A0A077Z7P3_TRITR Loading...

Elongation factor G, mitochondrial

Mitochondrial GTPase that catalyzes the GTP-dependent ribosomal translocation step during translation elongation. During this step, the ribosome changes from the pre-translocational (PRE) to the post-translocational (POST) state as the newly formed A-site-bound peptidyl-tRNA and P-site-bound deacylated tRNA move to the P and E sites, respectively. Catalyzes the coordinated movement of the two tRNA molecules, the mRNA and conformational changes in the ribosome.

AlphaFold DB , UniProt , Accession A0A077Z7P3, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 715 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	50.7	Low	81.3	Confident	205 Å²	205	83.7 Å²	83.7	100%	1.01	40%	0.4	S	S	*	.				0	136.7	0	-119.6	175.6	-172	0	0	108.8
2	R	63.8	Low	82.4	Confident	239 Å²	239	76.8 Å²	76.8	90%	0.902	37%	0.367	S	S	*	.	P	Polyproline II helix	trans	-66.1	136.5	169.2	-79.1	-173.4	-174.3	176.3	2.7	108.6	L4	R2-L4 PolarHBondContact O-N 3.44Å
3	P	71.3	Confident	83.1	Confident	56 Å²	56	70.9 Å²	70.9	36%	0.364	34%	0.339	S	S	.	.	P	Polyproline II helix	trans	-62.1	136.2	178	25.4	-32.4	0	0	0	109.6	R312 F378	P3-R312 HydrophobicContact CB-CB 4.34Å; P3-F378 HydrophobicContact CB-CD1 4.29Å; P3-F378 HydrophobicContact CB-CD2 3.97Å; P3-F378 HydrophobicContact CB-CE1 4.29Å; P3-F378 HydrophobicContact CB-CE2 3.97Å; P3-F378 HydrophobicContact CB-CG 4.14Å; P3-F378 HydrophobicContact CB-CZ 4.14Å
4	L	80.6	Confident	83.7	Confident	70 Å²	70	65.9 Å²	65.9	37%	0.366	31%	0.314	S	S	.	.	P	Polyproline II helix	trans	-58.6	139.2	167.9	-75.1	166.9	0	0	0	108.9	R2 A6 I9 V78 R312	R2-L4 PolarHBondContact O-N 3.44Å; L4-A6 PolarHBondContact O-N 2.74Å; L4-I9 HydrophobicContact CB-CD1 4.4Å; L4-V78 HydrophobicContact CD1-CG2 3.71Å; L4-R312 VanDerWaalsContact O-CD 3.25Å; L4-R312 WeakPolarHBondContact O-CD 3.48Å; L4-R312 PolarHBondContact O-NE 3.42Å
5	P	85.4	Confident	84	Confident	78 Å²	78	61.5 Å²	61.5	51%	0.506	29%	0.293	S	S	.	.	P	Polyproline II helix	trans	-58	138.6	172.2	-22.3	32.5	0	0	0	110.6	K7 K8	P5-K7 PolarHBondContact O-N 2.66Å; P5-K7 VanDerWaalsContact O-N 3.16Å; P5-K8 PolarHBondContact O-N 2.98Å
6	A	84.8	Confident	84	Confident	17 Å²	17	57.8 Å²	57.8	14%	0.14	28%	0.276	C	S	.	.	G	3₁₀ helix	trans	-53.9	-38	179.4	0	0	0	0	0	112.2	L4 K8 I9 R312	L4-A6 PolarHBondContact O-N 2.74Å; A6-K8 PolarHBondContact O-N 3.27Å; A6-I9 WeakPolarHBondContact O-CB 3.4Å; A6-I9 PolarHBondContact O-N 3.4Å; A6-R312 HydrophobicContact CB-CG 4.49Å
7	K	88.8	Confident	83.4	Confident	156 Å²	156	56 Å²	56	68%	0.678	27%	0.267	S	S	*	.	G	3₁₀ helix	trans	-54.5	-23.3	175.6	-63.2	-170.7	177.3	-171.7	0	115	P5 R10	P5-K7 PolarHBondContact O-N 2.66Å; P5-K7 VanDerWaalsContact O-N 3.16Å; K7-R10 PolarHBondContact O-NH1 3.12Å
8	K	90.9	Very high	82.8	Confident	84 Å²	84	55.8 Å²	55.8	37%	0.365	27%	0.267	S	S	.	.	G	3₁₀ helix	trans	-97.3	18	178.6	-68.6	-170.6	165	-154.4	0	112.8	P5 A6 D76 T77 V78	P5-K8 PolarHBondContact O-N 2.98Å; A6-K8 PolarHBondContact O-N 3.27Å; K8-D76 WeakPolarHBondContact CD-O 3.21Å; K8-T77 CarbonylContact O-C 3.51Å; K8-T77 WeakPolarHBondContact O-CA 3.41Å; K8-T77 WeakPolarHBondContact O-CG2 3.19Å; K8-V78 PolarHBondContact O-N 3.01Å
9	I	91.6	Very high	82.3	Confident	2 Å²	2	58.5 Å²	58.5	1%	0.01	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	141	177.5	-57.5	174.4	0	0	0	108.6	L4 A6 V78 P283	L4-I9 HydrophobicContact CB-CD1 4.4Å; A6-I9 WeakPolarHBondContact O-CB 3.4Å; A6-I9 PolarHBondContact O-N 3.4Å; I9-V78 CarbonylContact C-O 3.52Å; I9-V78 VanDerWaalsContact CA-O 3.31Å; I9-V78 WeakPolarHBondContact CA-O 3.47Å; I9-P283 HydrophobicContact CB-CG 4.1Å; I9-P283 HydrophobicContact CG2-CG 3.88Å; I9-P283 WeakPolarHBondContact O-CD 3.21Å
10	R	93.7	Very high	82.3	Confident	14 Å²	14	55.6 Å²	55.6	5%	0.053	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	131	169.7	-64.9	-64.9	-178.1	-78.9	-0.3	108.9	K7 I12 T77 V78 V79 N80 V276 I277 L280 P281 D282	K7-R10 PolarHBondContact O-NH1 3.12Å; R10-I12 HydrophobicContact CB-CG2 4.31Å; R10-T77 HydrophobicContact CG-CG2 4.03Å; R10-V78 PolarHBondContact N-O 3.08Å; R10-V79 HydrophobicContact CB-CB 4.5Å; R10-V79 HydrophobicContact CB-CG1 4.23Å; R10-V79 HydrophobicContact CB-CG2 4.24Å; R10-V79 CarbonylContact O-C 3.57Å; R10-V79 WeakPolarHBondContact O-CA 3.44Å; R10-N80 PolarHBondContact O-N 3.31Å; R10-V276 HydrophobicContact CB-CG1 4.39Å; R10-V276 HydrophobicContact CG-CG1 4.33Å; R10-I277 PolarHBondContact NH2-O 3.05Å; R10-L280 PolarHBondContact NE-O 3.26Å; R10-L280 VanDerWaalsContact NE-O 3.13Å; R10-P281 WeakPolarHBondContact CD-O 3.46Å; R10-D282 VanDerWaalsContact NH1-CB 3.31Å
11	N	93.1	Very high	82.3	Confident	0 Å²	0	53.4 Å²	53.4	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	102.6	174.3	-63.3	-41.3	0	0	0	108.6	N80 D102 G103 G380	N11-N80 WeakPolarHBondContact OD1-CB 3.34Å; N11-N80 PolarHBondContact OD1-ND2 2.83Å; N11-D102 HydrophobicContact CB-CB 4.24Å; N11-D102 WeakPolarHBondContact CB-OD2 3.2Å; N11-D102 PolarHBondContact ND2-OD2 3.03Å; N11-D102 PolarHBondContact O-N 2.99Å; N11-G103 PolarHBondContact O-N 3.15Å; N11-G380 PolarHBondContact ND2-O 3.25Å
12	I	93.9	Very high	84	Confident	1 Å²	1	44.3 Å²	44.3	1%	0.005	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	143.2	-172.5	68.1	168.4	0	0	0	113.3	R10 V79 N80 I81 I82 L101 G103 I105 V276 L280	R10-I12 HydrophobicContact CB-CG2 4.31Å; I12-V79 HydrophobicContact CD1-CG1 3.64Å; I12-V79 HydrophobicContact CG1-CG1 3.76Å; I12-N80 PolarHBondContact N-O 2.97Å; I12-I81 HydrophobicContact CD1-CG1 4.17Å; I12-I81 HydrophobicContact CG1-CG1 4.02Å; I12-I81 WeakPolarHBondContact O-CA 3.17Å; I12-I82 PolarHBondContact O-N 2.8Å; I12-L101 WeakPolarHBondContact O-CD2 3.41Å; I12-G103 VanDerWaalsContact CA-O 3.27Å; I12-G103 WeakPolarHBondContact CA-O 3.47Å; I12-I105 HydrophobicContact CD1-CD1 3.86Å; I12-I105 HydrophobicContact CD1-CG1 4.47Å; I12-V276 HydrophobicContact CD1-CG1 4.06Å; I12-V276 HydrophobicContact CD1-CG2 4.07Å; I12-V276 HydrophobicContact CG2-CG1 4.08Å; I12-L280 HydrophobicContact CG2-CD1 3.64Å
13	G	92.1	Very high	84.9	Confident	0 Å²	0	33.6 Å²	33.6	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	145.7	167.8	0	0	0	0	0	112	I82 G103 A104 I105	G13-I82 WeakPolarHBondContact CA-O 3.43Å; G13-G103 PolarHBondContact N-O 3.12Å; G13-A104 CarbonylContact O-C 3.52Å; G13-A104 VanDerWaalsContact O-CA 3.26Å; G13-A104 WeakPolarHBondContact O-CA 3.3Å; G13-I105 PolarHBondContact O-N 3.17Å
14	I	91.7	Very high	85.7	Confident	0 Å²	0	32.1 Å²	32.1	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	116.7	168.4	-63.3	173.3	0	0	0	107.9	K22 T26 I29 I81 I82 T84 I105 I107	I14-K22 HydrophobicContact CG2-CB 4.11Å; I14-K22 HydrophobicContact CG2-CG 4.13Å; I14-T26 HydrophobicContact CD1-CG2 4.41Å; I14-T26 WeakPolarHBondContact CD1-OG1 3.34Å; I14-I29 HydrophobicContact CD1-CD1 4.06Å; I14-I81 HydrophobicContact CD1-CG2 3.65Å; I14-I81 HydrophobicContact CG1-CG2 4.09Å; I14-I82 PolarHBondContact N-O 2.89Å; I14-T84 PolarHBondContact O-N 2.94Å; I14-T84 VanDerWaalsContact O-N 3.13Å; I14-T84 PolarHBondContact O-OG1 3.49Å; I14-I105 HydrophobicContact CG1-CD1 4.43Å; I14-I107 HydrophobicContact CG2-CD1 3.38Å; I14-I107 HydrophobicContact CG2-CG1 4.24Å
15	S	87.8	Confident	86.2	Confident	0 Å²	0	28.8 Å²	28.8	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	144	-177.8	-56.9	0	0	0	0	111	T84 I105 L106 I107	S15-T84 WeakPolarHBondContact CA-OG1 3.04Å; S15-T84 PolarHBondContact OG-OG1 3.41Å; S15-I105 PolarHBondContact N-O 2.84Å; S15-I105 VanDerWaalsContact O-O 3.08Å; S15-L106 WeakPolarHBondContact O-CA 3.48Å; S15-I107 PolarHBondContact O-N 3.21Å
16	A	83.4	Confident	86.4	Confident	2 Å²	2	25 Å²	25	2%	0.017	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-172.4	167.8	-174.9	0	0	0	0	0	111.3	K22 G86 I107	A16-K22 HydrophobicContact CB-CD 3.53Å; A16-K22 HydrophobicContact CB-CG 3.24Å; A16-K22 PolarHBondContact O-NZ 2.93Å; A16-G86 WeakPolarHBondContact O-CA 3.35Å; A16-I107 HydrophobicContact CB-CB 3.73Å; A16-I107 HydrophobicContact CB-CG2 4.49Å; A16-I107 VanDerWaalsContact CB-O 3.28Å; A16-I107 WeakPolarHBondContact CB-O 3.34Å
17	H	74.4	Confident	86.5	Confident	28 Å²	28	24.2 Å²	24.2	13%	0.13	12%	0.119	C	C	.	.			trans	-64.4	161.3	165.3	-169.2	74.4	0	0	0	112.4	S20 K22 Q115 Q117	H17-S20 WeakPolarHBondContact O-CB 3.38Å; H17-S20 PolarHBondContact O-N 3.5Å; H17-S20 PolarHBondContact O-OG 2.95Å; H17-K22 PolarHBondContact O-NZ 2.79Å; H17-Q115 HydrophobicContact CB-CB 4.39Å; H17-Q115 VanDerWaalsContact CB-OE1 3.3Å; H17-Q115 PolarHBondContact CD2-NE2 2.76Å; H17-Q115 PolarHBondContact CD2-OE1 2.86Å; H17-Q115 PolarHBondContact NE2-NE2 2.86Å; H17-Q117 PolarHBondContact CE1-OE1 2.87Å; H17-Q117 VanDerWaalsContact CE1-OE1 3.23Å; H17-Q117 WeakPolarHBondContact ND1-CB 3.45Å; H17-Q117 WeakPolarHBondContact ND1-CG 3.33Å; H17-Q117 PolarHBondContact ND1-OE1 2.91Å
18	I	72.9	Confident	86.6	Confident	52 Å²	52	17.3 Å²	17.3	27%	0.267	9%	0.088	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.8	142.3	172.5	-57	159.7	0	0	0	109.8	S20 I63 H87	I18-S20 PolarHBondContact O-N 3.16Å; I18-S20 VanDerWaalsContact O-N 3.08Å; I18-I63 HydrophobicContact CG2-CG2 4.47Å; I18-H87 HydrophobicContact CD1-CB 4.41Å; I18-H87 WeakPolarHBondContact CD1-CD2 3.45Å
19	D	73.7	Confident	86.6	Confident	107 Å²	107	13.3 Å²	13.3	57%	0.572	7%	0.071	S	C	*	.	T	Hydrogen-bonded Turn	trans	51.5	31.5	-177.5	-166.8	33.1	0	0	0	114.8	G21 K138 R141	D19-G21 VanDerWaalsContact C-N 3.31Å; D19-K138 WeakPolarHBondContact O-CE 3.49Å; D19-K138 PolarHBondContact O-NZ 2.72Å; D19-K138 IonicContact OD1-NZ 3.03Å; D19-K138 PolarHBondContact OD1-NZ 3.18Å; D19-K138 IonicContact OD2-NZ 2.69Å; D19-K138 PolarHBondContact OD2-NZ 2.85Å; D19-K138 VanDerWaalsContact OD2-NZ 3.14Å; D19-R141 IonicContact OD2-NH1 3.28Å
20	S	80.7	Confident	86.4	Confident	1 Å²	1	13.2 Å²	13.2	1%	0.007	7%	0.071	C	C	.	.	S	Bend	trans	-85.8	-7	167.6	-63.3	0	0	0	0	113	H17 I18 N137	H17-S20 WeakPolarHBondContact O-CB 3.38Å; H17-S20 PolarHBondContact O-N 3.5Å; H17-S20 PolarHBondContact O-OG 2.95Å; I18-S20 PolarHBondContact O-N 3.16Å; I18-S20 VanDerWaalsContact O-N 3.08Å; S20-N137 PolarHBondContact O-ND2 2.74Å
21	G	82.7	Confident	86.2	Confident	9 Å²	9	14.2 Å²	14.2	9%	0.093	8%	0.076	C	C	.	.			trans	86.5	31.8	-179.2	0	0	0	0	0	114.7	D19 T24 V25	D19-G21 VanDerWaalsContact C-N 3.31Å; G21-T24 PolarHBondContact O-N 3.41Å; G21-V25 WeakPolarHBondContact O-CG2 3.48Å; G21-V25 PolarHBondContact O-N 3.45Å
22	K	86.7	Confident	86	Confident	14 Å²	14	15.5 Å²	15.5	6%	0.061	8%	0.081	C	C	.	.	H	α-helix	trans	-52.5	-61.6	175.1	-69.6	-176	-74.9	-73.5	0	112	I14 A16 H17 T24 V25 T26 T84 I107	I14-K22 HydrophobicContact CG2-CB 4.11Å; I14-K22 HydrophobicContact CG2-CG 4.13Å; A16-K22 HydrophobicContact CB-CD 3.53Å; A16-K22 HydrophobicContact CB-CG 3.24Å; A16-K22 PolarHBondContact O-NZ 2.93Å; H17-K22 PolarHBondContact O-NZ 2.79Å; K22-T24 PolarHBondContact O-N 2.98Å; K22-V25 WeakPolarHBondContact O-CA 3.4Å; K22-V25 WeakPolarHBondContact O-CB 3.28Å; K22-V25 PolarHBondContact O-N 2.95Å; K22-T26 PolarHBondContact O-N 2.94Å; K22-T26 PolarHBondContact O-OG1 3.07Å; K22-T26 VanDerWaalsContact O-OG1 3.07Å; K22-T84 WeakPolarHBondContact CE-O 3.25Å; K22-I107 HydrophobicContact CG-CD1 4.27Å
23	T	83.8	Confident	85.6	Confident	14 Å²	14	16.4 Å²	16.4	9%	0.086	9%	0.087	C	C	.	.	H	α-helix	trans	-56.7	-39.6	-178.7	-35.6	0	0	0	0	111.3	T26 E27 V42 A50 M52 T64	T23-T26 PolarHBondContact O-N 3.12Å; T23-E27 VanDerWaalsContact O-CB 3.3Å; T23-E27 WeakPolarHBondContact O-CB 3.25Å; T23-E27 PolarHBondContact O-N 2.95Å; T23-V42 HydrophobicContact CG2-CG2 3.96Å; T23-A50 HydrophobicContact CG2-CB 3.79Å; T23-M52 HydrophobicContact CG2-CB 3.95Å; T23-T64 PolarHBondContact OG1-OG1 3.43Å
24	T	87.9	Confident	85.1	Confident	25 Å²	25	19.2 Å²	19.2	15%	0.153	12%	0.116	C	C	.	.	H	α-helix	trans	-63.8	-44.3	175.4	-45.6	0	0	0	0	112	G21 K22 E27 R28 A263	G21-T24 PolarHBondContact O-N 3.41Å; K22-T24 PolarHBondContact O-N 2.98Å; T24-E27 PolarHBondContact O-N 2.97Å; T24-R28 VanDerWaalsContact O-CG 3.27Å; T24-R28 WeakPolarHBondContact O-CG 3.39Å; T24-R28 PolarHBondContact O-N 2.87Å; T24-A263 HydrophobicContact CG2-CB 3.85Å
25	V	91.2	Very high	84.5	Confident	0 Å²	0	23.4 Å²	23.4	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-62.4	-46.6	175.3	170.2	0	0	0	0	110.5	G21 K22 E27 R28 I29 I107 F135 A263 L272	G21-V25 WeakPolarHBondContact O-CG2 3.48Å; G21-V25 PolarHBondContact O-N 3.45Å; K22-V25 WeakPolarHBondContact O-CA 3.4Å; K22-V25 WeakPolarHBondContact O-CB 3.28Å; K22-V25 PolarHBondContact O-N 2.95Å; V25-E27 VanDerWaalsContact C-N 3.32Å; V25-E27 PolarHBondContact O-N 2.6Å; V25-R28 PolarHBondContact O-N 2.82Å; V25-I29 HydrophobicContact CG1-CD1 3.87Å; V25-I29 HydrophobicContact CG1-CG1 4.44Å; V25-I29 WeakPolarHBondContact O-CG1 3.45Å; V25-I29 PolarHBondContact O-N 2.63Å; V25-I107 HydrophobicContact CB-CD1 3.87Å; V25-I107 HydrophobicContact CG1-CD1 4.09Å; V25-I107 HydrophobicContact CG2-CD1 3.86Å; V25-F135 HydrophobicContact CG2-CD1 4.26Å; V25-F135 HydrophobicContact CG2-CE1 3.88Å; V25-A263 HydrophobicContact CB-CB 4.5Å; V25-A263 HydrophobicContact CG2-CB 3.59Å; V25-L272 HydrophobicContact CG1-CD2 4.1Å
26	T	89.1	Confident	84	Confident	0 Å²	0	24.4 Å²	24.4	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-56.4	-46.4	176.6	-49.5	0	0	0	0	111.4	I14 K22 T23 R28 I29 L30 M52 I81 D83	I14-T26 HydrophobicContact CD1-CG2 4.41Å; I14-T26 WeakPolarHBondContact CD1-OG1 3.34Å; K22-T26 PolarHBondContact O-N 2.94Å; K22-T26 PolarHBondContact O-OG1 3.07Å; K22-T26 VanDerWaalsContact O-OG1 3.07Å; T23-T26 PolarHBondContact O-N 3.12Å; T26-R28 PolarHBondContact O-N 2.68Å; T26-I29 WeakPolarHBondContact O-CB 3.4Å; T26-I29 PolarHBondContact O-N 3.42Å; T26-L30 WeakPolarHBondContact O-CG 3.37Å; T26-L30 PolarHBondContact O-N 2.88Å; T26-M52 HydrophobicContact CG2-CE 3.81Å; T26-M52 HydrophobicContact CG2-CG 3.83Å; T26-M52 HydrophobicContact CG2-SD 4.05Å; T26-I81 HydrophobicContact CG2-CG2 4.28Å; T26-D83 HydrophobicContact CG2-CB 4.46Å; T26-D83 PolarHBondContact OG1-OD2 3.32Å
27	E	87.3	Confident	83.4	Confident	0 Å²	0	31.5 Å²	31.5	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-64.5	-39.8	178.1	-173.7	162.5	-156	0	0	112.4	T23 T24 V25 I29 L30 F31 I36 H40 A50	T23-E27 VanDerWaalsContact O-CB 3.3Å; T23-E27 WeakPolarHBondContact O-CB 3.25Å; T23-E27 PolarHBondContact O-N 2.95Å; T24-E27 PolarHBondContact O-N 2.97Å; V25-E27 VanDerWaalsContact C-N 3.32Å; V25-E27 PolarHBondContact O-N 2.6Å; E27-I29 VanDerWaalsContact C-N 3.34Å; E27-I29 PolarHBondContact O-N 2.83Å; E27-L30 PolarHBondContact O-N 2.88Å; E27-F31 PolarHBondContact O-N 2.86Å; E27-I36 HydrophobicContact CG-CD1 3.79Å; E27-I36 WeakPolarHBondContact O-CD1 3.31Å; E27-H40 VanDerWaalsContact CD-O 3.24Å; E27-H40 WeakPolarHBondContact OE1-CA 3.46Å; E27-H40 WeakPolarHBondContact OE1-CB 3.49Å; E27-H40 PolarHBondContact OE1-N 2.86Å; E27-A50 VanDerWaalsContact OE2-CB 3.24Å; E27-A50 WeakPolarHBondContact OE2-CB 3.38Å
28	R	90.5	Very high	83.2	Confident	10 Å²	10	36.7 Å²	36.7	4%	0.038	20%	0.199	C	C	.	.	H	α-helix	trans	-64.8	-38.3	173.7	-65.1	-29.8	-173.7	-142.2	10	112.2	T24 V25 T26 L30 F31 Y32 M39 H40 A263 N266 V269	T24-R28 VanDerWaalsContact O-CG 3.27Å; T24-R28 WeakPolarHBondContact O-CG 3.39Å; T24-R28 PolarHBondContact O-N 2.87Å; V25-R28 PolarHBondContact O-N 2.82Å; T26-R28 PolarHBondContact O-N 2.68Å; R28-L30 VanDerWaalsContact C-N 3.34Å; R28-F31 PolarHBondContact O-N 2.81Å; R28-Y32 HydrophobicContact CB-CD2 4.32Å; R28-Y32 HydrophobicContact CB-CE2 3.97Å; R28-Y32 WeakPolarHBondContact O-CD2 3.43Å; R28-Y32 PolarHBondContact O-N 3.19Å; R28-M39 WeakPolarHBondContact CD-SD 3.4Å; R28-M39 PolarHBondContact NE-SD 2.82Å; R28-M39 VanDerWaalsContact NE-SD 3.39Å; R28-H40 PolarHBondContact NH1-O 3.26Å; R28-A263 HydrophobicContact CG-CB 4.29Å; R28-A263 WeakPolarHBondContact CG-O 3.24Å; R28-A263 PolarHBondContact NE-O 3.07Å; R28-N266 WeakPolarHBondContact CD-OD1 3.49Å; R28-N266 PolarHBondContact NE-OD1 2.86Å; R28-V269 HydrophobicContact CB-CB 4.49Å; R28-V269 HydrophobicContact CB-CG1 4.07Å; R28-V269 HydrophobicContact CB-CG2 4Å; R28-V269 HydrophobicContact CG-CG2 4.45Å
29	I	91.1	Very high	83.2	Confident	0 Å²	0	35.7 Å²	35.7	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-61.5	-43.8	174.8	-70.7	168.1	0	0	0	110.9	I14 V25 T26 E27 F31 Y32 S33 V72 I81 V269 L273	I14-I29 HydrophobicContact CD1-CD1 4.06Å; V25-I29 HydrophobicContact CG1-CD1 3.87Å; V25-I29 HydrophobicContact CG1-CG1 4.44Å; V25-I29 WeakPolarHBondContact O-CG1 3.45Å; V25-I29 PolarHBondContact O-N 2.63Å; T26-I29 WeakPolarHBondContact O-CB 3.4Å; T26-I29 PolarHBondContact O-N 3.42Å; E27-I29 VanDerWaalsContact C-N 3.34Å; E27-I29 PolarHBondContact O-N 2.83Å; I29-F31 VanDerWaalsContact C-N 3.29Å; I29-F31 PolarHBondContact O-N 2.85Å; I29-Y32 PolarHBondContact O-N 2.96Å; I29-S33 WeakPolarHBondContact O-CB 3.15Å; I29-S33 PolarHBondContact O-N 2.83Å; I29-S33 VanDerWaalsContact O-N 3.08Å; I29-S33 PolarHBondContact O-OG 3.32Å; I29-V72 HydrophobicContact CG2-CG1 4.36Å; I29-V72 HydrophobicContact CG2-CG2 4.17Å; I29-I81 HydrophobicContact CB-CD1 4.43Å; I29-I81 HydrophobicContact CG2-CD1 3.45Å; I29-I81 VanDerWaalsContact CG2-CD1 3.45Å; I29-V269 HydrophobicContact CG1-CG1 3.72Å; I29-L273 HydrophobicContact CB-CD2 4.38Å; I29-L273 HydrophobicContact CD1-CD2 4.16Å; I29-L273 HydrophobicContact CG1-CD1 4.38Å; I29-L273 HydrophobicContact CG1-CD2 3.92Å; I29-L273 HydrophobicContact CG1-CG 4.2Å; I29-L273 HydrophobicContact CG2-CD1 4.23Å; I29-L273 HydrophobicContact CG2-CD2 3.68Å; I29-L273 HydrophobicContact CG2-CG 4.46Å
30	L	87.9	Confident	83.1	Confident	0 Å²	0	32.1 Å²	32.1	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-60.5	-40.1	175.7	-69.3	172.1	0	0	0	111.7	T26 E27 R28 S33 R35 I36 M52 T70 V72	T26-L30 WeakPolarHBondContact O-CG 3.37Å; T26-L30 PolarHBondContact O-N 2.88Å; E27-L30 PolarHBondContact O-N 2.88Å; R28-L30 VanDerWaalsContact C-N 3.34Å; L30-S33 PolarHBondContact O-OG 2.88Å; L30-S33 VanDerWaalsContact O-OG 3.06Å; L30-R35 HydrophobicContact CD2-CB 4.32Å; L30-R35 WeakPolarHBondContact O-CB 3.32Å; L30-R35 PolarHBondContact O-N 2.92Å; L30-I36 HydrophobicContact CB-CD1 3.84Å; L30-I36 HydrophobicContact CB-CG1 3.9Å; L30-I36 HydrophobicContact CB-CG2 4.13Å; L30-I36 PolarHBondContact O-N 3.01Å; L30-M52 HydrophobicContact CD1-CG 4.4Å; L30-M52 HydrophobicContact CD1-SD 3.85Å; L30-T70 HydrophobicContact CD2-CG2 3.99Å; L30-V72 HydrophobicContact CD2-CG1 3.61Å
31	F	89	Confident	82.4	Confident	36 Å²	36	36.4 Å²	36.4	16%	0.158	19%	0.193	C	C	.	.	H	α-helix	trans	-68	-50.4	179	-180	-89.5	0	0	0	111.8	E27 R28 I29 S33 G34 I36 D37 M39 Y192	E27-F31 PolarHBondContact O-N 2.86Å; R28-F31 PolarHBondContact O-N 2.81Å; I29-F31 VanDerWaalsContact C-N 3.29Å; I29-F31 PolarHBondContact O-N 2.85Å; F31-S33 PolarHBondContact O-N 2.91Å; F31-G34 PolarHBondContact O-N 2.73Å; F31-I36 VanDerWaalsContact CA-CG1 3.45Å; F31-I36 HydrophobicContact CB-CD1 4.04Å; F31-I36 HydrophobicContact CB-CG1 3.76Å; F31-I36 HydrophobicContact CD2-CG1 4.36Å; F31-I36 WeakPolarHBondContact CD2-O 3.47Å; F31-D37 WeakPolarHBondContact CE2-O 3.42Å; F31-M39 HydrophobicContact CB-CE 3.86Å; F31-M39 HydrophobicContact CB-CG 3.87Å; F31-M39 HydrophobicContact CD1-CE 3.02Å; F31-M39 HydrophobicContact CD1-CG 4.32Å; F31-M39 HydrophobicContact CD1-SD 4.46Å; F31-M39 HydrophobicContact CD2-CE 3.95Å; F31-M39 HydrophobicContact CD2-CG 3.45Å; F31-M39 VanDerWaalsContact CD2-CG 3.45Å; F31-M39 HydrophobicContact CE1-CE 3.37Å; F31-M39 HydrophobicContact CE2-CE 4.23Å; F31-M39 HydrophobicContact CE2-CG 3.99Å; F31-M39 HydrophobicContact CG-CE 3.33Å; F31-M39 HydrophobicContact CG-CG 3.61Å; F31-M39 HydrophobicContact CG-SD 4.29Å; F31-M39 HydrophobicContact CZ-CE 3.96Å; F31-Y192 HydrophobicContact CZ-CG 4.46Å
32	Y	89.1	Confident	81.3	Confident	27 Å²	27	37.3 Å²	37.3	11%	0.106	20%	0.197	C	C	.	.	H	α-helix	trans	-66.4	-27.2	-177	-66.6	-48.8	0	0	0	113.4	R28 I29 G34 M39 W74 Y192 N266 V269 Q270	R28-Y32 HydrophobicContact CB-CD2 4.32Å; R28-Y32 HydrophobicContact CB-CE2 3.97Å; R28-Y32 WeakPolarHBondContact O-CD2 3.43Å; R28-Y32 PolarHBondContact O-N 3.19Å; I29-Y32 PolarHBondContact O-N 2.96Å; Y32-G34 PolarHBondContact O-N 2.67Å; Y32-M39 HydrophobicContact CE1-CE 4.24Å; Y32-W74 WeakPolarHBondContact O-CZ3 3.28Å; Y32-Y192 VanDerWaalsContact CE1-O 3.3Å; Y32-Y192 WeakPolarHBondContact CE1-O 3.38Å; Y32-Y192 PolarHBondContact OH-O 3.41Å; Y32-N266 WeakPolarHBondContact OH-CA 3.25Å; Y32-N266 WeakPolarHBondContact OH-CB 3.42Å; Y32-N266 PolarHBondContact OH-O 2.87Å; Y32-V269 HydrophobicContact CD2-CB 3.9Å; Y32-V269 HydrophobicContact CD2-CG1 3.78Å; Y32-V269 HydrophobicContact CE2-CB 3.65Å; Y32-V269 HydrophobicContact CE2-CG1 3.98Å; Y32-V269 HydrophobicContact CE2-CG2 4.16Å; Y32-Q270 HydrophobicContact CD1-CG 4.39Å; Y32-Q270 HydrophobicContact CD2-CG 4.17Å; Y32-Q270 HydrophobicContact CG-CG 4.06Å
33	S	85.9	Confident	80	Confident	20 Å²	20	44 Å²	44	14%	0.14	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.9	1.4	173	59.7	0	0	0	0	114.3	I29 L30 F31 R35 V72	I29-S33 WeakPolarHBondContact O-CB 3.15Å; I29-S33 PolarHBondContact O-N 2.83Å; I29-S33 VanDerWaalsContact O-N 3.08Å; I29-S33 PolarHBondContact O-OG 3.32Å; L30-S33 PolarHBondContact O-OG 2.88Å; L30-S33 VanDerWaalsContact O-OG 3.06Å; F31-S33 PolarHBondContact O-N 2.91Å; S33-R35 VanDerWaalsContact C-N 3.34Å; S33-V72 WeakPolarHBondContact OG-CB 3.39Å; S33-V72 WeakPolarHBondContact OG-CG1 3.47Å
34	G	81.5	Confident	78.9	Confident	59 Å²	59	44.2 Å²	44.2	61%	0.608	23%	0.231	S	C	*	.	T	Hydrogen-bonded Turn	trans	75.1	18.7	178.7	0	0	0	0	0	114.4	F31 Y32	F31-G34 PolarHBondContact O-N 2.73Å; Y32-G34 PolarHBondContact O-N 2.67Å
35	R	78	Confident	77.3	Confident	87 Å²	87	53 Å²	53	33%	0.328	27%	0.267	S	S	.	.	S	Bend	trans	-88.8	-26.5	-179.2	-70.6	-69.2	179.2	153.7	-3.9	113.7	L30 S33 Y71 V72	L30-R35 HydrophobicContact CD2-CB 4.32Å; L30-R35 WeakPolarHBondContact O-CB 3.32Å; L30-R35 PolarHBondContact O-N 2.92Å; S33-R35 VanDerWaalsContact C-N 3.34Å; R35-Y71 VanDerWaalsContact NH1-CZ 3.3Å; R35-Y71 PolarHBondContact NH1-OH 2.94Å; R35-V72 HydrophobicContact CG-CG1 4.18Å
36	I	77.6	Confident	75.7	Confident	21 Å²	21	58 Å²	58	11%	0.108	29%	0.294	C	S	.	.			trans	-123.5	137.8	172	63	176.5	0	0	0	109.7	E27 L30 F31	E27-I36 HydrophobicContact CG-CD1 3.79Å; E27-I36 WeakPolarHBondContact O-CD1 3.31Å; L30-I36 HydrophobicContact CB-CD1 3.84Å; L30-I36 HydrophobicContact CB-CG1 3.9Å; L30-I36 HydrophobicContact CB-CG2 4.13Å; L30-I36 PolarHBondContact O-N 3.01Å; F31-I36 VanDerWaalsContact CA-CG1 3.45Å; F31-I36 HydrophobicContact CB-CD1 4.04Å; F31-I36 HydrophobicContact CB-CG1 3.76Å; F31-I36 HydrophobicContact CD2-CG1 4.36Å; F31-I36 WeakPolarHBondContact CD2-O 3.47Å
37	D	69.9	Low	74.2	Confident	152 Å²	152	66.8 Å²	66.8	81%	0.813	34%	0.335	S	S	*	.	S	Bend	trans	-82.6	-23.1	-179.6	-62.7	-39.6	0	0	0	112.6	F31	F31-D37 WeakPolarHBondContact CE2-O 3.42Å
38	Q	70.7	Confident	72.9	Confident	137 Å²	137	70.2 Å²	70.2	64%	0.64	36%	0.356	S	S	*	.	S	Bend	trans	-137.6	137.9	-176.4	-63.9	-177	6	0	0	110
39	M	73.5	Confident	71.3	Confident	31 Å²	31	70.2 Å²	70.2	15%	0.153	36%	0.359	C	S	.	.			trans	-96.1	137.4	175.1	-32.6	167.6	166.5	0	0	110	R28 F31 Y32 Y192	R28-M39 WeakPolarHBondContact CD-SD 3.4Å; R28-M39 PolarHBondContact NE-SD 2.82Å; R28-M39 VanDerWaalsContact NE-SD 3.39Å; F31-M39 HydrophobicContact CB-CE 3.86Å; F31-M39 HydrophobicContact CB-CG 3.87Å; F31-M39 HydrophobicContact CD1-CE 3.02Å; F31-M39 HydrophobicContact CD1-CG 4.32Å; F31-M39 HydrophobicContact CD1-SD 4.46Å; F31-M39 HydrophobicContact CD2-CE 3.95Å; F31-M39 HydrophobicContact CD2-CG 3.45Å; F31-M39 VanDerWaalsContact CD2-CG 3.45Å; F31-M39 HydrophobicContact CE1-CE 3.37Å; F31-M39 HydrophobicContact CE2-CE 4.23Å; F31-M39 HydrophobicContact CE2-CG 3.99Å; F31-M39 HydrophobicContact CG-CE 3.33Å; F31-M39 HydrophobicContact CG-CG 3.61Å; F31-M39 HydrophobicContact CG-SD 4.29Å; F31-M39 HydrophobicContact CZ-CE 3.96Å; Y32-M39 HydrophobicContact CE1-CE 4.24Å; M39-Y192 HydrophobicContact CE-CD1 4.45Å; M39-Y192 HydrophobicContact SD-CD1 4.33Å
40	H	71.7	Confident	69.8	Low	32 Å²	32	70.2 Å²	70.2	15%	0.148	36%	0.359	C	S	.	.			trans	-110.5	175	172.4	-59.7	88.5	0	0	0	110.2	E27 R28 G49	E27-H40 VanDerWaalsContact CD-O 3.24Å; E27-H40 WeakPolarHBondContact OE1-CA 3.46Å; E27-H40 WeakPolarHBondContact OE1-CB 3.49Å; E27-H40 PolarHBondContact OE1-N 2.86Å; R28-H40 PolarHBondContact NH1-O 3.26Å; H40-G49 WeakPolarHBondContact CB-O 3.24Å
41	E	66.5	Low	68.6	Low	91 Å²	91	72.4 Å²	72.4	43%	0.425	37%	0.373	S	S	.	.			trans	-117	144.6	171.2	-69.4	-175	-178	0	0	109.5	K43 G44 L264	E41-K43 PolarHBondContact O-N 2.89Å; E41-K43 VanDerWaalsContact O-N 3.13Å; E41-G44 PolarHBondContact O-N 3.04Å; E41-G44 VanDerWaalsContact O-N 3.09Å; E41-L264 VanDerWaalsContact OE1-CD1 3.3Å; E41-L264 WeakPolarHBondContact OE1-CD1 3.19Å
42	V	59.2	Low	67.3	Low	28 Å²	28	70.9 Å²	70.9	17%	0.17	37%	0.366	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.3	-36.1	-178.8	-179.8	0	0	0	0	112.4	T23 A50	T23-V42 HydrophobicContact CG2-CG2 3.96Å; V42-A50 HydrophobicContact CG2-CB 3.9Å
43	K	59.3	Low	66	Low	153 Å²	153	69.6 Å²	69.6	67%	0.665	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-126.2	38.3	174.6	-67.2	-173.5	178.2	175	0	111.9	E41 R61	E41-K43 PolarHBondContact O-N 2.89Å; E41-K43 VanDerWaalsContact O-N 3.13Å; K43-R61 VanDerWaalsContact CE-O 3.32Å; K43-R61 WeakPolarHBondContact CE-O 3.26Å; K43-R61 PolarHBondContact NZ-O 3.36Å
44	G	59.6	Low	64.9	Low	20 Å²	20	71.8 Å²	71.8	21%	0.206	37%	0.368	C	S	.	.			trans	-65.7	159.5	176.3	0	0	0	0	0	112.2	E41 D46	E41-G44 PolarHBondContact O-N 3.04Å; E41-G44 VanDerWaalsContact O-N 3.09Å; G44-D46 PolarHBondContact O-N 2.68Å; G44-D46 VanDerWaalsContact O-N 3.1Å
45	K	54.9	Low	64.2	Low	209 Å²	209	70.1 Å²	70.1	91%	0.909	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.2	-14.5	174.9	-70.2	-175.7	178.3	179.1	0	113	Q47	K45-Q47 VanDerWaalsContact C-N 3.29Å; K45-Q47 PolarHBondContact O-N 3.01Å
46	D	57.5	Low	63.6	Low	106 Å²	106	72.2 Å²	72.2	57%	0.567	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.2	-8.6	-166.7	-41.1	-18.3	0	0	0	112.7	G44 V48	G44-D46 PolarHBondContact O-N 2.68Å; G44-D46 VanDerWaalsContact O-N 3.1Å; D46-V48 HydrophobicContact CB-CG2 4.4Å; D46-V48 WeakPolarHBondContact O-CG2 3.32Å; D46-V48 PolarHBondContact O-N 2.54Å
47	Q	56.9	Low	63.2	Low	184 Å²	184	71.6 Å²	71.6	86%	0.86	36%	0.355	S	S	*	.	S	Bend	trans	56.4	-4.4	-176.3	-60.4	-170.3	2.4	0	0	116.4	K45	K45-Q47 VanDerWaalsContact C-N 3.29Å; K45-Q47 PolarHBondContact O-N 3.01Å
48	V	60.7	Low	63.1	Low	71 Å²	71	64.4 Å²	64.4	43%	0.43	32%	0.317	S	S	.	.			trans	-66.8	-40	177.4	-176.1	0	0	0	0	111.2	D46 R59	D46-V48 HydrophobicContact CB-CG2 4.4Å; D46-V48 WeakPolarHBondContact O-CG2 3.32Å; D46-V48 PolarHBondContact O-N 2.54Å; V48-R59 PolarHBondContact O-NH1 2.84Å
49	G	57.4	Low	63	Low	11 Å²	11	62.8 Å²	62.8	11%	0.113	31%	0.305	C	S	.	.			trans	73.4	167.2	-175.1	0	0	0	0	0	112.8	H40	H40-G49 WeakPolarHBondContact CB-O 3.24Å
50	A	59.2	Low	62.6	Low	0 Å²	0	66.8 Å²	66.8	0%	0	32%	0.323	C	S	.	.			trans	-65.3	144	176.7	0	0	0	0	0	110.9	T23 E27 V42 M52 D53	T23-A50 HydrophobicContact CG2-CB 3.79Å; E27-A50 VanDerWaalsContact OE2-CB 3.24Å; E27-A50 WeakPolarHBondContact OE2-CB 3.38Å; V42-A50 HydrophobicContact CG2-CB 3.9Å; A50-M52 PolarHBondContact O-N 2.85Å; A50-M52 VanDerWaalsContact O-N 3.11Å; A50-D53 PolarHBondContact O-N 3.06Å
51	T	61.5	Low	62.3	Low	46 Å²	46	69.7 Å²	69.7	28%	0.282	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.7	-26.8	-178	-55.5	0	0	0	0	113.1	A368	T51-A368 HydrophobicContact CG2-CB 4.22Å
52	M	63.3	Low	61.8	Low	4 Å²	4	66.5 Å²	66.5	2%	0.02	32%	0.324	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79	-26.4	-177	-61.6	-57.1	-73.9	0	0	113.9	T23 T26 L30 A50 F54 A68 T70 D83	T23-M52 HydrophobicContact CG2-CB 3.95Å; T26-M52 HydrophobicContact CG2-CE 3.81Å; T26-M52 HydrophobicContact CG2-CG 3.83Å; T26-M52 HydrophobicContact CG2-SD 4.05Å; L30-M52 HydrophobicContact CD1-CG 4.4Å; L30-M52 HydrophobicContact CD1-SD 3.85Å; A50-M52 PolarHBondContact O-N 2.85Å; A50-M52 VanDerWaalsContact O-N 3.11Å; M52-F54 PolarHBondContact O-N 3.47Å; M52-A68 HydrophobicContact CE-CB 3.42Å; M52-A68 VanDerWaalsContact CE-CB 3.42Å; M52-T70 HydrophobicContact CE-CG2 3.9Å; M52-T70 HydrophobicContact SD-CG2 4.26Å; M52-D83 HydrophobicContact CE-CB 3.99Å
53	D	61.3	Low	62.1	Low	0 Å²	0	66.6 Å²	66.6	0%	0	32%	0.323	C	S	.	.			trans	-91.6	90.2	179.6	-69.6	-18.5	0	0	0	108.4	A50 E58 R59 T64	A50-D53 PolarHBondContact O-N 3.06Å; D53-E58 WeakPolarHBondContact CA-OE2 3.25Å; D53-E58 HydrophobicContact CB-CB 3.79Å; D53-R59 HydrophobicContact CB-CG 4.26Å; D53-R59 WeakPolarHBondContact O-CG 3.43Å; D53-R59 PolarHBondContact O-NE 3.06Å; D53-T64 PolarHBondContact OD1-OG1 3.5Å; D53-T64 VanDerWaalsContact OD1-OG1 3.06Å
54	F	62.4	Low	62.3	Low	66 Å²	66	59.7 Å²	59.7	29%	0.289	29%	0.294	S	S	.	.			trans	-89.3	-25.8	-174.1	69.9	-86.8	0	0	0	112.4	M52 E58 Q66	M52-F54 PolarHBondContact O-N 3.47Å; F54-E58 PolarHBondContact N-OE2 2.88Å; F54-E58 VanDerWaalsContact N-OE2 3.13Å; F54-Q66 HydrophobicContact CE1-CB 4.36Å; F54-Q66 HydrophobicContact CZ-CB 4.35Å
55	M	66.8	Low	62.5	Low	23 Å²	23	59 Å²	59	11%	0.113	29%	0.286	C	S	.	.	S	Bend	trans	-76.4	139	176.7	-58.5	-166.1	175.4	0	0	110.3	L57 E58 R59 Q66	M55-L57 PolarHBondContact O-N 3.04Å; M55-L57 VanDerWaalsContact O-N 3.13Å; M55-E58 HydrophobicContact CB-CB 4.21Å; M55-E58 HydrophobicContact CB-CG 3.82Å; M55-E58 HydrophobicContact CG-CG 4.34Å; M55-E58 PolarHBondContact N-OE2 3.24Å; M55-E58 WeakPolarHBondContact O-CB 3.5Å; M55-E58 PolarHBondContact O-N 2.93Å; M55-R59 PolarHBondContact O-N 2.79Å; M55-R59 VanDerWaalsContact O-N 3.12Å; M55-Q66 HydrophobicContact CE-CB 4.26Å; M55-Q66 HydrophobicContact CE-CG 3.57Å
56	E	65.2	Low	63.3	Low	131 Å²	131	49.6 Å²	49.6	61%	0.612	25%	0.245	S	C	*	.	H	α-helix	trans	-54.7	-35.7	174.9	-168.5	-178.7	174.1	0	0	111.8	R59 Q60	E56-R59 PolarHBondContact O-N 2.69Å; E56-Q60 WeakPolarHBondContact O-CB 3.35Å; E56-Q60 VanDerWaalsContact O-CG 3.26Å; E56-Q60 WeakPolarHBondContact O-CG 3.31Å; E56-Q60 PolarHBondContact O-N 2.84Å; E56-Q60 PolarHBondContact OE1-NE2 3.42Å
57	L	69	Low	63.9	Low	9 Å²	9	44.7 Å²	44.7	5%	0.047	22%	0.219	C	C	.	.	H	α-helix	trans	-69.1	-37.2	178.8	-141.8	160.7	0	0	0	112.5	M55 Q60 R61 I65 V468 Q471	M55-L57 PolarHBondContact O-N 3.04Å; M55-L57 VanDerWaalsContact O-N 3.13Å; L57-Q60 PolarHBondContact O-N 3.49Å; L57-R61 HydrophobicContact CD2-CG 3.99Å; L57-R61 WeakPolarHBondContact O-CB 3.36Å; L57-R61 PolarHBondContact O-N 2.91Å; L57-I65 HydrophobicContact CB-CD1 4.29Å; L57-I65 HydrophobicContact CD2-CD1 3.82Å; L57-V468 HydrophobicContact CD1-CB 4.47Å; L57-V468 HydrophobicContact CD1-CG1 4.39Å; L57-V468 HydrophobicContact CD1-CG2 4.16Å; L57-V468 HydrophobicContact CD2-CG2 3.84Å; L57-Q471 HydrophobicContact CD1-CB 3.67Å; L57-Q471 HydrophobicContact CD1-CG 3.64Å
58	E	68.7	Low	64.7	Low	0 Å²	0	36.3 Å²	36.3	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-64.2	-44.4	174.4	-68.8	173.7	150.9	0	0	110	D53 F54 M55 G62 I63 I65 Q66	D53-E58 WeakPolarHBondContact CA-OE2 3.25Å; D53-E58 HydrophobicContact CB-CB 3.79Å; F54-E58 PolarHBondContact N-OE2 2.88Å; F54-E58 VanDerWaalsContact N-OE2 3.13Å; M55-E58 HydrophobicContact CB-CB 4.21Å; M55-E58 HydrophobicContact CB-CG 3.82Å; M55-E58 HydrophobicContact CG-CG 4.34Å; M55-E58 PolarHBondContact N-OE2 3.24Å; M55-E58 WeakPolarHBondContact O-CB 3.5Å; M55-E58 PolarHBondContact O-N 2.93Å; E58-G62 WeakPolarHBondContact O-CA 3.3Å; E58-G62 PolarHBondContact O-N 3.04Å; E58-I63 VanDerWaalsContact CA-O 3.23Å; E58-I63 WeakPolarHBondContact CA-O 3.5Å; E58-I63 WeakPolarHBondContact CB-O 3.49Å; E58-I63 VanDerWaalsContact CG-O 3.26Å; E58-I63 WeakPolarHBondContact CG-O 3.42Å; E58-I63 PolarHBondContact O-N 3.18Å; E58-I65 HydrophobicContact CG-CB 3.84Å; E58-I65 HydrophobicContact CG-CD1 3.89Å; E58-I65 HydrophobicContact CG-CG1 3.84Å; E58-I65 WeakPolarHBondContact OE1-CA 3.44Å; E58-I65 WeakPolarHBondContact OE1-CB 3.3Å; E58-I65 PolarHBondContact OE1-N 3.42Å; E58-Q66 PolarHBondContact OE1-N 3.24Å
59	R	69.2	Low	65.6	Low	103 Å²	103	33.7 Å²	33.7	39%	0.389	17%	0.167	S	C	.	.	H	α-helix	trans	-65	-44	176.1	-63.4	-178.5	-177	-171.7	-4.1	112.7	V48 D53 M55 E56	V48-R59 PolarHBondContact O-NH1 2.84Å; D53-R59 HydrophobicContact CB-CG 4.26Å; D53-R59 WeakPolarHBondContact O-CG 3.43Å; D53-R59 PolarHBondContact O-NE 3.06Å; M55-R59 PolarHBondContact O-N 2.79Å; M55-R59 VanDerWaalsContact O-N 3.12Å; E56-R59 PolarHBondContact O-N 2.69Å
60	Q	65.3	Low	66.7	Low	115 Å²	115	33.4 Å²	33.4	54%	0.537	16%	0.163	S	C	.	.	H	α-helix	trans	-65.6	-46.7	-179.9	-76.5	176	2.5	0	0	112.1	E56 L57	E56-Q60 WeakPolarHBondContact O-CB 3.35Å; E56-Q60 VanDerWaalsContact O-CG 3.26Å; E56-Q60 WeakPolarHBondContact O-CG 3.31Å; E56-Q60 PolarHBondContact O-N 2.84Å; E56-Q60 PolarHBondContact OE1-NE2 3.42Å; L57-Q60 PolarHBondContact O-N 3.49Å
61	R	64.4	Low	68	Low	93 Å²	93	34.6 Å²	34.6	35%	0.351	17%	0.168	S	C	.	.	H	α-helix	trans	-82.8	-25.7	-178.7	-65.9	-166.1	-173.7	-148	11	112.1	K43 L57 I63 E467	K43-R61 VanDerWaalsContact CE-O 3.32Å; K43-R61 WeakPolarHBondContact CE-O 3.26Å; K43-R61 PolarHBondContact NZ-O 3.36Å; L57-R61 HydrophobicContact CD2-CG 3.99Å; L57-R61 WeakPolarHBondContact O-CB 3.36Å; L57-R61 PolarHBondContact O-N 2.91Å; R61-I63 HydrophobicContact CB-CD1 4.26Å; R61-I63 HydrophobicContact CB-CG1 3.86Å; R61-E467 IonicContact CZ-OE2 2.96Å; R61-E467 IonicContact NH1-OE2 3.89Å; R61-E467 PolarHBondContact NH1-OE2 3.03Å; R61-E467 IonicContact NH2-OE2 2.77Å; R61-E467 PolarHBondContact NH2-OE2 2.87Å
62	G	56.9	Low	69.3	Low	24 Å²	24	32.4 Å²	32.4	25%	0.247	15%	0.154	C	C	.	.	T	Hydrogen-bonded Turn	trans	70.4	40.3	-173.4	0	0	0	0	0	112.8	E58	E58-G62 WeakPolarHBondContact O-CA 3.3Å; E58-G62 PolarHBondContact O-N 3.04Å
63	I	65.3	Low	70.5	Confident	30 Å²	30	35 Å²	35	15%	0.154	17%	0.17	C	C	.	.			trans	-132.5	141.2	177.4	59.6	172.7	0	0	0	108.8	I18 E58 R61 I65 L464	I18-I63 HydrophobicContact CG2-CG2 4.47Å; E58-I63 VanDerWaalsContact CA-O 3.23Å; E58-I63 WeakPolarHBondContact CA-O 3.5Å; E58-I63 WeakPolarHBondContact CB-O 3.49Å; E58-I63 VanDerWaalsContact CG-O 3.26Å; E58-I63 WeakPolarHBondContact CG-O 3.42Å; E58-I63 PolarHBondContact O-N 3.18Å; R61-I63 HydrophobicContact CB-CD1 4.26Å; R61-I63 HydrophobicContact CB-CG1 3.86Å; I63-I65 HydrophobicContact CD1-CG1 4.37Å; I63-I65 HydrophobicContact CG1-CG1 4.27Å; I63-L464 HydrophobicContact CD1-CD2 4.08Å
64	T	62.7	Low	72	Confident	8 Å²	8	37 Å²	37	5%	0.049	18%	0.178	C	C	.	.			trans	-79.4	129.1	170.6	-50.2	0	0	0	0	108.9	T23 D53 Q66 P85	T23-T64 PolarHBondContact OG1-OG1 3.43Å; D53-T64 PolarHBondContact OD1-OG1 3.5Å; D53-T64 VanDerWaalsContact OD1-OG1 3.06Å; T64-Q66 WeakPolarHBondContact CG2-O 3.42Å; T64-P85 WeakPolarHBondContact O-CB 3.17Å
65	I	63.5	Low	73.3	Confident	5 Å²	5	40.1 Å²	40.1	3%	0.026	19%	0.192	C	C	.	.			trans	-107.7	-49	-175.8	-70.7	171.4	0	0	0	109.7	L57 E58 I63 F90 V468	L57-I65 HydrophobicContact CB-CD1 4.29Å; L57-I65 HydrophobicContact CD2-CD1 3.82Å; E58-I65 HydrophobicContact CG-CB 3.84Å; E58-I65 HydrophobicContact CG-CD1 3.89Å; E58-I65 HydrophobicContact CG-CG1 3.84Å; E58-I65 WeakPolarHBondContact OE1-CA 3.44Å; E58-I65 WeakPolarHBondContact OE1-CB 3.3Å; E58-I65 PolarHBondContact OE1-N 3.42Å; I63-I65 HydrophobicContact CD1-CG1 4.37Å; I63-I65 HydrophobicContact CG1-CG1 4.27Å; I65-F90 HydrophobicContact CB-CE2 4.43Å; I65-F90 HydrophobicContact CB-CZ 4.46Å; I65-F90 HydrophobicContact CG1-CE2 3.97Å; I65-F90 HydrophobicContact CG1-CZ 4.16Å; I65-F90 HydrophobicContact CG2-CD1 4.26Å; I65-F90 HydrophobicContact CG2-CE1 3.81Å; I65-F90 HydrophobicContact CG2-CE2 4.26Å; I65-F90 HydrophobicContact CG2-CZ 3.83Å; I65-V468 HydrophobicContact CD1-CG1 4.02Å; I65-V468 HydrophobicContact CD1-CG2 3.89Å; I65-V468 HydrophobicContact CG2-CG1 3.91Å
66	Q	72	Confident	74.3	Confident	12 Å²	12	44.9 Å²	44.9	6%	0.056	22%	0.217	C	C	.	.	S	Bend	trans	-104.3	145.9	175.8	-73.8	-167.2	-15.6	0	0	111.2	F54 M55 E58 T64 A68	F54-Q66 HydrophobicContact CE1-CB 4.36Å; F54-Q66 HydrophobicContact CZ-CB 4.35Å; M55-Q66 HydrophobicContact CE-CB 4.26Å; M55-Q66 HydrophobicContact CE-CG 3.57Å; E58-Q66 PolarHBondContact OE1-N 3.24Å; T64-Q66 WeakPolarHBondContact CG2-O 3.42Å; Q66-A68 PolarHBondContact O-N 3.06Å
67	S	70.2	Confident	75.5	Confident	4 Å²	4	39.1 Å²	39.1	3%	0.028	19%	0.191	C	C	.	.	P	Polyproline II helix	trans	-68.1	123.1	177.5	-49.2	0	0	0	0	110.5	D83 E93 K324	S67-D83 WeakPolarHBondContact CA-O 3.34Å; S67-E93 PolarHBondContact N-OE2 2.95Å; S67-E93 PolarHBondContact OG-OE2 3.07Å; S67-K324 VanDerWaalsContact O-CE 3.29Å; S67-K324 WeakPolarHBondContact O-CE 3.09Å; S67-K324 PolarHBondContact O-NZ 2.94Å
68	A	72.8	Confident	76.6	Confident	8 Å²	8	39.8 Å²	39.8	7%	0.066	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	125.2	179.4	0	0	0	0	0	110.1	M52 Q66 I82 D83	M52-A68 HydrophobicContact CE-CB 3.42Å; M52-A68 VanDerWaalsContact CE-CB 3.42Å; Q66-A68 PolarHBondContact O-N 3.06Å; A68-I82 WeakPolarHBondContact O-CA 3.33Å; A68-D83 PolarHBondContact N-O 3.49Å; A68-D83 PolarHBondContact O-N 3.26Å
69	A	79.6	Confident	77.7	Confident	15 Å²	15	39.8 Å²	39.8	12%	0.124	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	128.6	178.3	0	0	0	0	0	110.1	I81 Y335	A69-I81 WeakPolarHBondContact CA-O 3.04Å; A69-Y335 HydrophobicContact CB-CE1 4.27Å
70	T	81.6	Confident	78.7	Confident	5 Å²	5	36 Å²	36	3%	0.031	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	167.4	174.9	-170.9	0	0	0	0	110	L30 M52 I81 H367	L30-T70 HydrophobicContact CD2-CG2 3.99Å; M52-T70 HydrophobicContact CE-CG2 3.9Å; M52-T70 HydrophobicContact SD-CG2 4.26Å; T70-I81 HydrophobicContact CG2-CB 3.86Å; T70-I81 HydrophobicContact CG2-CG2 4.45Å; T70-I81 PolarHBondContact N-O 2.79Å; T70-I81 PolarHBondContact O-N 2.72Å; T70-H367 PolarHBondContact OG1-CE1 2.73Å; T70-H367 VanDerWaalsContact OG1-CE1 3.27Å; T70-H367 PolarHBondContact OG1-ND1 2.93Å; T70-H367 VanDerWaalsContact OG1-ND1 3.17Å
71	Y	85.7	Confident	79.9	Confident	25 Å²	25	30.5 Å²	30.5	10%	0.098	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	145.2	175.9	82.6	-87.7	0	0	0	110.4	R35 V78 V79 N80 H367 E372	R35-Y71 VanDerWaalsContact NH1-CZ 3.3Å; R35-Y71 PolarHBondContact NH1-OH 2.94Å; Y71-V78 HydrophobicContact CD2-CG1 4.28Å; Y71-V79 WeakPolarHBondContact CA-O 3.46Å; Y71-N80 WeakPolarHBondContact CB-OD1 3.22Å; Y71-H367 HydrophobicContact CD1-CB 4.26Å; Y71-H367 HydrophobicContact CE1-CB 4.06Å; Y71-H367 PolarHBondContact O-ND1 3.5Å; Y71-E372 PolarHBondContact OH-OE2 2.92Å
72	V	88.8	Confident	81	Confident	0 Å²	0	26.2 Å²	26.2	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	162.4	178.4	-58.9	0	0	0	0	110.6	I29 L30 S33 R35 V78 V79 I81	I29-V72 HydrophobicContact CG2-CG1 4.36Å; I29-V72 HydrophobicContact CG2-CG2 4.17Å; L30-V72 HydrophobicContact CD2-CG1 3.61Å; S33-V72 WeakPolarHBondContact OG-CB 3.39Å; S33-V72 WeakPolarHBondContact OG-CG1 3.47Å; R35-V72 HydrophobicContact CG-CG1 4.18Å; V72-V78 WeakPolarHBondContact O-CA 3.42Å; V72-V79 HydrophobicContact CG2-CB 3.78Å; V72-V79 PolarHBondContact N-O 3.07Å; V72-V79 PolarHBondContact O-N 2.89Å; V72-I81 HydrophobicContact CG1-CD1 4.33Å; V72-I81 HydrophobicContact CG2-CD1 3.99Å
73	T	90.3	Very high	82.4	Confident	59 Å²	59	25 Å²	25	36%	0.362	13%	0.129	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	123	172.6	-50.9	0	0	0	0	108.2	T77	T73-T77 WeakPolarHBondContact CA-O 3.44Å
74	W	91.9	Very high	83.2	Confident	43 Å²	43	23.7 Å²	23.7	16%	0.163	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	124	178.9	-170.2	-113.6	0	0	0	108.9	Y32 D76 T77 Q270 L273 D274 I277	Y32-W74 WeakPolarHBondContact O-CZ3 3.28Å; W74-D76 PolarHBondContact O-N 3.17Å; W74-T77 PolarHBondContact N-O 2.8Å; W74-T77 WeakPolarHBondContact O-CA 3.47Å; W74-T77 VanDerWaalsContact O-CB 3.28Å; W74-T77 WeakPolarHBondContact O-CB 3.35Å; W74-T77 PolarHBondContact O-N 3.13Å; W74-Q270 HydrophobicContact CH2-CB 4.35Å; W74-Q270 HydrophobicContact CH2-CG 4.17Å; W74-Q270 HydrophobicContact CZ2-CB 4.14Å; W74-Q270 HydrophobicContact CZ2-CG 4.46Å; W74-L273 HydrophobicContact CD2-CB 4.2Å; W74-L273 HydrophobicContact CD2-CD1 3.97Å; W74-L273 HydrophobicContact CE3-CD1 4.12Å; W74-L273 HydrophobicContact CG-CB 4.13Å; W74-L273 HydrophobicContact CG-CD1 4.38Å; W74-L273 HydrophobicContact CZ2-CB 4.44Å; W74-L273 HydrophobicContact CZ2-CD1 4.44Å; W74-L273 HydrophobicContact CZ3-CD1 4.43Å; W74-D274 PolarHBondContact NE1-OD1 2.6Å; W74-I277 HydrophobicContact CB-CD1 4.3Å; W74-I277 VanDerWaalsContact CD1-CD1 3.5Å; W74-I277 HydrophobicContact CG-CD1 4.25Å; W74-I277 WeakPolarHBondContact O-CD1 3.36Å
75	K	89.1	Confident	84	Confident	131 Å²	131	23.4 Å²	23.4	57%	0.57	12%	0.121	S	C	*	.	T	Hydrogen-bonded Turn	trans	44.3	55	-178.2	-62.9	179.4	175.3	170.2	0	113.5	T77 D274 I277	K75-T77 PolarHBondContact O-N 2.91Å; K75-T77 PolarHBondContact O-OG1 2.88Å; K75-D274 WeakPolarHBondContact CE-OD1 3.48Å; K75-D274 IonicContact NZ-OD1 2.66Å; K75-D274 PolarHBondContact NZ-OD1 3.27Å; K75-D274 IonicContact NZ-OD2 3.27Å; K75-D274 PolarHBondContact NZ-OD2 3.33Å; K75-I277 HydrophobicContact CB-CD1 4.03Å
76	D	87.8	Confident	84.2	Confident	122 Å²	122	23.7 Å²	23.7	65%	0.652	13%	0.125	S	C	*	.	T	Hydrogen-bonded Turn	trans	57.8	15.8	-176.9	-56.9	-36.6	0	0	0	116.1	K8 W74	K8-D76 WeakPolarHBondContact CD-O 3.21Å; W74-D76 PolarHBondContact O-N 3.17Å
77	T	91.5	Very high	84.2	Confident	11 Å²	11	25.2 Å²	25.2	7%	0.067	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	131.6	177.5	-57.5	0	0	0	0	109.2	K8 R10 T73 W74 K75 V79 I277	K8-T77 CarbonylContact O-C 3.51Å; K8-T77 WeakPolarHBondContact O-CA 3.41Å; K8-T77 WeakPolarHBondContact O-CG2 3.19Å; R10-T77 HydrophobicContact CG-CG2 4.03Å; T73-T77 WeakPolarHBondContact CA-O 3.44Å; W74-T77 PolarHBondContact N-O 2.8Å; W74-T77 WeakPolarHBondContact O-CA 3.47Å; W74-T77 VanDerWaalsContact O-CB 3.28Å; W74-T77 WeakPolarHBondContact O-CB 3.35Å; W74-T77 PolarHBondContact O-N 3.13Å; K75-T77 PolarHBondContact O-N 2.91Å; K75-T77 PolarHBondContact O-OG1 2.88Å; T77-V79 HydrophobicContact CG2-CG2 4.45Å; T77-I277 HydrophobicContact CG2-CD1 4.42Å; T77-I277 HydrophobicContact CG2-CG1 4.31Å
78	V	90.6	Very high	84.2	Confident	22 Å²	22	26 Å²	26	13%	0.133	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	120.5	174.4	179.4	0	0	0	0	108.5	L4 K8 I9 R10 Y71 V72	L4-V78 HydrophobicContact CD1-CG2 3.71Å; K8-V78 PolarHBondContact O-N 3.01Å; I9-V78 CarbonylContact C-O 3.52Å; I9-V78 VanDerWaalsContact CA-O 3.31Å; I9-V78 WeakPolarHBondContact CA-O 3.47Å; R10-V78 PolarHBondContact N-O 3.08Å; Y71-V78 HydrophobicContact CD2-CG1 4.28Å; V72-V78 WeakPolarHBondContact O-CA 3.42Å
79	V	91.8	Very high	84.4	Confident	1 Å²	1	26 Å²	26	1%	0.006	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	110.5	177.8	-174.6	0	0	0	0	108.2	R10 I12 Y71 V72 T77 I81 V276	R10-V79 HydrophobicContact CB-CB 4.5Å; R10-V79 HydrophobicContact CB-CG1 4.23Å; R10-V79 HydrophobicContact CB-CG2 4.24Å; R10-V79 CarbonylContact O-C 3.57Å; R10-V79 WeakPolarHBondContact O-CA 3.44Å; I12-V79 HydrophobicContact CD1-CG1 3.64Å; I12-V79 HydrophobicContact CG1-CG1 3.76Å; Y71-V79 WeakPolarHBondContact CA-O 3.46Å; V72-V79 HydrophobicContact CG2-CB 3.78Å; V72-V79 PolarHBondContact N-O 3.07Å; V72-V79 PolarHBondContact O-N 2.89Å; T77-V79 HydrophobicContact CG2-CG2 4.45Å; V79-I81 HydrophobicContact CG1-CG1 3.96Å; V79-V276 HydrophobicContact CG1-CG1 4.24Å
80	N	91	Very high	84.4	Confident	22 Å²	22	25.5 Å²	25.5	12%	0.118	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	124.5	170.9	-60.5	-38.1	0	0	0	108.2	R10 N11 I12 Y71 I382	R10-N80 PolarHBondContact O-N 3.31Å; N11-N80 WeakPolarHBondContact OD1-CB 3.34Å; N11-N80 PolarHBondContact OD1-ND2 2.83Å; I12-N80 PolarHBondContact N-O 2.97Å; Y71-N80 WeakPolarHBondContact CB-OD1 3.22Å; N80-I382 HydrophobicContact CB-CD1 4.25Å
81	I	90.2	Very high	84.2	Confident	0 Å²	0	25.9 Å²	25.9	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	127.3	-175.4	-55.1	173.2	0	0	0	108.4	I12 I14 T26 I29 A69 T70 V72 V79	I12-I81 HydrophobicContact CD1-CG1 4.17Å; I12-I81 HydrophobicContact CG1-CG1 4.02Å; I12-I81 WeakPolarHBondContact O-CA 3.17Å; I14-I81 HydrophobicContact CD1-CG2 3.65Å; I14-I81 HydrophobicContact CG1-CG2 4.09Å; T26-I81 HydrophobicContact CG2-CG2 4.28Å; I29-I81 HydrophobicContact CB-CD1 4.43Å; I29-I81 HydrophobicContact CG2-CD1 3.45Å; I29-I81 VanDerWaalsContact CG2-CD1 3.45Å; A69-I81 WeakPolarHBondContact CA-O 3.04Å; T70-I81 HydrophobicContact CG2-CB 3.86Å; T70-I81 HydrophobicContact CG2-CG2 4.45Å; T70-I81 PolarHBondContact N-O 2.79Å; T70-I81 PolarHBondContact O-N 2.72Å; V72-I81 HydrophobicContact CG1-CD1 4.33Å; V72-I81 HydrophobicContact CG2-CD1 3.99Å; V79-I81 HydrophobicContact CG1-CG1 3.96Å
82	I	88.3	Confident	84.1	Confident	3 Å²	3	24.7 Å²	24.7	2%	0.015	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	111.8	167.9	-56	-177.7	0	0	0	108	I12 G13 I14 A68 T84 A97 L101 F323 I382	I12-I82 PolarHBondContact O-N 2.8Å; G13-I82 WeakPolarHBondContact CA-O 3.43Å; I14-I82 PolarHBondContact N-O 2.89Å; A68-I82 WeakPolarHBondContact O-CA 3.33Å; I82-T84 HydrophobicContact CG2-CG2 4.28Å; I82-A97 HydrophobicContact CG2-CB 3.84Å; I82-L101 HydrophobicContact CB-CD1 4.44Å; I82-L101 HydrophobicContact CB-CD2 4.17Å; I82-L101 HydrophobicContact CD1-CD2 3.64Å; I82-L101 HydrophobicContact CD1-CG 4.11Å; I82-L101 HydrophobicContact CG1-CD2 3.87Å; I82-F323 HydrophobicContact CD1-CE2 4.08Å; I82-F323 HydrophobicContact CD1-CZ 4.3Å; I82-I382 HydrophobicContact CD1-CD1 4.21Å
