y25-A29 HydrophobicContact CE2-CB 4.26Å; Y25-A29 WeakPolarHBondContact O-CB 3.44Å; Y25-A29 PolarHBondContact O-N 2.91Å; A29-H33 WeakPolarHBondContact O-CB 3.37Å; A29-H33 PolarHBondContact O-N 2.72Å; A29-H33 VanDerWaalsContact O-N 3.08Å; A29-F48 HydrophobicContact CB-CD2 4.48Å; A29-F48 HydrophobicContact CB-CE2 3.92Å; A29-F103 HydrophobicContact CB-CD2 3.84Å; A29-F103 HydrophobicContact CB-CE2 3.96Å
30	L	88.1	Confident	88.4	Confident	59 Å²	59	73.9 Å²	73.9	31%	0.309	35%	0.349	S	S	.	.	H	α-helix	trans	-65.7	-42.3	172.5	-71.6	171.4	0	0	0	111.7	R26 L28 W32 K36 F103 F107	R26-L30 WeakPolarHBondContact O-CG 3.3Å; R26-L30 PolarHBondContact O-N 3.3Å; L28-L30 VanDerWaalsContact C-N 3.32Å; L28-L30 PolarHBondContact O-N 3.45Å; L30-W32 PolarHBondContact O-N 3.01Å; L30-K36 WeakPolarHBondContact O-CD 3.36Å; L30-F103 HydrophobicContact CD2-CE2 4.49Å; L30-F103 HydrophobicContact CD2-CZ 4.31Å; L30-F107 HydrophobicContact CD1-CE1 4.35Å; L30-F107 HydrophobicContact CD1-CZ 4.34Å; L30-F107 HydrophobicContact CD2-CE1 4.2Å; L30-F107 HydrophobicContact CD2-CZ 4.25Å; L30-F107 HydrophobicContact CG-CE1 4.3Å; L30-F107 HydrophobicContact CG-CZ 4.02Å
31	K	88.6	Confident	88.2	Confident	128 Å²	128	74.6 Å²	74.6	56%	0.557	35%	0.35	S	S	*	.	H	α-helix	trans	-63.2	-40.6	-179.2	-175.9	176	179.7	178.9	0	112.6	R27 L28 N37	R27-K31 WeakPolarHBondContact O-CB 3.24Å; R27-K31 PolarHBondContact O-N 2.76Å; L28-K31 PolarHBondContact O-N 2.91Å; L28-K31 VanDerWaalsContact O-N 3.14Å; K31-N37 PolarHBondContact O-ND2 2.98Å
32	W	89.9	Confident	88.1	Confident	63 Å²	63	81.3 Å²	81.3	24%	0.239	38%	0.382	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103	16.6	-175.7	-67.6	109	0	0	0	113.6	L28 L30 A44 C47 I51	L28-W32 PolarHBondContact O-N 2.76Å; L30-W32 PolarHBondContact O-N 3.01Å; W32-A44 HydrophobicContact CE3-CB 4.25Å; W32-C47 HydrophobicContact CB-CB 4.15Å; W32-C47 HydrophobicContact CD2-CB 3.58Å; W32-C47 HydrophobicContact CE3-CB 3.88Å; W32-C47 HydrophobicContact CG-CB 3.74Å; W32-C47 HydrophobicContact CZ2-CB 4.47Å; W32-C47 HydrophobicContact CZ3-CB 4.41Å; W32-I51 HydrophobicContact CB-CD1 4.15Å; W32-I51 HydrophobicContact CG-CD1 4.01Å
33	H	86.4	Confident	88	Confident	44 Å²	44	82 Å²	82	20%	0.204	39%	0.386	C	S	.	.			trans	-65.1	136.7	175.2	-165.6	-93.6	0	0	0	109.7	A29 D35 K36 N37	A29-H33 WeakPolarHBondContact O-CB 3.37Å; A29-H33 PolarHBondContact O-N 2.72Å; A29-H33 VanDerWaalsContact O-N 3.08Å; H33-D35 WeakPolarHBondContact ND1-CB 3.27Å; H33-D35 PolarHBondContact ND1-N 3.28Å; H33-D35 PolarHBondContact O-N 2.78Å; H33-K36 PolarHBondContact O-N 3.31Å; H33-N37 PolarHBondContact O-N 2.75Å; H33-N37 PolarHBondContact O-ND2 2.74Å
34	P	84.2	Confident	87.8	Confident	30 Å²	30	74.9 Å²	74.9	20%	0.195	36%	0.355	C	S	.	.	G	3₁₀ helix	trans	-60.3	-30.2	-178.5	22.9	-34.2	0	0	0	112.6	K36 N37 M100	P34-K36 VanDerWaalsContact C-N 3.33Å; P34-K36 PolarHBondContact O-N 2.85Å; P34-N37 CarbonylContact O-C 3.59Å; P34-N37 PolarHBondContact O-N 2.71Å; P34-M100 HydrophobicContact CG-CE 3.71Å
35	D	84.7	Confident	87.6	Confident	126 Å²	126	79 Å²	79	67%	0.674	37%	0.374	S	S	*	.	G	3₁₀ helix	trans	-63.7	-34.4	174.4	-167	56.8	0	0	0	113.1	H33	H33-D35 WeakPolarHBondContact ND1-CB 3.27Å; H33-D35 PolarHBondContact ND1-N 3.28Å; H33-D35 PolarHBondContact O-N 2.78Å
36	K	85.3	Confident	87.5	Confident	136 Å²	136	85.6 Å²	85.6	59%	0.591	40%	0.402	S	S	*	.	G	3₁₀ helix	trans	-83.2	-14.7	178.5	-69.2	-155.5	-170.8	-78.5	0	113.6	L30 H33 P34 P38	L30-K36 WeakPolarHBondContact O-CD 3.36Å; H33-K36 PolarHBondContact O-N 3.31Å; P34-K36 VanDerWaalsContact C-N 3.33Å; P34-K36 PolarHBondContact O-N 2.85Å; K36-P38 WeakPolarHBondContact O-CD 3.23Å
37	N	85.6	Confident	87.4	Confident	39 Å²	39	84.4 Å²	84.4	21%	0.209	40%	0.403	C	S	.	.			trans	-128.2	61.2	-174.5	-59.2	-87.9	0	0	0	110.4	K31 H33 P34 D39 K40 K41 A44	K31-N37 PolarHBondContact O-ND2 2.98Å; H33-N37 PolarHBondContact O-N 2.75Å; H33-N37 PolarHBondContact O-ND2 2.74Å; P34-N37 CarbonylContact O-C 3.59Å; P34-N37 PolarHBondContact O-N 2.71Å; N37-D39 PolarHBondContact O-N 3.43Å; N37-K40 CarbonylContact O-C 3.59Å; N37-K40 PolarHBondContact O-N 2.62Å; N37-K41 PolarHBondContact O-N 2.93Å; N37-A44 HydrophobicContact CB-CB 3.81Å
38	P	83.5	Confident	87.4	Confident	94 Å²	94	78.1 Å²	78.1	61%	0.61	38%	0.379	S	S	*	.	G	3₁₀ helix	trans	-60.6	-34.6	-178.5	25.4	-34.1	0	0	0	112.2	K36 K40	K36-P38 WeakPolarHBondContact O-CD 3.23Å; P38-K40 VanDerWaalsContact C-N 3.34Å; P38-K40 PolarHBondContact O-N 3.22Å
39	D	86.7	Confident	87.2	Confident	158 Å²	158	81.7 Å²	81.7	85%	0.845	39%	0.394	S	S	*	.	G	3₁₀ helix	trans	-74.1	-24.6	-178.2	-53.4	-44.5	0	0	0	113.4	N37	N37-D39 PolarHBondContact O-N 3.43Å
40	K	88.5	Confident	87.2	Confident	114 Å²	114	85.1 Å²	85.1	50%	0.496	41%	0.412	S	S	.	.	G	3₁₀ helix	trans	-127.3	42.7	-172.1	-68.7	-178	162.9	-142.8	0	111.6	N37 P38 E42 E43 A44	N37-K40 CarbonylContact O-C 3.59Å; N37-K40 PolarHBondContact O-N 2.62Å; P38-K40 VanDerWaalsContact C-N 3.34Å; P38-K40 PolarHBondContact O-N 3.22Å; K40-E42 VanDerWaalsContact C-N 3.29Å; K40-E42 PolarHBondContact O-N 3.26Å; K40-E43 HydrophobicContact CB-CB 4.4Å; K40-E43 WeakPolarHBondContact CD-OE2 3.35Å; K40-E43 IonicContact NZ-OE2 2.95Å; K40-E43 PolarHBondContact NZ-OE2 3.09Å; K40-E43 VanDerWaalsContact NZ-OE2 3.12Å; K40-E43 PolarHBondContact O-N 3.12Å; K40-A44 VanDerWaalsContact O-CB 3.31Å; K40-A44 WeakPolarHBondContact O-CB 3.39Å; K40-A44 PolarHBondContact O-N 3.31Å
41	K	87.7	Confident	87.3	Confident	122 Å²	122	82.5 Å²	82.5	53%	0.53	40%	0.398	S	S	.	.	H	α-helix	trans	-53.8	-44.6	-175.2	-174.3	175.4	172.6	-179.1	0	112.6	N37 A44 E45	N37-K41 PolarHBondContact O-N 2.93Å; K41-A44 PolarHBondContact O-N 2.75Å; K41-E45 WeakPolarHBondContact CE-OE1 2.94Å; K41-E45 HydrophobicContact CG-CG 4.4Å; K41-E45 WeakPolarHBondContact CG-OE1 3.35Å; K41-E45 WeakPolarHBondContact O-CB 3.46Å; K41-E45 VanDerWaalsContact O-CG 3.28Å; K41-E45 WeakPolarHBondContact O-CG 3.4Å; K41-E45 PolarHBondContact O-N 3.05Å
42	E	87.6	Confident	87.4	Confident	141 Å²	141	76.4 Å²	76.4	66%	0.659	37%	0.371	S	S	*	.	H	α-helix	trans	-65.9	-42.8	-179.3	-64	-172.8	-172.5	0	0	113.5	K40 K46	K40-E42 VanDerWaalsContact C-N 3.29Å; K40-E42 PolarHBondContact O-N 3.26Å; E42-K46 WeakPolarHBondContact O-CB 3.33Å; E42-K46 VanDerWaalsContact O-CG 3.29Å; E42-K46 WeakPolarHBondContact O-CG 3.41Å; E42-K46 PolarHBondContact O-N 2.8Å; E42-K46 VanDerWaalsContact O-N 3.08Å
43	E	88.2	Confident	87.3	Confident	96 Å²	96	74.9 Å²	74.9	45%	0.449	37%	0.367	S	S	.	.	H	α-helix	trans	-66.2	-42.3	176.3	-68.3	179.9	-178.1	0	0	110.3	K40 K46 C47	K40-E43 HydrophobicContact CB-CB 4.4Å; K40-E43 WeakPolarHBondContact CD-OE2 3.35Å; K40-E43 IonicContact NZ-OE2 2.95Å; K40-E43 PolarHBondContact NZ-OE2 3.09Å; K40-E43 VanDerWaalsContact NZ-OE2 3.12Å; K40-E43 PolarHBondContact O-N 3.12Å; E43-K46 PolarHBondContact O-N 3.06Å; E43-C47 WeakPolarHBondContact O-CB 3.36Å; E43-C47 PolarHBondContact O-N 2.79Å; E43-C47 PolarHBondContact O-SG 2.84Å; E43-C47 VanDerWaalsContact O-SG 3.33Å
44	A	87.5	Confident	87.4	Confident	0 Å²	0	72.8 Å²	72.8	0%	0	36%	0.357	C	S	.	.	H	α-helix	trans	-62.3	-45.3	178	0	0	0	0	0	111.9	W32 N37 K40 K41 C47 F48	W32-A44 HydrophobicContact CE3-CB 4.25Å; N37-A44 HydrophobicContact CB-CB 3.81Å; K40-A44 VanDerWaalsContact O-CB 3.31Å; K40-A44 WeakPolarHBondContact O-CB 3.39Å; K40-A44 PolarHBondContact O-N 3.31Å; K41-A44 PolarHBondContact O-N 2.75Å; A44-C47 PolarHBondContact O-N 3.02Å; A44-F48 WeakPolarHBondContact O-CB 3.49Å; A44-F48 PolarHBondContact O-N 3.25Å
45	E	87.7	Confident	87.7	Confident	94 Å²	94	72.4 Å²	72.4	44%	0.439	35%	0.352	S	S	.	.	H	α-helix	trans	-62.2	-44.6	176.2	-76.1	176.4	-176.7	0	0	112.2	K41 F48 K49	K41-E45 WeakPolarHBondContact CE-OE1 2.94Å; K41-E45 HydrophobicContact CG-CG 4.4Å; K41-E45 WeakPolarHBondContact CG-OE1 3.35Å; K41-E45 WeakPolarHBondContact O-CB 3.46Å; K41-E45 VanDerWaalsContact O-CG 3.28Å; K41-E45 WeakPolarHBondContact O-CG 3.4Å; K41-E45 PolarHBondContact O-N 3.05Å; E45-F48 PolarHBondContact O-N 3.39Å; E45-K49 WeakPolarHBondContact O-CB 3.17Å; E45-K49 PolarHBondContact O-N 3.13Å
46	K	87.7	Confident	87.9	Confident	137 Å²	137	67.4 Å²	67.4	60%	0.596	33%	0.325	S	S	*	.	H	α-helix	trans	-60.9	-48.7	176.2	-73.9	170.6	-175.9	166.9	0	111.4	E42 E43 K49 L50	E42-K46 WeakPolarHBondContact O-CB 3.33Å; E42-K46 VanDerWaalsContact O-CG 3.29Å; E42-K46 WeakPolarHBondContact O-CG 3.41Å; E42-K46 PolarHBondContact O-N 2.8Å; E42-K46 VanDerWaalsContact O-N 3.08Å; E43-K46 PolarHBondContact O-N 3.06Å; K46-K49 PolarHBondContact O-N 3.08Å; K46-L50 WeakPolarHBondContact O-CG 3.3Å; K46-L50 PolarHBondContact O-N 2.92Å; K46-L50 VanDerWaalsContact O-N 3.13Å
47	C	86.8	Confident	88	Confident	36 Å²	36	61.4 Å²	61.4	24%	0.243	30%	0.299	C	S	.	.	H	α-helix	trans	-61.5	-46.1	176.7	-74.3	0	0	0	0	111.6	W32 E43 A44 K49 L50 I51	W32-C47 HydrophobicContact CB-CB 4.15Å; W32-C47 HydrophobicContact CD2-CB 3.58Å; W32-C47 HydrophobicContact CE3-CB 3.88Å; W32-C47 HydrophobicContact CG-CB 3.74Å; W32-C47 HydrophobicContact CZ2-CB 4.47Å; W32-C47 HydrophobicContact CZ3-CB 4.41Å; E43-C47 WeakPolarHBondContact O-CB 3.36Å; E43-C47 PolarHBondContact O-N 2.79Å; E43-C47 PolarHBondContact O-SG 2.84Å; E43-C47 VanDerWaalsContact O-SG 3.33Å; A44-C47 PolarHBondContact O-N 3.02Å; C47-K49 VanDerWaalsContact C-N 3.32Å; C47-K49 PolarHBondContact O-N 2.63Å; C47-L50 PolarHBondContact O-N 3.41Å; C47-I51 HydrophobicContact CB-CD1 4.48Å; C47-I51 WeakPolarHBondContact O-CB 3.37Å; C47-I51 VanDerWaalsContact O-CD1 3.29Å; C47-I51 WeakPolarHBondContact O-CD1 3.5Å; C47-I51 WeakPolarHBondContact O-CG1 3.18Å; C47-I51 PolarHBondContact O-N 3.45Å
48	F	88.6	Confident	88.2	Confident	6 Å²	6	59.7 Å²	59.7	3%	0.026	29%	0.29	C	S	.	.	H	α-helix	trans	-62.8	-38.6	-179	-173.7	-105.1	0	0	0	112.2	A29 A44 E45 I51 S52 P99 M100 F103	A29-F48 HydrophobicContact CB-CD2 4.48Å; A29-F48 HydrophobicContact CB-CE2 3.92Å; A44-F48 WeakPolarHBondContact O-CB 3.49Å; A44-F48 PolarHBondContact O-N 3.25Å; E45-F48 PolarHBondContact O-N 3.39Å; F48-I51 PolarHBondContact O-N 3.39Å; F48-S52 WeakPolarHBondContact O-CB 3.37Å; F48-S52 PolarHBondContact O-N 3.3Å; F48-S52 PolarHBondContact O-OG 3.05Å; F48-P99 HydrophobicContact CD1-CB 3.55Å; F48-P99 HydrophobicContact CE1-CB 3.35Å; F48-P99 HydrophobicContact CZ-CB 4.41Å; F48-M100 HydrophobicContact CD1-CE 3.99Å; F48-M100 HydrophobicContact CE1-CE 3.52Å; F48-M100 HydrophobicContact CE1-CG 4.33Å; F48-M100 HydrophobicContact CE1-SD 3.76Å; F48-M100 HydrophobicContact CZ-CE 4.06Å; F48-M100 HydrophobicContact CZ-SD 3.99Å; F48-F103 HydrophobicContact CE2-CD2 4.17Å; F48-F103 HydrophobicContact CZ-CB 3.96Å; F48-F103 HydrophobicContact CZ-CD2 4.2Å; F48-F103 HydrophobicContact CZ-CG 4.29Å
49	K	88.5	Confident	88.3	Confident	93 Å²	93	56.8 Å²	56.8	40%	0.404	27%	0.272	S	S	.	.	H	α-helix	trans	-61.9	-49.5	173.4	-171.3	174.6	-179.6	178.6	0	111.3	E45 K46 C47 I51 S52 E53 P99	E45-K49 WeakPolarHBondContact O-CB 3.17Å; E45-K49 PolarHBondContact O-N 3.13Å; K46-K49 PolarHBondContact O-N 3.08Å; C47-K49 VanDerWaalsContact C-N 3.32Å; C47-K49 PolarHBondContact O-N 2.63Å; K49-I51 VanDerWaalsContact C-N 3.35Å; K49-I51 PolarHBondContact O-N 3.45Å; K49-S52 PolarHBondContact O-N 3.36Å; K49-E53 WeakPolarHBondContact O-CB 3.47Å; K49-E53 PolarHBondContact O-N 3.42Å; K49-P99 HydrophobicContact CG-CG 4.37Å