83	D	85.2	Confident	83.8	Confident	0 Å²	0	25.3 Å²	25.3	0%	0	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79	120.1	172.4	-158.1	-14.5	0	0	0	108.7	T26 M52 S67 A68	T26-D83 HydrophobicContact CG2-CB 4.46Å; T26-D83 PolarHBondContact OG1-OD2 3.32Å; M52-D83 HydrophobicContact CE-CB 3.99Å; S67-D83 WeakPolarHBondContact CA-O 3.34Å; A68-D83 PolarHBondContact N-O 3.49Å; A68-D83 PolarHBondContact O-N 3.26Å
84	T	83.4	Confident	83.5	Confident	1 Å²	1	22.7 Å²	22.7	1%	0.006	12%	0.115	C	C	.	.	P	Polyproline II helix	trans	-102.1	141.1	-173.6	64.5	0	0	0	0	111.2	I14 S15 K22 I82 G86 A97	I14-T84 PolarHBondContact O-N 2.94Å; I14-T84 VanDerWaalsContact O-N 3.13Å; I14-T84 PolarHBondContact O-OG1 3.49Å; S15-T84 WeakPolarHBondContact CA-OG1 3.04Å; S15-T84 PolarHBondContact OG-OG1 3.41Å; K22-T84 WeakPolarHBondContact CE-O 3.25Å; I82-T84 HydrophobicContact CG2-CG2 4.28Å; T84-G86 PolarHBondContact O-N 2.79Å; T84-A97 HydrophobicContact CG2-CB 3.45Å; T84-A97 VanDerWaalsContact CG2-CB 3.45Å
85	P	79.2	Confident	83.2	Confident	2 Å²	2	20.9 Å²	20.9	1%	0.013	11%	0.109	C	C	.	.	P	Polyproline II helix	trans	-62.4	138	176.3	23.5	-30.4	0	0	0	110.5	T64 F90 E93 V94	T64-P85 WeakPolarHBondContact O-CB 3.17Å; P85-F90 HydrophobicContact CB-CB 3.84Å; P85-F90 HydrophobicContact CG-CB 3.77Å; P85-E93 HydrophobicContact CG-CB 3.39Å; P85-E93 HydrophobicContact CG-CG 4.18Å; P85-V94 HydrophobicContact CG-CG2 4.15Å; P85-V94 WeakPolarHBondContact O-CG2 3.22Å
86	G	67.3	Low	83.1	Confident	12 Å²	12	14.9 Å²	14.9	12%	0.124	8%	0.083	C	C	.	.			trans	-87.1	-10.6	178.5	0	0	0	0	0	114.4	A16 T84 Q117	A16-G86 WeakPolarHBondContact O-CA 3.35Å; T84-G86 PolarHBondContact O-N 2.79Å; G86-Q117 PolarHBondContact O-OE1 3.41Å
87	H	72.9	Confident	83	Confident	43 Å²	43	9.2 Å²	9.2	20%	0.199	5%	0.052	C	C	.	.	S	Bend	trans	-83.8	142.6	-170.7	-153.9	-81.7	0	0	0	111.5	I18 D89 F90 L464	I18-H87 HydrophobicContact CD1-CB 4.41Å; I18-H87 WeakPolarHBondContact CD1-CD2 3.45Å; H87-D89 IonicContact CE1-OD2 3.69Å; H87-D89 PolarHBondContact CE1-OD2 3.44Å; H87-D89 PolarHBondContact ND1-N 2.77Å; H87-D89 IonicContact ND1-OD2 3.33Å; H87-D89 PolarHBondContact ND1-OD2 3.4Å; H87-D89 VanDerWaalsContact ND1-OD2 3.14Å; H87-D89 PolarHBondContact O-N 3.36Å; H87-D89 VanDerWaalsContact O-N 3.15Å; H87-F90 HydrophobicContact CB-CD2 3.97Å; H87-F90 PolarHBondContact O-N 3.41Å; H87-F90 VanDerWaalsContact O-N 3.1Å; H87-L464 VanDerWaalsContact CE1-CD2 3.49Å; H87-L464 WeakPolarHBondContact CE1-CD2 3.47Å
88	V	69.9	Low	82.8	Confident	21 Å²	21	8.7 Å²	8.7	13%	0.127	5%	0.049	C	C	.	.	G	3₁₀ helix	trans	-58.3	-31.5	179.8	-175.2	0	0	0	0	112.2	F90 T91 Q117	V88-F90 VanDerWaalsContact C-N 3.26Å; V88-F90 PolarHBondContact O-N 2.89Å; V88-T91 HydrophobicContact CG1-CG2 4.42Å; V88-T91 WeakPolarHBondContact O-CB 3.39Å; V88-T91 WeakPolarHBondContact O-CG2 3.26Å; V88-T91 PolarHBondContact O-N 3.02Å; V88-T91 PolarHBondContact O-OG1 2.87Å; V88-Q117 HydrophobicContact CG2-CG 3.69Å
89	D	75.5	Confident	82.6	Confident	7 Å²	7	8.6 Å²	8.6	4%	0.037	5%	0.046	C	C	.	.	G	3₁₀ helix	trans	-72.3	-17.9	-177.6	-65	-27.2	0	0	0	114	H87 G462 L464 Q465 R669	H87-D89 IonicContact CE1-OD2 3.69Å; H87-D89 PolarHBondContact CE1-OD2 3.44Å; H87-D89 PolarHBondContact ND1-N 2.77Å; H87-D89 IonicContact ND1-OD2 3.33Å; H87-D89 PolarHBondContact ND1-OD2 3.4Å; H87-D89 VanDerWaalsContact ND1-OD2 3.14Å; H87-D89 PolarHBondContact O-N 3.36Å; H87-D89 VanDerWaalsContact O-N 3.15Å; D89-G462 VanDerWaalsContact OD1-CA 3.31Å; D89-G462 WeakPolarHBondContact OD1-CA 3.46Å; D89-L464 VanDerWaalsContact OD2-CB 3.27Å; D89-L464 WeakPolarHBondContact OD2-CB 3.46Å; D89-Q465 HydrophobicContact CB-CB 4.19Å; D89-R669 IonicContact OD1-CZ 3.4Å; D89-R669 IonicContact OD1-NH1 3.4Å; D89-R669 PolarHBondContact OD1-NH1 3.06Å; D89-R669 IonicContact OD1-NH2 3.81Å
90	F	80.8	Confident	82.4	Confident	5 Å²	5	8.5 Å²	8.5	2%	0.022	5%	0.046	C	C	.	.	G	3₁₀ helix	trans	-113.6	28.6	177.2	-55.6	-66.5	0	0	0	110.9	I65 P85 H87 V88 V92 E93 V94 L464 Q465 V468	I65-F90 HydrophobicContact CB-CE2 4.43Å; I65-F90 HydrophobicContact CB-CZ 4.46Å; I65-F90 HydrophobicContact CG1-CE2 3.97Å; I65-F90 HydrophobicContact CG1-CZ 4.16Å; I65-F90 HydrophobicContact CG2-CD1 4.26Å; I65-F90 HydrophobicContact CG2-CE1 3.81Å; I65-F90 HydrophobicContact CG2-CE2 4.26Å; I65-F90 HydrophobicContact CG2-CZ 3.83Å; P85-F90 HydrophobicContact CB-CB 3.84Å; P85-F90 HydrophobicContact CG-CB 3.77Å; H87-F90 HydrophobicContact CB-CD2 3.97Å; H87-F90 PolarHBondContact O-N 3.41Å; H87-F90 VanDerWaalsContact O-N 3.1Å; V88-F90 VanDerWaalsContact C-N 3.26Å; V88-F90 PolarHBondContact O-N 2.89Å; F90-V92 PolarHBondContact O-N 3.09Å; F90-E93 VanDerWaalsContact O-CB 3.32Å; F90-E93 WeakPolarHBondContact O-CB 3.32Å; F90-E93 PolarHBondContact O-N 2.78Å; F90-V94 PolarHBondContact O-N 3.31Å; F90-L464 HydrophobicContact CE2-CD2 4.24Å; F90-L464 HydrophobicContact CE2-CG 4.43Å; F90-Q465 HydrophobicContact CD1-CG 4.4Å; F90-Q465 HydrophobicContact CE1-CB 4.2Å; F90-Q465 HydrophobicContact CE1-CG 3.95Å; F90-V468 HydrophobicContact CZ-CB 4.27Å; F90-V468 HydrophobicContact CZ-CG1 4.36Å; F90-V468 HydrophobicContact CZ-CG2 4.05Å
91	T	78	Confident	82.4	Confident	14 Å²	14	7.8 Å²	7.8	9%	0.086	4%	0.042	C	C	.	.	H	α-helix	trans	-56.6	-33.8	178.8	36.5	0	0	0	0	113	V88 E93 V94 E95 T120	V88-T91 HydrophobicContact CG1-CG2 4.42Å; V88-T91 WeakPolarHBondContact O-CB 3.39Å; V88-T91 WeakPolarHBondContact O-CG2 3.26Å; V88-T91 PolarHBondContact O-N 3.02Å; V88-T91 PolarHBondContact O-OG1 2.87Å; T91-E93 VanDerWaalsContact C-N 3.29Å; T91-E93 PolarHBondContact O-N 3.31Å; T91-V94 WeakPolarHBondContact O-CB 3.17Å; T91-V94 PolarHBondContact O-N 3.28Å; T91-V94 VanDerWaalsContact O-N 3.09Å; T91-E95 WeakPolarHBondContact O-CG 3.36Å; T91-E95 PolarHBondContact O-N 2.99Å; T91-T120 HydrophobicContact CG2-CG2 4.45Å
92	V	82.8	Confident	82.5	Confident	0 Å²	0	7.9 Å²	7.9	0%	0	4%	0.043	C	C	.	.	H	α-helix	trans	-61	-33.5	174.7	67.3	0	0	0	0	113.4	F90 V94 E95 R96 D442 P443 T444	F90-V92 PolarHBondContact O-N 3.09Å; V92-V94 VanDerWaalsContact C-N 3.35Å; V92-E95 PolarHBondContact O-N 2.85Å; V92-R96 WeakPolarHBondContact O-CB 3.44Å; V92-R96 VanDerWaalsContact O-CG 3.23Å; V92-R96 WeakPolarHBondContact O-CG 3.48Å; V92-R96 PolarHBondContact O-N 2.79Å; V92-D442 WeakPolarHBondContact CG1-OD1 3.49Å; V92-P443 HydrophobicContact CG2-CG 3.94Å; V92-T444 HydrophobicContact CB-CG2 3.66Å; V92-T444 HydrophobicContact CG1-CG2 4.13Å; V92-T444 HydrophobicContact CG2-CG2 3.84Å
93	E	83.4	Confident	82.7	Confident	12 Å²	12	7.8 Å²	7.8	6%	0.056	4%	0.043	C	C	.	.	H	α-helix	trans	-66.4	-40.5	173.8	-75.3	-80.4	166.4	0	0	110.5	S67 P85 F90 T91 R96 A97	S67-E93 PolarHBondContact N-OE2 2.95Å; S67-E93 PolarHBondContact OG-OE2 3.07Å; P85-E93 HydrophobicContact CG-CB 3.39Å; P85-E93 HydrophobicContact CG-CG 4.18Å; F90-E93 VanDerWaalsContact O-CB 3.32Å; F90-E93 WeakPolarHBondContact O-CB 3.32Å; F90-E93 PolarHBondContact O-N 2.78Å; T91-E93 VanDerWaalsContact C-N 3.29Å; T91-E93 PolarHBondContact O-N 3.31Å; E93-R96 PolarHBondContact O-N 2.98Å; E93-R96 IonicContact OE1-CZ 3.79Å; E93-R96 IonicContact OE1-NH2 2.69Å; E93-R96 PolarHBondContact OE1-NH2 3.45Å; E93-R96 IonicContact OE2-NH2 3.2Å; E93-A97 WeakPolarHBondContact O-CB 3.43Å; E93-A97 PolarHBondContact O-N 2.87Å
94	V	84.1	Confident	83.2	Confident	4 Å²	4	7.8 Å²	7.8	2%	0.024	4%	0.043	C	C	.	.	H	α-helix	trans	-65.7	-43.3	175.4	-170.4	0	0	0	0	111.4	P85 F90 T91 V92 R96 A97 L98 Q124	P85-V94 HydrophobicContact CG-CG2 4.15Å; P85-V94 WeakPolarHBondContact O-CG2 3.22Å; F90-V94 PolarHBondContact O-N 3.31Å; T91-V94 WeakPolarHBondContact O-CB 3.17Å; T91-V94 PolarHBondContact O-N 3.28Å; T91-V94 VanDerWaalsContact O-N 3.09Å; V92-V94 VanDerWaalsContact C-N 3.35Å; V94-R96 VanDerWaalsContact C-N 3.34Å; V94-R96 PolarHBondContact O-N 2.95Å; V94-A97 PolarHBondContact O-N 2.88Å; V94-L98 HydrophobicContact CG1-CD1 3.8Å; V94-L98 HydrophobicContact CG1-CG 4.19Å; V94-L98 WeakPolarHBondContact O-CB 3.41Å; V94-L98 WeakPolarHBondContact O-CG 3.22Å; V94-L98 PolarHBondContact O-N 3.07Å; V94-Q124 VanDerWaalsContact CG1-OE1 3.3Å
95	E	85.5	Confident	83.7	Confident	6 Å²	6	7.8 Å²	7.8	3%	0.028	4%	0.042	C	C	.	.	H	α-helix	trans	-58.7	-45.5	175.5	-66.2	-78.3	172.2	0	0	111.5	T91 V92 R99 Q124 R127 Y128 I409	T91-E95 WeakPolarHBondContact O-CG 3.36Å; T91-E95 PolarHBondContact O-N 2.99Å; V92-E95 PolarHBondContact O-N 2.85Å; E95-R99 WeakPolarHBondContact O-CB 3.28Å; E95-R99 PolarHBondContact O-N 2.82Å; E95-R99 VanDerWaalsContact O-N 3.08Å; E95-Q124 VanDerWaalsContact OE1-CG 3.27Å; E95-Q124 WeakPolarHBondContact OE1-CG 3.29Å; E95-Q124 PolarHBondContact OE1-NE2 3.48Å; E95-R127 IonicContact OE1-CZ 3.01Å; E95-R127 IonicContact OE1-NH1 2.81Å; E95-R127 PolarHBondContact OE1-NH1 3.15Å; E95-R127 IonicContact OE2-NH1 3.29Å; E95-R127 PolarHBondContact OE2-NH1 3.24Å; E95-Y128 WeakPolarHBondContact OE2-CE2 3.27Å; E95-Y128 VanDerWaalsContact OE2-CZ 3.32Å; E95-Y128 PolarHBondContact OE2-OH 3.13Å; E95-I409 HydrophobicContact CB-CG2 3.64Å
96	R	85.1	Confident	84.4	Confident	5 Å²	5	7.7 Å²	7.7	2%	0.019	4%	0.042	C	C	.	.	H	α-helix	trans	-64.4	-43.1	178.3	-74.7	-170.7	-64.8	169	-9.6	112.5	V92 E93 V94 V100 F323 S392 I409 E441	V92-R96 WeakPolarHBondContact O-CB 3.44Å; V92-R96 VanDerWaalsContact O-CG 3.23Å; V92-R96 WeakPolarHBondContact O-CG 3.48Å; V92-R96 PolarHBondContact O-N 2.79Å; E93-R96 PolarHBondContact O-N 2.98Å; E93-R96 IonicContact OE1-CZ 3.79Å; E93-R96 IonicContact OE1-NH2 2.69Å; E93-R96 PolarHBondContact OE1-NH2 3.45Å; E93-R96 IonicContact OE2-NH2 3.2Å; V94-R96 VanDerWaalsContact C-N 3.34Å; V94-R96 PolarHBondContact O-N 2.95Å; R96-V100 WeakPolarHBondContact O-CG2 3.37Å; R96-F323 WeakPolarHBondContact CD-O 3.38Å; R96-S392 WeakPolarHBondContact CD-OG 3.46Å; R96-S392 PolarHBondContact NH1-OG 3.32Å; R96-I409 HydrophobicContact CG-CB 4.5Å; R96-I409 HydrophobicContact CG-CD1 3.72Å; R96-I409 HydrophobicContact CG-CG1 4.05Å; R96-I409 HydrophobicContact CG-CG2 3.95Å; R96-E441 PolarHBondContact NH1-O 3.11Å; R96-E441 PolarHBondContact NH2-O 3Å
97	A	86.8	Confident	85.6	Confident	2 Å²	2	7.1 Å²	7.1	2%	0.017	4%	0.036	C	C	.	.	H	α-helix	trans	-63.4	-53.6	175.7	0	0	0	0	0	110.5	I82 T84 E93 V94 R99 V100 L101	I82-A97 HydrophobicContact CG2-CB 3.84Å; T84-A97 HydrophobicContact CG2-CB 3.45Å; T84-A97 VanDerWaalsContact CG2-CB 3.45Å; E93-A97 WeakPolarHBondContact O-CB 3.43Å; E93-A97 PolarHBondContact O-N 2.87Å; V94-A97 PolarHBondContact O-N 2.88Å; A97-R99 VanDerWaalsContact C-N 3.29Å; A97-R99 PolarHBondContact O-N 3.43Å; A97-V100 WeakPolarHBondContact O-CB 3.21Å; A97-V100 PolarHBondContact O-N 3.3Å; A97-L101 HydrophobicContact CB-CD1 4.16Å; A97-L101 WeakPolarHBondContact O-CD1 3.37Å; A97-L101 WeakPolarHBondContact O-CG 3.44Å; A97-L101 PolarHBondContact O-N 2.96Å; A97-L101 VanDerWaalsContact O-N 3.15Å
98	L	87.8	Confident	86.5	Confident	1 Å²	1	5.1 Å²	5.1	1%	0.005	3%	0.027	C	C	.	.	H	α-helix	trans	-60.4	-34.4	-176	-72.3	174.6	0	0	0	113.2	V94 V100 L101 A104 Q124 M125 Y128	V94-L98 HydrophobicContact CG1-CD1 3.8Å; V94-L98 HydrophobicContact CG1-CG 4.19Å; V94-L98 WeakPolarHBondContact O-CB 3.41Å; V94-L98 WeakPolarHBondContact O-CG 3.22Å; V94-L98 PolarHBondContact O-N 3.07Å; L98-V100 PolarHBondContact O-N 2.97Å; L98-L101 HydrophobicContact CD2-CD1 4.46Å; L98-L101 PolarHBondContact O-N 3.44Å; L98-A104 HydrophobicContact CD2-CB 4.38Å; L98-Q124 HydrophobicContact CD1-CB 3.51Å; L98-M125 HydrophobicContact CD1-CG 4.04Å; L98-M125 HydrophobicContact CD2-CE 4.29Å; L98-M125 HydrophobicContact CD2-CG 3.91Å; L98-Y128 HydrophobicContact CB-CD2 3.79Å; L98-Y128 HydrophobicContact CB-CE2 4.25Å
99	R	86.5	Confident	87.4	Confident	19 Å²	19	4.7 Å²	4.7	7%	0.072	3%	0.025	C	C	.	.	H	α-helix	trans	-61.6	-25.8	175	178	58.6	-172.8	99.4	-13.2	113.5	E95 A97 Y128 L321 Y339 E407 I409	E95-R99 WeakPolarHBondContact O-CB 3.28Å; E95-R99 PolarHBondContact O-N 2.82Å; E95-R99 VanDerWaalsContact O-N 3.08Å; A97-R99 VanDerWaalsContact C-N 3.29Å; A97-R99 PolarHBondContact O-N 3.43Å; R99-Y128 HydrophobicContact CB-CD1 4.22Å; R99-Y128 HydrophobicContact CB-CE1 4.01Å; R99-Y128 HydrophobicContact CG-CE1 4.33Å; R99-L321 HydrophobicContact CG-CD2 4.08Å; R99-Y339 PolarHBondContact NH1-OH 3.37Å; R99-Y339 PolarHBondContact O-OH 3.41Å; R99-E407 PolarHBondContact NE-O 3.15Å; R99-I409 HydrophobicContact CB-CG1 4.47Å; R99-I409 HydrophobicContact CG-CG1 4.41Å
100	V	87.6	Confident	87.9	Confident	0 Å²	0	4.4 Å²	4.4	0%	0	2%	0.023	C	C	.	.	H	α-helix	trans	-103.1	-9.3	-172.7	175.9	0	0	0	0	112	R96 A97 L98 L321 F323 R337 I382	R96-V100 WeakPolarHBondContact O-CG2 3.37Å; A97-V100 WeakPolarHBondContact O-CB 3.21Å; A97-V100 PolarHBondContact O-N 3.3Å; L98-V100 PolarHBondContact O-N 2.97Å; V100-L321 HydrophobicContact CG2-CD2 4.23Å; V100-F323 HydrophobicContact CB-CD1 4.48Å; V100-F323 HydrophobicContact CB-CG 4.3Å; V100-F323 HydrophobicContact CG1-CD1 3.84Å; V100-F323 HydrophobicContact CG1-CD2 4.44Å; V100-F323 HydrophobicContact CG1-CE1 3.93Å; V100-F323 HydrophobicContact CG1-CG 4.11Å; V100-F323 HydrophobicContact CG1-CZ 4.27Å; V100-F323 HydrophobicContact CG2-CB 3.4Å; V100-F323 VanDerWaalsContact CG2-CB 3.4Å; V100-F323 HydrophobicContact CG2-CD1 3.92Å; V100-F323 HydrophobicContact CG2-CD2 4.16Å; V100-F323 HydrophobicContact CG2-CG 3.58Å; V100-R337 VanDerWaalsContact C-NH1 3.3Å; V100-R337 HydrophobicContact CG1-CB 3.57Å; V100-R337 HydrophobicContact CG1-CG 4.2Å; V100-R337 WeakPolarHBondContact O-CD 3.4Å; V100-R337 PolarHBondContact O-NH1 3.49Å; V100-I382 HydrophobicContact CG1-CD1 4.46Å
101	L	90.7	Very high	88.1	Confident	7 Å²	7	6.5 Å²	6.5	4%	0.037	4%	0.036	C	C	.	.			trans	-96.1	151.2	-176.5	-69.4	166	0	0	0	111.4	I12 I82 A97 L98	I12-L101 WeakPolarHBondContact O-CD2 3.41Å; I82-L101 HydrophobicContact CB-CD1 4.44Å; I82-L101 HydrophobicContact CB-CD2 4.17Å; I82-L101 HydrophobicContact CD1-CD2 3.64Å; I82-L101 HydrophobicContact CD1-CG 4.11Å; I82-L101 HydrophobicContact CG1-CD2 3.87Å; A97-L101 HydrophobicContact CB-CD1 4.16Å; A97-L101 WeakPolarHBondContact O-CD1 3.37Å; A97-L101 WeakPolarHBondContact O-CG 3.44Å; A97-L101 PolarHBondContact O-N 2.96Å; A97-L101 VanDerWaalsContact O-N 3.15Å; L98-L101 HydrophobicContact CD2-CD1 4.46Å; L98-L101 PolarHBondContact O-N 3.44Å
102	D	91.5	Very high	87.9	Confident	2 Å²	2	7.7 Å²	7.7	1%	0.011	5%	0.051	C	C	.	.	S	Bend	trans	-96.3	-27.4	175.7	-65.8	-41.3	0	0	0	111.3	N11 P131 P281 V286 R337	N11-D102 HydrophobicContact CB-CB 4.24Å; N11-D102 WeakPolarHBondContact CB-OD2 3.2Å; N11-D102 PolarHBondContact ND2-OD2 3.03Å; N11-D102 PolarHBondContact O-N 2.99Å; D102-P131 WeakPolarHBondContact O-CD 3.46Å; D102-P281 HydrophobicContact CB-CG 4.17Å; D102-P281 WeakPolarHBondContact O-CG 3.42Å; D102-V286 HydrophobicContact CB-CG2 3.87Å; D102-R337 VanDerWaalsContact CG-NH2 3.27Å; D102-R337 IonicContact OD1-CZ 2.84Å; D102-R337 IonicContact OD1-NH1 3.51Å; D102-R337 PolarHBondContact OD1-NH1 2.9Å; D102-R337 IonicContact OD1-NH2 3.49Å; D102-R337 PolarHBondContact OD1-NH2 3.09Å; D102-R337 IonicContact OD2-CZ 2.74Å; D102-R337 IonicContact OD2-NH1 2.65Å; D102-R337 IonicContact OD2-NH2 3.23Å; D102-R337 PolarHBondContact OD2-NH2 2.93Å; D102-R337 VanDerWaalsContact OD2-NH2 3.15Å
103	G	93.3	Very high	87.8	Confident	1 Å²	1	8 Å²	8	1%	0.01	5%	0.054	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	171.1	174	0	0	0	0	0	112.1	N11 I12 G13 P131	N11-G103 PolarHBondContact O-N 3.15Å; I12-G103 VanDerWaalsContact CA-O 3.27Å; I12-G103 WeakPolarHBondContact CA-O 3.47Å; G13-G103 PolarHBondContact N-O 3.12Å; G103-P131 CarbonylContact C-O 3.58Å; G103-P131 VanDerWaalsContact CA-O 3.24Å; G103-P131 WeakPolarHBondContact CA-O 3.43Å
104	A	94.2	Very high	87.6	Confident	0 Å²	0	7.9 Å²	7.9	0%	0	5%	0.054	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	160.6	175	0	0	0	0	0	113.1	G13 L98 M125 V130 P131 F132 L133	G13-A104 CarbonylContact O-C 3.52Å; G13-A104 VanDerWaalsContact O-CA 3.26Å; G13-A104 WeakPolarHBondContact O-CA 3.3Å; L98-A104 HydrophobicContact CD2-CB 4.38Å; A104-M125 HydrophobicContact CB-CE 3.56Å; A104-M125 HydrophobicContact CB-SD 4.34Å; A104-V130 HydrophobicContact CB-CG1 4.01Å; A104-P131 PolarHBondContact N-O 2.81Å; A104-F132 HydrophobicContact CB-CB 4.13Å; A104-F132 CarbonylContact O-C 3.53Å; A104-F132 WeakPolarHBondContact O-CA 3.38Å; A104-F132 WeakPolarHBondContact O-CB 3.27Å; A104-L133 PolarHBondContact O-N 3.48Å
105	I	95	Very high	87.1	Confident	0 Å²	0	10.4 Å²	10.4	0%	0	7%	0.066	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	114.7	168.9	-56.5	174.5	0	0	0	107.1	I12 G13 I14 S15 I107 L133 F135 L272 V276	I12-I105 HydrophobicContact CD1-CD1 3.86Å; I12-I105 HydrophobicContact CD1-CG1 4.47Å; G13-I105 PolarHBondContact O-N 3.17Å; I14-I105 HydrophobicContact CG1-CD1 4.43Å; S15-I105 PolarHBondContact N-O 2.84Å; S15-I105 VanDerWaalsContact O-O 3.08Å; I105-I107 HydrophobicContact CG2-CG1 4.07Å; I105-L133 WeakPolarHBondContact CA-O 3.42Å; I105-F135 HydrophobicContact CG2-CB 4.07Å; I105-L272 HydrophobicContact CD1-CD1 4.21Å; I105-L272 HydrophobicContact CD1-CD2 4.26Å; I105-L272 HydrophobicContact CD1-CG 4.25Å; I105-L272 HydrophobicContact CG2-CD1 4.16Å; I105-L272 HydrophobicContact CG2-CD2 4.41Å; I105-V276 HydrophobicContact CD1-CG2 3.75Å; I105-V276 HydrophobicContact CG1-CG2 4.32Å
106	L	93.9	Very high	86.3	Confident	1 Å²	1	10.5 Å²	10.5	1%	0.005	7%	0.067	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	106.9	171.7	-177.7	64.7	0	0	0	109.4	S15 L108 T118 V121 F132 L133 T134 F135	S15-L106 WeakPolarHBondContact O-CA 3.48Å; L106-L108 HydrophobicContact CG-CD2 4.37Å; L106-T118 HydrophobicContact CD1-CG2 4.32Å; L106-T118 HydrophobicContact CD2-CG2 4.16Å; L106-V121 HydrophobicContact CD1-CG1 4Å; L106-F132 HydrophobicContact CB-CD2 4.07Å; L106-F132 HydrophobicContact CD2-CD2 4.45Å; L106-F132 HydrophobicContact CD2-CE2 4.23Å; L106-L133 PolarHBondContact N-O 2.77Å; L106-T134 CarbonylContact O-C 3.57Å; L106-T134 WeakPolarHBondContact O-CA 3.11Å; L106-F135 PolarHBondContact O-N 2.79Å
107	I	93.2	Very high	85.6	Confident	0 Å²	0	11.1 Å²	11.1	0%	0	7%	0.07	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	131.6	176.6	-56.9	169.8	0	0	0	109.8	I14 S15 A16 K22 V25 I105 F135 N137	I14-I107 HydrophobicContact CG2-CD1 3.38Å; I14-I107 HydrophobicContact CG2-CG1 4.24Å; S15-I107 PolarHBondContact O-N 3.21Å; A16-I107 HydrophobicContact CB-CB 3.73Å; A16-I107 HydrophobicContact CB-CG2 4.49Å; A16-I107 VanDerWaalsContact CB-O 3.28Å; A16-I107 WeakPolarHBondContact CB-O 3.34Å; K22-I107 HydrophobicContact CG-CD1 4.27Å; V25-I107 HydrophobicContact CB-CD1 3.87Å; V25-I107 HydrophobicContact CG1-CD1 4.09Å; V25-I107 HydrophobicContact CG2-CD1 3.86Å; I105-I107 HydrophobicContact CG2-CG1 4.07Å; I107-F135 CarbonylContact C-O 3.46Å; I107-F135 WeakPolarHBondContact CA-O 3.46Å; I107-F135 HydrophobicContact CG1-CB 4.43Å; I107-F135 HydrophobicContact CG1-CD1 4.31Å; I107-F135 HydrophobicContact CG2-CD1 4.3Å; I107-N137 HydrophobicContact CG2-CB 3.72Å
108	L	91.6	Very high	85.3	Confident	1 Å²	1	11.1 Å²	11.1	1%	0.005	7%	0.07	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	148.4	173.3	-60.5	176.7	0	0	0	110.3	L106 V114 T118 T134 F135 I136 N137 V149 I153	L106-L108 HydrophobicContact CG-CD2 4.37Å; L108-V114 HydrophobicContact CD1-CG2 4.42Å; L108-T118 HydrophobicContact CD2-CG2 3.59Å; L108-T134 HydrophobicContact CD1-CG2 3.77Å; L108-T134 HydrophobicContact CG-CG2 4.26Å; L108-F135 PolarHBondContact N-O 3.1Å; L108-I136 WeakPolarHBondContact O-CA 3.04Å; L108-N137 PolarHBondContact O-N 3.06Å; L108-V149 HydrophobicContact CB-CG1 4.23Å; L108-V149 HydrophobicContact CD1-CG1 3.91Å; L108-I153 HydrophobicContact CD1-CD1 3.64Å; L108-I153 HydrophobicContact CD1-CG1 3.76Å
109	C	87.6	Confident	84.9	Confident	12 Å²	12	14.7 Å²	14.7	8%	0.081	9%	0.086	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	127.7	175.8	-179	0	0	0	0	110.2	V111 G112 G113	C109-V111 PolarHBondContact O-N 2.89Å; C109-V111 VanDerWaalsContact O-N 3.1Å; C109-G112 PolarHBondContact O-N 2.77Å; C109-G113 PolarHBondContact O-N 2.93Å
110	G	86.6	Confident	84.5	Confident	0 Å²	0	15.6 Å²	15.6	0%	0	9%	0.093	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.5	-23.4	176.3	0	0	0	0	0	114.3	N137 N145 R148	G110-N137 PolarHBondContact N-O 3.39Å; G110-N145 PolarHBondContact O-N 3.3Å; G110-N145 VanDerWaalsContact O-N 3.14Å; G110-R148 PolarHBondContact O-NH2 3.39Å
111	V	84.8	Confident	84.3	Confident	50 Å²	50	16 Å²	16	30%	0.303	10%	0.096	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.5	-43.5	175.9	-174.3	0	0	0	0	112	C109 R141 A144 R148	C109-V111 PolarHBondContact O-N 2.89Å; C109-V111 VanDerWaalsContact O-N 3.1Å; V111-R141 HydrophobicContact CG2-CB 3.6Å; V111-A144 HydrophobicContact CG2-CB 4.09Å; V111-R148 PolarHBondContact O-NH2 2.78Å
112	G	73.5	Confident	84	Confident	38 Å²	38	16.1 Å²	16.1	39%	0.392	10%	0.097	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.1	-24.8	-173.5	0	0	0	0	0	114.8	C109	C109-G112 PolarHBondContact O-N 2.77Å
113	G	80.9	Confident	83.6	Confident	7 Å²	7	23.8 Å²	23.8	7%	0.072	13%	0.126	C	C	.	.	B	Isolated β-bridge	trans	61.9	-145.2	-176.3	0	0	0	0	0	113.6	C109 Q115	C109-G113 PolarHBondContact O-N 2.93Å; G113-Q115 PolarHBondContact O-N 2.93Å
114	V	79.8	Confident	83.3	Confident	9 Å²	9	24.1 Å²	24.1	6%	0.055	13%	0.127	C	C	.	.	S	Bend	trans	-78.8	117.3	177.7	178.4	0	0	0	0	109.6	L108 T118 F119 A152 I153 K156 L157	L108-V114 HydrophobicContact CD1-CG2 4.42Å; V114-T118 HydrophobicContact CG1-CG2 4.1Å; V114-F119 HydrophobicContact CG1-CD2 4.3Å; V114-F119 HydrophobicContact CG1-CE2 3.84Å; V114-F119 HydrophobicContact CG1-CZ 4.32Å; V114-A152 HydrophobicContact CB-CB 4.36Å; V114-A152 HydrophobicContact CG2-CB 3.97Å; V114-I153 HydrophobicContact CG2-CG1 3.88Å; V114-K156 HydrophobicContact CB-CD 4.38Å; V114-K156 HydrophobicContact CG1-CB 4.39Å; V114-L157 HydrophobicContact CG1-CD1 4.12Å; V114-L157 HydrophobicContact CG1-CD2 3.8Å; V114-L157 HydrophobicContact CG1-CG 3.86Å; V114-L157 HydrophobicContact CG2-CD1 4.04Å; V114-L157 HydrophobicContact CG2-CG 4.3Å
115	Q	73.3	Confident	83	Confident	58 Å²	58	24.1 Å²	24.1	27%	0.271	13%	0.127	S	C	.	.			trans	-106.5	169.3	-179.8	-65.3	175.3	-70.2	0	0	110.6	H17 G113 Q117 T118 F119	H17-Q115 HydrophobicContact CB-CB 4.39Å; H17-Q115 VanDerWaalsContact CB-OE1 3.3Å; H17-Q115 PolarHBondContact CD2-NE2 2.76Å; H17-Q115 PolarHBondContact CD2-OE1 2.86Å; H17-Q115 PolarHBondContact NE2-NE2 2.86Å; G113-Q115 PolarHBondContact O-N 2.93Å; Q115-Q117 PolarHBondContact O-N 2.99Å; Q115-T118 PolarHBondContact N-OG1 2.91Å; Q115-T118 WeakPolarHBondContact O-CB 3.33Å; Q115-T118 PolarHBondContact O-N 3.24Å; Q115-T118 PolarHBondContact O-OG1 3.4Å; Q115-F119 WeakPolarHBondContact O-CD2 3.44Å
116	S	68.5	Low	82.7	Confident	8 Å²	8	26.3 Å²	26.3	6%	0.056	15%	0.145	C	C	.	.	H	α-helix	trans	-49.9	-51.2	-179.7	51.8	0	0	0	0	114.2	T118 F119 E673	S116-T118 PolarHBondContact O-N 2.72Å; S116-F119 WeakPolarHBondContact O-CB 3.44Å; S116-F119 PolarHBondContact O-N 3.01Å; S116-E673 WeakPolarHBondContact CB-O 3.2Å; S116-E673 PolarHBondContact OG-O 3.01Å
117	Q	70.5	Confident	82.4	Confident	18 Å²	18	30.6 Å²	30.6	8%	0.084	16%	0.161	C	C	.	.	H	α-helix	trans	-68.1	-22.2	-177.3	-55.6	171.9	-8.3	0	0	112	H17 G86 V88 Q115 F119 T120 V121	H17-Q117 PolarHBondContact CE1-OE1 2.87Å; H17-Q117 VanDerWaalsContact CE1-OE1 3.23Å; H17-Q117 WeakPolarHBondContact ND1-CB 3.45Å; H17-Q117 WeakPolarHBondContact ND1-CG 3.33Å; H17-Q117 PolarHBondContact ND1-OE1 2.91Å; G86-Q117 PolarHBondContact O-OE1 3.41Å; V88-Q117 HydrophobicContact CG2-CG 3.69Å; Q115-Q117 PolarHBondContact O-N 2.99Å; Q117-F119 PolarHBondContact O-N 2.68Å; Q117-T120 PolarHBondContact O-N 2.66Å; Q117-V121 WeakPolarHBondContact O-CG2 3.33Å; Q117-V121 PolarHBondContact O-N 3.46Å
118	T	79.6	Confident	82.1	Confident	1 Å²	1	32.4 Å²	32.4	1%	0.006	17%	0.168	C	C	.	.	H	α-helix	trans	-59.1	-40.2	171.5	-51.8	0	0	0	0	110.3	L106 L108 V114 Q115 S116 V121 C122 L157	L106-T118 HydrophobicContact CD1-CG2 4.32Å; L106-T118 HydrophobicContact CD2-CG2 4.16Å; L108-T118 HydrophobicContact CD2-CG2 3.59Å; V114-T118 HydrophobicContact CG1-CG2 4.1Å; Q115-T118 PolarHBondContact N-OG1 2.91Å; Q115-T118 WeakPolarHBondContact O-CB 3.33Å; Q115-T118 PolarHBondContact O-N 3.24Å; Q115-T118 PolarHBondContact O-OG1 3.4Å; S116-T118 PolarHBondContact O-N 2.72Å; T118-V121 PolarHBondContact O-N 3.16Å; T118-C122 WeakPolarHBondContact O-CB 3.46Å; T118-C122 PolarHBondContact O-N 3.33Å; T118-C122 PolarHBondContact O-SG 2.79Å; T118-L157 HydrophobicContact CG2-CD1 4.06Å; T118-L157 HydrophobicContact CG2-CD2 4.44Å
119	F	79.7	Confident	82	Confident	77 Å²	77	38 Å²	38	34%	0.338	20%	0.198	S	C	.	.	H	α-helix	trans	-63.3	-44.6	175.9	-69.3	-95.6	0	0	0	112	V114 Q115 S116 Q117 C122 R123 K156 L157	V114-F119 HydrophobicContact CG1-CD2 4.3Å; V114-F119 HydrophobicContact CG1-CE2 3.84Å; V114-F119 HydrophobicContact CG1-CZ 4.32Å; Q115-F119 WeakPolarHBondContact O-CD2 3.44Å; S116-F119 WeakPolarHBondContact O-CB 3.44Å; S116-F119 PolarHBondContact O-N 3.01Å; Q117-F119 PolarHBondContact O-N 2.68Å; F119-C122 PolarHBondContact O-N 2.69Å; F119-R123 WeakPolarHBondContact O-CB 3.46Å; F119-R123 PolarHBondContact O-N 3.33Å; F119-K156 HydrophobicContact CE1-CB 4.43Å; F119-K156 WeakPolarHBondContact CE1-O 3.48Å; F119-K156 HydrophobicContact CZ-CB 3.81Å; F119-L157 HydrophobicContact CD1-CD2 3.7Å; F119-L157 HydrophobicContact CD2-CD2 4.39Å; F119-L157 HydrophobicContact CE1-CD2 3.87Å; F119-L157 HydrophobicContact CG-CD2 4.02Å; F119-L157 HydrophobicContact CZ-CD2 4.31Å
120	T	78.1	Confident	82.2	Confident	37 Å²	37	37.7 Å²	37.7	23%	0.227	20%	0.196	C	C	.	.	H	α-helix	trans	-58.7	-50	177.3	-48.6	0	0	0	0	110.4	T91 Q117 C122 R123 Q124	T91-T120 HydrophobicContact CG2-CG2 4.45Å; Q117-T120 PolarHBondContact O-N 2.66Å; T120-C122 PolarHBondContact O-N 2.82Å; T120-R123 WeakPolarHBondContact O-CB 3.44Å; T120-R123 PolarHBondContact O-N 3.39Å; T120-R123 VanDerWaalsContact O-N 3.17Å; T120-Q124 VanDerWaalsContact O-CG 3.26Å; T120-Q124 WeakPolarHBondContact O-CG 3.42Å; T120-Q124 PolarHBondContact O-N 3.11Å
121	V	83.2	Confident	82.5	Confident	10 Å²	10	38.1 Å²	38.1	6%	0.061	20%	0.199	C	C	.	.	H	α-helix	trans	-61.2	-43.8	178.5	172.5	0	0	0	0	111.5	L106 Q117 T118 R123 Q124 M125	L106-V121 HydrophobicContact CD1-CG1 4Å; Q117-V121 WeakPolarHBondContact O-CG2 3.33Å; Q117-V121 PolarHBondContact O-N 3.46Å; T118-V121 PolarHBondContact O-N 3.16Å; V121-R123 VanDerWaalsContact C-N 3.33Å; V121-R123 PolarHBondContact O-N 3.02Å; V121-Q124 WeakPolarHBondContact O-CB 3.37Å; V121-Q124 PolarHBondContact O-N 2.95Å; V121-M125 HydrophobicContact CG1-CE 3.54Å; V121-M125 HydrophobicContact CG1-SD 4.21Å; V121-M125 WeakPolarHBondContact O-CG 3.3Å; V121-M125 PolarHBondContact O-N 3.41Å
122	C	85.8	Confident	83	Confident	9 Å²	9	36.1 Å²	36.1	6%	0.061	19%	0.186	C	C	.	.	H	α-helix	trans	-61.8	-39.6	175.7	-71.3	0	0	0	0	112.2	T118 F119 T120 Q124 M125 A126 F159	T118-C122 WeakPolarHBondContact O-CB 3.46Å; T118-C122 PolarHBondContact O-N 3.33Å; T118-C122 PolarHBondContact O-SG 2.79Å; F119-C122 PolarHBondContact O-N 2.69Å; T120-C122 PolarHBondContact O-N 2.82Å; C122-Q124 VanDerWaalsContact C-N 3.33Å; C122-M125 PolarHBondContact O-N 2.88Å; C122-A126 VanDerWaalsContact O-CB 3.31Å; C122-A126 WeakPolarHBondContact O-CB 3.48Å; C122-A126 PolarHBondContact O-N 3.3Å; C122-F159 HydrophobicContact CB-CE2 4.26Å; C122-F159 HydrophobicContact CB-CZ 4.4Å
123	R	83.5	Confident	84.1	Confident	163 Å²	163	34.3 Å²	34.3	62%	0.615	17%	0.167	S	C	*	.	H	α-helix	trans	-65.5	-36.2	175.2	-172.9	-179.1	-178.8	-168.8	1.5	111.7	F119 T120 V121 A126 R127	F119-R123 WeakPolarHBondContact O-CB 3.46Å; F119-R123 PolarHBondContact O-N 3.33Å; T120-R123 WeakPolarHBondContact O-CB 3.44Å; T120-R123 PolarHBondContact O-N 3.39Å; T120-R123 VanDerWaalsContact O-N 3.17Å; V121-R123 VanDerWaalsContact C-N 3.33Å; V121-R123 PolarHBondContact O-N 3.02Å; R123-A126 WeakPolarHBondContact O-CB 3.35Å; R123-A126 PolarHBondContact O-N 2.96Å; R123-R127 PolarHBondContact O-N 3.41Å
124	Q	85.6	Confident	84.8	Confident	7 Å²	7	34.1 Å²	34.1	3%	0.033	17%	0.165	C	C	.	.	H	α-helix	trans	-69.5	-44.8	175.7	-66.1	175.8	-38.9	0	0	111.7	V94 E95 L98 T120 V121 C122 A126 R127 Y128	V94-Q124 VanDerWaalsContact CG1-OE1 3.3Å; E95-Q124 VanDerWaalsContact OE1-CG 3.27Å; E95-Q124 WeakPolarHBondContact OE1-CG 3.29Å; E95-Q124 PolarHBondContact OE1-NE2 3.48Å; L98-Q124 HydrophobicContact CD1-CB 3.51Å; T120-Q124 VanDerWaalsContact O-CG 3.26Å; T120-Q124 WeakPolarHBondContact O-CG 3.42Å; T120-Q124 PolarHBondContact O-N 3.11Å; V121-Q124 WeakPolarHBondContact O-CB 3.37Å; V121-Q124 PolarHBondContact O-N 2.95Å; C122-Q124 VanDerWaalsContact C-N 3.33Å; Q124-A126 PolarHBondContact O-N 3.49Å; Q124-R127 WeakPolarHBondContact O-CB 3.36Å; Q124-R127 PolarHBondContact O-N 3.19Å; Q124-R127 VanDerWaalsContact O-N 3.17Å; Q124-Y128 VanDerWaalsContact O-CD2 3.31Å; Q124-Y128 WeakPolarHBondContact O-CD2 3.37Å; Q124-Y128 PolarHBondContact O-N 3.3Å
125	M	89	Confident	85.6	Confident	0 Å²	0	33.7 Å²	33.7	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-59.8	-35.7	170.8	-67.8	173.9	179.9	0	0	111.1	L98 A104 V121 C122 N129 V130 F132 R253	L98-M125 HydrophobicContact CD1-CG 4.04Å; L98-M125 HydrophobicContact CD2-CE 4.29Å; L98-M125 HydrophobicContact CD2-CG 3.91Å; A104-M125 HydrophobicContact CB-CE 3.56Å; A104-M125 HydrophobicContact CB-SD 4.34Å; V121-M125 HydrophobicContact CG1-CE 3.54Å; V121-M125 HydrophobicContact CG1-SD 4.21Å; V121-M125 WeakPolarHBondContact O-CG 3.3Å; V121-M125 PolarHBondContact O-N 3.41Å; C122-M125 PolarHBondContact O-N 2.88Å; M125-N129 PolarHBondContact O-N 3.45Å; M125-N129 VanDerWaalsContact O-N 3.12Å; M125-V130 PolarHBondContact O-N 2.92Å; M125-V130 VanDerWaalsContact O-N 3.1Å; M125-F132 HydrophobicContact SD-CB 4.01Å; M125-F132 HydrophobicContact SD-CD1 4.09Å; M125-F132 HydrophobicContact SD-CG 3.99Å; M125-R253 PolarHBondContact O-NH2 3.4Å
126	A	88.6	Confident	86.6	Confident	46 Å²	46	30.9 Å²	30.9	38%	0.38	15%	0.149	S	C	.	.	H	α-helix	trans	-59.6	-46.2	173.6	0	0	0	0	0	113.1	C122 R123 Q124 Y128 N129 R253	C122-A126 VanDerWaalsContact O-CB 3.31Å; C122-A126 WeakPolarHBondContact O-CB 3.48Å; C122-A126 PolarHBondContact O-N 3.3Å; R123-A126 WeakPolarHBondContact O-CB 3.35Å; R123-A126 PolarHBondContact O-N 2.96Å; Q124-A126 PolarHBondContact O-N 3.49Å; A126-Y128 PolarHBondContact O-N 3.12Å; A126-N129 PolarHBondContact O-N 3.23Å; A126-N129 PolarHBondContact O-OD1 3.25Å; A126-R253 PolarHBondContact O-NH1 2.96Å
127	R	86.8	Confident	87.8	Confident	91 Å²	91	30.6 Å²	30.6	34%	0.343	15%	0.147	S	C	.	.	H	α-helix	trans	-60.9	-41	-179.4	-172.3	-178.1	-65.3	143.3	-4.5	113.3	E95 R123 Q124 H410	E95-R127 IonicContact OE1-CZ 3.01Å; E95-R127 IonicContact OE1-NH1 2.81Å; E95-R127 PolarHBondContact OE1-NH1 3.15Å; E95-R127 IonicContact OE2-NH1 3.29Å; E95-R127 PolarHBondContact OE2-NH1 3.24Å; R123-R127 PolarHBondContact O-N 3.41Å; Q124-R127 WeakPolarHBondContact O-CB 3.36Å; Q124-R127 PolarHBondContact O-N 3.19Å; Q124-R127 VanDerWaalsContact O-N 3.17Å; R127-H410 VanDerWaalsContact CZ-CD2 3.42Å; R127-H410 PolarHBondContact NH1-CD2 2.92Å; R127-H410 PolarHBondContact NH2-CD2 3.23Å
128	Y	87.4	Confident	88.8	Confident	39 Å²	39	30.6 Å²	30.6	15%	0.153	15%	0.146	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.4	9.4	-178	-57.2	-65.8	0	0	0	113.9	E95 L98 R99 Q124 A126 V130 H410	E95-Y128 WeakPolarHBondContact OE2-CE2 3.27Å; E95-Y128 VanDerWaalsContact OE2-CZ 3.32Å; E95-Y128 PolarHBondContact OE2-OH 3.13Å; L98-Y128 HydrophobicContact CB-CD2 3.79Å; L98-Y128 HydrophobicContact CB-CE2 4.25Å; R99-Y128 HydrophobicContact CB-CD1 4.22Å; R99-Y128 HydrophobicContact CB-CE1 4.01Å; R99-Y128 HydrophobicContact CG-CE1 4.33Å; Q124-Y128 VanDerWaalsContact O-CD2 3.31Å; Q124-Y128 WeakPolarHBondContact O-CD2 3.37Å; Q124-Y128 PolarHBondContact O-N 3.3Å; A126-Y128 PolarHBondContact O-N 3.12Å; Y128-V130 PolarHBondContact O-N 3.08Å; Y128-H410 PolarHBondContact OH-N 2.94Å
129	N	88.8	Confident	89.4	Confident	118 Å²	118	30.9 Å²	30.9	63%	0.631	15%	0.148	S	C	*	.	T	Hydrogen-bonded Turn	trans	52.1	35.6	-178.7	-65.7	-44.7	0	0	0	114.6	M125 A126 P131 R253	M125-N129 PolarHBondContact O-N 3.45Å; M125-N129 VanDerWaalsContact O-N 3.12Å; A126-N129 PolarHBondContact O-N 3.23Å; A126-N129 PolarHBondContact O-OD1 3.25Å; N129-P131 VanDerWaalsContact O-CD 3.27Å; N129-P131 WeakPolarHBondContact O-CD 3.42Å; N129-R253 VanDerWaalsContact C-CD 3.49Å; N129-R253 WeakPolarHBondContact O-CD 3.38Å
130	V	91.5	Very high	89.9	Confident	5 Å²	5	28.1 Å²	28.1	3%	0.03	14%	0.137	C	C	.	.			trans	-80.8	119	-176.9	178.9	0	0	0	0	110.5	A104 M125 Y128 R253	A104-V130 HydrophobicContact CB-CG1 4.01Å; M125-V130 PolarHBondContact O-N 2.92Å; M125-V130 VanDerWaalsContact O-N 3.1Å; Y128-V130 PolarHBondContact O-N 3.08Å; V130-R253 WeakPolarHBondContact O-CD 2.98Å; V130-R253 PolarHBondContact O-NE 3.22Å
131	P	94.3	Very high	90.3	Very high	10 Å²	10	31.5 Å²	31.5	7%	0.065	15%	0.145	C	C	.	.			trans	-60.5	140.8	168.4	-24.4	37.2	0	0	0	111.7	D102 G103 A104 N129 V250 L251 R253 L280 P281	D102-P131 WeakPolarHBondContact O-CD 3.46Å; G103-P131 CarbonylContact C-O 3.58Å; G103-P131 VanDerWaalsContact CA-O 3.24Å; G103-P131 WeakPolarHBondContact CA-O 3.43Å; A104-P131 PolarHBondContact N-O 2.81Å; N129-P131 VanDerWaalsContact O-CD 3.27Å; N129-P131 WeakPolarHBondContact O-CD 3.42Å; P131-V250 HydrophobicContact CB-CG1 4.12Å; P131-V250 WeakPolarHBondContact CB-O 3.45Å; P131-L251 HydrophobicContact CG-CD2 4.38Å; P131-R253 HydrophobicContact CG-CG 4.43Å; P131-L280 HydrophobicContact CB-CD2 4.42Å; P131-P281 HydrophobicContact CG-CG 4.16Å
132	F	94.7	Very high	90.4	Very high	8 Å²	8	38.2 Å²	38.2	4%	0.035	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	149.8	-178	67.8	-86.4	0	0	0	113.2	A104 L106 M125 F159 A256	A104-F132 HydrophobicContact CB-CB 4.13Å; A104-F132 CarbonylContact O-C 3.53Å; A104-F132 WeakPolarHBondContact O-CA 3.38Å; A104-F132 WeakPolarHBondContact O-CB 3.27Å; L106-F132 HydrophobicContact CB-CD2 4.07Å; L106-F132 HydrophobicContact CD2-CD2 4.45Å; L106-F132 HydrophobicContact CD2-CE2 4.23Å; M125-F132 HydrophobicContact SD-CB 4.01Å; M125-F132 HydrophobicContact SD-CD1 4.09Å; M125-F132 HydrophobicContact SD-CG 3.99Å; F132-F159 HydrophobicContact CE1-CE1 4.28Å; F132-F159 HydrophobicContact CE1-CZ 4.11Å; F132-F159 HydrophobicContact CZ-CD1 4.38Å; F132-F159 HydrophobicContact CZ-CD2 4.21Å; F132-F159 HydrophobicContact CZ-CE1 4.03Å; F132-F159 AromaticContact CZ-CE2 3.84Å; F132-F159 HydrophobicContact CZ-CE2 3.84Å; F132-F159 HydrophobicContact CZ-CG 4.48Å; F132-F159 AromaticContact CZ-CZ 3.75Å; F132-F159 HydrophobicContact CZ-CZ 3.75Å; F132-A256 HydrophobicContact CE2-CB 4.08Å; F132-A256 HydrophobicContact CZ-CB 4.23Å
133	L	95.9	Very high	90.3	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99	150.9	166.5	-52.7	-180	0	0	0	109.2	A104 I105 L106 V250 P257 L259 A275 V276 Y279 L280	A104-L133 PolarHBondContact O-N 3.48Å; I105-L133 WeakPolarHBondContact CA-O 3.42Å; L106-L133 PolarHBondContact N-O 2.77Å; L133-V250 HydrophobicContact CD2-CG1 4.29Å; L133-P257 HydrophobicContact CD2-CG 3.4Å; L133-L259 HydrophobicContact CB-CD1 4.44Å; L133-A275 HydrophobicContact CD1-CB 3.96Å; L133-V276 HydrophobicContact CD1-CG2 4.15Å; L133-Y279 HydrophobicContact CD2-CD2 4.45Å; L133-L280 HydrophobicContact CD1-CD1 4.05Å; L133-L280 HydrophobicContact CD1-CG 3.94Å; L133-L280 HydrophobicContact CD2-CD2 4.15Å; L133-L280 HydrophobicContact CD2-CG 4.3Å; L133-L280 HydrophobicContact CG-CD1 4.12Å; L133-L280 HydrophobicContact CG-CD2 3.87Å; L133-L280 HydrophobicContact CG-CG 3.83Å
134	T	95.6	Very high	90.5	Very high	2 Å²	2	36.2 Å²	36.2	1%	0.012	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	132.7	173.4	-55.6	0	0	0	0	109.9	L106 L108 I153 P257 I258 L259	L106-T134 CarbonylContact O-C 3.57Å; L106-T134 WeakPolarHBondContact O-CA 3.11Å; L108-T134 HydrophobicContact CD1-CG2 3.77Å; L108-T134 HydrophobicContact CG-CG2 4.26Å; T134-I153 HydrophobicContact CG2-CD1 4Å; T134-P257 WeakPolarHBondContact CB-O 3.36Å; T134-P257 PolarHBondContact N-O 3.31Å; T134-I258 HydrophobicContact CG2-CG1 4.07Å; T134-I258 CarbonylContact O-C 3.54Å; T134-I258 WeakPolarHBondContact O-CA 3.03Å; T134-L259 PolarHBondContact O-N 2.9Å
135	F	96.5	Very high	90.6	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	116.8	176.9	-178.7	-111.8	0	0	0	110.8	V25 I105 L106 I107 L108 N137 L259 L272	V25-F135 HydrophobicContact CG2-CD1 4.26Å; V25-F135 HydrophobicContact CG2-CE1 3.88Å; I105-F135 HydrophobicContact CG2-CB 4.07Å; L106-F135 PolarHBondContact O-N 2.79Å; I107-F135 CarbonylContact C-O 3.46Å; I107-F135 WeakPolarHBondContact CA-O 3.46Å; I107-F135 HydrophobicContact CG1-CB 4.43Å; I107-F135 HydrophobicContact CG1-CD1 4.31Å; I107-F135 HydrophobicContact CG2-CD1 4.3Å; L108-F135 PolarHBondContact N-O 3.1Å; F135-N137 HydrophobicContact CD1-CB 3.98Å; F135-N137 HydrophobicContact CE1-CB 3.76Å; F135-N137 PolarHBondContact O-N 2.99Å; F135-L259 WeakPolarHBondContact CA-O 3.37Å; F135-L259 HydrophobicContact CD2-CB 4.01Å; F135-L272 HydrophobicContact CB-CD1 4.19Å; F135-L272 HydrophobicContact CB-CD2 4.33Å; F135-L272 HydrophobicContact CD1-CD2 4.2Å; F135-L272 HydrophobicContact CD2-CB 4.42Å; F135-L272 HydrophobicContact CD2-CD1 4.2Å; F135-L272 HydrophobicContact CD2-CD2 3.99Å; F135-L272 HydrophobicContact CD2-CG 4.44Å; F135-L272 HydrophobicContact CE2-CB 4.49Å; F135-L272 HydrophobicContact CE2-CD2 4.32Å; F135-L272 HydrophobicContact CG-CD1 4.38Å; F135-L272 HydrophobicContact CG-CD2 3.92Å
136	I	95	Very high	90.7	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	107.9	174.1	-58.1	174.2	0	0	0	108.4	L108 L139 A146 V149 I258 L259 L260 G261	L108-I136 WeakPolarHBondContact O-CA 3.04Å; I136-L139 HydrophobicContact CG2-CD2 3.8Å; I136-L139 HydrophobicContact CG2-CG 4.26Å; I136-A146 HydrophobicContact CD1-CB 4.27Å; I136-V149 HydrophobicContact CD1-CB 3.81Å; I136-V149 HydrophobicContact CD1-CG1 3.76Å; I136-V149 HydrophobicContact CG1-CB 4.46Å; I136-V149 HydrophobicContact CG1-CG1 3.98Å; I136-I258 HydrophobicContact CD1-CG2 3.51Å; I136-I258 HydrophobicContact CG1-CG2 3.77Å; I136-L259 PolarHBondContact N-O 3.22Å; I136-L260 HydrophobicContact CB-CD2 3.81Å; I136-L260 HydrophobicContact CD1-CD2 3.76Å; I136-L260 HydrophobicContact CG1-CD2 4.14Å; I136-G261 PolarHBondContact O-N 2.85Å
137	N	94.3	Very high	90.8	Very high	2 Å²	2	41.3 Å²	41.3	1%	0.011	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	171.8	179	-165	15.1	0	0	0	111.5	S20 I107 L108 G110 F135 L139 G261 A263	S20-N137 PolarHBondContact O-ND2 2.74Å; I107-N137 HydrophobicContact CG2-CB 3.72Å; L108-N137 PolarHBondContact O-N 3.06Å; G110-N137 PolarHBondContact N-O 3.39Å; F135-N137 HydrophobicContact CD1-CB 3.98Å; F135-N137 HydrophobicContact CE1-CB 3.76Å; F135-N137 PolarHBondContact O-N 2.99Å; N137-L139 VanDerWaalsContact C-N 3.3Å; N137-L139 PolarHBondContact O-N 3.38Å; N137-G261 CarbonylContact C-O 3.5Å; N137-G261 WeakPolarHBondContact CA-O 3.45Å; N137-A263 PolarHBondContact OD1-N 2.89Å
138	K	91.2	Very high	91	Very high	17 Å²	17	42.5 Å²	42.5	7%	0.074	20%	0.203	C	C	.	.			trans	60.9	33.2	176	-58.3	-175.3	170.9	-171.3	0	113.9	D19 D140 R141 G261	D19-K138 WeakPolarHBondContact O-CE 3.49Å; D19-K138 PolarHBondContact O-NZ 2.72Å; D19-K138 IonicContact OD1-NZ 3.03Å; D19-K138 PolarHBondContact OD1-NZ 3.18Å; D19-K138 IonicContact OD2-NZ 2.69Å; D19-K138 PolarHBondContact OD2-NZ 2.85Å; D19-K138 VanDerWaalsContact OD2-NZ 3.14Å; K138-D140 WeakPolarHBondContact CA-OD1 3.24Å; K138-D140 PolarHBondContact O-N 2.92Å; K138-D140 VanDerWaalsContact O-N 3.15Å; K138-R141 HydrophobicContact CB-CG 4.28Å; K138-R141 PolarHBondContact O-N 2.95Å; K138-G261 PolarHBondContact N-O 3Å
139	L	91.7	Very high	91.1	Very high	7 Å²	7	40.7 Å²	40.7	4%	0.037	20%	0.196	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.1	-8.3	174.2	-69.2	177.6	0	0	0	114.1	I136 N137 A144 A146 E171 F174 L260 G261	I136-L139 HydrophobicContact CG2-CD2 3.8Å; I136-L139 HydrophobicContact CG2-CG 4.26Å; N137-L139 VanDerWaalsContact C-N 3.3Å; N137-L139 PolarHBondContact O-N 3.38Å; L139-A144 HydrophobicContact CD2-CB 4.32Å; L139-A146 HydrophobicContact CD2-CB 4.28Å; L139-E171 WeakPolarHBondContact O-CA 2.95Å; L139-E171 PolarHBondContact O-N 2.95Å; L139-E171 VanDerWaalsContact O-N 3.14Å; L139-F174 HydrophobicContact CB-CD2 4.36Å; L139-F174 HydrophobicContact CB-CE2 4.44Å; L139-F174 HydrophobicContact CB-CG 4.49Å; L139-F174 HydrophobicContact CD1-CE2 3.99Å; L139-F174 HydrophobicContact CD1-CZ 4.18Å; L139-L260 HydrophobicContact CD1-CB 3.73Å; L139-L260 HydrophobicContact CD1-CD2 4.23Å; L139-L260 HydrophobicContact CD1-CG 4.38Å; L139-G261 PolarHBondContact N-O 3.32Å
140	D	90.2	Very high	91.3	Very high	20 Å²	20	35.2 Å²	35.2	11%	0.107	17%	0.167	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.1	-11.1	175.8	63	-63.2	0	0	0	114.5	K138 E171 T262 K265	K138-D140 WeakPolarHBondContact CA-OD1 3.24Å; K138-D140 PolarHBondContact O-N 2.92Å; K138-D140 VanDerWaalsContact O-N 3.15Å; D140-E171 WeakPolarHBondContact CA-O 3.4Å; D140-E171 CarbonylContact O-C 3.55Å; D140-T262 HydrophobicContact CB-CG2 4.26Å; D140-T262 VanDerWaalsContact OD1-CB 3.3Å; D140-T262 WeakPolarHBondContact OD1-CB 3.36Å; D140-T262 PolarHBondContact OD1-OG1 2.89Å; D140-K265 HydrophobicContact CB-CD 3.66Å; D140-K265 HydrophobicContact CB-CG 4.15Å
141	R	86.3	Confident	91.3	Very high	107 Å²	107	39.2 Å²	39.2	40%	0.404	19%	0.187	S	C	.	.	S	Bend	trans	-81.7	153.7	-179.9	-70.6	-165.2	173.9	-173.5	-0.8	111.9	D19 V111 K138 A144 E171	D19-R141 IonicContact OD2-NH1 3.28Å; V111-R141 HydrophobicContact CG2-CB 3.6Å; K138-R141 HydrophobicContact CB-CG 4.28Å; K138-R141 PolarHBondContact O-N 2.95Å; R141-A144 WeakPolarHBondContact O-CB 3.02Å; R141-A144 PolarHBondContact O-N 2.99Å; R141-E171 WeakPolarHBondContact O-CG 3.29Å
142	Q	85.5	Confident	90.9	Very high	151 Å²	151	39.5 Å²	39.5	71%	0.706	19%	0.191	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.4	140	171.5	-69.8	179	-16.8	0	0	110.8	A144 E171	Q142-A144 PolarHBondContact O-N 3.46Å; Q142-E171 WeakPolarHBondContact CA-OE1 3.34Å
143	N	84.7	Confident	90.6	Very high	117 Å²	117	39.2 Å²	39.2	63%	0.626	19%	0.189	S	C	*	.	T	Hydrogen-bonded Turn	trans	64.2	16.8	-175.6	-52.5	-53.9	0	0	0	114.8	N145 R148 E171	N143-N145 PolarHBondContact O-N 3.1Å; N143-R148 PolarHBondContact O-NH2 2.89Å; N143-E171 PolarHBondContact N-OE1 3.34Å
144	A	86.3	Confident	90.3	Very high	13 Å²	13	42.6 Å²	42.6	11%	0.107	20%	0.202	C	C	.	.			trans	-71.4	124.5	172.1	0	0	0	0	0	110.1	V111 L139 R141 Q142	V111-A144 HydrophobicContact CG2-CB 4.09Å; L139-A144 HydrophobicContact CD2-CB 4.32Å; R141-A144 WeakPolarHBondContact O-CB 3.02Å; R141-A144 PolarHBondContact O-N 2.99Å; Q142-A144 PolarHBondContact O-N 3.46Å
145	N	88.5	Confident	89.9	Confident	69 Å²	69	49.9 Å²	49.9	37%	0.369	24%	0.236	S	C	.	.			trans	-142	110.2	-178.5	-178.1	-34.5	0	0	0	109.8	G110 N143 E147 R148 V149	G110-N145 PolarHBondContact O-N 3.3Å; G110-N145 VanDerWaalsContact O-N 3.14Å; N143-N145 PolarHBondContact O-N 3.1Å; N145-E147 WeakPolarHBondContact OD1-CB 3.49Å; N145-E147 PolarHBondContact OD1-N 3.5Å; N145-R148 HydrophobicContact CB-CB 4.06Å; N145-R148 PolarHBondContact OD1-N 2.99Å; N145-V149 WeakPolarHBondContact O-CG2 3.44Å; N145-V149 PolarHBondContact O-N 3.37Å
146	A	91.3	Very high	89.2	Confident	7 Å²	7	55.3 Å²	55.3	6%	0.058	26%	0.26	C	S	.	.	H	α-helix	trans	-66.3	-38.5	-178.6	0	0	0	0	0	113	I136 L139 R148 V149 L150 L260	I136-A146 HydrophobicContact CD1-CB 4.27Å; L139-A146 HydrophobicContact CD2-CB 4.28Å; A146-R148 PolarHBondContact O-N 2.86Å; A146-V149 PolarHBondContact O-N 2.78Å; A146-L150 PolarHBondContact O-N 2.79Å; A146-L260 HydrophobicContact CB-CD1 4.26Å; A146-L260 HydrophobicContact CB-CD2 3.82Å
147	E	91	Very high	88.7	Confident	85 Å²	85	56.7 Å²	56.7	40%	0.397	27%	0.267	S	S	.	.	H	α-helix	trans	-64.9	-40.7	180	-57	-171.9	149.1	0	0	111.9	N145 V149 L150 L151 R212	N145-E147 WeakPolarHBondContact OD1-CB 3.49Å; N145-E147 PolarHBondContact OD1-N 3.5Å; E147-V149 VanDerWaalsContact C-N 3.27Å; E147-V149 PolarHBondContact O-N 2.65Å; E147-L150 WeakPolarHBondContact O-CB 3.5Å; E147-L150 PolarHBondContact O-N 3.04Å; E147-L151 WeakPolarHBondContact O-CG 3.16Å; E147-L151 PolarHBondContact O-N 2.85Å; E147-R212 VanDerWaalsContact CD-NH2 3.26Å; E147-R212 IonicContact OE1-CZ 2.64Å; E147-R212 IonicContact OE1-NH2 3.64Å; E147-R212 PolarHBondContact OE1-NH2 2.82Å
148	R	90.2	Very high	88.2	Confident	115 Å²	115	59.5 Å²	59.5	43%	0.434	30%	0.297	S	S	.	.	H	α-helix	trans	-60.9	-39.1	175	-176.1	-177.3	61.5	163.7	1.4	111.4	G110 V111 N143 N145 A146 A152	G110-R148 PolarHBondContact O-NH2 3.39Å; V111-R148 PolarHBondContact O-NH2 2.78Å; N143-R148 PolarHBondContact O-NH2 2.89Å; N145-R148 HydrophobicContact CB-CB 4.06Å; N145-R148 PolarHBondContact OD1-N 2.99Å; A146-R148 PolarHBondContact O-N 2.86Å; R148-A152 WeakPolarHBondContact O-CB 3.44Å; R148-A152 PolarHBondContact O-N 2.89Å
149	V	89.1	Confident	88	Confident	1 Å²	1	61 Å²	61	1%	0.006	30%	0.303	C	S	.	.	H	α-helix	trans	-69.7	-41.2	176.5	-179.7	0	0	0	0	111	L108 I136 N145 A146 E147 L151 A152 I153	L108-V149 HydrophobicContact CB-CG1 4.23Å; L108-V149 HydrophobicContact CD1-CG1 3.91Å; I136-V149 HydrophobicContact CD1-CB 3.81Å; I136-V149 HydrophobicContact CD1-CG1 3.76Å; I136-V149 HydrophobicContact CG1-CB 4.46Å; I136-V149 HydrophobicContact CG1-CG1 3.98Å; N145-V149 WeakPolarHBondContact O-CG2 3.44Å; N145-V149 PolarHBondContact O-N 3.37Å; A146-V149 PolarHBondContact O-N 2.78Å; E147-V149 VanDerWaalsContact C-N 3.27Å; E147-V149 PolarHBondContact O-N 2.65Å; V149-L151 PolarHBondContact O-N 2.93Å; V149-A152 WeakPolarHBondContact O-CB 3.28Å; V149-A152 PolarHBondContact O-N 3.01Å; V149-I153 HydrophobicContact CG1-CD1 4.11Å; V149-I153 HydrophobicContact CG1-CG1 4.47Å; V149-I153 VanDerWaalsContact O-CG1 3.31Å; V149-I153 WeakPolarHBondContact O-CG1 3.46Å; V149-I153 PolarHBondContact O-N 2.7Å