50	L	88.8	Confident	88.4	Confident	71 Å²	71	52.4 Å²	52.4	37%	0.372	25%	0.249	S	C	.	.	H	α-helix	trans	-61.7	-39.8	177.9	-70.6	171.7	0	0	0	113	I9 K46 C47 E53 A54	I9-L50 HydrophobicContact CD1-CB 4.41Å; I9-L50 HydrophobicContact CG2-CB 4.31Å; K46-L50 WeakPolarHBondContact O-CG 3.3Å; K46-L50 PolarHBondContact O-N 2.92Å; K46-L50 VanDerWaalsContact O-N 3.13Å; C47-L50 PolarHBondContact O-N 3.41Å; L50-E53 PolarHBondContact O-N 2.92Å; L50-A54 WeakPolarHBondContact O-CB 3.38Å; L50-A54 PolarHBondContact O-N 2.79Å
51	I	90.8	Very high	88.3	Confident	4 Å²	4	52 Å²	52	2%	0.021	26%	0.257	C	S	.	.	H	α-helix	trans	-64.8	-41.4	177.4	-71.4	157	0	0	0	111	I9 L10 Y25 L28 W32 C47 F48 K49 A54 Y55	I9-I51 HydrophobicContact CG2-CG1 4.05Å; L10-I51 HydrophobicContact CD2-CG2 4.06Å; Y25-I51 HydrophobicContact CD2-CG2 3.55Å; Y25-I51 HydrophobicContact CE2-CG2 3.89Å; L28-I51 HydrophobicContact CB-CD1 3.72Å; L28-I51 HydrophobicContact CB-CG1 4.15Å; L28-I51 HydrophobicContact CB-CG2 4.02Å; L28-I51 HydrophobicContact CD1-CG1 4.41Å; W32-I51 HydrophobicContact CB-CD1 4.15Å; W32-I51 HydrophobicContact CG-CD1 4.01Å; C47-I51 HydrophobicContact CB-CD1 4.48Å; C47-I51 WeakPolarHBondContact O-CB 3.37Å; C47-I51 VanDerWaalsContact O-CD1 3.29Å; C47-I51 WeakPolarHBondContact O-CD1 3.5Å; C47-I51 WeakPolarHBondContact O-CG1 3.18Å; C47-I51 PolarHBondContact O-N 3.45Å; F48-I51 PolarHBondContact O-N 3.39Å; K49-I51 VanDerWaalsContact C-N 3.35Å; K49-I51 PolarHBondContact O-N 3.45Å; I51-A54 PolarHBondContact O-N 3.33Å; I51-Y55 WeakPolarHBondContact O-CB 2.89Å; I51-Y55 PolarHBondContact O-N 2.86Å
52	S	90.2	Very high	88.2	Confident	0 Å²	0	54.2 Å²	54.2	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-69.5	-38.4	178.6	-56.8	0	0	0	0	111.6	F48 K49 Y55 E56 P99	F48-S52 WeakPolarHBondContact O-CB 3.37Å; F48-S52 PolarHBondContact O-N 3.3Å; F48-S52 PolarHBondContact O-OG 3.05Å; K49-S52 PolarHBondContact O-N 3.36Å; S52-Y55 PolarHBondContact O-N 3.31Å; S52-E56 PolarHBondContact O-N 2.93Å; S52-P99 WeakPolarHBondContact OG-CB 3.49Å
53	E	87.9	Confident	88.1	Confident	31 Å²	31	49.1 Å²	49.1	15%	0.145	24%	0.243	C	C	.	.	H	α-helix	trans	-59.4	-50.1	171.8	-159.9	-171	134	0	0	112.4	Y6 K49 L50 Y55 E56 V57 F91 F96	Y6-E53 HydrophobicContact CE1-CB 4.45Å; Y6-E53 HydrophobicContact CE1-CG 4.08Å; Y6-E53 WeakPolarHBondContact CE1-OE1 3.4Å; Y6-E53 PolarHBondContact OH-OE1 3.08Å; K49-E53 WeakPolarHBondContact O-CB 3.47Å; K49-E53 PolarHBondContact O-N 3.42Å; L50-E53 PolarHBondContact O-N 2.92Å; E53-Y55 VanDerWaalsContact C-N 3.28Å; E53-Y55 PolarHBondContact O-N 3.39Å; E53-E56 PolarHBondContact O-N 2.9Å; E53-V57 PolarHBondContact O-N 3.23Å; E53-F91 VanDerWaalsContact CD-CZ 3.5Å; E53-F91 HydrophobicContact CG-CE1 3.92Å; E53-F91 HydrophobicContact CG-CE2 4.01Å; E53-F91 HydrophobicContact CG-CZ 3.28Å; E53-F91 WeakPolarHBondContact OE1-CE2 3.17Å; E53-F91 WeakPolarHBondContact OE1-CZ 3.41Å; E53-F96 HydrophobicContact CB-CE2 3.89Å; E53-F96 HydrophobicContact CB-CZ 3.87Å; E53-F96 HydrophobicContact CG-CD2 4.46Å; E53-F96 HydrophobicContact CG-CE2 4Å; E53-F96 HydrophobicContact CG-CZ 4.31Å
54	A	89.4	Confident	88.1	Confident	0 Å²	0	46.6 Å²	46.6	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-59.2	-41.1	176.7	0	0	0	0	0	112.1	Y6 I9 L10 L50 I51 L58	Y6-A54 VanDerWaalsContact CD1-CA 3.44Å; Y6-A54 HydrophobicContact CD1-CB 3.6Å; Y6-A54 HydrophobicContact CG-CB 3.98Å; I9-A54 HydrophobicContact CB-CB 4.33Å; I9-A54 HydrophobicContact CG2-CB 4.14Å; L10-A54 HydrophobicContact CD1-CB 4.15Å; L10-A54 HydrophobicContact CD2-CB 4.21Å; L10-A54 HydrophobicContact CG-CB 3.84Å; L50-A54 WeakPolarHBondContact O-CB 3.38Å; L50-A54 PolarHBondContact O-N 2.79Å; I51-A54 PolarHBondContact O-N 3.33Å; A54-L58 VanDerWaalsContact O-CB 3.23Å; A54-L58 WeakPolarHBondContact O-CB 3.44Å; A54-L58 VanDerWaalsContact O-CG 3.24Å; A54-L58 WeakPolarHBondContact O-CG 3.49Å; A54-L58 PolarHBondContact O-N 3.29Å
55	Y	90.7	Very high	87.9	Confident	23 Å²	23	49.8 Å²	49.8	9%	0.09	25%	0.246	C	C	.	.	H	α-helix	trans	-67.5	-44.2	178.8	178.1	-102.6	0	0	0	112.2	I21 K22 Y25 I51 S52 E53 V57 L58 S59 I102 V106	I21-Y55 HydrophobicContact CG2-CD2 3.9Å; I21-Y55 HydrophobicContact CG2-CE2 4.25Å; K22-Y55 HydrophobicContact CB-CE2 4.39Å; K22-Y55 HydrophobicContact CG-CE2 3.75Å; Y25-Y55 HydrophobicContact CD1-CD1 4.39Å; Y25-Y55 HydrophobicContact CD1-CD2 4.19Å; Y25-Y55 HydrophobicContact CD1-CE2 4.42Å; Y25-Y55 HydrophobicContact CD1-CG 4.17Å; Y25-Y55 VanDerWaalsContact CD2-CB 3.41Å; Y25-Y55 HydrophobicContact CD2-CD1 4.32Å; Y25-Y55 HydrophobicContact CD2-CD2 4.16Å; Y25-Y55 AromaticContact CD2-CG 3.7Å; Y25-Y55 HydrophobicContact CD2-CG 3.7Å; Y25-Y55 HydrophobicContact CE2-CD1 4.45Å; Y25-Y55 HydrophobicContact CE2-CG 4.24Å; Y25-Y55 HydrophobicContact CG-CD1 4.29Å; Y25-Y55 AromaticContact CG-CD2 3.69Å; Y25-Y55 HydrophobicContact CG-CD2 3.69Å; Y25-Y55 HydrophobicContact CG-CE2 4.32Å; Y25-Y55 AromaticContact CG-CG 3.66Å; Y25-Y55 HydrophobicContact CG-CG 3.66Å; I51-Y55 WeakPolarHBondContact O-CB 2.89Å; I51-Y55 PolarHBondContact O-N 2.86Å; S52-Y55 PolarHBondContact O-N 3.31Å; E53-Y55 VanDerWaalsContact C-N 3.28Å; E53-Y55 PolarHBondContact O-N 3.39Å; Y55-V57 VanDerWaalsContact C-N 3.31Å; Y55-V57 PolarHBondContact O-N 3.31Å; Y55-L58 PolarHBondContact O-N 3.47Å; Y55-S59 WeakPolarHBondContact O-CB 3.29Å; Y55-S59 PolarHBondContact O-N 3.37Å; Y55-S59 PolarHBondContact O-OG 3.22Å; Y55-I102 HydrophobicContact CD1-CG2 3.63Å; Y55-I102 HydrophobicContact CE1-CG2 3.96Å; Y55-V106 HydrophobicContact CD1-CG2 4.35Å; Y55-V106 HydrophobicContact CE1-CG2 3.44Å; Y55-V106 VanDerWaalsContact CE1-CG2 3.44Å
56	E	88	Confident	87.6	Confident	21 Å²	21	50.9 Å²	50.9	10%	0.098	25%	0.253	C	S	.	.	H	α-helix	trans	-61.3	-41.2	-179	-160.2	-167.4	132.9	0	0	111.7	S52 E53 S59 K63 F96 R97 I102	S52-E56 PolarHBondContact O-N 2.93Å; E53-E56 PolarHBondContact O-N 2.9Å; E56-S59 PolarHBondContact O-OG 3.12Å; E56-K63 IonicContact OE1-NZ 3.12Å; E56-K63 PolarHBondContact OE1-NZ 2.82Å; E56-F96 HydrophobicContact CB-CE2 4.21Å; E56-F96 WeakPolarHBondContact OE2-CA 3.41Å; E56-F96 WeakPolarHBondContact OE2-CD2 3.4Å; E56-F96 VanDerWaalsContact OE2-CE2 3.3Å; E56-F96 WeakPolarHBondContact OE2-CE2 3.15Å; E56-R97 PolarHBondContact OE2-N 3.06Å; E56-I102 HydrophobicContact CB-CD1 4.37Å
57	V	88	Confident	87.2	Confident	9 Å²	9	45 Å²	45	6%	0.055	23%	0.227	C	C	.	.	H	α-helix	trans	-73.5	-42.8	179	177.8	0	0	0	0	111.9	Y6 E53 Y55 K63 R64 Y67	Y6-V57 HydrophobicContact CD2-CB 4.03Å; Y6-V57 HydrophobicContact CD2-CG1 3.92Å; Y6-V57 HydrophobicContact CD2-CG2 4.45Å; Y6-V57 HydrophobicContact CE2-CB 3.88Å; Y6-V57 HydrophobicContact CE2-CG1 3.8Å; Y6-V57 HydrophobicContact CE2-CG2 3.81Å; E53-V57 PolarHBondContact O-N 3.23Å; Y55-V57 VanDerWaalsContact C-N 3.31Å; Y55-V57 PolarHBondContact O-N 3.31Å; V57-K63 HydrophobicContact CG1-CB 4.33Å; V57-K63 CarbonylContact O-C 3.47Å; V57-K63 VanDerWaalsContact O-CB 3.27Å; V57-K63 WeakPolarHBondContact O-CB 3.47Å; V57-R64 PolarHBondContact O-N 2.85Å; V57-Y67 HydrophobicContact CG1-CD2 4.33Å; V57-Y67 HydrophobicContact CG1-CG 4.09Å
58	L	88.9	Confident	87.1	Confident	3 Å²	3	46.5 Å²	46.5	2%	0.016	23%	0.233	C	C	.	.	H	α-helix	trans	-83.7	-23.2	-173.6	-65.6	179.3	0	0	0	114	Y7 L10 I12 I21 A54 Y55 R64 Y67	Y7-L58 HydrophobicContact CD1-CD1 3.99Å; Y7-L58 HydrophobicContact CD1-CD2 4.38Å; Y7-L58 HydrophobicContact CE1-CD1 4.1Å; Y7-L58 HydrophobicContact CE1-CD2 3.76Å; Y7-L58 HydrophobicContact CE2-CD2 4.01Å; Y7-L58 HydrophobicContact CG-CD1 4.39Å; L10-L58 HydrophobicContact CD1-CD1 3.87Å; I12-L58 HydrophobicContact CD1-CD1 4.25Å; I21-L58 HydrophobicContact CD1-CB 4.1Å; I21-L58 HydrophobicContact CG2-CB 4.09Å; A54-L58 VanDerWaalsContact O-CB 3.23Å; A54-L58 WeakPolarHBondContact O-CB 3.44Å; A54-L58 VanDerWaalsContact O-CG 3.24Å; A54-L58 WeakPolarHBondContact O-CG 3.49Å; A54-L58 PolarHBondContact O-N 3.29Å; Y55-L58 PolarHBondContact O-N 3.47Å; L58-R64 HydrophobicContact CD2-CG 4.08Å; L58-Y67 HydrophobicContact CD2-CD1 4.21Å; L58-Y67 HydrophobicContact CD2-CE1 4.49Å
59	S	86.9	Confident	86.6	Confident	33 Å²	33	55.4 Å²	55.4	23%	0.231	27%	0.266	C	S	.	.	H	α-helix	trans	-72.5	-35.6	179.5	60.3	0	0	0	0	112.7	Y55 E56	Y55-S59 WeakPolarHBondContact O-CB 3.29Å; Y55-S59 PolarHBondContact O-N 3.37Å; Y55-S59 PolarHBondContact O-OG 3.22Å; E56-S59 PolarHBondContact O-OG 3.12Å
60	D	87.3	Confident	85.7	Confident	67 Å²	67	56.2 Å²	56.2	36%	0.358	27%	0.267	S	S	.	.	S	Bend	trans	-83.7	118.1	177	-77.9	-36.1	0	0	0	110.7	K62 K63 R64	D60-K62 PolarHBondContact O-N 2.79Å; D60-K62 VanDerWaalsContact O-N 3.12Å; D60-K63 HydrophobicContact CB-CB 3.89Å; D60-K63 HydrophobicContact CB-CD 3.92Å; D60-K63 HydrophobicContact CB-CG 3.77Å; D60-K63 PolarHBondContact O-N 2.7Å; D60-K63 WeakPolarHBondContact OD2-CD 3.46Å; D60-K63 WeakPolarHBondContact OD2-CE 3.45Å; D60-K63 IonicContact OD2-NZ 2.8Å; D60-K63 PolarHBondContact OD2-NZ 3.28Å; D60-R64 WeakPolarHBondContact O-CB 3.43Å; D60-R64 PolarHBondContact O-N 3.48Å
61	P	87.1	Confident	84.4	Confident	104 Å²	104	55.8 Å²	55.8	68%	0.675	28%	0.279	S	S	*	.	H	α-helix	trans	-60.3	-31.1	-177.4	23.6	-33.4	0	0	0	112.5	D65	P61-D65 VanDerWaalsContact O-CB 3.3Å; P61-D65 WeakPolarHBondContact O-CB 3.38Å; P61-D65 PolarHBondContact O-N 3.31Å
62	K	85.7	Confident	82.9	Confident	170 Å²	170	56.2 Å²	56.2	74%	0.739	28%	0.284	S	S	*	.	H	α-helix	trans	-68.4	-45.2	175.5	-66.2	-177.8	179.9	178.5	0	112.2	D60 M66	D60-K62 PolarHBondContact O-N 2.79Å; D60-K62 VanDerWaalsContact O-N 3.12Å; K62-M66 WeakPolarHBondContact O-CG 3.21Å; K62-M66 PolarHBondContact O-N 3.35Å
63	K	85.9	Confident	81.1	Confident	34 Å²	34	57.7 Å²	57.7	15%	0.148	29%	0.292	C	S	.	.	H	α-helix	trans	-70.3	-39.1	179.5	-64	-175.2	-173.2	161	0	110.8	E56 V57 D60 M66 Y67 F94	E56-K63 IonicContact OE1-NZ 3.12Å; E56-K63 PolarHBondContact OE1-NZ 2.82Å; V57-K63 HydrophobicContact CG1-CB 4.33Å; V57-K63 CarbonylContact O-C 3.47Å; V57-K63 VanDerWaalsContact O-CB 3.27Å; V57-K63 WeakPolarHBondContact O-CB 3.47Å; D60-K63 HydrophobicContact CB-CB 3.89Å; D60-K63 HydrophobicContact CB-CD 3.92Å; D60-K63 HydrophobicContact CB-CG 3.77Å; D60-K63 PolarHBondContact O-N 2.7Å; D60-K63 WeakPolarHBondContact OD2-CD 3.46Å; D60-K63 WeakPolarHBondContact OD2-CE 3.45Å; D60-K63 IonicContact OD2-NZ 2.8Å; D60-K63 PolarHBondContact OD2-NZ 3.28Å; K63-M66 PolarHBondContact O-N 3.45Å; K63-Y67 WeakPolarHBondContact O-CB 3.39Å; K63-Y67 PolarHBondContact O-N 2.95Å; K63-F94 HydrophobicContact CD-CD1 3.83Å; K63-F94 HydrophobicContact CD-CE1 3.89Å; K63-F94 HydrophobicContact CG-CD1 4.14Å; K63-F94 HydrophobicContact CG-CE1 3.66Å; K63-F94 HydrophobicContact CG-CZ 4.26Å
64	R	86.8	Confident	79.5	Confident	43 Å²	43	57.6 Å²	57.6	16%	0.162	29%	0.294	C	S	.	.	H	α-helix	trans	-60.1	-46.7	173.6	-176.3	176.4	177.5	177.2	0	111.9	Y7 K14 A16 V57 L58 D60 M66 Y67 D68	Y7-R64 PolarHBondContact OH-NE 3.25Å; Y7-R64 VanDerWaalsContact OH-NE 3.08Å; K14-R64 PolarHBondContact O-NH2 2.76Å; A16-R64 PolarHBondContact O-NH1 3Å; A16-R64 PolarHBondContact O-NH2 2.94Å; V57-R64 PolarHBondContact O-N 2.85Å; L58-R64 HydrophobicContact CD2-CG 4.08Å; D60-R64 WeakPolarHBondContact O-CB 3.43Å; D60-R64 PolarHBondContact O-N 3.48Å; R64-M66 PolarHBondContact O-N 2.92Å; R64-Y67 WeakPolarHBondContact O-CB 3.44Å; R64-Y67 PolarHBondContact O-N 3.25Å; R64-D68 IonicContact NE-OD2 3.88Å; R64-D68 WeakPolarHBondContact O-CB 2.95Å; R64-D68 VanDerWaalsContact O-CG 3.24Å; R64-D68 PolarHBondContact O-N 2.9Å
65	D	84.4	Confident	77.8	Confident	67 Å²	67	65.2 Å²	65.2	36%	0.358	33%	0.329	S	S	.	.	H	α-helix	trans	-62.6	-41.7	176	-178.3	46.5	0	0	0	111.5	P61 Y67 D68 R69	P61-D65 VanDerWaalsContact O-CB 3.3Å; P61-D65 WeakPolarHBondContact O-CB 3.38Å; P61-D65 PolarHBondContact O-N 3.31Å; D65-Y67 PolarHBondContact O-N 2.83Å; D65-D68 PolarHBondContact O-N 3.5Å; D65-R69 VanDerWaalsContact O-CB 3.27Å; D65-R69 WeakPolarHBondContact O-CB 3.49Å; D65-R69 WeakPolarHBondContact O-CG 3.44Å; D65-R69 PolarHBondContact O-N 2.94Å; D65-R69 IonicContact OD1-CZ 2.7Å; D65-R69 IonicContact OD1-NE 3.05Å; D65-R69 PolarHBondContact OD1-NE 2.99Å; D65-R69 IonicContact OD1-NH2 2.95Å; D65-R69 IonicContact OD2-CZ 3.9Å; D65-R69 IonicContact OD2-NE 2.82Å; D65-R69 PolarHBondContact OD2-NE 3.2Å; D65-R69 IonicContact OD2-NH2 3.67Å; D65-R69 PolarHBondContact OD2-NH2 3.2Å
66	M	80.3	Confident	75.7	Confident	116 Å²	116	69.7 Å²	69.7	57%	0.571	35%	0.354	S	S	*	.	H	α-helix	trans	-60.9	-42.3	173	-71.8	-179.9	177.6	0	0	112.6	K62 K63 R64 R70 F94	K62-M66 WeakPolarHBondContact O-CG 3.21Å; K62-M66 PolarHBondContact O-N 3.35Å; K63-M66 PolarHBondContact O-N 3.45Å; R64-M66 PolarHBondContact O-N 2.92Å; M66-R70 VanDerWaalsContact O-CB 3.27Å; M66-R70 WeakPolarHBondContact O-CB 3.28Å; M66-R70 PolarHBondContact O-N 3.03Å; M66-F94 HydrophobicContact SD-CZ 4.28Å
67	Y	81.3	Confident	73.6	Confident	14 Å²	14	70.1 Å²	70.1	6%	0.055	36%	0.364	C	S	.	.	H	α-helix	trans	-66.1	-43.7	177.2	177.1	-102.4	0	0	0	112.3	T4 C5 Y6 Y7 V57 L58 K63 R64 D65 R70 G72	T4-Y67 PolarHBondContact O-OH 3.37Å; T4-Y67 VanDerWaalsContact O-OH 3.07Å; C5-Y67 WeakPolarHBondContact CA-OH 3.36Å; Y6-Y67 HydrophobicContact CD2-CD1 4.26Å; Y6-Y67 AromaticContact CD2-CD2 3.63Å; Y6-Y67 HydrophobicContact CD2-CD2 3.63Å; Y6-Y67 AromaticContact CD2-CE1 3.93Å; Y6-Y67 HydrophobicContact CD2-CE1 3.93Å; Y6-Y67 AromaticContact CD2-CE2 3.26Å; Y6-Y67 HydrophobicContact CD2-CE2 3.26Å; Y6-Y67 HydrophobicContact CD2-CG 4.11Å; Y6-Y67 AromaticContact CD2-CZ 3.41Å; Y6-Y67 VanDerWaalsContact CD2-CZ 3.41Å; Y6-Y67 AromaticContact CE2-CD2 3.58Å; Y6-Y67 HydrophobicContact CE2-CD2 3.58Å; Y6-Y67 AromaticContact CE2-CE2 3.38Å; Y6-Y67 HydrophobicContact CE2-CE2 3.38Å; Y6-Y67 HydrophobicContact CE2-CG 4.38Å; Y6-Y67 HydrophobicContact CG-CE2 4.26Å; Y6-Y67 PolarHBondContact N-OH 3.43Å; Y6-Y67 VanDerWaalsContact N-OH 3.1Å; Y7-Y67 HydrophobicContact CD2-CE1 4Å; Y7-Y67 HydrophobicContact CE2-CD1 4.08Å; Y7-Y67 AromaticContact CE2-CE1 3.69Å; Y7-Y67 HydrophobicContact CE2-CE1 3.69Å; V57-Y67 HydrophobicContact CG1-CD2 4.33Å; V57-Y67 HydrophobicContact CG1-CG 4.09Å; L58-Y67 HydrophobicContact CD2-CD1 4.21Å; L58-Y67 HydrophobicContact CD2-CE1 4.49Å; K63-Y67 WeakPolarHBondContact O-CB 3.39Å; K63-Y67 PolarHBondContact O-N 2.95Å; R64-Y67 WeakPolarHBondContact O-CB 3.44Å; R64-Y67 PolarHBondContact O-N 3.25Å; D65-Y67 PolarHBondContact O-N 2.83Å; Y67-R70 PolarHBondContact O-N 3.33Å; Y67-G72 PolarHBondContact O-N 3.01Å; Y67-G72 PolarHBondContact OH-O 3.3Å; Y67-G72 VanDerWaalsContact OH-O 3.04Å
68	D	83.9	Confident	71.4	Confident	67 Å²	67	78.3 Å²	78.3	36%	0.358	40%	0.402	S	S	.	.	H	α-helix	trans	-68.2	-41.3	179.4	-70.7	-21.3	0	0	0	110.9	Y7 R64 D65 G71	Y7-D68 WeakPolarHBondContact CE2-OD1 3.4Å; Y7-D68 VanDerWaalsContact OH-CG 3.31Å; Y7-D68 PolarHBondContact OH-OD1 3.13Å; Y7-D68 PolarHBondContact OH-OD2 3.23Å; Y7-D68 VanDerWaalsContact OH-OD2 3.07Å; R64-D68 IonicContact NE-OD2 3.88Å; R64-D68 WeakPolarHBondContact O-CB 2.95Å; R64-D68 VanDerWaalsContact O-CG 3.24Å; R64-D68 PolarHBondContact O-N 2.9Å; D65-D68 PolarHBondContact O-N 3.5Å; D68-G71 PolarHBondContact O-N 3.48Å; D68-G71 VanDerWaalsContact O-N 3.12Å
69	R	78.6	Confident	69	Low	194 Å²	194	82.4 Å²	82.4	73%	0.732	44%	0.436	S	S	*	.	H	α-helix	trans	-65.8	-34.6	174.6	-73.5	179.6	-167.1	-161.3	8	113.3	D65 G71	D65-R69 VanDerWaalsContact O-CB 3.27Å; D65-R69 WeakPolarHBondContact O-CB 3.49Å; D65-R69 WeakPolarHBondContact O-CG 3.44Å; D65-R69 PolarHBondContact O-N 2.94Å; D65-R69 IonicContact OD1-CZ 2.7Å; D65-R69 IonicContact OD1-NE 3.05Å; D65-R69 PolarHBondContact OD1-NE 2.99Å; D65-R69 IonicContact OD1-NH2 2.95Å; D65-R69 IonicContact OD2-CZ 3.9Å; D65-R69 IonicContact OD2-NE 2.82Å; D65-R69 PolarHBondContact OD2-NE 3.2Å; D65-R69 IonicContact OD2-NH2 3.67Å; D65-R69 PolarHBondContact OD2-NH2 3.2Å; R69-G71 PolarHBondContact O-N 3.08Å; R69-G71 VanDerWaalsContact O-N 3.16Å
70	R	67.8	Low	66.5	Low	110 Å²	110	89.4 Å²	89.4	42%	0.415	46%	0.463	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.7	-1.5	174.3	-168.9	175.9	-98.5	-159.6	-5.5	112.4	M66 Y67 D73 P74 I76	M66-R70 VanDerWaalsContact O-CB 3.27Å; M66-R70 WeakPolarHBondContact O-CB 3.28Å; M66-R70 PolarHBondContact O-N 3.03Å; Y67-R70 PolarHBondContact O-N 3.33Å; R70-D73 WeakPolarHBondContact CD-O 3.5Å; R70-D73 WeakPolarHBondContact CG-O 3.38Å; R70-P74 PolarHBondContact NH1-O 3.07Å; R70-P74 VanDerWaalsContact NH1-O 3.08Å; R70-I76 WeakPolarHBondContact CG-O 3.4Å
71	G	62.9	Low	64.2	Low	62 Å²	62	92.4 Å²	92.4	64%	0.639	48%	0.483	S	S	*	.	T	Hydrogen-bonded Turn	trans	88.4	14.7	177.4	0	0	0	0	0	113.8	D68 R69 D73	D68-G71 PolarHBondContact O-N 3.48Å; D68-G71 VanDerWaalsContact O-N 3.12Å; R69-G71 PolarHBondContact O-N 3.08Å; R69-G71 VanDerWaalsContact O-N 3.16Å; G71-D73 PolarHBondContact O-N 2.79Å
72	G	58	Low	61.8	Low	12 Å²	12	95.7 Å²	95.7	12%	0.124	49%	0.487	C	S	.	.	S	Bend	trans	69.2	15.6	179.9	0	0	0	0	0	114.3	Y67	Y67-G72 PolarHBondContact O-N 3.01Å; Y67-G72 PolarHBondContact OH-O 3.3Å; Y67-G72 VanDerWaalsContact OH-O 3.04Å
73	D	53.1	Low	59.3	Low	32 Å²	32	96.6 Å²	96.6	17%	0.171	49%	0.494	C	S	.	.			trans	-118.6	115.1	171.2	-162.3	-29.4	0	0	0	108.3	R70 G71 H75 I76	R70-D73 WeakPolarHBondContact CD-O 3.5Å; R70-D73 WeakPolarHBondContact CG-O 3.38Å; G71-D73 PolarHBondContact O-N 2.79Å; D73-H75 PolarHBondContact O-N 3.15Å; D73-H75 WeakPolarHBondContact OD1-CB 3.31Å; D73-H75 PolarHBondContact OD1-N 2.83Å; D73-I76 HydrophobicContact CB-CB 4.04Å; D73-I76 HydrophobicContact CB-CD1 3.78Å; D73-I76 HydrophobicContact CB-CG1 3.71Å; D73-I76 PolarHBondContact O-N 3.14Å; D73-I76 WeakPolarHBondContact OD2-CD1 3.5Å
74	P	54.1	Low	57.3	Low	28 Å²	28	99 Å²	99	18%	0.182	53%	0.529	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.6	-16.9	175.3	23.4	-29.7	0	0	0	112.5	T4 R70	T4-P74 VanDerWaalsContact OG1-CG 3.25Å; T4-P74 WeakPolarHBondContact OG1-CG 3.36Å; R70-P74 PolarHBondContact NH1-O 3.07Å; R70-P74 VanDerWaalsContact NH1-O 3.08Å
75	H	53.2	Low	55.2	Low	160 Å²	160	99.8 Å²	99.8	74%	0.741	54%	0.544	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.2	-6.9	-177.8	-65	-45.6	0	0	0	115.9	D73 G77	D73-H75 PolarHBondContact O-N 3.15Å; D73-H75 WeakPolarHBondContact OD1-CB 3.31Å; D73-H75 PolarHBondContact OD1-N 2.83Å; H75-G77 PolarHBondContact O-N 3.23Å
76	I	48.1	Very low	53.6	Low	118 Å²	118	101.3 Å²	101.3	61%	0.605	55%	0.552	S	S	*	*			trans	-99.4	78.1	178.1	-57.5	177.9	0	0	0	109	R70 D73	R70-I76 WeakPolarHBondContact CG-O 3.4Å; D73-I76 HydrophobicContact CB-CB 4.04Å; D73-I76 HydrophobicContact CB-CD1 3.78Å; D73-I76 HydrophobicContact CB-CG1 3.71Å; D73-I76 PolarHBondContact O-N 3.14Å; D73-I76 WeakPolarHBondContact OD2-CD1 3.5Å
77	G	42.9	Very low	52.3	Low	30 Å²	30	102 Å²	102	31%	0.309	57%	0.566	S	S	.	*	S	Bend	trans	-172.2	85.7	175.9	0	0	0	0	0	110.9	H75	H75-G77 PolarHBondContact O-N 3.23Å
78	E	43.1	Very low	50.8	Low	181 Å²	181	108.1 Å²	108.1	85%	0.846	59%	0.593	S	S	*	*			trans	28.5	110.8	158.9	-73.8	175.3	151.9	0	0	117.5	F80	E78-F80 PolarHBondContact O-N 2.92Å
79	A	38	Very low	49.2	Very low	89 Å²	89	106.6 Å²	106.6	74%	0.736	59%	0.587	S	S	*	*			trans	-19.8	93	153.8	0	0	0	0	0	115.3	V81	A79-V81 HydrophobicContact CB-CG2 4.09Å
80	F	35.1	Very low	47.5	Very low	180 Å²	180	102.4 Å²	102.4	79%	0.789	58%	0.577	S	S	*	*			trans	-96.7	84.7	139.4	-99.4	-89.3	0	0	0	106.7	E78 F82	E78-F80 PolarHBondContact O-N 2.92Å; F80-F82 PolarHBondContact O-N 3.5Å; F80-F82 VanDerWaalsContact O-N 3.13Å
81	V	38.4	Very low	46.4	Very low	129 Å²	129	99.8 Å²	99.8	78%	0.782	57%	0.569	S	S	*	*			trans	-73.7	95.5	168	-177.7	0	0	0	0	106.1	A79	A79-V81 HydrophobicContact CB-CG2 4.09Å
82	F	35.4	Very low	45.8	Very low	174 Å²	174	101.1 Å²	101.1	76%	0.763	57%	0.565	S	S	*	*			trans	-86.3	115.3	158.1	-136.4	-90.2	0	0	0	106.5	F80 G84 A85	F80-F82 PolarHBondContact O-N 3.5Å; F80-F82 VanDerWaalsContact O-N 3.13Å; F82-G84 PolarHBondContact O-N 2.68Å; F82-A85 PolarHBondContact O-N 2.83Å
83	E	34.7	Very low	45.2	Very low	188 Å²	188	111.8 Å²	111.8	88%	0.879	60%	0.601	S	S	*	*	T	Hydrogen-bonded Turn	trans	-54.2	115.8	178.5	-168.5	167.3	170.8	0	0	109.8
84	G	43.3	Very low	45.1	Very low	86 Å²	86	113.4 Å²	113.4	89%	0.887	61%	0.607	S	S	*	*	T	Hydrogen-bonded Turn	trans	108.1	-0.3	173	0	0	0	0	0	117.6	F82	F82-G84 PolarHBondContact O-N 2.68Å
85	A	42.8	Very low	45.1	Very low	59 Å²	59	120.6 Å²	120.6	49%	0.488	64%	0.638	S	S	.	*			trans	-100.8	124.6	175.1	0	0	0	0	0	111.5	F82	F82-A85 PolarHBondContact O-N 2.83Å
86	D	49.7	Very low	45.4	Very low	98 Å²	98	115.6 Å²	115.6	52%	0.524	61%	0.614	S	S	.	*			trans	-43.9	136.9	171.1	46.1	-38.7	0	0	0	112.4	F88 S89	D86-F88 PolarHBondContact O-N 2.86Å; D86-S89 WeakPolarHBondContact O-CA 3.3Å; D86-S89 WeakPolarHBondContact O-CB 3.09Å; D86-S89 PolarHBondContact O-N 3.37Å; D86-S89 WeakPolarHBondContact OD1-CB 3.37Å
87	P	53.8	Low	46.3	Very low	132 Å²	132	116.6 Å²	116.6	86%	0.857	61%	0.61	S	S	*	*	T	Hydrogen-bonded Turn	trans	-56.7	-17.2	179.7	-24.8	32.2	0	0	0	114.4
88	F	50.4	Low	47.9	Very low	142 Å²	142	120.5 Å²	120.5	62%	0.623	62%	0.624	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81	-22.9	174.7	-144.3	-93.6	0	0	0	112.8	D86 F91	D86-F88 PolarHBondContact O-N 2.86Å; F88-F91 WeakPolarHBondContact O-CB 3.42Å; F88-F91 PolarHBondContact O-N 3.29Å
89	S	49.8	Very low	49.5	Very low	34 Å²	34	113 Å²	113	24%	0.238	59%	0.591	C	S	.	*	G	3₁₀ helix	trans	-82.5	-13.7	-177.3	-172.4	0	0	0	0	113.6	D86 F91 T92	D86-S89 WeakPolarHBondContact O-CA 3.3Å; D86-S89 WeakPolarHBondContact O-CB 3.09Å; D86-S89 PolarHBondContact O-N 3.37Å; D86-S89 WeakPolarHBondContact OD1-CB 3.37Å; S89-F91 PolarHBondContact O-N 3.29Å; S89-T92 WeakPolarHBondContact O-CB 3.3Å; S89-T92 PolarHBondContact O-N 3.06Å; S89-T92 PolarHBondContact O-OG1 3.4Å; S89-T92 PolarHBondContact OG-OG1 3.42Å
90	M	43.3	Very low	51.4	Low	107 Å²	107	111.7 Å²	111.7	53%	0.527	57%	0.57	S	S	.	*	G	3₁₀ helix	trans	-66.2	-18.5	168.9	-158.9	-176.2	-174.3	0	0	112.7	T92	M90-T92 VanDerWaalsContact C-N 3.29Å
91	F	45.4	Very low	53.4	Low	55 Å²	55	106.2 Å²	106.2	24%	0.241	55%	0.549	C	S	.	.	G	3₁₀ helix	trans	-72.4	-21.1	170.8	-165.5	-100.1	0	0	0	112.8	Y6 E53 F88 S89 R93 F94 F96	Y6-F91 WeakPolarHBondContact OH-CE2 3.46Å; E53-F91 VanDerWaalsContact CD-CZ 3.5Å; E53-F91 HydrophobicContact CG-CE1 3.92Å; E53-F91 HydrophobicContact CG-CE2 4.01Å; E53-F91 HydrophobicContact CG-CZ 3.28Å; E53-F91 WeakPolarHBondContact OE1-CE2 3.17Å; E53-F91 WeakPolarHBondContact OE1-CZ 3.41Å; F88-F91 WeakPolarHBondContact O-CB 3.42Å; F88-F91 PolarHBondContact O-N 3.29Å; S89-F91 PolarHBondContact O-N 3.29Å; F91-R93 PolarHBondContact O-N 3.45Å; F91-R93 VanDerWaalsContact O-N 3.13Å; F91-F94 PolarHBondContact O-N 2.85Å; F91-F96 HydrophobicContact CD1-CB 4.44Å; F91-F96 HydrophobicContact CE1-CB 4.01Å; F91-F96 AromaticContact CE1-CD2 3.76Å; F91-F96 HydrophobicContact CE1-CD2 3.76Å; F91-F96 AromaticContact CE1-CG 3.91Å; F91-F96 HydrophobicContact CE1-CG 3.91Å; F91-F96 HydrophobicContact CZ-CD2 4.35Å