150	L	92.4	Very high	88.1	Confident	4 Å²	4	62.6 Å²	62.6	2%	0.021	31%	0.312	C	S	.	.	H	α-helix	trans	-55.1	-50.8	172.5	171.4	70.5	0	0	0	111.7	A146 E147 A152 I153 R154 A161 L163 I258	A146-L150 PolarHBondContact O-N 2.79Å; E147-L150 WeakPolarHBondContact O-CB 3.5Å; E147-L150 PolarHBondContact O-N 3.04Å; L150-A152 VanDerWaalsContact C-N 3.3Å; L150-A152 PolarHBondContact O-N 2.97Å; L150-I153 PolarHBondContact O-N 3.37Å; L150-R154 PolarHBondContact O-N 3.39Å; L150-R154 VanDerWaalsContact O-N 3.08Å; L150-A161 HydrophobicContact CD1-CB 4.42Å; L150-A161 WeakPolarHBondContact CD1-O 3.4Å; L150-L163 HydrophobicContact CD2-CD1 4.21Å; L150-L163 HydrophobicContact CD2-CG 4.15Å; L150-I258 HydrophobicContact CB-CD1 4.48Å; L150-I258 HydrophobicContact CD1-CD1 3.35Å
151	L	91.5	Very high	88.2	Confident	89 Å²	89	61.6 Å²	61.6	47%	0.466	31%	0.306	S	S	.	.	H	α-helix	trans	-60.1	-41.3	177.4	-70.9	173.5	0	0	0	111.5	E147 V149 I153 R154 Q155	E147-L151 WeakPolarHBondContact O-CG 3.16Å; E147-L151 PolarHBondContact O-N 2.85Å; V149-L151 PolarHBondContact O-N 2.93Å; L151-I153 PolarHBondContact O-N 3.44Å; L151-R154 PolarHBondContact O-N 3.17Å; L151-Q155 WeakPolarHBondContact O-CB 3.45Å; L151-Q155 WeakPolarHBondContact O-CG 3.47Å; L151-Q155 PolarHBondContact O-N 3.28Å
152	A	86.2	Confident	88.6	Confident	16 Å²	16	56.6 Å²	56.6	13%	0.132	29%	0.288	C	S	.	.	H	α-helix	trans	-63.9	-38.8	176.3	0	0	0	0	0	112.5	V114 R148 V149 L150 K156	V114-A152 HydrophobicContact CB-CB 4.36Å; V114-A152 HydrophobicContact CG2-CB 3.97Å; R148-A152 WeakPolarHBondContact O-CB 3.44Å; R148-A152 PolarHBondContact O-N 2.89Å; V149-A152 WeakPolarHBondContact O-CB 3.28Å; V149-A152 PolarHBondContact O-N 3.01Å; L150-A152 VanDerWaalsContact C-N 3.3Å; L150-A152 PolarHBondContact O-N 2.97Å; A152-K156 WeakPolarHBondContact O-CA 3.42Å; A152-K156 WeakPolarHBondContact O-CB 3.18Å; A152-K156 PolarHBondContact O-N 2.91Å
153	I	88.9	Confident	89	Confident	2 Å²	2	49.8 Å²	49.8	1%	0.01	26%	0.256	C	S	.	.	I	π-helix	trans	-61.5	-48.7	175.1	-67.3	160.8	0	0	0	110.1	L108 V114 T134 V149 L150 L151 L157 G158 F159 A161 I258	L108-I153 HydrophobicContact CD1-CD1 3.64Å; L108-I153 HydrophobicContact CD1-CG1 3.76Å; V114-I153 HydrophobicContact CG2-CG1 3.88Å; T134-I153 HydrophobicContact CG2-CD1 4Å; V149-I153 HydrophobicContact CG1-CD1 4.11Å; V149-I153 HydrophobicContact CG1-CG1 4.47Å; V149-I153 VanDerWaalsContact O-CG1 3.31Å; V149-I153 WeakPolarHBondContact O-CG1 3.46Å; V149-I153 PolarHBondContact O-N 2.7Å; L150-I153 PolarHBondContact O-N 3.37Å; L151-I153 PolarHBondContact O-N 3.44Å; I153-L157 HydrophobicContact CG1-CD1 4.44Å; I153-L157 HydrophobicContact CG2-CD1 4.32Å; I153-L157 WeakPolarHBondContact O-CA 3Å; I153-L157 VanDerWaalsContact O-CB 3.3Å; I153-L157 WeakPolarHBondContact O-CB 3.46Å; I153-L157 PolarHBondContact O-N 2.79Å; I153-G158 PolarHBondContact O-N 2.85Å; I153-F159 HydrophobicContact CG2-CB 4.2Å; I153-F159 HydrophobicContact CG2-CD2 4.46Å; I153-A161 HydrophobicContact CG2-CB 3.73Å; I153-I258 HydrophobicContact CD1-CD1 3.64Å; I153-I258 HydrophobicContact CD1-CG1 4.13Å
154	R	90.6	Very high	89.5	Confident	70 Å²	70	44.5 Å²	44.5	26%	0.264	23%	0.228	S	C	.	.	I	π-helix	trans	-62.9	-49.2	180	-68.3	-178.5	-178.5	169.7	4.3	112.1	L150 L151 G158 A161 E215	L150-R154 PolarHBondContact O-N 3.39Å; L150-R154 VanDerWaalsContact O-N 3.08Å; L151-R154 PolarHBondContact O-N 3.17Å; R154-G158 WeakPolarHBondContact O-CA 3.4Å; R154-G158 PolarHBondContact O-N 3.36Å; R154-A161 VanDerWaalsContact CZ-O 3.25Å; R154-A161 PolarHBondContact NE-O 3.03Å; R154-A161 PolarHBondContact NH2-O 2.96Å; R154-E215 IonicContact CZ-OE1 3.76Å; R154-E215 VanDerWaalsContact CZ-OE1 3.23Å; R154-E215 IonicContact NH1-OE1 2.8Å; R154-E215 PolarHBondContact NH1-OE1 2.95Å; R154-E215 IonicContact NH2-OE1 2.73Å; R154-E215 PolarHBondContact NH2-OE1 2.83Å
155	Q	87.4	Confident	89.9	Confident	155 Å²	155	44 Å²	44	72%	0.724	22%	0.224	S	C	*	.	I	π-helix	trans	-76	-42.4	-174.7	-69.2	176.6	-7.7	0	0	113.4	L151	L151-Q155 WeakPolarHBondContact O-CB 3.45Å; L151-Q155 WeakPolarHBondContact O-CG 3.47Å; L151-Q155 PolarHBondContact O-N 3.28Å
156	K	81.6	Confident	90.2	Very high	115 Å²	115	40.9 Å²	40.9	50%	0.5	21%	0.207	S	C	.	.	I	π-helix	trans	-90.2	-42.4	-172.9	-63	-169.5	176.7	-173.6	0	112.8	V114 F119 A152	V114-K156 HydrophobicContact CB-CD 4.38Å; V114-K156 HydrophobicContact CG1-CB 4.39Å; F119-K156 HydrophobicContact CE1-CB 4.43Å; F119-K156 WeakPolarHBondContact CE1-O 3.48Å; F119-K156 HydrophobicContact CZ-CB 3.81Å; A152-K156 WeakPolarHBondContact O-CA 3.42Å; A152-K156 WeakPolarHBondContact O-CB 3.18Å; A152-K156 PolarHBondContact O-N 2.91Å
157	L	83	Confident	90.3	Very high	28 Å²	28	42.3 Å²	42.3	15%	0.147	22%	0.215	C	C	.	.	I	π-helix	trans	-92	-17.5	-178.4	-57.8	174.4	0	0	0	112.7	V114 T118 F119 I153 F159	V114-L157 HydrophobicContact CG1-CD1 4.12Å; V114-L157 HydrophobicContact CG1-CD2 3.8Å; V114-L157 HydrophobicContact CG1-CG 3.86Å; V114-L157 HydrophobicContact CG2-CD1 4.04Å; V114-L157 HydrophobicContact CG2-CG 4.3Å; T118-L157 HydrophobicContact CG2-CD1 4.06Å; T118-L157 HydrophobicContact CG2-CD2 4.44Å; F119-L157 HydrophobicContact CD1-CD2 3.7Å; F119-L157 HydrophobicContact CD2-CD2 4.39Å; F119-L157 HydrophobicContact CE1-CD2 3.87Å; F119-L157 HydrophobicContact CG-CD2 4.02Å; F119-L157 HydrophobicContact CZ-CD2 4.31Å; I153-L157 HydrophobicContact CG1-CD1 4.44Å; I153-L157 HydrophobicContact CG2-CD1 4.32Å; I153-L157 WeakPolarHBondContact O-CA 3Å; I153-L157 VanDerWaalsContact O-CB 3.3Å; I153-L157 WeakPolarHBondContact O-CB 3.46Å; I153-L157 PolarHBondContact O-N 2.79Å; L157-F159 VanDerWaalsContact C-N 3.28Å; L157-F159 HydrophobicContact CB-CD2 3.47Å; L157-F159 VanDerWaalsContact CB-CD2 3.47Å; L157-F159 HydrophobicContact CB-CE2 3.77Å; L157-F159 HydrophobicContact CB-CG 4.46Å; L157-F159 HydrophobicContact CD1-CD2 4.07Å; L157-F159 HydrophobicContact CD1-CE2 4.17Å; L157-F159 HydrophobicContact CG-CD2 4.4Å; L157-F159 HydrophobicContact CG-CE2 4.48Å; L157-F159 PolarHBondContact O-N 3.2Å
158	G	85.3	Confident	90.3	Very high	62 Å²	62	38.9 Å²	38.9	64%	0.639	20%	0.2	S	C	*	.			trans	73.1	16.2	179.4	0	0	0	0	0	114.4	I153 R154	I153-G158 PolarHBondContact O-N 2.85Å; R154-G158 WeakPolarHBondContact O-CA 3.4Å; R154-G158 PolarHBondContact O-N 3.36Å
159	F	87.3	Confident	90.2	Very high	48 Å²	48	35.2 Å²	35.2	21%	0.211	20%	0.197	C	C	.	.			trans	-83.4	140.8	178.7	-69.4	-60.6	0	0	0	112	C122 F132 I153 L157 A161 A256	C122-F159 HydrophobicContact CB-CE2 4.26Å; C122-F159 HydrophobicContact CB-CZ 4.4Å; F132-F159 HydrophobicContact CE1-CE1 4.28Å; F132-F159 HydrophobicContact CE1-CZ 4.11Å; F132-F159 HydrophobicContact CZ-CD1 4.38Å; F132-F159 HydrophobicContact CZ-CD2 4.21Å; F132-F159 HydrophobicContact CZ-CE1 4.03Å; F132-F159 AromaticContact CZ-CE2 3.84Å; F132-F159 HydrophobicContact CZ-CE2 3.84Å; F132-F159 HydrophobicContact CZ-CG 4.48Å; F132-F159 AromaticContact CZ-CZ 3.75Å; F132-F159 HydrophobicContact CZ-CZ 3.75Å; I153-F159 HydrophobicContact CG2-CB 4.2Å; I153-F159 HydrophobicContact CG2-CD2 4.46Å; L157-F159 VanDerWaalsContact C-N 3.28Å; L157-F159 HydrophobicContact CB-CD2 3.47Å; L157-F159 VanDerWaalsContact CB-CD2 3.47Å; L157-F159 HydrophobicContact CB-CE2 3.77Å; L157-F159 HydrophobicContact CB-CG 4.46Å; L157-F159 HydrophobicContact CD1-CD2 4.07Å; L157-F159 HydrophobicContact CD1-CE2 4.17Å; L157-F159 HydrophobicContact CG-CD2 4.4Å; L157-F159 HydrophobicContact CG-CE2 4.48Å; L157-F159 PolarHBondContact O-N 3.2Å; F159-A161 PolarHBondContact O-N 2.64Å; F159-A161 VanDerWaalsContact O-N 3.14Å; F159-A256 HydrophobicContact CB-CB 4.27Å
160	N	91.9	Very high	90	Very high	40 Å²	40	38.6 Å²	38.6	21%	0.214	22%	0.221	C	C	.	.			trans	-71.9	102.2	161.2	-176.9	12.3	0	0	0	108.5	L219 V223 F255 A256	N160-L219 PolarHBondContact ND2-O 3.12Å; N160-V223 WeakPolarHBondContact ND2-CG2 3.49Å; N160-F255 WeakPolarHBondContact O-CA 3.36Å; N160-F255 WeakPolarHBondContact O-CD2 3.26Å; N160-A256 PolarHBondContact O-N 3.25Å
161	A	93.5	Very high	89.7	Confident	0 Å²	0	41.4 Å²	41.4	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	143.3	-173.1	0	0	0	0	0	110.7	L150 I153 R154 F159 A256 I258	L150-A161 HydrophobicContact CD1-CB 4.42Å; L150-A161 WeakPolarHBondContact CD1-O 3.4Å; I153-A161 HydrophobicContact CG2-CB 3.73Å; R154-A161 VanDerWaalsContact CZ-O 3.25Å; R154-A161 PolarHBondContact NE-O 3.03Å; R154-A161 PolarHBondContact NH2-O 2.96Å; F159-A161 PolarHBondContact O-N 2.64Å; F159-A161 VanDerWaalsContact O-N 3.14Å; A161-A256 VanDerWaalsContact CA-O 3.31Å; A161-A256 WeakPolarHBondContact CA-O 3.41Å; A161-A256 HydrophobicContact CB-CB 4.02Å; A161-A256 WeakPolarHBondContact CB-O 3.4Å; A161-I258 HydrophobicContact CB-CD1 3.78Å; A161-I258 HydrophobicContact CB-CG1 4.45Å
162	A	94.3	Very high	89.4	Confident	2 Å²	2	41.4 Å²	41.4	2%	0.017	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	155.8	174.6	0	0	0	0	0	111.5	L216 L219 F255 I258	A162-L216 HydrophobicContact CB-CD1 3.77Å; A162-L219 HydrophobicContact CB-CD1 3.84Å; A162-F255 HydrophobicContact CB-CE2 3.83Å; A162-F255 HydrophobicContact CB-CZ 3.8Å; A162-I258 WeakPolarHBondContact O-CB 3.34Å; A162-I258 PolarHBondContact O-N 3.1Å
163	L	94.9	Very high	89.5	Confident	8 Å²	8	48.4 Å²	48.4	4%	0.042	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	130.2	174.7	-68	171.8	0	0	0	109.3	L150 L166 L180 I258 L260	L150-L163 HydrophobicContact CD2-CD1 4.21Å; L150-L163 HydrophobicContact CD2-CG 4.15Å; L163-L166 HydrophobicContact CD1-CD2 4.18Å; L163-L180 WeakPolarHBondContact O-CD1 3.47Å; L163-I258 HydrophobicContact CD2-CB 4.04Å; L163-I258 HydrophobicContact CD2-CG2 3.65Å; L163-L260 HydrophobicContact CD2-CD1 4.37Å; L163-L260 HydrophobicContact CD2-CD2 3.88Å; L163-L260 HydrophobicContact CD2-CG 4.33Å
164	L	94.7	Very high	89.5	Confident	5 Å²	5	48.4 Å²	48.4	3%	0.026	27%	0.269	C	S	.	.	S	Bend	trans	-87.4	-16	165.7	-60.5	-169.1	0	0	0	111.7	L180 I181 L216 I246 P257 I258 L259 Y279	L164-L180 WeakPolarHBondContact O-CB 3.39Å; L164-L180 PolarHBondContact O-N 2.85Å; L164-L180 VanDerWaalsContact O-N 3.1Å; L164-I181 HydrophobicContact CD2-CD1 4.35Å; L164-L216 HydrophobicContact CD2-CD1 3.83Å; L164-L216 HydrophobicContact CD2-CD2 3.95Å; L164-I246 HydrophobicContact CD2-CD1 3.93Å; L164-P257 HydrophobicContact CD1-CB 3.59Å; L164-P257 HydrophobicContact CD2-CB 4.24Å; L164-P257 HydrophobicContact CG-CB 3.86Å; L164-I258 PolarHBondContact N-O 3.19Å; L164-L259 HydrophobicContact CD1-CD1 4.47Å; L164-Y279 HydrophobicContact CD1-CD2 4.41Å; L164-Y279 HydrophobicContact CD1-CE2 3.73Å
165	Q	95	Very high	89.4	Confident	4 Å²	4	47.1 Å²	47.1	2%	0.019	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	148.4	-173.2	-67.7	173.9	-20.5	0	0	111.3	V177 V178 L260	Q165-V177 HydrophobicContact CB-CB 4.34Å; Q165-V178 CarbonylContact C-O 3.57Å; Q165-V178 WeakPolarHBondContact CA-O 3.4Å; Q165-L260 HydrophobicContact CB-CB 4.43Å; Q165-L260 HydrophobicContact CB-CD1 4.34Å; Q165-L260 HydrophobicContact CB-CG 4.26Å; Q165-L260 WeakPolarHBondContact O-CD1 3.5Å; Q165-L260 PolarHBondContact OE1-O 3.42Å
166	L	93.7	Very high	89.6	Confident	2 Å²	2	39.8 Å²	39.8	1%	0.01	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	140	167.6	-64.5	175	0	0	0	111.4	L163 V177 V178 L180 M205 E208 A209 R212	L163-L166 HydrophobicContact CD1-CD2 4.18Å; L166-V177 CarbonylContact O-C 3.59Å; L166-V177 VanDerWaalsContact O-CA 3.28Å; L166-V177 WeakPolarHBondContact O-CA 3.36Å; L166-V178 HydrophobicContact CB-CB 4.26Å; L166-V178 PolarHBondContact N-O 3.39Å; L166-V178 PolarHBondContact O-N 2.76Å; L166-L180 HydrophobicContact CD1-CD2 3.82Å; L166-L180 HydrophobicContact CG-CD1 4.35Å; L166-L180 HydrophobicContact CG-CD2 3.93Å; L166-L180 HydrophobicContact CG-CG 4.39Å; L166-M205 HydrophobicContact CB-CE 3.97Å; L166-E208 HydrophobicContact CD1-CG 4.09Å; L166-A209 HydrophobicContact CD1-CB 4.08Å; L166-R212 HydrophobicContact CD1-CB 4.27Å; L166-R212 HydrophobicContact CD1-CG 4.13Å; L166-R212 HydrophobicContact CD2-CB 4.4Å; L166-R212 HydrophobicContact CD2-CG 3.96Å
167	P	93.2	Very high	90.2	Very high	37 Å²	37	34.3 Å²	34.3	24%	0.24	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	128.2	-179.9	31.9	-32.2	0	0	0	110.9	G169 F174 M205 L260	P167-G169 PolarHBondContact O-N 3.15Å; P167-F174 HydrophobicContact CB-CD2 3.96Å; P167-F174 HydrophobicContact CB-CE2 3.58Å; P167-M205 WeakPolarHBondContact O-CE 3.39Å; P167-L260 HydrophobicContact CB-CD1 4.16Å; P167-L260 HydrophobicContact CG-CD1 4.16Å
168	I	91.8	Very high	90.7	Very high	14 Å²	14	33 Å²	33	7%	0.072	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	104.5	170.7	-54.7	174.8	0	0	0	107.7	F174 S175 G176 V178 A185 Y187 P202 M205	I168-F174 WeakPolarHBondContact O-CA 3.24Å; I168-S175 WeakPolarHBondContact CG2-OG 3.33Å; I168-S175 PolarHBondContact O-N 3.21Å; I168-S175 PolarHBondContact O-OG 2.86Å; I168-G176 WeakPolarHBondContact CB-O 3.42Å; I168-G176 PolarHBondContact N-O 3.08Å; I168-V178 HydrophobicContact CD1-CG2 3.84Å; I168-V178 HydrophobicContact CG1-CG2 3.7Å; I168-A185 HydrophobicContact CD1-CB 3.82Å; I168-Y187 HydrophobicContact CD1-CE1 3.95Å; I168-Y187 HydrophobicContact CD1-CE2 4.37Å; I168-Y187 HydrophobicContact CG2-CE1 4.15Å; I168-P202 HydrophobicContact CD1-CG 4.46Å; I168-M205 HydrophobicContact CG1-SD 4.25Å
169	G	87.8	Confident	91.2	Very high	37 Å²	37	31.2 Å²	31.2	38%	0.381	18%	0.181	S	C	.	.	S	Bend	trans	79.1	175.5	-172.4	0	0	0	0	0	113	P167	P167-G169 PolarHBondContact O-N 3.15Å
170	S	84.3	Confident	91.5	Very high	73 Å²	73	28.9 Å²	28.9	51%	0.51	17%	0.171	S	C	.	.			trans	-133.7	154.5	179.9	56.4	0	0	0	0	110.8	S172 K173 F174	S170-S172 PolarHBondContact O-N 3.27Å; S170-K173 WeakPolarHBondContact O-CA 3.49Å; S170-K173 WeakPolarHBondContact O-CB 3.3Å; S170-K173 PolarHBondContact O-N 2.93Å; S170-F174 PolarHBondContact O-N 3.49Å
171	E	87.2	Confident	91.5	Very high	62 Å²	62	27.4 Å²	27.4	29%	0.29	16%	0.163	S	C	.	.	G	3₁₀ helix	trans	54.1	-125	173.6	-45.6	-175	156.3	0	0	112.7	L139 D140 R141 Q142 N143 K173 F174	L139-E171 WeakPolarHBondContact O-CA 2.95Å; L139-E171 PolarHBondContact O-N 2.95Å; L139-E171 VanDerWaalsContact O-N 3.14Å; D140-E171 WeakPolarHBondContact CA-O 3.4Å; D140-E171 CarbonylContact O-C 3.55Å; R141-E171 WeakPolarHBondContact O-CG 3.29Å; Q142-E171 WeakPolarHBondContact CA-OE1 3.34Å; N143-E171 PolarHBondContact N-OE1 3.34Å; E171-K173 PolarHBondContact O-N 2.94Å; E171-F174 WeakPolarHBondContact O-CB 3.32Å; E171-F174 PolarHBondContact O-N 3.2Å
172	S	85.5	Confident	91.3	Very high	89 Å²	89	30.2 Å²	30.2	62%	0.622	18%	0.178	S	C	*	.	G	3₁₀ helix	trans	-60.3	-27.3	177.3	59.6	0	0	0	0	113.6	S170	S170-S172 PolarHBondContact O-N 3.27Å
173	K	87.3	Confident	91.1	Very high	164 Å²	164	33.4 Å²	33.4	71%	0.713	19%	0.193	S	C	*	.	G	3₁₀ helix	trans	-89.7	1.8	-179.2	-61.6	-178.6	-179.5	177.4	0	113.6	S170 E171 S175	S170-K173 WeakPolarHBondContact O-CA 3.49Å; S170-K173 WeakPolarHBondContact O-CB 3.3Å; S170-K173 PolarHBondContact O-N 2.93Å; E171-K173 PolarHBondContact O-N 2.94Å; K173-S175 PolarHBondContact O-N 3.02Å
174	F	89.6	Confident	91	Very high	2 Å²	2	34.3 Å²	34.3	1%	0.009	20%	0.197	C	C	.	.			trans	-62.3	106.6	176.7	-177.3	-100.8	0	0	0	110.7	L139 P167 I168 S170 E171 G176 V177 T262 K267	L139-F174 HydrophobicContact CB-CD2 4.36Å; L139-F174 HydrophobicContact CB-CE2 4.44Å; L139-F174 HydrophobicContact CB-CG 4.49Å; L139-F174 HydrophobicContact CD1-CE2 3.99Å; L139-F174 HydrophobicContact CD1-CZ 4.18Å; P167-F174 HydrophobicContact CB-CD2 3.96Å; P167-F174 HydrophobicContact CB-CE2 3.58Å; I168-F174 WeakPolarHBondContact O-CA 3.24Å; S170-F174 PolarHBondContact O-N 3.49Å; E171-F174 WeakPolarHBondContact O-CB 3.32Å; E171-F174 PolarHBondContact O-N 3.2Å; F174-G176 WeakPolarHBondContact CE2-O 3.49Å; F174-V177 HydrophobicContact CE2-CG1 4.2Å; F174-V177 HydrophobicContact CZ-CG1 3.68Å; F174-T262 HydrophobicContact CD1-CG2 3.61Å; F174-T262 HydrophobicContact CE1-CG2 3.78Å; F174-K267 HydrophobicContact CD1-CB 4.41Å; F174-K267 HydrophobicContact CD1-CD 4.06Å; F174-K267 HydrophobicContact CE1-CB 3.86Å; F174-K267 HydrophobicContact CE1-CD 4.26Å; F174-K267 PolarHBondContact O-NZ 2.84Å
175	S	88.1	Confident	91	Very high	43 Å²	43	34 Å²	34	30%	0.301	20%	0.195	S	C	.	.			trans	-107.5	-27.2	-172	59.4	0	0	0	0	113.7	I168 K173	I168-S175 WeakPolarHBondContact CG2-OG 3.33Å; I168-S175 PolarHBondContact O-N 3.21Å; I168-S175 PolarHBondContact O-OG 2.86Å; K173-S175 PolarHBondContact O-N 3.02Å
176	G	91.3	Very high	90.9	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-171.2	-173.1	-172.6	0	0	0	0	0	113	I168 F174 L186	I168-G176 WeakPolarHBondContact CB-O 3.42Å; I168-G176 PolarHBondContact N-O 3.08Å; F174-G176 WeakPolarHBondContact CE2-O 3.49Å; G176-L186 CarbonylContact C-O 3.55Å; G176-L186 WeakPolarHBondContact CA-O 3.33Å
177	V	93.9	Very high	90.8	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	143.1	175.6	-63.8	0	0	0	0	110.2	Q165 L166 F174 L186 F188 L260	Q165-V177 HydrophobicContact CB-CB 4.34Å; L166-V177 CarbonylContact O-C 3.59Å; L166-V177 VanDerWaalsContact O-CA 3.28Å; L166-V177 WeakPolarHBondContact O-CA 3.36Å; F174-V177 HydrophobicContact CE2-CG1 4.2Å; F174-V177 HydrophobicContact CZ-CG1 3.68Å; V177-L186 HydrophobicContact CG2-CB 4.02Å; V177-L186 HydrophobicContact CG2-CD1 4.22Å; V177-L186 PolarHBondContact N-O 3.33Å; V177-L186 PolarHBondContact O-N 3.49Å; V177-F188 HydrophobicContact CG2-CE2 4.08Å; V177-F188 HydrophobicContact CG2-CZ 4.07Å; V177-L260 HydrophobicContact CG1-CB 4.31Å
178	V	94.7	Very high	90.6	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	123.3	168.7	179.7	0	0	0	0	108	Q165 L166 I168 V201 M205 A209	Q165-V178 CarbonylContact C-O 3.57Å; Q165-V178 WeakPolarHBondContact CA-O 3.4Å; L166-V178 HydrophobicContact CB-CB 4.26Å; L166-V178 PolarHBondContact N-O 3.39Å; L166-V178 PolarHBondContact O-N 2.76Å; I168-V178 HydrophobicContact CD1-CG2 3.84Å; I168-V178 HydrophobicContact CG1-CG2 3.7Å; V178-V201 HydrophobicContact CG1-CB 4.5Å; V178-V201 HydrophobicContact CG1-CG1 4Å; V178-V201 HydrophobicContact CG1-CG2 3.77Å; V178-V201 HydrophobicContact CG2-CG1 4.25Å; V178-M205 HydrophobicContact CG2-CE 4.35Å; V178-M205 HydrophobicContact CG2-SD 4.45Å; V178-A209 HydrophobicContact CG1-CB 4.49Å
179	D	94.4	Very high	90.3	Very high	25 Å²	25	38.2 Å²	38.2	13%	0.134	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	117.5	170	-172	-24.9	0	0	0	109	I181 D182 Q183 H184	D179-I181 VanDerWaalsContact C-N 3.32Å; D179-I181 PolarHBondContact OD1-N 3.23Å; D179-D182 PolarHBondContact OD1-N 2.99Å; D179-Q183 VanDerWaalsContact O-CA 3.29Å; D179-Q183 WeakPolarHBondContact O-CA 3.37Å; D179-Q183 PolarHBondContact O-N 2.73Å; D179-H184 PolarHBondContact N-O 3.27Å; D179-H184 PolarHBondContact O-N 2.74Å; D179-H184 IonicContact OD2-CE1 2.82Å
180	L	93.2	Very high	89.9	Confident	0 Å²	0	44.6 Å²	44.6	0%	0	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.7	-24	-177.9	-65.4	177.5	0	0	0	112.7	L163 L164 L166 Q183 A209 R212 L213	L163-L180 WeakPolarHBondContact O-CD1 3.47Å; L164-L180 WeakPolarHBondContact O-CB 3.39Å; L164-L180 PolarHBondContact O-N 2.85Å; L164-L180 VanDerWaalsContact O-N 3.1Å; L166-L180 HydrophobicContact CD1-CD2 3.82Å; L166-L180 HydrophobicContact CG-CD1 4.35Å; L166-L180 HydrophobicContact CG-CD2 3.93Å; L166-L180 HydrophobicContact CG-CG 4.39Å; L180-Q183 PolarHBondContact O-NE2 3.33Å; L180-A209 HydrophobicContact CD2-CB 3.98Å; L180-R212 HydrophobicContact CD1-CB 3.91Å; L180-R212 HydrophobicContact CD2-CB 4.3Å; L180-L213 WeakPolarHBondContact O-CD1 3.29Å
181	I	92.1	Very high	89.5	Confident	8 Å²	8	45.5 Å²	45.5	4%	0.041	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.9	-47.4	-173.1	-59.9	173.5	0	0	0	111	L164 D179 L216 S239 L242 K243 I246 Y279	L164-I181 HydrophobicContact CD2-CD1 4.35Å; D179-I181 VanDerWaalsContact C-N 3.32Å; D179-I181 PolarHBondContact OD1-N 3.23Å; I181-L216 HydrophobicContact CG1-CD2 4.37Å; I181-S239 PolarHBondContact O-OG 3.35Å; I181-L242 HydrophobicContact CG1-CD2 4.24Å; I181-L242 HydrophobicContact CG2-CD2 4.33Å; I181-K243 HydrophobicContact CD1-CG 4.36Å; I181-K243 HydrophobicContact CG2-CD 4.32Å; I181-K243 HydrophobicContact CG2-CG 3.86Å; I181-I246 HydrophobicContact CD1-CD1 3.71Å; I181-I246 HydrophobicContact CG1-CD1 4.45Å; I181-Y279 WeakPolarHBondContact CD1-OH 3.37Å
182	D	90.8	Very high	89	Confident	59 Å²	59	49 Å²	49	32%	0.316	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.2	-2.2	179.9	-65.4	-26.7	0	0	0	112.1	D179 H184 K243	D179-D182 PolarHBondContact OD1-N 2.99Å; D182-H184 PolarHBondContact O-N 2.99Å; D182-K243 IonicContact OD1-NZ 2.68Å; D182-K243 PolarHBondContact OD1-NZ 3.23Å; D182-K243 IonicContact OD2-NZ 3.86Å; D182-K243 PolarHBondContact OD2-NZ 3.24Å
183	Q	90.3	Very high	88.7	Confident	69 Å²	69	44.9 Å²	44.9	32%	0.322	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	55.9	44.3	174.9	-68.2	-74.5	-48	0	0	113.9	D179 L180 V201 L213	D179-Q183 VanDerWaalsContact O-CA 3.29Å; D179-Q183 WeakPolarHBondContact O-CA 3.37Å; D179-Q183 PolarHBondContact O-N 2.73Å; L180-Q183 PolarHBondContact O-NE2 3.33Å; Q183-V201 WeakPolarHBondContact O-CG2 3.2Å; Q183-L213 HydrophobicContact CG-CD2 4.45Å
184	H	92.7	Very high	88.3	Confident	27 Å²	27	40.6 Å²	40.6	13%	0.125	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	149.9	176.8	65.5	39.5	0	0	0	112.5	D179 D182 K198	D179-H184 PolarHBondContact N-O 3.27Å; D179-H184 PolarHBondContact O-N 2.74Å; D179-H184 IonicContact OD2-CE1 2.82Å; D182-H184 PolarHBondContact O-N 2.99Å; H184-K198 PolarHBondContact NE2-NZ 3.37Å
185	A	93.6	Very high	88	Confident	0 Å²	0	44.5 Å²	44.5	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	133.5	170.9	0	0	0	0	0	110.7	I168 Y187 K198 D199 E200	I168-A185 HydrophobicContact CD1-CB 3.82Å; A185-Y187 HydrophobicContact CB-CD2 4.33Å; A185-Y187 HydrophobicContact CB-CE2 3.7Å; A185-K198 WeakPolarHBondContact O-CA 3.3Å; A185-D199 HydrophobicContact CB-CB 4.42Å; A185-D199 PolarHBondContact N-O 3.44Å; A185-D199 PolarHBondContact O-N 3.24Å; A185-E200 WeakPolarHBondContact CB-O 3.29Å
186	L	93	Very high	87.9	Confident	9 Å²	9	45.5 Å²	45.5	5%	0.047	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	114.6	173.6	-63.7	177.9	0	0	0	109.2	G176 V177 F188 K198 P271	G176-L186 CarbonylContact C-O 3.55Å; G176-L186 WeakPolarHBondContact CA-O 3.33Å; V177-L186 HydrophobicContact CG2-CB 4.02Å; V177-L186 HydrophobicContact CG2-CD1 4.22Å; V177-L186 PolarHBondContact N-O 3.33Å; V177-L186 PolarHBondContact O-N 3.49Å; L186-F188 HydrophobicContact CB-CZ 4.49Å; L186-K198 HydrophobicContact CD2-CD 4.4Å; L186-K198 HydrophobicContact CD2-CG 3.75Å; L186-P271 HydrophobicContact CD1-CG 3.79Å
187	Y	92.1	Very high	87.9	Confident	45 Å²	45	50.6 Å²	50.6	18%	0.176	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	135.7	170.8	-63.9	-85.4	0	0	0	109.7	I168 A185 R197 D199 P202	I168-Y187 HydrophobicContact CD1-CE1 3.95Å; I168-Y187 HydrophobicContact CD1-CE2 4.37Å; I168-Y187 HydrophobicContact CG2-CE1 4.15Å; A185-Y187 HydrophobicContact CB-CD2 4.33Å; A185-Y187 HydrophobicContact CB-CE2 3.7Å; Y187-R197 PolarHBondContact N-O 3.43Å; Y187-R197 PolarHBondContact O-N 3.16Å; Y187-D199 HydrophobicContact CD2-CB 3.94Å; Y187-D199 HydrophobicContact CE2-CB 3.8Å; Y187-P202 WeakPolarHBondContact OH-CG 3.45Å
188	F	89.8	Confident	87.8	Confident	12 Å²	12	57.2 Å²	57.2	5%	0.053	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	103	-179.8	-55.5	-89.2	0	0	0	108.1	V177 L186 L196 K267 G268 P271	V177-F188 HydrophobicContact CG2-CE2 4.08Å; V177-F188 HydrophobicContact CG2-CZ 4.07Å; L186-F188 HydrophobicContact CB-CZ 4.49Å; F188-L196 HydrophobicContact CD1-CD2 4.13Å; F188-L196 HydrophobicContact CD1-CG 4.43Å; F188-L196 HydrophobicContact CE1-CD2 3.69Å; F188-L196 HydrophobicContact CE1-CG 4.46Å; F188-L196 HydrophobicContact CZ-CD2 4.49Å; F188-K267 HydrophobicContact CB-CB 4.4Å; F188-K267 HydrophobicContact CB-CD 4.46Å; F188-K267 HydrophobicContact CB-CG 3.99Å; F188-K267 HydrophobicContact CD2-CB 3.63Å; F188-K267 HydrophobicContact CD2-CD 4.29Å; F188-K267 HydrophobicContact CD2-CG 3.99Å; F188-K267 HydrophobicContact CE2-CB 4.05Å; F188-K267 HydrophobicContact CG-CB 3.96Å; F188-K267 HydrophobicContact CG-CG 4.11Å; F188-G268 VanDerWaalsContact CE1-N 3.28Å; F188-P271 HydrophobicContact CE1-CG 4.33Å; F188-P271 HydrophobicContact CZ-CG 4.11Å
189	E	83.9	Confident	87.6	Confident	78 Å²	78	60.5 Å²	60.5	36%	0.364	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	145.1	-177.1	-64.2	-173.3	159.2	0	0	111.4	G193 T195 R197	E189-G193 WeakPolarHBondContact O-CA 3.35Å; E189-G193 PolarHBondContact O-N 3.37Å; E189-T195 PolarHBondContact N-O 2.98Å; E189-R197 HydrophobicContact CG-CB 4.21Å; E189-R197 WeakPolarHBondContact OE1-CD 3.48Å
190	E	79.2	Confident	87.5	Confident	171 Å²	171	65.7 Å²	65.7	80%	0.799	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.1	150.1	176.3	-69.1	-171.4	-178.8	0	0	111.1
191	P	76.3	Confident	87.3	Confident	93 Å²	93	66.2 Å²	66.2	60%	0.604	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	cis	-87.3	152.1	4.5	35.3	-34.7	0	0	0	113.6	G193	P191-G193 PolarHBondContact O-N 3.48Å
192	Y	77.6	Confident	87.3	Confident	134 Å²	134	67.2 Å²	67.2	53%	0.525	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	61.4	6	174.1	-48.5	-74	0	0	0	117.8	F31 Y32 M39 C194 N266	F31-Y192 HydrophobicContact CZ-CG 4.46Å; Y32-Y192 VanDerWaalsContact CE1-O 3.3Å; Y32-Y192 WeakPolarHBondContact CE1-O 3.38Å; Y32-Y192 PolarHBondContact OH-O 3.41Å; M39-Y192 HydrophobicContact CE-CD1 4.45Å; M39-Y192 HydrophobicContact SD-CD1 4.33Å; Y192-C194 VanDerWaalsContact C-N 3.28Å; Y192-C194 PolarHBondContact O-N 2.96Å; Y192-N266 WeakPolarHBondContact O-CB 3.28Å
193	G	77.8	Confident	87.2	Confident	4 Å²	4	72.1 Å²	72.1	4%	0.041	35%	0.353	C	S	.	.	T	Hydrogen-bonded Turn	trans	73.2	18	177.5	0	0	0	0	0	113.7	E189 P191 T195 Q270	E189-G193 WeakPolarHBondContact O-CA 3.35Å; E189-G193 PolarHBondContact O-N 3.37Å; P191-G193 PolarHBondContact O-N 3.48Å; G193-T195 VanDerWaalsContact C-N 3.32Å; G193-T195 PolarHBondContact O-N 2.96Å; G193-Q270 PolarHBondContact O-NE2 3.4Å
194	C	79.5	Confident	87.2	Confident	73 Å²	73	74.1 Å²	74.1	49%	0.493	38%	0.375	S	S	.	.			trans	-65.2	-35	-176.3	-64.2	0	0	0	0	112.9	Y192	Y192-C194 VanDerWaalsContact C-N 3.28Å; Y192-C194 PolarHBondContact O-N 2.96Å
195	T	83.2	Confident	87.1	Confident	84 Å²	84	73.8 Å²	73.8	52%	0.515	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	114.5	178.7	-51.5	0	0	0	0	109.5	E189 G193	E189-T195 PolarHBondContact N-O 2.98Å; G193-T195 VanDerWaalsContact C-N 3.32Å; G193-T195 PolarHBondContact O-N 2.96Å
196	L	87.2	Confident	86.9	Confident	65 Å²	65	78.4 Å²	78.4	34%	0.34	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	111.3	171	-71.3	112.4	0	0	0	109.5	F188 Q270	F188-L196 HydrophobicContact CD1-CD2 4.13Å; F188-L196 HydrophobicContact CD1-CG 4.43Å; F188-L196 HydrophobicContact CE1-CD2 3.69Å; F188-L196 HydrophobicContact CE1-CG 4.46Å; F188-L196 HydrophobicContact CZ-CD2 4.49Å; L196-Q270 HydrophobicContact CD1-CB 4.07Å; L196-Q270 HydrophobicContact CD1-CG 4.06Å; L196-Q270 HydrophobicContact CD2-CB 4.41Å
197	R	90.2	Very high	86.9	Confident	107 Å²	107	82.3 Å²	82.3	40%	0.404	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87	115.5	170.4	-170	-174.4	82.1	-169	14.3	109.3	Y187 E189 D199	Y187-R197 PolarHBondContact N-O 3.43Å; Y187-R197 PolarHBondContact O-N 3.16Å; E189-R197 HydrophobicContact CG-CB 4.21Å; E189-R197 WeakPolarHBondContact OE1-CD 3.48Å; R197-D199 IonicContact CZ-OD2 3.91Å; R197-D199 IonicContact NE-OD2 3.07Å; R197-D199 PolarHBondContact NE-OD2 3.04Å; R197-D199 IonicContact NH2-OD2 2.98Å; R197-D199 PolarHBondContact NH2-OD2 3.44Å
198	K	91.4	Very high	86.9	Confident	139 Å²	139	83.4 Å²	83.4	60%	0.604	42%	0.422	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84	131.9	168.9	-61.8	-163.7	172.2	-153.7	0	109.4	H184 A185 L186	H184-K198 PolarHBondContact NE2-NZ 3.37Å; A185-K198 WeakPolarHBondContact O-CA 3.3Å; L186-K198 HydrophobicContact CD2-CD 4.4Å; L186-K198 HydrophobicContact CD2-CG 3.75Å
199	D	91.4	Very high	87	Confident	69 Å²	69	82.8 Å²	82.8	37%	0.369	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	170.3	-175.9	-152.2	-19.3	0	0	0	110	A185 Y187 R197	A185-D199 HydrophobicContact CB-CB 4.42Å; A185-D199 PolarHBondContact N-O 3.44Å; A185-D199 PolarHBondContact O-N 3.24Å; Y187-D199 HydrophobicContact CD2-CB 3.94Å; Y187-D199 HydrophobicContact CE2-CB 3.8Å; R197-D199 IonicContact CZ-OD2 3.91Å; R197-D199 IonicContact NE-OD2 3.07Å; R197-D199 PolarHBondContact NE-OD2 3.04Å; R197-D199 IonicContact NH2-OD2 2.98Å; R197-D199 PolarHBondContact NH2-OD2 3.44Å
200	E	91.1	Very high	87.5	Confident	134 Å²	134	85.2 Å²	85.2	63%	0.626	43%	0.43	S	S	*	.	P	Polyproline II helix	trans	-69.8	153.1	173.1	-70.6	-169.9	-175.7	0	0	111.7	A185 R206	A185-E200 WeakPolarHBondContact CB-O 3.29Å; E200-R206 IonicContact OE2-CZ 2.72Å; E200-R206 IonicContact OE2-NH2 3.84Å; E200-R206 PolarHBondContact OE2-NH2 3.3Å
201	V	90.3	Very high	88.1	Confident	11 Å²	11	83.1 Å²	83.1	7%	0.067	42%	0.421	C	S	.	.	P	Polyproline II helix	trans	-60.5	128.1	174.2	-176	0	0	0	0	109.9	V178 Q183 Q203 M205 R206 A209	V178-V201 HydrophobicContact CG1-CB 4.5Å; V178-V201 HydrophobicContact CG1-CG1 4Å; V178-V201 HydrophobicContact CG1-CG2 3.77Å; V178-V201 HydrophobicContact CG2-CG1 4.25Å; Q183-V201 WeakPolarHBondContact O-CG2 3.2Å; V201-Q203 PolarHBondContact O-N 3.08Å; V201-M205 HydrophobicContact CG1-CB 4.37Å; V201-R206 HydrophobicContact CB-CG 4.2Å; V201-R206 HydrophobicContact CG1-CG 4.08Å; V201-R206 PolarHBondContact O-NE 3.36Å; V201-A209 HydrophobicContact CG1-CB 4.24Å
202	P	90.8	Very high	88.9	Confident	28 Å²	28	80.4 Å²	80.4	18%	0.182	40%	0.399	C	S	.	.	P	Polyproline II helix	trans	-52	135.3	177.1	-27.8	34.8	0	0	0	111.7	I168 Y187 S204 M205 R206	I168-P202 HydrophobicContact CD1-CG 4.46Å; Y187-P202 WeakPolarHBondContact OH-CG 3.45Å; P202-S204 PolarHBondContact O-N 3.05Å; P202-S204 VanDerWaalsContact O-N 3.12Å; P202-M205 HydrophobicContact CG-SD 4.49Å; P202-M205 PolarHBondContact O-N 2.83Å; P202-R206 PolarHBondContact O-N 2.94Å
203	Q	89.6	Confident	89.6	Confident	162 Å²	162	75.8 Å²	75.8	76%	0.757	38%	0.383	S	S	*	.	G	3₁₀ helix	trans	-55	-36.4	-175.7	-68.9	-178.7	0.3	0	0	112.9	V201 M205 R206	V201-Q203 PolarHBondContact O-N 3.08Å; Q203-M205 PolarHBondContact O-N 2.92Å; Q203-R206 PolarHBondContact O-N 3.24Å
204	S	89.8	Confident	90.4	Very high	111 Å²	111	80.7 Å²	80.7	78%	0.776	40%	0.404	S	S	*	.	G	3₁₀ helix	trans	-64.9	-20.8	177.9	58.2	0	0	0	0	114.3	P202	P202-S204 PolarHBondContact O-N 3.05Å; P202-S204 VanDerWaalsContact O-N 3.12Å
205	M	90.6	Very high	91	Very high	20 Å²	20	79.4 Å²	79.4	10%	0.099	39%	0.391	C	S	.	.	G	3₁₀ helix	trans	-109.5	-4.1	-176.1	-63.3	-176.7	73.9	0	0	113.1	L166 P167 I168 V178 V201 P202 Q203 T207 E208 A209	L166-M205 HydrophobicContact CB-CE 3.97Å; P167-M205 WeakPolarHBondContact O-CE 3.39Å; I168-M205 HydrophobicContact CG1-SD 4.25Å; V178-M205 HydrophobicContact CG2-CE 4.35Å; V178-M205 HydrophobicContact CG2-SD 4.45Å; V201-M205 HydrophobicContact CG1-CB 4.37Å; P202-M205 HydrophobicContact CG-SD 4.49Å; P202-M205 PolarHBondContact O-N 2.83Å; Q203-M205 PolarHBondContact O-N 2.92Å; M205-T207 VanDerWaalsContact C-N 3.34Å; M205-T207 PolarHBondContact O-N 2.88Å; M205-E208 PolarHBondContact O-N 2.92Å; M205-A209 VanDerWaalsContact O-CB 3.3Å; M205-A209 WeakPolarHBondContact O-CB 3.33Å; M205-A209 PolarHBondContact O-N 3.33Å
206	R	90.6	Very high	91.5	Very high	98 Å²	98	75.5 Å²	75.5	37%	0.37	37%	0.367	S	S	.	.	H	α-helix	trans	-60.4	-42.3	-175.7	-74.4	-177.5	-175.9	-170.4	-5	112.5	E200 V201 P202 Q203 A209 Q210	E200-R206 IonicContact OE2-CZ 2.72Å; E200-R206 IonicContact OE2-NH2 3.84Å; E200-R206 PolarHBondContact OE2-NH2 3.3Å; V201-R206 HydrophobicContact CB-CG 4.2Å; V201-R206 HydrophobicContact CG1-CG 4.08Å; V201-R206 PolarHBondContact O-NE 3.36Å; P202-R206 PolarHBondContact O-N 2.94Å; Q203-R206 PolarHBondContact O-N 3.24Å; R206-A209 PolarHBondContact O-N 3.3Å; R206-Q210 WeakPolarHBondContact O-CG 3.39Å; R206-Q210 PolarHBondContact O-N 3.5Å
207	T	92.6	Very high	91.8	Very high	90 Å²	90	73.5 Å²	73.5	55%	0.552	36%	0.356	S	S	*	.	H	α-helix	trans	-63.4	-50	177.4	-50.1	0	0	0	0	111.1	M205 A209 Q210 E211	M205-T207 VanDerWaalsContact C-N 3.34Å; M205-T207 PolarHBondContact O-N 2.88Å; T207-A209 VanDerWaalsContact C-N 3.35Å; T207-A209 PolarHBondContact O-N 2.84Å; T207-Q210 PolarHBondContact O-N 3.1Å; T207-E211 WeakPolarHBondContact O-CG 3.46Å; T207-E211 PolarHBondContact O-N 2.83Å
208	E	92.1	Very high	91.9	Very high	68 Å²	68	72.5 Å²	72.5	32%	0.318	36%	0.356	S	S	.	.	H	α-helix	trans	-60.1	-43.4	177.7	-171	-171.7	163.8	0	0	111.5	L166 M205 Q210 E211 R212	L166-E208 HydrophobicContact CD1-CG 4.09Å; M205-E208 PolarHBondContact O-N 2.92Å; E208-Q210 VanDerWaalsContact C-N 3.31Å; E208-Q210 PolarHBondContact O-N 3.39Å; E208-E211 PolarHBondContact O-N 3.1Å; E208-R212 HydrophobicContact CG-CG 4.26Å; E208-R212 VanDerWaalsContact O-CB 3.28Å; E208-R212 WeakPolarHBondContact O-CB 3.15Å; E208-R212 WeakPolarHBondContact O-CG 3.45Å; E208-R212 PolarHBondContact O-N 3.37Å
209	A	92.5	Very high	92	Very high	0 Å²	0	67.3 Å²	67.3	0%	0	34%	0.335	C	S	.	.	H	α-helix	trans	-62.3	-36.6	177.3	0	0	0	0	0	112.7	L166 V178 L180 V201 M205 R206 T207 L213	L166-A209 HydrophobicContact CD1-CB 4.08Å; V178-A209 HydrophobicContact CG1-CB 4.49Å; L180-A209 HydrophobicContact CD2-CB 3.98Å; V201-A209 HydrophobicContact CG1-CB 4.24Å; M205-A209 VanDerWaalsContact O-CB 3.3Å; M205-A209 WeakPolarHBondContact O-CB 3.33Å; M205-A209 PolarHBondContact O-N 3.33Å; R206-A209 PolarHBondContact O-N 3.3Å; T207-A209 VanDerWaalsContact C-N 3.35Å; T207-A209 PolarHBondContact O-N 2.84Å; A209-L213 VanDerWaalsContact O-CB 3.27Å; A209-L213 WeakPolarHBondContact O-CB 3.43Å; A209-L213 PolarHBondContact O-N 3.13Å
210	Q	92.6	Very high	92.1	Very high	128 Å²	128	64 Å²	64	60%	0.598	32%	0.318	S	S	*	.	H	α-helix	trans	-71.7	-43.2	176.2	-74.6	177.9	-13.5	0	0	112.1	R206 T207 E208 R212 L213 H214	R206-Q210 WeakPolarHBondContact O-CG 3.39Å; R206-Q210 PolarHBondContact O-N 3.5Å; T207-Q210 PolarHBondContact O-N 3.1Å; E208-Q210 VanDerWaalsContact C-N 3.31Å; E208-Q210 PolarHBondContact O-N 3.39Å; Q210-R212 VanDerWaalsContact C-N 3.34Å; Q210-L213 PolarHBondContact O-N 3.38Å; Q210-H214 PolarHBondContact O-N 2.93Å
211	E	93.2	Very high	92.1	Very high	127 Å²	127	58.2 Å²	58.2	59%	0.593	29%	0.292	S	S	*	.	H	α-helix	trans	-60.7	-44.7	175.4	-72.3	174.8	-178.8	0	0	111.2	T207 E208 H214 E215	T207-E211 WeakPolarHBondContact O-CG 3.46Å; T207-E211 PolarHBondContact O-N 2.83Å; E208-E211 PolarHBondContact O-N 3.1Å; E211-H214 WeakPolarHBondContact O-CB 3.33Å; E211-H214 PolarHBondContact O-N 3.05Å; E211-E215 PolarHBondContact O-N 3.45Å
212	R	92.8	Very high	92.2	Very high	37 Å²	37	63.2 Å²	63.2	14%	0.14	32%	0.318	C	S	.	.	H	α-helix	trans	-70.2	-34.4	179.3	-66.9	-69.8	-160.3	165.3	2.4	113.1	E147 L166 L180 E208 Q210 H214 E215 L216	E147-R212 VanDerWaalsContact CD-NH2 3.26Å; E147-R212 IonicContact OE1-CZ 2.64Å; E147-R212 IonicContact OE1-NH2 3.64Å; E147-R212 PolarHBondContact OE1-NH2 2.82Å; L166-R212 HydrophobicContact CD1-CB 4.27Å; L166-R212 HydrophobicContact CD1-CG 4.13Å; L166-R212 HydrophobicContact CD2-CB 4.4Å; L166-R212 HydrophobicContact CD2-CG 3.96Å; L180-R212 HydrophobicContact CD1-CB 3.91Å; L180-R212 HydrophobicContact CD2-CB 4.3Å; E208-R212 HydrophobicContact CG-CG 4.26Å; E208-R212 VanDerWaalsContact O-CB 3.28Å; E208-R212 WeakPolarHBondContact O-CB 3.15Å; E208-R212 WeakPolarHBondContact O-CG 3.45Å; E208-R212 PolarHBondContact O-N 3.37Å; Q210-R212 VanDerWaalsContact C-N 3.34Å; R212-H214 VanDerWaalsContact C-N 3.35Å; R212-E215 WeakPolarHBondContact CD-OE2 3.36Å; R212-E215 IonicContact CZ-OE2 3.45Å; R212-E215 IonicContact NH1-OE2 2.81Å; R212-E215 PolarHBondContact NH1-OE2 3.22Å; R212-L216 WeakPolarHBondContact O-CB 3.27Å; R212-L216 PolarHBondContact O-N 3.37Å
213	L	93	Very high	92.2	Very high	36 Å²	36	63 Å²	63	19%	0.188	32%	0.316	C	S	.	.	H	α-helix	trans	-65.1	-41.1	170.4	175.6	60.7	0	0	0	110.9	L180 Q183 A209 Q210 L216 I217 L242	L180-L213 WeakPolarHBondContact O-CD1 3.29Å; Q183-L213 HydrophobicContact CG-CD2 4.45Å; A209-L213 VanDerWaalsContact O-CB 3.27Å; A209-L213 WeakPolarHBondContact O-CB 3.43Å; A209-L213 PolarHBondContact O-N 3.13Å; Q210-L213 PolarHBondContact O-N 3.38Å; L213-L216 HydrophobicContact CD1-CD2 4.4Å; L213-L216 WeakPolarHBondContact O-CB 3.37Å; L213-L216 PolarHBondContact O-N 3Å; L213-I217 HydrophobicContact CD1-CD1 4.04Å; L213-I217 HydrophobicContact CD1-CG1 4.19Å; L213-I217 HydrophobicContact CG-CD1 3.97Å; L213-I217 VanDerWaalsContact O-CG1 3.3Å; L213-I217 WeakPolarHBondContact O-CG1 3.14Å; L213-I217 PolarHBondContact O-N 3.44Å; L213-L242 HydrophobicContact CD1-CD2 3.95Å
214	H	92.9	Very high	92.3	Very high	108 Å²	108	55.9 Å²	55.9	50%	0.5	28%	0.283	S	S	.	.	H	α-helix	trans	-63.1	-46	176.1	-171.3	64.6	0	0	0	111.5	Q210 E211 R212 L216 I217 E218	Q210-H214 PolarHBondContact O-N 2.93Å; E211-H214 WeakPolarHBondContact O-CB 3.33Å; E211-H214 PolarHBondContact O-N 3.05Å; R212-H214 VanDerWaalsContact C-N 3.35Å; H214-L216 VanDerWaalsContact C-N 3.32Å; H214-L216 PolarHBondContact O-N 3.13Å; H214-I217 PolarHBondContact O-N 2.84Å; H214-E218 PolarHBondContact O-N 3.32Å
215	E	92.7	Very high	92.3	Very high	46 Å²	46	57 Å²	57	22%	0.215	28%	0.281	C	S	.	.	H	α-helix	trans	-56.1	-44.6	172.8	-173.8	-168.5	177.2	0	0	111.4	R154 E211 R212 E218 L219	R154-E215 IonicContact CZ-OE1 3.76Å; R154-E215 VanDerWaalsContact CZ-OE1 3.23Å; R154-E215 IonicContact NH1-OE1 2.8Å; R154-E215 PolarHBondContact NH1-OE1 2.95Å; R154-E215 IonicContact NH2-OE1 2.73Å; R154-E215 PolarHBondContact NH2-OE1 2.83Å; E211-E215 PolarHBondContact O-N 3.45Å; R212-E215 WeakPolarHBondContact CD-OE2 3.36Å; R212-E215 IonicContact CZ-OE2 3.45Å; R212-E215 IonicContact NH1-OE2 2.81Å; R212-E215 PolarHBondContact NH1-OE2 3.22Å; E215-E218 PolarHBondContact O-N 3.22Å; E215-L219 HydrophobicContact CG-CD1 3.92Å; E215-L219 HydrophobicContact CG-CG 4.49Å; E215-L219 WeakPolarHBondContact O-CB 3.42Å; E215-L219 VanDerWaalsContact O-CG 3.25Å; E215-L219 WeakPolarHBondContact O-CG 3.26Å; E215-L219 PolarHBondContact O-N 2.97Å
216	L	93.8	Very high	92.3	Very high	1 Å²	1	60.7 Å²	60.7	1%	0.005	30%	0.297	C	S	.	.	H	α-helix	trans	-61.1	-46.2	177.4	174.4	64.1	0	0	0	111.8	A162 L164 I181 R212 L213 H214 L219 V220 L242 F255	A162-L216 HydrophobicContact CB-CD1 3.77Å; L164-L216 HydrophobicContact CD2-CD1 3.83Å; L164-L216 HydrophobicContact CD2-CD2 3.95Å; I181-L216 HydrophobicContact CG1-CD2 4.37Å; R212-L216 WeakPolarHBondContact O-CB 3.27Å; R212-L216 PolarHBondContact O-N 3.37Å; L213-L216 HydrophobicContact CD1-CD2 4.4Å; L213-L216 WeakPolarHBondContact O-CB 3.37Å; L213-L216 PolarHBondContact O-N 3Å; H214-L216 VanDerWaalsContact C-N 3.32Å; H214-L216 PolarHBondContact O-N 3.13Å; L216-L219 PolarHBondContact O-N 3.4Å; L216-V220 HydrophobicContact CD1-CG2 3.99Å; L216-V220 VanDerWaalsContact O-CG2 3.25Å; L216-V220 WeakPolarHBondContact O-CG2 3.48Å; L216-V220 PolarHBondContact O-N 3.39Å; L216-L242 HydrophobicContact CD2-CD2 4.4Å; L216-F255 HydrophobicContact CD1-CE1 4.43Å; L216-F255 HydrophobicContact CD1-CE2 4.46Å; L216-F255 HydrophobicContact CD1-CZ 3.67Å
217	I	93.3	Very high	92.3	Very high	23 Å²	23	56 Å²	56	12%	0.118	28%	0.28	C	S	.	.	H	α-helix	trans	-62.4	-46.9	179.5	-68	165.8	0	0	0	110	L213 H214 L219 V220 S221 F231 P237 L242	L213-I217 HydrophobicContact CD1-CD1 4.04Å; L213-I217 HydrophobicContact CD1-CG1 4.19Å; L213-I217 HydrophobicContact CG-CD1 3.97Å; L213-I217 VanDerWaalsContact O-CG1 3.3Å; L213-I217 WeakPolarHBondContact O-CG1 3.14Å; L213-I217 PolarHBondContact O-N 3.44Å; H214-I217 PolarHBondContact O-N 2.84Å; I217-L219 PolarHBondContact O-N 2.92Å; I217-V220 PolarHBondContact O-N 3.37Å; I217-S221 WeakPolarHBondContact O-CB 3.47Å; I217-S221 PolarHBondContact O-N 3.27Å; I217-S221 PolarHBondContact O-OG 2.91Å; I217-S221 VanDerWaalsContact O-OG 3.04Å; I217-F231 HydrophobicContact CG2-CD2 3.77Å; I217-F231 HydrophobicContact CG2-CE2 4.24Å; I217-P237 HydrophobicContact CD1-CG 3.98Å; I217-P237 HydrophobicContact CG1-CG 4.21Å; I217-P237 HydrophobicContact CG2-CG 4.28Å; I217-L242 HydrophobicContact CG1-CD1 4.26Å; I217-L242 HydrophobicContact CG1-CD2 4.34Å
218	E	92.7	Very high	92.3	Very high	87 Å²	87	52.4 Å²	52.4	41%	0.407	26%	0.26	S	S	.	.	H	α-helix	trans	-59.3	-45.6	178.7	-174.9	-173.2	171.3	0	0	112.2	H214 E215 V220 S221 N222 F231	H214-E218 PolarHBondContact O-N 3.32Å; E215-E218 PolarHBondContact O-N 3.22Å; E218-V220 PolarHBondContact O-N 3.18Å; E218-S221 VanDerWaalsContact C-OG 3.31Å; E218-S221 VanDerWaalsContact CA-OG 3.28Å; E218-S221 WeakPolarHBondContact CA-OG 3.15Å; E218-S221 PolarHBondContact O-N 2.88Å; E218-S221 PolarHBondContact O-OG 2.98Å; E218-N222 VanDerWaalsContact O-CG 3.24Å; E218-N222 PolarHBondContact O-N 2.86Å; E218-N222 VanDerWaalsContact O-N 3.16Å; E218-N222 PolarHBondContact O-ND2 3.39Å; E218-F231 HydrophobicContact CB-CZ 4.34Å; E218-F231 HydrophobicContact CG-CZ 4.35Å
219	L	93.1	Very high	92.2	Very high	30 Å²	30	54 Å²	54	16%	0.157	27%	0.27	C	S	.	.	H	α-helix	trans	-69.4	-34.2	-178.6	-70.5	173.7	0	0	0	112.8	N160 A162 E215 L216 I217	N160-L219 PolarHBondContact ND2-O 3.12Å; A162-L219 HydrophobicContact CB-CD1 3.84Å; E215-L219 HydrophobicContact CG-CD1 3.92Å; E215-L219 HydrophobicContact CG-CG 4.49Å; E215-L219 WeakPolarHBondContact O-CB 3.42Å; E215-L219 VanDerWaalsContact O-CG 3.25Å; E215-L219 WeakPolarHBondContact O-CG 3.26Å; E215-L219 PolarHBondContact O-N 2.97Å; L216-L219 PolarHBondContact O-N 3.4Å; I217-L219 PolarHBondContact O-N 2.92Å
220	V	93.3	Very high	92.2	Very high	0 Å²	0	55.2 Å²	55.2	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-76.6	-36.9	175.9	179.5	0	0	0	0	110.6	L216 I217 E218 N222 V223 D224 L227 A245 I246 F255	L216-V220 HydrophobicContact CD1-CG2 3.99Å; L216-V220 VanDerWaalsContact O-CG2 3.25Å; L216-V220 WeakPolarHBondContact O-CG2 3.48Å; L216-V220 PolarHBondContact O-N 3.39Å; I217-V220 PolarHBondContact O-N 3.37Å; E218-V220 PolarHBondContact O-N 3.18Å; V220-N222 PolarHBondContact O-N 2.96Å; V220-V223 PolarHBondContact O-N 2.7Å; V220-D224 HydrophobicContact CG1-CB 4.34Å; V220-D224 PolarHBondContact O-N 3.09Å; V220-L227 HydrophobicContact CB-CD2 3.71Å; V220-L227 HydrophobicContact CG1-CD2 3.47Å; V220-L227 VanDerWaalsContact CG1-CD2 3.47Å; V220-A245 HydrophobicContact CG1-CB 3.92Å; V220-I246 HydrophobicContact CG1-CG1 4.43Å; V220-I246 HydrophobicContact CG2-CG1 4.06Å; V220-F255 HydrophobicContact CG2-CD1 4.35Å; V220-F255 HydrophobicContact CG2-CD2 4.16Å; V220-F255 HydrophobicContact CG2-CE1 4.04Å; V220-F255 HydrophobicContact CG2-CE2 3.84Å; V220-F255 HydrophobicContact CG2-CG 4.4Å; V220-F255 HydrophobicContact CG2-CZ 3.77Å
221	S	92.9	Very high	92	Very high	12 Å²	12	52.6 Å²	52.6	8%	0.084	26%	0.264	C	S	.	.	H	α-helix	trans	-64.6	-27.5	177.1	58.8	0	0	0	0	113	I217 E218 V223	I217-S221 WeakPolarHBondContact O-CB 3.47Å; I217-S221 PolarHBondContact O-N 3.27Å; I217-S221 PolarHBondContact O-OG 2.91Å; I217-S221 VanDerWaalsContact O-OG 3.04Å; E218-S221 VanDerWaalsContact C-OG 3.31Å; E218-S221 VanDerWaalsContact CA-OG 3.28Å; E218-S221 WeakPolarHBondContact CA-OG 3.15Å; E218-S221 PolarHBondContact O-N 2.88Å; E218-S221 PolarHBondContact O-OG 2.98Å; S221-V223 PolarHBondContact O-N 3.07Å
222	N	91.2	Very high	91.9	Very high	115 Å²	115	53.3 Å²	53.3	62%	0.615	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.9	-12.7	172.6	-72	-25.4	0	0	0	113.9	E218 V220	E218-N222 VanDerWaalsContact O-CG 3.24Å; E218-N222 PolarHBondContact O-N 2.86Å; E218-N222 VanDerWaalsContact O-N 3.16Å; E218-N222 PolarHBondContact O-ND2 3.39Å; V220-N222 PolarHBondContact O-N 2.96Å
223	V	90.3	Very high	91.8	Very high	23 Å²	23	57 Å²	57	14%	0.139	29%	0.29	C	S	.	.	T	Hydrogen-bonded Turn	trans	-122.6	-33.8	-170.8	169.5	0	0	0	0	112.8	N160 V220 S221 A249 K254	N160-V223 WeakPolarHBondContact ND2-CG2 3.49Å; V220-V223 PolarHBondContact O-N 2.7Å; S221-V223 PolarHBondContact O-N 3.07Å; V223-A249 HydrophobicContact CG1-CB 3.83Å; V223-K254 HydrophobicContact CB-CB 4.4Å; V223-K254 HydrophobicContact CG1-CB 3.2Å; V223-K254 HydrophobicContact CG1-CD 3.72Å; V223-K254 HydrophobicContact CG1-CG 4.13Å; V223-K254 HydrophobicContact CG2-CB 4.3Å
224	D	92	Very high	91.5	Very high	13 Å²	13	63.8 Å²	63.8	7%	0.07	32%	0.321	C	S	.	.			trans	-105.2	115.3	-179.6	-175.7	76.3	0	0	0	110.8	V220 H226 L227 G228 A245 R248	V220-D224 HydrophobicContact CG1-CB 4.34Å; V220-D224 PolarHBondContact O-N 3.09Å; D224-H226 VanDerWaalsContact C-N 3.35Å; D224-H226 PolarHBondContact O-N 3.44Å; D224-L227 HydrophobicContact CB-CB 4.2Å; D224-L227 PolarHBondContact O-N 3.32Å; D224-L227 WeakPolarHBondContact OD2-CB 3.36Å; D224-L227 PolarHBondContact OD2-N 2.83Å; D224-G228 PolarHBondContact O-N 2.8Å; D224-A245 HydrophobicContact CB-CB 4.27Å; D224-A245 WeakPolarHBondContact OD2-CB 3.28Å; D224-R248 IonicContact OD1-CZ 3.97Å; D224-R248 IonicContact OD1-NE 3.72Å; D224-R248 PolarHBondContact OD1-NE 2.95Å; D224-R248 IonicContact OD1-NH2 2.71Å; D224-R248 PolarHBondContact OD1-NH2 3.26Å; D224-R248 IonicContact OD2-CZ 2.79Å; D224-R248 IonicContact OD2-NE 2.77Å; D224-R248 IonicContact OD2-NH2 3.28Å; D224-R248 PolarHBondContact OD2-NH2 3.4Å