92	T	48.2	Very low	55.3	Low	90 Å²	90	100.4 Å²	100.4	55%	0.552	51%	0.514	S	S	*	.	G	3₁₀ helix	trans	-78.8	5.1	-169.4	69.5	0	0	0	0	115.1	S89 M90 F94	S89-T92 WeakPolarHBondContact O-CB 3.3Å; S89-T92 PolarHBondContact O-N 3.06Å; S89-T92 PolarHBondContact O-OG1 3.4Å; S89-T92 PolarHBondContact OG-OG1 3.42Å; M90-T92 VanDerWaalsContact C-N 3.29Å; T92-F94 CarbonylContact C-O 3.48Å; T92-F94 PolarHBondContact O-N 3.49Å
93	R	45.4	Very low	57.4	Low	236 Å²	236	93.8 Å²	93.8	89%	0.891	49%	0.485	S	S	*	.	G	3₁₀ helix	trans	-66.2	-20	164.8	-162.2	171.9	-157.8	136	5.7	111.8	F91	F91-R93 PolarHBondContact O-N 3.45Å; F91-R93 VanDerWaalsContact O-N 3.13Å
94	F	51.7	Low	59.6	Low	65 Å²	65	90.6 Å²	90.6	29%	0.285	46%	0.464	S	S	.	.	S	Bend	trans	-98.7	124.4	163.4	-59.9	-67.1	0	0	0	107.9	K63 M66 F91 T92 F96	K63-F94 HydrophobicContact CD-CD1 3.83Å; K63-F94 HydrophobicContact CD-CE1 3.89Å; K63-F94 HydrophobicContact CG-CD1 4.14Å; K63-F94 HydrophobicContact CG-CE1 3.66Å; K63-F94 HydrophobicContact CG-CZ 4.26Å; M66-F94 HydrophobicContact SD-CZ 4.28Å; F91-F94 PolarHBondContact O-N 2.85Å; T92-F94 CarbonylContact C-O 3.48Å; T92-F94 PolarHBondContact O-N 3.49Å; F94-F96 PolarHBondContact O-N 2.86Å
95	H	55	Low	61.3	Low	180 Å²	180	91.8 Å²	91.8	83%	0.833	45%	0.447	S	S	*	.			trans	-68	79	174.5	-129.3	-88.5	0	0	0	107.7	R97	H95-R97 PolarHBondContact O-N 3.06Å
96	F	59	Low	62.8	Low	54 Å²	54	89.7 Å²	89.7	24%	0.237	43%	0.428	C	S	.	.			trans	-62.5	114.7	-175.4	-168.1	-108.7	0	0	0	108.3	E53 E56 F91 F94 P99 I102	E53-F96 HydrophobicContact CB-CE2 3.89Å; E53-F96 HydrophobicContact CB-CZ 3.87Å; E53-F96 HydrophobicContact CG-CD2 4.46Å; E53-F96 HydrophobicContact CG-CE2 4Å; E53-F96 HydrophobicContact CG-CZ 4.31Å; E56-F96 HydrophobicContact CB-CE2 4.21Å; E56-F96 WeakPolarHBondContact OE2-CA 3.41Å; E56-F96 WeakPolarHBondContact OE2-CD2 3.4Å; E56-F96 VanDerWaalsContact OE2-CE2 3.3Å; E56-F96 WeakPolarHBondContact OE2-CE2 3.15Å; F91-F96 HydrophobicContact CD1-CB 4.44Å; F91-F96 HydrophobicContact CE1-CB 4.01Å; F91-F96 AromaticContact CE1-CD2 3.76Å; F91-F96 HydrophobicContact CE1-CD2 3.76Å; F91-F96 AromaticContact CE1-CG 3.91Å; F91-F96 HydrophobicContact CE1-CG 3.91Å; F91-F96 HydrophobicContact CZ-CD2 4.35Å; F94-F96 PolarHBondContact O-N 2.86Å; F96-P99 HydrophobicContact CE1-CG 4.15Å; F96-I102 HydrophobicContact CE2-CD1 4.25Å; F96-I102 HydrophobicContact CZ-CD1 4.38Å
97	R	67.6	Low	64	Low	139 Å²	139	86.7 Å²	86.7	53%	0.525	41%	0.41	S	S	.	.			trans	-74.1	155.2	-179.4	-76	-172.2	163.2	175.7	-2.6	109.7	E56 H95 I102 E105	E56-R97 PolarHBondContact OE2-N 3.06Å; H95-R97 PolarHBondContact O-N 3.06Å; R97-I102 HydrophobicContact CB-CD1 4.09Å; R97-I102 HydrophobicContact CB-CG1 3.73Å; R97-E105 IonicContact CZ-OE2 2.75Å; R97-E105 IonicContact NH1-OE1 3.86Å; R97-E105 IonicContact NH1-OE2 3.28Å; R97-E105 PolarHBondContact NH1-OE2 2.87Å
98	D	76.7	Confident	64.9	Low	113 Å²	113	84.5 Å²	84.5	60%	0.604	40%	0.403	S	S	*	.			trans	-53.9	130.3	171.4	-84.4	-47.1	0	0	0	109.1	M100 D101 I102	D98-M100 PolarHBondContact O-N 3.44Å; D98-D101 HydrophobicContact CB-CB 4.22Å; D98-D101 WeakPolarHBondContact O-CA 3.46Å; D98-D101 WeakPolarHBondContact O-CB 3.27Å; D98-D101 PolarHBondContact O-N 2.7Å; D98-I102 PolarHBondContact O-N 3.39Å
99	P	77	Confident	65.3	Low	22 Å²	22	81 Å²	81	14%	0.143	41%	0.408	C	S	.	.	H	α-helix	trans	-51.5	-32.7	179.7	-33	38.4	0	0	0	113.3	F48 K49 S52 F96 F103	F48-P99 HydrophobicContact CD1-CB 3.55Å; F48-P99 HydrophobicContact CE1-CB 3.35Å; F48-P99 HydrophobicContact CZ-CB 4.41Å; K49-P99 HydrophobicContact CG-CG 4.37Å; S52-P99 WeakPolarHBondContact OG-CB 3.49Å; F96-P99 HydrophobicContact CE1-CG 4.15Å; P99-F103 WeakPolarHBondContact O-CB 3.44Å; P99-F103 PolarHBondContact O-N 3.3Å
100	M	76.4	Confident	65.7	Low	63 Å²	63	81.6 Å²	81.6	31%	0.31	41%	0.412	S	S	.	.	H	α-helix	trans	-71.7	-30.3	176.3	-67.3	-62.5	167.1	0	0	113	P34 F48 D98 R104	P34-M100 HydrophobicContact CG-CE 3.71Å; F48-M100 HydrophobicContact CD1-CE 3.99Å; F48-M100 HydrophobicContact CE1-CE 3.52Å; F48-M100 HydrophobicContact CE1-CG 4.33Å; F48-M100 HydrophobicContact CE1-SD 3.76Å; F48-M100 HydrophobicContact CZ-CE 4.06Å; F48-M100 HydrophobicContact CZ-SD 3.99Å; D98-M100 PolarHBondContact O-N 3.44Å; M100-R104 WeakPolarHBondContact O-CB 3.45Å; M100-R104 WeakPolarHBondContact O-CD 3.38Å; M100-R104 WeakPolarHBondContact O-CG 3.47Å; M100-R104 PolarHBondContact O-N 3.41Å
101	D	78.4	Confident	66	Low	64 Å²	64	78.4 Å²	78.4	34%	0.342	41%	0.406	S	S	.	.	H	α-helix	trans	-77.8	-37.3	176.2	-71.1	-16.1	0	0	0	111.5	D98 F103 R104 E105	D98-D101 HydrophobicContact CB-CB 4.22Å; D98-D101 WeakPolarHBondContact O-CA 3.46Å; D98-D101 WeakPolarHBondContact O-CB 3.27Å; D98-D101 PolarHBondContact O-N 2.7Å; D101-F103 VanDerWaalsContact C-N 3.29Å; D101-F103 PolarHBondContact O-N 2.85Å; D101-R104 CarbonylContact O-C 3.56Å; D101-R104 PolarHBondContact O-N 3.01Å; D101-R104 IonicContact OD1-CZ 3.59Å; D101-R104 IonicContact OD1-NH1 2.95Å; D101-R104 PolarHBondContact OD1-NH1 3.37Å; D101-E105 VanDerWaalsContact O-CB 3.28Å; D101-E105 WeakPolarHBondContact O-CB 3.42Å; D101-E105 PolarHBondContact O-N 3.02Å
102	I	77.5	Confident	66.4	Low	8 Å²	8	81.2 Å²	81.2	4%	0.041	42%	0.423	C	S	.	.	H	α-helix	trans	-60.4	-44.4	169.1	-60.5	172.1	0	0	0	109.4	Y25 Y55 E56 F96 R97 D98 E105 V106	Y25-I102 HydrophobicContact CE1-CG2 4.48Å; Y55-I102 HydrophobicContact CD1-CG2 3.63Å; Y55-I102 HydrophobicContact CE1-CG2 3.96Å; E56-I102 HydrophobicContact CB-CD1 4.37Å; F96-I102 HydrophobicContact CE2-CD1 4.25Å; F96-I102 HydrophobicContact CZ-CD1 4.38Å; R97-I102 HydrophobicContact CB-CD1 4.09Å; R97-I102 HydrophobicContact CB-CG1 3.73Å; D98-I102 PolarHBondContact O-N 3.39Å; I102-E105 PolarHBondContact O-N 3.12Å; I102-V106 HydrophobicContact CG2-CG2 4.26Å; I102-V106 WeakPolarHBondContact O-CB 3.28Å; I102-V106 VanDerWaalsContact O-CG2 3.22Å; I102-V106 WeakPolarHBondContact O-CG2 2.92Å; I102-V106 PolarHBondContact O-N 3.01Å
103	F	79.3	Confident	66.6	Low	34 Å²	34	82.7 Å²	82.7	15%	0.149	43%	0.428	C	S	.	.	H	α-helix	trans	-60.5	-48.1	175.5	-177.1	-90.4	0	0	0	111.3	Y25 A29 L30 F48 P99 D101 E105 V106 F107	Y25-F103 WeakPolarHBondContact OH-CA 3.13Å; Y25-F103 PolarHBondContact OH-N 3.19Å; A29-F103 HydrophobicContact CB-CD2 3.84Å; A29-F103 HydrophobicContact CB-CE2 3.96Å; L30-F103 HydrophobicContact CD2-CE2 4.49Å; L30-F103 HydrophobicContact CD2-CZ 4.31Å; F48-F103 HydrophobicContact CE2-CD2 4.17Å; F48-F103 HydrophobicContact CZ-CB 3.96Å; F48-F103 HydrophobicContact CZ-CD2 4.2Å; F48-F103 HydrophobicContact CZ-CG 4.29Å; P99-F103 WeakPolarHBondContact O-CB 3.44Å; P99-F103 PolarHBondContact O-N 3.3Å; D101-F103 VanDerWaalsContact C-N 3.29Å; D101-F103 PolarHBondContact O-N 2.85Å; F103-E105 VanDerWaalsContact C-N 3.32Å; F103-E105 PolarHBondContact O-N 2.8Å; F103-V106 PolarHBondContact O-N 2.78Å; F103-F107 HydrophobicContact CD1-CD2 4.11Å; F103-F107 HydrophobicContact CD1-CG 4.48Å; F103-F107 AromaticContact CD2-CD2 3.57Å; F103-F107 HydrophobicContact CD2-CD2 3.57Å; F103-F107 AromaticContact CD2-CE2 3.39Å; F103-F107 HydrophobicContact CD2-CE2 3.39Å; F103-F107 HydrophobicContact CD2-CZ 4.24Å; F103-F107 HydrophobicContact CE1-CB 4.44Å; F103-F107 HydrophobicContact CE1-CD2 4.01Å; F103-F107 HydrophobicContact CE1-CE2 4.41Å; F103-F107 HydrophobicContact CE1-CG 4.09Å; F103-F107 AromaticContact CE2-CD2 3.49Å; F103-F107 HydrophobicContact CE2-CD2 3.49Å; F103-F107 VanDerWaalsContact CE2-CD2 3.49Å; F103-F107 HydrophobicContact CE2-CE1 4.19Å; F103-F107 AromaticContact CE2-CE2 3.09Å; F103-F107 HydrophobicContact CE2-CE2 3.09Å; F103-F107 HydrophobicContact CE2-CG 4.19Å; F103-F107 AromaticContact CE2-CZ 3.49Å; F103-F107 HydrophobicContact CE2-CZ 3.49Å; F103-F107 VanDerWaalsContact CE2-CZ 3.49Å; F103-F107 AromaticContact CG-CD2 3.9Å; F103-F107 HydrophobicContact CG-CD2 3.9Å; F103-F107 HydrophobicContact CG-CE2 4.19Å; F103-F107 HydrophobicContact CZ-CD1 4.12Å; F103-F107 AromaticContact CZ-CD2 3.71Å; F103-F107 HydrophobicContact CZ-CD2 3.71Å; F103-F107 HydrophobicContact CZ-CE1 4.08Å; F103-F107 AromaticContact CZ-CE2 3.67Å; F103-F107 HydrophobicContact CZ-CE2 3.67Å; F103-F107 AromaticContact CZ-CG 3.94Å; F103-F107 HydrophobicContact CZ-CG 3.94Å; F103-F107 AromaticContact CZ-CZ 3.86Å; F103-F107 HydrophobicContact CZ-CZ 3.86Å; F103-F107 VanDerWaalsContact O-CB 3.3Å; F103-F107 WeakPolarHBondContact O-CB 3.05Å; F103-F107 VanDerWaalsContact O-CD2 3.23Å; F103-F107 WeakPolarHBondContact O-CD2 3.25Å; F103-F107 PolarHBondContact O-N 2.89Å
104	R	81	Confident	67	Low	121 Å²	121	75.6 Å²	75.6	46%	0.457	42%	0.415	S	S	.	.	H	α-helix	trans	-60.8	-40.5	175.8	-74.9	165	-178.3	157.3	-3.1	111.9	M100 D101 A108	M100-R104 WeakPolarHBondContact O-CB 3.45Å; M100-R104 WeakPolarHBondContact O-CD 3.38Å; M100-R104 WeakPolarHBondContact O-CG 3.47Å; M100-R104 PolarHBondContact O-N 3.41Å; D101-R104 CarbonylContact O-C 3.56Å; D101-R104 PolarHBondContact O-N 3.01Å; D101-R104 IonicContact OD1-CZ 3.59Å; D101-R104 IonicContact OD1-NH1 2.95Å; D101-R104 PolarHBondContact OD1-NH1 3.37Å; R104-A108 VanDerWaalsContact O-CA 3.29Å; R104-A108 WeakPolarHBondContact O-CA 3.29Å; R104-A108 WeakPolarHBondContact O-CB 3.22Å; R104-A108 PolarHBondContact O-N 3.16Å
105	E	79.3	Confident	67	Low	111 Å²	111	77.8 Å²	77.8	52%	0.519	43%	0.428	S	S	.	.	H	α-helix	trans	-66.4	-46.2	178.9	-178	174	176.8	0	0	111.1	R97 D101 I102 F103 F107 G109	R97-E105 IonicContact CZ-OE2 2.75Å; R97-E105 IonicContact NH1-OE1 3.86Å; R97-E105 IonicContact NH1-OE2 3.28Å; R97-E105 PolarHBondContact NH1-OE2 2.87Å; D101-E105 VanDerWaalsContact O-CB 3.28Å; D101-E105 WeakPolarHBondContact O-CB 3.42Å; D101-E105 PolarHBondContact O-N 3.02Å; I102-E105 PolarHBondContact O-N 3.12Å; F103-E105 VanDerWaalsContact C-N 3.32Å; F103-E105 PolarHBondContact O-N 2.8Å; E105-F107 PolarHBondContact O-N 3.03Å; E105-G109 VanDerWaalsContact O-CA 3.31Å; E105-G109 WeakPolarHBondContact O-CA 3.31Å; E105-G109 PolarHBondContact O-N 3.21Å
106	V	73.7	Confident	66.7	Low	16 Å²	16	75.5 Å²	75.5	10%	0.097	42%	0.416	C	S	.	.	H	α-helix	trans	-67.9	-37	179.6	174.6	0	0	0	0	111.6	Y25 R26 Y55 I102 F103 S110	Y25-V106 HydrophobicContact CD1-CB 4.42Å; Y25-V106 HydrophobicContact CD1-CG1 3.98Å; Y25-V106 HydrophobicContact CD1-CG2 4.28Å; Y25-V106 HydrophobicContact CE1-CB 3.95Å; Y25-V106 HydrophobicContact CE1-CG1 3.97Å; Y25-V106 HydrophobicContact CE1-CG2 3.89Å; R26-V106 HydrophobicContact CG-CG1 4.09Å; Y55-V106 HydrophobicContact CD1-CG2 4.35Å; Y55-V106 HydrophobicContact CE1-CG2 3.44Å; Y55-V106 VanDerWaalsContact CE1-CG2 3.44Å; I102-V106 HydrophobicContact CG2-CG2 4.26Å; I102-V106 WeakPolarHBondContact O-CB 3.28Å; I102-V106 VanDerWaalsContact O-CG2 3.22Å; I102-V106 WeakPolarHBondContact O-CG2 2.92Å; I102-V106 PolarHBondContact O-N 3.01Å; F103-V106 PolarHBondContact O-N 2.78Å; V106-S110 PolarHBondContact O-OG 3.14Å