225	D	90.9	Very high	91.3	Very high	136 Å²	136	64.2 Å²	64.2	73%	0.727	32%	0.321	S	S	*	.	H	α-helix	trans	-58.7	-43.2	-174.3	-57.1	-32.9	0	0	0	112.4	L227 G228 D229	D225-L227 PolarHBondContact O-N 3.38Å; D225-G228 WeakPolarHBondContact O-CA 3.31Å; D225-G228 PolarHBondContact O-N 3.26Å; D225-D229 PolarHBondContact O-N 2.91Å
226	H	90.5	Very high	90.9	Very high	96 Å²	96	71.7 Å²	71.7	44%	0.444	35%	0.353	S	S	.	.	H	α-helix	trans	-65.8	-40.8	-179	178.5	-77	0	0	0	112.6	D224 G228 L230	D224-H226 VanDerWaalsContact C-N 3.35Å; D224-H226 PolarHBondContact O-N 3.44Å; H226-G228 VanDerWaalsContact C-N 3.33Å; H226-L230 PolarHBondContact O-N 3.22Å
227	L	90.9	Very high	90.7	Very high	1 Å²	1	72.9 Å²	72.9	1%	0.005	36%	0.36	C	S	.	.	H	α-helix	trans	-71.9	-32.3	174.2	-162	72.8	0	0	0	111.4	V220 D224 D225 L230 F231 P237 L242 A245	V220-L227 HydrophobicContact CB-CD2 3.71Å; V220-L227 HydrophobicContact CG1-CD2 3.47Å; V220-L227 VanDerWaalsContact CG1-CD2 3.47Å; D224-L227 HydrophobicContact CB-CB 4.2Å; D224-L227 PolarHBondContact O-N 3.32Å; D224-L227 WeakPolarHBondContact OD2-CB 3.36Å; D224-L227 PolarHBondContact OD2-N 2.83Å; D225-L227 PolarHBondContact O-N 3.38Å; L227-L230 HydrophobicContact CD1-CD1 4.48Å; L227-L230 PolarHBondContact O-N 3.24Å; L227-F231 WeakPolarHBondContact O-CB 3.43Å; L227-F231 PolarHBondContact O-N 2.89Å; L227-P237 HydrophobicContact CD1-CB 3.62Å; L227-P237 HydrophobicContact CD1-CG 3.96Å; L227-L242 HydrophobicContact CD2-CD1 3.89Å; L227-A245 HydrophobicContact CB-CB 3.94Å; L227-A245 HydrophobicContact CD1-CB 4.29Å; L227-A245 HydrophobicContact CD2-CB 3.93Å; L227-A245 HydrophobicContact CG-CB 4.29Å
228	G	90.8	Very high	90.6	Very high	13 Å²	13	74.4 Å²	74.4	13%	0.134	37%	0.373	C	S	.	.	H	α-helix	trans	-53.5	-51.4	170.1	0	0	0	0	0	112.6	D224 D225 H226 L230 F231 L232	D224-G228 PolarHBondContact O-N 2.8Å; D225-G228 WeakPolarHBondContact O-CA 3.31Å; D225-G228 PolarHBondContact O-N 3.26Å; H226-G228 VanDerWaalsContact C-N 3.33Å; G228-L230 PolarHBondContact O-N 3.13Å; G228-F231 PolarHBondContact O-N 2.84Å; G228-L232 WeakPolarHBondContact O-CG 3.33Å; G228-L232 PolarHBondContact O-N 2.74Å
229	D	91.8	Very high	90.6	Very high	101 Å²	101	72.7 Å²	72.7	54%	0.54	37%	0.371	S	S	.	.	H	α-helix	trans	-60.5	-46.6	178.6	-68.5	-24.6	0	0	0	111.9	D225 F231 L232 E233	D225-D229 PolarHBondContact O-N 2.91Å; D229-F231 VanDerWaalsContact C-N 3.3Å; D229-F231 PolarHBondContact O-N 2.86Å; D229-L232 PolarHBondContact O-N 2.73Å; D229-E233 WeakPolarHBondContact O-CG 3.47Å; D229-E233 PolarHBondContact O-N 2.9Å
230	L	90.9	Very high	90.5	Very high	27 Å²	27	78 Å²	78	14%	0.141	40%	0.398	C	S	.	.	H	α-helix	trans	-60.9	-39.1	177.3	-73.3	173.2	0	0	0	112.5	H226 L227 G228 E233 E234 K235	H226-L230 PolarHBondContact O-N 3.22Å; L227-L230 HydrophobicContact CD1-CD1 4.48Å; L227-L230 PolarHBondContact O-N 3.24Å; G228-L230 PolarHBondContact O-N 3.13Å; L230-E233 PolarHBondContact O-N 2.96Å; L230-E234 PolarHBondContact O-N 2.98Å; L230-K235 HydrophobicContact CD2-CB 4.21Å; L230-K235 HydrophobicContact CD2-CD 4.15Å; L230-K235 PolarHBondContact O-N 2.97Å
231	F	89.7	Confident	90.5	Very high	72 Å²	72	81.1 Å²	81.1	32%	0.316	41%	0.413	S	S	.	.	H	α-helix	trans	-67.7	-42.1	178.7	-174	-100	0	0	0	111.8	I217 E218 L227 G228 D229 E233 E234	I217-F231 HydrophobicContact CG2-CD2 3.77Å; I217-F231 HydrophobicContact CG2-CE2 4.24Å; E218-F231 HydrophobicContact CB-CZ 4.34Å; E218-F231 HydrophobicContact CG-CZ 4.35Å; L227-F231 WeakPolarHBondContact O-CB 3.43Å; L227-F231 PolarHBondContact O-N 2.89Å; G228-F231 PolarHBondContact O-N 2.84Å; D229-F231 VanDerWaalsContact C-N 3.3Å; D229-F231 PolarHBondContact O-N 2.86Å; F231-E233 VanDerWaalsContact C-N 3.29Å; F231-E233 PolarHBondContact O-N 3.05Å; F231-E234 PolarHBondContact O-N 3.38Å; F231-E234 VanDerWaalsContact O-N 3.08Å
232	L	90.7	Very high	90.5	Very high	142 Å²	142	80.8 Å²	80.8	74%	0.743	41%	0.41	S	S	*	.	H	α-helix	trans	-64.3	-32.6	175.4	-71.3	172.3	0	0	0	112.8	G228 D229 E234	G228-L232 WeakPolarHBondContact O-CG 3.33Å; G228-L232 PolarHBondContact O-N 2.74Å; D229-L232 PolarHBondContact O-N 2.73Å; L232-E234 PolarHBondContact O-N 3.17Å
233	E	91	Very high	90.6	Very high	114 Å²	114	77.8 Å²	77.8	53%	0.533	39%	0.392	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.7	4.5	174.1	-68.8	-175.8	168.9	0	0	113.9	D229 L230 F231 K235	D229-E233 WeakPolarHBondContact O-CG 3.47Å; D229-E233 PolarHBondContact O-N 2.9Å; L230-E233 PolarHBondContact O-N 2.96Å; F231-E233 VanDerWaalsContact C-N 3.29Å; F231-E233 PolarHBondContact O-N 3.05Å; E233-K235 HydrophobicContact CB-CD 4.25Å; E233-K235 HydrophobicContact CB-CG 4.16Å; E233-K235 PolarHBondContact O-N 3.48Å; E233-K235 VanDerWaalsContact O-N 3.16Å; E233-K235 WeakPolarHBondContact OE2-CD 3.49Å; E233-K235 WeakPolarHBondContact OE2-CE 3.4Å; E233-K235 IonicContact OE2-NZ 3.97Å; E233-K235 PolarHBondContact OE2-NZ 3.41Å
234	E	86.3	Confident	90.8	Very high	180 Å²	180	78.3 Å²	78.3	84%	0.841	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.4	24.5	-174.7	-57.8	-175.5	168	0	0	113.7	L230 F231 L232	L230-E234 PolarHBondContact O-N 2.98Å; F231-E234 PolarHBondContact O-N 3.38Å; F231-E234 VanDerWaalsContact O-N 3.08Å; L232-E234 PolarHBondContact O-N 3.17Å
235	K	88.2	Confident	90.9	Very high	116 Å²	116	77.7 Å²	77.7	50%	0.504	40%	0.395	S	S	.	.	P	Polyproline II helix	trans	-88.7	128	177.8	-71.2	179	-176.1	161.2	0	110.5	L230 E233 P237	L230-K235 HydrophobicContact CD2-CB 4.21Å; L230-K235 HydrophobicContact CD2-CD 4.15Å; L230-K235 PolarHBondContact O-N 2.97Å; E233-K235 HydrophobicContact CB-CD 4.25Å; E233-K235 HydrophobicContact CB-CG 4.16Å; E233-K235 PolarHBondContact O-N 3.48Å; E233-K235 VanDerWaalsContact O-N 3.16Å; E233-K235 WeakPolarHBondContact OE2-CD 3.49Å; E233-K235 WeakPolarHBondContact OE2-CE 3.4Å; E233-K235 IonicContact OE2-NZ 3.97Å; E233-K235 PolarHBondContact OE2-NZ 3.41Å; K235-P237 WeakPolarHBondContact O-CD 3.5Å
236	K	85.7	Confident	91.1	Very high	204 Å²	204	71.2 Å²	71.2	89%	0.887	36%	0.361	S	S	*	.	P	Polyproline II helix	trans	-71.2	120.1	173.7	-67.9	-174.2	-180	-177.3	0	109.8
237	P	89.2	Confident	91.3	Very high	25 Å²	25	68.7 Å²	68.7	16%	0.162	35%	0.347	C	S	.	.	P	Polyproline II helix	trans	-67.9	145.7	178.4	29.2	-35.2	0	0	0	110.7	I217 L227 K235 E241	I217-P237 HydrophobicContact CD1-CG 3.98Å; I217-P237 HydrophobicContact CG1-CG 4.21Å; I217-P237 HydrophobicContact CG2-CG 4.28Å; L227-P237 HydrophobicContact CD1-CB 3.62Å; L227-P237 HydrophobicContact CD1-CG 3.96Å; K235-P237 WeakPolarHBondContact O-CD 3.5Å; P237-E241 HydrophobicContact CB-CB 4.43Å
238	S	91.6	Very high	91.5	Very high	55 Å²	55	73 Å²	73	39%	0.385	36%	0.364	S	S	.	.	P	Polyproline II helix	trans	-69.5	156.7	168.7	65.2	0	0	0	0	111.2	L240 E241 L242	S238-L240 PolarHBondContact O-N 2.91Å; S238-L240 VanDerWaalsContact O-N 3.15Å; S238-E241 WeakPolarHBondContact CB-OE2 3.19Å; S238-E241 PolarHBondContact N-OE2 3.05Å; S238-E241 PolarHBondContact O-N 2.94Å; S238-E241 VanDerWaalsContact O-N 3.12Å; S238-E241 WeakPolarHBondContact OG-CB 3.25Å; S238-E241 VanDerWaalsContact OG-CG 3.22Å; S238-E241 WeakPolarHBondContact OG-CG 3.5Å; S238-E241 PolarHBondContact OG-N 3.01Å; S238-E241 PolarHBondContact OG-OE2 2.79Å; S238-L242 PolarHBondContact O-N 2.92Å
239	S	90.9	Very high	91.6	Very high	52 Å²	52	72.5 Å²	72.5	36%	0.364	36%	0.358	S	S	.	.	H	α-helix	trans	-56.6	-32.3	176.6	-54.5	0	0	0	0	112.4	I181 K243	I181-S239 PolarHBondContact O-OG 3.35Å; S239-K243 WeakPolarHBondContact O-CB 3.34Å; S239-K243 VanDerWaalsContact O-CG 3.26Å; S239-K243 WeakPolarHBondContact O-CG 3.27Å; S239-K243 PolarHBondContact O-N 3.4Å
240	L	92.4	Very high	91.7	Very high	140 Å²	140	67.7 Å²	67.7	73%	0.733	33%	0.332	S	S	*	.	H	α-helix	trans	-72.4	-42.3	177.5	-173.1	136.8	0	0	0	112.3	S238 K243 A244	S238-L240 PolarHBondContact O-N 2.91Å; S238-L240 VanDerWaalsContact O-N 3.15Å; L240-K243 PolarHBondContact O-N 2.92Å; L240-A244 WeakPolarHBondContact O-CB 3.43Å; L240-A244 PolarHBondContact O-N 2.92Å
241	E	92.2	Very high	91.8	Very high	66 Å²	66	69 Å²	69	31%	0.308	34%	0.339	S	S	.	.	H	α-helix	trans	-64	-41.8	174.7	-73	161.9	150	0	0	111.3	P237 S238 A244 A245	P237-E241 HydrophobicContact CB-CB 4.43Å; S238-E241 WeakPolarHBondContact CB-OE2 3.19Å; S238-E241 PolarHBondContact N-OE2 3.05Å; S238-E241 PolarHBondContact O-N 2.94Å; S238-E241 VanDerWaalsContact O-N 3.12Å; S238-E241 WeakPolarHBondContact OG-CB 3.25Å; S238-E241 VanDerWaalsContact OG-CG 3.22Å; S238-E241 WeakPolarHBondContact OG-CG 3.5Å; S238-E241 PolarHBondContact OG-N 3.01Å; S238-E241 PolarHBondContact OG-OE2 2.79Å; E241-A244 PolarHBondContact O-N 3.26Å; E241-A245 WeakPolarHBondContact O-CB 3.3Å; E241-A245 PolarHBondContact O-N 2.77Å
242	L	93.4	Very high	91.9	Very high	5 Å²	5	69.4 Å²	69.4	3%	0.026	35%	0.347	C	S	.	.	H	α-helix	trans	-64.2	-44.5	176.8	-175.7	59.3	0	0	0	111.4	I181 L213 L216 I217 L227 S238 A244 A245 I246	I181-L242 HydrophobicContact CG1-CD2 4.24Å; I181-L242 HydrophobicContact CG2-CD2 4.33Å; L213-L242 HydrophobicContact CD1-CD2 3.95Å; L216-L242 HydrophobicContact CD2-CD2 4.4Å; I217-L242 HydrophobicContact CG1-CD1 4.26Å; I217-L242 HydrophobicContact CG1-CD2 4.34Å; L227-L242 HydrophobicContact CD2-CD1 3.89Å; S238-L242 PolarHBondContact O-N 2.92Å; L242-A244 VanDerWaalsContact C-N 3.32Å; L242-A244 PolarHBondContact O-N 3.43Å; L242-A245 PolarHBondContact O-N 2.89Å; L242-I246 HydrophobicContact CD1-CD1 4.25Å; L242-I246 HydrophobicContact CD1-CG1 4.4Å; L242-I246 HydrophobicContact CG-CD1 4.01Å; L242-I246 VanDerWaalsContact O-CG1 3.29Å; L242-I246 WeakPolarHBondContact O-CG1 3.37Å; L242-I246 PolarHBondContact O-N 2.97Å
243	K	94	Very high	91.9	Very high	53 Å²	53	64.9 Å²	64.9	23%	0.23	32%	0.321	C	S	.	.	H	α-helix	trans	-60.3	-42.1	174.5	-74.6	-178.7	-176.1	178.9	0	111.7	I181 D182 S239 L240 R247 Y279	I181-K243 HydrophobicContact CD1-CG 4.36Å; I181-K243 HydrophobicContact CG2-CD 4.32Å; I181-K243 HydrophobicContact CG2-CG 3.86Å; D182-K243 IonicContact OD1-NZ 2.68Å; D182-K243 PolarHBondContact OD1-NZ 3.23Å; D182-K243 IonicContact OD2-NZ 3.86Å; D182-K243 PolarHBondContact OD2-NZ 3.24Å; S239-K243 WeakPolarHBondContact O-CB 3.34Å; S239-K243 VanDerWaalsContact O-CG 3.26Å; S239-K243 WeakPolarHBondContact O-CG 3.27Å; S239-K243 PolarHBondContact O-N 3.4Å; L240-K243 PolarHBondContact O-N 2.92Å; K243-R247 WeakPolarHBondContact O-CB 3.45Å; K243-R247 PolarHBondContact O-N 2.97Å; K243-Y279 HydrophobicContact CB-CE1 4.25Å; K243-Y279 HydrophobicContact CG-CE1 4.35Å
244	A	93.6	Very high	91.9	Very high	33 Å²	33	65.4 Å²	65.4	27%	0.273	32%	0.321	S	S	.	.	H	α-helix	trans	-65.4	-40.3	177.3	0	0	0	0	0	112.4	L240 E241 L242 R247 R248	L240-A244 WeakPolarHBondContact O-CB 3.43Å; L240-A244 PolarHBondContact O-N 2.92Å; E241-A244 PolarHBondContact O-N 3.26Å; L242-A244 VanDerWaalsContact C-N 3.32Å; L242-A244 PolarHBondContact O-N 3.43Å; A244-R247 PolarHBondContact O-N 3.37Å; A244-R248 WeakPolarHBondContact O-CG 3.44Å; A244-R248 PolarHBondContact O-N 3.08Å
245	A	94.4	Very high	92.3	Very high	0 Å²	0	57.1 Å²	57.1	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-65.2	-46.7	175.9	0	0	0	0	0	111.9	V220 D224 L227 E241 L242 R247 R248 A249	V220-A245 HydrophobicContact CG1-CB 3.92Å; D224-A245 HydrophobicContact CB-CB 4.27Å; D224-A245 WeakPolarHBondContact OD2-CB 3.28Å; L227-A245 HydrophobicContact CB-CB 3.94Å; L227-A245 HydrophobicContact CD1-CB 4.29Å; L227-A245 HydrophobicContact CD2-CB 3.93Å; L227-A245 HydrophobicContact CG-CB 4.29Å; E241-A245 WeakPolarHBondContact O-CB 3.3Å; E241-A245 PolarHBondContact O-N 2.77Å; L242-A245 PolarHBondContact O-N 2.89Å; A245-R247 VanDerWaalsContact C-N 3.29Å; A245-R247 PolarHBondContact O-N 3.15Å; A245-R248 PolarHBondContact O-N 3.01Å; A245-A249 WeakPolarHBondContact O-CB 3.33Å; A245-A249 PolarHBondContact O-N 2.97Å
246	I	95.2	Very high	92.5	Very high	0 Å²	0	51.7 Å²	51.7	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-57.5	-45.1	174.5	-67.3	164.9	0	0	0	110	L164 I181 V220 L242 R248 A249 V250 F255 P257 Y279	L164-I246 HydrophobicContact CD2-CD1 3.93Å; I181-I246 HydrophobicContact CD1-CD1 3.71Å; I181-I246 HydrophobicContact CG1-CD1 4.45Å; V220-I246 HydrophobicContact CG1-CG1 4.43Å; V220-I246 HydrophobicContact CG2-CG1 4.06Å; L242-I246 HydrophobicContact CD1-CD1 4.25Å; L242-I246 HydrophobicContact CD1-CG1 4.4Å; L242-I246 HydrophobicContact CG-CD1 4.01Å; L242-I246 VanDerWaalsContact O-CG1 3.29Å; L242-I246 WeakPolarHBondContact O-CG1 3.37Å; L242-I246 PolarHBondContact O-N 2.97Å; I246-R248 PolarHBondContact O-N 3.06Å; I246-A249 PolarHBondContact O-N 3.3Å; I246-V250 HydrophobicContact CG2-CG2 4.13Å; I246-V250 WeakPolarHBondContact O-CB 3.37Å; I246-V250 WeakPolarHBondContact O-CG2 3.49Å; I246-V250 PolarHBondContact O-N 2.77Å; I246-F255 HydrophobicContact CG1-CE1 4.49Å; I246-F255 HydrophobicContact CG2-CD1 4.32Å; I246-F255 HydrophobicContact CG2-CE1 4.16Å; I246-P257 HydrophobicContact CG2-CB 4.46Å; I246-Y279 HydrophobicContact CB-CD1 4.08Å; I246-Y279 HydrophobicContact CB-CE1 3.8Å; I246-Y279 HydrophobicContact CG2-CD1 3.58Å; I246-Y279 HydrophobicContact CG2-CE1 3.57Å; I246-Y279 HydrophobicContact CG2-CG 4.12Å
247	R	94.9	Very high	93	Very high	44 Å²	44	42 Å²	42	17%	0.166	22%	0.217	C	C	.	.	H	α-helix	trans	-56.7	-52.1	176.2	-176.1	-179.1	-179.8	73.2	4.4	111.3	K243 A244 A245 A249 V250 L251 D278 Y279 L280 E285	K243-R247 WeakPolarHBondContact O-CB 3.45Å; K243-R247 PolarHBondContact O-N 2.97Å; A244-R247 PolarHBondContact O-N 3.37Å; A245-R247 VanDerWaalsContact C-N 3.29Å; A245-R247 PolarHBondContact O-N 3.15Å; R247-A249 VanDerWaalsContact C-N 3.3Å; R247-A249 PolarHBondContact O-N 3.22Å; R247-V250 PolarHBondContact O-N 2.95Å; R247-L251 HydrophobicContact CG-CD1 4.2Å; R247-L251 HydrophobicContact CG-CG 4.37Å; R247-L251 VanDerWaalsContact O-CG 3.28Å; R247-L251 WeakPolarHBondContact O-CG 3.29Å; R247-L251 PolarHBondContact O-N 3.24Å; R247-D278 WeakPolarHBondContact CD-O 2.94Å; R247-D278 PolarHBondContact NH1-O 3.28Å; R247-Y279 HydrophobicContact CB-CD1 4.24Å; R247-L280 PolarHBondContact NH1-O 3.17Å; R247-L280 PolarHBondContact NH2-O 3.1Å; R247-E285 IonicContact CZ-OE1 3.85Å; R247-E285 IonicContact CZ-OE2 2.88Å; R247-E285 IonicContact NE-OE1 3.82Å; R247-E285 IonicContact NH2-OE1 2.83Å; R247-E285 PolarHBondContact NH2-OE1 3.29Å; R247-E285 IonicContact NH2-OE2 2.78Å; R247-E285 PolarHBondContact NH2-OE2 3.13Å
248	R	94.2	Very high	93.3	Very high	92 Å²	92	40.8 Å²	40.8	35%	0.347	21%	0.209	S	C	.	.	H	α-helix	trans	-58.4	-41.3	178.5	-71	-174.1	-60.8	-97	3.4	112.4	D224 A244 A245 I246 T252	D224-R248 IonicContact OD1-CZ 3.97Å; D224-R248 IonicContact OD1-NE 3.72Å; D224-R248 PolarHBondContact OD1-NE 2.95Å; D224-R248 IonicContact OD1-NH2 2.71Å; D224-R248 PolarHBondContact OD1-NH2 3.26Å; D224-R248 IonicContact OD2-CZ 2.79Å; D224-R248 IonicContact OD2-NE 2.77Å; D224-R248 IonicContact OD2-NH2 3.28Å; D224-R248 PolarHBondContact OD2-NH2 3.4Å; A244-R248 WeakPolarHBondContact O-CG 3.44Å; A244-R248 PolarHBondContact O-N 3.08Å; A245-R248 PolarHBondContact O-N 3.01Å; I246-R248 PolarHBondContact O-N 3.06Å; R248-T252 WeakPolarHBondContact O-CG2 3.49Å; R248-T252 PolarHBondContact O-N 3.46Å; R248-T252 VanDerWaalsContact O-N 3.15Å; R248-T252 PolarHBondContact O-OG1 3.22Å
249	A	94	Very high	93.5	Very high	1 Å²	1	38.4 Å²	38.4	1%	0.008	19%	0.192	C	C	.	.	H	α-helix	trans	-69.5	-34	179.2	0	0	0	0	0	113	V223 A245 I246 R247 T252 R253 K254 F255	V223-A249 HydrophobicContact CG1-CB 3.83Å; A245-A249 WeakPolarHBondContact O-CB 3.33Å; A245-A249 PolarHBondContact O-N 2.97Å; I246-A249 PolarHBondContact O-N 3.3Å; R247-A249 VanDerWaalsContact C-N 3.3Å; R247-A249 PolarHBondContact O-N 3.22Å; A249-T252 PolarHBondContact O-OG1 2.94Å; A249-R253 PolarHBondContact O-N 3.17Å; A249-K254 PolarHBondContact O-N 3.4Å; A249-K254 VanDerWaalsContact O-N 3.1Å; A249-F255 HydrophobicContact CB-CB 3.52Å; A249-F255 HydrophobicContact CB-CG 4.34Å; A249-F255 PolarHBondContact O-N 2.74Å
250	V	94.3	Very high	93.7	Very high	1 Å²	1	36 Å²	36	1%	0.006	18%	0.175	C	C	.	.	H	α-helix	trans	-68.5	-47.9	173.7	169.4	0	0	0	0	111.1	P131 L133 I246 R247 T252 R253 F255 P257 L280	P131-V250 HydrophobicContact CB-CG1 4.12Å; P131-V250 WeakPolarHBondContact CB-O 3.45Å; L133-V250 HydrophobicContact CD2-CG1 4.29Å; I246-V250 HydrophobicContact CG2-CG2 4.13Å; I246-V250 WeakPolarHBondContact O-CB 3.37Å; I246-V250 WeakPolarHBondContact O-CG2 3.49Å; I246-V250 PolarHBondContact O-N 2.77Å; R247-V250 PolarHBondContact O-N 2.95Å; V250-T252 PolarHBondContact O-N 3.44Å; V250-R253 WeakPolarHBondContact O-CA 3.43Å; V250-R253 PolarHBondContact O-N 3.1Å; V250-F255 HydrophobicContact CG2-CD1 4.49Å; V250-P257 VanDerWaalsContact CG2-CD 3.45Å; V250-P257 HydrophobicContact CG2-CG 3.57Å; V250-L280 HydrophobicContact CG1-CD2 4.35Å
251	L	92.7	Very high	93.8	Very high	54 Å²	54	29.3 Å²	29.3	28%	0.283	14%	0.14	S	C	.	.	H	α-helix	trans	-59.9	-36.4	179.9	-67.8	-176.3	0	0	0	112.2	P131 R247 R253 P281	P131-L251 HydrophobicContact CG-CD2 4.38Å; R247-L251 HydrophobicContact CG-CD1 4.2Å; R247-L251 HydrophobicContact CG-CG 4.37Å; R247-L251 VanDerWaalsContact O-CG 3.28Å; R247-L251 WeakPolarHBondContact O-CG 3.29Å; R247-L251 PolarHBondContact O-N 3.24Å; L251-R253 VanDerWaalsContact C-N 3.28Å; L251-P281 HydrophobicContact CD2-CB 3.55Å; L251-P281 HydrophobicContact CD2-CG 3.93Å
252	T	91.1	Very high	93.8	Very high	81 Å²	81	26.1 Å²	26.1	50%	0.497	13%	0.125	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.5	-1.1	175.4	56	0	0	0	0	113.8	R248 A249 V250 K254	R248-T252 WeakPolarHBondContact O-CG2 3.49Å; R248-T252 PolarHBondContact O-N 3.46Å; R248-T252 VanDerWaalsContact O-N 3.15Å; R248-T252 PolarHBondContact O-OG1 3.22Å; A249-T252 PolarHBondContact O-OG1 2.94Å; V250-T252 PolarHBondContact O-N 3.44Å; T252-K254 PolarHBondContact O-N 2.92Å; T252-K254 VanDerWaalsContact O-N 3.15Å
253	R	90.5	Very high	93.8	Very high	47 Å²	47	25.9 Å²	25.9	18%	0.177	12%	0.124	C	C	.	.	T	Hydrogen-bonded Turn	trans	58.9	19.4	-179.6	-58.7	-179.8	65.2	-134.3	-3.6	114.9	M125 A126 N129 V130 P131 A249 V250 L251	M125-R253 PolarHBondContact O-NH2 3.4Å; A126-R253 PolarHBondContact O-NH1 2.96Å; N129-R253 VanDerWaalsContact C-CD 3.49Å; N129-R253 WeakPolarHBondContact O-CD 3.38Å; V130-R253 WeakPolarHBondContact O-CD 2.98Å; V130-R253 PolarHBondContact O-NE 3.22Å; P131-R253 HydrophobicContact CG-CG 4.43Å; A249-R253 PolarHBondContact O-N 3.17Å; V250-R253 WeakPolarHBondContact O-CA 3.43Å; V250-R253 PolarHBondContact O-N 3.1Å; L251-R253 VanDerWaalsContact C-N 3.28Å
254	K	91.5	Very high	93.5	Very high	125 Å²	125	26.9 Å²	26.9	54%	0.543	13%	0.131	S	C	.	.	S	Bend	trans	-86.2	-16.2	177.2	-66.7	-178.3	-178.6	179.4	0	112.4	V223 A249 T252	V223-K254 HydrophobicContact CB-CB 4.4Å; V223-K254 HydrophobicContact CG1-CB 3.2Å; V223-K254 HydrophobicContact CG1-CD 3.72Å; V223-K254 HydrophobicContact CG1-CG 4.13Å; V223-K254 HydrophobicContact CG2-CB 4.3Å; A249-K254 PolarHBondContact O-N 3.4Å; A249-K254 VanDerWaalsContact O-N 3.1Å; T252-K254 PolarHBondContact O-N 2.92Å; T252-K254 VanDerWaalsContact O-N 3.15Å
255	F	93.8	Very high	93.2	Very high	6 Å²	6	29.3 Å²	29.3	3%	0.026	14%	0.135	C	C	.	.			trans	-132.7	136.5	177.9	-178.3	-104.7	0	0	0	111.8	N160 A162 L216 V220 I246 A249 V250 P257	N160-F255 WeakPolarHBondContact O-CA 3.36Å; N160-F255 WeakPolarHBondContact O-CD2 3.26Å; A162-F255 HydrophobicContact CB-CE2 3.83Å; A162-F255 HydrophobicContact CB-CZ 3.8Å; L216-F255 HydrophobicContact CD1-CE1 4.43Å; L216-F255 HydrophobicContact CD1-CE2 4.46Å; L216-F255 HydrophobicContact CD1-CZ 3.67Å; V220-F255 HydrophobicContact CG2-CD1 4.35Å; V220-F255 HydrophobicContact CG2-CD2 4.16Å; V220-F255 HydrophobicContact CG2-CE1 4.04Å; V220-F255 HydrophobicContact CG2-CE2 3.84Å; V220-F255 HydrophobicContact CG2-CG 4.4Å; V220-F255 HydrophobicContact CG2-CZ 3.77Å; I246-F255 HydrophobicContact CG1-CE1 4.49Å; I246-F255 HydrophobicContact CG2-CD1 4.32Å; I246-F255 HydrophobicContact CG2-CE1 4.16Å; A249-F255 HydrophobicContact CB-CB 3.52Å; A249-F255 HydrophobicContact CB-CG 4.34Å; A249-F255 PolarHBondContact O-N 2.74Å; V250-F255 HydrophobicContact CG2-CD1 4.49Å; F255-P257 HydrophobicContact CD1-CB 4.45Å; F255-P257 HydrophobicContact CE1-CB 3.92Å; F255-P257 WeakPolarHBondContact O-CD 3.3Å
256	A	92.8	Very high	93	Very high	2 Å²	2	30.2 Å²	30.2	2%	0.017	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	99.3	178.4	0	0	0	0	0	110.7	F132 F159 N160 A161	F132-A256 HydrophobicContact CE2-CB 4.08Å; F132-A256 HydrophobicContact CZ-CB 4.23Å; F159-A256 HydrophobicContact CB-CB 4.27Å; N160-A256 PolarHBondContact O-N 3.25Å; A161-A256 VanDerWaalsContact CA-O 3.31Å; A161-A256 WeakPolarHBondContact CA-O 3.41Å; A161-A256 HydrophobicContact CB-CB 4.02Å; A161-A256 WeakPolarHBondContact CB-O 3.4Å
257	P	95.6	Very high	92.9	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	135.9	178.3	27.9	-34.7	0	0	0	110.8	L133 T134 L164 I246 V250 F255	L133-P257 HydrophobicContact CD2-CG 3.4Å; T134-P257 WeakPolarHBondContact CB-O 3.36Å; T134-P257 PolarHBondContact N-O 3.31Å; L164-P257 HydrophobicContact CD1-CB 3.59Å; L164-P257 HydrophobicContact CD2-CB 4.24Å; L164-P257 HydrophobicContact CG-CB 3.86Å; I246-P257 HydrophobicContact CG2-CB 4.46Å; V250-P257 VanDerWaalsContact CG2-CD 3.45Å; V250-P257 HydrophobicContact CG2-CG 3.57Å; F255-P257 HydrophobicContact CD1-CB 4.45Å; F255-P257 HydrophobicContact CE1-CB 3.92Å; F255-P257 WeakPolarHBondContact O-CD 3.3Å
258	I	96.1	Very high	92.7	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	120.5	-179.6	-60.9	159.5	0	0	0	110.4	T134 I136 L150 I153 A161 A162 L163 L164 L260	T134-I258 HydrophobicContact CG2-CG1 4.07Å; T134-I258 CarbonylContact O-C 3.54Å; T134-I258 WeakPolarHBondContact O-CA 3.03Å; I136-I258 HydrophobicContact CD1-CG2 3.51Å; I136-I258 HydrophobicContact CG1-CG2 3.77Å; L150-I258 HydrophobicContact CB-CD1 4.48Å; L150-I258 HydrophobicContact CD1-CD1 3.35Å; I153-I258 HydrophobicContact CD1-CD1 3.64Å; I153-I258 HydrophobicContact CD1-CG1 4.13Å; A161-I258 HydrophobicContact CB-CD1 3.78Å; A161-I258 HydrophobicContact CB-CG1 4.45Å; A162-I258 WeakPolarHBondContact O-CB 3.34Å; A162-I258 PolarHBondContact O-N 3.1Å; L163-I258 HydrophobicContact CD2-CB 4.04Å; L163-I258 HydrophobicContact CD2-CG2 3.65Å; L164-I258 PolarHBondContact N-O 3.19Å; I258-L260 HydrophobicContact CG2-CD2 4.24Å
259	L	96.5	Very high	92.7	Very high	5 Å²	5	25.1 Å²	25.1	3%	0.026	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	158.4	171.1	-66.4	107.5	0	0	0	111.1	L133 T134 F135 I136 L164 L272 A275	L133-L259 HydrophobicContact CB-CD1 4.44Å; T134-L259 PolarHBondContact O-N 2.9Å; F135-L259 WeakPolarHBondContact CA-O 3.37Å; F135-L259 HydrophobicContact CD2-CB 4.01Å; I136-L259 PolarHBondContact N-O 3.22Å; L164-L259 HydrophobicContact CD1-CD1 4.47Å; L259-L272 HydrophobicContact CD1-CD1 4.29Å; L259-A275 HydrophobicContact CD1-CB 3.85Å; L259-A275 HydrophobicContact CD2-CB 3.65Å; L259-A275 HydrophobicContact CG-CB 4.4Å
260	L	95.4	Very high	92.6	Very high	0 Å²	0	25.3 Å²	25.3	0%	0	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	143	-171.1	-59.7	-174.9	0	0	0	111.6	I136 L139 A146 L163 Q165 P167 V177 I258	I136-L260 HydrophobicContact CB-CD2 3.81Å; I136-L260 HydrophobicContact CD1-CD2 3.76Å; I136-L260 HydrophobicContact CG1-CD2 4.14Å; L139-L260 HydrophobicContact CD1-CB 3.73Å; L139-L260 HydrophobicContact CD1-CD2 4.23Å; L139-L260 HydrophobicContact CD1-CG 4.38Å; A146-L260 HydrophobicContact CB-CD1 4.26Å; A146-L260 HydrophobicContact CB-CD2 3.82Å; L163-L260 HydrophobicContact CD2-CD1 4.37Å; L163-L260 HydrophobicContact CD2-CD2 3.88Å; L163-L260 HydrophobicContact CD2-CG 4.33Å; Q165-L260 HydrophobicContact CB-CB 4.43Å; Q165-L260 HydrophobicContact CB-CD1 4.34Å; Q165-L260 HydrophobicContact CB-CG 4.26Å; Q165-L260 WeakPolarHBondContact O-CD1 3.5Å; Q165-L260 PolarHBondContact OE1-O 3.42Å; P167-L260 HydrophobicContact CB-CD1 4.16Å; P167-L260 HydrophobicContact CG-CD1 4.16Å; V177-L260 HydrophobicContact CG1-CB 4.31Å; I258-L260 HydrophobicContact CG2-CD2 4.24Å
261	G	93.5	Very high	92.6	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	13%	0.126	C	C	.	.			trans	-179.1	-173.9	170.7	0	0	0	0	0	116.1	I136 N137 K138 L139 K267	I136-G261 PolarHBondContact O-N 2.85Å; N137-G261 CarbonylContact C-O 3.5Å; N137-G261 WeakPolarHBondContact CA-O 3.45Å; K138-G261 PolarHBondContact N-O 3Å; L139-G261 PolarHBondContact N-O 3.32Å; G261-K267 CarbonylContact C-O 3.57Å; G261-K267 WeakPolarHBondContact CA-O 3.26Å
262	T	93.2	Very high	92.7	Very high	0 Å²	0	23.2 Å²	23.2	0%	0	11%	0.112	C	C	.	.	B	Isolated β-bridge	trans	-138.8	108.2	170.3	170.1	0	0	0	0	109	D140 F174 L264 K265 N266 K267	D140-T262 HydrophobicContact CB-CG2 4.26Å; D140-T262 VanDerWaalsContact OD1-CB 3.3Å; D140-T262 WeakPolarHBondContact OD1-CB 3.36Å; D140-T262 PolarHBondContact OD1-OG1 2.89Å; F174-T262 HydrophobicContact CD1-CG2 3.61Å; F174-T262 HydrophobicContact CE1-CG2 3.78Å; T262-L264 VanDerWaalsContact C-N 3.27Å; T262-L264 PolarHBondContact O-N 3.48Å; T262-K265 HydrophobicContact CG2-CB 3.78Å; T262-K265 PolarHBondContact OG1-N 3.04Å; T262-N266 PolarHBondContact O-N 3.47Å; T262-N266 VanDerWaalsContact O-N 3.1Å; T262-K267 CarbonylContact C-O 3.36Å; T262-K267 HydrophobicContact CG2-CB 3.85Å; T262-K267 HydrophobicContact CG2-CD 4.44Å; T262-K267 HydrophobicContact CG2-CG 4.17Å; T262-K267 PolarHBondContact N-O 3.18Å; T262-K267 PolarHBondContact O-N 2.97Å
263	A	91.5	Very high	92.8	Very high	0 Å²	0	19.4 Å²	19.4	0%	0	9%	0.089	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.5	-32.1	178.5	0	0	0	0	0	112.1	T24 V25 R28 N137 N266	T24-A263 HydrophobicContact CG2-CB 3.85Å; V25-A263 HydrophobicContact CB-CB 4.5Å; V25-A263 HydrophobicContact CG2-CB 3.59Å; R28-A263 HydrophobicContact CG-CB 4.29Å; R28-A263 WeakPolarHBondContact CG-O 3.24Å; R28-A263 PolarHBondContact NE-O 3.07Å; N137-A263 PolarHBondContact OD1-N 2.89Å; A263-N266 PolarHBondContact O-N 3.26Å; A263-N266 PolarHBondContact O-OD1 3.21Å
264	L	88.4	Confident	93	Very high	74 Å²	74	19.3 Å²	19.3	39%	0.387	9%	0.092	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.7	-47.5	-179.9	-174.1	66	0	0	0	111.1	E41 T262 N266	E41-L264 VanDerWaalsContact OE1-CD1 3.3Å; E41-L264 WeakPolarHBondContact OE1-CD1 3.19Å; T262-L264 VanDerWaalsContact C-N 3.27Å; T262-L264 PolarHBondContact O-N 3.48Å; L264-N266 VanDerWaalsContact C-N 3.31Å; L264-N266 PolarHBondContact O-N 3.35Å
265	K	87.7	Confident	93.1	Very high	83 Å²	83	13.5 Å²	13.5	36%	0.361	7%	0.068	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.2	14.3	177.8	-61	-170.8	179.3	173.8	0	114	D140 T262 K267	D140-K265 HydrophobicContact CB-CD 3.66Å; D140-K265 HydrophobicContact CB-CG 4.15Å; T262-K265 HydrophobicContact CG2-CB 3.78Å; T262-K265 PolarHBondContact OG1-N 3.04Å; K265-K267 WeakPolarHBondContact O-CG 3.45Å; K265-K267 PolarHBondContact O-N 2.79Å
266	N	90.7	Very high	93.2	Very high	19 Å²	19	13.2 Å²	13.2	10%	0.102	7%	0.066	C	C	.	.	T	Hydrogen-bonded Turn	trans	63.7	40.4	169.7	-59.6	-31.6	0	0	0	114.3	R28 Y32 Y192 T262 A263 L264	R28-N266 WeakPolarHBondContact CD-OD1 3.49Å; R28-N266 PolarHBondContact NE-OD1 2.86Å; Y32-N266 WeakPolarHBondContact OH-CA 3.25Å; Y32-N266 WeakPolarHBondContact OH-CB 3.42Å; Y32-N266 PolarHBondContact OH-O 2.87Å; Y192-N266 WeakPolarHBondContact O-CB 3.28Å; T262-N266 PolarHBondContact O-N 3.47Å; T262-N266 VanDerWaalsContact O-N 3.1Å; A263-N266 PolarHBondContact O-N 3.26Å; A263-N266 PolarHBondContact O-OD1 3.21Å; L264-N266 VanDerWaalsContact C-N 3.31Å; L264-N266 PolarHBondContact O-N 3.35Å
267	K	92.3	Very high	93.2	Very high	29 Å²	29	14.3 Å²	14.3	13%	0.126	7%	0.071	C	C	.	.	B	Isolated β-bridge	trans	-128.7	135.6	-178.9	-50.9	-170.3	-173.8	-177.9	0	111.6	F174 F188 G261 T262 K265	F174-K267 HydrophobicContact CD1-CB 4.41Å; F174-K267 HydrophobicContact CD1-CD 4.06Å; F174-K267 HydrophobicContact CE1-CB 3.86Å; F174-K267 HydrophobicContact CE1-CD 4.26Å; F174-K267 PolarHBondContact O-NZ 2.84Å; F188-K267 HydrophobicContact CB-CB 4.4Å; F188-K267 HydrophobicContact CB-CD 4.46Å; F188-K267 HydrophobicContact CB-CG 3.99Å; F188-K267 HydrophobicContact CD2-CB 3.63Å; F188-K267 HydrophobicContact CD2-CD 4.29Å; F188-K267 HydrophobicContact CD2-CG 3.99Å; F188-K267 HydrophobicContact CE2-CB 4.05Å; F188-K267 HydrophobicContact CG-CB 3.96Å; F188-K267 HydrophobicContact CG-CG 4.11Å; G261-K267 CarbonylContact C-O 3.57Å; G261-K267 WeakPolarHBondContact CA-O 3.26Å; T262-K267 CarbonylContact C-O 3.36Å; T262-K267 HydrophobicContact CG2-CB 3.85Å; T262-K267 HydrophobicContact CG2-CD 4.44Å; T262-K267 HydrophobicContact CG2-CG 4.17Å; T262-K267 PolarHBondContact N-O 3.18Å; T262-K267 PolarHBondContact O-N 2.97Å; K265-K267 WeakPolarHBondContact O-CG 3.45Å; K265-K267 PolarHBondContact O-N 2.79Å
268	G	91.4	Very high	93.1	Very high	0 Å²	0	17.5 Å²	17.5	0%	0	9%	0.089	C	C	.	.	S	Bend	trans	86.8	0.1	173.6	0	0	0	0	0	116.2	F188 L272	F188-G268 VanDerWaalsContact CE1-N 3.28Å; G268-L272 PolarHBondContact O-N 3.11Å
269	V	92.8	Very high	93.1	Very high	0 Å²	0	17.9 Å²	17.9	0%	0	9%	0.09	C	C	.	.	H	α-helix	trans	-79.3	-37.3	-178.6	-177.7	0	0	0	0	112.4	R28 I29 Y32 L272 L273	R28-V269 HydrophobicContact CB-CB 4.49Å; R28-V269 HydrophobicContact CB-CG1 4.07Å; R28-V269 HydrophobicContact CB-CG2 4Å; R28-V269 HydrophobicContact CG-CG2 4.45Å; I29-V269 HydrophobicContact CG1-CG1 3.72Å; Y32-V269 HydrophobicContact CD2-CB 3.9Å; Y32-V269 HydrophobicContact CD2-CG1 3.78Å; Y32-V269 HydrophobicContact CE2-CB 3.65Å; Y32-V269 HydrophobicContact CE2-CG1 3.98Å; Y32-V269 HydrophobicContact CE2-CG2 4.16Å; V269-L272 WeakPolarHBondContact O-CB 3.49Å; V269-L272 PolarHBondContact O-N 3.27Å; V269-L273 PolarHBondContact O-N 3.41Å; V269-L273 VanDerWaalsContact O-N 3.08Å
270	Q	92.5	Very high	93	Very high	5 Å²	5	17.7 Å²	17.7	2%	0.023	9%	0.089	C	C	.	.	H	α-helix	trans	-66.2	-42.6	177.7	-53.9	98.2	-48	0	0	113	Y32 W74 G193 L196 L272 L273 D274	Y32-Q270 HydrophobicContact CD1-CG 4.39Å; Y32-Q270 HydrophobicContact CD2-CG 4.17Å; Y32-Q270 HydrophobicContact CG-CG 4.06Å; W74-Q270 HydrophobicContact CH2-CB 4.35Å; W74-Q270 HydrophobicContact CH2-CG 4.17Å; W74-Q270 HydrophobicContact CZ2-CB 4.14Å; W74-Q270 HydrophobicContact CZ2-CG 4.46Å; G193-Q270 PolarHBondContact O-NE2 3.4Å; L196-Q270 HydrophobicContact CD1-CB 4.07Å; L196-Q270 HydrophobicContact CD1-CG 4.06Å; L196-Q270 HydrophobicContact CD2-CB 4.41Å; Q270-L272 PolarHBondContact O-N 3.1Å; Q270-L273 WeakPolarHBondContact O-CB 3.43Å; Q270-L273 PolarHBondContact O-N 3.04Å; Q270-L273 VanDerWaalsContact O-N 3.07Å; Q270-D274 PolarHBondContact O-N 3.34Å
271	P	94	Very high	92.9	Very high	11 Å²	11	17.8 Å²	17.8	7%	0.071	9%	0.09	C	C	.	.	H	α-helix	trans	-60.2	-31.6	171.4	-25.8	35.7	0	0	0	113.6	L186 F188 D274 A275	L186-P271 HydrophobicContact CD1-CG 3.79Å; F188-P271 HydrophobicContact CE1-CG 4.33Å; F188-P271 HydrophobicContact CZ-CG 4.11Å; P271-D274 PolarHBondContact O-N 3.39Å; P271-A275 WeakPolarHBondContact O-CB 3.26Å; P271-A275 PolarHBondContact O-N 3.3Å
272	L	95	Very high	92.9	Very high	0 Å²	0	18.1 Å²	18.1	0%	0	9%	0.091	C	C	.	.	H	α-helix	trans	-64.1	-42.9	172.1	176.6	66	0	0	0	111.6	V25 I105 F135 L259 G268 V269 Q270 D274 A275 V276	V25-L272 HydrophobicContact CG1-CD2 4.1Å; I105-L272 HydrophobicContact CD1-CD1 4.21Å; I105-L272 HydrophobicContact CD1-CD2 4.26Å; I105-L272 HydrophobicContact CD1-CG 4.25Å; I105-L272 HydrophobicContact CG2-CD1 4.16Å; I105-L272 HydrophobicContact CG2-CD2 4.41Å; F135-L272 HydrophobicContact CB-CD1 4.19Å; F135-L272 HydrophobicContact CB-CD2 4.33Å; F135-L272 HydrophobicContact CD1-CD2 4.2Å; F135-L272 HydrophobicContact CD2-CB 4.42Å; F135-L272 HydrophobicContact CD2-CD1 4.2Å; F135-L272 HydrophobicContact CD2-CD2 3.99Å; F135-L272 HydrophobicContact CD2-CG 4.44Å; F135-L272 HydrophobicContact CE2-CB 4.49Å; F135-L272 HydrophobicContact CE2-CD2 4.32Å; F135-L272 HydrophobicContact CG-CD1 4.38Å; F135-L272 HydrophobicContact CG-CD2 3.92Å; L259-L272 HydrophobicContact CD1-CD1 4.29Å; G268-L272 PolarHBondContact O-N 3.11Å; V269-L272 WeakPolarHBondContact O-CB 3.49Å; V269-L272 PolarHBondContact O-N 3.27Å; Q270-L272 PolarHBondContact O-N 3.1Å; L272-D274 VanDerWaalsContact C-N 3.32Å; L272-D274 PolarHBondContact O-N 3.5Å; L272-A275 PolarHBondContact O-N 3.18Å; L272-V276 WeakPolarHBondContact O-CG2 3.22Å; L272-V276 PolarHBondContact O-N 3.2Å
273	L	93.4	Very high	92.7	Very high	1 Å²	1	18.2 Å²	18.2	1%	0.005	9%	0.092	C	C	.	.	H	α-helix	trans	-65.2	-35.6	175.2	-72.6	175.3	0	0	0	112.9	I29 W74 V269 Q270 V276 I277	I29-L273 HydrophobicContact CB-CD2 4.38Å; I29-L273 HydrophobicContact CD1-CD2 4.16Å; I29-L273 HydrophobicContact CG1-CD1 4.38Å; I29-L273 HydrophobicContact CG1-CD2 3.92Å; I29-L273 HydrophobicContact CG1-CG 4.2Å; I29-L273 HydrophobicContact CG2-CD1 4.23Å; I29-L273 HydrophobicContact CG2-CD2 3.68Å; I29-L273 HydrophobicContact CG2-CG 4.46Å; W74-L273 HydrophobicContact CD2-CB 4.2Å; W74-L273 HydrophobicContact CD2-CD1 3.97Å; W74-L273 HydrophobicContact CE3-CD1 4.12Å; W74-L273 HydrophobicContact CG-CB 4.13Å; W74-L273 HydrophobicContact CG-CD1 4.38Å; W74-L273 HydrophobicContact CZ2-CB 4.44Å; W74-L273 HydrophobicContact CZ2-CD1 4.44Å; W74-L273 HydrophobicContact CZ3-CD1 4.43Å; V269-L273 PolarHBondContact O-N 3.41Å; V269-L273 VanDerWaalsContact O-N 3.08Å; Q270-L273 WeakPolarHBondContact O-CB 3.43Å; Q270-L273 PolarHBondContact O-N 3.04Å; Q270-L273 VanDerWaalsContact O-N 3.07Å; L273-V276 WeakPolarHBondContact O-CB 3.23Å; L273-V276 PolarHBondContact O-N 3.09Å; L273-I277 PolarHBondContact O-N 2.89Å
274	D	94.3	Very high	92.6	Very high	45 Å²	45	20.6 Å²	20.6	24%	0.241	11%	0.109	C	C	.	.	H	α-helix	trans	-64.3	-46.8	173.4	-71.7	-10	0	0	0	111	W74 K75 Q270 P271 L272 V276 I277 D278	W74-D274 PolarHBondContact NE1-OD1 2.6Å; K75-D274 WeakPolarHBondContact CE-OD1 3.48Å; K75-D274 IonicContact NZ-OD1 2.66Å; K75-D274 PolarHBondContact NZ-OD1 3.27Å; K75-D274 IonicContact NZ-OD2 3.27Å; K75-D274 PolarHBondContact NZ-OD2 3.33Å; Q270-D274 PolarHBondContact O-N 3.34Å; P271-D274 PolarHBondContact O-N 3.39Å; L272-D274 VanDerWaalsContact C-N 3.32Å; L272-D274 PolarHBondContact O-N 3.5Å; D274-V276 VanDerWaalsContact C-N 3.28Å; D274-V276 PolarHBondContact O-N 3.12Å; D274-I277 PolarHBondContact O-N 2.92Å; D274-D278 PolarHBondContact O-N 3.14Å
275	A	95.2	Very high	92.6	Very high	4 Å²	4	21 Å²	21	3%	0.033	11%	0.108	C	C	.	.	H	α-helix	trans	-61.1	-33.2	176.1	0	0	0	0	0	113.4	L133 L259 P271 L272 I277 D278 Y279	L133-A275 HydrophobicContact CD1-CB 3.96Å; L259-A275 HydrophobicContact CD1-CB 3.85Å; L259-A275 HydrophobicContact CD2-CB 3.65Å; L259-A275 HydrophobicContact CG-CB 4.4Å; P271-A275 WeakPolarHBondContact O-CB 3.26Å; P271-A275 PolarHBondContact O-N 3.3Å; L272-A275 PolarHBondContact O-N 3.18Å; A275-I277 VanDerWaalsContact C-N 3.34Å; A275-D278 PolarHBondContact O-N 3.31Å; A275-Y279 HydrophobicContact CB-CD2 3.78Å; A275-Y279 HydrophobicContact CB-CE2 3.97Å; A275-Y279 WeakPolarHBondContact O-CB 3.13Å; A275-Y279 WeakPolarHBondContact O-CD2 3.43Å; A275-Y279 PolarHBondContact O-N 3.21Å
276	V	94.6	Very high	92.5	Very high	0 Å²	0	18.9 Å²	18.9	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-60.7	-43.6	172.8	163.9	0	0	0	0	111.1	R10 I12 V79 I105 L133 L272 L273 D274 L280	R10-V276 HydrophobicContact CB-CG1 4.39Å; R10-V276 HydrophobicContact CG-CG1 4.33Å; I12-V276 HydrophobicContact CD1-CG1 4.06Å; I12-V276 HydrophobicContact CD1-CG2 4.07Å; I12-V276 HydrophobicContact CG2-CG1 4.08Å; V79-V276 HydrophobicContact CG1-CG1 4.24Å; I105-V276 HydrophobicContact CD1-CG2 3.75Å; I105-V276 HydrophobicContact CG1-CG2 4.32Å; L133-V276 HydrophobicContact CD1-CG2 4.15Å; L272-V276 WeakPolarHBondContact O-CG2 3.22Å; L272-V276 PolarHBondContact O-N 3.2Å; L273-V276 WeakPolarHBondContact O-CB 3.23Å; L273-V276 PolarHBondContact O-N 3.09Å; D274-V276 VanDerWaalsContact C-N 3.28Å; D274-V276 PolarHBondContact O-N 3.12Å; V276-L280 HydrophobicContact CB-CD1 4.38Å; V276-L280 HydrophobicContact CG1-CD1 4.24Å; V276-L280 HydrophobicContact CG2-CD1 4.06Å; V276-L280 WeakPolarHBondContact O-CB 3.3Å; V276-L280 PolarHBondContact O-N 3.41Å
277	I	94.1	Very high	92.3	Very high	24 Å²	24	22.8 Å²	22.8	12%	0.123	13%	0.127	C	C	.	.	H	α-helix	trans	-70.2	-44.3	179.2	-62.9	-178.4	0	0	0	110.2	R10 W74 K75 T77 L273 D274 A275	R10-I277 PolarHBondContact NH2-O 3.05Å; W74-I277 HydrophobicContact CB-CD1 4.3Å; W74-I277 VanDerWaalsContact CD1-CD1 3.5Å; W74-I277 HydrophobicContact CG-CD1 4.25Å; W74-I277 WeakPolarHBondContact O-CD1 3.36Å; K75-I277 HydrophobicContact CB-CD1 4.03Å; T77-I277 HydrophobicContact CG2-CD1 4.42Å; T77-I277 HydrophobicContact CG2-CG1 4.31Å; L273-I277 PolarHBondContact O-N 2.89Å; D274-I277 PolarHBondContact O-N 2.92Å; A275-I277 VanDerWaalsContact C-N 3.34Å
278	D	93.4	Very high	91.9	Very high	68 Å²	68	22.3 Å²	22.3	36%	0.364	13%	0.126	S	C	.	.	H	α-helix	trans	-73.1	-39.8	-172	-70.8	-11.3	0	0	0	112.9	R247 D274 A275	R247-D278 WeakPolarHBondContact CD-O 2.94Å; R247-D278 PolarHBondContact NH1-O 3.28Å; D274-D278 PolarHBondContact O-N 3.14Å; A275-D278 PolarHBondContact O-N 3.31Å
279	Y	95.2	Very high	91.6	Very high	8 Å²	8	23.9 Å²	23.9	3%	0.031	14%	0.136	C	C	.	.	H	α-helix	trans	-113.3	-26	-168.9	-54.2	-54.9	0	0	0	115.6	L133 L164 I181 K243 I246 R247 A275	L133-Y279 HydrophobicContact CD2-CD2 4.45Å; L164-Y279 HydrophobicContact CD1-CD2 4.41Å; L164-Y279 HydrophobicContact CD1-CE2 3.73Å; I181-Y279 WeakPolarHBondContact CD1-OH 3.37Å; K243-Y279 HydrophobicContact CB-CE1 4.25Å; K243-Y279 HydrophobicContact CG-CE1 4.35Å; I246-Y279 HydrophobicContact CB-CD1 4.08Å; I246-Y279 HydrophobicContact CB-CE1 3.8Å; I246-Y279 HydrophobicContact CG2-CD1 3.58Å; I246-Y279 HydrophobicContact CG2-CE1 3.57Å; I246-Y279 HydrophobicContact CG2-CG 4.12Å; R247-Y279 HydrophobicContact CB-CD1 4.24Å; A275-Y279 HydrophobicContact CB-CD2 3.78Å; A275-Y279 HydrophobicContact CB-CE2 3.97Å; A275-Y279 WeakPolarHBondContact O-CB 3.13Å; A275-Y279 WeakPolarHBondContact O-CD2 3.43Å; A275-Y279 PolarHBondContact O-N 3.21Å
280	L	95.1	Very high	91.2	Very high	0 Å²	0	23.9 Å²	23.9	0%	0	14%	0.136	C	C	.	.	S	Bend	trans	-84	152.8	179	-68.1	179.4	0	0	0	112	R10 I12 P131 L133 R247 V250 V276	R10-L280 PolarHBondContact NE-O 3.26Å; R10-L280 VanDerWaalsContact NE-O 3.13Å; I12-L280 HydrophobicContact CG2-CD1 3.64Å; P131-L280 HydrophobicContact CB-CD2 4.42Å; L133-L280 HydrophobicContact CD1-CD1 4.05Å; L133-L280 HydrophobicContact CD1-CG 3.94Å; L133-L280 HydrophobicContact CD2-CD2 4.15Å; L133-L280 HydrophobicContact CD2-CG 4.3Å; L133-L280 HydrophobicContact CG-CD1 4.12Å; L133-L280 HydrophobicContact CG-CD2 3.87Å; L133-L280 HydrophobicContact CG-CG 3.83Å; R247-L280 PolarHBondContact NH1-O 3.17Å; R247-L280 PolarHBondContact NH2-O 3.1Å; V250-L280 HydrophobicContact CG1-CD2 4.35Å; V276-L280 HydrophobicContact CB-CD1 4.38Å; V276-L280 HydrophobicContact CG1-CD1 4.24Å; V276-L280 HydrophobicContact CG2-CD1 4.06Å; V276-L280 WeakPolarHBondContact O-CB 3.3Å; V276-L280 PolarHBondContact O-N 3.41Å
281	P	93.8	Very high	90.7	Very high	3 Å²	3	25.9 Å²	25.9	2%	0.019	15%	0.147	C	C	.	.	P	Polyproline II helix	trans	-70.9	154.1	-175.6	26.1	-32.6	0	0	0	112.5	R10 D102 P131 L251 E285 V286	R10-P281 WeakPolarHBondContact CD-O 3.46Å; D102-P281 HydrophobicContact CB-CG 4.17Å; D102-P281 WeakPolarHBondContact O-CG 3.42Å; P131-P281 HydrophobicContact CG-CG 4.16Å; L251-P281 HydrophobicContact CD2-CB 3.55Å; L251-P281 HydrophobicContact CD2-CG 3.93Å; P281-E285 WeakPolarHBondContact CA-OE2 3.33Å; P281-E285 HydrophobicContact CB-CB 4.24Å; P281-V286 HydrophobicContact CB-CG2 3.91Å; P281-V286 HydrophobicContact CG-CG2 4.01Å
282	D	92.2	Very high	89.9	Confident	6 Å²	6	25.6 Å²	25.6	3%	0.032	15%	0.145	C	C	.	.	P	Polyproline II helix	trans	-90.3	161.3	160.2	79.3	69.3	0	0	0	111.2	R10 S284 E285	R10-D282 VanDerWaalsContact NH1-CB 3.31Å; D282-S284 PolarHBondContact O-N 2.91Å; D282-S284 WeakPolarHBondContact OD1-CA 3.48Å; D282-S284 VanDerWaalsContact OD1-CB 3.3Å; D282-S284 WeakPolarHBondContact OD1-CB 3.4Å; D282-S284 PolarHBondContact OD1-N 3.38Å; D282-S284 PolarHBondContact OD1-OG 3.42Å; D282-E285 PolarHBondContact N-OE2 2.83Å; D282-E285 PolarHBondContact O-N 3.37Å
283	P	89.7	Confident	88.8	Confident	3 Å²	3	28.4 Å²	28.4	2%	0.019	16%	0.158	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.2	-18.7	-175	-25.9	34.5	0	0	0	115.1	I9	I9-P283 HydrophobicContact CB-CG 4.1Å; I9-P283 HydrophobicContact CG2-CG 3.88Å; I9-P283 WeakPolarHBondContact O-CD 3.21Å
284	S	88.3	Confident	87.3	Confident	49 Å²	49	31.2 Å²	31.2	34%	0.343	17%	0.173	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.3	-15.1	178.2	71.3	0	0	0	0	114.3	D282	D282-S284 PolarHBondContact O-N 2.91Å; D282-S284 WeakPolarHBondContact OD1-CA 3.48Å; D282-S284 VanDerWaalsContact OD1-CB 3.3Å; D282-S284 WeakPolarHBondContact OD1-CB 3.4Å; D282-S284 PolarHBondContact OD1-N 3.38Å; D282-S284 PolarHBondContact OD1-OG 3.42Å
285	E	88.3	Confident	85.5	Confident	82 Å²	82	35.4 Å²	35.4	38%	0.383	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.2	-14.5	177.3	-65.4	175.6	156.9	0	0	112.6	R247 P281 D282	R247-E285 IonicContact CZ-OE1 3.85Å; R247-E285 IonicContact CZ-OE2 2.88Å; R247-E285 IonicContact NE-OE1 3.82Å; R247-E285 IonicContact NH2-OE1 2.83Å; R247-E285 PolarHBondContact NH2-OE1 3.29Å; R247-E285 IonicContact NH2-OE2 2.78Å; R247-E285 PolarHBondContact NH2-OE2 3.13Å; P281-E285 WeakPolarHBondContact CA-OE2 3.33Å; P281-E285 HydrophobicContact CB-CB 4.24Å; D282-E285 PolarHBondContact N-OE2 2.83Å; D282-E285 PolarHBondContact O-N 3.37Å
286	V	86.7	Confident	83.5	Confident	39 Å²	39	44.8 Å²	44.8	24%	0.236	23%	0.227	C	C	.	.	S	Bend	trans	-92.1	117.5	179.5	-176.5	0	0	0	0	110.2	D102 P281 N288	D102-V286 HydrophobicContact CB-CG2 3.87Å; P281-V286 HydrophobicContact CB-CG2 3.91Å; P281-V286 HydrophobicContact CG-CG2 4.01Å; V286-N288 PolarHBondContact O-N 3.02Å; V286-N288 PolarHBondContact O-ND2 3.06Å
287	T	85.4	Confident	81.6	Confident	102 Å²	102	46 Å²	46	63%	0.626	24%	0.237	S	C	*	.			trans	-72.5	112	173.9	-51.7	0	0	0	0	109.9	I307	T287-I307 HydrophobicContact CG2-CD1 4.3Å; T287-I307 HydrophobicContact CG2-CG1 4.31Å; T287-I307 HydrophobicContact CG2-CG2 3.78Å
288	N	85.3	Confident	79.4	Confident	18 Å²	18	55.2 Å²	55.2	10%	0.096	28%	0.276	C	S	.	.			trans	-106.1	132.7	177.2	-69	-74.1	0	0	0	110	V286 L308 Y339	V286-N288 PolarHBondContact O-N 3.02Å; V286-N288 PolarHBondContact O-ND2 3.06Å; N288-L308 HydrophobicContact CB-CB 4.49Å; N288-L308 HydrophobicContact CB-CD1 4.46Å; N288-L308 PolarHBondContact O-N 3.26Å; N288-Y339 HydrophobicContact CB-CD1 3.73Å; N288-Y339 HydrophobicContact CB-CE1 4.22Å; N288-Y339 VanDerWaalsContact CG-CD1 3.4Å; N288-Y339 WeakPolarHBondContact OD1-CE1 3.48Å
289	T	84.9	Confident	77.2	Confident	34 Å²	34	60.6 Å²	60.6	21%	0.209	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	152.6	-178.2	51.7	0	0	0	0	111.7	V305 E306 I307 L406	T289-V305 HydrophobicContact CG2-CG1 3.67Å; T289-E306 CarbonylContact C-O 3.54Å; T289-E306 VanDerWaalsContact CA-O 3.32Å; T289-E306 WeakPolarHBondContact CA-O 3.4Å; T289-I307 HydrophobicContact CG2-CG1 4.38Å; T289-L406 WeakPolarHBondContact O-CD2 3.39Å
290	V	83.7	Confident	75.1	Confident	0 Å²	0	67.9 Å²	67.9	0%	0	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	140.9	173.9	71.1	0	0	0	0	110.1	V292 E306 L308 M404 A405 L406	V290-V292 HydrophobicContact CG1-CG2 4.05Å; V290-E306 HydrophobicContact CG1-CB 4Å; V290-E306 PolarHBondContact N-O 2.81Å; V290-E306 PolarHBondContact O-N 3.31Å; V290-L308 HydrophobicContact CB-CD1 4.29Å; V290-L308 HydrophobicContact CB-CD2 4.07Å; V290-L308 HydrophobicContact CB-CG 4.17Å; V290-L308 HydrophobicContact CG1-CD2 3.64Å; V290-L308 HydrophobicContact CG1-CG 4.12Å; V290-M404 HydrophobicContact CG2-CB 3.79Å; V290-A405 WeakPolarHBondContact CG2-O 3.31Å; V290-L406 HydrophobicContact CB-CD2 3.96Å; V290-L406 HydrophobicContact CG2-CD2 3.87Å; V290-L406 HydrophobicContact CG2-CG 4.2Å
291	N	82.1	Confident	73.1	Confident	46 Å²	46	74.6 Å²	74.6	25%	0.246	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	124.8	173.4	-64.1	-38.7	0	0	0	108.9	H303 M404 A405	N291-H303 HydrophobicContact CB-CB 4.34Å; N291-M404 CarbonylContact O-C 3.58Å; N291-M404 WeakPolarHBondContact O-CA 3.04Å; N291-A405 WeakPolarHBondContact CB-O 3.44Å; N291-A405 PolarHBondContact N-O 3.35Å; N291-A405 PolarHBondContact O-N 2.76Å
292	V	77.8	Confident	71	Confident	5 Å²	5	81.5 Å²	81.5	3%	0.03	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	124.5	177.8	-170.7	0	0	0	0	108.6	V290 D294 H303 F304 E306 M404	V290-V292 HydrophobicContact CG1-CG2 4.05Å; V292-D294 PolarHBondContact O-N 3.39Å; V292-H303 VanDerWaalsContact O-CA 3.29Å; V292-H303 WeakPolarHBondContact O-CA 3.16Å; V292-F304 HydrophobicContact CB-CD1 4.41Å; V292-F304 HydrophobicContact CB-CD2 4.2Å; V292-F304 HydrophobicContact CB-CE1 3.93Å; V292-F304 HydrophobicContact CB-CE2 3.69Å; V292-F304 HydrophobicContact CB-CZ 3.55Å; V292-F304 HydrophobicContact CG1-CE1 3.94Å; V292-F304 HydrophobicContact CG1-CE2 4.14Å; V292-F304 HydrophobicContact CG1-CZ 3.54Å; V292-F304 HydrophobicContact CG2-CE2 3.95Å; V292-F304 HydrophobicContact CG2-CZ 4.22Å; V292-F304 PolarHBondContact N-O 3.46Å; V292-F304 PolarHBondContact O-N 3.05Å; V292-F304 VanDerWaalsContact O-N 3.1Å; V292-E306 HydrophobicContact CG2-CB 4.04Å; V292-M404 HydrophobicContact CG2-CG 4.2Å
293	E	72.2	Confident	69.7	Low	60 Å²	60	86 Å²	86	28%	0.28	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.6	122.8	174.4	-165.3	-179.5	135.5	0	0	109.8	Q295 H303 K403	E293-Q295 PolarHBondContact O-N 3.45Å; E293-H303 WeakPolarHBondContact CA-ND1 3.45Å; E293-K403 HydrophobicContact CB-CB 4.01Å; E293-K403 HydrophobicContact CB-CD 4.48Å; E293-K403 PolarHBondContact N-O 3.24Å; E293-K403 IonicContact OE1-NZ 3.66Å; E293-K403 PolarHBondContact OE1-NZ 2.75Å; E293-K403 WeakPolarHBondContact OE2-CD 3.37Å; E293-K403 IonicContact OE2-NZ 3.94Å; E293-K403 PolarHBondContact OE2-NZ 2.95Å; E293-K403 VanDerWaalsContact OE2-NZ 3.11Å
294	D	62	Low	68.9	Low	59 Å²	59	90.4 Å²	90.4	32%	0.316	43%	0.428	S	S	.	.			trans	-77.6	112.5	177.7	-173.4	0.8	0	0	0	110	V292 Y296 A297 Y302 F304	V292-D294 PolarHBondContact O-N 3.39Å; D294-Y296 PolarHBondContact O-N 3.36Å; D294-Y296 PolarHBondContact OD1-N 3.11Å; D294-A297 HydrophobicContact CB-CB 4.01Å; D294-A297 PolarHBondContact O-N 2.9Å; D294-Y302 PolarHBondContact N-O 3.15Å; D294-F304 HydrophobicContact CB-CD1 4.28Å; D294-F304 HydrophobicContact CB-CE1 4.47Å
295	Q	56.4	Low	68.4	Low	134 Å²	134	92.3 Å²	92.3	63%	0.626	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.9	-15.9	178.3	-67.3	-179.4	7	0	0	113.3	E293 S401	E293-Q295 PolarHBondContact O-N 3.45Å; Q295-S401 PolarHBondContact NE2-O 2.96Å
296	Y	52.8	Low	68.2	Low	200 Å²	200	91.1 Å²	91.1	78%	0.784	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.3	-1.9	-179	-62.2	-80.5	0	0	0	113.3	D294 F298	D294-Y296 PolarHBondContact O-N 3.36Å; D294-Y296 PolarHBondContact OD1-N 3.11Å; Y296-F298 PolarHBondContact O-N 3Å
297	A	53.5	Low	68.1	Low	25 Å²	25	94.7 Å²	94.7	21%	0.207	45%	0.448	C	S	.	.			trans	-76.5	119.7	177	0	0	0	0	0	111.2	D294 R299 Y302	D294-A297 HydrophobicContact CB-CB 4.01Å; D294-A297 PolarHBondContact O-N 2.9Å; A297-R299 PolarHBondContact O-N 3.38Å; A297-Y302 HydrophobicContact CB-CG 4.43Å
298	F	48.5	Very low	68.2	Low	218 Å²	218	90.2 Å²	90.2	96%	0.956	42%	0.42	S	S	*	.	S	Bend	trans	-62.3	-10.1	174	-79.9	-89.4	0	0	0	113.8	Y296	Y296-F298 PolarHBondContact O-N 3Å
299	R	47.7	Very low	68.3	Low	181 Å²	181	92.4 Å²	92.4	68%	0.683	43%	0.432	S	S	*	.	S	Bend	trans	-118.1	128.9	171.9	-72.6	-177.3	-176.3	169.9	1.3	109	A297 D301 Y302	A297-R299 PolarHBondContact O-N 3.38Å; R299-D301 PolarHBondContact O-N 2.78Å; R299-Y302 HydrophobicContact CB-CD2 4.16Å; R299-Y302 HydrophobicContact CB-CE2 4.43Å; R299-Y302 PolarHBondContact O-N 2.9Å
300	H	50	Low	68.3	Low	161 Å²	161	92.5 Å²	92.5	75%	0.745	43%	0.433	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.1	3	-175.3	-76.2	38	0	0	0	115.6
301	D	53.2	Low	68.4	Low	141 Å²	141	96.1 Å²	96.1	75%	0.754	45%	0.45	S	S	*	.	T	Hydrogen-bonded Turn	trans	-114	10.1	-174.3	-63.8	-30.4	0	0	0	113.9	R299	R299-D301 PolarHBondContact O-N 2.78Å
302	Y	50.5	Low	68.6	Low	148 Å²	148	95.3 Å²	95.3	58%	0.58	44%	0.444	S	S	*	.			trans	-90.2	118.3	173.5	-85.4	-87.3	0	0	0	111.2	D294 A297 R299	D294-Y302 PolarHBondContact N-O 3.15Å; A297-Y302 HydrophobicContact CB-CG 4.43Å; R299-Y302 HydrophobicContact CB-CD2 4.16Å; R299-Y302 HydrophobicContact CB-CE2 4.43Å; R299-Y302 PolarHBondContact O-N 2.9Å
303	H	64.5	Low	68.9	Low	101 Å²	101	95.7 Å²	95.7	47%	0.468	45%	0.447	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	142.3	168.9	-54.8	-70.6	0	0	0	108.8	N291 V292 E293	N291-H303 HydrophobicContact CB-CB 4.34Å; V292-H303 VanDerWaalsContact O-CA 3.29Å; V292-H303 WeakPolarHBondContact O-CA 3.16Å; E293-H303 WeakPolarHBondContact CA-ND1 3.45Å
304	F	73.2	Confident	69.4	Low	95 Å²	95	99.3 Å²	99.3	42%	0.417	47%	0.468	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	151.1	164.1	63.8	-90.7	0	0	0	109.8	V292 D294 E306	V292-F304 HydrophobicContact CB-CD1 4.41Å; V292-F304 HydrophobicContact CB-CD2 4.2Å; V292-F304 HydrophobicContact CB-CE1 3.93Å; V292-F304 HydrophobicContact CB-CE2 3.69Å; V292-F304 HydrophobicContact CB-CZ 3.55Å; V292-F304 HydrophobicContact CG1-CE1 3.94Å; V292-F304 HydrophobicContact CG1-CE2 4.14Å; V292-F304 HydrophobicContact CG1-CZ 3.54Å; V292-F304 HydrophobicContact CG2-CE2 3.95Å; V292-F304 HydrophobicContact CG2-CZ 4.22Å; V292-F304 PolarHBondContact N-O 3.46Å; V292-F304 PolarHBondContact O-N 3.05Å; V292-F304 VanDerWaalsContact O-N 3.1Å; D294-F304 HydrophobicContact CB-CD1 4.28Å; D294-F304 HydrophobicContact CB-CE1 4.47Å; F304-E306 HydrophobicContact CE2-CB 4.41Å
305	V	78	Confident	70.5	Confident	89 Å²	89	105.6 Å²	105.6	54%	0.539	49%	0.488	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	117.8	-178.9	-175.1	0	0	0	0	108.5	T289	T289-V305 HydrophobicContact CG2-CG1 3.67Å
306	E	83.4	Confident	72	Confident	57 Å²	57	102 Å²	102	27%	0.266	47%	0.472	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	139.4	175.1	-172.8	174.6	171.2	0	0	109.8	T289 V290 V292 F304 R402	T289-E306 CarbonylContact C-O 3.54Å; T289-E306 VanDerWaalsContact CA-O 3.32Å; T289-E306 WeakPolarHBondContact CA-O 3.4Å; V290-E306 HydrophobicContact CG1-CB 4Å; V290-E306 PolarHBondContact N-O 2.81Å; V290-E306 PolarHBondContact O-N 3.31Å; V292-E306 HydrophobicContact CG2-CB 4.04Å; F304-E306 HydrophobicContact CE2-CB 4.41Å; E306-R402 IonicContact OE1-NH1 2.73Å; E306-R402 IonicContact OE2-NH1 3.27Å
307	I	85.7	Confident	73.7	Confident	114 Å²	114	94.6 Å²	94.6	59%	0.585	45%	0.449	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.3	124.2	174.2	-61.1	173.5	0	0	0	108.2	T287 T289	T287-I307 HydrophobicContact CG2-CD1 4.3Å; T287-I307 HydrophobicContact CG2-CG1 4.31Å; T287-I307 HydrophobicContact CG2-CG2 3.78Å; T289-I307 HydrophobicContact CG2-CG1 4.38Å
308	L	87	Confident	75.5	Confident	8 Å²	8	93.6 Å²	93.6	4%	0.042	44%	0.439	C	S	.	.	P	Polyproline II helix	trans	-74.6	143.5	176.6	-64.9	178	0	0	0	111	N288 V290 V319 Y339 Q340 L406	N288-L308 HydrophobicContact CB-CB 4.49Å; N288-L308 HydrophobicContact CB-CD1 4.46Å; N288-L308 PolarHBondContact O-N 3.26Å; V290-L308 HydrophobicContact CB-CD1 4.29Å; V290-L308 HydrophobicContact CB-CD2 4.07Å; V290-L308 HydrophobicContact CB-CG 4.17Å; V290-L308 HydrophobicContact CG1-CD2 3.64Å; V290-L308 HydrophobicContact CG1-CG 4.12Å; L308-V319 HydrophobicContact CD1-CG1 4.19Å; L308-V319 HydrophobicContact CD2-CB 4.46Å; L308-V319 HydrophobicContact CD2-CG2 4.19Å; L308-Y339 HydrophobicContact CD1-CG 4.28Å; L308-Q340 HydrophobicContact CB-CB 4.45Å; L308-Q340 HydrophobicContact CD2-CB 4.28Å; L308-L406 HydrophobicContact CD1-CD2 3.89Å
309	N	87	Confident	77.5	Confident	65 Å²	65	83.2 Å²	83.2	35%	0.348	39%	0.394	S	S	.	.	P	Polyproline II helix	trans	-91.9	120.5	177.3	-178.2	-10.4	0	0	0	110.5	E311 L316	N309-E311 PolarHBondContact O-N 2.96Å; N309-E311 VanDerWaalsContact OD1-CB 3.25Å; N309-E311 WeakPolarHBondContact OD1-CB 3.44Å; N309-E311 PolarHBondContact OD1-N 2.82Å; N309-L316 HydrophobicContact CB-CD1 3.45Å; N309-L316 VanDerWaalsContact CB-CD1 3.45Å; N309-L316 WeakPolarHBondContact ND2-CD1 3.28Å
310	P	84.8	Confident	79.6	Confident	35 Å²	35	74.6 Å²	74.6	23%	0.227	36%	0.361	C	S	.	.			trans	-79.5	8.2	-179.5	34.3	-36.7	0	0	0	113.9	R312	P310-R312 PolarHBondContact O-N 3.43Å; P310-R312 VanDerWaalsContact O-N 3.12Å
311	E	85.8	Confident	81.6	Confident	77 Å²	77	67 Å²	67	36%	0.36	33%	0.326	S	S	.	.			trans	-55.8	119.5	175.8	-172.8	-179.6	175.4	0	0	109.9	N309 S313 R315	N309-E311 PolarHBondContact O-N 2.96Å; N309-E311 VanDerWaalsContact OD1-CB 3.25Å; N309-E311 WeakPolarHBondContact OD1-CB 3.44Å; N309-E311 PolarHBondContact OD1-N 2.82Å; E311-S313 PolarHBondContact O-N 3.21Å; E311-R315 IonicContact OE1-CZ 2.63Å; E311-R315 IonicContact OE1-NH1 3.69Å; E311-R315 PolarHBondContact OE1-NH1 2.82Å
312	R	87.4	Confident	83.4	Confident	28 Å²	28	60.2 Å²	60.2	11%	0.106	29%	0.29	C	S	.	.			trans	-75.8	62.9	178.6	-67.6	-177.4	62.9	96.4	-5	111.1	P3 L4 A6 P310 F378 S379 D381	P3-R312 HydrophobicContact CB-CB 4.34Å; L4-R312 VanDerWaalsContact O-CD 3.25Å; L4-R312 WeakPolarHBondContact O-CD 3.48Å; L4-R312 PolarHBondContact O-NE 3.42Å; A6-R312 HydrophobicContact CB-CG 4.49Å; P310-R312 PolarHBondContact O-N 3.43Å; P310-R312 VanDerWaalsContact O-N 3.12Å; R312-F378 HydrophobicContact CB-CB 4.2Å; R312-F378 HydrophobicContact CG-CB 4.35Å; R312-S379 VanDerWaalsContact CG-O 3.31Å; R312-S379 WeakPolarHBondContact CG-O 3.42Å; R312-S379 PolarHBondContact NH1-O 3.25Å; R312-D381 IonicContact CZ-OD1 3.9Å; R312-D381 VanDerWaalsContact CZ-OD1 3.27Å; R312-D381 IonicContact NH1-OD1 3.14Å; R312-D381 PolarHBondContact NH1-OD1 3.45Å; R312-D381 IonicContact NH1-OD2 2.96Å; R312-D381 IonicContact NH2-OD1 2.74Å; R312-D381 PolarHBondContact NH2-OD1 3.15Å; R312-D381 IonicContact NH2-OD2 3.62Å; R312-D381 PolarHBondContact NH2-OD2 2.9Å
313	S	84.5	Confident	85.1	Confident	14 Å²	14	53.5 Å²	53.5	10%	0.098	26%	0.264	C	S	.	.	S	Bend	trans	-133.2	162.2	178.5	76.2	0	0	0	0	111	E311 R315 G341	E311-S313 PolarHBondContact O-N 3.21Å; S313-R315 VanDerWaalsContact C-N 3.29Å; S313-R315 WeakPolarHBondContact OG-CB 3.27Å; S313-R315 PolarHBondContact OG-N 3.23Å; S313-G341 CarbonylContact O-C 3.48Å; S313-G341 WeakPolarHBondContact O-CA 3.4Å
314	D	82	Confident	86	Confident	136 Å²	136	49 Å²	49	73%	0.727	24%	0.243	S	C	*	.	S	Bend	trans	-87.8	6.6	172.3	59.6	-14.8	0	0	0	112.9	L316 A342	D314-L316 VanDerWaalsContact C-N 3.3Å; D314-L316 PolarHBondContact O-N 3.19Å; D314-A342 HydrophobicContact CB-CB 4.23Å
315	R	85.5	Confident	86.6	Confident	191 Å²	191	44.8 Å²	44.8	72%	0.721	23%	0.225	S	C	*	.	S	Bend	trans	-70.5	-26.8	-177	-64.8	174.4	173.6	170.4	-7.7	113.5	E311 S313	E311-R315 IonicContact OE1-CZ 2.63Å; E311-R315 IonicContact OE1-NH1 3.69Å; E311-R315 PolarHBondContact OE1-NH1 2.82Å; S313-R315 VanDerWaalsContact C-N 3.29Å; S313-R315 WeakPolarHBondContact OG-CB 3.27Å; S313-R315 PolarHBondContact OG-N 3.23Å
316	L	86.4	Confident	86.6	Confident	59 Å²	59	42.4 Å²	42.4	31%	0.309	21%	0.208	S	C	.	.	S	Bend	trans	-109.8	151.9	-177.2	-68.5	177	0	0	0	110.5	N309 D314 Q340 G341	N309-L316 HydrophobicContact CB-CD1 3.45Å; N309-L316 VanDerWaalsContact CB-CD1 3.45Å; N309-L316 WeakPolarHBondContact ND2-CD1 3.28Å; D314-L316 VanDerWaalsContact C-N 3.3Å; D314-L316 PolarHBondContact O-N 3.19Å; L316-Q340 HydrophobicContact CB-CG 3.78Å; L316-Q340 HydrophobicContact CD1-CG 4.06Å; L316-G341 WeakPolarHBondContact O-CA 3.43Å
317	P	88.3	Confident	86.1	Confident	44 Å²	44	41.3 Å²	41.3	29%	0.286	21%	0.209	S	C	.	.			trans	-61.1	144.2	179.2	25.8	-34.4	0	0	0	110.9	V319 Q340 D399	P317-V319 PolarHBondContact O-N 3.12Å; P317-Q340 PolarHBondContact O-NE2 2.63Å; P317-D399 HydrophobicContact CB-CB 4.25Å
318	F	91.6	Very high	85.4	Confident	3 Å²	3	37.4 Å²	37.4	1%	0.013	20%	0.197	C	C	.	.			trans	-65.5	132.4	176.8	168.9	-99.6	0	0	0	110.3	F336 I338 Q340 I343 I349 F396 V397 T398	F318-F336 HydrophobicContact CE2-CE2 4.28Å; F318-F336 HydrophobicContact CZ-CD2 4.12Å; F318-F336 AromaticContact CZ-CE2 3.98Å; F318-F336 HydrophobicContact CZ-CE2 3.98Å; F318-I338 HydrophobicContact CD2-CG2 3.89Å; F318-I338 HydrophobicContact CE2-CB 4.28Å; F318-I338 HydrophobicContact CE2-CD1 3.96Å; F318-I338 HydrophobicContact CE2-CG1 3.82Å; F318-I338 HydrophobicContact CE2-CG2 3.73Å; F318-Q340 WeakPolarHBondContact CA-O 3.38Å; F318-I343 HydrophobicContact CD2-CB 3.81Å; F318-I343 HydrophobicContact CD2-CG2 4.49Å; F318-I343 HydrophobicContact CE1-CD1 4.14Å; F318-I343 HydrophobicContact CE2-CB 3.72Å; F318-I343 HydrophobicContact CE2-CD1 4.03Å; F318-I343 HydrophobicContact CE2-CG1 4.39Å; F318-I343 HydrophobicContact CE2-CG2 4Å; F318-I343 HydrophobicContact CG-CB 4.5Å; F318-I343 HydrophobicContact CZ-CB 4.36Å; F318-I343 HydrophobicContact CZ-CD1 3.79Å; F318-I349 HydrophobicContact CD1-CG2 3.94Å; F318-I349 HydrophobicContact CE1-CG2 3.91Å; F318-F396 HydrophobicContact CE1-CB 3.9Å; F318-V397 VanDerWaalsContact O-CA 3.28Å; F318-V397 WeakPolarHBondContact O-CA 3.43Å; F318-T398 HydrophobicContact CB-CG2 3.61Å; F318-T398 HydrophobicContact CD1-CG2 4.3Å; F318-T398 HydrophobicContact CG-CG2 4.34Å; F318-T398 PolarHBondContact N-OG1 3.39Å; F318-T398 PolarHBondContact O-N 3.22Å
319	V	92.1	Very high	84.5	Confident	0 Å²	0	48.8 Å²	48.8	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	120.1	169.2	-175.4	0	0	0	0	108.2	L308 P317 Y339 Q340 T395 F396 V397 M404 L406	L308-V319 HydrophobicContact CD1-CG1 4.19Å; L308-V319 HydrophobicContact CD2-CB 4.46Å; L308-V319 HydrophobicContact CD2-CG2 4.19Å; P317-V319 PolarHBondContact O-N 3.12Å; V319-Y339 PolarHBondContact O-N 2.85Å; V319-Q340 HydrophobicContact CB-CB 4.27Å; V319-Q340 HydrophobicContact CG2-CB 4.35Å; V319-Q340 PolarHBondContact N-O 3.02Å; V319-Q340 PolarHBondContact O-N 2.86Å; V319-T395 HydrophobicContact CG1-CG2 4.24Å; V319-F396 WeakPolarHBondContact CA-O 3.44Å; V319-V397 HydrophobicContact CG1-CG1 4.49Å; V319-V397 HydrophobicContact CG2-CG1 4.31Å; V319-M404 HydrophobicContact CG2-SD 4.03Å; V319-L406 HydrophobicContact CG1-CD1 4.13Å; V319-L406 HydrophobicContact CG1-CD2 4.4Å; V319-L406 HydrophobicContact CG1-CG 4.33Å
320	G	91.6	Very high	83.6	Confident	0 Å²	0	53.4 Å²	53.4	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	147.7	179	0	0	0	0	0	113.4	R337 T395 F396	G320-R337 CarbonylContact C-O 3.51Å; G320-R337 WeakPolarHBondContact CA-O 3.39Å; G320-T395 WeakPolarHBondContact O-CA 3.26Å; G320-F396 PolarHBondContact N-O 3.1Å; G320-F396 PolarHBondContact O-N 3.16Å
321	L	91.4	Very high	83.2	Confident	1 Å²	1	53.4 Å²	53.4	1%	0.005	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	122.9	178	-175.9	61.5	0	0	0	110.4	R99 V100 F336 R337 Y339 G393 L406	R99-L321 HydrophobicContact CG-CD2 4.08Å; V100-L321 HydrophobicContact CG2-CD2 4.23Å; L321-F336 CarbonylContact O-C 3.58Å; L321-F336 WeakPolarHBondContact O-CA 3.33Å; L321-F336 WeakPolarHBondContact O-CB 3.39Å; L321-R337 PolarHBondContact N-O 3.02Å; L321-R337 PolarHBondContact O-N 2.65Å; L321-Y339 HydrophobicContact CB-CD2 4.43Å; L321-Y339 HydrophobicContact CB-CE2 3.75Å; L321-Y339 HydrophobicContact CD2-CE2 4.48Å; L321-G393 WeakPolarHBondContact CD1-O 3.47Å; L321-L406 HydrophobicContact CB-CD1 3.65Å; L321-L406 HydrophobicContact CD1-CB 4.27Å; L321-L406 HydrophobicContact CD1-CD1 4.26Å; L321-L406 HydrophobicContact CG-CD1 4.42Å
322	A	90.3	Very high	83.1	Confident	0 Å²	0	52.1 Å²	52.1	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	122.4	167.4	0	0	0	0	0	110.3	T334 Y335 G393 D394 F396	A322-T334 HydrophobicContact CB-CG2 3.6Å; A322-Y335 VanDerWaalsContact CA-O 3.3Å; A322-Y335 WeakPolarHBondContact CA-O 3.43Å; A322-G393 VanDerWaalsContact O-CA 3.31Å; A322-G393 WeakPolarHBondContact O-CA 3.35Å; A322-G393 PolarHBondContact O-N 2.8Å; A322-D394 PolarHBondContact N-O 3.44Å; A322-F396 HydrophobicContact CB-CD2 4.19Å; A322-F396 HydrophobicContact CB-CE2 3.74Å
323	F	86.5	Confident	83.1	Confident	6 Å²	6	51.1 Å²	51.1	3%	0.026	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	-18.9	-173.5	72.2	-88.8	0	0	0	114.3	I82 R96 V100 Y335 I382 S392	I82-F323 HydrophobicContact CD1-CE2 4.08Å; I82-F323 HydrophobicContact CD1-CZ 4.3Å; R96-F323 WeakPolarHBondContact CD-O 3.38Å; V100-F323 HydrophobicContact CB-CD1 4.48Å; V100-F323 HydrophobicContact CB-CG 4.3Å; V100-F323 HydrophobicContact CG1-CD1 3.84Å; V100-F323 HydrophobicContact CG1-CD2 4.44Å; V100-F323 HydrophobicContact CG1-CE1 3.93Å; V100-F323 HydrophobicContact CG1-CG 4.11Å; V100-F323 HydrophobicContact CG1-CZ 4.27Å; V100-F323 HydrophobicContact CG2-CB 3.4Å; V100-F323 VanDerWaalsContact CG2-CB 3.4Å; V100-F323 HydrophobicContact CG2-CD1 3.92Å; V100-F323 HydrophobicContact CG2-CD2 4.16Å; V100-F323 HydrophobicContact CG2-CG 3.58Å; F323-Y335 PolarHBondContact N-O 2.79Å; F323-I382 HydrophobicContact CE1-CG2 3.98Å; F323-I382 HydrophobicContact CZ-CG2 3.94Å; F323-S392 PolarHBondContact O-OG 2.89Å; F323-S392 VanDerWaalsContact O-OG 3.05Å
324	K	83.8	Confident	83.3	Confident	8 Å²	8	50.4 Å²	50.4	4%	0.035	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	134.5	176	-177.7	-175.3	179.5	-165.3	0	109.4	S67 E326 Y335	S67-K324 VanDerWaalsContact O-CE 3.29Å; S67-K324 WeakPolarHBondContact O-CE 3.09Å; S67-K324 PolarHBondContact O-NZ 2.94Å; K324-E326 IonicContact NZ-OE2 2.64Å; K324-E326 PolarHBondContact NZ-OE2 2.88Å; K324-Y335 HydrophobicContact CB-CD2 3.96Å; K324-Y335 HydrophobicContact CB-CG 4.11Å; K324-Y335 HydrophobicContact CD-CD2 4.04Å; K324-Y335 HydrophobicContact CD-CE2 4.05Å; K324-Y335 HydrophobicContact CD-CG 4.43Å; K324-Y335 HydrophobicContact CG-CD2 3.99Å; K324-Y335 HydrophobicContact CG-CE2 4.36Å; K324-Y335 PolarHBondContact O-N 3.4Å
325	L	85	Confident	83.6	Confident	6 Å²	6	44.2 Å²	44.2	3%	0.031	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	130.3	173.4	-56.1	-178.7	0	0	0	108	T334 C390 K440 E441	L325-T334 HydrophobicContact CD2-CG2 3.78Å; L325-T334 WeakPolarHBondContact CD2-OG1 3.32Å; L325-C390 VanDerWaalsContact CD1-O 3.29Å; L325-C390 WeakPolarHBondContact CD1-O 3.28Å; L325-K440 WeakPolarHBondContact CD1-O 3.45Å; L325-E441 HydrophobicContact CB-CG 4.33Å
326	E	79.2	Confident	83.8	Confident	39 Å²	39	35.3 Å²	35.3	18%	0.182	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	117.1	-179.6	-172.7	-176.2	149.8	0	0	108	K324 G328 L333 Y335	K324-E326 IonicContact NZ-OE2 2.64Å; K324-E326 PolarHBondContact NZ-OE2 2.88Å; E326-G328 PolarHBondContact O-N 2.9Å; E326-L333 PolarHBondContact N-O 2.86Å; E326-L333 WeakPolarHBondContact O-CA 3.44Å; E326-L333 PolarHBondContact O-N 2.94Å; E326-Y335 HydrophobicContact CB-CE2 3.92Å; E326-Y335 WeakPolarHBondContact OE2-CE2 3.23Å; E326-Y335 PolarHBondContact OE2-OH 3.25Å
327	A	73	Confident	84	Confident	34 Å²	34	32.6 Å²	32.6	28%	0.281	17%	0.167	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	110.4	170	0	0	0	0	0	109.8	R437	A327-R437 VanDerWaalsContact CB-NE 3.32Å; A327-R437 PolarHBondContact O-NH2 2.64Å
328	G	70.5	Confident	84.2	Confident	32 Å²	32	30.5 Å²	30.5	33%	0.33	15%	0.153	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	179.9	170.1	0	0	0	0	0	111.6	E326 F330 G331	E326-G328 PolarHBondContact O-N 2.9Å; G328-F330 PolarHBondContact O-N 2.97Å; G328-F330 VanDerWaalsContact O-N 3.13Å; G328-G331 PolarHBondContact N-O 3.34Å; G328-G331 PolarHBondContact O-N 2.98Å; G328-G331 VanDerWaalsContact O-N 3.12Å
329	R	67.3	Low	84.1	Confident	247 Å²	247	30.6 Å²	30.6	93%	0.932	15%	0.153	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58	-25.1	174.3	-64.6	-178.8	-179.8	-178.9	0.2	113.4
330	F	69.3	Low	84.1	Confident	162 Å²	162	31 Å²	31	71%	0.711	16%	0.155	S	C	*	.	T	Hydrogen-bonded Turn	trans	-96	4.4	-177.4	-55.5	-72.3	0	0	0	113.7	G328 M371 F386	G328-F330 PolarHBondContact O-N 2.97Å; G328-F330 VanDerWaalsContact O-N 3.13Å; F330-M371 HydrophobicContact CD2-CE 4.18Å; F330-M371 HydrophobicContact CE2-CE 4.2Å; F330-F386 HydrophobicContact CB-CE1 4.11Å
331	G	76.7	Confident	84	Confident	34 Å²	34	31 Å²	31	35%	0.351	16%	0.155	S	C	.	.	E	Extended strand (participates in β ladder)	trans	116.5	-173.9	-176.8	0	0	0	0	0	113	G328 L333	G328-G331 PolarHBondContact N-O 3.34Å; G328-G331 PolarHBondContact O-N 2.98Å; G328-G331 VanDerWaalsContact O-N 3.12Å; G331-L333 PolarHBondContact O-N 3.29Å
332	Q	82.6	Confident	84	Confident	51 Å²	51	31.8 Å²	31.8	24%	0.238	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	117.6	179.4	-175.2	174.4	-29.1	0	0	110.4	F386 G387 L388	Q332-F386 WeakPolarHBondContact O-CA 3.32Å; Q332-G387 PolarHBondContact O-N 3.38Å; Q332-L388 PolarHBondContact NE2-O 3.32Å
333	L	87.4	Confident	84.1	Confident	6 Å²	6	31.8 Å²	31.8	3%	0.031	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	129.4	164.1	-74.7	79.5	0	0	0	108.8	E326 G331 Y335 M366 M371 T385 F386	E326-L333 PolarHBondContact N-O 2.86Å; E326-L333 WeakPolarHBondContact O-CA 3.44Å; E326-L333 PolarHBondContact O-N 2.94Å; G331-L333 PolarHBondContact O-N 3.29Å; L333-Y335 HydrophobicContact CB-CE2 4.4Å; L333-M366 HydrophobicContact CD2-CE 4.03Å; L333-M366 HydrophobicContact CD2-SD 3.75Å; L333-M371 HydrophobicContact CD2-SD 4.37Å; L333-T385 WeakPolarHBondContact CA-O 3.5Å; L333-F386 HydrophobicContact CD1-CD1 3.8Å; L333-F386 HydrophobicContact CD1-CE1 3.29Å; L333-F386 HydrophobicContact CD1-CZ 4.01Å; L333-F386 HydrophobicContact CD2-CE1 4.15Å; L333-F386 HydrophobicContact CD2-CZ 4.01Å; L333-F386 HydrophobicContact CG-CD1 3.95Å; L333-F386 HydrophobicContact CG-CE1 3.56Å; L333-F386 HydrophobicContact CG-CZ 3.88Å
334	T	89.2	Confident	84.3	Confident	0 Å²	0	33.7 Å²	33.7	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	116.6	172.9	-64.8	0	0	0	0	108	A322 L325 A384 T385 L388 C390	A322-T334 HydrophobicContact CB-CG2 3.6Å; L325-T334 HydrophobicContact CD2-CG2 3.78Å; L325-T334 WeakPolarHBondContact CD2-OG1 3.32Å; T334-A384 WeakPolarHBondContact O-CA 3.08Å; T334-T385 PolarHBondContact N-O 3.38Å; T334-T385 PolarHBondContact O-N 3.33Å; T334-L388 HydrophobicContact CG2-CD1 4.04Å; T334-C390 VanDerWaalsContact CG2-SG 3.53Å; T334-C390 PolarHBondContact OG1-SG 2.91Å
335	Y	88.9	Confident	84.6	Confident	6 Å²	6	41.9 Å²	41.9	2%	0.024	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	133.5	173.5	-65	-109.5	0	0	0	109.2	A69 A322 F323 K324 E326 L333 M366 C383 A384	A69-Y335 HydrophobicContact CB-CE1 4.27Å; A322-Y335 VanDerWaalsContact CA-O 3.3Å; A322-Y335 WeakPolarHBondContact CA-O 3.43Å; F323-Y335 PolarHBondContact N-O 2.79Å; K324-Y335 HydrophobicContact CB-CD2 3.96Å; K324-Y335 HydrophobicContact CB-CG 4.11Å; K324-Y335 HydrophobicContact CD-CD2 4.04Å; K324-Y335 HydrophobicContact CD-CE2 4.05Å; K324-Y335 HydrophobicContact CD-CG 4.43Å; K324-Y335 HydrophobicContact CG-CD2 3.99Å; K324-Y335 HydrophobicContact CG-CE2 4.36Å; K324-Y335 PolarHBondContact O-N 3.4Å; E326-Y335 HydrophobicContact CB-CE2 3.92Å; E326-Y335 WeakPolarHBondContact OE2-CE2 3.23Å; E326-Y335 PolarHBondContact OE2-OH 3.25Å; L333-Y335 HydrophobicContact CB-CE2 4.4Å; Y335-M366 HydrophobicContact CD1-CG 4.35Å; Y335-M366 HydrophobicContact CE1-CB 3.83Å; Y335-M366 HydrophobicContact CE1-CG 3.42Å; Y335-M366 VanDerWaalsContact CE1-CG 3.42Å; Y335-C383 WeakPolarHBondContact CA-O 3.42Å; Y335-A384 HydrophobicContact CD1-CB 4.11Å; Y335-A384 HydrophobicContact CD2-CB 4.44Å; Y335-A384 HydrophobicContact CE1-CB 4.4Å; Y335-A384 HydrophobicContact CG-CB 4.14Å
336	F	88.8	Confident	84.8	Confident	3 Å²	3	42.8 Å²	42.8	1%	0.013	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	149.1	175.2	57.8	-85.8	0	0	0	111.9	F318 L321 I338 I343 L363 C383 T385	F318-F336 HydrophobicContact CE2-CE2 4.28Å; F318-F336 HydrophobicContact CZ-CD2 4.12Å; F318-F336 AromaticContact CZ-CE2 3.98Å; F318-F336 HydrophobicContact CZ-CE2 3.98Å; L321-F336 CarbonylContact O-C 3.58Å; L321-F336 WeakPolarHBondContact O-CA 3.33Å; L321-F336 WeakPolarHBondContact O-CB 3.39Å; F336-I338 HydrophobicContact CD2-CG1 4.03Å; F336-I338 HydrophobicContact CE2-CD1 4.16Å; F336-I338 HydrophobicContact CE2-CG1 3.97Å; F336-I343 HydrophobicContact CE2-CD1 4.14Å; F336-I343 HydrophobicContact CE2-CG2 4.11Å; F336-I343 HydrophobicContact CZ-CD1 4Å; F336-I343 HydrophobicContact CZ-CG2 4.36Å; F336-L363 HydrophobicContact CE1-CD2 4.36Å; F336-L363 HydrophobicContact CZ-CD2 3.69Å; F336-C383 WeakPolarHBondContact CE2-SG 3.35Å; F336-C383 WeakPolarHBondContact CZ-SG 3.41Å; F336-C383 PolarHBondContact N-O 2.64Å; F336-C383 PolarHBondContact O-N 2.72Å; F336-C383 VanDerWaalsContact O-N 3.09Å; F336-C383 VanDerWaalsContact O-O 3.13Å; F336-T385 HydrophobicContact CD1-CG2 4.39Å; F336-T385 HydrophobicContact CE1-CG2 3.68Å
337	R	91	Very high	85.3	Confident	3 Å²	3	43.7 Å²	43.7	1%	0.011	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	133.7	168.6	170.5	173.3	172.7	-175.2	0.3	109	V100 D102 G320 L321 Y339 I382	V100-R337 VanDerWaalsContact C-NH1 3.3Å; V100-R337 HydrophobicContact CG1-CB 3.57Å; V100-R337 HydrophobicContact CG1-CG 4.2Å; V100-R337 WeakPolarHBondContact O-CD 3.4Å; V100-R337 PolarHBondContact O-NH1 3.49Å; D102-R337 VanDerWaalsContact CG-NH2 3.27Å; D102-R337 IonicContact OD1-CZ 2.84Å; D102-R337 IonicContact OD1-NH1 3.51Å; D102-R337 PolarHBondContact OD1-NH1 2.9Å; D102-R337 IonicContact OD1-NH2 3.49Å; D102-R337 PolarHBondContact OD1-NH2 3.09Å; D102-R337 IonicContact OD2-CZ 2.74Å; D102-R337 IonicContact OD2-NH1 2.65Å; D102-R337 IonicContact OD2-NH2 3.23Å; D102-R337 PolarHBondContact OD2-NH2 2.93Å; D102-R337 VanDerWaalsContact OD2-NH2 3.15Å; G320-R337 CarbonylContact C-O 3.51Å; G320-R337 WeakPolarHBondContact CA-O 3.39Å; L321-R337 PolarHBondContact N-O 3.02Å; L321-R337 PolarHBondContact O-N 2.65Å; R337-Y339 HydrophobicContact CB-CE2 4.18Å; R337-Y339 HydrophobicContact CG-CD2 4.3Å; R337-Y339 HydrophobicContact CG-CE1 4.4Å; R337-Y339 HydrophobicContact CG-CE2 3.9Å; R337-Y339 VanDerWaalsContact CZ-CE1 3.45Å; R337-I382 HydrophobicContact CB-CG1 4.35Å
338	I	91.6	Very high	86.2	Confident	0 Å²	0	44.4 Å²	44.4	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	129.1	176.5	-47.8	-176.2	0	0	0	108.1	F318 F336 I343 A377 G380 D381	F318-I338 HydrophobicContact CD2-CG2 3.89Å; F318-I338 HydrophobicContact CE2-CB 4.28Å; F318-I338 HydrophobicContact CE2-CD1 3.96Å; F318-I338 HydrophobicContact CE2-CG1 3.82Å; F318-I338 HydrophobicContact CE2-CG2 3.73Å; F336-I338 HydrophobicContact CD2-CG1 4.03Å; F336-I338 HydrophobicContact CE2-CD1 4.16Å; F336-I338 HydrophobicContact CE2-CG1 3.97Å; I338-I343 HydrophobicContact CD1-CG2 3.55Å; I338-A377 HydrophobicContact CD1-CB 3.46Å; I338-A377 VanDerWaalsContact CD1-CB 3.46Å; I338-G380 PolarHBondContact O-N 3.49Å; I338-D381 PolarHBondContact N-O 3.31Å
339	Y	91.1	Very high	87.2	Confident	5 Å²	5	43 Å²	43	2%	0.02	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	-29.2	178.5	-71.3	-85.9	0	0	0	112.7	R99 N288 L308 V319 L321 R337 S379 L406	R99-Y339 PolarHBondContact NH1-OH 3.37Å; R99-Y339 PolarHBondContact O-OH 3.41Å; N288-Y339 HydrophobicContact CB-CD1 3.73Å; N288-Y339 HydrophobicContact CB-CE1 4.22Å; N288-Y339 VanDerWaalsContact CG-CD1 3.4Å; N288-Y339 WeakPolarHBondContact OD1-CE1 3.48Å; L308-Y339 HydrophobicContact CD1-CG 4.28Å; V319-Y339 PolarHBondContact O-N 2.85Å; L321-Y339 HydrophobicContact CB-CD2 4.43Å; L321-Y339 HydrophobicContact CB-CE2 3.75Å; L321-Y339 HydrophobicContact CD2-CE2 4.48Å; R337-Y339 HydrophobicContact CB-CE2 4.18Å; R337-Y339 HydrophobicContact CG-CD2 4.3Å; R337-Y339 HydrophobicContact CG-CE1 4.4Å; R337-Y339 HydrophobicContact CG-CE2 3.9Å; R337-Y339 VanDerWaalsContact CZ-CE1 3.45Å; Y339-S379 VanDerWaalsContact C-OG 3.23Å; Y339-S379 PolarHBondContact O-OG 2.85Å; Y339-L406 HydrophobicContact CD2-CD1 3.83Å; Y339-L406 HydrophobicContact CE2-CD1 4Å
340	Q	90.6	Very high	88.3	Confident	9 Å²	9	31.8 Å²	31.8	4%	0.042	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147	149.8	177.9	-175.3	173.9	-65.5	0	0	110.2	L308 L316 P317 F318 V319	L308-Q340 HydrophobicContact CB-CB 4.45Å; L308-Q340 HydrophobicContact CD2-CB 4.28Å; L316-Q340 HydrophobicContact CB-CG 3.78Å; L316-Q340 HydrophobicContact CD1-CG 4.06Å; P317-Q340 PolarHBondContact O-NE2 2.63Å; F318-Q340 WeakPolarHBondContact CA-O 3.38Å; V319-Q340 HydrophobicContact CB-CB 4.27Å; V319-Q340 HydrophobicContact CG2-CB 4.35Å; V319-Q340 PolarHBondContact N-O 3.02Å; V319-Q340 PolarHBondContact O-N 2.86Å
341	G	90.4	Very high	89.3	Confident	0 Å²	0	24.2 Å²	24.2	0%	0	14%	0.136	C	C	.	.	S	Bend	trans	74.2	-158	176.4	0	0	0	0	0	113.2	S313 L316 S379	S313-G341 CarbonylContact O-C 3.48Å; S313-G341 WeakPolarHBondContact O-CA 3.4Å; L316-G341 WeakPolarHBondContact O-CA 3.43Å; G341-S379 PolarHBondContact O-N 3.36Å
342	A	90.8	Very high	89.8	Confident	16 Å²	16	23.3 Å²	23.3	13%	0.132	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	155.3	179.4	0	0	0	0	0	110.7	D314 A377 F378	D314-A342 HydrophobicContact CB-CB 4.23Å; A342-A377 WeakPolarHBondContact CA-O 3.47Å; A342-F378 HydrophobicContact CB-CD1 3.7Å; A342-F378 HydrophobicContact CB-CE1 3.97Å; A342-F378 HydrophobicContact CB-CG 4.43Å
343	I	91.7	Very high	89.9	Confident	0 Å²	0	28.4 Å²	28.4	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	132.9	173.4	-164	174.8	0	0	0	109	F318 F336 I338 D347 I349 V360 L363 S376 A377	F318-I343 HydrophobicContact CD2-CB 3.81Å; F318-I343 HydrophobicContact CD2-CG2 4.49Å; F318-I343 HydrophobicContact CE1-CD1 4.14Å; F318-I343 HydrophobicContact CE2-CB 3.72Å; F318-I343 HydrophobicContact CE2-CD1 4.03Å; F318-I343 HydrophobicContact CE2-CG1 4.39Å; F318-I343 HydrophobicContact CE2-CG2 4Å; F318-I343 HydrophobicContact CG-CB 4.5Å; F318-I343 HydrophobicContact CZ-CB 4.36Å; F318-I343 HydrophobicContact CZ-CD1 3.79Å; F336-I343 HydrophobicContact CE2-CD1 4.14Å; F336-I343 HydrophobicContact CE2-CG2 4.11Å; F336-I343 HydrophobicContact CZ-CD1 4Å; F336-I343 HydrophobicContact CZ-CG2 4.36Å; I338-I343 HydrophobicContact CD1-CG2 3.55Å; I343-D347 HydrophobicContact CG1-CB 4.45Å; I343-I349 HydrophobicContact CD1-CD1 4.44Å; I343-I349 HydrophobicContact CD1-CG2 3.79Å; I343-I349 HydrophobicContact CG1-CG2 4.37Å; I343-V360 HydrophobicContact CD1-CG2 3.7Å; I343-V360 HydrophobicContact CG1-CG2 4.2Å; I343-L363 HydrophobicContact CD1-CD2 4.45Å; I343-L363 HydrophobicContact CG1-CD1 4.49Å; I343-L363 HydrophobicContact CG2-CD1 3.99Å; I343-L363 HydrophobicContact CG2-CD2 4.18Å; I343-S376 CarbonylContact O-C 3.43Å; I343-S376 VanDerWaalsContact O-CA 3.28Å; I343-S376 WeakPolarHBondContact O-CA 3.38Å; I343-A377 HydrophobicContact CG2-CB 4.02Å; I343-A377 PolarHBondContact N-O 3.24Å; I343-A377 PolarHBondContact O-N 3.14Å
344	S	91.4	Very high	89.9	Confident	46 Å²	46	31.1 Å²	31.1	32%	0.322	16%	0.16	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	157.8	178.1	-60.3	0	0	0	0	111.1	G346 D347 E375	S344-G346 PolarHBondContact O-N 3.46Å; S344-D347 PolarHBondContact N-OD2 3.01Å; S344-D347 WeakPolarHBondContact O-CB 3.12Å; S344-D347 PolarHBondContact O-N 2.91Å; S344-E375 WeakPolarHBondContact CA-O 3.46Å
345	R	90.3	Very high	89.7	Confident	180 Å²	180	35.4 Å²	35.4	68%	0.679	18%	0.181	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.5	124.1	173.5	-176.7	-177.2	176	-164.1	-4.8	109.8	Q361 E375	R345-Q361 WeakPolarHBondContact CG-O 3.25Å; R345-Q361 PolarHBondContact NE-O 3.41Å; R345-Q361 VanDerWaalsContact NE-O 3.12Å; R345-E375 PolarHBondContact N-O 2.86Å
346	G	88.5	Confident	89.6	Confident	25 Å²	25	40 Å²	40	26%	0.258	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	103.2	-12.1	179.4	0	0	0	0	0	114.6	S344 R359 V360	S344-G346 PolarHBondContact O-N 3.46Å; G346-R359 WeakPolarHBondContact O-CG 3.45Å; G346-R359 PolarHBondContact O-NE 3.41Å; G346-V360 WeakPolarHBondContact CA-O 3.39Å; G346-V360 PolarHBondContact N-O 2.96Å
347	D	90.5	Very high	89.7	Confident	58 Å²	58	46.6 Å²	46.6	31%	0.31	23%	0.23	S	C	.	.			trans	-64.4	155.5	178.9	-71.3	-11.3	0	0	0	112	I343 S344 R359 V360	I343-D347 HydrophobicContact CG1-CB 4.45Å; S344-D347 PolarHBondContact N-OD2 3.01Å; S344-D347 WeakPolarHBondContact O-CB 3.12Å; S344-D347 PolarHBondContact O-N 2.91Å; D347-R359 WeakPolarHBondContact O-CA 3.37Å; D347-V360 PolarHBondContact O-N 3.44Å
348	S	91.1	Very high	89.6	Confident	49 Å²	49	47.9 Å²	47.9	34%	0.343	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	121.2	174.5	-61	0	0	0	0	110.3
349	I	92.1	Very high	89.6	Confident	2 Å²	2	55.8 Å²	55.8	1%	0.01	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	154.2	176.4	59.9	177.5	0	0	0	110.4	F318 I343 K357 T358 V360 L388 F396 T398	F318-I349 HydrophobicContact CD1-CG2 3.94Å; F318-I349 HydrophobicContact CE1-CG2 3.91Å; I343-I349 HydrophobicContact CD1-CD1 4.44Å; I343-I349 HydrophobicContact CD1-CG2 3.79Å; I343-I349 HydrophobicContact CG1-CG2 4.37Å; I349-K357 CarbonylContact O-C 3.55Å; I349-K357 WeakPolarHBondContact O-CA 3.41Å; I349-T358 PolarHBondContact N-O 3.44Å; I349-T358 PolarHBondContact O-N 3.12Å; I349-T358 VanDerWaalsContact O-O 3.08Å; I349-V360 HydrophobicContact CD1-CG2 3.88Å; I349-V360 HydrophobicContact CG1-CG2 4.02Å; I349-V360 HydrophobicContact CG2-CG2 4.15Å; I349-L388 HydrophobicContact CD1-CD1 4.09Å; I349-L388 HydrophobicContact CD1-CD2 3.91Å; I349-L388 HydrophobicContact CG1-CD2 4.38Å; I349-F396 HydrophobicContact CB-CD1 4.39Å; I349-F396 HydrophobicContact CD1-CB 4.29Å; I349-F396 HydrophobicContact CD1-CD1 3.66Å; I349-F396 HydrophobicContact CD1-CE1 4.14Å; I349-F396 HydrophobicContact CD1-CG 4.05Å; I349-F396 HydrophobicContact CG1-CD1 3.99Å; I349-T398 HydrophobicContact CG2-CG2 4.39Å
350	I	91.1	Very high	89.6	Confident	13 Å²	13	55.6 Å²	55.6	7%	0.067	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	129.5	-178	-56	173.3	0	0	0	107.3	A352 K357 F396 V397	I350-A352 PolarHBondContact O-N 2.9Å; I350-K357 HydrophobicContact CG1-CB 4.26Å; I350-K357 HydrophobicContact CG1-CG 4.14Å; I350-F396 WeakPolarHBondContact O-CA 3.45Å; I350-V397 HydrophobicContact CB-CG2 4.41Å; I350-V397 PolarHBondContact N-O 3.46Å; I350-V397 PolarHBondContact O-N 2.83Å
351	N	90.4	Very high	89.5	Confident	2 Å²	2	62.1 Å²	62.1	1%	0.011	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	116.9	170.7	178.9	-41.9	0	0	0	108.6	R353 T354 M355 K356 D394 F396	N351-R353 PolarHBondContact O-N 3.17Å; N351-R353 WeakPolarHBondContact OD1-CB 3.31Å; N351-R353 PolarHBondContact OD1-N 2.91Å; N351-T354 WeakPolarHBondContact CB-OG1 3.41Å; N351-T354 VanDerWaalsContact CG-OG1 3.22Å; N351-T354 PolarHBondContact O-N 3.31Å; N351-T354 PolarHBondContact OD1-N 3.14Å; N351-T354 VanDerWaalsContact OD1-N 3.17Å; N351-T354 PolarHBondContact OD1-OG1 3.45Å; N351-M355 WeakPolarHBondContact O-CA 3.31Å; N351-M355 PolarHBondContact O-N 3.15Å; N351-K356 PolarHBondContact N-O 3.34Å; N351-K356 VanDerWaalsContact N-O 3.1Å; N351-D394 PolarHBondContact ND2-OD2 3.34Å; N351-F396 HydrophobicContact CB-CD1 4.17Å; N351-F396 HydrophobicContact CB-CE1 3.83Å; N351-F396 HydrophobicContact CB-CZ 4.5Å
352	A	87.4	Confident	89.4	Confident	16 Å²	16	66.7 Å²	66.7	13%	0.132	32%	0.315	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-26	-174	0	0	0	0	0	113.7	I350 T395 M404	I350-A352 PolarHBondContact O-N 2.9Å; A352-T395 WeakPolarHBondContact CB-O 3.44Å; A352-T395 PolarHBondContact N-O 3.08Å; A352-M404 WeakPolarHBondContact CB-O 3.49Å
353	R	84.5	Confident	89.4	Confident	157 Å²	157	66 Å²	66	59%	0.592	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.8	-42	179.1	-174.8	-177.4	58.7	73.8	6	112.6	N351 D394	N351-R353 PolarHBondContact O-N 3.17Å; N351-R353 WeakPolarHBondContact OD1-CB 3.31Å; N351-R353 PolarHBondContact OD1-N 2.91Å; R353-D394 IonicContact CZ-OD1 2.91Å; R353-D394 IonicContact CZ-OD2 3.72Å; R353-D394 IonicContact NE-OD1 2.66Å; R353-D394 PolarHBondContact NE-OD1 2.86Å; R353-D394 IonicContact NE-OD2 3.47Å; R353-D394 IonicContact NH2-OD1 3.74Å; R353-D394 PolarHBondContact NH2-OD1 2.99Å; R353-D394 IonicContact NH2-OD2 2.94Å; R353-D394 PolarHBondContact NH2-OD2 2.78Å
354	T	85.8	Confident	89.2	Confident	64 Å²	64	66 Å²	66	39%	0.393	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.4	-10.6	-175.9	58.5	0	0	0	0	113.6	N351 K356	N351-T354 WeakPolarHBondContact CB-OG1 3.41Å; N351-T354 VanDerWaalsContact CG-OG1 3.22Å; N351-T354 PolarHBondContact O-N 3.31Å; N351-T354 PolarHBondContact OD1-N 3.14Å; N351-T354 VanDerWaalsContact OD1-N 3.17Å; N351-T354 PolarHBondContact OD1-OG1 3.45Å; T354-K356 PolarHBondContact O-N 3.2Å; T354-K356 VanDerWaalsContact O-N 3.08Å
355	M	84.9	Confident	88.8	Confident	89 Å²	89	66.6 Å²	66.6	44%	0.438	30%	0.304	S	S	.	.			trans	55.3	17.2	-171.3	-60	-60.6	-71.2	0	0	114.3	N351 K403	N351-M355 WeakPolarHBondContact O-CA 3.31Å; N351-M355 PolarHBondContact O-N 3.15Å; M355-K403 HydrophobicContact SD-CG 4.38Å
356	K	88.3	Confident	88.1	Confident	102 Å²	102	59 Å²	59	44%	0.443	28%	0.277	S	S	.	.			trans	-80.5	121.6	179	-171.5	175.3	176.7	176.2	0	110.2	N351 T354 E389	N351-K356 PolarHBondContact N-O 3.34Å; N351-K356 VanDerWaalsContact N-O 3.1Å; T354-K356 PolarHBondContact O-N 3.2Å; T354-K356 VanDerWaalsContact O-N 3.08Å; K356-E389 IonicContact NZ-OE2 2.79Å; K356-E389 PolarHBondContact NZ-OE2 3.04Å
357	K	90	Very high	87.2	Confident	142 Å²	142	59.2 Å²	59.2	62%	0.617	27%	0.271	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.5	129.4	174.3	-170.1	172.6	-177.2	174.1	0	110.2	I349 I350	I349-K357 CarbonylContact O-C 3.55Å; I349-K357 WeakPolarHBondContact O-CA 3.41Å; I350-K357 HydrophobicContact CG1-CB 4.26Å; I350-K357 HydrophobicContact CG1-CG 4.14Å
358	T	90.1	Very high	85.9	Confident	30 Å²	30	57.4 Å²	57.4	18%	0.184	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	143	179	-47.5	0	0	0	0	110.2	I349 L388	I349-T358 PolarHBondContact N-O 3.44Å; I349-T358 PolarHBondContact O-N 3.12Å; I349-T358 VanDerWaalsContact O-O 3.08Å; T358-L388 HydrophobicContact CG2-CD2 3.63Å
359	R	90.9	Very high	84.7	Confident	167 Å²	167	60 Å²	60	63%	0.63	27%	0.274	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95.9	132.7	179.9	-167.8	178.2	-173.6	-171.9	-0.4	110.7	G346 D347 Q361	G346-R359 WeakPolarHBondContact O-CG 3.45Å; G346-R359 PolarHBondContact O-NE 3.41Å; D347-R359 WeakPolarHBondContact O-CA 3.37Å; R359-Q361 PolarHBondContact O-N 3.31Å
360	V	90.6	Very high	83.8	Confident	1 Å²	1	66.8 Å²	66.8	1%	0.006	31%	0.305	C	S	.	.			trans	-78.2	103.5	178.1	-176.9	0	0	0	0	109.3	I343 G346 D347 I349 L363	I343-V360 HydrophobicContact CD1-CG2 3.7Å; I343-V360 HydrophobicContact CG1-CG2 4.2Å; G346-V360 WeakPolarHBondContact CA-O 3.39Å; G346-V360 PolarHBondContact N-O 2.96Å; D347-V360 PolarHBondContact O-N 3.44Å; I349-V360 HydrophobicContact CD1-CG2 3.88Å; I349-V360 HydrophobicContact CG1-CG2 4.02Å; I349-V360 HydrophobicContact CG2-CG2 4.15Å; V360-L363 HydrophobicContact CG1-CD1 4.18Å; V360-L363 HydrophobicContact CG1-CD2 3.69Å; V360-L363 HydrophobicContact CG1-CG 3.6Å
361	Q	88.2	Confident	83.2	Confident	146 Å²	146	69.4 Å²	69.4	68%	0.682	32%	0.318	S	S	*	.			trans	-80.2	-35.9	-177.1	-63.2	-172.1	-2	0	0	113	R345 R359	R345-Q361 WeakPolarHBondContact CG-O 3.25Å; R345-Q361 PolarHBondContact NE-O 3.41Å; R345-Q361 VanDerWaalsContact NE-O 3.12Å; R359-Q361 PolarHBondContact O-N 3.31Å
362	R	89.7	Confident	83	Confident	96 Å²	96	73.6 Å²	73.6	36%	0.362	34%	0.338	S	S	.	.			trans	-151.3	132.7	-173.8	-167.8	179.5	-175.6	-169.6	0.3	109.4	V364 D373 T385 F386	R362-V364 HydrophobicContact CG-CG1 4.12Å; R362-D373 IonicContact CZ-OD1 3.12Å; R362-D373 VanDerWaalsContact CZ-OD1 3.27Å; R362-D373 IonicContact CZ-OD2 2.9Å; R362-D373 IonicContact NE-OD1 3.68Å; R362-D373 PolarHBondContact NE-OD1 3.37Å; R362-D373 IonicContact NE-OD2 3.84Å; R362-D373 VanDerWaalsContact NH2-CG 3.28Å; R362-D373 IonicContact NH2-OD1 3.68Å; R362-D373 PolarHBondContact NH2-OD1 3.15Å; R362-D373 VanDerWaalsContact NH2-OD1 3.07Å; R362-D373 IonicContact NH2-OD2 3.48Å; R362-D373 PolarHBondContact NH2-OD2 3.32Å; R362-T385 WeakPolarHBondContact O-CA 3.43Å; R362-T385 WeakPolarHBondContact O-CB 3.24Å; R362-T385 PolarHBondContact O-OG1 2.89Å; R362-F386 HydrophobicContact CB-CD2 4.24Å; R362-F386 HydrophobicContact CG-CD2 4.46Å
363	L	89.7	Confident	83	Confident	2 Å²	2	77.4 Å²	77.4	1%	0.01	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	130	173.2	-74.7	167.2	0	0	0	108	F336 I343 V360 V374	F336-L363 HydrophobicContact CE1-CD2 4.36Å; F336-L363 HydrophobicContact CZ-CD2 3.69Å; I343-L363 HydrophobicContact CD1-CD2 4.45Å; I343-L363 HydrophobicContact CG1-CD1 4.49Å; I343-L363 HydrophobicContact CG2-CD1 3.99Å; I343-L363 HydrophobicContact CG2-CD2 4.18Å; V360-L363 HydrophobicContact CG1-CD1 4.18Å; V360-L363 HydrophobicContact CG1-CD2 3.69Å; V360-L363 HydrophobicContact CG1-CG 3.6Å; L363-V374 WeakPolarHBondContact CB-O 3.18Å; L363-V374 PolarHBondContact O-N 3.1Å
364	V	88.4	Confident	83.1	Confident	0 Å²	0	71.1 Å²	71.1	0%	0	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	145.3	179.8	-63.2	0	0	0	0	110.8	R362 M366 E372 D373 A384 F386	R362-V364 HydrophobicContact CG-CG1 4.12Å; V364-M366 HydrophobicContact CG2-SD 4.06Å; V364-E372 CarbonylContact C-O 3.53Å; V364-E372 VanDerWaalsContact CA-O 3.24Å; V364-E372 WeakPolarHBondContact CA-O 3.32Å; V364-D373 WeakPolarHBondContact CG1-OD1 3.32Å; V364-A384 HydrophobicContact CG2-CB 3.99Å; V364-A384 WeakPolarHBondContact CG2-O 3.23Å; V364-A384 PolarHBondContact N-O 2.9Å; V364-A384 PolarHBondContact O-N 3.23Å; V364-F386 HydrophobicContact CG1-CE2 3.92Å; V364-F386 HydrophobicContact CG2-CE2 3.89Å
365	R	83.2	Confident	83.2	Confident	57 Å²	57	75.5 Å²	75.5	22%	0.215	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	133.2	161.7	-77	178.2	-176.5	175.5	-2.8	108.4	E372 V374 D381	R365-E372 PolarHBondContact N-O 3.18Å; R365-E372 PolarHBondContact O-N 3.23Å; R365-V374 HydrophobicContact CB-CG2 4.08Å; R365-V374 HydrophobicContact CG-CG2 3.67Å; R365-D381 IonicContact NH2-OD1 3.18Å; R365-D381 IonicContact NH2-OD2 2.86Å; R365-D381 PolarHBondContact NH2-OD2 3.16Å
366	M	75	Confident	83.5	Confident	21 Å²	21	72.4 Å²	72.4	10%	0.103	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	134.9	-178.2	-63	-61.7	-63.7	0	0	109.9	L333 Y335 V364 M371 A384	L333-M366 HydrophobicContact CD2-CE 4.03Å; L333-M366 HydrophobicContact CD2-SD 3.75Å; Y335-M366 HydrophobicContact CD1-CG 4.35Å; Y335-M366 HydrophobicContact CE1-CB 3.83Å; Y335-M366 HydrophobicContact CE1-CG 3.42Å; Y335-M366 VanDerWaalsContact CE1-CG 3.42Å; V364-M366 HydrophobicContact CG2-SD 4.06Å; M366-M371 HydrophobicContact CE-CG 3.92Å; M366-M371 HydrophobicContact SD-CG 3.59Å; M366-M371 VanDerWaalsContact SD-CG 3.59Å; M366-M371 HydrophobicContact SD-SD 4.3Å; M366-A384 HydrophobicContact CG-CB 4.17Å
367	H	68.3	Low	83.6	Confident	29 Å²	29	67.6 Å²	67.6	13%	0.134	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	92.4	168.4	-176	81.4	0	0	0	108.3	T70 Y71 N369 H370	T70-H367 PolarHBondContact OG1-CE1 2.73Å; T70-H367 VanDerWaalsContact OG1-CE1 3.27Å; T70-H367 PolarHBondContact OG1-ND1 2.93Å; T70-H367 VanDerWaalsContact OG1-ND1 3.17Å; Y71-H367 HydrophobicContact CD1-CB 4.26Å; Y71-H367 HydrophobicContact CE1-CB 4.06Å; Y71-H367 PolarHBondContact O-ND1 3.5Å; H367-N369 PolarHBondContact O-N 2.95Å; H367-H370 PolarHBondContact N-O 3.2Å; H367-H370 PolarHBondContact O-N 2.94Å
368	A	64.6	Low	83.6	Confident	21 Å²	21	62.2 Å²	62.2	17%	0.174	29%	0.294	C	S	.	.	T	Hydrogen-bonded Turn	trans	49	-106.4	-169.9	0	0	0	0	0	110.9	T51	T51-A368 HydrophobicContact CG2-CB 4.22Å
369	N	66.2	Low	83.6	Confident	102 Å²	102	61 Å²	61	55%	0.545	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.3	-6.4	-178.8	-63.6	-31.6	0	0	0	114.7	H367	H367-N369 PolarHBondContact O-N 2.95Å
370	H	71.8	Confident	83.4	Confident	145 Å²	145	53.1 Å²	53.1	67%	0.671	26%	0.257	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-100	137.3	-179.2	-69.4	-74.7	0	0	0	111.6	H367	H367-H370 PolarHBondContact N-O 3.2Å; H367-H370 PolarHBondContact O-N 2.94Å
371	M	80.1	Confident	83.3	Confident	68 Å²	68	53.3 Å²	53.3	34%	0.335	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	123	-178.9	-64.7	-177.8	-87.4	0	0	109.7	F330 L333 M366 F386	F330-M371 HydrophobicContact CD2-CE 4.18Å; F330-M371 HydrophobicContact CE2-CE 4.2Å; L333-M371 HydrophobicContact CD2-SD 4.37Å; M366-M371 HydrophobicContact CE-CG 3.92Å; M366-M371 HydrophobicContact SD-CG 3.59Å; M366-M371 VanDerWaalsContact SD-CG 3.59Å; M366-M371 HydrophobicContact SD-SD 4.3Å; M371-F386 HydrophobicContact SD-CE2 4.43Å; M371-F386 HydrophobicContact SD-CZ 3.61Å
372	E	84.4	Confident	83.3	Confident	91 Å²	91	47.3 Å²	47.3	43%	0.425	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	121.4	174.1	-171.8	-179.7	169.4	0	0	109.2	Y71 V364 R365	Y71-E372 PolarHBondContact OH-OE2 2.92Å; V364-E372 CarbonylContact C-O 3.53Å; V364-E372 VanDerWaalsContact CA-O 3.24Å; V364-E372 WeakPolarHBondContact CA-O 3.32Å; R365-E372 PolarHBondContact N-O 3.18Å; R365-E372 PolarHBondContact O-N 3.23Å
373	D	87.3	Confident	83.3	Confident	95 Å²	95	42.9 Å²	42.9	51%	0.508	22%	0.215	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-71	131	177.1	-78.9	-52.4	0	0	0	111.2	R362 V364	R362-D373 IonicContact CZ-OD1 3.12Å; R362-D373 VanDerWaalsContact CZ-OD1 3.27Å; R362-D373 IonicContact CZ-OD2 2.9Å; R362-D373 IonicContact NE-OD1 3.68Å; R362-D373 PolarHBondContact NE-OD1 3.37Å; R362-D373 IonicContact NE-OD2 3.84Å; R362-D373 VanDerWaalsContact NH2-CG 3.28Å; R362-D373 IonicContact NH2-OD1 3.68Å; R362-D373 PolarHBondContact NH2-OD1 3.15Å; R362-D373 VanDerWaalsContact NH2-OD1 3.07Å; R362-D373 IonicContact NH2-OD2 3.48Å; R362-D373 PolarHBondContact NH2-OD2 3.32Å; V364-D373 WeakPolarHBondContact CG1-OD1 3.32Å
374	V	87.4	Confident	83.3	Confident	25 Å²	25	42.8 Å²	42.8	15%	0.152	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	136.4	179.1	-175.2	0	0	0	0	109.7	L363 R365 S376	L363-V374 WeakPolarHBondContact CB-O 3.18Å; L363-V374 PolarHBondContact O-N 3.1Å; R365-V374 HydrophobicContact CB-CG2 4.08Å; R365-V374 HydrophobicContact CG-CG2 3.67Å; V374-S376 WeakPolarHBondContact CG1-O 3.49Å
375	E	88.6	Confident	83.4	Confident	156 Å²	156	42.8 Å²	42.8	73%	0.729	21%	0.214	S	C	*	.	S	Bend	trans	-74.7	-40.2	179.4	-65.1	-176.2	156.7	0	0	112.5	S344 R345	S344-E375 WeakPolarHBondContact CA-O 3.46Å; R345-E375 PolarHBondContact N-O 2.86Å
376	S	89.9	Confident	83.6	Confident	25 Å²	25	41.4 Å²	41.4	18%	0.175	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.5	140.8	-174.8	62.3	0	0	0	0	111.8	I343 V374	I343-S376 CarbonylContact O-C 3.43Å; I343-S376 VanDerWaalsContact O-CA 3.28Å; I343-S376 WeakPolarHBondContact O-CA 3.38Å; V374-S376 WeakPolarHBondContact CG1-O 3.49Å
377	A	90.2	Very high	83.9	Confident	1 Å²	1	43 Å²	43	1%	0.008	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	146	172.2	0	0	0	0	0	110.4	I338 A342 I343 D381 C383	I338-A377 HydrophobicContact CD1-CB 3.46Å; I338-A377 VanDerWaalsContact CD1-CB 3.46Å; A342-A377 WeakPolarHBondContact CA-O 3.47Å; I343-A377 HydrophobicContact CG2-CB 4.02Å; I343-A377 PolarHBondContact N-O 3.24Å; I343-A377 PolarHBondContact O-N 3.14Å; A377-D381 HydrophobicContact CB-CB 4.28Å; A377-C383 HydrophobicContact CB-CB 4.33Å