107	F	75.8	Confident	66.2	Low	34 Å²	34	75.9 Å²	75.9	15%	0.149	44%	0.435	C	S	.	.	H	α-helix	trans	-89.2	-41.7	-178.8	-77.4	-101.9	0	0	0	112.5	R26 L30 F103 E105 S110 L112	R26-F107 HydrophobicContact CB-CZ 4.05Å; R26-F107 HydrophobicContact CG-CE2 4.04Å; R26-F107 HydrophobicContact CG-CZ 3.92Å; L30-F107 HydrophobicContact CD1-CE1 4.35Å; L30-F107 HydrophobicContact CD1-CZ 4.34Å; L30-F107 HydrophobicContact CD2-CE1 4.2Å; L30-F107 HydrophobicContact CD2-CZ 4.25Å; L30-F107 HydrophobicContact CG-CE1 4.3Å; L30-F107 HydrophobicContact CG-CZ 4.02Å; F103-F107 HydrophobicContact CD1-CD2 4.11Å; F103-F107 HydrophobicContact CD1-CG 4.48Å; F103-F107 AromaticContact CD2-CD2 3.57Å; F103-F107 HydrophobicContact CD2-CD2 3.57Å; F103-F107 AromaticContact CD2-CE2 3.39Å; F103-F107 HydrophobicContact CD2-CE2 3.39Å; F103-F107 HydrophobicContact CD2-CZ 4.24Å; F103-F107 HydrophobicContact CE1-CB 4.44Å; F103-F107 HydrophobicContact CE1-CD2 4.01Å; F103-F107 HydrophobicContact CE1-CE2 4.41Å; F103-F107 HydrophobicContact CE1-CG 4.09Å; F103-F107 AromaticContact CE2-CD2 3.49Å; F103-F107 HydrophobicContact CE2-CD2 3.49Å; F103-F107 VanDerWaalsContact CE2-CD2 3.49Å; F103-F107 HydrophobicContact CE2-CE1 4.19Å; F103-F107 AromaticContact CE2-CE2 3.09Å; F103-F107 HydrophobicContact CE2-CE2 3.09Å; F103-F107 HydrophobicContact CE2-CG 4.19Å; F103-F107 AromaticContact CE2-CZ 3.49Å; F103-F107 HydrophobicContact CE2-CZ 3.49Å; F103-F107 VanDerWaalsContact CE2-CZ 3.49Å; F103-F107 AromaticContact CG-CD2 3.9Å; F103-F107 HydrophobicContact CG-CD2 3.9Å; F103-F107 HydrophobicContact CG-CE2 4.19Å; F103-F107 HydrophobicContact CZ-CD1 4.12Å; F103-F107 AromaticContact CZ-CD2 3.71Å; F103-F107 HydrophobicContact CZ-CD2 3.71Å; F103-F107 HydrophobicContact CZ-CE1 4.08Å; F103-F107 AromaticContact CZ-CE2 3.67Å; F103-F107 HydrophobicContact CZ-CE2 3.67Å; F103-F107 AromaticContact CZ-CG 3.94Å; F103-F107 HydrophobicContact CZ-CG 3.94Å; F103-F107 AromaticContact CZ-CZ 3.86Å; F103-F107 HydrophobicContact CZ-CZ 3.86Å; F103-F107 VanDerWaalsContact O-CB 3.3Å; F103-F107 WeakPolarHBondContact O-CB 3.05Å; F103-F107 VanDerWaalsContact O-CD2 3.23Å; F103-F107 WeakPolarHBondContact O-CD2 3.25Å; F103-F107 PolarHBondContact O-N 2.89Å; E105-F107 PolarHBondContact O-N 3.03Å; F107-S110 VanDerWaalsContact O-O 3.12Å; F107-L112 WeakPolarHBondContact O-CD2 3.29Å
108	A	71.5	Confident	65.1	Low	86 Å²	86	74.3 Å²	74.3	71%	0.711	45%	0.446	S	S	*	.	H	α-helix	trans	-78.4	-27.9	179	0	0	0	0	0	113.4	R104	R104-A108 VanDerWaalsContact O-CA 3.29Å; R104-A108 WeakPolarHBondContact O-CA 3.29Å; R104-A108 WeakPolarHBondContact O-CB 3.22Å; R104-A108 PolarHBondContact O-N 3.16Å
109	G	60	Low	63.6	Low	70 Å²	70	73.7 Å²	73.7	72%	0.722	45%	0.45	S	S	*	.	S	Bend	trans	-85.1	-10.8	178.2	0	0	0	0	0	114.6	E105	E105-G109 VanDerWaalsContact O-CA 3.31Å; E105-G109 WeakPolarHBondContact O-CA 3.31Å; E105-G109 PolarHBondContact O-N 3.21Å
110	S	56.9	Low	62.3	Low	46 Å²	46	77.9 Å²	77.9	32%	0.322	47%	0.471	S	S	.	.	S	Bend	trans	-118.1	105.7	174.1	74.1	0	0	0	0	109.6	V106 F107 L112	V106-S110 PolarHBondContact O-OG 3.14Å; F107-S110 VanDerWaalsContact O-O 3.12Å; S110-L112 PolarHBondContact O-N 3.46Å
111	G	49.8	Very low	60.8	Low	39 Å²	39	83.4 Å²	83.4	40%	0.402	50%	0.495	S	S	.	.			trans	-36.4	106.3	177.3	0	0	0	0	0	112.9	D113 S114	G111-D113 WeakPolarHBondContact CA-OD1 3.22Å; G111-D113 PolarHBondContact O-N 3.18Å; G111-S114 PolarHBondContact O-N 3.27Å; G111-S114 VanDerWaalsContact O-N 3.11Å
112	L	54.7	Low	59	Low	114 Å²	114	87 Å²	87	60%	0.597	52%	0.515	S	S	*	.	G	3₁₀ helix	trans	-53.7	-25.3	177.6	-24	166.8	0	0	0	111.1	F107 S110 S114	F107-L112 WeakPolarHBondContact O-CD2 3.29Å; S110-L112 PolarHBondContact O-N 3.46Å; L112-S114 VanDerWaalsContact C-N 3.33Å; L112-S114 PolarHBondContact O-N 3.17Å
113	D	51.9	Low	57.5	Low	121 Å²	121	94.7 Å²	94.7	65%	0.647	55%	0.548	S	S	*	.	G	3₁₀ helix	trans	-64.6	-25.9	179.5	52.5	-84.8	0	0	0	114.3	G111	G111-D113 WeakPolarHBondContact CA-OD1 3.22Å; G111-D113 PolarHBondContact O-N 3.18Å
114	S	53.2	Low	55.3	Low	88 Å²	88	101.8 Å²	101.8	62%	0.615	58%	0.581	S	S	*	*	G	3₁₀ helix	trans	-98.7	-8.4	-170.6	-69	0	0	0	0	115	G111 L112	G111-S114 PolarHBondContact O-N 3.27Å; G111-S114 VanDerWaalsContact O-N 3.11Å; L112-S114 VanDerWaalsContact C-N 3.33Å; L112-S114 PolarHBondContact O-N 3.17Å
115	L	51.7	Low	53.3	Low	110 Å²	110	105 Å²	105	58%	0.576	60%	0.595	S	S	*	*	T	Hydrogen-bonded Turn	trans	-123.6	-24.1	-178	-72.8	172.1	0	0	0	114.8	G117	L115-G117 VanDerWaalsContact C-N 3.35Å
116	F	50	Low	51.1	Low	132 Å²	132	107.1 Å²	107.1	58%	0.579	61%	0.61	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.7	-11.4	173.8	-89.3	-104	0	0	0	113.1	I120	F116-I120 HydrophobicContact CB-CD1 4.45Å; F116-I120 HydrophobicContact CD1-CD1 3.4Å; F116-I120 VanDerWaalsContact CD1-CD1 3.4Å; F116-I120 HydrophobicContact CE1-CD1 3.93Å; F116-I120 HydrophobicContact CG-CD1 4.25Å
117	G	47.8	Very low	49.6	Very low	62 Å²	62	112.2 Å²	112.2	64%	0.639	64%	0.641	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.9	1.1	-176.7	0	0	0	0	0	117.3	L115	L115-G117 VanDerWaalsContact C-N 3.35Å
118	S	45.2	Very low	47.6	Very low	106 Å²	106	119.3 Å²	119.3	74%	0.741	68%	0.675	S	S	*	*	S	Bend	trans	-144.4	5.2	-171.6	-55.4	0	0	0	0	118.3
119	S	44.3	Very low	46.3	Very low	100 Å²	100	123.3 Å²	123.3	70%	0.699	68%	0.684	S	S	*	*			trans	-156.1	21.1	-179	-75.9	0	0	0	0	117	H121	S119-H121 PolarHBondContact O-N 3.48Å
120	I	50.3	Low	45	Very low	111 Å²	111	127.3 Å²	127.3	57%	0.569	69%	0.688	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.9	60.5	169.6	-44.7	-177.3	0	0	0	109.3	F116	F116-I120 HydrophobicContact CB-CD1 4.45Å; F116-I120 HydrophobicContact CD1-CD1 3.4Å; F116-I120 VanDerWaalsContact CD1-CD1 3.4Å; F116-I120 HydrophobicContact CE1-CD1 3.93Å; F116-I120 HydrophobicContact CG-CD1 4.25Å
121	H	45.1	Very low	44.3	Very low	179 Å²	179	136.1 Å²	136.1	83%	0.829	71%	0.714	S	S	*	*	T	Hydrogen-bonded Turn	trans	-143.8	17.2	167.3	-144.5	-78.6	0	0	0	112.7	S119	S119-H121 PolarHBondContact O-N 3.48Å
122	D	40.3	Very low	43.8	Very low	140 Å²	140	140.2 Å²	140.2	75%	0.749	73%	0.732	S	S	*	*			trans	-124.2	23.7	179.4	-150.5	-119.8	0	0	0	112.9	Q124	D122-Q124 VanDerWaalsContact C-N 3.26Å; D122-Q124 PolarHBondContact O-N 3.18Å; D122-Q124 VanDerWaalsContact O-N 3.1Å
123	F	44.9	Very low	43.5	Very low	169 Å²	169	141.8 Å²	141.8	74%	0.741	74%	0.74	S	S	*	*			trans	-80.7	86.2	160.4	-98.1	-85.2	0	0	0	108.2	Y125	F123-Y125 HydrophobicContact CD1-CD2 4.09Å; F123-Y125 AromaticContact CD1-CE2 3.95Å; F123-Y125 HydrophobicContact CD1-CE2 3.95Å; F123-Y125 HydrophobicContact CE1-CE2 4.39Å; F123-Y125 PolarHBondContact O-N 3.04Å
124	Q	34.6	Very low	42.8	Very low	182 Å²	182	147.3 Å²	147.3	85%	0.85	75%	0.752	S	S	*	*			trans	-62.7	75.7	164.3	-157.8	175.3	4	0	0	108.9	D122	D122-Q124 VanDerWaalsContact C-N 3.26Å; D122-Q124 PolarHBondContact O-N 3.18Å; D122-Q124 VanDerWaalsContact O-N 3.1Å
125	Y	39.4	Very low	42.4	Very low	189 Å²	189	152.6 Å²	152.6	74%	0.741	76%	0.764	S	S	*	*			trans	-95.6	113.3	149.8	-85.3	-77.1	0	0	0	106.5	F123 T127	F123-Y125 HydrophobicContact CD1-CD2 4.09Å; F123-Y125 AromaticContact CD1-CE2 3.95Å; F123-Y125 HydrophobicContact CD1-CE2 3.95Å; F123-Y125 HydrophobicContact CE1-CE2 4.39Å; F123-Y125 PolarHBondContact O-N 3.04Å; Y125-T127 VanDerWaalsContact C-N 3.29Å; Y125-T127 PolarHBondContact O-N 3.1Å; Y125-T127 PolarHBondContact O-OG1 3.08Å
126	D	32.5	Very low	41.8	Very low	155 Å²	155	154.1 Å²	154.1	83%	0.829	77%	0.773	S	S	*	*			trans	-52.4	89.5	172.1	-145.2	-50.2	0	0	0	109.5
127	T	42.7	Very low	41.7	Very low	124 Å²	124	153.1 Å²	153.1	76%	0.761	78%	0.782	S	S	*	*			trans	-142.3	105.7	164.7	28	0	0	0	0	106.9	Y125 L129	Y125-T127 VanDerWaalsContact C-N 3.29Å; Y125-T127 PolarHBondContact O-N 3.1Å; Y125-T127 PolarHBondContact O-OG1 3.08Å; T127-L129 PolarHBondContact O-N 3.32Å
128	Q	33.2	Very low	41.5	Very low	183 Å²	183	157.2 Å²	157.2	86%	0.855	78%	0.784	S	S	*	*			trans	-38.1	125.4	172.5	-49.4	-163.7	10.9	0	0	111.1
129	L	43.4	Very low	41.8	Very low	170 Å²	170	163.7 Å²	163.7	89%	0.89	79%	0.793	S	S	*	*			trans	178	120.5	136.7	-94.4	171.4	0	0	0	110	T127 R131	T127-L129 PolarHBondContact O-N 3.32Å; L129-R131 PolarHBondContact O-N 3.45Å
130	N	33.2	Very low	41.7	Very low	153 Å²	153	167.1 Å²	167.1	82%	0.818	80%	0.803	S	S	*	*			trans	-41.5	123.1	168.5	-79.1	-60.2	0	0	0	113.3
131	R	42.1	Very low	41.6	Very low	231 Å²	231	166.5 Å²	166.5	87%	0.872	82%	0.815	S	S	*	*			trans	-156.2	96.1	137.4	-142.9	169.5	-72.8	-137.1	1.8	111.6	L129	L129-R131 PolarHBondContact O-N 3.45Å
132	T	39.9	Very low	41.6	Very low	125 Å²	125	161.8 Å²	161.8	77%	0.767	81%	0.814	S	S	*	*			trans	-16.4	130.1	144.3	1.2	0	0	0	0	113
133	L	47.6	Very low	41.6	Very low	147 Å²	147	167 Å²	167	77%	0.77	82%	0.823	S	S	*	*			trans	-177.7	106.2	134.1	-92.2	161.1	0	0	0	111.7
134	R	37.2	Very low	42	Very low	238 Å²	238	167.7 Å²	167.7	90%	0.898	83%	0.829	S	S	*	*			trans	6.5	121	150.6	-54.1	-178.3	-166.9	-171.3	3.6	118.2
135	F	44.1	Very low	42.8	Very low	199 Å²	199	165.4 Å²	165.4	87%	0.873	83%	0.833	S	S	*	*			trans	-106.3	116.9	158.1	-76.2	-77.6	0	0	0	111.1	S137	F135-S137 PolarHBondContact O-N 2.82Å
136	N	39.9	Very low	43.1	Very low	142 Å²	142	160 Å²	160	76%	0.759	84%	0.835	S	S	*	*			trans	-69.9	110.6	163	-100.1	-8.3	0	0	0	108.6
137	S	47.9	Very low	44	Very low	111 Å²	111	158.1 Å²	158.1	78%	0.776	83%	0.834	S	S	*	*			trans	-94.5	97.3	166.6	161.5	0	0	0	0	109	F135	F135-S137 PolarHBondContact O-N 2.82Å
138	H	43.1	Very low	44.5	Very low	148 Å²	148	156.2 Å²	156.2	69%	0.685	82%	0.823	S	S	*	*			trans	-78.7	110.9	158.8	-53.6	-60.1	0	0	0	107.8
139	R	51.4	Low	45.3	Very low	242 Å²	242	157 Å²	157	91%	0.913	82%	0.82	S	S	*	*			trans	-167.4	117.8	147.1	-102.5	157.3	-148	-153.4	8.3	111.5
140	N	42.5	Very low	45.2	Very low	171 Å²	171	157 Å²	157	91%	0.914	82%	0.815	S	S	*	*			trans	-61.6	123	176.9	-160.7	11.6	0	0	0	111
141	A	48.2	Very low	45.6	Very low	99 Å²	99	158.1 Å²	158.1	82%	0.818	82%	0.815	S	S	*	*			trans	-164.7	119.4	161.2	0	0	0	0	0	111.7
142	G	44.8	Very low	45.5	Very low	79 Å²	79	151.6 Å²	151.6	81%	0.814	81%	0.81	S	S	*	*			trans	86.8	74.2	146.6	0	0	0	0	0	118.3
143	R	41.4	Very low	45.6	Very low	250 Å²	250	149 Å²	149	94%	0.943	81%	0.809	S	S	*	*			trans	-82.4	116.1	158.8	-76.5	-170.9	175.7	-132.4	1	110
144	Q	53.5	Low	45.5	Very low	184 Å²	184	150.2 Å²	150.2	86%	0.86	82%	0.815	S	S	*	*			trans	-144.3	131.6	158	-63.2	-170.9	40.8	0	0	110.9
145	S	50.6	Low	45.7	Very low	133 Å²	133	143.1 Å²	143.1	93%	0.93	80%	0.802	S	S	*	*			trans	85.7	123.8	163.2	85.9	0	0	0	0	119.9
146	G	45.9	Very low	45.6	Very low	76 Å²	76	138.4 Å²	138.4	78%	0.784	79%	0.794	S	S	*	*			trans	124.7	64.3	149.7	0	0	0	0	0	119.8
147	S	51.6	Low	45.7	Very low	116 Å²	116	139.5 Å²	139.5	81%	0.811	80%	0.795	S	S	*	*			trans	24	164.1	131.9	-112.4	0	0	0	0	122.9
148	P	52.6	Low	45.3	Very low	83 Å²	83	139.7 Å²	139.7	54%	0.539	79%	0.791	S	S	.	*			cis	-140	169	-46.3	26.6	-2.8	0	0	0	114.4
149	Y	49.5	Very low	45.1	Very low	199 Å²	199	140.2 Å²	140.2	78%	0.78	79%	0.794	S	S	*	*			trans	101.9	134.2	156.4	-49.4	-68.5	0	0	0	121.7
150	H	42.4	Very low	44.3	Very low	171 Å²	171	132.7 Å²	132.7	79%	0.792	78%	0.778	S	S	*	*			trans	100	89	155.3	-58.6	-70.8	0	0	0	121