378	F	91.3	Very high	84.7	Confident	29 Å²	29	41.8 Å²	41.8	13%	0.127	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	168.3	-172.9	-60.8	-93.1	0	0	0	111.7	P3 R312 A342 G380 D381	P3-F378 HydrophobicContact CB-CD1 4.29Å; P3-F378 HydrophobicContact CB-CD2 3.97Å; P3-F378 HydrophobicContact CB-CE1 4.29Å; P3-F378 HydrophobicContact CB-CE2 3.97Å; P3-F378 HydrophobicContact CB-CG 4.14Å; P3-F378 HydrophobicContact CB-CZ 4.14Å; R312-F378 HydrophobicContact CB-CB 4.2Å; R312-F378 HydrophobicContact CG-CB 4.35Å; A342-F378 HydrophobicContact CB-CD1 3.7Å; A342-F378 HydrophobicContact CB-CE1 3.97Å; A342-F378 HydrophobicContact CB-CG 4.43Å; F378-G380 PolarHBondContact O-N 3.49Å; F378-D381 PolarHBondContact N-OD2 3.14Å; F378-D381 VanDerWaalsContact O-CB 3.25Å; F378-D381 WeakPolarHBondContact O-CB 3.35Å; F378-D381 PolarHBondContact O-N 2.88Å
379	S	90.1	Very high	85.5	Confident	4 Å²	4	46.8 Å²	46.8	3%	0.028	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	-44.7	128.1	173	176.9	0	0	0	0	113.2	R312 Y339 G341	R312-S379 VanDerWaalsContact CG-O 3.31Å; R312-S379 WeakPolarHBondContact CG-O 3.42Å; R312-S379 PolarHBondContact NH1-O 3.25Å; Y339-S379 VanDerWaalsContact C-OG 3.23Å; Y339-S379 PolarHBondContact O-OG 2.85Å; G341-S379 PolarHBondContact O-N 3.36Å
380	G	86.4	Confident	86.4	Confident	1 Å²	1	42.4 Å²	42.4	1%	0.01	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	92.6	-12.7	-175.6	0	0	0	0	0	114.8	N11 I338 F378	N11-G380 PolarHBondContact ND2-O 3.25Å; I338-G380 PolarHBondContact O-N 3.49Å; F378-G380 PolarHBondContact O-N 3.49Å
381	D	88.3	Confident	86.9	Confident	5 Å²	5	36.9 Å²	36.9	3%	0.027	20%	0.202	C	C	.	.			trans	-79.9	147.3	175.7	-67.6	-9.3	0	0	0	111.8	R312 I338 R365 A377 F378	R312-D381 IonicContact CZ-OD1 3.9Å; R312-D381 VanDerWaalsContact CZ-OD1 3.27Å; R312-D381 IonicContact NH1-OD1 3.14Å; R312-D381 PolarHBondContact NH1-OD1 3.45Å; R312-D381 IonicContact NH1-OD2 2.96Å; R312-D381 IonicContact NH2-OD1 2.74Å; R312-D381 PolarHBondContact NH2-OD1 3.15Å; R312-D381 IonicContact NH2-OD2 3.62Å; R312-D381 PolarHBondContact NH2-OD2 2.9Å; I338-D381 PolarHBondContact N-O 3.31Å; R365-D381 IonicContact NH2-OD1 3.18Å; R365-D381 IonicContact NH2-OD2 2.86Å; R365-D381 PolarHBondContact NH2-OD2 3.16Å; A377-D381 HydrophobicContact CB-CB 4.28Å; F378-D381 PolarHBondContact N-OD2 3.14Å; F378-D381 VanDerWaalsContact O-CB 3.25Å; F378-D381 WeakPolarHBondContact O-CB 3.35Å; F378-D381 PolarHBondContact O-N 2.88Å
382	I	88.5	Confident	87	Confident	20 Å²	20	34.5 Å²	34.5	10%	0.103	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	125.5	166.2	-62.7	171.3	0	0	0	107.6	N80 I82 V100 F323 R337	N80-I382 HydrophobicContact CB-CD1 4.25Å; I82-I382 HydrophobicContact CD1-CD1 4.21Å; V100-I382 HydrophobicContact CG1-CD1 4.46Å; F323-I382 HydrophobicContact CE1-CG2 3.98Å; F323-I382 HydrophobicContact CZ-CG2 3.94Å; R337-I382 HydrophobicContact CB-CG1 4.35Å
383	C	89.3	Confident	87	Confident	4 Å²	4	30.5 Å²	30.5	3%	0.027	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144	170	176.4	60.1	0	0	0	0	110.8	Y335 F336 A377	Y335-C383 WeakPolarHBondContact CA-O 3.42Å; F336-C383 WeakPolarHBondContact CE2-SG 3.35Å; F336-C383 WeakPolarHBondContact CZ-SG 3.41Å; F336-C383 PolarHBondContact N-O 2.64Å; F336-C383 PolarHBondContact O-N 2.72Å; F336-C383 VanDerWaalsContact O-N 3.09Å; F336-C383 VanDerWaalsContact O-O 3.13Å; A377-C383 HydrophobicContact CB-CB 4.33Å
384	A	89.7	Confident	87.1	Confident	0 Å²	0	26.4 Å²	26.4	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	155.1	177	0	0	0	0	0	111.2	T334 Y335 V364 M366	T334-A384 WeakPolarHBondContact O-CA 3.08Å; Y335-A384 HydrophobicContact CD1-CB 4.11Å; Y335-A384 HydrophobicContact CD2-CB 4.44Å; Y335-A384 HydrophobicContact CE1-CB 4.4Å; Y335-A384 HydrophobicContact CG-CB 4.14Å; V364-A384 HydrophobicContact CG2-CB 3.99Å; V364-A384 WeakPolarHBondContact CG2-O 3.23Å; V364-A384 PolarHBondContact N-O 2.9Å; V364-A384 PolarHBondContact O-N 3.23Å; M366-A384 HydrophobicContact CG-CB 4.17Å
385	T	90.1	Very high	87.2	Confident	0 Å²	0	25.5 Å²	25.5	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	159.3	173.6	-169.2	0	0	0	0	110.8	L333 T334 F336 R362 L388	L333-T385 WeakPolarHBondContact CA-O 3.5Å; T334-T385 PolarHBondContact N-O 3.38Å; T334-T385 PolarHBondContact O-N 3.33Å; F336-T385 HydrophobicContact CD1-CG2 4.39Å; F336-T385 HydrophobicContact CE1-CG2 3.68Å; R362-T385 WeakPolarHBondContact O-CA 3.43Å; R362-T385 WeakPolarHBondContact O-CB 3.24Å; R362-T385 PolarHBondContact O-OG1 2.89Å; T385-L388 HydrophobicContact CG2-CD1 3.08Å; T385-L388 HydrophobicContact CG2-CG 3.69Å
386	F	88.2	Confident	87.4	Confident	27 Å²	27	18.2 Å²	18.2	12%	0.118	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	147.7	-175.5	-67.6	-94.5	0	0	0	111.8	F330 Q332 L333 R362 V364 M371 L388	F330-F386 HydrophobicContact CB-CE1 4.11Å; Q332-F386 WeakPolarHBondContact O-CA 3.32Å; L333-F386 HydrophobicContact CD1-CD1 3.8Å; L333-F386 HydrophobicContact CD1-CE1 3.29Å; L333-F386 HydrophobicContact CD1-CZ 4.01Å; L333-F386 HydrophobicContact CD2-CE1 4.15Å; L333-F386 HydrophobicContact CD2-CZ 4.01Å; L333-F386 HydrophobicContact CG-CD1 3.95Å; L333-F386 HydrophobicContact CG-CE1 3.56Å; L333-F386 HydrophobicContact CG-CZ 3.88Å; R362-F386 HydrophobicContact CB-CD2 4.24Å; R362-F386 HydrophobicContact CG-CD2 4.46Å; V364-F386 HydrophobicContact CG1-CE2 3.92Å; V364-F386 HydrophobicContact CG2-CE2 3.89Å; M371-F386 HydrophobicContact SD-CE2 4.43Å; M371-F386 HydrophobicContact SD-CZ 3.61Å; F386-L388 VanDerWaalsContact C-N 3.32Å; F386-L388 PolarHBondContact O-N 3.18Å
387	G	81.4	Confident	87.5	Confident	55 Å²	55	17.2 Å²	17.2	57%	0.567	11%	0.107	S	C	*	.	S	Bend	trans	76.1	17	165.7	0	0	0	0	0	114.7	Q332	Q332-G387 PolarHBondContact O-N 3.38Å
388	L	84	Confident	87.4	Confident	4 Å²	4	19.8 Å²	19.8	2%	0.021	12%	0.123	C	C	.	.			trans	-80.9	120.4	169.5	-77.2	174	0	0	0	110.2	Q332 T334 I349 T358 T385 F386 C390 F396	Q332-L388 PolarHBondContact NE2-O 3.32Å; T334-L388 HydrophobicContact CG2-CD1 4.04Å; I349-L388 HydrophobicContact CD1-CD1 4.09Å; I349-L388 HydrophobicContact CD1-CD2 3.91Å; I349-L388 HydrophobicContact CG1-CD2 4.38Å; T358-L388 HydrophobicContact CG2-CD2 3.63Å; T385-L388 HydrophobicContact CG2-CD1 3.08Å; T385-L388 HydrophobicContact CG2-CG 3.69Å; F386-L388 VanDerWaalsContact C-N 3.32Å; F386-L388 PolarHBondContact O-N 3.18Å; L388-C390 PolarHBondContact O-N 3.25Å; L388-F396 HydrophobicContact CD1-CE1 4.37Å; L388-F396 HydrophobicContact CD1-CE2 4.36Å; L388-F396 HydrophobicContact CD1-CZ 3.98Å; L388-F396 HydrophobicContact CD2-CE1 3.9Å; L388-F396 HydrophobicContact CD2-CZ 4.12Å; L388-F396 HydrophobicContact CG-CZ 4.49Å
389	E	81.8	Confident	86.8	Confident	126 Å²	126	20.7 Å²	20.7	59%	0.589	13%	0.129	S	C	*	.			trans	-83.5	101.5	166.2	-69	-174.4	154.2	0	0	109.8	K356	K356-E389 IonicContact NZ-OE2 2.79Å; K356-E389 PolarHBondContact NZ-OE2 3.04Å
390	C	84.7	Confident	86.2	Confident	10 Å²	10	24.4 Å²	24.4	7%	0.068	16%	0.155	C	C	.	.			trans	-148.5	168.5	176	59.3	0	0	0	0	111.8	L325 T334 L388 D394 F396	L325-C390 VanDerWaalsContact CD1-O 3.29Å; L325-C390 WeakPolarHBondContact CD1-O 3.28Å; T334-C390 VanDerWaalsContact CG2-SG 3.53Å; T334-C390 PolarHBondContact OG1-SG 2.91Å; L388-C390 PolarHBondContact O-N 3.25Å; C390-D394 HydrophobicContact CB-CB 4.14Å; C390-D394 WeakPolarHBondContact CB-OD2 3.41Å; C390-F396 HydrophobicContact CB-CE2 4.11Å; C390-F396 HydrophobicContact CB-CZ 3.65Å
391	A	83.5	Confident	85.5	Confident	28 Å²	28	27.3 Å²	27.3	23%	0.231	18%	0.175	C	C	.	.			trans	-96.6	158.2	166.5	0	0	0	0	0	110	G393 D394	A391-G393 PolarHBondContact O-N 3.42Å; A391-D394 PolarHBondContact N-OD2 2.91Å; A391-D394 WeakPolarHBondContact O-CB 3.39Å; A391-D394 PolarHBondContact O-N 2.98Å
392	S	82.9	Confident	84.8	Confident	18 Å²	18	32.6 Å²	32.6	13%	0.126	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.9	130.8	170.8	-168.3	0	0	0	0	109.7	R96 F323	R96-S392 WeakPolarHBondContact CD-OG 3.46Å; R96-S392 PolarHBondContact NH1-OG 3.32Å; F323-S392 PolarHBondContact O-OG 2.89Å; F323-S392 VanDerWaalsContact O-OG 3.05Å
393	G	84	Confident	84.2	Confident	8 Å²	8	35.7 Å²	35.7	8%	0.082	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	97.9	-6.1	-174.2	0	0	0	0	0	114.8	L321 A322 A391	L321-G393 WeakPolarHBondContact CD1-O 3.47Å; A322-G393 VanDerWaalsContact O-CA 3.31Å; A322-G393 WeakPolarHBondContact O-CA 3.35Å; A322-G393 PolarHBondContact O-N 2.8Å; A391-G393 PolarHBondContact O-N 3.42Å
394	D	88.2	Confident	83.8	Confident	9 Å²	9	35.8 Å²	35.8	5%	0.048	21%	0.208	C	C	.	.			trans	-67.6	135.8	177.8	-76.7	-10.4	0	0	0	111.4	A322 N351 R353 C390 A391 F396	A322-D394 PolarHBondContact N-O 3.44Å; N351-D394 PolarHBondContact ND2-OD2 3.34Å; R353-D394 IonicContact CZ-OD1 2.91Å; R353-D394 IonicContact CZ-OD2 3.72Å; R353-D394 IonicContact NE-OD1 2.66Å; R353-D394 PolarHBondContact NE-OD1 2.86Å; R353-D394 IonicContact NE-OD2 3.47Å; R353-D394 IonicContact NH2-OD1 3.74Å; R353-D394 PolarHBondContact NH2-OD1 2.99Å; R353-D394 IonicContact NH2-OD2 2.94Å; R353-D394 PolarHBondContact NH2-OD2 2.78Å; C390-D394 HydrophobicContact CB-CB 4.14Å; C390-D394 WeakPolarHBondContact CB-OD2 3.41Å; A391-D394 PolarHBondContact N-OD2 2.91Å; A391-D394 WeakPolarHBondContact O-CB 3.39Å; A391-D394 PolarHBondContact O-N 2.98Å; D394-F396 HydrophobicContact CB-CE2 4.46Å
395	T	90.9	Very high	83.5	Confident	6 Å²	6	38 Å²	38	4%	0.037	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91	136.5	173.7	-57.2	0	0	0	0	110.3	V319 G320 A352 V397 L406	V319-T395 HydrophobicContact CG1-CG2 4.24Å; G320-T395 WeakPolarHBondContact O-CA 3.26Å; A352-T395 WeakPolarHBondContact CB-O 3.44Å; A352-T395 PolarHBondContact N-O 3.08Å; T395-V397 HydrophobicContact CG2-CG1 4.31Å; T395-L406 HydrophobicContact CG2-CB 4.47Å; T395-L406 HydrophobicContact CG2-CD1 3.94Å; T395-L406 HydrophobicContact CG2-CG 3.92Å; T395-L406 WeakPolarHBondContact OG1-CB 3.38Å; T395-L406 PolarHBondContact OG1-N 3.3Å
396	F	91.8	Very high	83.1	Confident	3 Å²	3	38.1 Å²	38.1	1%	0.013	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	134.5	175.9	-71.8	-84.2	0	0	0	111.2	F318 V319 G320 A322 I349 I350 N351 L388 C390 D394	F318-F396 HydrophobicContact CE1-CB 3.9Å; V319-F396 WeakPolarHBondContact CA-O 3.44Å; G320-F396 PolarHBondContact N-O 3.1Å; G320-F396 PolarHBondContact O-N 3.16Å; A322-F396 HydrophobicContact CB-CD2 4.19Å; A322-F396 HydrophobicContact CB-CE2 3.74Å; I349-F396 HydrophobicContact CB-CD1 4.39Å; I349-F396 HydrophobicContact CD1-CB 4.29Å; I349-F396 HydrophobicContact CD1-CD1 3.66Å; I349-F396 HydrophobicContact CD1-CE1 4.14Å; I349-F396 HydrophobicContact CD1-CG 4.05Å; I349-F396 HydrophobicContact CG1-CD1 3.99Å; I350-F396 WeakPolarHBondContact O-CA 3.45Å; N351-F396 HydrophobicContact CB-CD1 4.17Å; N351-F396 HydrophobicContact CB-CE1 3.83Å; N351-F396 HydrophobicContact CB-CZ 4.5Å; L388-F396 HydrophobicContact CD1-CE1 4.37Å; L388-F396 HydrophobicContact CD1-CE2 4.36Å; L388-F396 HydrophobicContact CD1-CZ 3.98Å; L388-F396 HydrophobicContact CD2-CE1 3.9Å; L388-F396 HydrophobicContact CD2-CZ 4.12Å; L388-F396 HydrophobicContact CG-CZ 4.49Å; C390-F396 HydrophobicContact CB-CE2 4.11Å; C390-F396 HydrophobicContact CB-CZ 3.65Å; D394-F396 HydrophobicContact CB-CE2 4.46Å
397	V	91.6	Very high	82.4	Confident	4 Å²	4	41.1 Å²	41.1	2%	0.024	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	155.7	179.8	-62.9	0	0	0	0	111.9	F318 V319 I350 T395 D399 M404	F318-V397 VanDerWaalsContact O-CA 3.28Å; F318-V397 WeakPolarHBondContact O-CA 3.43Å; V319-V397 HydrophobicContact CG1-CG1 4.49Å; V319-V397 HydrophobicContact CG2-CG1 4.31Å; I350-V397 HydrophobicContact CB-CG2 4.41Å; I350-V397 PolarHBondContact N-O 3.46Å; I350-V397 PolarHBondContact O-N 2.83Å; T395-V397 HydrophobicContact CG2-CG1 4.31Å; V397-D399 WeakPolarHBondContact CG2-O 3.45Å; V397-M404 HydrophobicContact CG1-CB 4.13Å
398	T	88.1	Confident	82	Confident	55 Å²	55	44.7 Å²	44.7	34%	0.337	25%	0.247	S	C	.	.	S	Bend	trans	-89	-28.3	170	46.1	0	0	0	0	113.2	F318 I349	F318-T398 HydrophobicContact CB-CG2 3.61Å; F318-T398 HydrophobicContact CD1-CG2 4.3Å; F318-T398 HydrophobicContact CG-CG2 4.34Å; F318-T398 PolarHBondContact N-OG1 3.39Å; F318-T398 PolarHBondContact O-N 3.22Å; I349-T398 HydrophobicContact CG2-CG2 4.39Å
399	D	80.1	Confident	81.8	Confident	48 Å²	48	45.4 Å²	45.4	26%	0.257	25%	0.251	S	S	.	.			trans	-88	116.9	-178.1	-175.7	8.6	0	0	0	111.1	P317 V397 S401	P317-D399 HydrophobicContact CB-CB 4.25Å; V397-D399 WeakPolarHBondContact CG2-O 3.45Å; D399-S401 VanDerWaalsContact C-N 3.32Å; D399-S401 VanDerWaalsContact OD1-CB 3.26Å; D399-S401 WeakPolarHBondContact OD1-CB 3.02Å; D399-S401 PolarHBondContact OD1-N 3.14Å; D399-S401 PolarHBondContact OD1-OG 3.31Å; D399-S401 PolarHBondContact OD2-OG 2.96Å
400	S	76.4	Confident	81.7	Confident	81 Å²	81	43.6 Å²	43.6	57%	0.566	24%	0.242	S	C	*	.	S	Bend	trans	-78.4	-17.8	175.3	54.9	0	0	0	0	113.3	R402	S400-R402 VanDerWaalsContact C-N 3.27Å; S400-R402 PolarHBondContact O-N 2.97Å
401	S	72.6	Confident	81.6	Confident	63 Å²	63	46.1 Å²	46.1	44%	0.441	26%	0.257	S	S	.	.	S	Bend	trans	-75.5	-19.1	-173.7	75	0	0	0	0	112.7	Q295 D399	Q295-S401 PolarHBondContact NE2-O 2.96Å; D399-S401 VanDerWaalsContact C-N 3.32Å; D399-S401 VanDerWaalsContact OD1-CB 3.26Å; D399-S401 WeakPolarHBondContact OD1-CB 3.02Å; D399-S401 PolarHBondContact OD1-N 3.14Å; D399-S401 PolarHBondContact OD1-OG 3.31Å; D399-S401 PolarHBondContact OD2-OG 2.96Å
402	R	72.9	Confident	81.2	Confident	115 Å²	115	46 Å²	46	43%	0.434	25%	0.254	S	S	.	.	S	Bend	trans	-122.5	118	-178.9	-66.2	-179.9	169.8	-159.9	-1.8	109.6	E306 S400 M404	E306-R402 IonicContact OE1-NH1 2.73Å; E306-R402 IonicContact OE2-NH1 3.27Å; S400-R402 VanDerWaalsContact C-N 3.27Å; S400-R402 PolarHBondContact O-N 2.97Å; R402-M404 HydrophobicContact CB-CE 3.82Å; R402-M404 HydrophobicContact CB-CG 4.1Å; R402-M404 VanDerWaalsContact CD-CE 3.46Å; R402-M404 HydrophobicContact CG-CE 4.3Å; R402-M404 PolarHBondContact O-N 3.15Å; R402-M404 VanDerWaalsContact O-N 3.16Å
403	K	75.6	Confident	80.7	Confident	86 Å²	86	48.6 Å²	48.6	37%	0.374	28%	0.277	S	S	.	.			trans	-79.3	101.1	170.5	-69.6	179.5	-177	175.2	0	108.5	E293 M355	E293-K403 HydrophobicContact CB-CB 4.01Å; E293-K403 HydrophobicContact CB-CD 4.48Å; E293-K403 PolarHBondContact N-O 3.24Å; E293-K403 IonicContact OE1-NZ 3.66Å; E293-K403 PolarHBondContact OE1-NZ 2.75Å; E293-K403 WeakPolarHBondContact OE2-CD 3.37Å; E293-K403 IonicContact OE2-NZ 3.94Å; E293-K403 PolarHBondContact OE2-NZ 2.95Å; E293-K403 VanDerWaalsContact OE2-NZ 3.11Å; M355-K403 HydrophobicContact SD-CG 4.38Å
404	M	81.1	Confident	80.6	Confident	5 Å²	5	50.6 Å²	50.6	3%	0.025	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	129.1	178.1	-58.5	-174.9	174.6	0	0	109.5	V290 N291 V292 V319 A352 V397 R402	V290-M404 HydrophobicContact CG2-CB 3.79Å; N291-M404 CarbonylContact O-C 3.58Å; N291-M404 WeakPolarHBondContact O-CA 3.04Å; V292-M404 HydrophobicContact CG2-CG 4.2Å; V319-M404 HydrophobicContact CG2-SD 4.03Å; A352-M404 WeakPolarHBondContact CB-O 3.49Å; V397-M404 HydrophobicContact CG1-CB 4.13Å; R402-M404 HydrophobicContact CB-CE 3.82Å; R402-M404 HydrophobicContact CB-CG 4.1Å; R402-M404 VanDerWaalsContact CD-CE 3.46Å; R402-M404 HydrophobicContact CG-CE 4.3Å; R402-M404 PolarHBondContact O-N 3.15Å; R402-M404 VanDerWaalsContact O-N 3.16Å
405	A	83.7	Confident	80	Confident	47 Å²	47	51.8 Å²	51.8	39%	0.388	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	125	173.6	0	0	0	0	0	109.4	V290 N291	V290-A405 WeakPolarHBondContact CG2-O 3.31Å; N291-A405 WeakPolarHBondContact CB-O 3.44Å; N291-A405 PolarHBondContact N-O 3.35Å; N291-A405 PolarHBondContact O-N 2.76Å
406	L	82.8	Confident	79.5	Confident	2 Å²	2	52 Å²	52	1%	0.01	30%	0.297	C	S	.	.	P	Polyproline II helix	trans	-71.1	154.3	169	-67.3	165.4	0	0	0	109.4	T289 V290 L308 V319 L321 Y339 T395 N408	T289-L406 WeakPolarHBondContact O-CD2 3.39Å; V290-L406 HydrophobicContact CB-CD2 3.96Å; V290-L406 HydrophobicContact CG2-CD2 3.87Å; V290-L406 HydrophobicContact CG2-CG 4.2Å; L308-L406 HydrophobicContact CD1-CD2 3.89Å; V319-L406 HydrophobicContact CG1-CD1 4.13Å; V319-L406 HydrophobicContact CG1-CD2 4.4Å; V319-L406 HydrophobicContact CG1-CG 4.33Å; L321-L406 HydrophobicContact CB-CD1 3.65Å; L321-L406 HydrophobicContact CD1-CB 4.27Å; L321-L406 HydrophobicContact CD1-CD1 4.26Å; L321-L406 HydrophobicContact CG-CD1 4.42Å; Y339-L406 HydrophobicContact CD2-CD1 3.83Å; Y339-L406 HydrophobicContact CE2-CD1 4Å; T395-L406 HydrophobicContact CG2-CB 4.47Å; T395-L406 HydrophobicContact CG2-CD1 3.94Å; T395-L406 HydrophobicContact CG2-CG 3.92Å; T395-L406 WeakPolarHBondContact OG1-CB 3.38Å; T395-L406 PolarHBondContact OG1-N 3.3Å; L406-N408 PolarHBondContact O-N 3.1Å
407	E	73.6	Confident	79.3	Confident	91 Å²	91	53.8 Å²	53.8	43%	0.425	31%	0.31	S	S	.	.	P	Polyproline II helix	trans	-54.2	128.8	176.4	-68.4	-178.2	166.3	0	0	111.4	R99	R99-E407 PolarHBondContact NE-O 3.15Å
408	N	72.1	Confident	79.2	Confident	130 Å²	130	54.8 Å²	54.8	70%	0.695	32%	0.315	S	S	*	.	P	Polyproline II helix	trans	-63.9	149.8	177.8	-71.5	-28.4	0	0	0	111	L406	L406-N408 PolarHBondContact O-N 3.1Å
409	I	79.8	Confident	79.3	Confident	18 Å²	18	52.5 Å²	52.5	9%	0.092	30%	0.301	C	S	.	.	P	Polyproline II helix	trans	-64.8	139.6	170.1	-58.9	129.2	0	0	0	108.5	E95 R96 R99 V411	E95-I409 HydrophobicContact CB-CG2 3.64Å; R96-I409 HydrophobicContact CG-CB 4.5Å; R96-I409 HydrophobicContact CG-CD1 3.72Å; R96-I409 HydrophobicContact CG-CG1 4.05Å; R96-I409 HydrophobicContact CG-CG2 3.95Å; R99-I409 HydrophobicContact CB-CG1 4.47Å; R99-I409 HydrophobicContact CG-CG1 4.41Å; I409-V411 PolarHBondContact O-N 2.81Å; I409-V411 VanDerWaalsContact O-N 3.15Å
410	H	80.6	Confident	79.9	Confident	88 Å²	88	50.3 Å²	50.3	41%	0.407	29%	0.29	S	S	.	.			trans	-68.5	111.6	170.2	-179.9	78.2	0	0	0	109.8	R127 Y128 P412	R127-H410 VanDerWaalsContact CZ-CD2 3.42Å; R127-H410 PolarHBondContact NH1-CD2 2.92Å; R127-H410 PolarHBondContact NH2-CD2 3.23Å; Y128-H410 PolarHBondContact OH-N 2.94Å; H410-P412 WeakPolarHBondContact O-CD 3.39Å
411	V	81.4	Confident	80.5	Confident	63 Å²	63	50.9 Å²	50.9	38%	0.382	28%	0.282	S	S	.	.			trans	-97.1	112.7	177.2	-176	0	0	0	0	108.6	I409 P443 T444	I409-V411 PolarHBondContact O-N 2.81Å; I409-V411 VanDerWaalsContact O-N 3.15Å; V411-P443 HydrophobicContact CB-CG 4.49Å; V411-P443 HydrophobicContact CG1-CB 3.96Å; V411-P443 HydrophobicContact CG1-CG 3.97Å; V411-P443 HydrophobicContact CG2-CB 3.95Å; V411-P443 HydrophobicContact CG2-CG 3.62Å; V411-T444 HydrophobicContact CG1-CG2 3.76Å
412	P	75.5	Confident	81.5	Confident	25 Å²	25	49.7 Å²	49.7	16%	0.162	27%	0.272	C	S	.	.	P	Polyproline II helix	trans	-67.1	150.4	174.8	27.8	-33.5	0	0	0	111	H410 T444 M461	H410-P412 WeakPolarHBondContact O-CD 3.39Å; P412-T444 HydrophobicContact CG-CG2 3.95Å; P412-M461 HydrophobicContact CB-CE 3.68Å; P412-M461 HydrophobicContact CB-SD 3.89Å; P412-M461 HydrophobicContact CG-CE 3.62Å; P412-M461 HydrophobicContact CG-SD 3.63Å
413	A	72.9	Confident	82.3	Confident	74 Å²	74	50.4 Å²	50.4	61%	0.612	28%	0.278	S	S	*	.	P	Polyproline II helix	trans	-69.2	138.8	175.5	0	0	0	0	0	110.6
414	P	81.2	Confident	82.9	Confident	50 Å²	50	48.4 Å²	48.4	33%	0.325	28%	0.275	S	S	.	.	P	Polyproline II helix	trans	-65.3	136.7	177.3	27.2	-33.8	0	0	0	110.9	G460	P414-G460 CarbonylContact C-O 3.6Å; P414-G460 WeakPolarHBondContact CA-O 3.3Å
415	V	75.7	Confident	83.1	Confident	33 Å²	33	59.6 Å²	59.6	20%	0.2	32%	0.317	C	S	.	.			trans	-108.8	-14.9	-175	-64.1	0	0	0	0	113.9	G460 M461 I665 Y678	V415-G460 PolarHBondContact N-O 3.23Å; V415-M461 WeakPolarHBondContact CG2-O 3.39Å; V415-I665 HydrophobicContact CG2-CD1 4.34Å; V415-I665 HydrophobicContact CG2-CG1 4.07Å; V415-Y678 PolarHBondContact O-OH 2.9Å
416	V	81.1	Confident	83.3	Confident	10 Å²	10	66.6 Å²	66.6	6%	0.061	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	140.9	175.7	179.2	0	0	0	0	109.7	L418 S459 G460 E463 L466 I665	V416-L418 HydrophobicContact CG1-CD2 4.46Å; V416-L418 HydrophobicContact CG1-CG 4.08Å; V416-S459 CarbonylContact O-C 3.53Å; V416-S459 WeakPolarHBondContact O-CA 3.37Å; V416-S459 WeakPolarHBondContact O-CB 3.4Å; V416-G460 PolarHBondContact N-O 2.82Å; V416-G460 PolarHBondContact O-N 2.63Å; V416-E463 HydrophobicContact CG1-CG 3.99Å; V416-E463 HydrophobicContact CG2-CG 4.44Å; V416-L466 HydrophobicContact CB-CD1 4.38Å; V416-L466 HydrophobicContact CG1-CD1 3.8Å; V416-I665 HydrophobicContact CG2-CB 4.41Å; V416-I665 HydrophobicContact CG2-CG2 3.37Å
417	S	86.3	Confident	83.6	Confident	42 Å²	42	68.4 Å²	68.4	29%	0.294	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	128.8	170.6	-62.8	0	0	0	0	110.2	V458 S459 P486	S417-V458 CarbonylContact C-O 3.6Å; S417-V458 WeakPolarHBondContact CA-O 3.46Å; S417-S459 PolarHBondContact OG-OG 2.76Å; S417-P486 WeakPolarHBondContact O-CD 3.4Å; S417-P486 WeakPolarHBondContact O-CG 3.25Å
418	L	89.3	Confident	84.2	Confident	25 Å²	25	66 Å²	66	13%	0.131	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	151.4	177.9	-63.6	178.7	0	0	0	110.5	V416 I457 V458 L466 L483	V416-L418 HydrophobicContact CG1-CD2 4.46Å; V416-L418 HydrophobicContact CG1-CG 4.08Å; L418-I457 WeakPolarHBondContact O-CA 3.33Å; L418-V458 HydrophobicContact CB-CG2 4.43Å; L418-V458 PolarHBondContact N-O 2.77Å; L418-V458 WeakPolarHBondContact O-CG2 3.35Å; L418-V458 PolarHBondContact O-N 3.44Å; L418-L466 HydrophobicContact CB-CD1 4.03Å; L418-L466 HydrophobicContact CD1-CB 4.18Å; L418-L466 HydrophobicContact CD1-CD1 3.62Å; L418-L466 HydrophobicContact CG-CD1 3.69Å; L418-L483 HydrophobicContact CD1-CD1 4.48Å
419	S	90.8	Very high	85.1	Confident	6 Å²	6	65.7 Å²	65.7	4%	0.042	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	136.1	166.9	60.9	0	0	0	0	109.3	L456 L483 G484 K485	S419-L456 WeakPolarHBondContact CA-O 3.14Å; S419-L483 WeakPolarHBondContact O-CA 3.47Å; S419-G484 PolarHBondContact N-O 3.45Å; S419-G484 PolarHBondContact O-N 2.9Å; S419-G484 VanDerWaalsContact OG-C 3.25Å; S419-G484 WeakPolarHBondContact OG-CA 2.99Å; S419-G484 PolarHBondContact OG-O 3.26Å; S419-K485 PolarHBondContact OG-O 3.21Å
420	M	91.9	Very high	85.5	Confident	3 Å²	3	67.7 Å²	67.7	2%	0.015	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	122	177.8	-171.6	178.3	-80.8	0	0	109.3	F431 L435 L456 V458 M473 V481 E482 L483	M420-F431 HydrophobicContact CG-CE2 3.87Å; M420-F431 HydrophobicContact CG-CZ 4.07Å; M420-F431 HydrophobicContact SD-CE2 3.67Å; M420-F431 HydrophobicContact SD-CZ 4.16Å; M420-L435 HydrophobicContact SD-CD2 4.28Å; M420-L456 PolarHBondContact N-O 3.14Å; M420-V458 HydrophobicContact CB-CG1 4.01Å; M420-V458 HydrophobicContact CB-CG2 4Å; M420-V458 HydrophobicContact CE-CG1 4.19Å; M420-V458 HydrophobicContact CE-CG2 3.83Å; M420-V458 HydrophobicContact SD-CG1 4.03Å; M420-M473 HydrophobicContact CE-CE 4.35Å; M420-M473 HydrophobicContact SD-CE 3.71Å; M420-M473 HydrophobicContact SD-SD 3.92Å; M420-V481 HydrophobicContact CG-CB 4.03Å; M420-V481 HydrophobicContact CG-CG1 4.37Å; M420-V481 HydrophobicContact CG-CG2 4.27Å; M420-V481 HydrophobicContact SD-CG2 4.38Å; M420-E482 WeakPolarHBondContact CA-O 3.41Å; M420-L483 HydrophobicContact CB-CD2 4.29Å; M420-L483 HydrophobicContact CE-CD2 3.46Å; M420-L483 VanDerWaalsContact CE-CD2 3.46Å; M420-L483 HydrophobicContact CG-CD2 4.14Å
421	K	90.5	Very high	86.1	Confident	92 Å²	92	64.4 Å²	64.4	40%	0.4	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	140.3	-179.2	-67.4	177.4	-176.7	167.6	0	110.8	E455 V481 E482	K421-E455 WeakPolarHBondContact CE-OE1 3.36Å; K421-E455 IonicContact NZ-OE1 2.74Å; K421-E455 PolarHBondContact NZ-OE1 3.18Å; K421-V481 CarbonylContact O-C 3.49Å; K421-V481 VanDerWaalsContact O-CA 3.28Å; K421-V481 WeakPolarHBondContact O-CA 3.47Å; K421-E482 PolarHBondContact N-O 3.49Å; K421-E482 PolarHBondContact O-N 3.2Å
422	V	92.1	Very high	86.5	Confident	39 Å²	39	65 Å²	65	24%	0.236	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	131.1	173.4	-167.2	0	0	0	0	109	S424 D427 F431	V422-S424 WeakPolarHBondContact CG1-O 3.36Å; V422-D427 HydrophobicContact CG1-CB 3.92Å; V422-F431 HydrophobicContact CG2-CB 3.69Å; V422-F431 HydrophobicContact CG2-CD1 3.46Å; V422-F431 VanDerWaalsContact CG2-CD1 3.46Å; V422-F431 HydrophobicContact CG2-CD2 3.6Å; V422-F431 HydrophobicContact CG2-CE1 3.82Å; V422-F431 HydrophobicContact CG2-CE2 3.96Å; V422-F431 HydrophobicContact CG2-CG 3.3Å; V422-F431 HydrophobicContact CG2-CZ 4.04Å
423	K	89.8	Confident	87.1	Confident	130 Å²	130	69.9 Å²	69.9	57%	0.565	36%	0.36	S	S	*	.	S	Bend	trans	-67.1	-37.1	178.4	-68.6	-170.6	-172.5	171.4	0	112.6	E480	K423-E480 HydrophobicContact CB-CB 4.49Å; K423-E480 HydrophobicContact CD-CB 3.88Å; K423-E480 HydrophobicContact CG-CB 4.31Å; K423-E480 PolarHBondContact N-O 3.38Å; K423-E480 IonicContact NZ-OE2 3.85Å; K423-E480 PolarHBondContact NZ-OE2 3.43Å
424	S	88.3	Confident	87.9	Confident	43 Å²	43	66.4 Å²	66.4	30%	0.301	33%	0.331	S	S	.	.	S	Bend	trans	-119.1	130.2	-177.7	167.3	0	0	0	0	110.9	V422 K426 D427	V422-S424 WeakPolarHBondContact CG1-O 3.36Å; S424-K426 PolarHBondContact O-N 3.48Å; S424-K426 VanDerWaalsContact O-N 3.14Å; S424-K426 PolarHBondContact OG-N 2.91Å; S424-D427 WeakPolarHBondContact CB-OD2 3.5Å; S424-D427 PolarHBondContact O-N 2.65Å
425	R	85.4	Confident	88.4	Confident	241 Å²	241	64.2 Å²	64.2	91%	0.909	32%	0.317	S	S	*	.	G	3₁₀ helix	trans	-63.1	-19.8	176.9	-70.2	-175	177.8	-175.1	-1.4	113.7	D427	R425-D427 PolarHBondContact O-N 3.29Å
426	K	87.8	Confident	89	Confident	193 Å²	193	66.2 Å²	66.2	84%	0.839	33%	0.326	S	S	*	.	G	3₁₀ helix	trans	-67.9	-23.1	178.3	-63.3	-176.9	179.5	-180	0	112.5	S424	S424-K426 PolarHBondContact O-N 3.48Å; S424-K426 VanDerWaalsContact O-N 3.14Å; S424-K426 PolarHBondContact OG-N 2.91Å
427	D	88.8	Confident	89.2	Confident	40 Å²	40	67.7 Å²	67.7	21%	0.214	33%	0.331	C	S	.	.	G	3₁₀ helix	trans	-96.1	6.4	-172.4	-49.5	-29.8	0	0	0	112.2	V422 S424 R425 D429 N430 F431 C479	V422-D427 HydrophobicContact CG1-CB 3.92Å; S424-D427 WeakPolarHBondContact CB-OD2 3.5Å; S424-D427 PolarHBondContact O-N 2.65Å; R425-D427 PolarHBondContact O-N 3.29Å; D427-D429 VanDerWaalsContact C-N 3.34Å; D427-D429 PolarHBondContact O-N 2.96Å; D427-N430 PolarHBondContact O-N 3.26Å; D427-F431 WeakPolarHBondContact O-CB 3.26Å; D427-F431 PolarHBondContact O-N 3.22Å; D427-C479 HydrophobicContact CB-CB 4.23Å
428	A	87.6	Confident	89.3	Confident	42 Å²	42	65.7 Å²	65.7	35%	0.347	32%	0.317	S	S	.	.	H	α-helix	trans	-58.3	-40	-175.5	0	0	0	0	0	113.3	F431 T432	A428-F431 WeakPolarHBondContact O-CB 3.49Å; A428-F431 PolarHBondContact O-N 3.32Å; A428-T432 PolarHBondContact O-N 3.38Å; A428-T432 PolarHBondContact O-OG1 3.25Å
429	D	89.6	Confident	89.3	Confident	122 Å²	122	66.3 Å²	66.3	65%	0.652	32%	0.323	S	S	*	.	H	α-helix	trans	-68	-40.3	178.6	-70.1	-17.7	0	0	0	112	D427 F431 K433	D427-D429 VanDerWaalsContact C-N 3.34Å; D427-D429 PolarHBondContact O-N 2.96Å; D429-F431 VanDerWaalsContact C-N 3.33Å; D429-K433 VanDerWaalsContact O-CG 3.3Å; D429-K433 WeakPolarHBondContact O-CG 3.45Å; D429-K433 PolarHBondContact O-N 3.16Å; D429-K433 VanDerWaalsContact O-N 3.11Å
430	N	89.9	Confident	89	Confident	60 Å²	60	71.2 Å²	71.2	32%	0.321	34%	0.344	S	S	.	.	H	α-helix	trans	-67.2	-38.5	176.6	-75.1	-10	0	0	0	110.9	D427 K433 A434 Y477	D427-N430 PolarHBondContact O-N 3.26Å; N430-K433 PolarHBondContact O-N 2.86Å; N430-A434 WeakPolarHBondContact O-CB 3.27Å; N430-A434 PolarHBondContact O-N 3.36Å; N430-Y477 PolarHBondContact ND2-O 2.6Å
431	F	91.4	Very high	88.6	Confident	19 Å²	19	71.5 Å²	71.5	8%	0.083	35%	0.345	C	S	.	.	H	α-helix	trans	-59.9	-49.9	174.7	178.9	-112.6	0	0	0	112.4	M420 V422 D427 A428 D429 K433 A434 L435 L456 M473 V481	M420-F431 HydrophobicContact CG-CE2 3.87Å; M420-F431 HydrophobicContact CG-CZ 4.07Å; M420-F431 HydrophobicContact SD-CE2 3.67Å; M420-F431 HydrophobicContact SD-CZ 4.16Å; V422-F431 HydrophobicContact CG2-CB 3.69Å; V422-F431 HydrophobicContact CG2-CD1 3.46Å; V422-F431 VanDerWaalsContact CG2-CD1 3.46Å; V422-F431 HydrophobicContact CG2-CD2 3.6Å; V422-F431 HydrophobicContact CG2-CE1 3.82Å; V422-F431 HydrophobicContact CG2-CE2 3.96Å; V422-F431 HydrophobicContact CG2-CG 3.3Å; V422-F431 HydrophobicContact CG2-CZ 4.04Å; D427-F431 WeakPolarHBondContact O-CB 3.26Å; D427-F431 PolarHBondContact O-N 3.22Å; A428-F431 WeakPolarHBondContact O-CB 3.49Å; A428-F431 PolarHBondContact O-N 3.32Å; D429-F431 VanDerWaalsContact C-N 3.33Å; F431-K433 VanDerWaalsContact C-N 3.33Å; F431-K433 PolarHBondContact O-N 3.16Å; F431-A434 PolarHBondContact O-N 3.08Å; F431-L435 HydrophobicContact CD1-CD1 3.72Å; F431-L435 HydrophobicContact CD2-CD1 4.21Å; F431-L435 HydrophobicContact CD2-CG 4.48Å; F431-L435 HydrophobicContact CE1-CD1 3.36Å; F431-L435 HydrophobicContact CE2-CD1 3.88Å; F431-L435 HydrophobicContact CE2-CG 4.25Å; F431-L435 HydrophobicContact CG-CD1 4.15Å; F431-L435 HydrophobicContact CZ-CD1 3.48Å; F431-L435 VanDerWaalsContact CZ-CD1 3.48Å; F431-L435 HydrophobicContact CZ-CG 4.3Å; F431-L435 WeakPolarHBondContact O-CG 3.08Å; F431-L435 PolarHBondContact O-N 3.18Å; F431-L456 HydrophobicContact CE1-CD2 3.7Å; F431-L456 HydrophobicContact CZ-CD2 3.6Å; F431-M473 HydrophobicContact CD2-SD 3.78Å; F431-M473 HydrophobicContact CE2-CE 4.43Å; F431-M473 HydrophobicContact CE2-SD 3.91Å; F431-V481 HydrophobicContact CD2-CG1 3.76Å; F431-V481 HydrophobicContact CE2-CG1 3.71Å
432	T	90.2	Very high	88.4	Confident	76 Å²	76	67.2 Å²	67.2	47%	0.466	33%	0.326	S	S	.	.	H	α-helix	trans	-63.3	-38.4	177.7	-58.2	0	0	0	0	112.1	A428 N436	A428-T432 PolarHBondContact O-N 3.38Å; A428-T432 PolarHBondContact O-OG1 3.25Å; T432-N436 WeakPolarHBondContact O-CB 3.31Å; T432-N436 PolarHBondContact O-N 2.96Å; T432-N436 VanDerWaalsContact O-N 3.15Å; T432-N436 PolarHBondContact O-ND2 3.43Å
433	K	89.1	Confident	88.1	Confident	128 Å²	128	67.7 Å²	67.7	56%	0.557	33%	0.33	S	S	*	.	H	α-helix	trans	-63.3	-44.4	174.6	-73.3	172.2	-174.8	172.2	0	111.9	D429 N430 F431 R437 Y477	D429-K433 VanDerWaalsContact O-CG 3.3Å; D429-K433 WeakPolarHBondContact O-CG 3.45Å; D429-K433 PolarHBondContact O-N 3.16Å; D429-K433 VanDerWaalsContact O-N 3.11Å; N430-K433 PolarHBondContact O-N 2.86Å; F431-K433 VanDerWaalsContact C-N 3.33Å; F431-K433 PolarHBondContact O-N 3.16Å; K433-R437 WeakPolarHBondContact O-CB 3.46Å; K433-R437 PolarHBondContact O-N 2.9Å; K433-R437 VanDerWaalsContact O-N 3.15Å; K433-Y477 HydrophobicContact CB-CE1 4.25Å
434	A	89.5	Confident	87.9	Confident	0 Å²	0	61.6 Å²	61.6	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-63.7	-47.7	179.2	0	0	0	0	0	111.9	N430 F431 R437 F438 M473 Y477	N430-A434 WeakPolarHBondContact O-CB 3.27Å; N430-A434 PolarHBondContact O-N 3.36Å; F431-A434 PolarHBondContact O-N 3.08Å; A434-R437 WeakPolarHBondContact O-CB 3.28Å; A434-R437 PolarHBondContact O-N 3.4Å; A434-F438 HydrophobicContact CB-CE2 4.17Å; A434-F438 HydrophobicContact CB-CZ 4.45Å; A434-F438 WeakPolarHBondContact O-CD2 3.48Å; A434-F438 VanDerWaalsContact O-CG 3.27Å; A434-F438 WeakPolarHBondContact O-CG 3.34Å; A434-F438 PolarHBondContact O-N 3.43Å; A434-M473 HydrophobicContact CB-CE 4.39Å; A434-M473 HydrophobicContact CB-CG 4.04Å; A434-M473 HydrophobicContact CB-SD 4.42Å; A434-Y477 HydrophobicContact CB-CD1 4.27Å; A434-Y477 HydrophobicContact CB-CD2 3.51Å; A434-Y477 HydrophobicContact CB-CE1 4.4Å; A434-Y477 HydrophobicContact CB-CE2 3.68Å; A434-Y477 HydrophobicContact CB-CG 3.84Å
435	L	91	Very high	88	Confident	4 Å²	4	59.6 Å²	59.6	2%	0.021	29%	0.29	C	S	.	.	H	α-helix	trans	-59.1	-50.5	178.7	-76.5	167.1	0	0	0	112.7	M420 F431 R437 F438 C439 F445 L456 V458 M473	M420-L435 HydrophobicContact SD-CD2 4.28Å; F431-L435 HydrophobicContact CD1-CD1 3.72Å; F431-L435 HydrophobicContact CD2-CD1 4.21Å; F431-L435 HydrophobicContact CD2-CG 4.48Å; F431-L435 HydrophobicContact CE1-CD1 3.36Å; F431-L435 HydrophobicContact CE2-CD1 3.88Å; F431-L435 HydrophobicContact CE2-CG 4.25Å; F431-L435 HydrophobicContact CG-CD1 4.15Å; F431-L435 HydrophobicContact CZ-CD1 3.48Å; F431-L435 VanDerWaalsContact CZ-CD1 3.48Å; F431-L435 HydrophobicContact CZ-CG 4.3Å; F431-L435 WeakPolarHBondContact O-CG 3.08Å; F431-L435 PolarHBondContact O-N 3.18Å; L435-R437 PolarHBondContact O-N 2.81Å; L435-F438 PolarHBondContact O-N 3.17Å; L435-C439 PolarHBondContact O-N 2.87Å; L435-C439 PolarHBondContact O-SG 2.83Å; L435-C439 VanDerWaalsContact O-SG 3.38Å; L435-F445 HydrophobicContact CD2-CE1 3.91Å; L435-F445 HydrophobicContact CD2-CZ 3.96Å; L435-L456 HydrophobicContact CD1-CD2 3.37Å; L435-L456 HydrophobicContact CD2-CD2 4.28Å; L435-L456 HydrophobicContact CG-CD2 4.48Å; L435-V458 HydrophobicContact CD2-CG1 4.13Å; L435-M473 HydrophobicContact CD2-CE 3.56Å; L435-M473 HydrophobicContact CG-CE 3.85Å
436	N	88.3	Confident	88.2	Confident	75 Å²	75	50.9 Å²	50.9	40%	0.401	26%	0.263	S	S	.	.	H	α-helix	trans	-62.3	-29.8	179.4	-74.1	-25.9	0	0	0	112.3	T432 K440 Q447	T432-N436 WeakPolarHBondContact O-CB 3.31Å; T432-N436 PolarHBondContact O-N 2.96Å; T432-N436 VanDerWaalsContact O-N 3.15Å; T432-N436 PolarHBondContact O-ND2 3.43Å; N436-K440 VanDerWaalsContact O-CG 3.32Å; N436-K440 WeakPolarHBondContact O-CG 3.27Å; N436-Q447 PolarHBondContact OD1-NE2 2.94Å
437	R	85.5	Confident	88.3	Confident	42 Å²	42	45 Å²	45	16%	0.158	24%	0.239	C	C	.	.	H	α-helix	trans	-72.6	-49.9	174.3	178.7	-176.9	167.3	-159.3	-13.1	111.3	A327 K433 A434 L435 C439 K440 E441 E476 Y477	A327-R437 VanDerWaalsContact CB-NE 3.32Å; A327-R437 PolarHBondContact O-NH2 2.64Å; K433-R437 WeakPolarHBondContact O-CB 3.46Å; K433-R437 PolarHBondContact O-N 2.9Å; K433-R437 VanDerWaalsContact O-N 3.15Å; A434-R437 WeakPolarHBondContact O-CB 3.28Å; A434-R437 PolarHBondContact O-N 3.4Å; L435-R437 PolarHBondContact O-N 2.81Å; R437-C439 VanDerWaalsContact C-N 3.31Å; R437-C439 PolarHBondContact O-N 2.74Å; R437-K440 WeakPolarHBondContact O-CA 3.44Å; R437-K440 WeakPolarHBondContact O-CB 3.18Å; R437-K440 PolarHBondContact O-N 3.33Å; R437-E441 HydrophobicContact CG-CG 4.34Å; R437-E441 IonicContact CZ-OE1 3.54Å; R437-E441 VanDerWaalsContact CZ-OE1 3.27Å; R437-E441 IonicContact NE-OE1 2.68Å; R437-E441 PolarHBondContact NE-OE1 2.86Å; R437-E441 IonicContact NH2-OE1 3.72Å; R437-E441 PolarHBondContact NH2-OE1 3.18Å; R437-E441 PolarHBondContact O-N 2.78Å; R437-E476 IonicContact CZ-OE2 3.64Å; R437-E476 IonicContact NH1-OE2 3.75Å; R437-E476 PolarHBondContact NH1-OE2 2.83Å; R437-E476 IonicContact NH2-OE2 3.15Å; R437-E476 PolarHBondContact NH2-OE2 2.95Å; R437-Y477 WeakPolarHBondContact CD-OH 3.49Å; R437-Y477 PolarHBondContact NH1-OH 2.7Å; R437-Y477 VanDerWaalsContact NH1-OH 3.09Å
438	F	89.3	Confident	88.3	Confident	0 Å²	0	50.6 Å²	50.6	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-62.7	-37.7	-178.7	-61.1	-26.5	0	0	0	112.3	A434 L435 K440 E441 D442 F445 Y469 R472 M473 Y477	A434-F438 HydrophobicContact CB-CE2 4.17Å; A434-F438 HydrophobicContact CB-CZ 4.45Å; A434-F438 WeakPolarHBondContact O-CD2 3.48Å; A434-F438 VanDerWaalsContact O-CG 3.27Å; A434-F438 WeakPolarHBondContact O-CG 3.34Å; A434-F438 PolarHBondContact O-N 3.43Å; L435-F438 PolarHBondContact O-N 3.17Å; F438-K440 PolarHBondContact O-N 3.42Å; F438-E441 PolarHBondContact O-N 3.47Å; F438-D442 PolarHBondContact O-N 2.79Å; F438-F445 HydrophobicContact CB-CD1 3.84Å; F438-F445 HydrophobicContact CB-CE1 3.98Å; F438-Y469 HydrophobicContact CB-CD1 3.93Å; F438-Y469 HydrophobicContact CB-CE1 3.82Å; F438-Y469 AromaticContact CD1-CD1 3.98Å; F438-Y469 HydrophobicContact CD1-CD1 3.98Å; F438-Y469 AromaticContact CD1-CE1 3.97Å; F438-Y469 HydrophobicContact CD1-CE1 3.97Å; F438-Y469 AromaticContact CD2-CD1 3.54Å; F438-Y469 HydrophobicContact CD2-CD1 3.54Å; F438-Y469 HydrophobicContact CD2-CE1 4.23Å; F438-Y469 HydrophobicContact CD2-CG 4.29Å; F438-Y469 HydrophobicContact CE1-CD1 4.38Å; F438-Y469 AromaticContact CE2-CD1 3.95Å; F438-Y469 HydrophobicContact CE2-CD1 3.95Å; F438-Y469 AromaticContact CG-CD1 3.56Å; F438-Y469 HydrophobicContact CG-CD1 3.56Å; F438-Y469 AromaticContact CG-CE1 3.76Å; F438-Y469 HydrophobicContact CG-CE1 3.76Å; F438-Y469 HydrophobicContact CZ-CD1 4.37Å; F438-R472 HydrophobicContact CE2-CB 4.48Å; F438-R472 HydrophobicContact CZ-CB 3.86Å; F438-M473 HydrophobicContact CD2-CE 3.75Å; F438-M473 HydrophobicContact CD2-CG 4.46Å; F438-M473 HydrophobicContact CE2-CE 3.76Å; F438-M473 HydrophobicContact CE2-CG 3.54Å; F438-M473 HydrophobicContact CZ-CG 4.31Å; F438-Y477 HydrophobicContact CZ-CE2 4.35Å
439	C	88.1	Confident	88.4	Confident	37 Å²	37	54.9 Å²	54.9	25%	0.25	27%	0.269	C	S	.	.	H	α-helix	trans	-63.4	-25.9	172.3	-67.7	0	0	0	0	113.8	L435 R437 F445	L435-C439 PolarHBondContact O-N 2.87Å; L435-C439 PolarHBondContact O-SG 2.83Å; L435-C439 VanDerWaalsContact O-SG 3.38Å; R437-C439 VanDerWaalsContact C-N 3.31Å; R437-C439 PolarHBondContact O-N 2.74Å; C439-F445 PolarHBondContact SG-O 3.44Å
440	K	85.1	Confident	88.1	Confident	110 Å²	110	51 Å²	51	48%	0.478	25%	0.248	S	C	.	.	H	α-helix	trans	-82.6	-37.1	174.4	-71.8	174.9	-177.9	-176.1	0	112.1	L325 N436 R437 F438	L325-K440 WeakPolarHBondContact CD1-O 3.45Å; N436-K440 VanDerWaalsContact O-CG 3.32Å; N436-K440 WeakPolarHBondContact O-CG 3.27Å; R437-K440 WeakPolarHBondContact O-CA 3.44Å; R437-K440 WeakPolarHBondContact O-CB 3.18Å; R437-K440 PolarHBondContact O-N 3.33Å; F438-K440 PolarHBondContact O-N 3.42Å
441	E	84.5	Confident	87.7	Confident	9 Å²	9	53.6 Å²	53.6	4%	0.042	27%	0.266	C	S	.	.	H	α-helix	trans	-67.1	-40.3	177.2	-72.9	-176.5	-177.9	0	0	111.4	R96 L325 R437 F438 R472	R96-E441 PolarHBondContact NH1-O 3.11Å; R96-E441 PolarHBondContact NH2-O 3Å; L325-E441 HydrophobicContact CB-CG 4.33Å; R437-E441 HydrophobicContact CG-CG 4.34Å; R437-E441 IonicContact CZ-OE1 3.54Å; R437-E441 VanDerWaalsContact CZ-OE1 3.27Å; R437-E441 IonicContact NE-OE1 2.68Å; R437-E441 PolarHBondContact NE-OE1 2.86Å; R437-E441 IonicContact NH2-OE1 3.72Å; R437-E441 PolarHBondContact NH2-OE1 3.18Å; R437-E441 PolarHBondContact O-N 2.78Å; F438-E441 PolarHBondContact O-N 3.47Å; E441-R472 IonicContact OE1-NH2 2.79Å; E441-R472 IonicContact OE2-CZ 3.38Å; E441-R472 IonicContact OE2-NH1 3.13Å; E441-R472 PolarHBondContact OE2-NH1 2.54Å; E441-R472 VanDerWaalsContact OE2-NH1 3.12Å; E441-R472 IonicContact OE2-NH2 2.65Å; E441-R472 PolarHBondContact OE2-NH2 2.84Å
442	D	85.9	Confident	86.7	Confident	1 Å²	1	56.5 Å²	56.5	1%	0.005	28%	0.28	C	S	.	.			trans	-135.6	109.6	-172.3	-178.5	-10.2	0	0	0	111.3	V92 F438 T444 F445 Q465 Y469	V92-D442 WeakPolarHBondContact CG1-OD1 3.49Å; F438-D442 PolarHBondContact O-N 2.79Å; D442-T444 VanDerWaalsContact CG-OG1 3.3Å; D442-T444 PolarHBondContact O-N 2.71Å; D442-T444 WeakPolarHBondContact OD1-CB 3.26Å; D442-T444 PolarHBondContact OD1-N 2.81Å; D442-T444 PolarHBondContact OD1-OG1 3.32Å; D442-T444 PolarHBondContact OD2-OG1 3.14Å; D442-F445 HydrophobicContact CB-CB 4.26Å; D442-F445 PolarHBondContact O-N 3.05Å; D442-F445 VanDerWaalsContact O-N 3.16Å; D442-Q465 PolarHBondContact OD2-NE2 3.03Å; D442-Y469 WeakPolarHBondContact CB-OH 3.33Å; D442-Y469 PolarHBondContact OD2-OH 3.27Å
443	P	84.3	Confident	86.2	Confident	50 Å²	50	53.9 Å²	53.9	33%	0.325	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.7	-13.6	-178.5	30.4	-36.3	0	0	0	113.8	V92 V411	V92-P443 HydrophobicContact CG2-CG 3.94Å; V411-P443 HydrophobicContact CB-CG 4.49Å; V411-P443 HydrophobicContact CG1-CB 3.96Å; V411-P443 HydrophobicContact CG1-CG 3.97Å; V411-P443 HydrophobicContact CG2-CB 3.95Å; V411-P443 HydrophobicContact CG2-CG 3.62Å
444	T	86.1	Confident	85.9	Confident	1 Å²	1	55.5 Å²	55.5	1%	0.006	27%	0.272	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.7	-22	173.5	67	0	0	0	0	112.4	V92 V411 P412 D442 T446 M461 Q465	V92-T444 HydrophobicContact CB-CG2 3.66Å; V92-T444 HydrophobicContact CG1-CG2 4.13Å; V92-T444 HydrophobicContact CG2-CG2 3.84Å; V411-T444 HydrophobicContact CG1-CG2 3.76Å; P412-T444 HydrophobicContact CG-CG2 3.95Å; D442-T444 VanDerWaalsContact CG-OG1 3.3Å; D442-T444 PolarHBondContact O-N 2.71Å; D442-T444 WeakPolarHBondContact OD1-CB 3.26Å; D442-T444 PolarHBondContact OD1-N 2.81Å; D442-T444 PolarHBondContact OD1-OG1 3.32Å; D442-T444 PolarHBondContact OD2-OG1 3.14Å; T444-T446 PolarHBondContact O-N 3.25Å; T444-M461 HydrophobicContact CG2-CG 4.05Å; T444-M461 HydrophobicContact CG2-SD 4.25Å; T444-Q465 PolarHBondContact OG1-NE2 2.85Å
445	F	90.7	Very high	85.7	Confident	2 Å²	2	55.9 Å²	55.9	1%	0.009	27%	0.274	C	S	.	.			trans	-83.6	101.9	175.9	-176.1	-97.7	0	0	0	110	L435 F438 C439 D442 V458 S459 L466 Y469	L435-F445 HydrophobicContact CD2-CE1 3.91Å; L435-F445 HydrophobicContact CD2-CZ 3.96Å; F438-F445 HydrophobicContact CB-CD1 3.84Å; F438-F445 HydrophobicContact CB-CE1 3.98Å; C439-F445 PolarHBondContact SG-O 3.44Å; D442-F445 HydrophobicContact CB-CB 4.26Å; D442-F445 PolarHBondContact O-N 3.05Å; D442-F445 VanDerWaalsContact O-N 3.16Å; F445-V458 HydrophobicContact CE2-CB 4.05Å; F445-V458 HydrophobicContact CE2-CG1 4.38Å; F445-V458 HydrophobicContact CZ-CB 4.07Å; F445-V458 HydrophobicContact CZ-CG1 3.89Å; F445-S459 WeakPolarHBondContact CA-O 3.33Å; F445-L466 HydrophobicContact CD2-CD2 3.86Å; F445-L466 HydrophobicContact CE2-CD2 3.65Å; F445-Y469 HydrophobicContact CB-CE2 4.03Å; F445-Y469 AromaticContact CD2-CD2 3.58Å; F445-Y469 HydrophobicContact CD2-CD2 3.58Å; F445-Y469 AromaticContact CD2-CE2 3.86Å; F445-Y469 HydrophobicContact CD2-CE2 3.86Å; F445-Y469 HydrophobicContact CD2-CG 4.23Å; F445-Y469 AromaticContact CE2-CD2 3.96Å; F445-Y469 HydrophobicContact CE2-CD2 3.96Å; F445-Y469 HydrophobicContact CE2-CG 4.23Å; F445-Y469 HydrophobicContact CG-CD2 4.17Å; F445-Y469 HydrophobicContact CG-CE2 4.07Å
446	T	89.3	Confident	85.7	Confident	57 Å²	57	57.1 Å²	57.1	35%	0.35	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	151.2	-177.4	59.8	0	0	0	0	111.2	T444 V458 S459	T444-T446 PolarHBondContact O-N 3.25Å; T446-V458 CarbonylContact O-C 3.52Å; T446-V458 WeakPolarHBondContact O-CA 3.13Å; T446-S459 PolarHBondContact N-O 3.36Å; T446-S459 PolarHBondContact O-N 3.48Å; T446-S459 WeakPolarHBondContact OG1-CB 3.19Å
447	Q	90.6	Very high	85.9	Confident	71 Å²	71	54.7 Å²	54.7	33%	0.332	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	138.9	176.3	63.7	175.8	-6.4	0	0	110.2	N436 L456 I457	N436-Q447 PolarHBondContact OD1-NE2 2.94Å; Q447-L456 HydrophobicContact CB-CD1 4.39Å; Q447-I457 WeakPolarHBondContact CA-O 3.31Å
448	K	89.4	Confident	86.2	Confident	156 Å²	156	52.7 Å²	52.7	68%	0.678	26%	0.259	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-139.1	124.9	174.2	-172.8	175.6	-178.8	178.5	0	109.4	N450 I457	K448-N450 PolarHBondContact O-N 3.28Å; K448-I457 PolarHBondContact N-O 3.47Å; K448-I457 PolarHBondContact O-N 3.36Å
449	Y	88.4	Confident	86.2	Confident	132 Å²	132	53.3 Å²	53.3	52%	0.518	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	118.8	169.9	-174.5	-102.3	0	0	0	109.2	V451 K454	Y449-V451 HydrophobicContact CD1-CG2 4.42Å; Y449-V451 PolarHBondContact O-N 2.93Å; Y449-K454 WeakPolarHBondContact OH-CA 3.46Å; Y449-K454 WeakPolarHBondContact OH-CB 3.45Å
450	N	82.9	Confident	86.1	Confident	40 Å²	40	51.6 Å²	51.6	21%	0.214	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	111.9	174.5	-175.1	-18.2	0	0	0	109	K448 E452 S453 K454 E455 I457	K448-N450 PolarHBondContact O-N 3.28Å; N450-E452 VanDerWaalsContact C-N 3.28Å; N450-E452 PolarHBondContact O-N 3.31Å; N450-E452 WeakPolarHBondContact OD1-CB 3.44Å; N450-E452 PolarHBondContact OD1-N 2.93Å; N450-S453 WeakPolarHBondContact CB-OG 3.42Å; N450-S453 VanDerWaalsContact CG-OG 3.29Å; N450-S453 PolarHBondContact ND2-OG 3.16Å; N450-S453 PolarHBondContact OD1-N 3.41Å; N450-K454 VanDerWaalsContact O-CA 3.28Å; N450-K454 WeakPolarHBondContact O-CA 3.46Å; N450-K454 PolarHBondContact O-N 3.38Å; N450-E455 PolarHBondContact N-O 3.3Å; N450-E455 PolarHBondContact O-N 3.49Å; N450-I457 HydrophobicContact CB-CD1 3.77Å; N450-I457 HydrophobicContact CB-CG1 4.28Å
451	V	81.4	Confident	86	Confident	115 Å²	115	47 Å²	47	70%	0.697	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.3	-34.8	-177.7	-177	0	0	0	0	111.7	Y449	Y449-V451 HydrophobicContact CD1-CG2 4.42Å; Y449-V451 PolarHBondContact O-N 2.93Å
452	E	72.2	Confident	85.8	Confident	80 Å²	80	46.7 Å²	46.7	37%	0.374	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.2	-49.3	-176.6	-174.4	173.9	-177.9	0	0	111.6	N450 K454 A489 R491	N450-E452 VanDerWaalsContact C-N 3.28Å; N450-E452 PolarHBondContact O-N 3.31Å; N450-E452 WeakPolarHBondContact OD1-CB 3.44Å; N450-E452 PolarHBondContact OD1-N 2.93Å; E452-K454 VanDerWaalsContact C-N 3.33Å; E452-A489 WeakPolarHBondContact OE2-CB 3.22Å; E452-R491 IonicContact OE1-CZ 3.21Å; E452-R491 IonicContact OE1-NE 3.57Å; E452-R491 PolarHBondContact OE1-NE 2.91Å; E452-R491 VanDerWaalsContact OE1-NE 3.1Å; E452-R491 IonicContact OE1-NH1 3.18Å; E452-R491 IonicContact OE1-NH2 3.27Å; E452-R491 PolarHBondContact OE1-NH2 2.88Å; E452-R491 IonicContact OE2-CZ 2.77Å; E452-R491 IonicContact OE2-NH2 4Å; E452-R491 PolarHBondContact OE2-NH2 3.4Å
453	S	77.9	Confident	85.6	Confident	22 Å²	22	49.5 Å²	49.5	15%	0.154	25%	0.245	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.8	-12.9	178.9	64.4	0	0	0	0	113.8	N450 E455	N450-S453 WeakPolarHBondContact CB-OG 3.42Å; N450-S453 VanDerWaalsContact CG-OG 3.29Å; N450-S453 PolarHBondContact ND2-OG 3.16Å; N450-S453 PolarHBondContact OD1-N 3.41Å; S453-E455 PolarHBondContact O-N 3.35Å
454	K	82.6	Confident	85.5	Confident	162 Å²	162	48.2 Å²	48.2	70%	0.704	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	54.3	37.9	-171.9	-59.1	179.5	-177.3	175.3	0	112.5	Y449 N450 E452	Y449-K454 WeakPolarHBondContact OH-CA 3.46Å; Y449-K454 WeakPolarHBondContact OH-CB 3.45Å; N450-K454 VanDerWaalsContact O-CA 3.28Å; N450-K454 WeakPolarHBondContact O-CA 3.46Å; N450-K454 PolarHBondContact O-N 3.38Å; E452-K454 VanDerWaalsContact C-N 3.33Å