151	H	40.7	Very low	44.3	Very low	176 Å²	176	135 Å²	135	82%	0.815	78%	0.775	S	S	*	*				74.5	93.9	119	-123.6	-86.3	0	0	0	122.4
152	A	40.9	Very low	43.6	Very low	94 Å²	94	137.7 Å²	137.7	78%	0.777	78%	0.776	S	S	*	*				42.2	130.4	125.5	0	0	0	0	0	123
153	G	42.1	Very low	43.9	Very low	72 Å²	72	139.2 Å²	139.2	74%	0.742	77%	0.771	S	S	*	*			trans	167.9	90.3	153.3	0	0	0	0	0	116.5
154	L	45.1	Very low	43.6	Very low	171 Å²	171	134.3 Å²	134.3	90%	0.895	76%	0.763	S	S	*	*			trans	-2.9	158.9	152.1	-77.9	95.6	0	0	0	119.9
155	S	41.8	Very low	43	Very low	90 Å²	90	133.3 Å²	133.3	63%	0.629	76%	0.761	S	S	*	*			cis	175.9	150.8	-2.6	172.5	0	0	0	0	108.4
156	S	42.8	Very low	42.6	Very low	99 Å²	99	131.7 Å²	131.7	69%	0.692	75%	0.75	S	S	*	*			trans	54.5	136.1	146.8	53.4	0	0	0	0	120.5
157	Q	42.1	Very low	42.4	Very low	166 Å²	166	135.3 Å²	135.3	78%	0.776	75%	0.751	S	S	*	*				174.2	118.2	66.3	-174.4	170.6	-29.3	0	0	107.1
158	V	38.1	Very low	42.2	Very low	114 Å²	114	135.5 Å²	135.5	69%	0.691	75%	0.75	S	S	*	*				78.6	140.2	91	173.7	0	0	0	0	116.9
159	Q	39.3	Very low	41.5	Very low	160 Å²	160	138.6 Å²	138.6	75%	0.748	76%	0.761	S	S	*	*			trans	84.2	144.8	159.9	-80.9	150.1	18.8	0	0	119.1
160	S	34.1	Very low	41.3	Very low	83 Å²	83	137.6 Å²	137.6	58%	0.58	77%	0.765	S	S	*	*			cis	171	163.1	-18.1	-86	0	0	0	0	106.2
161	Y	42.1	Very low	41	Very low	219 Å²	219	133.1 Å²	133.1	86%	0.859	77%	0.766	S	S	*	*			trans	106.7	113.4	156.9	-54.4	-72.3	0	0	0	120
162	D	35.4	Very low	41.1	Very low	157 Å²	157	127.9 Å²	127.9	84%	0.84	76%	0.759	S	S	*	*			trans	-87.8	-160.5	162.9	-46.9	-71.1	0	0	0	111.5
163	P	49.9	Very low	41.3	Very low	110 Å²	110	131.8 Å²	131.8	71%	0.714	77%	0.766	S	S	*	*			cis	-136.3	-168.1	-30.7	24.6	0.8	0	0	0	114
164	I	35.6	Very low	41.5	Very low	148 Å²	148	137.3 Å²	137.3	76%	0.759	77%	0.77	S	S	*	*			trans	84.3	122.3	154	-36	-177.5	0	0	0	118.8
165	I	41.2	Very low	41.2	Very low	162 Å²	162	135.6 Å²	135.6	83%	0.831	76%	0.762	S	S	*	*				169.4	138.5	123.5	-79.4	160.3	0	0	0	111.1
166	S	42.6	Very low	41.8	Very low	99 Å²	99	135.5 Å²	135.5	69%	0.692	76%	0.761	S	S	*	*			trans	-59.2	156.9	-173.5	44	0	0	0	0	120.3
167	D	41.7	Very low	42.1	Very low	153 Å²	153	135.9 Å²	135.9	82%	0.818	76%	0.761	S	S	*	*			trans	2.1	159	145.6	-56.5	-28.1	0	0	0	119.5
168	P	46.8	Very low	42.3	Very low	119 Å²	119	138.3 Å²	138.3	77%	0.773	77%	0.77	S	S	*	*			cis	-151.9	-178.2	33.5	41.8	-18.6	0	0	0	118
169	L	37.9	Very low	42.4	Very low	149 Å²	149	136.3 Å²	136.3	78%	0.78	77%	0.772	S	S	*	*			trans	53.8	103.7	142.7	-161.2	105.1	0	0	0	119.5
170	M	45.6	Very low	42.4	Very low	177 Å²	177	132 Å²	132	87%	0.872	77%	0.77	S	S	*	*			trans	-160.5	124.7	143.1	-144.7	55.3	72.8	0	0	113.3
171	G	36	Very low	42.9	Very low	77 Å²	77	133.1 Å²	133.1	79%	0.794	78%	0.778	S	S	*	*			trans	-83.8	167	170.7	0	0	0	0	0	113.2
172	G	42.9	Very low	43	Very low	66 Å²	66	129.8 Å²	129.8	68%	0.68	77%	0.774	S	S	*	*			trans	169.6	103.9	171	0	0	0	0	0	109.2
173	L	43.7	Very low	43.2	Very low	176 Å²	176	130.9 Å²	130.9	92%	0.921	77%	0.772	S	S	*	*				69.8	84.8	88.8	-74.5	162.6	0	0	0	112.8
174	F	47.2	Very low	43.3	Very low	189 Å²	189	132.2 Å²	132.2	83%	0.829	77%	0.773	S	S	*	*			trans	-136.5	95.9	144.6	-162.1	-105.8	0	0	0	110.4	S176	F174-S176 WeakPolarHBondContact CE1-OG 3.38Å
175	D	38.6	Very low	43.9	Very low	134 Å²	134	129.4 Å²	129.4	72%	0.717	76%	0.764	S	S	*	*			trans	-67.5	133.3	164.4	-161.8	-99.3	0	0	0	108.7
176	S	54.2	Low	43.9	Very low	89 Å²	89	127.3 Å²	127.3	62%	0.622	76%	0.755	S	S	*	*			trans	-143.3	117.7	163	-86.1	0	0	0	0	110.1	F174	F174-S176 WeakPolarHBondContact CE1-OG 3.38Å
177	P	50.3	Low	44	Very low	107 Å²	107	130 Å²	130	70%	0.695	76%	0.758	S	S	*	*			trans	-103.7	91.2	-172.4	36.6	-28.2	0	0	0	110.4
178	F	45.7	Very low	44	Very low	217 Å²	217	126.7 Å²	126.7	95%	0.952	75%	0.752	S	S	*	*			trans	-177.4	134.8	154.9	-132.6	-110.6	0	0	0	111.2
179	G	38.8	Very low	43.6	Very low	72 Å²	72	126.4 Å²	126.4	74%	0.742	75%	0.752	S	S	*	*			trans	107.4	79	145.6	0	0	0	0	0	117.7
180	G	40.7	Very low	43.9	Very low	68 Å²	68	126.1 Å²	126.1	70%	0.701	76%	0.757	S	S	*	*				60	97	115.3	0	0	0	0	0	119
181	S	43.8	Very low	43.7	Very low	108 Å²	108	125.5 Å²	125.5	76%	0.755	76%	0.757	S	S	*	*				44.9	134	112.4	-43.9	0	0	0	0	119.6
182	L	44.3	Very low	43.9	Very low	148 Å²	148	127.8 Å²	127.8	78%	0.775	76%	0.761	S	S	*	*				149.4	118	112.5	-79	-176.4	0	0	0	114.1
183	F	40.9	Very low	43.7	Very low	181 Å²	181	127.7 Å²	127.7	79%	0.794	76%	0.761	S	S	*	*			trans	83.6	93.9	148.8	-80.1	-93.3	0	0	0	122.2
184	N	51.9	Low	43.4	Very low	137 Å²	137	129.6 Å²	129.6	73%	0.733	76%	0.762	S	S	*	*			trans	-81.5	-176.8	134.4	-148.7	25.9	0	0	0	108
185	P	47	Very low	42.8	Very low	89 Å²	89	125 Å²	125	58%	0.578	76%	0.759	S	S	*	*			cis	-136.1	166.7	-30.5	15.9	9.8	0	0	0	115
186	L	41.3	Very low	42.9	Very low	119 Å²	119	125.9 Å²	125.9	62%	0.623	76%	0.763	S	S	*	*				14.7	126.9	121.8	-175.5	72.1	0	0	0	120.1
187	M	44.2	Very low	42.1	Very low	156 Å²	156	126.7 Å²	126.7	77%	0.768	77%	0.766	S	S	*	*			trans	152.8	109.4	135.5	-82.4	-69.3	-172.3	0	0	109.5
188	A	41.6	Very low	41.3	Very low	83 Å²	83	130.9 Å²	130.9	69%	0.686	78%	0.777	S	S	*	*				57.9	93.3	96.6	0	0	0	0	0	111.9
189	S	39.7	Very low	41	Very low	112 Å²	112	123.8 Å²	123.8	78%	0.783	77%	0.765	S	S	*	*				49.6	99.1	85.5	-162.6	0	0	0	0	113.2
190	T	43.4	Very low	40.9	Very low	143 Å²	143	126.8 Å²	126.8	88%	0.877	77%	0.774	S	S	*	*				179.8	94.9	129.7	27	0	0	0	0	107.4
191	N	41.6	Very low	40.9	Very low	164 Å²	164	128.5 Å²	128.5	88%	0.877	78%	0.776	S	S	*	*			trans	-119.1	111.8	168.9	-156.2	28.6	0	0	0	106.1
192	S	40.8	Very low	41	Very low	125 Å²	125	128.6 Å²	128.6	87%	0.874	78%	0.777	S	S	*	*			trans	153.6	103.3	151.8	47.6	0	0	0	0	109.9
193	G	37.4	Very low	41.4	Very low	65 Å²	65	126.5 Å²	126.5	67%	0.67	77%	0.77	S	S	*	*			trans	164.4	103.4	170	0	0	0	0	0	114.4
194	F	37.3	Very low	41.4	Very low	215 Å²	215	122.4 Å²	122.4	94%	0.943	76%	0.764	S	S	*	*			trans	84	108.1	152.9	-73.4	-88.7	0	0	0	120.1
195	A	34.4	Very low	41	Very low	93 Å²	93	121.4 Å²	121.4	77%	0.769	76%	0.763	S	S	*	*			trans	-36.8	132.2	160.6	0	0	0	0	0	115.7
196	N	41	Very low	40.7	Very low	152 Å²	152	125.6 Å²	125.6	81%	0.813	77%	0.772	S	S	*	*			trans	-162.1	123	133.6	-122.4	5.1	0	0	0	109.3
197	P	38.5	Very low	40.7	Very low	106 Å²	106	124.5 Å²	124.5	69%	0.688	77%	0.774	S	S	*	*			trans	-83.7	140.2	168.5	34	-26.9	0	0	0	108
198	Q	33.3	Very low	40.4	Very low	195 Å²	195	122.4 Å²	122.4	91%	0.911	78%	0.775	S	S	*	*	S	Bend	trans	82.1	102.8	-178.2	-49.9	172.4	-7.2	0	0	114.4
199	G	38.7	Very low	40.4	Very low	68 Å²	68	127 Å²	127	70%	0.701	78%	0.78	S	S	*	*			trans	162.5	109.8	167.8	0	0	0	0	0	112	S201	G199-S201 PolarHBondContact O-N 3.14Å; G199-S201 VanDerWaalsContact O-N 3.12Å
200	S	37.2	Very low	40.2	Very low	135 Å²	135	125.5 Å²	125.5	94%	0.944	78%	0.783	S	S	*	*			trans	-54.6	111.8	170.9	-50.8	0	0	0	0	110.1
201	S	39.6	Very low	39.9	Very low	105 Å²	105	121.8 Å²	121.8	73%	0.734	77%	0.773	S	S	*	*			trans	-119.8	103.6	176.5	56.1	0	0	0	0	110.5	G199	G199-S201 PolarHBondContact O-N 3.14Å; G199-S201 VanDerWaalsContact O-N 3.12Å
202	S	46.3	Very low	39.6	Very low	110 Å²	110	119.5 Å²	119.5	77%	0.769	77%	0.77	S	S	*	*			trans	-79.5	117.9	166.5	39.7	0	0	0	0	109.7
203	T	52.6	Low	39.3	Very low	104 Å²	104	119.5 Å²	119.5	64%	0.638	77%	0.77	S	S	*	*			trans	-102.5	111.4	173.9	48.7	0	0	0	0	110
204	S	40.7	Very low	39.1	Very low	95 Å²	95	121.3 Å²	121.3	66%	0.664	77%	0.77	S	S	*	*			trans	-95.8	110	168.9	53.7	0	0	0	0	109
205	V	44.6	Very low	39.4	Very low	116 Å²	116	116.7 Å²	116.7	70%	0.703	77%	0.772	S	S	*	*			trans	-90.6	109.8	168.3	-75.7	0	0	0	0	108.9
206	F	40.5	Very low	40	Very low	176 Å²	176	114.8 Å²	114.8	77%	0.772	76%	0.761	S	S	*	*			trans	-96.2	117.2	166.7	56.1	-85.3	0	0	0	107.4
207	S	40.8	Very low	40.9	Very low	96 Å²	96	109.7 Å²	109.7	67%	0.671	75%	0.745	S	S	*	*			trans	-103.8	92	169.2	50.7	0	0	0	0	108.5
208	S	39.3	Very low	42.2	Very low	112 Å²	112	113.8 Å²	113.8	78%	0.783	75%	0.752	S	S	*	*			trans	-97.3	95.2	163.8	-65.9	0	0	0	0	107.8
209	F	41.7	Very low	44.4	Very low	179 Å²	179	111.2 Å²	111.2	79%	0.785	73%	0.734	S	S	*	*			trans	-94.9	93.6	160.1	61.8	-89.7	0	0	0	107.6
210	G	35.5	Very low	46.3	Very low	82 Å²	82	111.1 Å²	111.1	85%	0.845	72%	0.723	S	S	*	*			trans	-71.3	127.9	162.3	0	0	0	0	0	108.8
211	G	36.8	Very low	48.6	Very low	65 Å²	65	106.8 Å²	106.8	67%	0.67	69%	0.69	S	S	*	*			trans	169.1	79.7	177.5	0	0	0	0	0	112.3
212	S	35.5	Very low	50.6	Low	116 Å²	116	104.3 Å²	104.3	81%	0.811	67%	0.673	S	S	*	*	S	Bend	trans	31.3	126.3	160.2	-77.7	0	0	0	0	120.8
213	S	33.5	Very low	52.5	Low	125 Å²	125	101.1 Å²	101.1	87%	0.874	65%	0.649	S	S	*	*			trans	70.8	64.5	158.9	63.7	0	0	0	0	117.3
214	C	33.4	Very low	54	Low	102 Å²	102	98.8 Å²	98.8	69%	0.689	64%	0.637	S	S	*	*			trans	-149.7	135.4	154.7	57.2	0	0	0	0	110.2	G216	C214-G216 PolarHBondContact O-N 3.03Å
215	A	43.9	Very low	56.1	Low	119 Å²	119	97.8 Å²	97.8	98%	0.983	63%	0.63	S	S	*	*			trans	-70.6	56.7	169.8	0	0	0	0	0	110.3
216	G	47.3	Very low	58.2	Low	52 Å²	52	98 Å²	98	54%	0.536	62%	0.621	S	S	.	*			trans	-97.6	112.3	-176.9	0	0	0	0	0	110.2	C214	C214-G216 PolarHBondContact O-N 3.03Å
217	G	59.8	Low	60.5	Low	46 Å²	46	98.3 Å²	98.3	47%	0.474	62%	0.619	S	S	.	*			trans	-62.6	146.2	176.8	0	0	0	0	0	112.5	R219 N241	G217-R219 PolarHBondContact O-N 3.12Å; G217-N241 VanDerWaalsContact CA-OD1 3.3Å; G217-N241 WeakPolarHBondContact CA-OD1 3.23Å
218	F	64.8	Low	62.6	Low	191 Å²	191	96.5 Å²	96.5	84%	0.838	60%	0.604	S	S	*	*			trans	-66.1	122.5	-178.2	-60.8	-83.8	0	0	0	110.2	E240 N241	F218-E240 WeakPolarHBondContact O-CA 3.3Å; F218-N241 PolarHBondContact O-N 3.43Å; F218-N241 VanDerWaalsContact O-N 3.12Å
219	R	80.9	Confident	64.8	Low	142 Å²	142	99 Å²	99	54%	0.536	61%	0.608	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-119.3	122.8	170.2	-173.8	173.3	177.6	-98.8	0.1	110.4	G217 V221 V239 E240	G217-R219 PolarHBondContact O-N 3.12Å; R219-V221 HydrophobicContact CG-CG2 4.48Å; R219-V239 CarbonylContact C-O 3.52Å; R219-V239 WeakPolarHBondContact CA-O 3.4Å; R219-E240 HydrophobicContact CB-CG 4.28Å; R219-E240 WeakPolarHBondContact CD-OE2 3.36Å; R219-E240 HydrophobicContact CG-CB 4.15Å; R219-E240 HydrophobicContact CG-CG 4.16Å; R219-E240 IonicContact NE-OE2 2.83Å; R219-E240 PolarHBondContact NE-OE2 2.8Å
220	S	78.3	Confident	66.9	Low	65 Å²	65	94 Å²	94	46%	0.455	61%	0.608	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-121.2	138.5	173.5	178.5	0	0	0	0	109.4	V238 V239	S220-V238 CarbonylContact O-C 3.49Å; S220-V238 WeakPolarHBondContact O-CA 3.32Å; S220-V239 PolarHBondContact N-O 3.04Å; S220-V239 PolarHBondContact O-N 2.72Å
221	V	85.3	Confident	69.1	Low	44 Å²	44	95.5 Å²	95.5	27%	0.267	59%	0.591	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-130.5	125.2	177.2	-178.2	0	0	0	0	108.6	R219 T236 K237 V238	R219-V221 HydrophobicContact CG-CG2 4.48Å; V221-T236 HydrophobicContact CG1-CG2 4.2Å; V221-K237 CarbonylContact C-O 3.47Å; V221-K237 WeakPolarHBondContact CA-O 3.2Å; V221-V238 HydrophobicContact CG1-CG2 4.17Å; V221-V238 HydrophobicContact CG2-CG1 4.16Å; V221-V238 HydrophobicContact CG2-CG2 4.19Å
222	S	80.7	Confident	71.2	Confident	53 Å²	53	95.6 Å²	95.6	37%	0.371	58%	0.575	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-125.8	119.5	178	175.9	0	0	0	0	109.4	T236 K237	S222-T236 CarbonylContact O-C 3.58Å; S222-T236 WeakPolarHBondContact O-CA 3.35Å; S222-K237 PolarHBondContact N-O 3.49Å; S222-K237 PolarHBondContact O-N 2.95Å