455	E	87.1	Confident	85.6	Confident	8 Å²	8	48.1 Å²	48.1	4%	0.037	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	145.6	-179.2	-68.6	176.9	170.4	0	0	110.5	K421 N450 S453 K487	K421-E455 WeakPolarHBondContact CE-OE1 3.36Å; K421-E455 IonicContact NZ-OE1 2.74Å; K421-E455 PolarHBondContact NZ-OE1 3.18Å; N450-E455 PolarHBondContact N-O 3.3Å; N450-E455 PolarHBondContact O-N 3.49Å; S453-E455 PolarHBondContact O-N 3.35Å; E455-K487 VanDerWaalsContact OE1-CD 3.25Å; E455-K487 WeakPolarHBondContact OE1-CD 3.04Å; E455-K487 WeakPolarHBondContact OE1-CE 3.33Å; E455-K487 IonicContact OE1-NZ 2.7Å; E455-K487 PolarHBondContact OE1-NZ 3.01Å; E455-K487 WeakPolarHBondContact OE2-CG 3.39Å
456	L	90.9	Very high	85.5	Confident	29 Å²	29	48 Å²	48	15%	0.152	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	121.1	168.3	-170.9	76.3	0	0	0	108.7	S419 M420 F431 L435 Q447 V458	S419-L456 WeakPolarHBondContact CA-O 3.14Å; M420-L456 PolarHBondContact N-O 3.14Å; F431-L456 HydrophobicContact CE1-CD2 3.7Å; F431-L456 HydrophobicContact CZ-CD2 3.6Å; L435-L456 HydrophobicContact CD1-CD2 3.37Å; L435-L456 HydrophobicContact CD2-CD2 4.28Å; L435-L456 HydrophobicContact CG-CD2 4.48Å; Q447-L456 HydrophobicContact CB-CD1 4.39Å; L456-V458 HydrophobicContact CD2-CG1 4.41Å
457	I	91	Very high	85.4	Confident	24 Å²	24	49.4 Å²	49.4	12%	0.123	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	126.1	173.6	-56.9	177.9	0	0	0	107.5	L418 Q447 K448 N450 P486	L418-I457 WeakPolarHBondContact O-CA 3.33Å; Q447-I457 WeakPolarHBondContact CA-O 3.31Å; K448-I457 PolarHBondContact N-O 3.47Å; K448-I457 PolarHBondContact O-N 3.36Å; N450-I457 HydrophobicContact CB-CD1 3.77Å; N450-I457 HydrophobicContact CB-CG1 4.28Å; I457-P486 HydrophobicContact CD1-CB 4.25Å; I457-P486 HydrophobicContact CG1-CB 4.48Å; I457-P486 HydrophobicContact CG2-CG 4.47Å
458	V	92.2	Very high	85.2	Confident	0 Å²	0	46.1 Å²	46.1	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	138.6	170.8	-64.3	0	0	0	0	108.9	S417 L418 M420 L435 F445 T446 L456 L466	S417-V458 CarbonylContact C-O 3.6Å; S417-V458 WeakPolarHBondContact CA-O 3.46Å; L418-V458 HydrophobicContact CB-CG2 4.43Å; L418-V458 PolarHBondContact N-O 2.77Å; L418-V458 WeakPolarHBondContact O-CG2 3.35Å; L418-V458 PolarHBondContact O-N 3.44Å; M420-V458 HydrophobicContact CB-CG1 4.01Å; M420-V458 HydrophobicContact CB-CG2 4Å; M420-V458 HydrophobicContact CE-CG1 4.19Å; M420-V458 HydrophobicContact CE-CG2 3.83Å; M420-V458 HydrophobicContact SD-CG1 4.03Å; L435-V458 HydrophobicContact CD2-CG1 4.13Å; F445-V458 HydrophobicContact CE2-CB 4.05Å; F445-V458 HydrophobicContact CE2-CG1 4.38Å; F445-V458 HydrophobicContact CZ-CB 4.07Å; F445-V458 HydrophobicContact CZ-CG1 3.89Å; T446-V458 CarbonylContact O-C 3.52Å; T446-V458 WeakPolarHBondContact O-CA 3.13Å; L456-V458 HydrophobicContact CD2-CG1 4.41Å; V458-L466 HydrophobicContact CB-CD2 4.4Å; V458-L466 HydrophobicContact CG2-CD1 4.47Å; V458-L466 HydrophobicContact CG2-CD2 4.04Å
459	S	89.9	Confident	85.3	Confident	14 Å²	14	39.2 Å²	39.2	10%	0.098	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	145.7	-179.5	-50.9	0	0	0	0	111	V416 S417 F445 T446	V416-S459 CarbonylContact O-C 3.53Å; V416-S459 WeakPolarHBondContact O-CA 3.37Å; V416-S459 WeakPolarHBondContact O-CB 3.4Å; S417-S459 PolarHBondContact OG-OG 2.76Å; F445-S459 WeakPolarHBondContact CA-O 3.33Å; T446-S459 PolarHBondContact N-O 3.36Å; T446-S459 PolarHBondContact O-N 3.48Å; T446-S459 WeakPolarHBondContact OG1-CB 3.19Å
460	G	86.7	Confident	85.3	Confident	0 Å²	0	33.6 Å²	33.6	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-159.8	-175.6	-178.4	0	0	0	0	0	112.8	P414 V415 V416 G462	P414-G460 CarbonylContact C-O 3.6Å; P414-G460 WeakPolarHBondContact CA-O 3.3Å; V415-G460 PolarHBondContact N-O 3.23Å; V416-G460 PolarHBondContact N-O 2.82Å; V416-G460 PolarHBondContact O-N 2.63Å; G460-G462 VanDerWaalsContact C-N 3.35Å
461	M	82.5	Confident	85.6	Confident	15 Å²	15	35 Å²	35	7%	0.074	18%	0.177	C	C	.	.	S	Bend	trans	-75.6	-17	-179	-65.2	-56.1	-66	0	0	114.5	P412 V415 T444 R669	P412-M461 HydrophobicContact CB-CE 3.68Å; P412-M461 HydrophobicContact CB-SD 3.89Å; P412-M461 HydrophobicContact CG-CE 3.62Å; P412-M461 HydrophobicContact CG-SD 3.63Å; V415-M461 WeakPolarHBondContact CG2-O 3.39Å; T444-M461 HydrophobicContact CG2-CG 4.05Å; T444-M461 HydrophobicContact CG2-SD 4.25Å; M461-R669 PolarHBondContact O-NH2 2.97Å
462	G	79.4	Confident	85.9	Confident	1 Å²	1	30 Å²	30	1%	0.01	15%	0.146	C	C	.	.			trans	-175.8	167.6	177.5	0	0	0	0	0	113.9	D89 G460 L464 Q465 L466	D89-G462 VanDerWaalsContact OD1-CA 3.31Å; D89-G462 WeakPolarHBondContact OD1-CA 3.46Å; G460-G462 VanDerWaalsContact C-N 3.35Å; G462-L464 VanDerWaalsContact C-N 3.33Å; G462-L464 PolarHBondContact O-N 3.29Å; G462-Q465 PolarHBondContact O-N 3.3Å; G462-L466 PolarHBondContact O-N 3Å
463	E	81.4	Confident	86.7	Confident	60 Å²	60	26.2 Å²	26.2	28%	0.28	13%	0.128	S	C	.	.	H	α-helix	trans	-62.9	-40.1	179.4	-68.4	175.1	164.3	0	0	111.5	V416 Q465 L466 E467 T666	V416-E463 HydrophobicContact CG1-CG 3.99Å; V416-E463 HydrophobicContact CG2-CG 4.44Å; E463-Q465 VanDerWaalsContact C-N 3.32Å; E463-Q465 PolarHBondContact O-N 3.48Å; E463-L466 PolarHBondContact O-N 3.32Å; E463-L466 VanDerWaalsContact O-N 3.16Å; E463-E467 WeakPolarHBondContact O-CG 3.42Å; E463-E467 PolarHBondContact O-N 3.24Å; E463-T666 PolarHBondContact OE2-OG1 3.35Å
464	L	83.5	Confident	87.2	Confident	23 Å²	23	30.3 Å²	30.3	12%	0.12	14%	0.143	C	C	.	.	H	α-helix	trans	-58.2	-41.8	176.6	176.7	63.8	0	0	0	112.3	I63 H87 D89 F90 G462 L466 E467 V468	I63-L464 HydrophobicContact CD1-CD2 4.08Å; H87-L464 VanDerWaalsContact CE1-CD2 3.49Å; H87-L464 WeakPolarHBondContact CE1-CD2 3.47Å; D89-L464 VanDerWaalsContact OD2-CB 3.27Å; D89-L464 WeakPolarHBondContact OD2-CB 3.46Å; F90-L464 HydrophobicContact CE2-CD2 4.24Å; F90-L464 HydrophobicContact CE2-CG 4.43Å; G462-L464 VanDerWaalsContact C-N 3.33Å; G462-L464 PolarHBondContact O-N 3.29Å; L464-L466 VanDerWaalsContact C-N 3.34Å; L464-L466 PolarHBondContact O-N 2.87Å; L464-E467 PolarHBondContact O-N 3.24Å; L464-V468 HydrophobicContact CD1-CG2 4.27Å; L464-V468 WeakPolarHBondContact O-CB 3.47Å; L464-V468 VanDerWaalsContact O-CG2 3.26Å; L464-V468 WeakPolarHBondContact O-CG2 3.48Å; L464-V468 PolarHBondContact O-N 3.34Å
465	Q	86.7	Confident	87.3	Confident	0 Å²	0	26.2 Å²	26.2	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-61.5	-45.5	178.1	-173.2	-171.6	19.4	0	0	110.5	D89 F90 D442 T444 G462 E463 V468 Y469	D89-Q465 HydrophobicContact CB-CB 4.19Å; F90-Q465 HydrophobicContact CD1-CG 4.4Å; F90-Q465 HydrophobicContact CE1-CB 4.2Å; F90-Q465 HydrophobicContact CE1-CG 3.95Å; D442-Q465 PolarHBondContact OD2-NE2 3.03Å; T444-Q465 PolarHBondContact OG1-NE2 2.85Å; G462-Q465 PolarHBondContact O-N 3.3Å; E463-Q465 VanDerWaalsContact C-N 3.32Å; E463-Q465 PolarHBondContact O-N 3.48Å; Q465-V468 PolarHBondContact O-N 3.49Å; Q465-Y469 HydrophobicContact CG-CD2 3.9Å; Q465-Y469 HydrophobicContact CG-CE2 3.6Å; Q465-Y469 WeakPolarHBondContact O-CD2 3.5Å; Q465-Y469 PolarHBondContact O-N 2.9Å
466	L	88.9	Confident	87.2	Confident	0 Å²	0	29.3 Å²	29.3	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-67	-38.1	179.7	-61.5	178.7	0	0	0	112	V416 L418 F445 V458 G462 E463 L464 Y469 A470	V416-L466 HydrophobicContact CB-CD1 4.38Å; V416-L466 HydrophobicContact CG1-CD1 3.8Å; L418-L466 HydrophobicContact CB-CD1 4.03Å; L418-L466 HydrophobicContact CD1-CB 4.18Å; L418-L466 HydrophobicContact CD1-CD1 3.62Å; L418-L466 HydrophobicContact CG-CD1 3.69Å; F445-L466 HydrophobicContact CD2-CD2 3.86Å; F445-L466 HydrophobicContact CE2-CD2 3.65Å; V458-L466 HydrophobicContact CB-CD2 4.4Å; V458-L466 HydrophobicContact CG2-CD1 4.47Å; V458-L466 HydrophobicContact CG2-CD2 4.04Å; G462-L466 PolarHBondContact O-N 3Å; E463-L466 PolarHBondContact O-N 3.32Å; E463-L466 VanDerWaalsContact O-N 3.16Å; L464-L466 VanDerWaalsContact C-N 3.34Å; L464-L466 PolarHBondContact O-N 2.87Å; L466-Y469 PolarHBondContact O-N 3.3Å; L466-A470 WeakPolarHBondContact O-CB 3.4Å; L466-A470 PolarHBondContact O-N 3.03Å
467	E	87.2	Confident	87	Confident	85 Å²	85	30 Å²	30	40%	0.397	15%	0.15	S	C	.	.	H	α-helix	trans	-61.6	-44.9	171.9	-75.4	-178.4	-175	0	0	112.3	R61 E463 L464 Y469 A470 Q471 L483	R61-E467 IonicContact CZ-OE2 2.96Å; R61-E467 IonicContact NH1-OE2 3.89Å; R61-E467 PolarHBondContact NH1-OE2 3.03Å; R61-E467 IonicContact NH2-OE2 2.77Å; R61-E467 PolarHBondContact NH2-OE2 2.87Å; E463-E467 WeakPolarHBondContact O-CG 3.42Å; E463-E467 PolarHBondContact O-N 3.24Å; L464-E467 PolarHBondContact O-N 3.24Å; E467-Y469 VanDerWaalsContact C-N 3.33Å; E467-Y469 PolarHBondContact O-N 3.06Å; E467-A470 PolarHBondContact O-N 3.41Å; E467-Q471 PolarHBondContact O-N 2.97Å; E467-L483 HydrophobicContact CG-CD1 4.31Å
468	V	87.4	Confident	86.8	Confident	3 Å²	3	35 Å²	35	2%	0.018	18%	0.178	C	C	.	.	H	α-helix	trans	-61	-44.6	177.5	165.7	0	0	0	0	110.2	L57 I65 F90 L464 Q465 Q471 R472	L57-V468 HydrophobicContact CD1-CB 4.47Å; L57-V468 HydrophobicContact CD1-CG1 4.39Å; L57-V468 HydrophobicContact CD1-CG2 4.16Å; L57-V468 HydrophobicContact CD2-CG2 3.84Å; I65-V468 HydrophobicContact CD1-CG1 4.02Å; I65-V468 HydrophobicContact CD1-CG2 3.89Å; I65-V468 HydrophobicContact CG2-CG1 3.91Å; F90-V468 HydrophobicContact CZ-CB 4.27Å; F90-V468 HydrophobicContact CZ-CG1 4.36Å; F90-V468 HydrophobicContact CZ-CG2 4.05Å; L464-V468 HydrophobicContact CD1-CG2 4.27Å; L464-V468 WeakPolarHBondContact O-CB 3.47Å; L464-V468 VanDerWaalsContact O-CG2 3.26Å; L464-V468 WeakPolarHBondContact O-CG2 3.48Å; L464-V468 PolarHBondContact O-N 3.34Å; Q465-V468 PolarHBondContact O-N 3.49Å; V468-Q471 PolarHBondContact O-N 2.89Å; V468-R472 HydrophobicContact CG1-CG 4.49Å; V468-R472 WeakPolarHBondContact O-CB 3.41Å; V468-R472 WeakPolarHBondContact O-CG 3.3Å; V468-R472 PolarHBondContact O-N 2.87Å
469	Y	90.2	Very high	86.6	Confident	10 Å²	10	35 Å²	35	4%	0.039	18%	0.178	C	C	.	.	H	α-helix	trans	-63.7	-41.2	175	-78.9	-61.6	0	0	0	112.7	F438 D442 F445 Q465 L466 E467 Q471 R472 M473	F438-Y469 HydrophobicContact CB-CD1 3.93Å; F438-Y469 HydrophobicContact CB-CE1 3.82Å; F438-Y469 AromaticContact CD1-CD1 3.98Å; F438-Y469 HydrophobicContact CD1-CD1 3.98Å; F438-Y469 AromaticContact CD1-CE1 3.97Å; F438-Y469 HydrophobicContact CD1-CE1 3.97Å; F438-Y469 AromaticContact CD2-CD1 3.54Å; F438-Y469 HydrophobicContact CD2-CD1 3.54Å; F438-Y469 HydrophobicContact CD2-CE1 4.23Å; F438-Y469 HydrophobicContact CD2-CG 4.29Å; F438-Y469 HydrophobicContact CE1-CD1 4.38Å; F438-Y469 AromaticContact CE2-CD1 3.95Å; F438-Y469 HydrophobicContact CE2-CD1 3.95Å; F438-Y469 AromaticContact CG-CD1 3.56Å; F438-Y469 HydrophobicContact CG-CD1 3.56Å; F438-Y469 AromaticContact CG-CE1 3.76Å; F438-Y469 HydrophobicContact CG-CE1 3.76Å; F438-Y469 HydrophobicContact CZ-CD1 4.37Å; D442-Y469 WeakPolarHBondContact CB-OH 3.33Å; D442-Y469 PolarHBondContact OD2-OH 3.27Å; F445-Y469 HydrophobicContact CB-CE2 4.03Å; F445-Y469 AromaticContact CD2-CD2 3.58Å; F445-Y469 HydrophobicContact CD2-CD2 3.58Å; F445-Y469 AromaticContact CD2-CE2 3.86Å; F445-Y469 HydrophobicContact CD2-CE2 3.86Å; F445-Y469 HydrophobicContact CD2-CG 4.23Å; F445-Y469 AromaticContact CE2-CD2 3.96Å; F445-Y469 HydrophobicContact CE2-CD2 3.96Å; F445-Y469 HydrophobicContact CE2-CG 4.23Å; F445-Y469 HydrophobicContact CG-CD2 4.17Å; F445-Y469 HydrophobicContact CG-CE2 4.07Å; Q465-Y469 HydrophobicContact CG-CD2 3.9Å; Q465-Y469 HydrophobicContact CG-CE2 3.6Å; Q465-Y469 WeakPolarHBondContact O-CD2 3.5Å; Q465-Y469 PolarHBondContact O-N 2.9Å; L466-Y469 PolarHBondContact O-N 3.3Å; E467-Y469 VanDerWaalsContact C-N 3.33Å; E467-Y469 PolarHBondContact O-N 3.06Å; Y469-Q471 VanDerWaalsContact C-N 3.33Å; Y469-Q471 PolarHBondContact O-N 3.47Å; Y469-R472 PolarHBondContact O-N 2.86Å; Y469-M473 WeakPolarHBondContact O-CG 3.38Å; Y469-M473 PolarHBondContact O-N 2.9Å
470	A	90.1	Very high	86.7	Confident	14 Å²	14	37.6 Å²	37.6	12%	0.116	19%	0.188	C	C	.	.	H	α-helix	trans	-60.5	-41.8	174.7	0	0	0	0	0	112.2	L466 E467 M473 K474 V481 L483	L466-A470 WeakPolarHBondContact O-CB 3.4Å; L466-A470 PolarHBondContact O-N 3.03Å; E467-A470 PolarHBondContact O-N 3.41Å; A470-M473 PolarHBondContact O-N 2.79Å; A470-K474 PolarHBondContact O-N 3.47Å; A470-V481 HydrophobicContact CB-CG2 3.53Å; A470-L483 HydrophobicContact CB-CD1 3.88Å; A470-L483 HydrophobicContact CB-CD2 4.38Å; A470-L483 HydrophobicContact CB-CG 4.14Å
471	Q	87.9	Confident	86.9	Confident	69 Å²	69	38.5 Å²	38.5	32%	0.322	19%	0.194	S	C	.	.	H	α-helix	trans	-69.3	-37.3	175.9	-171.9	170.7	-16.7	0	0	111.9	L57 E467 V468 Y469 M473 K474 S475	L57-Q471 HydrophobicContact CD1-CB 3.67Å; L57-Q471 HydrophobicContact CD1-CG 3.64Å; E467-Q471 PolarHBondContact O-N 2.97Å; V468-Q471 PolarHBondContact O-N 2.89Å; Y469-Q471 VanDerWaalsContact C-N 3.33Å; Y469-Q471 PolarHBondContact O-N 3.47Å; Q471-M473 VanDerWaalsContact C-N 3.34Å; Q471-M473 PolarHBondContact O-N 2.98Å; Q471-K474 WeakPolarHBondContact O-CB 3.4Å; Q471-K474 PolarHBondContact O-N 2.83Å; Q471-K474 VanDerWaalsContact O-N 3.14Å; Q471-S475 PolarHBondContact O-N 2.92Å; Q471-S475 PolarHBondContact O-OG 2.88Å
472	R	87.7	Confident	87.3	Confident	11 Å²	11	43.6 Å²	43.6	4%	0.042	22%	0.217	C	C	.	.	H	α-helix	trans	-62.3	-37.3	172.2	-74.2	-179	67.6	-161.6	-3.2	112.2	F438 E441 V468 Y469 K474 S475 E476	F438-R472 HydrophobicContact CE2-CB 4.48Å; F438-R472 HydrophobicContact CZ-CB 3.86Å; E441-R472 IonicContact OE1-NH2 2.79Å; E441-R472 IonicContact OE2-CZ 3.38Å; E441-R472 IonicContact OE2-NH1 3.13Å; E441-R472 PolarHBondContact OE2-NH1 2.54Å; E441-R472 VanDerWaalsContact OE2-NH1 3.12Å; E441-R472 IonicContact OE2-NH2 2.65Å; E441-R472 PolarHBondContact OE2-NH2 2.84Å; V468-R472 HydrophobicContact CG1-CG 4.49Å; V468-R472 WeakPolarHBondContact O-CB 3.41Å; V468-R472 WeakPolarHBondContact O-CG 3.3Å; V468-R472 PolarHBondContact O-N 2.87Å; Y469-R472 PolarHBondContact O-N 2.86Å; R472-K474 VanDerWaalsContact C-N 3.28Å; R472-K474 PolarHBondContact O-N 3.11Å; R472-S475 WeakPolarHBondContact CA-OG 3.12Å; R472-S475 PolarHBondContact O-N 2.77Å; R472-S475 PolarHBondContact O-OG 2.7Å; R472-E476 IonicContact CZ-OE1 3.14Å; R472-E476 IonicContact NE-OE1 2.63Å; R472-E476 PolarHBondContact NE-OE1 2.89Å; R472-E476 IonicContact NH2-OE1 3.64Å; R472-E476 PolarHBondContact NH2-OE1 2.69Å; R472-E476 IonicContact NH2-OE2 3.01Å; R472-E476 VanDerWaalsContact O-CB 3.26Å; R472-E476 WeakPolarHBondContact O-CB 3.47Å; R472-E476 WeakPolarHBondContact O-CG 3.08Å; R472-E476 PolarHBondContact O-N 2.87Å
473	M	89.2	Confident	87.9	Confident	0 Å²	0	46.1 Å²	46.1	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-60.9	-39.9	172.3	-66.8	-170.3	-174.2	0	0	111.7	M420 F431 A434 L435 F438 Y469 A470 Q471 Y477 N478 C479 V481	M420-M473 HydrophobicContact CE-CE 4.35Å; M420-M473 HydrophobicContact SD-CE 3.71Å; M420-M473 HydrophobicContact SD-SD 3.92Å; F431-M473 HydrophobicContact CD2-SD 3.78Å; F431-M473 HydrophobicContact CE2-CE 4.43Å; F431-M473 HydrophobicContact CE2-SD 3.91Å; A434-M473 HydrophobicContact CB-CE 4.39Å; A434-M473 HydrophobicContact CB-CG 4.04Å; A434-M473 HydrophobicContact CB-SD 4.42Å; L435-M473 HydrophobicContact CD2-CE 3.56Å; L435-M473 HydrophobicContact CG-CE 3.85Å; F438-M473 HydrophobicContact CD2-CE 3.75Å; F438-M473 HydrophobicContact CD2-CG 4.46Å; F438-M473 HydrophobicContact CE2-CE 3.76Å; F438-M473 HydrophobicContact CE2-CG 3.54Å; F438-M473 HydrophobicContact CZ-CG 4.31Å; Y469-M473 WeakPolarHBondContact O-CG 3.38Å; Y469-M473 PolarHBondContact O-N 2.9Å; A470-M473 PolarHBondContact O-N 2.79Å; Q471-M473 VanDerWaalsContact C-N 3.34Å; Q471-M473 PolarHBondContact O-N 2.98Å; M473-Y477 CarbonylContact O-C 3.47Å; M473-Y477 WeakPolarHBondContact O-CA 3.21Å; M473-Y477 WeakPolarHBondContact O-CB 2.98Å; M473-Y477 PolarHBondContact O-N 3.17Å; M473-Y477 VanDerWaalsContact O-N 3.1Å; M473-N478 PolarHBondContact O-N 3.03Å; M473-C479 CarbonylContact C-O 3.57Å; M473-C479 PolarHBondContact O-N 2.75Å; M473-C479 VanDerWaalsContact O-N 3.1Å; M473-V481 HydrophobicContact SD-CG1 3.8Å; M473-V481 HydrophobicContact SD-CG2 4.38Å
474	K	88.6	Confident	88.1	Confident	108 Å²	108	44.5 Å²	44.5	47%	0.47	23%	0.23	S	C	.	.	H	α-helix	trans	-67.3	-45.2	177.1	-179.7	172.1	173.9	160.1	0	111.8	A470 Q471 R472 N478 C479 E480	A470-K474 PolarHBondContact O-N 3.47Å; Q471-K474 WeakPolarHBondContact O-CB 3.4Å; Q471-K474 PolarHBondContact O-N 2.83Å; Q471-K474 VanDerWaalsContact O-N 3.14Å; R472-K474 VanDerWaalsContact C-N 3.28Å; R472-K474 PolarHBondContact O-N 3.11Å; K474-N478 VanDerWaalsContact O-CA 3.25Å; K474-N478 WeakPolarHBondContact O-CA 3.43Å; K474-N478 PolarHBondContact O-N 2.85Å; K474-C479 WeakPolarHBondContact CA-O 3.45Å; K474-C479 PolarHBondContact N-O 3.14Å; K474-E480 HydrophobicContact CD-CG 4.09Å; K474-E480 VanDerWaalsContact CE-OE1 3.23Å; K474-E480 WeakPolarHBondContact CE-OE1 3.47Å; K474-E480 HydrophobicContact CG-CG 4.27Å; K474-E480 IonicContact NZ-OE1 3.1Å; K474-E480 PolarHBondContact NZ-OE1 3.38Å
475	S	84.6	Confident	88.2	Confident	77 Å²	77	50.8 Å²	50.8	54%	0.538	26%	0.256	S	S	.	.	H	α-helix	trans	-79.2	-40	-176.1	61	0	0	0	0	114	Q471 R472	Q471-S475 PolarHBondContact O-N 2.92Å; Q471-S475 PolarHBondContact O-OG 2.88Å; R472-S475 WeakPolarHBondContact CA-OG 3.12Å; R472-S475 PolarHBondContact O-N 2.77Å; R472-S475 PolarHBondContact O-OG 2.7Å
476	E	85.1	Confident	88	Confident	72 Å²	72	51.3 Å²	51.3	34%	0.336	26%	0.26	S	S	.	.	H	α-helix	trans	-88.5	-33.8	-175.4	-61.3	-178.3	-150.8	0	0	112.8	R437 R472	R437-E476 IonicContact CZ-OE2 3.64Å; R437-E476 IonicContact NH1-OE2 3.75Å; R437-E476 PolarHBondContact NH1-OE2 2.83Å; R437-E476 IonicContact NH2-OE2 3.15Å; R437-E476 PolarHBondContact NH2-OE2 2.95Å; R472-E476 IonicContact CZ-OE1 3.14Å; R472-E476 IonicContact NE-OE1 2.63Å; R472-E476 PolarHBondContact NE-OE1 2.89Å; R472-E476 IonicContact NH2-OE1 3.64Å; R472-E476 PolarHBondContact NH2-OE1 2.69Å; R472-E476 IonicContact NH2-OE2 3.01Å; R472-E476 VanDerWaalsContact O-CB 3.26Å; R472-E476 WeakPolarHBondContact O-CB 3.47Å; R472-E476 WeakPolarHBondContact O-CG 3.08Å; R472-E476 PolarHBondContact O-N 2.87Å
477	Y	86.4	Confident	87.6	Confident	43 Å²	43	57.1 Å²	57.1	17%	0.169	29%	0.285	C	S	.	.	H	α-helix	trans	-116.7	0.6	-172.8	-69.9	-87.1	0	0	0	114	N430 K433 A434 R437 F438 M473 C479	N430-Y477 PolarHBondContact ND2-O 2.6Å; K433-Y477 HydrophobicContact CB-CE1 4.25Å; A434-Y477 HydrophobicContact CB-CD1 4.27Å; A434-Y477 HydrophobicContact CB-CD2 3.51Å; A434-Y477 HydrophobicContact CB-CE1 4.4Å; A434-Y477 HydrophobicContact CB-CE2 3.68Å; A434-Y477 HydrophobicContact CB-CG 3.84Å; R437-Y477 WeakPolarHBondContact CD-OH 3.49Å; R437-Y477 PolarHBondContact NH1-OH 2.7Å; R437-Y477 VanDerWaalsContact NH1-OH 3.09Å; F438-Y477 HydrophobicContact CZ-CE2 4.35Å; M473-Y477 CarbonylContact O-C 3.47Å; M473-Y477 WeakPolarHBondContact O-CA 3.21Å; M473-Y477 WeakPolarHBondContact O-CB 2.98Å; M473-Y477 PolarHBondContact O-N 3.17Å; M473-Y477 VanDerWaalsContact O-N 3.1Å; Y477-C479 PolarHBondContact O-N 2.83Å; Y477-C479 VanDerWaalsContact O-N 3.17Å
478	N	86.7	Confident	87.4	Confident	131 Å²	131	53.9 Å²	53.9	70%	0.701	27%	0.271	S	S	*	.			trans	51.6	32.4	-173.2	-64.2	-46.6	0	0	0	112.9	M473 K474	M473-N478 PolarHBondContact O-N 3.03Å; K474-N478 VanDerWaalsContact O-CA 3.25Å; K474-N478 WeakPolarHBondContact O-CA 3.43Å; K474-N478 PolarHBondContact O-N 2.85Å
479	C	89	Confident	87.2	Confident	0 Å²	0	54.8 Å²	54.8	0%	0	28%	0.279	C	S	.	.			trans	-109.7	108.9	-177.5	177.6	0	0	0	0	109.6	D427 M473 K474 Y477	D427-C479 HydrophobicContact CB-CB 4.23Å; M473-C479 CarbonylContact C-O 3.57Å; M473-C479 PolarHBondContact O-N 2.75Å; M473-C479 VanDerWaalsContact O-N 3.1Å; K474-C479 WeakPolarHBondContact CA-O 3.45Å; K474-C479 PolarHBondContact N-O 3.14Å; Y477-C479 PolarHBondContact O-N 2.83Å; Y477-C479 VanDerWaalsContact O-N 3.17Å
480	E	91	Very high	87.1	Confident	67 Å²	67	55.1 Å²	55.1	31%	0.313	28%	0.281	S	S	.	.			trans	-81	124.2	173.9	-64.9	-154.9	162.8	0	0	111.5	K423 K474	K423-E480 HydrophobicContact CB-CB 4.49Å; K423-E480 HydrophobicContact CD-CB 3.88Å; K423-E480 HydrophobicContact CG-CB 4.31Å; K423-E480 PolarHBondContact N-O 3.38Å; K423-E480 IonicContact NZ-OE2 3.85Å; K423-E480 PolarHBondContact NZ-OE2 3.43Å; K474-E480 HydrophobicContact CD-CG 4.09Å; K474-E480 VanDerWaalsContact CE-OE1 3.23Å; K474-E480 WeakPolarHBondContact CE-OE1 3.47Å; K474-E480 HydrophobicContact CG-CG 4.27Å; K474-E480 IonicContact NZ-OE1 3.1Å; K474-E480 PolarHBondContact NZ-OE1 3.38Å
481	V	92.3	Very high	87	Confident	20 Å²	20	56.7 Å²	56.7	12%	0.121	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	151	177.7	-59.1	0	0	0	0	111.1	M420 K421 F431 A470 M473	M420-V481 HydrophobicContact CG-CB 4.03Å; M420-V481 HydrophobicContact CG-CG1 4.37Å; M420-V481 HydrophobicContact CG-CG2 4.27Å; M420-V481 HydrophobicContact SD-CG2 4.38Å; K421-V481 CarbonylContact O-C 3.49Å; K421-V481 VanDerWaalsContact O-CA 3.28Å; K421-V481 WeakPolarHBondContact O-CA 3.47Å; F431-V481 HydrophobicContact CD2-CG1 3.76Å; F431-V481 HydrophobicContact CE2-CG1 3.71Å; A470-V481 HydrophobicContact CB-CG2 3.53Å; M473-V481 HydrophobicContact SD-CG1 3.8Å; M473-V481 HydrophobicContact SD-CG2 4.38Å
482	E	91.2	Very high	87.2	Confident	122 Å²	122	53.4 Å²	53.4	57%	0.57	27%	0.268	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-108.6	126.2	172.7	-172	178.2	-179.6	0	0	108.8	M420 K421	M420-E482 WeakPolarHBondContact CA-O 3.41Å; K421-E482 PolarHBondContact N-O 3.49Å; K421-E482 PolarHBondContact O-N 3.2Å
483	L	90.2	Very high	87.5	Confident	53 Å²	53	53.2 Å²	53.2	28%	0.277	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	132.2	174.2	-64.8	177.6	0	0	0	109.1	L418 S419 M420 E467 A470	L418-L483 HydrophobicContact CD1-CD1 4.48Å; S419-L483 WeakPolarHBondContact O-CA 3.47Å; M420-L483 HydrophobicContact CB-CD2 4.29Å; M420-L483 HydrophobicContact CE-CD2 3.46Å; M420-L483 VanDerWaalsContact CE-CD2 3.46Å; M420-L483 HydrophobicContact CG-CD2 4.14Å; E467-L483 HydrophobicContact CG-CD1 4.31Å; A470-L483 HydrophobicContact CB-CD1 3.88Å; A470-L483 HydrophobicContact CB-CD2 4.38Å; A470-L483 HydrophobicContact CB-CG 4.14Å
484	G	87.1	Confident	87.6	Confident	27 Å²	27	53.3 Å²	53.3	28%	0.278	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	173.1	179.1	0	0	0	0	0	112.8	S419	S419-G484 PolarHBondContact N-O 3.45Å; S419-G484 PolarHBondContact O-N 2.9Å; S419-G484 VanDerWaalsContact OG-C 3.25Å; S419-G484 WeakPolarHBondContact OG-CA 2.99Å; S419-G484 PolarHBondContact OG-O 3.26Å
485	K	85	Confident	87.7	Confident	154 Å²	154	50.3 Å²	50.3	67%	0.67	26%	0.262	S	S	*	.	P	Polyproline II helix	trans	-67.7	136.2	169.7	-65.4	-177.7	-178.4	-179.5	0	108.9	S419 K487 F662	S419-K485 PolarHBondContact OG-O 3.21Å; K485-K487 PolarHBondContact O-N 3.49Å; K485-F662 HydrophobicContact CD-CB 4.46Å
486	P	82.5	Confident	88.1	Confident	12 Å²	12	48.7 Å²	48.7	8%	0.078	25%	0.253	C	S	.	.	P	Polyproline II helix	trans	-58.4	135.8	168.9	-20.7	32.5	0	0	0	109.8	S417 I457 V488 F662	S417-P486 WeakPolarHBondContact O-CD 3.4Å; S417-P486 WeakPolarHBondContact O-CG 3.25Å; I457-P486 HydrophobicContact CD1-CB 4.25Å; I457-P486 HydrophobicContact CG1-CB 4.48Å; I457-P486 HydrophobicContact CG2-CG 4.47Å; P486-V488 PolarHBondContact O-N 3.28Å; P486-F662 HydrophobicContact CB-CE1 4.21Å; P486-F662 HydrophobicContact CB-CZ 4.27Å; P486-F662 HydrophobicContact CG-CE1 3.81Å; P486-F662 HydrophobicContact CG-CZ 4.36Å
487	K	80.4	Confident	88.5	Confident	121 Å²	121	49.3 Å²	49.3	53%	0.526	26%	0.263	S	S	.	.	P	Polyproline II helix	trans	-63.1	126.9	170.8	-74	-179.7	179.2	168.8	0	110.1	E455 K485	E455-K487 VanDerWaalsContact OE1-CD 3.25Å; E455-K487 WeakPolarHBondContact OE1-CD 3.04Å; E455-K487 WeakPolarHBondContact OE1-CE 3.33Å; E455-K487 IonicContact OE1-NZ 2.7Å; E455-K487 PolarHBondContact OE1-NZ 3.01Å; E455-K487 WeakPolarHBondContact OE2-CG 3.39Å; K485-K487 PolarHBondContact O-N 3.49Å
488	V	82.1	Confident	88.8	Confident	18 Å²	18	47.9 Å²	47.9	11%	0.109	26%	0.259	C	S	.	.	P	Polyproline II helix	trans	-74.8	133.4	172	-178.7	0	0	0	0	108.3	P486 F490 P613 N659 F662	P486-V488 PolarHBondContact O-N 3.28Å; V488-F490 VanDerWaalsContact C-N 3.29Å; V488-F490 HydrophobicContact CB-CD2 4.15Å; V488-F490 HydrophobicContact CB-CE2 3.68Å; V488-F490 HydrophobicContact CB-CZ 3.92Å; V488-F490 HydrophobicContact CG1-CD1 4.48Å; V488-F490 HydrophobicContact CG1-CD2 4.38Å; V488-F490 HydrophobicContact CG1-CE1 4.21Å; V488-F490 HydrophobicContact CG1-CE2 4.12Å; V488-F490 HydrophobicContact CG1-CZ 4.02Å; V488-F490 WeakPolarHBondContact O-CD2 3.38Å; V488-F490 PolarHBondContact O-N 3.43Å; V488-P613 HydrophobicContact CG1-CG 3.64Å; V488-N659 HydrophobicContact CG2-CB 4.11Å; V488-F662 HydrophobicContact CG2-CE2 3.54Å; V488-F662 HydrophobicContact CG2-CZ 3.92Å
489	A	83.6	Confident	89.2	Confident	22 Å²	22	46 Å²	46	18%	0.182	26%	0.256	C	S	.	.			trans	-75.9	81.1	174.5	0	0	0	0	0	109.6	E452 Y685	E452-A489 WeakPolarHBondContact OE2-CB 3.22Å; A489-Y685 VanDerWaalsContact O-CE1 3.25Å; A489-Y685 WeakPolarHBondContact O-CE1 3.34Å; A489-Y685 PolarHBondContact O-OH 3.45Å; A489-Y685 VanDerWaalsContact O-OH 3.12Å
490	F	88.3	Confident	89.4	Confident	17 Å²	17	46.4 Å²	46.4	8%	0.075	26%	0.258	C	S	.	.			trans	-70.5	146	169.9	-64	-78.9	0	0	0	110.1	V488 I565 S567 E612 N659 V688 L696	V488-F490 VanDerWaalsContact C-N 3.29Å; V488-F490 HydrophobicContact CB-CD2 4.15Å; V488-F490 HydrophobicContact CB-CE2 3.68Å; V488-F490 HydrophobicContact CB-CZ 3.92Å; V488-F490 HydrophobicContact CG1-CD1 4.48Å; V488-F490 HydrophobicContact CG1-CD2 4.38Å; V488-F490 HydrophobicContact CG1-CE1 4.21Å; V488-F490 HydrophobicContact CG1-CE2 4.12Å; V488-F490 HydrophobicContact CG1-CZ 4.02Å; V488-F490 WeakPolarHBondContact O-CD2 3.38Å; V488-F490 PolarHBondContact O-N 3.43Å; F490-I565 HydrophobicContact CB-CD1 3.7Å; F490-I565 HydrophobicContact CG-CD1 4.34Å; F490-S567 WeakPolarHBondContact O-CB 3.37Å; F490-S567 PolarHBondContact O-OG 3.49Å; F490-E612 HydrophobicContact CD1-CB 3.81Å; F490-E612 HydrophobicContact CE1-CB 3.72Å; F490-N659 HydrophobicContact CZ-CB 4.4Å; F490-V688 HydrophobicContact CD1-CG2 4.09Å; F490-V688 HydrophobicContact CE1-CG2 4.24Å; F490-L696 HydrophobicContact CD1-CD1 3.94Å; F490-L696 HydrophobicContact CD2-CD1 4.06Å; F490-L696 HydrophobicContact CD2-CD2 4.4Å; F490-L696 HydrophobicContact CE1-CD1 3.68Å; F490-L696 HydrophobicContact CE2-CD1 3.78Å; F490-L696 HydrophobicContact CE2-CD2 3.83Å; F490-L696 HydrophobicContact CE2-CG 4.49Å; F490-L696 HydrophobicContact CG-CD1 4.13Å; F490-L696 HydrophobicContact CZ-CD1 3.59Å; F490-L696 HydrophobicContact CZ-CD2 4.2Å
491	R	88.8	Confident	89.5	Confident	46 Å²	46	47 Å²	47	17%	0.174	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	160.2	172.5	-54	-65.4	177.6	135.1	-3.2	110.3	E452 M530 P568 A570 L610 I611 Y685	E452-R491 IonicContact OE1-CZ 3.21Å; E452-R491 IonicContact OE1-NE 3.57Å; E452-R491 PolarHBondContact OE1-NE 2.91Å; E452-R491 VanDerWaalsContact OE1-NE 3.1Å; E452-R491 IonicContact OE1-NH1 3.18Å; E452-R491 IonicContact OE1-NH2 3.27Å; E452-R491 PolarHBondContact OE1-NH2 2.88Å; E452-R491 IonicContact OE2-CZ 2.77Å; E452-R491 IonicContact OE2-NH2 4Å; E452-R491 PolarHBondContact OE2-NH2 3.4Å; R491-M530 HydrophobicContact CG-CE 4.39Å; R491-M530 HydrophobicContact CG-SD 4.26Å; R491-P568 WeakPolarHBondContact CD-O 3.43Å; R491-A570 HydrophobicContact CB-CB 4.1Å; R491-A570 HydrophobicContact CG-CB 4.37Å; R491-L610 WeakPolarHBondContact O-CA 3.25Å; R491-I611 HydrophobicContact CB-CD1 3.87Å; R491-I611 HydrophobicContact CB-CG1 3.59Å; R491-I611 PolarHBondContact N-O 3.21Å; R491-I611 PolarHBondContact O-N 2.95Å; R491-Y685 HydrophobicContact CG-CD1 4.35Å; R491-Y685 HydrophobicContact CG-CE1 3.79Å
492	E	92.2	Very high	89.5	Confident	0 Å²	0	48.5 Å²	48.5	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	137.2	177.3	-48.1	-166.4	-163	0	0	109.2	G562 P563 L564 I565 G566 S567 P568 V569 A570 W608 L610	E492-G562 VanDerWaalsContact OE2-C 3.26Å; E492-G562 WeakPolarHBondContact OE2-CA 3.32Å; E492-P563 WeakPolarHBondContact OE2-CD 3.35Å; E492-L564 PolarHBondContact OE1-N 3.29Å; E492-L564 WeakPolarHBondContact OE2-CB 3.25Å; E492-L564 PolarHBondContact OE2-N 2.97Å; E492-I565 HydrophobicContact CG-CG1 4.41Å; E492-I565 VanDerWaalsContact OE1-CG1 3.3Å; E492-I565 WeakPolarHBondContact OE1-CG1 3.39Å; E492-I565 PolarHBondContact OE1-N 3.21Å; E492-G566 PolarHBondContact OE1-N 3.37Å; E492-S567 PolarHBondContact OE1-N 3.5Å; E492-P568 PolarHBondContact N-O 2.77Å; E492-V569 HydrophobicContact CB-CG2 4.43Å; E492-V569 CarbonylContact O-C 3.56Å; E492-V569 VanDerWaalsContact O-CA 3.26Å; E492-V569 WeakPolarHBondContact O-CA 3.33Å; E492-A570 PolarHBondContact O-N 2.98Å; E492-W608 HydrophobicContact CB-CE3 4.26Å; E492-L610 HydrophobicContact CG-CD2 3.73Å
493	T	92.7	Very high	89.5	Confident	8 Å²	8	48.5 Å²	48.5	5%	0.049	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	156.1	178.1	-161.9	0	0	0	0	110.7	A570 G571 W608 Q609 I611	T493-A570 WeakPolarHBondContact CB-O 3.35Å; T493-A570 PolarHBondContact OG1-O 3.12Å; T493-G571 PolarHBondContact OG1-O 3.41Å; T493-W608 WeakPolarHBondContact O-CA 3.43Å; T493-Q609 HydrophobicContact CG2-CG 3.51Å; T493-Q609 PolarHBondContact N-O 3.32Å; T493-Q609 PolarHBondContact O-N 3.01Å; T493-I611 HydrophobicContact CG2-CG2 3.67Å
494	L	92.7	Very high	89.5	Confident	1 Å²	1	46.2 Å²	46.2	1%	0.005	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	144.1	175.3	-167.4	68.8	0	0	0	109	A496 C498 C521 P523 I572 W608	L494-A496 WeakPolarHBondContact CD2-O 3.48Å; L494-A496 WeakPolarHBondContact CG-O 3.33Å; L494-C498 HydrophobicContact CD2-CB 4.32Å; L494-C521 HydrophobicContact CD2-CB 4.21Å; L494-C521 VanDerWaalsContact CD2-O 3.26Å; L494-C521 WeakPolarHBondContact CD2-O 3.41Å; L494-P523 VanDerWaalsContact O-CB 3.26Å; L494-P523 WeakPolarHBondContact O-CB 3.28Å; L494-I572 HydrophobicContact CB-CG2 3.74Å; L494-W608 HydrophobicContact CD1-CD2 4.35Å; L494-W608 HydrophobicContact CD1-CZ2 4.07Å
495	S	90.7	Very high	89.6	Confident	46 Å²	46	51.7 Å²	51.7	32%	0.322	26%	0.262	S	S	.	.	S	Bend	trans	-97.6	-29.6	178.2	-62.2	0	0	0	0	112.7	V607 Q609	S495-V607 WeakPolarHBondContact CB-O 3.24Å; S495-V607 PolarHBondContact N-O 2.84Å; S495-Q609 VanDerWaalsContact OG-CG 3.29Å; S495-Q609 WeakPolarHBondContact OG-CG 3.48Å
496	A	91.3	Very high	89.6	Confident	43 Å²	43	49.9 Å²	49.9	36%	0.355	25%	0.254	S	S	.	.	S	Bend	trans	-141.5	147.9	-176.1	0	0	0	0	0	111.1	L494 C498	L494-A496 WeakPolarHBondContact CD2-O 3.48Å; L494-A496 WeakPolarHBondContact CG-O 3.33Å; A496-C498 PolarHBondContact O-N 3.48Å
497	P	93.4	Very high	89.1	Confident	84 Å²	84	57.1 Å²	57.1	55%	0.545	29%	0.287	S	S	.	.			trans	-52	134.7	174.6	-28	36.3	0	0	0	113.1	V520 C521 E522	P497-V520 HydrophobicContact CB-CG1 4.11Å; P497-C521 CarbonylContact C-O 3.51Å; P497-C521 VanDerWaalsContact CA-O 3.32Å; P497-C521 WeakPolarHBondContact CA-O 3.41Å; P497-E522 HydrophobicContact CB-CG 4.1Å; P497-E522 HydrophobicContact CG-CG 4.28Å
498	C	93.7	Very high	88.4	Confident	14 Å²	14	56.3 Å²	56.3	10%	0.095	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	122.2	179	-176.6	0	0	0	0	109.5	L494 A496 V520 C521 V602	L494-C498 HydrophobicContact CD2-CB 4.32Å; A496-C498 PolarHBondContact O-N 3.48Å; C498-V520 WeakPolarHBondContact O-CA 3.34Å; C498-C521 PolarHBondContact N-O 2.85Å; C498-C521 PolarHBondContact O-N 2.87Å; C498-V602 HydrophobicContact CB-CG1 4.16Å
499	S	94.2	Very high	87.6	Confident	91 Å²	91	60.3 Å²	60.3	64%	0.636	34%	0.341	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81	141.6	175.7	55.4	0	0	0	0	111	G519	S499-G519 WeakPolarHBondContact CA-O 3.41Å
500	F	93.1	Very high	86.9	Confident	8 Å²	8	62.2 Å²	62.2	4%	0.035	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	146.5	175.4	57.6	-95.8	0	0	0	111	V517 I518 G519 C521 F574 A598 V602	F500-V517 HydrophobicContact CE2-CG1 4.01Å; F500-I518 WeakPolarHBondContact O-CA 3.34Å; F500-G519 VanDerWaalsContact CE1-C 3.49Å; F500-G519 VanDerWaalsContact CZ-CA 3.45Å; F500-G519 PolarHBondContact N-O 2.96Å; F500-G519 PolarHBondContact O-N 3.25Å; F500-C521 HydrophobicContact CD1-CB 4.35Å; F500-C521 HydrophobicContact CE1-CB 4.25Å; F500-F574 AromaticContact CD1-CE2 3.94Å; F500-F574 HydrophobicContact CD1-CE2 3.94Å; F500-F574 HydrophobicContact CD1-CZ 4.45Å; F500-F574 HydrophobicContact CD2-CE2 4.47Å; F500-F574 HydrophobicContact CD2-CZ 4.24Å; F500-F574 AromaticContact CE1-CD2 3.71Å; F500-F574 HydrophobicContact CE1-CD2 3.71Å; F500-F574 HydrophobicContact CE1-CE1 4.4Å; F500-F574 AromaticContact CE1-CE2 3.28Å; F500-F574 HydrophobicContact CE1-CE2 3.28Å; F500-F574 HydrophobicContact CE1-CG 4.44Å; F500-F574 AromaticContact CE1-CZ 3.69Å; F500-F574 HydrophobicContact CE1-CZ 3.69Å; F500-F574 HydrophobicContact CE2-CE1 4.07Å; F500-F574 AromaticContact CE2-CE2 3.91Å; F500-F574 HydrophobicContact CE2-CE2 3.91Å; F500-F574 AromaticContact CE2-CZ 3.44Å; F500-F574 HydrophobicContact CE2-CZ 3.44Å; F500-F574 VanDerWaalsContact CE2-CZ 3.44Å; F500-F574 HydrophobicContact CG-CE2 4.49Å; F500-F574 HydrophobicContact CZ-CD1 4.17Å; F500-F574 AromaticContact CZ-CD2 3.9Å; F500-F574 HydrophobicContact CZ-CD2 3.9Å; F500-F574 AromaticContact CZ-CE1 3.6Å; F500-F574 HydrophobicContact CZ-CE1 3.6Å; F500-F574 AromaticContact CZ-CE2 3.27Å; F500-F574 HydrophobicContact CZ-CE2 3.27Å; F500-F574 HydrophobicContact CZ-CG 4.32Å; F500-F574 AromaticContact CZ-CZ 3.12Å; F500-F574 HydrophobicContact CZ-CZ 3.12Å; F500-A598 HydrophobicContact CD2-CB 3.85Å; F500-A598 HydrophobicContact CE2-CB 4.41Å; F500-A598 HydrophobicContact CG-CB 4.34Å; F500-V602 HydrophobicContact CB-CG2 3.77Å; F500-V602 HydrophobicContact CD1-CG2 3.67Å; F500-V602 HydrophobicContact CG-CG2 4.05Å
501	D	93.7	Very high	86	Confident	81 Å²	81	69.8 Å²	69.8	43%	0.433	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	90.4	173.5	179.2	1	0	0	0	108.3	R516 I518	D501-R516 VanDerWaalsContact CG-NH2 3.32Å; D501-R516 IonicContact OD1-CZ 3.65Å; D501-R516 IonicContact OD1-NE 3.11Å; D501-R516 PolarHBondContact OD1-NE 3Å; D501-R516 IonicContact OD1-NH2 2.67Å; D501-R516 PolarHBondContact OD1-NH2 2.92Å; D501-R516 VanDerWaalsContact OD1-NH2 3.15Å; D501-R516 IonicContact OD2-CZ 3Å; D501-R516 IonicContact OD2-NE 2.84Å; D501-R516 IonicContact OD2-NH2 2.78Å; D501-R516 PolarHBondContact OD2-NH2 3.47Å; D501-I518 HydrophobicContact CB-CG1 4.39Å; D501-I518 HydrophobicContact CB-CG2 4.47Å; D501-I518 WeakPolarHBondContact OD1-CG1 3.37Å
502	Y	93.5	Very high	85.6	Confident	50 Å²	50	68.2 Å²	68.2	20%	0.196	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	127.2	-179	-169.5	-96	0	0	0	111	H504 R516 V517 A594 Y597 A598 D601	Y502-H504 HydrophobicContact CD1-CB 4.33Å; Y502-H504 HydrophobicContact CE1-CB 3.81Å; Y502-R516 CarbonylContact O-C 3.54Å; Y502-R516 VanDerWaalsContact O-CA 3.23Å; Y502-R516 WeakPolarHBondContact O-CA 3.31Å; Y502-R516 WeakPolarHBondContact O-CG 3.35Å; Y502-V517 PolarHBondContact N-O 3.42Å; Y502-V517 VanDerWaalsContact N-O 3.08Å; Y502-V517 PolarHBondContact O-N 3.43Å; Y502-A594 HydrophobicContact CD1-CB 4.24Å; Y502-A594 WeakPolarHBondContact CD1-O 3.13Å; Y502-Y597 AromaticContact CE1-CD2 3.9Å; Y502-Y597 HydrophobicContact CE1-CD2 3.9Å; Y502-Y597 AromaticContact CE1-CG 4Å; Y502-Y597 HydrophobicContact CE1-CG 4Å; Y502-Y597 VanDerWaalsContact CE2-CB 3.49Å; Y502-Y597 HydrophobicContact CE2-CG 4.33Å; Y502-Y597 AromaticContact CZ-CD2 3.89Å; Y502-Y597 AromaticContact CZ-CG 3.69Å; Y502-Y597 WeakPolarHBondContact OH-CB 3.38Å; Y502-Y597 WeakPolarHBondContact OH-CD2 3.47Å; Y502-A598 HydrophobicContact CG-CB 4.49Å; Y502-D601 WeakPolarHBondContact CD2-OD2 3.39Å
503	W	89.9	Confident	85.3	Confident	122 Å²	122	70.4 Å²	70.4	46%	0.462	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	128.4	167.4	143.9	-24.8	0	0	0	107.5	R505 R516	W503-R505 HydrophobicContact CZ2-CB 4.35Å; W503-R505 VanDerWaalsContact CZ2-CZ 3.49Å; W503-R516 HydrophobicContact CB-CB 4.44Å; W503-R516 HydrophobicContact CB-CG 4.19Å
504	H	91.1	Very high	85.2	Confident	5 Å²	5	72.4 Å²	72.4	2%	0.023	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	112.9	165.7	-173.7	63.7	0	0	0	109.5	Y502 Q513 Y514 G515 A594	Y502-H504 HydrophobicContact CD1-CB 4.33Å; Y502-H504 HydrophobicContact CE1-CB 3.81Å; H504-Q513 PolarHBondContact NE2-OE1 3.01Å; H504-Y514 WeakPolarHBondContact O-CA 3.31Å; H504-G515 WeakPolarHBondContact CB-O 3.36Å; H504-G515 PolarHBondContact N-O 3.44Å; H504-G515 PolarHBondContact O-N 3.14Å; H504-A594 HydrophobicContact CB-CB 3.83Å
505	R	88.6	Confident	85.1	Confident	143 Å²	143	72.4 Å²	72.4	54%	0.54	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	119.2	172.1	-172	-179.7	76.6	178.3	2.7	110.5	W503 Q513	W503-R505 HydrophobicContact CZ2-CB 4.35Å; W503-R505 VanDerWaalsContact CZ2-CZ 3.49Å; R505-Q513 VanDerWaalsContact CA-O 3.31Å; R505-Q513 WeakPolarHBondContact CA-O 3.29Å
506	K	85	Confident	85.2	Confident	115 Å²	115	73.9 Å²	73.9	50%	0.5	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	118.4	166.3	-75.5	-174.3	175.1	-179.5	0	109.4	Q513	K506-Q513 HydrophobicContact CB-CB 4.39Å; K506-Q513 PolarHBondContact N-O 2.94Å; K506-Q513 VanDerWaalsContact N-O 3.08Å; K506-Q513 PolarHBondContact O-N 2.65Å
507	Q	72.8	Confident	85.3	Confident	164 Å²	164	71.8 Å²	71.8	77%	0.766	40%	0.396	S	S	*	.			trans	-127.4	76	178.2	-161.5	175.3	3.9	0	0	107.9
508	S	64.5	Low	85.3	Confident	105 Å²	105	70 Å²	70	73%	0.734	38%	0.381	S	S	*	.	S	Bend	trans	-139.2	102.8	174	49	0	0	0	0	110.1	G510	S508-G510 PolarHBondContact O-N 3.16Å
509	G	64.7	Low	85.3	Confident	101 Å²	101	69.5 Å²	69.5	100%	1.041	38%	0.378	S	S	*	.	S	Bend	trans	63.4	-8.1	162.4	0	0	0	0	0	120
510	G	69.3	Low	85.3	Confident	62 Å²	62	66 Å²	66	64%	0.639	35%	0.353	S	S	*	.	S	Bend	trans	-130.6	-160.9	-177.3	0	0	0	0	0	113.9	S508 G512	S508-G510 PolarHBondContact O-N 3.16Å; G510-G512 PolarHBondContact O-N 3.45Å
511	Q	69.6	Low	85.4	Confident	177 Å²	177	65.6 Å²	65.6	83%	0.827	35%	0.351	S	S	*	.	S	Bend	trans	-55	123.5	170.4	-76.4	-173.5	-7.2	0	0	109.2
512	G	80	Confident	85.4	Confident	13 Å²	13	64.1 Å²	64.1	13%	0.134	34%	0.342	C	S	.	.			trans	-59.5	146.2	176.1	0	0	0	0	0	110.3	G510 D585	G510-G512 PolarHBondContact O-N 3.45Å; G512-D585 WeakPolarHBondContact CA-OD1 3.37Å
513	Q	86.7	Confident	85.4	Confident	45 Å²	45	63.8 Å²	63.8	21%	0.21	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	121.5	170.2	-66.5	-176.4	-9.7	0	0	108	H504 R505 K506 D585 A590	H504-Q513 PolarHBondContact NE2-OE1 3.01Å; R505-Q513 VanDerWaalsContact CA-O 3.31Å; R505-Q513 WeakPolarHBondContact CA-O 3.29Å; K506-Q513 HydrophobicContact CB-CB 4.39Å; K506-Q513 PolarHBondContact N-O 2.94Å; K506-Q513 VanDerWaalsContact N-O 3.08Å; K506-Q513 PolarHBondContact O-N 2.65Å; Q513-D585 CarbonylContact C-O 3.59Å; Q513-D585 WeakPolarHBondContact CA-O 3.21Å; Q513-A590 HydrophobicContact CB-CB 4Å
514	Y	90.1	Very high	85.5	Confident	51 Å²	51	58.7 Å²	58.7	20%	0.2	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	125.1	175.6	-173.8	-88.4	0	0	0	110.9	H504 A580 H581 H582 D585 S586	H504-Y514 WeakPolarHBondContact O-CA 3.31Å; Y514-A580 HydrophobicContact CE1-CB 3.97Å; Y514-A580 WeakPolarHBondContact OH-CB 3.49Å; Y514-H581 VanDerWaalsContact CE1-C 3.5Å; Y514-H582 HydrophobicContact CD1-CB 3.56Å; Y514-H582 VanDerWaalsContact CD1-N 3.31Å; Y514-H582 HydrophobicContact CE1-CB 4.25Å; Y514-H582 HydrophobicContact CG-CB 3.72Å; Y514-D585 PolarHBondContact N-O 2.83Å; Y514-S586 VanDerWaalsContact O-CA 3.3Å; Y514-S586 WeakPolarHBondContact O-CA 3.19Å; Y514-S586 WeakPolarHBondContact O-CB 3.37Å; Y514-S586 PolarHBondContact O-OG 2.81Å
515	G	90.4	Very high	85.2	Confident	1 Å²	1	61.6 Å²	61.6	1%	0.01	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-162	130.4	168.9	0	0	0	0	0	110.1	H504	H504-G515 WeakPolarHBondContact CB-O 3.36Å; H504-G515 PolarHBondContact N-O 3.44Å; H504-G515 PolarHBondContact O-N 3.14Å
516	R	93.7	Very high	84.8	Confident	76 Å²	76	58.4 Å²	58.4	29%	0.287	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	133.7	172.7	-174.5	-178.7	-176.5	-174.7	-1.2	109.4	D501 Y502 W503 I518 G579 A580	D501-R516 VanDerWaalsContact CG-NH2 3.32Å; D501-R516 IonicContact OD1-CZ 3.65Å; D501-R516 IonicContact OD1-NE 3.11Å; D501-R516 PolarHBondContact OD1-NE 3Å; D501-R516 IonicContact OD1-NH2 2.67Å; D501-R516 PolarHBondContact OD1-NH2 2.92Å; D501-R516 VanDerWaalsContact OD1-NH2 3.15Å; D501-R516 IonicContact OD2-CZ 3Å; D501-R516 IonicContact OD2-NE 2.84Å; D501-R516 IonicContact OD2-NH2 2.78Å; D501-R516 PolarHBondContact OD2-NH2 3.47Å; Y502-R516 CarbonylContact O-C 3.54Å; Y502-R516 VanDerWaalsContact O-CA 3.23Å; Y502-R516 WeakPolarHBondContact O-CA 3.31Å; Y502-R516 WeakPolarHBondContact O-CG 3.35Å; W503-R516 HydrophobicContact CB-CB 4.44Å; W503-R516 HydrophobicContact CB-CG 4.19Å; R516-I518 HydrophobicContact CG-CG1 4.23Å; R516-G579 CarbonylContact O-C 3.59Å; R516-G579 WeakPolarHBondContact O-CA 3.24Å; R516-A580 HydrophobicContact CB-CB 3.92Å; R516-A580 PolarHBondContact N-O 2.9Å; R516-A580 PolarHBondContact O-N 3.39Å
517	V	92.9	Very high	84.6	Confident	0 Å²	0	59.9 Å²	59.9	0%	0	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	124.1	179.8	-168.2	0	0	0	0	108	F500 Y502 I551 V576 F591 A594	F500-V517 HydrophobicContact CE2-CG1 4.01Å; Y502-V517 PolarHBondContact N-O 3.42Å; Y502-V517 VanDerWaalsContact N-O 3.08Å; Y502-V517 PolarHBondContact O-N 3.43Å; V517-I551 HydrophobicContact CG1-CD1 4.47Å; V517-I551 HydrophobicContact CG1-CG2 4.24Å; V517-I551 HydrophobicContact CG2-CD1 4.16Å; V517-I551 HydrophobicContact CG2-CG1 4.4Å; V517-V576 HydrophobicContact CG1-CG1 3.72Å; V517-V576 HydrophobicContact CG1-CG2 4.1Å; V517-F591 HydrophobicContact CG2-CD1 4.08Å; V517-F591 HydrophobicContact CG2-CE1 4.45Å; V517-A594 HydrophobicContact CG2-CB 3.87Å
518	I	94.1	Very high	85.1	Confident	45 Å²	45	57.3 Å²	57.3	23%	0.231	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	133.3	-178	-52.8	175.8	0	0	0	108.2	F500 D501 R516 R577 D578	F500-I518 WeakPolarHBondContact O-CA 3.34Å; D501-I518 HydrophobicContact CB-CG1 4.39Å; D501-I518 HydrophobicContact CB-CG2 4.47Å; D501-I518 WeakPolarHBondContact OD1-CG1 3.37Å; R516-I518 HydrophobicContact CG-CG1 4.23Å; I518-R577 PolarHBondContact O-N 3.38Å; I518-D578 WeakPolarHBondContact CA-O 3.41Å; I518-D578 HydrophobicContact CB-CB 4.37Å; I518-D578 WeakPolarHBondContact CB-O 3.34Å; I518-D578 PolarHBondContact N-O 2.82Å; I518-D578 PolarHBondContact O-N 3.1Å; I518-D578 VanDerWaalsContact O-N 3.11Å
519	G	93.8	Very high	85.7	Confident	4 Å²	4	53.1 Å²	53.1	4%	0.041	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-177.5	-167.3	-175.4	0	0	0	0	0	114.4	S499 F500 C575	S499-G519 WeakPolarHBondContact CA-O 3.41Å; F500-G519 VanDerWaalsContact CE1-C 3.49Å; F500-G519 VanDerWaalsContact CZ-CA 3.45Å; F500-G519 PolarHBondContact N-O 2.96Å; F500-G519 PolarHBondContact O-N 3.25Å; G519-C575 CarbonylContact C-O 3.5Å; G519-C575 WeakPolarHBondContact CA-O 3.44Å
520	V	94.7	Very high	86.5	Confident	17 Å²	17	51.8 Å²	51.8	10%	0.103	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	130.8	176.7	-175.2	0	0	0	0	108.4	P497 C498 E522 C575	P497-V520 HydrophobicContact CB-CG1 4.11Å; C498-V520 WeakPolarHBondContact O-CA 3.34Å; V520-E522 HydrophobicContact CG1-CG 3.73Å; V520-C575 PolarHBondContact N-O 3Å; V520-C575 VanDerWaalsContact O-CB 3.31Å; V520-C575 WeakPolarHBondContact O-CB 3.45Å; V520-C575 PolarHBondContact O-N 3.42Å
521	C	93.8	Very high	87.3	Confident	0 Å²	0	53.7 Å²	53.7	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	123.4	168.9	-168.3	0	0	0	0	108.4	L494 P497 C498 F500 R573 F574 V602	L494-C521 HydrophobicContact CD2-CB 4.21Å; L494-C521 VanDerWaalsContact CD2-O 3.26Å; L494-C521 WeakPolarHBondContact CD2-O 3.41Å; P497-C521 CarbonylContact C-O 3.51Å; P497-C521 VanDerWaalsContact CA-O 3.32Å; P497-C521 WeakPolarHBondContact CA-O 3.41Å; C498-C521 PolarHBondContact N-O 2.85Å; C498-C521 PolarHBondContact O-N 2.87Å; F500-C521 HydrophobicContact CD1-CB 4.35Å; F500-C521 HydrophobicContact CE1-CB 4.25Å; C521-R573 CarbonylContact C-O 3.6Å; C521-R573 VanDerWaalsContact CA-O 3.31Å; C521-R573 WeakPolarHBondContact CA-O 3.34Å; C521-F574 HydrophobicContact CB-CD2 4.47Å; C521-V602 HydrophobicContact CB-CG1 3.88Å; C521-V602 HydrophobicContact CB-CG2 4.2Å
522	E	93.6	Very high	88.3	Confident	50 Å²	50	47.7 Å²	47.7	23%	0.234	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	146	-175.2	-60.4	-178.1	160.9	0	0	110.9	P497 V520 I572 R573 R577	P497-E522 HydrophobicContact CB-CG 4.1Å; P497-E522 HydrophobicContact CG-CG 4.28Å; V520-E522 HydrophobicContact CG1-CG 3.73Å; E522-I572 CarbonylContact O-C 3.55Å; E522-I572 WeakPolarHBondContact O-CA 3.19Å; E522-R573 PolarHBondContact N-O 2.84Å; E522-R573 PolarHBondContact O-N 2.74Å; E522-R573 IonicContact OE2-NH1 3.37Å; E522-R577 IonicContact OE1-NH2 3.74Å
523	P	93.5	Very high	88.9	Confident	43 Å²	43	49.7 Å²	49.7	28%	0.279	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	142.8	172.4	30.9	-35.5	0	0	0	111.8	L494	L494-P523 VanDerWaalsContact O-CB 3.26Å; L494-P523 WeakPolarHBondContact O-CB 3.28Å
524	L	91.9	Very high	89.2	Confident	15 Å²	15	49.4 Å²	49.4	8%	0.079	25%	0.249	C	C	.	.	P	Polyproline II helix	trans	-82.1	153.3	171.7	-69.3	176.2	0	0	0	111.2	R528 E531 E533 G571 R573	L524-R528 HydrophobicContact CB-CB 4.37Å; L524-R528 HydrophobicContact CD1-CB 4.41Å; L524-E531 HydrophobicContact CD1-CB 4.07Å; L524-E531 WeakPolarHBondContact CD1-O 3.38Å; L524-E533 HydrophobicContact CD1-CB 4.16Å; L524-E533 HydrophobicContact CD2-CB 4.27Å; L524-E533 WeakPolarHBondContact CD2-OE2 3.5Å; L524-G571 WeakPolarHBondContact CB-O 3.24Å; L524-G571 PolarHBondContact N-O 3.42Å; L524-R573 HydrophobicContact CD2-CB 3.96Å; L524-R573 HydrophobicContact CG-CB 4.44Å