223	T	87	Confident	73.8	Confident	43 Å²	43	91.1 Å²	91.1	26%	0.264	54%	0.542	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	129.2	178.8	-63.9	0	0	0	0	109.9	R234 V235 T236	T223-R234 HydrophobicContact CG2-CG 3.88Å; T223-V235 CarbonylContact C-O 3.54Å; T223-V235 WeakPolarHBondContact CA-O 3.32Å; T223-T236 PolarHBondContact OG1-OG1 3.15Å
224	S	82.9	Confident	76.3	Confident	56 Å²	56	90 Å²	90	39%	0.392	52%	0.519	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	121.8	179	174.6	0	0	0	0	110.5	R234 V235	S224-R234 CarbonylContact O-C 3.53Å; S224-R234 WeakPolarHBondContact O-CA 3.34Å; S224-V235 PolarHBondContact N-O 3.34Å; S224-V235 PolarHBondContact O-N 2.95Å
225	S	86.7	Confident	79	Confident	73 Å²	73	86.7 Å²	86.7	51%	0.51	50%	0.496	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	133.4	178.2	-57.8	0	0	0	0	111.1	V233 R234	S225-V233 CarbonylContact C-O 3.5Å; S225-V233 WeakPolarHBondContact CA-O 3.19Å; S225-R234 WeakPolarHBondContact OG-CG 3.27Å
226	K	87.2	Confident	81.2	Confident	120 Å²	120	82 Å²	82	52%	0.522	46%	0.455	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	144.8	177.3	63.4	177.4	-177.9	-178.9	0	111	V228 V233	K226-V228 HydrophobicContact CD-CG2 4.07Å; K226-V228 HydrophobicContact CG-CG2 4.05Å; K226-V233 HydrophobicContact CG-CB 4.14Å; K226-V233 PolarHBondContact N-O 2.99Å; K226-V233 WeakPolarHBondContact O-CA 3.4Å; K226-V233 WeakPolarHBondContact O-CB 3.23Å; K226-V233 PolarHBondContact O-N 3.4Å; K226-V233 VanDerWaalsContact O-O 3.1Å
227	Y	88.5	Confident	83.2	Confident	183 Å²	183	83 Å²	83	72%	0.718	44%	0.444	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87.9	127	172.3	-71.1	-87.7	0	0	0	110.3	K231 M232	Y227-K231 CarbonylContact C-O 3.42Å; Y227-K231 WeakPolarHBondContact CA-O 3.27Å; Y227-M232 HydrophobicContact CD1-CB 4.13Å; Y227-M232 HydrophobicContact CE1-CB 3.78Å; Y227-M232 HydrophobicContact CE1-CG 4.29Å
228	V	86.8	Confident	84.5	Confident	59 Å²	59	82.1 Å²	82.1	36%	0.358	43%	0.43	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	121.5	177.2	-175.7	0	0	0	0	108.2	K226 G230 K231 V233	K226-V228 HydrophobicContact CD-CG2 4.07Å; K226-V228 HydrophobicContact CG-CG2 4.05Å; V228-G230 PolarHBondContact O-N 3.02Å; V228-K231 PolarHBondContact N-O 3.03Å; V228-K231 PolarHBondContact O-N 3.07Å; V228-V233 HydrophobicContact CB-CG2 3.88Å; V228-V233 HydrophobicContact CG2-CB 4.43Å; V228-V233 HydrophobicContact CG2-CG2 3.84Å
229	N	85.4	Confident	85.4	Confident	164 Å²	164	74.3 Å²	74.3	88%	0.877	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.1	38.2	-179.1	-59.4	-24.2	0	0	0	114.2	K231	N229-K231 VanDerWaalsContact C-N 3.26Å; N229-K231 PolarHBondContact O-N 2.74Å
230	G	84.2	Confident	85.3	Confident	75 Å²	75	71.7 Å²	71.7	77%	0.773	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	80.6	-3.1	-179.4	0	0	0	0	0	115.4	V228	V228-G230 PolarHBondContact O-N 3.02Å
231	K	82.2	Confident	85.3	Confident	113 Å²	113	73.9 Å²	73.9	49%	0.491	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	140.7	177.5	-58.1	-169	176.2	-174.7	0	111.2	Y227 V228 N229 V233 V250 D251	Y227-K231 CarbonylContact C-O 3.42Å; Y227-K231 WeakPolarHBondContact CA-O 3.27Å; V228-K231 PolarHBondContact N-O 3.03Å; V228-K231 PolarHBondContact O-N 3.07Å; N229-K231 VanDerWaalsContact C-N 3.26Å; N229-K231 PolarHBondContact O-N 2.74Å; K231-V233 PolarHBondContact O-N 3.37Å; K231-V250 HydrophobicContact CB-CG1 3.73Å; K231-V250 HydrophobicContact CD-CG1 3.76Å; K231-V250 HydrophobicContact CG-CG1 4.38Å; K231-D251 WeakPolarHBondContact CA-OD1 3.07Å; K231-D251 WeakPolarHBondContact CB-OD2 3.46Å; K231-D251 WeakPolarHBondContact CD-OD2 3.32Å; K231-D251 VanDerWaalsContact CG-OD2 3.23Å; K231-D251 WeakPolarHBondContact CG-OD2 3.5Å
232	M	82.1	Confident	84.8	Confident	67 Å²	67	73.5 Å²	73.5	33%	0.33	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	112.3	176	-178	176.6	65.8	0	0	109.4	Y227 V250 D251	Y227-M232 HydrophobicContact CD1-CB 4.13Å; Y227-M232 HydrophobicContact CE1-CB 3.78Å; Y227-M232 HydrophobicContact CE1-CG 4.29Å; M232-V250 CarbonylContact O-C 3.59Å; M232-V250 VanDerWaalsContact O-CA 3.31Å; M232-V250 WeakPolarHBondContact O-CA 3.35Å; M232-D251 PolarHBondContact N-OD1 3.08Å; M232-D251 PolarHBondContact O-N 2.94Å
233	V	88.7	Confident	84.7	Confident	22 Å²	22	73.2 Å²	73.2	13%	0.133	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	115.4	175.1	-172.6	0	0	0	0	109.6	S225 K226 V228 K231 V235 E249 V250	S225-V233 CarbonylContact C-O 3.5Å; S225-V233 WeakPolarHBondContact CA-O 3.19Å; K226-V233 HydrophobicContact CG-CB 4.14Å; K226-V233 PolarHBondContact N-O 2.99Å; K226-V233 WeakPolarHBondContact O-CA 3.4Å; K226-V233 WeakPolarHBondContact O-CB 3.23Å; K226-V233 PolarHBondContact O-N 3.4Å; K226-V233 VanDerWaalsContact O-O 3.1Å; V228-V233 HydrophobicContact CB-CG2 3.88Å; V228-V233 HydrophobicContact CG2-CB 4.43Å; V228-V233 HydrophobicContact CG2-CG2 3.84Å; K231-V233 PolarHBondContact O-N 3.37Å; V233-V235 HydrophobicContact CG1-CG2 4.46Å; V233-E249 CarbonylContact C-O 3.51Å; V233-E249 WeakPolarHBondContact CA-O 3.24Å; V233-V250 HydrophobicContact CG1-CG2 4.36Å; V233-V250 HydrophobicContact CG2-CG2 4.16Å
234	R	87.2	Confident	84.5	Confident	100 Å²	100	73.6 Å²	73.6	38%	0.377	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	124.8	177.5	177.7	179.9	-174.4	-172.5	4.7	110.2	T223 S224 S225 E248 E249	T223-R234 HydrophobicContact CG2-CG 3.88Å; S224-R234 CarbonylContact O-C 3.53Å; S224-R234 WeakPolarHBondContact O-CA 3.34Å; S225-R234 WeakPolarHBondContact OG-CG 3.27Å; R234-E248 CarbonylContact O-C 3.53Å; R234-E248 WeakPolarHBondContact O-CA 3.14Å; R234-E249 HydrophobicContact CB-CB 4.22Å; R234-E249 PolarHBondContact N-O 2.84Å; R234-E249 PolarHBondContact O-N 3.03Å
235	V	90.2	Very high	84.7	Confident	34 Å²	34	72.4 Å²	72.4	21%	0.206	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	119.6	178.8	-175.3	0	0	0	0	109.1	T223 S224 V233 I246 T247 E248	T223-V235 CarbonylContact C-O 3.54Å; T223-V235 WeakPolarHBondContact CA-O 3.32Å; S224-V235 PolarHBondContact N-O 3.34Å; S224-V235 PolarHBondContact O-N 2.95Å; V233-V235 HydrophobicContact CG1-CG2 4.46Å; V235-I246 HydrophobicContact CG1-CG2 3.77Å; V235-T247 CarbonylContact C-O 3.42Å; V235-T247 VanDerWaalsContact CA-O 3.3Å; V235-T247 WeakPolarHBondContact CA-O 3.37Å; V235-E248 HydrophobicContact CG1-CG 4.3Å; V235-E248 HydrophobicContact CG2-CG 4.12Å
236	T	90	Very high	84.7	Confident	20 Å²	20	71 Å²	71	12%	0.123	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	112.4	179.1	-59.7	0	0	0	0	109.6	V221 S222 T223 V238 I246 T247	V221-T236 HydrophobicContact CG1-CG2 4.2Å; S222-T236 CarbonylContact O-C 3.58Å; S222-T236 WeakPolarHBondContact O-CA 3.35Å; T223-T236 PolarHBondContact OG1-OG1 3.15Å; T236-V238 HydrophobicContact CG2-CG2 4.03Å; T236-I246 CarbonylContact O-C 3.52Å; T236-I246 WeakPolarHBondContact O-CA 3.01Å; T236-T247 PolarHBondContact N-O 3.07Å; T236-T247 PolarHBondContact O-N 3.48Å
237	K	88	Confident	84.8	Confident	72 Å²	72	66.3 Å²	66.3	31%	0.313	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	116.4	172.8	177.5	173.5	173.4	167.9	0	109.5	V221 S222 V239 E244 T245 I246	V221-K237 CarbonylContact C-O 3.47Å; V221-K237 WeakPolarHBondContact CA-O 3.2Å; S222-K237 PolarHBondContact N-O 3.49Å; S222-K237 PolarHBondContact O-N 2.95Å; K237-V239 HydrophobicContact CG-CG2 4.26Å; K237-E244 VanDerWaalsContact CE-OE1 3.23Å; K237-E244 WeakPolarHBondContact CE-OE1 3.41Å; K237-E244 VanDerWaalsContact CE-OE2 3.27Å; K237-E244 WeakPolarHBondContact CE-OE2 3.31Å; K237-E244 IonicContact NZ-OE1 2.72Å; K237-E244 PolarHBondContact NZ-OE1 3.11Å; K237-E244 IonicContact NZ-OE2 3.7Å; K237-E244 PolarHBondContact NZ-OE2 3.46Å; K237-T245 CarbonylContact C-O 3.54Å; K237-T245 WeakPolarHBondContact CA-O 3.38Å; K237-I246 HydrophobicContact CB-CG1 4.34Å; K237-I246 HydrophobicContact CG-CG1 4.17Å
238	V	87.1	Confident	84.7	Confident	28 Å²	28	61.1 Å²	61.1	17%	0.17	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	117.7	174.6	-179.7	0	0	0	0	108.2	S220 V221 T236 E240 E244 T245	S220-V238 CarbonylContact O-C 3.49Å; S220-V238 WeakPolarHBondContact O-CA 3.32Å; V221-V238 HydrophobicContact CG1-CG2 4.17Å; V221-V238 HydrophobicContact CG2-CG1 4.16Å; V221-V238 HydrophobicContact CG2-CG2 4.19Å; T236-V238 HydrophobicContact CG2-CG2 4.03Å; V238-E240 HydrophobicContact CG1-CB 4.48Å; V238-E244 CarbonylContact O-C 3.56Å; V238-E244 WeakPolarHBondContact O-CA 3.3Å; V238-T245 PolarHBondContact N-O 3.23Å; V238-T245 PolarHBondContact O-N 2.91Å
239	V	84.2	Confident	84.7	Confident	27 Å²	27	60.4 Å²	60.4	16%	0.164	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	115.8	171.4	-175.6	0	0	0	0	107.6	R219 S220 K237 T243 E244 C262	R219-V239 CarbonylContact C-O 3.52Å; R219-V239 WeakPolarHBondContact CA-O 3.4Å; S220-V239 PolarHBondContact N-O 3.04Å; S220-V239 PolarHBondContact O-N 2.72Å; K237-V239 HydrophobicContact CG-CG2 4.26Å; V239-T243 CarbonylContact C-O 3.56Å; V239-T243 VanDerWaalsContact CA-O 3.3Å; V239-T243 WeakPolarHBondContact CA-O 2.94Å; V239-E244 HydrophobicContact CG1-CG 4.23Å; V239-E244 HydrophobicContact CG2-CB 4.24Å; V239-E244 HydrophobicContact CG2-CG 3.81Å; V239-C262 WeakPolarHBondContact CG1-SG 3.18Å
240	E	79.1	Confident	84.8	Confident	87 Å²	87	54.1 Å²	54.1	41%	0.407	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	127.4	-179.2	-173.5	170.5	166.7	0	0	109.7	F218 R219 V238 G242 T243	F218-E240 WeakPolarHBondContact O-CA 3.3Å; R219-E240 HydrophobicContact CB-CG 4.28Å; R219-E240 WeakPolarHBondContact CD-OE2 3.36Å; R219-E240 HydrophobicContact CG-CB 4.15Å; R219-E240 HydrophobicContact CG-CG 4.16Å; R219-E240 IonicContact NE-OE2 2.83Å; R219-E240 PolarHBondContact NE-OE2 2.8Å; V238-E240 HydrophobicContact CG1-CB 4.48Å; E240-G242 PolarHBondContact O-N 3.04Å; E240-G242 VanDerWaalsContact O-N 3.09Å; E240-T243 PolarHBondContact N-O 3.06Å; E240-T243 WeakPolarHBondContact O-CB 3.43Å; E240-T243 PolarHBondContact O-N 2.93Å
241	N	77.5	Confident	84.7	Confident	111 Å²	111	54.4 Å²	54.4	59%	0.594	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.5	35	176.5	-57	-29.9	0	0	0	114	G217 F218	G217-N241 VanDerWaalsContact CA-OD1 3.3Å; G217-N241 WeakPolarHBondContact CA-OD1 3.23Å; F218-N241 PolarHBondContact O-N 3.43Å; F218-N241 VanDerWaalsContact O-N 3.12Å
242	G	75	Confident	84.7	Confident	36 Å²	36	51.6 Å²	51.6	37%	0.371	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	80.7	11.4	-177.1	0	0	0	0	0	115	E240 Q261 C262	E240-G242 PolarHBondContact O-N 3.04Å; E240-G242 VanDerWaalsContact O-N 3.09Å; G242-Q261 CarbonylContact O-C 3.44Å; G242-C262 WeakPolarHBondContact O-CB 3.22Å; G242-C262 PolarHBondContact O-N 3.1Å
243	T	78.2	Confident	84.8	Confident	48 Å²	48	55.1 Å²	55.1	29%	0.294	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	121.1	174.4	-54.7	0	0	0	0	110.3	V239 E240 V259 R260	V239-T243 CarbonylContact C-O 3.56Å; V239-T243 VanDerWaalsContact CA-O 3.3Å; V239-T243 WeakPolarHBondContact CA-O 2.94Å; E240-T243 PolarHBondContact N-O 3.06Å; E240-T243 WeakPolarHBondContact O-CB 3.43Å; E240-T243 PolarHBondContact O-N 2.93Å; T243-V259 HydrophobicContact CG2-CG1 3.48Å; T243-V259 VanDerWaalsContact CG2-CG1 3.48Å; T243-R260 CarbonylContact C-O 3.5Å
244	E	84.1	Confident	84.6	Confident	50 Å²	50	58.1 Å²	58.1	23%	0.234	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	122.2	171.2	-47.1	-160.1	141.9	0	0	110.8	K237 V238 V239 V259 R260 C262	K237-E244 VanDerWaalsContact CE-OE1 3.23Å; K237-E244 WeakPolarHBondContact CE-OE1 3.41Å; K237-E244 VanDerWaalsContact CE-OE2 3.27Å; K237-E244 WeakPolarHBondContact CE-OE2 3.31Å; K237-E244 IonicContact NZ-OE1 2.72Å; K237-E244 PolarHBondContact NZ-OE1 3.11Å; K237-E244 IonicContact NZ-OE2 3.7Å; K237-E244 PolarHBondContact NZ-OE2 3.46Å; V238-E244 CarbonylContact O-C 3.56Å; V238-E244 WeakPolarHBondContact O-CA 3.3Å; V239-E244 HydrophobicContact CG1-CG 4.23Å; V239-E244 HydrophobicContact CG2-CB 4.24Å; V239-E244 HydrophobicContact CG2-CG 3.81Å; E244-V259 CarbonylContact O-C 3.56Å; E244-V259 WeakPolarHBondContact O-CA 3.41Å; E244-R260 WeakPolarHBondContact CA-O 3.35Å; E244-R260 PolarHBondContact N-O 2.81Å; E244-R260 PolarHBondContact O-N 2.93Å; E244-R260 VanDerWaalsContact O-O 3.12Å; E244-C262 WeakPolarHBondContact CG-SG 3.14Å
245	T	86.4	Confident	84.7	Confident	32 Å²	32	57.5 Å²	57.5	20%	0.196	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	119.7	171.1	-59.5	0	0	0	0	108.8	K237 V238 Q257 T258 V259	K237-T245 CarbonylContact C-O 3.54Å; K237-T245 WeakPolarHBondContact CA-O 3.38Å; V238-T245 PolarHBondContact N-O 3.23Å; V238-T245 PolarHBondContact O-N 2.91Å; T245-Q257 HydrophobicContact CG2-CG 4.35Å; T245-T258 CarbonylContact C-O 3.54Å; T245-T258 WeakPolarHBondContact CA-O 3.01Å; T245-V259 HydrophobicContact CG2-CG2 4.04Å
246	I	87.4	Confident	84.5	Confident	43 Å²	43	59.3 Å²	59.3	22%	0.221	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	120.3	176.6	-56.9	171.2	0	0	0	107.7	V235 T236 K237 Q257 T258	V235-I246 HydrophobicContact CG1-CG2 3.77Å; T236-I246 CarbonylContact O-C 3.52Å; T236-I246 WeakPolarHBondContact O-CA 3.01Å; K237-I246 HydrophobicContact CB-CG1 4.34Å; K237-I246 HydrophobicContact CG-CG1 4.17Å; I246-Q257 CarbonylContact O-C 3.48Å; I246-Q257 WeakPolarHBondContact O-CA 3.48Å; I246-T258 PolarHBondContact N-O 3.43Å; I246-T258 PolarHBondContact O-N 3.13Å
247	T	87.7	Confident	84.4	Confident	21 Å²	21	64.4 Å²	64.4	13%	0.129	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	123.5	177.1	-53.7	0	0	0	0	109	V235 T236 E249 V254	V235-T247 CarbonylContact C-O 3.42Å; V235-T247 VanDerWaalsContact CA-O 3.3Å; V235-T247 WeakPolarHBondContact CA-O 3.37Å; T236-T247 PolarHBondContact N-O 3.07Å; T236-T247 PolarHBondContact O-N 3.48Å; T247-E249 HydrophobicContact CG2-CG 4.38Å; T247-V254 HydrophobicContact CG2-CB 4.49Å; T247-V254 HydrophobicContact CG2-CG1 3.77Å; T247-V254 HydrophobicContact CG2-CG2 3.93Å
248	E	86.9	Confident	84.3	Confident	75 Å²	75	63 Å²	63	35%	0.35	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	127.5	172.6	-54.7	-172.4	156.9	0	0	109.4	R234 V235 V254 T255 N256	R234-E248 CarbonylContact O-C 3.53Å; R234-E248 WeakPolarHBondContact O-CA 3.14Å; V235-E248 HydrophobicContact CG1-CG 4.3Å; V235-E248 HydrophobicContact CG2-CG 4.12Å; E248-V254 CarbonylContact O-C 3.53Å; E248-V254 WeakPolarHBondContact O-CA 3.45Å; E248-T255 PolarHBondContact O-N 2.75Å; E248-T255 PolarHBondContact O-OG1 2.87Å; E248-N256 HydrophobicContact CB-CB 4.06Å; E248-N256 HydrophobicContact CG-CB 4.21Å; E248-N256 PolarHBondContact N-O 3.45Å; E248-N256 PolarHBondContact O-N 3Å
249	E	87.6	Confident	84.3	Confident	43 Å²	43	65.9 Å²	65.9	20%	0.201	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	137.1	178.2	-67.1	166.3	-160.4	0	0	109.2	V233 R234 T247 H253 V254	V233-E249 CarbonylContact C-O 3.51Å; V233-E249 WeakPolarHBondContact CA-O 3.24Å; R234-E249 HydrophobicContact CB-CB 4.22Å; R234-E249 PolarHBondContact N-O 2.84Å; R234-E249 PolarHBondContact O-N 3.03Å; T247-E249 HydrophobicContact CG2-CG 4.38Å; E249-H253 CarbonylContact C-O 3.49Å; E249-H253 VanDerWaalsContact CA-O 3.24Å; E249-H253 WeakPolarHBondContact CA-O 3.47Å; E249-V254 HydrophobicContact CG-CG2 3.89Å
250	V	86.3	Confident	84.4	Confident	32 Å²	32	72.5 Å²	72.5	19%	0.194	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	121.5	171.3	-177.4	0	0	0	0	108.4	K231 M232 V233 G252 H253 T255	K231-V250 HydrophobicContact CB-CG1 3.73Å; K231-V250 HydrophobicContact CD-CG1 3.76Å; K231-V250 HydrophobicContact CG-CG1 4.38Å; M232-V250 CarbonylContact O-C 3.59Å; M232-V250 VanDerWaalsContact O-CA 3.31Å; M232-V250 WeakPolarHBondContact O-CA 3.35Å; V233-V250 HydrophobicContact CG1-CG2 4.36Å; V233-V250 HydrophobicContact CG2-CG2 4.16Å; V250-G252 PolarHBondContact O-N 2.86Å; V250-G252 VanDerWaalsContact O-N 3.17Å; V250-H253 PolarHBondContact N-O 3.28Å; V250-H253 PolarHBondContact O-N 3.27Å; V250-T255 HydrophobicContact CB-CG2 3.69Å; V250-T255 HydrophobicContact CG2-CG2 3.48Å; V250-T255 VanDerWaalsContact CG2-CG2 3.48Å
251	D	83.9	Confident	84.4	Confident	81 Å²	81	76.3 Å²	76.3	43%	0.433	41%	0.412	S	S	.	.	T	Hydrogen-bonded Turn	trans	49.1	40.8	-176.1	-59.5	-35.4	0	0	0	112.7	K231 M232 H253	K231-D251 WeakPolarHBondContact CA-OD1 3.07Å; K231-D251 WeakPolarHBondContact CB-OD2 3.46Å; K231-D251 WeakPolarHBondContact CD-OD2 3.32Å; K231-D251 VanDerWaalsContact CG-OD2 3.23Å; K231-D251 WeakPolarHBondContact CG-OD2 3.5Å; M232-D251 PolarHBondContact N-OD1 3.08Å; M232-D251 PolarHBondContact O-N 2.94Å; D251-H253 VanDerWaalsContact C-N 3.32Å; D251-H253 PolarHBondContact O-N 3.47Å; D251-H253 PolarHBondContact O-ND1 3.22Å; D251-H253 VanDerWaalsContact O-ND1 3.14Å
252	G	81.7	Confident	83.9	Confident	54 Å²	54	73.1 Å²	73.1	56%	0.557	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	80.4	1.3	-179.8	0	0	0	0	0	115.7	V250	V250-G252 PolarHBondContact O-N 2.86Å; V250-G252 VanDerWaalsContact O-N 3.17Å
253	H	82.7	Confident	83.2	Confident	142 Å²	142	74.8 Å²	74.8	66%	0.657	42%	0.415	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-105.1	126.5	177.7	-66.1	67.7	0	0	0	110.5	E249 V250 D251 T255	E249-H253 CarbonylContact C-O 3.49Å; E249-H253 VanDerWaalsContact CA-O 3.24Å; E249-H253 WeakPolarHBondContact CA-O 3.47Å; V250-H253 PolarHBondContact N-O 3.28Å; V250-H253 PolarHBondContact O-N 3.27Å; D251-H253 VanDerWaalsContact C-N 3.32Å; D251-H253 PolarHBondContact O-N 3.47Å; D251-H253 PolarHBondContact O-ND1 3.22Å; D251-H253 VanDerWaalsContact O-ND1 3.14Å; H253-T255 PolarHBondContact O-N 2.93Å; H253-T255 VanDerWaalsContact O-N 3.16Å
254	V	86.3	Confident	82	Confident	85 Å²	85	81 Å²	81	52%	0.515	45%	0.447	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.1	116	176.6	-179.8	0	0	0	0	109.5	T247 E248 E249	T247-V254 HydrophobicContact CG2-CB 4.49Å; T247-V254 HydrophobicContact CG2-CG1 3.77Å; T247-V254 HydrophobicContact CG2-CG2 3.93Å; E248-V254 CarbonylContact O-C 3.53Å; E248-V254 WeakPolarHBondContact O-CA 3.45Å; E249-V254 HydrophobicContact CG-CG2 3.89Å
255	T	88	Confident	80.2	Confident	86 Å²	86	81.9 Å²	81.9	53%	0.528	47%	0.469	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	-31.3	177.8	51.6	0	0	0	0	112.6	E248 V250 H253	E248-T255 PolarHBondContact O-N 2.75Å; E248-T255 PolarHBondContact O-OG1 2.87Å; V250-T255 HydrophobicContact CB-CG2 3.69Å; V250-T255 HydrophobicContact CG2-CG2 3.48Å; V250-T255 VanDerWaalsContact CG2-CG2 3.48Å; H253-T255 PolarHBondContact O-N 2.93Å; H253-T255 VanDerWaalsContact O-N 3.16Å
256	N	86.1	Confident	78.1	Confident	72 Å²	72	84.6 Å²	84.6	39%	0.385	50%	0.495	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.5	140.2	-179.6	-163.6	-48	0	0	0	110.1	E248 T258	E248-N256 HydrophobicContact CB-CB 4.06Å; E248-N256 HydrophobicContact CG-CB 4.21Å; E248-N256 PolarHBondContact N-O 3.45Å; E248-N256 PolarHBondContact O-N 3Å; N256-T258 PolarHBondContact OD1-OG1 2.83Å
257	Q	87.9	Confident	75.9	Confident	128 Å²	128	90.6 Å²	90.6	60%	0.598	53%	0.526	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-135.3	122.2	170.9	-169.5	178.1	13.7	0	0	108.7	T245 I246	T245-Q257 HydrophobicContact CG2-CG 4.35Å; I246-Q257 CarbonylContact O-C 3.48Å; I246-Q257 WeakPolarHBondContact O-CA 3.48Å
258	T	86.7	Confident	73.4	Confident	41 Å²	41	98.8 Å²	98.8	25%	0.252	56%	0.563	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-124.2	124.3	-178	-67.1	0	0	0	0	109.6	T245 I246 N256 R260	T245-T258 CarbonylContact C-O 3.54Å; T245-T258 WeakPolarHBondContact CA-O 3.01Å; I246-T258 PolarHBondContact N-O 3.43Å; I246-T258 PolarHBondContact O-N 3.13Å; N256-T258 PolarHBondContact OD1-OG1 2.83Å; T258-R260 HydrophobicContact CG2-CG 3.95Å
259	V	87	Confident	71.3	Confident	90 Å²	90	99.8 Å²	99.8	55%	0.545	58%	0.584	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-112.2	129.3	176.4	-175.1	0	0	0	0	109	T243 E244 T245	T243-V259 HydrophobicContact CG2-CG1 3.48Å; T243-V259 VanDerWaalsContact CG2-CG1 3.48Å; E244-V259 CarbonylContact O-C 3.56Å; E244-V259 WeakPolarHBondContact O-CA 3.41Å; T245-V259 HydrophobicContact CG2-CG2 4.04Å
260	R	85.5	Confident	68.8	Low	166 Å²	166	110 Å²	110	63%	0.626	64%	0.635	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-138	146.3	179.4	-60.2	-178.1	-174.6	-179.2	2.5	109.2	T243 E244 T258	T243-R260 CarbonylContact C-O 3.5Å; E244-R260 WeakPolarHBondContact CA-O 3.35Å; E244-R260 PolarHBondContact N-O 2.81Å; E244-R260 PolarHBondContact O-N 2.93Å; E244-R260 VanDerWaalsContact O-O 3.12Å; T258-R260 HydrophobicContact CG2-CG 3.95Å
261	Q	78.9	Confident	67.9	Low	167 Å²	167	114 Å²	114	78%	0.78	66%	0.657	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-77	138	167.4	-75.8	-173.1	-8.9	0	0	109.9	G242 G263	G242-Q261 CarbonylContact O-C 3.44Å; Q261-G263 PolarHBondContact O-N 3.34Å
262	C	67.6	Low	67.1	Low	44 Å²	44	115.7 Å²	115.7	30%	0.297	67%	0.669	S	S	.	*			trans	-60.2	105.2	166.6	-68.1	0	0	0	0	108.1	V239 G242 E244 N264	V239-C262 WeakPolarHBondContact CG1-SG 3.18Å; G242-C262 WeakPolarHBondContact O-CB 3.22Å; G242-C262 PolarHBondContact O-N 3.1Å; E244-C262 WeakPolarHBondContact CG-SG 3.14Å; C262-N264 PolarHBondContact O-N 3.36Å
263	G	60.8	Low	66.3	Low	70 Å²	70	119.1 Å²	119.1	72%	0.722	68%	0.675	S	S	*	*			trans	-63.5	124.2	173.3	0	0	0	0	0	110.3	Q261 G265	Q261-G263 PolarHBondContact O-N 3.34Å; G263-G265 VanDerWaalsContact C-N 3.35Å; G263-G265 PolarHBondContact O-N 3.37Å
264	N	51.8	Low	65.3	Low	179 Å²	179	117.8 Å²	117.8	96%	0.957	68%	0.677	S	S	*	*	S	Bend	trans	-58.8	96.7	164	-68.3	-42.2	0	0	0	108.2	C262	C262-N264 PolarHBondContact O-N 3.36Å
265	G	46.5	Very low	64	Low	68 Å²	68	119.8 Å²	119.8	70%	0.701	69%	0.687	S	S	*	*			trans	-176.3	54.4	-171.1	0	0	0	0	0	113.7	G263	G263-G265 VanDerWaalsContact C-N 3.35Å; G263-G265 PolarHBondContact O-N 3.37Å
266	A	42.3	Very low	62.4	Low	90 Å²	90	122.1 Å²	122.1	74%	0.744	70%	0.697	S	S	*	*			trans	-58.4	135.6	153.9	0	0	0	0	0	109.1
267	L	41.9	Very low	60.7	Low	168 Å²	168	125.6 Å²	125.6	88%	0.88	72%	0.72	S	S	*	*			trans	59.2	85.5	158.1	-66.2	157.9	0	0	0	117.1
268	Q	34.7	Very low	58.6	Low	194 Å²	194	125.5 Å²	125.5	91%	0.907	73%	0.729	S	S	*	*			trans	-147.8	74.9	140.2	-155.8	134.4	34.3	0	0	109.8
269	A	43.6	Very low	56.3	Low	96 Å²	96	132.5 Å²	132.5	79%	0.793	77%	0.769	S	S	*	*			trans	-107.9	105.9	160.7	0	0	0	0	0	106.5
270	M	34.6	Very low	53.5	Low	258 Å²	258	136.4 Å²	136.4	100%	1.271	79%	0.789	S	S	*	*			trans	74.3	0	177.4	-59.1	-171.4	161.3	0	0	117.1

Retrieved 270 of 270 residues in 423.7 ms (Link to these results)

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