525	P	86.5	Confident	89.3	Confident	67 Å²	67	52.6 Å²	52.6	44%	0.435	26%	0.261	S	S	.	.	P	Polyproline II helix	trans	-56.6	152.6	171.7	-24.8	34.6	0	0	0	112.4	H527 R528 N529	P525-H527 WeakPolarHBondContact CB-CE1 3.22Å; P525-H527 WeakPolarHBondContact CB-ND1 3.27Å; P525-H527 PolarHBondContact O-N 2.9Å; P525-R528 CarbonylContact O-C 3.57Å; P525-R528 PolarHBondContact O-N 2.96Å; P525-N529 PolarHBondContact O-N 2.88Å
526	A	79.5	Confident	89.3	Confident	75 Å²	75	56 Å²	56	62%	0.62	28%	0.279	S	S	*	.	G	3₁₀ helix	trans	-55.2	-25.8	-175.4	0	0	0	0	0	115.3	R528 N529	A526-R528 VanDerWaalsContact C-N 3.31Å; A526-N529 PolarHBondContact O-ND2 3.03Å; A526-N529 PolarHBondContact O-OD1 3.25Å
527	H	79.9	Confident	89.2	Confident	146 Å²	146	55.1 Å²	55.1	68%	0.676	28%	0.278	S	S	*	.	G	3₁₀ helix	trans	-78.5	-12	177.5	66.5	-86.1	0	0	0	113.8	P525	P525-H527 WeakPolarHBondContact CB-CE1 3.22Å; P525-H527 WeakPolarHBondContact CB-ND1 3.27Å; P525-H527 PolarHBondContact O-N 2.9Å
528	R	83	Confident	88.8	Confident	110 Å²	110	56.5 Å²	56.5	42%	0.415	29%	0.287	S	S	.	.	G	3₁₀ helix	trans	-121.3	22.1	175.4	-67.3	-177.3	-172.3	-169.4	-2.1	112.2	L524 P525 A526 M530 E531	L524-R528 HydrophobicContact CB-CB 4.37Å; L524-R528 HydrophobicContact CD1-CB 4.41Å; P525-R528 CarbonylContact O-C 3.57Å; P525-R528 PolarHBondContact O-N 2.96Å; A526-R528 VanDerWaalsContact C-N 3.31Å; R528-M530 PolarHBondContact O-N 3.3Å; R528-E531 WeakPolarHBondContact CD-OE2 3.5Å; R528-E531 PolarHBondContact O-N 3.37Å
529	N	78.6	Confident	88.2	Confident	18 Å²	18	61 Å²	61	10%	0.096	32%	0.317	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.3	2.4	-175.4	65	-3.1	0	0	0	115	P525 A526 A570 G571 I611 Y685	P525-N529 PolarHBondContact O-N 2.88Å; A526-N529 PolarHBondContact O-ND2 3.03Å; A526-N529 PolarHBondContact O-OD1 3.25Å; N529-A570 CarbonylContact O-C 3.57Å; N529-A570 WeakPolarHBondContact O-CB 3.2Å; N529-G571 VanDerWaalsContact O-CA 3.32Å; N529-G571 WeakPolarHBondContact O-CA 3.4Å; N529-G571 PolarHBondContact O-N 3.16Å; N529-G571 VanDerWaalsContact O-N 3.12Å; N529-I611 HydrophobicContact CB-CD1 4.49Å; N529-Y685 PolarHBondContact ND2-O 3.28Å
530	M	80.2	Confident	87.4	Confident	73 Å²	73	63 Å²	63	36%	0.36	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105	-6.6	172.6	-69	-59.3	-70	0	0	113.5	R491 R528 A570 Y685	R491-M530 HydrophobicContact CG-CE 4.39Å; R491-M530 HydrophobicContact CG-SD 4.26Å; R528-M530 PolarHBondContact O-N 3.3Å; M530-A570 HydrophobicContact SD-CB 4.4Å; M530-Y685 HydrophobicContact CE-CD2 4.16Å; M530-Y685 HydrophobicContact CE-CE2 3.62Å; M530-Y685 HydrophobicContact CG-CD2 3.81Å; M530-Y685 HydrophobicContact CG-CE2 4.19Å; M530-Y685 HydrophobicContact SD-CD1 4.38Å; M530-Y685 HydrophobicContact SD-CD2 3.24Å; M530-Y685 WeakPolarHBondContact SD-CD2 3.4Å; M530-Y685 HydrophobicContact SD-CE1 4.43Å; M530-Y685 HydrophobicContact SD-CE2 3.35Å; M530-Y685 WeakPolarHBondContact SD-CE2 3.3Å; M530-Y685 HydrophobicContact SD-CG 3.82Å
531	E	86.2	Confident	86.9	Confident	101 Å²	101	68.1 Å²	68.1	47%	0.472	36%	0.363	S	S	.	.			trans	-91.5	152	-177.8	-64.1	178.3	179.6	0	0	111.2	L524 R528 G571 I572	L524-E531 HydrophobicContact CD1-CB 4.07Å; L524-E531 WeakPolarHBondContact CD1-O 3.38Å; R528-E531 WeakPolarHBondContact CD-OE2 3.5Å; R528-E531 PolarHBondContact O-N 3.37Å; E531-G571 VanDerWaalsContact O-CA 3.28Å; E531-G571 WeakPolarHBondContact O-CA 3.32Å; E531-G571 PolarHBondContact O-N 2.94Å; E531-I572 PolarHBondContact O-N 3.08Å
532	L	90.5	Very high	86.4	Confident	52 Å²	52	71.8 Å²	71.8	27%	0.272	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	107.9	166.4	-69.2	175.8	0	0	0	107.2	F555 C559 V569 I572	L532-F555 HydrophobicContact CB-CE1 4.12Å; L532-F555 HydrophobicContact CB-CZ 4.29Å; L532-F555 HydrophobicContact CD2-CZ 4.08Å; L532-C559 HydrophobicContact CD1-CB 3.76Å; L532-C559 HydrophobicContact CD2-CB 4.34Å; L532-V569 HydrophobicContact CD2-CG1 4.45Å; L532-I572 HydrophobicContact CD2-CD1 4.23Å; L532-I572 HydrophobicContact CD2-CG1 3.5Å
533	E	92.4	Very high	86.1	Confident	54 Å²	54	69.6 Å²	69.6	25%	0.252	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	130.1	-179.1	-169.6	177.8	179.3	0	0	109.5	L524 I572 R573 F574	L524-E533 HydrophobicContact CD1-CB 4.16Å; L524-E533 HydrophobicContact CD2-CB 4.27Å; L524-E533 WeakPolarHBondContact CD2-OE2 3.5Å; E533-I572 PolarHBondContact N-O 3.37Å; E533-R573 HydrophobicContact CB-CB 4.13Å; E533-R573 HydrophobicContact CB-CG 4.04Å; E533-R573 VanDerWaalsContact CD-NE 3.25Å; E533-R573 HydrophobicContact CG-CG 4.11Å; E533-R573 CarbonylContact O-C 3.6Å; E533-R573 VanDerWaalsContact O-CA 3.23Å; E533-R573 WeakPolarHBondContact O-CA 3.37Å; E533-R573 IonicContact OE1-CZ 3.83Å; E533-R573 IonicContact OE1-NE 3.39Å; E533-R573 IonicContact OE1-NH2 2.69Å; E533-R573 IonicContact OE2-CZ 2.81Å; E533-R573 VanDerWaalsContact OE2-CZ 3.24Å; E533-R573 IonicContact OE2-NE 3.23Å; E533-R573 PolarHBondContact OE2-NE 2.9Å; E533-R573 IonicContact OE2-NH2 3.81Å; E533-R573 PolarHBondContact OE2-NH2 2.69Å; E533-F574 PolarHBondContact O-N 2.95Å
534	F	93.6	Very high	85.8	Confident	39 Å²	39	68.8 Å²	68.8	17%	0.171	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	127.4	171.1	176.6	-95.4	0	0	0	108.5	M548 I551 E552 F555 F574 V576	F534-M548 HydrophobicContact CZ-SD 4.48Å; F534-I551 HydrophobicContact CE2-CB 4.45Å; F534-I551 HydrophobicContact CE2-CG2 3.84Å; F534-I551 HydrophobicContact CZ-CB 4.41Å; F534-I551 HydrophobicContact CZ-CG2 4.18Å; F534-E552 HydrophobicContact CB-CG 3.88Å; F534-E552 HydrophobicContact CD1-CB 3.98Å; F534-E552 HydrophobicContact CD1-CG 4.02Å; F534-E552 HydrophobicContact CD2-CB 4.03Å; F534-E552 HydrophobicContact CD2-CG 4.21Å; F534-E552 HydrophobicContact CE1-CB 4.15Å; F534-E552 HydrophobicContact CE2-CB 4.19Å; F534-E552 HydrophobicContact CG-CB 3.93Å; F534-E552 HydrophobicContact CG-CG 3.76Å; F534-E552 HydrophobicContact CZ-CB 4.25Å; F534-F555 HydrophobicContact CD2-CD1 4.48Å; F534-F574 HydrophobicContact CD2-CB 4.4Å; F534-F574 AromaticContact CD2-CD1 3.91Å; F534-F574 HydrophobicContact CD2-CD1 3.91Å; F534-F574 AromaticContact CE2-CD1 3.85Å; F534-F574 HydrophobicContact CE2-CD1 3.85Å; F534-F574 HydrophobicContact CE2-CE1 4.42Å; F534-V576 HydrophobicContact CE2-CG2 3.64Å; F534-V576 HydrophobicContact CZ-CG2 3.86Å
535	R	92.7	Very high	85.5	Confident	119 Å²	119	75.3 Å²	75.3	45%	0.449	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	124.1	-178.3	-165.7	-179	-174.2	-168.1	7.7	110.7	E537 R573 F574 C575 V576	R535-E537 WeakPolarHBondContact CD-OE1 3.49Å; R535-E537 HydrophobicContact CG-CG 4.06Å; R535-E537 IonicContact CZ-OE1 3.24Å; R535-E537 IonicContact NE-OE1 3.97Å; R535-E537 PolarHBondContact NE-OE1 3.03Å; R535-E537 IonicContact NH1-OE1 3.15Å; R535-E537 PolarHBondContact NH1-OE1 2.77Å; R535-R573 HydrophobicContact CB-CG 4.46Å; R535-F574 PolarHBondContact N-O 3.42Å; R535-C575 CarbonylContact O-C 3.47Å; R535-C575 WeakPolarHBondContact O-CA 3.5Å; R535-V576 PolarHBondContact O-N 3.02Å
536	D	91.4	Very high	85.6	Confident	71 Å²	71	78.9 Å²	78.9	38%	0.38	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	113.4	169.2	-178.5	9.9	0	0	0	109.2	C538	D536-C538 WeakPolarHBondContact OD1-CB 3.5Å; D536-C538 PolarHBondContact OD1-N 3.05Å; D536-C538 PolarHBondContact OD1-SG 3.03Å
537	E	90.2	Very high	86.2	Confident	59 Å²	59	76.2 Å²	76.2	28%	0.276	38%	0.381	S	S	.	.			trans	-113.1	14.7	173.7	-63.6	-174	164.1	0	0	111.3	R535 V539 V576 R577	R535-E537 WeakPolarHBondContact CD-OE1 3.49Å; R535-E537 HydrophobicContact CG-CG 4.06Å; R535-E537 IonicContact CZ-OE1 3.24Å; R535-E537 IonicContact NE-OE1 3.97Å; R535-E537 PolarHBondContact NE-OE1 3.03Å; R535-E537 IonicContact NH1-OE1 3.15Å; R535-E537 PolarHBondContact NH1-OE1 2.77Å; E537-V539 PolarHBondContact O-N 2.69Å; E537-V576 CarbonylContact C-O 3.57Å; E537-V576 WeakPolarHBondContact CA-O 3.42Å; E537-V576 PolarHBondContact N-O 3.5Å; E537-R577 HydrophobicContact CB-CG 4.22Å; E537-R577 IonicContact OE2-NE 3.33Å; E537-R577 PolarHBondContact OE2-NE 2.81Å
538	C	85.7	Confident	86.7	Confident	29 Å²	29	69.9 Å²	69.9	20%	0.196	35%	0.352	C	S	.	.			trans	-67.9	122.1	-176.7	-67.7	0	0	0	0	111.8	D536 M548 V576 R577	D536-C538 WeakPolarHBondContact OD1-CB 3.5Å; D536-C538 PolarHBondContact OD1-N 3.05Å; D536-C538 PolarHBondContact OD1-SG 3.03Å; C538-M548 HydrophobicContact CB-CE 4.35Å; C538-V576 PolarHBondContact N-O 3.3Å; C538-V576 PolarHBondContact SG-O 3.14Å; C538-R577 WeakPolarHBondContact CA-O 3.43Å
539	V	79.7	Confident	87.2	Confident	140 Å²	140	68.4 Å²	68.4	85%	0.848	36%	0.356	S	S	*	.			trans	-99.6	97.5	174.1	-174.1	0	0	0	0	109.3	E537	E537-V539 PolarHBondContact O-N 2.69Å
540	G	78.9	Confident	87.8	Confident	44 Å²	44	68.2 Å²	68.2	45%	0.454	36%	0.357	S	S	.	.	S	Bend	trans	124.9	-160.8	177.7	0	0	0	0	0	113.4
541	N	82.3	Confident	88.5	Confident	125 Å²	125	64.8 Å²	64.8	67%	0.668	34%	0.339	S	S	*	.	S	Bend	trans	-113	19.6	-178.3	-75.2	-14.7	0	0	0	112.8	V543 H581	N541-V543 PolarHBondContact O-N 3.17Å; N541-H581 PolarHBondContact O-CE1 3.45Å
542	N	85	Confident	88.8	Confident	78 Å²	78	62.1 Å²	62.1	42%	0.417	33%	0.327	S	S	.	.	S	Bend	trans	-61.9	-31.6	-179.9	-73.4	-9	0	0	0	112.6	D578 A580 H581	N542-D578 VanDerWaalsContact CB-OD1 3.27Å; N542-D578 WeakPolarHBondContact CB-OD1 3.24Å; N542-D578 PolarHBondContact ND2-OD1 3.36Å; N542-D578 PolarHBondContact ND2-OD2 3.22Å; N542-A580 CarbonylContact O-C 3.57Å; N542-H581 PolarHBondContact O-N 2.95Å; N542-H581 PolarHBondContact O-ND1 2.75Å
543	V	86.5	Confident	88.9	Confident	3 Å²	3	66.3 Å²	66.3	2%	0.018	34%	0.343	C	S	.	.	S	Bend	trans	-118.3	116.3	166.4	-175.7	0	0	0	0	107.8	N541 K545 M548 I551 F591	N541-V543 PolarHBondContact O-N 3.17Å; V543-K545 PolarHBondContact O-N 3.04Å; V543-M548 HydrophobicContact CB-CE 3.55Å; V543-M548 HydrophobicContact CG1-CE 3.41Å; V543-M548 VanDerWaalsContact CG1-CE 3.41Å; V543-M548 HydrophobicContact CG1-SD 4.44Å; V543-I551 HydrophobicContact CG1-CD1 3.91Å; V543-F591 HydrophobicContact CG1-CD1 4.42Å; V543-F591 HydrophobicContact CG1-CE1 3.79Å; V543-F591 HydrophobicContact CG1-CZ 4.05Å; V543-F591 HydrophobicContact CG2-CE1 4.47Å
544	P	86.4	Confident	88.9	Confident	26 Å²	26	63.7 Å²	63.7	17%	0.169	33%	0.331	C	S	.	.			trans	-57.5	130.3	177.9	-27.5	35	0	0	0	111.6	Q546 F547 H581	P544-Q546 HydrophobicContact CB-CG 3.93Å; P544-Q546 PolarHBondContact O-N 3.07Å; P544-F547 HydrophobicContact CB-CD2 3.77Å; P544-F547 HydrophobicContact CB-CE2 4.04Å; P544-F547 HydrophobicContact CG-CD2 3.9Å; P544-F547 HydrophobicContact CG-CE2 3.94Å; P544-F547 PolarHBondContact O-N 2.8Å; P544-H581 HydrophobicContact CG-CB 4.2Å
545	K	86.6	Confident	88.9	Confident	153 Å²	153	61.9 Å²	61.9	67%	0.665	32%	0.323	S	S	*	.	G	3₁₀ helix	trans	-55.8	-27.2	-176.7	-67.7	-170.8	175.7	-173.4	0	114.2	V543 F547 M548	V543-K545 PolarHBondContact O-N 3.04Å; K545-F547 PolarHBondContact O-N 2.95Å; K545-M548 PolarHBondContact O-N 2.87Å
546	Q	89	Confident	88.9	Confident	142 Å²	142	62 Å²	62	66%	0.664	32%	0.323	S	S	*	.	G	3₁₀ helix	trans	-60.3	-25.1	174.7	66.3	-173.1	6	0	0	113.7	P544	P544-Q546 HydrophobicContact CB-CG 3.93Å; P544-Q546 PolarHBondContact O-N 3.07Å
547	F	91.2	Very high	88.9	Confident	18 Å²	18	61 Å²	61	8%	0.079	33%	0.325	C	S	.	.	G	3₁₀ helix	trans	-91.9	-7.2	179.9	-60.6	-50.4	0	0	0	113.6	P544 K545 C550 I551 E588 F591	P544-F547 HydrophobicContact CB-CD2 3.77Å; P544-F547 HydrophobicContact CB-CE2 4.04Å; P544-F547 HydrophobicContact CG-CD2 3.9Å; P544-F547 HydrophobicContact CG-CE2 3.94Å; P544-F547 PolarHBondContact O-N 2.8Å; K545-F547 PolarHBondContact O-N 2.95Å; F547-C550 WeakPolarHBondContact O-CA 3.48Å; F547-C550 VanDerWaalsContact O-CB 3.24Å; F547-C550 WeakPolarHBondContact O-CB 3.13Å; F547-C550 PolarHBondContact O-N 2.84Å; F547-I551 PolarHBondContact O-N 2.76Å; F547-E588 HydrophobicContact CD1-CG 4.26Å; F547-E588 HydrophobicContact CE1-CG 4.09Å; F547-F591 HydrophobicContact CB-CB 4.34Å; F547-F591 HydrophobicContact CB-CD2 3.73Å; F547-F591 HydrophobicContact CB-CE2 4.17Å; F547-F591 HydrophobicContact CB-CG 3.99Å; F547-F591 HydrophobicContact CD1-CD2 4.13Å; F547-F591 AromaticContact CD2-CD2 3.57Å; F547-F591 HydrophobicContact CD2-CD2 3.57Å; F547-F591 AromaticContact CD2-CE2 3.35Å; F547-F591 HydrophobicContact CD2-CE2 3.35Å; F547-F591 HydrophobicContact CD2-CZ 4.25Å; F547-F591 HydrophobicContact CE2-CD2 4.16Å; F547-F591 AromaticContact CE2-CE2 3.83Å; F547-F591 HydrophobicContact CE2-CE2 3.83Å; F547-F591 AromaticContact CG-CD2 3.55Å; F547-F591 HydrophobicContact CG-CD2 3.55Å; F547-F591 AromaticContact CG-CE2 3.85Å; F547-F591 HydrophobicContact CG-CE2 3.85Å; F547-F591 HydrophobicContact CG-CG 4.31Å
548	M	91	Very high	88.9	Confident	14 Å²	14	58.6 Å²	58.6	7%	0.069	32%	0.315	C	S	.	.	H	α-helix	trans	-58.4	-44.9	178.6	-66.9	-59.8	163.7	0	0	113.4	F534 C538 V543 K545 C550 I551 E552	F534-M548 HydrophobicContact CZ-SD 4.48Å; C538-M548 HydrophobicContact CB-CE 4.35Å; V543-M548 HydrophobicContact CB-CE 3.55Å; V543-M548 HydrophobicContact CG1-CE 3.41Å; V543-M548 VanDerWaalsContact CG1-CE 3.41Å; V543-M548 HydrophobicContact CG1-SD 4.44Å; K545-M548 PolarHBondContact O-N 2.87Å; M548-C550 PolarHBondContact O-N 2.84Å; M548-I551 PolarHBondContact O-N 2.79Å; M548-I551 HydrophobicContact SD-CD1 4.04Å; M548-E552 PolarHBondContact O-N 2.82Å
549	P	92.4	Very high	89.2	Confident	78 Å²	78	57.3 Å²	57.3	51%	0.506	31%	0.307	S	S	.	.	H	α-helix	trans	-62	-27.5	174	-22.3	34.5	0	0	0	113.3	K553	P549-K553 WeakPolarHBondContact O-CB 3.25Å; P549-K553 PolarHBondContact O-N 2.81Å
550	C	93	Very high	89.5	Confident	15 Å²	15	57.6 Å²	57.6	10%	0.101	30%	0.299	C	S	.	.	H	α-helix	trans	-73.3	-41.7	177.7	-61.2	0	0	0	0	111.2	F547 M548 K553 G554 I592	F547-C550 WeakPolarHBondContact O-CA 3.48Å; F547-C550 VanDerWaalsContact O-CB 3.24Å; F547-C550 WeakPolarHBondContact O-CB 3.13Å; F547-C550 PolarHBondContact O-N 2.84Å; M548-C550 PolarHBondContact O-N 2.84Å; C550-K553 PolarHBondContact O-N 3.31Å; C550-G554 PolarHBondContact O-N 3.09Å; C550-I592 HydrophobicContact CB-CD1 4.5Å; C550-I592 HydrophobicContact CB-CG1 3.97Å; C550-I592 VanDerWaalsContact O-CG1 3.26Å; C550-I592 WeakPolarHBondContact O-CG1 3.48Å
551	I	93.1	Very high	90	Very high	0 Å²	0	61.1 Å²	61.1	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-61.8	-47.7	173.8	-63.2	172.6	0	0	0	109.7	V517 F534 V543 F547 M548 K553 G554 F555 F574 V576 F591 A595	V517-I551 HydrophobicContact CG1-CD1 4.47Å; V517-I551 HydrophobicContact CG1-CG2 4.24Å; V517-I551 HydrophobicContact CG2-CD1 4.16Å; V517-I551 HydrophobicContact CG2-CG1 4.4Å; F534-I551 HydrophobicContact CE2-CB 4.45Å; F534-I551 HydrophobicContact CE2-CG2 3.84Å; F534-I551 HydrophobicContact CZ-CB 4.41Å; F534-I551 HydrophobicContact CZ-CG2 4.18Å; V543-I551 HydrophobicContact CG1-CD1 3.91Å; F547-I551 PolarHBondContact O-N 2.76Å; M548-I551 PolarHBondContact O-N 2.79Å; M548-I551 HydrophobicContact SD-CD1 4.04Å; I551-K553 VanDerWaalsContact C-N 3.29Å; I551-K553 PolarHBondContact O-N 2.89Å; I551-G554 PolarHBondContact O-N 3.15Å; I551-G554 VanDerWaalsContact O-N 3.12Å; I551-F555 PolarHBondContact O-N 2.87Å; I551-F574 HydrophobicContact CG2-CE1 4.1Å; I551-V576 HydrophobicContact CG2-CG2 4.02Å; I551-F591 HydrophobicContact CD1-CD1 3.83Å; I551-F591 HydrophobicContact CD1-CE1 4.41Å; I551-F591 HydrophobicContact CG1-CB 3.96Å; I551-F591 HydrophobicContact CG1-CD1 3.94Å; I551-F591 HydrophobicContact CG1-CG 4.31Å; I551-A595 HydrophobicContact CB-CB 4.3Å; I551-A595 HydrophobicContact CG2-CB 3.75Å; I551-A595 WeakPolarHBondContact O-CB 3.23Å
552	E	93.6	Very high	90.2	Very high	46 Å²	46	55.5 Å²	55.5	22%	0.215	27%	0.273	C	S	.	.	H	α-helix	trans	-58.5	-40.9	176.9	-175.2	-177.4	-173.8	0	0	112	F534 M548 F555 R556	F534-E552 HydrophobicContact CB-CG 3.88Å; F534-E552 HydrophobicContact CD1-CB 3.98Å; F534-E552 HydrophobicContact CD1-CG 4.02Å; F534-E552 HydrophobicContact CD2-CB 4.03Å; F534-E552 HydrophobicContact CD2-CG 4.21Å; F534-E552 HydrophobicContact CE1-CB 4.15Å; F534-E552 HydrophobicContact CE2-CB 4.19Å; F534-E552 HydrophobicContact CG-CB 3.93Å; F534-E552 HydrophobicContact CG-CG 3.76Å; F534-E552 HydrophobicContact CZ-CB 4.25Å; M548-E552 PolarHBondContact O-N 2.82Å; E552-F555 PolarHBondContact O-N 3.47Å; E552-R556 WeakPolarHBondContact O-CG 3.46Å; E552-R556 PolarHBondContact O-N 3.38Å; E552-R556 IonicContact OE1-CZ 2.96Å; E552-R556 IonicContact OE1-NH1 2.7Å; E552-R556 PolarHBondContact OE1-NH1 2.88Å; E552-R556 IonicContact OE1-NH2 2.74Å; E552-R556 PolarHBondContact OE1-NH2 3.14Å; E552-R556 IonicContact OE2-NH1 2.74Å
553	K	92.9	Very high	90.4	Very high	139 Å²	139	54.2 Å²	54.2	60%	0.604	27%	0.269	S	S	*	.	H	α-helix	trans	-63.5	-42	174.8	-173.4	178.8	-179.3	-179.6	0	112.2	P549 C550 I551 A557 I592	P549-K553 WeakPolarHBondContact O-CB 3.25Å; P549-K553 PolarHBondContact O-N 2.81Å; C550-K553 PolarHBondContact O-N 3.31Å; I551-K553 VanDerWaalsContact C-N 3.29Å; I551-K553 PolarHBondContact O-N 2.89Å; K553-A557 WeakPolarHBondContact O-CB 3.27Å; K553-A557 PolarHBondContact O-N 2.86Å; K553-I592 HydrophobicContact CD-CD1 4.42Å
554	G	92.4	Very high	90.5	Very high	0 Å²	0	56.2 Å²	56.2	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-64.3	-43.4	175.6	0	0	0	0	0	112.7	C550 I551 A557 A558	C550-G554 PolarHBondContact O-N 3.09Å; I551-G554 PolarHBondContact O-N 3.15Å; I551-G554 VanDerWaalsContact O-N 3.12Å; G554-A557 PolarHBondContact O-N 3.48Å; G554-A558 PolarHBondContact O-N 3.43Å
555	F	93.3	Very high	90.5	Very high	0 Å²	0	55.9 Å²	55.9	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-57.1	-54.2	172.9	162.2	-113.5	0	0	0	111.8	L532 F534 I551 E552 A557 A558 C559 I572 F574 M599	L532-F555 HydrophobicContact CB-CE1 4.12Å; L532-F555 HydrophobicContact CB-CZ 4.29Å; L532-F555 HydrophobicContact CD2-CZ 4.08Å; F534-F555 HydrophobicContact CD2-CD1 4.48Å; I551-F555 PolarHBondContact O-N 2.87Å; E552-F555 PolarHBondContact O-N 3.47Å; F555-A557 VanDerWaalsContact C-N 3.3Å; F555-A557 PolarHBondContact O-N 3.33Å; F555-A558 WeakPolarHBondContact O-CB 3.4Å; F555-A558 PolarHBondContact O-N 2.9Å; F555-A558 VanDerWaalsContact O-N 3.11Å; F555-C559 WeakPolarHBondContact CE2-SG 3.44Å; F555-C559 PolarHBondContact O-N 3.02Å; F555-C559 PolarHBondContact O-SG 2.82Å; F555-I572 HydrophobicContact CE2-CD1 3.61Å; F555-I572 HydrophobicContact CE2-CG1 4.23Å; F555-I572 HydrophobicContact CZ-CD1 3.95Å; F555-I572 HydrophobicContact CZ-CG1 4.05Å; F555-F574 HydrophobicContact CB-CD1 4.38Å; F555-F574 HydrophobicContact CB-CG 4.49Å; F555-F574 HydrophobicContact CD1-CB 4.17Å; F555-F574 HydrophobicContact CD2-CB 3.67Å; F555-F574 HydrophobicContact CD2-CD1 4.37Å; F555-F574 AromaticContact CD2-CD2 3.72Å; F555-F574 HydrophobicContact CD2-CD2 3.72Å; F555-F574 HydrophobicContact CD2-CE2 4.42Å; F555-F574 AromaticContact CD2-CG 3.67Å; F555-F574 HydrophobicContact CD2-CG 3.67Å; F555-F574 HydrophobicContact CE1-CB 4.06Å; F555-F574 HydrophobicContact CE2-CB 3.55Å; F555-F574 HydrophobicContact CE2-CD2 4.04Å; F555-F574 HydrophobicContact CE2-CG 4.01Å; F555-F574 HydrophobicContact CG-CB 3.99Å; F555-F574 HydrophobicContact CG-CD1 4.34Å; F555-F574 HydrophobicContact CG-CD2 4.47Å; F555-F574 HydrophobicContact CG-CG 4.03Å; F555-F574 HydrophobicContact CZ-CB 3.75Å; F555-M599 HydrophobicContact CD2-CE 4.26Å; F555-M599 HydrophobicContact CD2-CG 3.87Å; F555-M599 HydrophobicContact CD2-SD 3.68Å; F555-M599 HydrophobicContact CE2-CE 4.1Å; F555-M599 HydrophobicContact CE2-SD 3.91Å
556	R	92.3	Very high	90.4	Very high	122 Å²	122	49.7 Å²	49.7	46%	0.46	26%	0.255	S	S	.	.	H	α-helix	trans	-59.5	-39.8	179.6	-75.2	-173.2	175.7	122.1	5.6	112.7	E552 C559	E552-R556 WeakPolarHBondContact O-CG 3.46Å; E552-R556 PolarHBondContact O-N 3.38Å; E552-R556 IonicContact OE1-CZ 2.96Å; E552-R556 IonicContact OE1-NH1 2.7Å; E552-R556 PolarHBondContact OE1-NH1 2.88Å; E552-R556 IonicContact OE1-NH2 2.74Å; E552-R556 PolarHBondContact OE1-NH2 3.14Å; E552-R556 IonicContact OE2-NH1 2.74Å; R556-C559 PolarHBondContact O-N 3.19Å
557	A	91	Very high	90.3	Very high	51 Å²	51	44 Å²	44	42%	0.421	23%	0.231	S	C	.	.	H	α-helix	trans	-66.8	-35.3	177.3	0	0	0	0	0	112.6	K553 G554 F555 C559	K553-A557 WeakPolarHBondContact O-CB 3.27Å; K553-A557 PolarHBondContact O-N 2.86Å; G554-A557 PolarHBondContact O-N 3.48Å; F555-A557 VanDerWaalsContact C-N 3.3Å; F555-A557 PolarHBondContact O-N 3.33Å; A557-C559 VanDerWaalsContact C-N 3.34Å
558	A	91.2	Very high	90.1	Very high	8 Å²	8	44.8 Å²	44.8	7%	0.066	24%	0.238	C	C	.	.	H	α-helix	trans	-67.5	-36	174	0	0	0	0	0	111.9	G554 F555 E560 K596 M599	G554-A558 PolarHBondContact O-N 3.43Å; F555-A558 WeakPolarHBondContact O-CB 3.4Å; F555-A558 PolarHBondContact O-N 2.9Å; F555-A558 VanDerWaalsContact O-N 3.11Å; A558-E560 PolarHBondContact O-N 2.91Å; A558-K596 HydrophobicContact CB-CG 4.2Å; A558-M599 HydrophobicContact CB-CB 3.66Å; A558-M599 HydrophobicContact CB-CG 4.05Å
559	C	91.1	Very high	90.2	Very high	2 Å²	2	44.3 Å²	44.3	1%	0.014	24%	0.236	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.9	-8.4	-179.8	-67.5	0	0	0	0	115	L532 F555 R556 A557 K561 V569	L532-C559 HydrophobicContact CD1-CB 3.76Å; L532-C559 HydrophobicContact CD2-CB 4.34Å; F555-C559 WeakPolarHBondContact CE2-SG 3.44Å; F555-C559 PolarHBondContact O-N 3.02Å; F555-C559 PolarHBondContact O-SG 2.82Å; R556-C559 PolarHBondContact O-N 3.19Å; A557-C559 VanDerWaalsContact C-N 3.34Å; C559-K561 VanDerWaalsContact C-N 3.25Å; C559-K561 PolarHBondContact O-N 3.45Å; C559-V569 HydrophobicContact CB-CB 3.98Å; C559-V569 PolarHBondContact O-N 3.43Å
560	E	87.2	Confident	90.1	Very high	146 Å²	146	40.7 Å²	40.7	68%	0.682	21%	0.213	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.5	-27.8	177.2	-68.1	-175	174.3	0	0	112.9	A558	A558-E560 PolarHBondContact O-N 2.91Å
561	K	87.6	Confident	89.9	Confident	118 Å²	118	40 Å²	40	51%	0.513	21%	0.208	S	C	.	.	S	Bend	trans	-133.7	108.2	-178.7	-171.4	-178.9	-178.9	-175.2	0	110.4	C559 Y700	C559-K561 VanDerWaalsContact C-N 3.25Å; C559-K561 PolarHBondContact O-N 3.45Å; K561-Y700 VanDerWaalsContact CE-OH 3.24Å; K561-Y700 WeakPolarHBondContact CE-OH 3.19Å
562	G	87.4	Confident	90	Very high	6 Å²	6	40 Å²	40	6%	0.062	21%	0.208	C	C	.	.			trans	-76.1	166.3	177.8	0	0	0	0	0	114.4	E492 G566 S567	E492-G562 VanDerWaalsContact OE2-C 3.26Å; E492-G562 WeakPolarHBondContact OE2-CA 3.32Å; G562-G566 WeakPolarHBondContact O-CA 3.3Å; G562-G566 PolarHBondContact O-N 3.04Å; G562-S567 WeakPolarHBondContact CA-O 3.43Å; G562-S567 PolarHBondContact N-O 3.05Å
563	P	89.1	Confident	90	Very high	52 Å²	52	40.5 Å²	40.5	34%	0.338	21%	0.208	S	C	.	.	S	Bend	trans	-74.5	-28.5	-175.2	26.3	-34	0	0	0	115.9	E492 F603 W608	E492-P563 WeakPolarHBondContact OE2-CD 3.35Å; P563-F603 HydrophobicContact CB-CB 4.04Å; P563-F603 HydrophobicContact CB-CG 4.32Å; P563-F603 HydrophobicContact CG-CB 4.22Å; P563-F603 HydrophobicContact CG-CD1 4.06Å; P563-F603 HydrophobicContact CG-CG 4.23Å; P563-W608 HydrophobicContact CG-CB 4.37Å; P563-W608 HydrophobicContact CG-CD2 3.71Å; P563-W608 HydrophobicContact CG-CE3 4.22Å; P563-W608 HydrophobicContact CG-CG 3.72Å
564	L	88.1	Confident	90.1	Very high	44 Å²	44	33.9 Å²	33.9	23%	0.23	18%	0.179	C	C	.	.	S	Bend	trans	-84	-58.5	-168.9	-64	177.6	0	0	0	112.7	E492 W608 L610 I697 Y700	E492-L564 PolarHBondContact OE1-N 3.29Å; E492-L564 WeakPolarHBondContact OE2-CB 3.25Å; E492-L564 PolarHBondContact OE2-N 2.97Å; L564-W608 HydrophobicContact CD1-CB 3.8Å; L564-W608 HydrophobicContact CD2-CB 4.38Å; L564-W608 HydrophobicContact CG-CB 4.01Å; L564-L610 HydrophobicContact CB-CD2 4.09Å; L564-L610 HydrophobicContact CD1-CD2 3.89Å; L564-L610 HydrophobicContact CD1-CG 4.09Å; L564-I697 HydrophobicContact CD2-CD1 4.35Å; L564-Y700 WeakPolarHBondContact O-CD1 3.34Å
565	I	87.5	Confident	90.2	Very high	20 Å²	20	33.9 Å²	33.9	10%	0.103	18%	0.179	C	C	.	.	S	Bend	trans	-125	5.4	-175.7	64.7	172	0	0	0	112.4	F490 E492 S567 L610 L696 I697 Y700	F490-I565 HydrophobicContact CB-CD1 3.7Å; F490-I565 HydrophobicContact CG-CD1 4.34Å; E492-I565 HydrophobicContact CG-CG1 4.41Å; E492-I565 VanDerWaalsContact OE1-CG1 3.3Å; E492-I565 WeakPolarHBondContact OE1-CG1 3.39Å; E492-I565 PolarHBondContact OE1-N 3.21Å; I565-S567 WeakPolarHBondContact CD1-OG 3.49Å; I565-S567 PolarHBondContact O-N 3.27Å; I565-L610 HydrophobicContact CD1-CD1 4.05Å; I565-L610 HydrophobicContact CD1-CD2 3.76Å; I565-L610 HydrophobicContact CG1-CD2 3.81Å; I565-L610 HydrophobicContact CG2-CD1 4.09Å; I565-L610 HydrophobicContact CG2-CD2 4.41Å; I565-L696 HydrophobicContact CG2-CB 4.16Å; I565-I697 HydrophobicContact CG2-CG1 4.04Å; I565-Y700 HydrophobicContact CB-CG 4.33Å; I565-Y700 WeakPolarHBondContact O-CD2 3.28Å; I565-Y700 WeakPolarHBondContact O-CE2 3.31Å
566	G	84.6	Confident	90.2	Very high	23 Å²	23	33.9 Å²	33.9	24%	0.237	18%	0.179	C	C	.	.	S	Bend	trans	71.6	17.6	-175.9	0	0	0	0	0	113.4	E492 G562	E492-G566 PolarHBondContact OE1-N 3.37Å; G562-G566 WeakPolarHBondContact O-CA 3.3Å; G562-G566 PolarHBondContact O-N 3.04Å
567	S	86.1	Confident	90.2	Very high	22 Å²	22	33.6 Å²	33.6	15%	0.154	18%	0.178	C	C	.	.	P	Polyproline II helix	trans	-77.5	154.1	174.8	-93.4	0	0	0	0	110.4	F490 E492 G562 I565 V569	F490-S567 WeakPolarHBondContact O-CB 3.37Å; F490-S567 PolarHBondContact O-OG 3.49Å; E492-S567 PolarHBondContact OE1-N 3.5Å; G562-S567 WeakPolarHBondContact CA-O 3.43Å; G562-S567 PolarHBondContact N-O 3.05Å; I565-S567 WeakPolarHBondContact CD1-OG 3.49Å; I565-S567 PolarHBondContact O-N 3.27Å; S567-V569 PolarHBondContact O-N 3.21Å
568	P	88	Confident	90.2	Very high	34 Å²	34	34.1 Å²	34.1	22%	0.221	17%	0.174	C	C	.	.	P	Polyproline II helix	trans	-62.3	139	177.9	-18.5	29.9	0	0	0	111.3	R491 E492	R491-P568 WeakPolarHBondContact CD-O 3.43Å; E492-P568 PolarHBondContact N-O 2.77Å
569	V	92.3	Very high	90.1	Very high	5 Å²	5	34.1 Å²	34.1	3%	0.03	17%	0.174	C	C	.	.	B	Isolated β-bridge	trans	-75.1	137.2	176.4	174	0	0	0	0	109.7	E492 L532 C559 S567 I572 F603 W608	E492-V569 HydrophobicContact CB-CG2 4.43Å; E492-V569 CarbonylContact O-C 3.56Å; E492-V569 VanDerWaalsContact O-CA 3.26Å; E492-V569 WeakPolarHBondContact O-CA 3.33Å; L532-V569 HydrophobicContact CD2-CG1 4.45Å; C559-V569 HydrophobicContact CB-CB 3.98Å; C559-V569 PolarHBondContact O-N 3.43Å; S567-V569 PolarHBondContact O-N 3.21Å; V569-I572 HydrophobicContact CG1-CD1 3.44Å; V569-I572 VanDerWaalsContact CG1-CD1 3.44Å; V569-I572 HydrophobicContact CG1-CG1 3.81Å; V569-I572 HydrophobicContact CG1-CG2 4.24Å; V569-F603 HydrophobicContact CG2-CE1 4.06Å; V569-F603 HydrophobicContact CG2-CZ 4.27Å; V569-W608 HydrophobicContact CB-CZ3 4.36Å; V569-W608 HydrophobicContact CG1-CH2 3.84Å; V569-W608 HydrophobicContact CG1-CZ3 3.63Å; V569-W608 HydrophobicContact CG2-CH2 4.15Å; V569-W608 HydrophobicContact CG2-CZ3 3.83Å
570	A	89.5	Confident	90.1	Very high	2 Å²	2	35 Å²	35	2%	0.017	18%	0.182	C	C	.	.			trans	-144	157.3	179.1	0	0	0	0	0	111.4	R491 E492 T493 N529 M530	R491-A570 HydrophobicContact CB-CB 4.1Å; R491-A570 HydrophobicContact CG-CB 4.37Å; E492-A570 PolarHBondContact O-N 2.98Å; T493-A570 WeakPolarHBondContact CB-O 3.35Å; T493-A570 PolarHBondContact OG1-O 3.12Å; N529-A570 CarbonylContact O-C 3.57Å; N529-A570 WeakPolarHBondContact O-CB 3.2Å; M530-A570 HydrophobicContact SD-CB 4.4Å
571	G	90.5	Very high	90.2	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	17%	0.166	C	C	.	.	S	Bend	trans	73.2	34.7	173.3	0	0	0	0	0	113.6	T493 L524 N529 E531	T493-G571 PolarHBondContact OG1-O 3.41Å; L524-G571 WeakPolarHBondContact CB-O 3.24Å; L524-G571 PolarHBondContact N-O 3.42Å; N529-G571 VanDerWaalsContact O-CA 3.32Å; N529-G571 WeakPolarHBondContact O-CA 3.4Å; N529-G571 PolarHBondContact O-N 3.16Å; N529-G571 VanDerWaalsContact O-N 3.12Å; E531-G571 VanDerWaalsContact O-CA 3.28Å; E531-G571 WeakPolarHBondContact O-CA 3.32Å; E531-G571 PolarHBondContact O-N 2.94Å
572	I	93.5	Very high	90.2	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	148.9	178	63.3	164.4	0	0	0	111.3	L494 E522 E531 L532 E533 F555 V569 M599 W608	L494-I572 HydrophobicContact CB-CG2 3.74Å; E522-I572 CarbonylContact O-C 3.55Å; E522-I572 WeakPolarHBondContact O-CA 3.19Å; E531-I572 PolarHBondContact O-N 3.08Å; L532-I572 HydrophobicContact CD2-CD1 4.23Å; L532-I572 HydrophobicContact CD2-CG1 3.5Å; E533-I572 PolarHBondContact N-O 3.37Å; F555-I572 HydrophobicContact CE2-CD1 3.61Å; F555-I572 HydrophobicContact CE2-CG1 4.23Å; F555-I572 HydrophobicContact CZ-CD1 3.95Å; F555-I572 HydrophobicContact CZ-CG1 4.05Å; V569-I572 HydrophobicContact CG1-CD1 3.44Å; V569-I572 VanDerWaalsContact CG1-CD1 3.44Å; V569-I572 HydrophobicContact CG1-CG1 3.81Å; V569-I572 HydrophobicContact CG1-CG2 4.24Å; I572-M599 HydrophobicContact CD1-CE 3.78Å; I572-W608 HydrophobicContact CD1-CH2 4.46Å
573	R	94.4	Very high	90	Very high	56 Å²	56	37.2 Å²	37.2	21%	0.211	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	123.5	172.7	-177.6	-172.7	-66.4	158.8	-5.5	109.6	C521 E522 L524 E533 R535 C575	C521-R573 CarbonylContact C-O 3.6Å; C521-R573 VanDerWaalsContact CA-O 3.31Å; C521-R573 WeakPolarHBondContact CA-O 3.34Å; E522-R573 PolarHBondContact N-O 2.84Å; E522-R573 PolarHBondContact O-N 2.74Å; E522-R573 IonicContact OE2-NH1 3.37Å; L524-R573 HydrophobicContact CD2-CB 3.96Å; L524-R573 HydrophobicContact CG-CB 4.44Å; E533-R573 HydrophobicContact CB-CB 4.13Å; E533-R573 HydrophobicContact CB-CG 4.04Å; E533-R573 VanDerWaalsContact CD-NE 3.25Å; E533-R573 HydrophobicContact CG-CG 4.11Å; E533-R573 CarbonylContact O-C 3.6Å; E533-R573 VanDerWaalsContact O-CA 3.23Å; E533-R573 WeakPolarHBondContact O-CA 3.37Å; E533-R573 IonicContact OE1-CZ 3.83Å; E533-R573 IonicContact OE1-NE 3.39Å; E533-R573 IonicContact OE1-NH2 2.69Å; E533-R573 IonicContact OE2-CZ 2.81Å; E533-R573 VanDerWaalsContact OE2-CZ 3.24Å; E533-R573 IonicContact OE2-NE 3.23Å; E533-R573 PolarHBondContact OE2-NE 2.9Å; E533-R573 IonicContact OE2-NH2 3.81Å; E533-R573 PolarHBondContact OE2-NH2 2.69Å; R535-R573 HydrophobicContact CB-CG 4.46Å; R573-C575 WeakPolarHBondContact CD-SG 3.09Å; R573-C575 VanDerWaalsContact CG-SG 3.56Å
574	F	94.5	Very high	89.7	Confident	0 Å²	0	40.1 Å²	40.1	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	103.3	174	-165.7	-98.5	0	0	0	109.8	F500 C521 E533 F534 R535 I551 F555 V576 A598 M599	F500-F574 AromaticContact CD1-CE2 3.94Å; F500-F574 HydrophobicContact CD1-CE2 3.94Å; F500-F574 HydrophobicContact CD1-CZ 4.45Å; F500-F574 HydrophobicContact CD2-CE2 4.47Å; F500-F574 HydrophobicContact CD2-CZ 4.24Å; F500-F574 AromaticContact CE1-CD2 3.71Å; F500-F574 HydrophobicContact CE1-CD2 3.71Å; F500-F574 HydrophobicContact CE1-CE1 4.4Å; F500-F574 AromaticContact CE1-CE2 3.28Å; F500-F574 HydrophobicContact CE1-CE2 3.28Å; F500-F574 HydrophobicContact CE1-CG 4.44Å; F500-F574 AromaticContact CE1-CZ 3.69Å; F500-F574 HydrophobicContact CE1-CZ 3.69Å; F500-F574 HydrophobicContact CE2-CE1 4.07Å; F500-F574 AromaticContact CE2-CE2 3.91Å; F500-F574 HydrophobicContact CE2-CE2 3.91Å; F500-F574 AromaticContact CE2-CZ 3.44Å; F500-F574 HydrophobicContact CE2-CZ 3.44Å; F500-F574 VanDerWaalsContact CE2-CZ 3.44Å; F500-F574 HydrophobicContact CG-CE2 4.49Å; F500-F574 HydrophobicContact CZ-CD1 4.17Å; F500-F574 AromaticContact CZ-CD2 3.9Å; F500-F574 HydrophobicContact CZ-CD2 3.9Å; F500-F574 AromaticContact CZ-CE1 3.6Å; F500-F574 HydrophobicContact CZ-CE1 3.6Å; F500-F574 AromaticContact CZ-CE2 3.27Å; F500-F574 HydrophobicContact CZ-CE2 3.27Å; F500-F574 HydrophobicContact CZ-CG 4.32Å; F500-F574 AromaticContact CZ-CZ 3.12Å; F500-F574 HydrophobicContact CZ-CZ 3.12Å; C521-F574 HydrophobicContact CB-CD2 4.47Å; E533-F574 PolarHBondContact O-N 2.95Å; F534-F574 HydrophobicContact CD2-CB 4.4Å; F534-F574 AromaticContact CD2-CD1 3.91Å; F534-F574 HydrophobicContact CD2-CD1 3.91Å; F534-F574 AromaticContact CE2-CD1 3.85Å; F534-F574 HydrophobicContact CE2-CD1 3.85Å; F534-F574 HydrophobicContact CE2-CE1 4.42Å; R535-F574 PolarHBondContact N-O 3.42Å; I551-F574 HydrophobicContact CG2-CE1 4.1Å; F555-F574 HydrophobicContact CB-CD1 4.38Å; F555-F574 HydrophobicContact CB-CG 4.49Å; F555-F574 HydrophobicContact CD1-CB 4.17Å; F555-F574 HydrophobicContact CD2-CB 3.67Å; F555-F574 HydrophobicContact CD2-CD1 4.37Å; F555-F574 AromaticContact CD2-CD2 3.72Å; F555-F574 HydrophobicContact CD2-CD2 3.72Å; F555-F574 HydrophobicContact CD2-CE2 4.42Å; F555-F574 AromaticContact CD2-CG 3.67Å; F555-F574 HydrophobicContact CD2-CG 3.67Å; F555-F574 HydrophobicContact CE1-CB 4.06Å; F555-F574 HydrophobicContact CE2-CB 3.55Å; F555-F574 HydrophobicContact CE2-CD2 4.04Å; F555-F574 HydrophobicContact CE2-CG 4.01Å; F555-F574 HydrophobicContact CG-CB 3.99Å; F555-F574 HydrophobicContact CG-CD1 4.34Å; F555-F574 HydrophobicContact CG-CD2 4.47Å; F555-F574 HydrophobicContact CG-CG 4.03Å; F555-F574 HydrophobicContact CZ-CB 3.75Å; F574-V576 HydrophobicContact CD1-CG2 3.89Å; F574-V576 HydrophobicContact CE1-CG2 3.73Å; F574-A598 HydrophobicContact CZ-CB 4.42Å; F574-M599 HydrophobicContact CD2-CG 4.29Å; F574-M599 HydrophobicContact CD2-SD 3.4Å; F574-M599 WeakPolarHBondContact CD2-SD 3.29Å; F574-M599 HydrophobicContact CE2-CG 3.87Å; F574-M599 HydrophobicContact CE2-SD 3.39Å; F574-M599 WeakPolarHBondContact CE2-SD 3.46Å
575	C	94.2	Very high	89.6	Confident	0 Å²	0	40.3 Å²	40.3	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	113.8	180	-63.1	0	0	0	0	110.5	G519 V520 R535 R573	G519-C575 CarbonylContact C-O 3.5Å; G519-C575 WeakPolarHBondContact CA-O 3.44Å; V520-C575 PolarHBondContact N-O 3Å; V520-C575 VanDerWaalsContact O-CB 3.31Å; V520-C575 WeakPolarHBondContact O-CB 3.45Å; V520-C575 PolarHBondContact O-N 3.42Å; R535-C575 CarbonylContact O-C 3.47Å; R535-C575 WeakPolarHBondContact O-CA 3.5Å; R573-C575 WeakPolarHBondContact CD-SG 3.09Å; R573-C575 VanDerWaalsContact CG-SG 3.56Å
576	V	93.5	Very high	89.6	Confident	0 Å²	0	40.2 Å²	40.2	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	116.1	173.6	-171.8	0	0	0	0	108.6	V517 F534 R535 E537 C538 I551 F574	V517-V576 HydrophobicContact CG1-CG1 3.72Å; V517-V576 HydrophobicContact CG1-CG2 4.1Å; F534-V576 HydrophobicContact CE2-CG2 3.64Å; F534-V576 HydrophobicContact CZ-CG2 3.86Å; R535-V576 PolarHBondContact O-N 3.02Å; E537-V576 CarbonylContact C-O 3.57Å; E537-V576 WeakPolarHBondContact CA-O 3.42Å; E537-V576 PolarHBondContact N-O 3.5Å; C538-V576 PolarHBondContact N-O 3.3Å; C538-V576 PolarHBondContact SG-O 3.14Å; I551-V576 HydrophobicContact CG2-CG2 4.02Å; F574-V576 HydrophobicContact CD1-CG2 3.89Å; F574-V576 HydrophobicContact CE1-CG2 3.73Å
577	R	92.2	Very high	89.8	Confident	117 Å²	117	40.8 Å²	40.8	44%	0.442	21%	0.214	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	-34	-176	-70.7	-172.9	174.8	165.4	8	113.4	I518 E522 E537 C538	I518-R577 PolarHBondContact O-N 3.38Å; E522-R577 IonicContact OE1-NH2 3.74Å; E537-R577 HydrophobicContact CB-CG 4.22Å; E537-R577 IonicContact OE2-NE 3.33Å; E537-R577 PolarHBondContact OE2-NE 2.81Å; C538-R577 WeakPolarHBondContact CA-O 3.43Å
578	D	90.9	Very high	90	Very high	61 Å²	61	45.8 Å²	45.8	33%	0.326	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-159.1	-179.8	178.1	-154.8	-7	0	0	0	110	I518 N542	I518-D578 WeakPolarHBondContact CA-O 3.41Å; I518-D578 HydrophobicContact CB-CB 4.37Å; I518-D578 WeakPolarHBondContact CB-O 3.34Å; I518-D578 PolarHBondContact N-O 2.82Å; I518-D578 PolarHBondContact O-N 3.1Å; I518-D578 VanDerWaalsContact O-N 3.11Å; N542-D578 VanDerWaalsContact CB-OD1 3.27Å; N542-D578 WeakPolarHBondContact CB-OD1 3.24Å; N542-D578 PolarHBondContact ND2-OD1 3.36Å; N542-D578 PolarHBondContact ND2-OD2 3.22Å
579	G	90.6	Very high	90.2	Very high	8 Å²	8	49 Å²	49	8%	0.082	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-178.3	-160.9	174.2	0	0	0	0	0	111.9	R516	R516-G579 CarbonylContact O-C 3.59Å; R516-G579 WeakPolarHBondContact O-CA 3.24Å
580	A	90.8	Very high	90.1	Very high	22 Å²	22	48.8 Å²	48.8	18%	0.182	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.2	145.2	172.1	0	0	0	0	0	110.4	Y514 R516 N542	Y514-A580 HydrophobicContact CE1-CB 3.97Å; Y514-A580 WeakPolarHBondContact OH-CB 3.49Å; R516-A580 HydrophobicContact CB-CB 3.92Å; R516-A580 PolarHBondContact N-O 2.9Å; R516-A580 PolarHBondContact O-N 3.39Å; N542-A580 CarbonylContact O-C 3.57Å
581	H	89.9	Confident	90.3	Very high	74 Å²	74	48.7 Å²	48.7	34%	0.343	25%	0.247	S	C	.	.			trans	-124	160.2	171.4	74.4	-78.8	0	0	0	110.6	Y514 N541 N542 P544 S586 F591	Y514-H581 VanDerWaalsContact CE1-C 3.5Å; N541-H581 PolarHBondContact O-CE1 3.45Å; N542-H581 PolarHBondContact O-N 2.95Å; N542-H581 PolarHBondContact O-ND1 2.75Å; P544-H581 HydrophobicContact CG-CB 4.2Å; H581-S586 WeakPolarHBondContact CA-OG 3.36Å; H581-S586 WeakPolarHBondContact CB-OG 3.3Å; H581-F591 HydrophobicContact CB-CE2 4.38Å; H581-F591 HydrophobicContact CB-CZ 4.03Å
582	H	87.6	Confident	90.4	Very high	82 Å²	82	50.8 Å²	50.8	38%	0.38	26%	0.257	S	S	.	.			trans	-116.3	140.4	170.7	-172.1	-113.7	0	0	0	108.2	Y514 V584 D585 S586	Y514-H582 HydrophobicContact CD1-CB 3.56Å; Y514-H582 VanDerWaalsContact CD1-N 3.31Å; Y514-H582 HydrophobicContact CE1-CB 4.25Å; Y514-H582 HydrophobicContact CG-CB 3.72Å; H582-V584 PolarHBondContact O-N 2.8Å; H582-V584 VanDerWaalsContact O-N 3.15Å; H582-D585 HydrophobicContact CB-CB 4.2Å; H582-D585 IonicContact CE1-OD2 2.77Å; H582-D585 PolarHBondContact CE1-OD2 2.77Å; H582-D585 VanDerWaalsContact CE1-OD2 3.23Å; H582-D585 IonicContact CG-OD2 3.83Å; H582-D585 VanDerWaalsContact ND1-CG 3.34Å; H582-D585 PolarHBondContact ND1-N 2.91Å; H582-D585 IonicContact ND1-OD2 3.17Å; H582-D585 PolarHBondContact ND1-OD2 2.88Å; H582-S586 PolarHBondContact N-OG 3.26Å; H582-S586 WeakPolarHBondContact O-CB 3.09Å; H582-S586 PolarHBondContact O-N 3.36Å; H582-S586 PolarHBondContact O-OG 2.9Å
583	I	82.4	Confident	90.4	Very high	160 Å²	160	52.6 Å²	52.6	82%	0.821	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60	-33	-171.2	-62	166.9	0	0	0	111.9
584	V	82.7	Confident	90.3	Very high	113 Å²	113	50 Å²	50	69%	0.685	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.2	-36.9	-174.5	-176	0	0	0	0	112.6	H582	H582-V584 PolarHBondContact O-N 2.8Å; H582-V584 VanDerWaalsContact O-N 3.15Å
585	D	86.3	Confident	90.3	Very high	48 Å²	48	50 Å²	50	26%	0.257	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.7	-5.8	-169.4	-59	-42.1	0	0	0	113.5	G512 Q513 Y514 H582 T587	G512-D585 WeakPolarHBondContact CA-OD1 3.37Å; Q513-D585 CarbonylContact C-O 3.59Å; Q513-D585 WeakPolarHBondContact CA-O 3.21Å; Y514-D585 PolarHBondContact N-O 2.83Å; H582-D585 HydrophobicContact CB-CB 4.2Å; H582-D585 IonicContact CE1-OD2 2.77Å; H582-D585 PolarHBondContact CE1-OD2 2.77Å; H582-D585 VanDerWaalsContact CE1-OD2 3.23Å; H582-D585 IonicContact CG-OD2 3.83Å; H582-D585 VanDerWaalsContact ND1-CG 3.34Å; H582-D585 PolarHBondContact ND1-N 2.91Å; H582-D585 IonicContact ND1-OD2 3.17Å; H582-D585 PolarHBondContact ND1-OD2 2.88Å; D585-T587 PolarHBondContact O-N 3.14Å
586	S	87.3	Confident	90.2	Very high	18 Å²	18	53.9 Å²	53.9	13%	0.126	27%	0.274	C	S	.	.			trans	-81.1	111.1	176.5	-75.3	0	0	0	0	111.8	Y514 H581 H582	Y514-S586 VanDerWaalsContact O-CA 3.3Å; Y514-S586 WeakPolarHBondContact O-CA 3.19Å; Y514-S586 WeakPolarHBondContact O-CB 3.37Å; Y514-S586 PolarHBondContact O-OG 2.81Å; H581-S586 WeakPolarHBondContact CA-OG 3.36Å; H581-S586 WeakPolarHBondContact CB-OG 3.3Å; H582-S586 PolarHBondContact N-OG 3.26Å; H582-S586 WeakPolarHBondContact O-CB 3.09Å; H582-S586 PolarHBondContact O-N 3.36Å; H582-S586 PolarHBondContact O-OG 2.9Å
587	T	89.3	Confident	90.2	Very high	35 Å²	35	57 Å²	57	22%	0.215	29%	0.286	C	S	.	.			trans	-117.7	161.4	178.2	57	0	0	0	0	110.8	D585 I589 A590 F591	D585-T587 PolarHBondContact O-N 3.14Å; T587-I589 PolarHBondContact O-N 3.05Å; T587-A590 WeakPolarHBondContact O-CB 3.38Å; T587-A590 PolarHBondContact O-N 3.42Å; T587-A590 VanDerWaalsContact O-N 3.07Å; T587-A590 WeakPolarHBondContact OG1-CB 3.35Å; T587-A590 PolarHBondContact OG1-N 2.96Å; T587-F591 PolarHBondContact O-N 3.45Å
588	E	90.3	Very high	90.3	Very high	126 Å²	126	51.4 Å²	51.4	59%	0.589	27%	0.265	S	S	*	.	H	α-helix	trans	-55.1	-42.4	175.2	-63.3	-179.3	-178.9	0	0	111.8	F547 A590 F591 I592	F547-E588 HydrophobicContact CD1-CG 4.26Å; F547-E588 HydrophobicContact CE1-CG 4.09Å; E588-A590 VanDerWaalsContact C-N 3.33Å; E588-A590 PolarHBondContact O-N 2.94Å; E588-F591 PolarHBondContact O-N 2.93Å; E588-I592 VanDerWaalsContact O-CG1 3.3Å; E588-I592 WeakPolarHBondContact O-CG1 3.43Å; E588-I592 PolarHBondContact O-N 3.39Å
589	I	90.8	Very high	90.4	Very high	102 Å²	102	48.5 Å²	48.5	52%	0.523	25%	0.25	S	C	.	.	H	α-helix	trans	-64.2	-38.6	178.3	-60.4	171.8	0	0	0	110.9	T587 F591 I592 L593	T587-I589 PolarHBondContact O-N 3.05Å; I589-F591 VanDerWaalsContact C-N 3.34Å; I589-F591 PolarHBondContact O-N 3.22Å; I589-I592 PolarHBondContact O-N 3.3Å; I589-L593 HydrophobicContact CG2-CD1 3.89Å; I589-L593 HydrophobicContact CG2-CG 4.23Å; I589-L593 WeakPolarHBondContact O-CB 3.36Å; I589-L593 WeakPolarHBondContact O-CG 3.45Å; I589-L593 PolarHBondContact O-N 3.5Å
590	A	91.7	Very high	90.4	Very high	0 Å²	0	51.7 Å²	51.7	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-61.5	-42.8	178.4	0	0	0	0	0	111.6	Q513 T587 E588 A594	Q513-A590 HydrophobicContact CB-CB 4Å; T587-A590 WeakPolarHBondContact O-CB 3.38Å; T587-A590 PolarHBondContact O-N 3.42Å; T587-A590 VanDerWaalsContact O-N 3.07Å; T587-A590 WeakPolarHBondContact OG1-CB 3.35Å; T587-A590 PolarHBondContact OG1-N 2.96Å; E588-A590 VanDerWaalsContact C-N 3.33Å; E588-A590 PolarHBondContact O-N 2.94Å; A590-A594 VanDerWaalsContact O-CB 3.25Å; A590-A594 WeakPolarHBondContact O-CB 3.49Å; A590-A594 PolarHBondContact O-N 2.95Å
591	F	93	Very high	90.4	Very high	0 Å²	0	53.5 Å²	53.5	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-73.8	-34.1	176.9	-82.2	-73.3	0	0	0	113.6	V517 V543 F547 I551 H581 T587 E588 I589 A594 A595	V517-F591 HydrophobicContact CG2-CD1 4.08Å; V517-F591 HydrophobicContact CG2-CE1 4.45Å; V543-F591 HydrophobicContact CG1-CD1 4.42Å; V543-F591 HydrophobicContact CG1-CE1 3.79Å; V543-F591 HydrophobicContact CG1-CZ 4.05Å; V543-F591 HydrophobicContact CG2-CE1 4.47Å; F547-F591 HydrophobicContact CB-CB 4.34Å; F547-F591 HydrophobicContact CB-CD2 3.73Å; F547-F591 HydrophobicContact CB-CE2 4.17Å; F547-F591 HydrophobicContact CB-CG 3.99Å; F547-F591 HydrophobicContact CD1-CD2 4.13Å; F547-F591 AromaticContact CD2-CD2 3.57Å; F547-F591 HydrophobicContact CD2-CD2 3.57Å; F547-F591 AromaticContact CD2-CE2 3.35Å; F547-F591 HydrophobicContact CD2-CE2 3.35Å; F547-F591 HydrophobicContact CD2-CZ 4.25Å; F547-F591 HydrophobicContact CE2-CD2 4.16Å; F547-F591 AromaticContact CE2-CE2 3.83Å; F547-F591 HydrophobicContact CE2-CE2 3.83Å; F547-F591 AromaticContact CG-CD2 3.55Å; F547-F591 HydrophobicContact CG-CD2 3.55Å; F547-F591 AromaticContact CG-CE2 3.85Å; F547-F591 HydrophobicContact CG-CE2 3.85Å; F547-F591 HydrophobicContact CG-CG 4.31Å; I551-F591 HydrophobicContact CD1-CD1 3.83Å; I551-F591 HydrophobicContact CD1-CE1 4.41Å; I551-F591 HydrophobicContact CG1-CB 3.96Å; I551-F591 HydrophobicContact CG1-CD1 3.94Å; I551-F591 HydrophobicContact CG1-CG 4.31Å; H581-F591 HydrophobicContact CB-CE2 4.38Å; H581-F591 HydrophobicContact CB-CZ 4.03Å; T587-F591 PolarHBondContact O-N 3.45Å; E588-F591 PolarHBondContact O-N 2.93Å; I589-F591 VanDerWaalsContact C-N 3.34Å; I589-F591 PolarHBondContact O-N 3.22Å; F591-A594 PolarHBondContact O-N 3.44Å; F591-A595 WeakPolarHBondContact O-CB 3.38Å; F591-A595 PolarHBondContact O-N 3.34Å
592	I	92.8	Very high	90.5	Very high	44 Å²	44	50 Å²	50	23%	0.226	25%	0.253	C	S	.	.	H	α-helix	trans	-60.4	-47.8	171.4	-70.1	163.9	0	0	0	110.3	C550 K553 E588 I589 A595 K596	C550-I592 HydrophobicContact CB-CD1 4.5Å; C550-I592 HydrophobicContact CB-CG1 3.97Å; C550-I592 VanDerWaalsContact O-CG1 3.26Å; C550-I592 WeakPolarHBondContact O-CG1 3.48Å; K553-I592 HydrophobicContact CD-CD1 4.42Å; E588-I592 VanDerWaalsContact O-CG1 3.3Å; E588-I592 WeakPolarHBondContact O-CG1 3.43Å; E588-I592 PolarHBondContact O-N 3.39Å; I589-I592 PolarHBondContact O-N 3.3Å; I592-A595 PolarHBondContact O-N 2.91Å; I592-K596 WeakPolarHBondContact O-CB 3.41Å; I592-K596 PolarHBondContact O-N 3.01Å
593	L	92.9	Very high	90.7	Very high	39 Å²	39	47.7 Å²	47.7	20%	0.204	24%	0.242	C	C	.	.	H	α-helix	trans	-67.2	-42.7	178.6	-71	175.6	0	0	0	111.4	I589 A595 K596 Y597	I589-L593 HydrophobicContact CG2-CD1 3.89Å; I589-L593 HydrophobicContact CG2-CG 4.23Å; I589-L593 WeakPolarHBondContact O-CB 3.36Å; I589-L593 WeakPolarHBondContact O-CG 3.45Å; I589-L593 PolarHBondContact O-N 3.5Å; L593-A595 VanDerWaalsContact C-N 3.31Å; L593-A595 PolarHBondContact O-N 3.33Å; L593-K596 PolarHBondContact O-N 2.96Å; L593-Y597 HydrophobicContact CB-CD2 4.24Å; L593-Y597 HydrophobicContact CB-CE2 4.09Å; L593-Y597 HydrophobicContact CD2-CE2 4.11Å; L593-Y597 WeakPolarHBondContact O-CD2 3.21Å; L593-Y597 PolarHBondContact O-N 3.45Å
594	A	93.8	Very high	91.1	Very high	0 Å²	0	45 Å²	45	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-58.4	-43.7	176.9	0	0	0	0	0	111.8	Y502 H504 V517 A590 F591 A598	Y502-A594 HydrophobicContact CD1-CB 4.24Å; Y502-A594 WeakPolarHBondContact CD1-O 3.13Å; H504-A594 HydrophobicContact CB-CB 3.83Å; V517-A594 HydrophobicContact CG2-CB 3.87Å; A590-A594 VanDerWaalsContact O-CB 3.25Å; A590-A594 WeakPolarHBondContact O-CB 3.49Å; A590-A594 PolarHBondContact O-N 2.95Å; F591-A594 PolarHBondContact O-N 3.44Å; A594-A598 WeakPolarHBondContact O-CB 3.49Å; A594-A598 PolarHBondContact O-N 3.42Å
595	A	93.3	Very high	91.5	Very high	0 Å²	0	45.6 Å²	45.6	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-66.1	-40.3	175.7	0	0	0	0	0	112.6	I551 F591 I592 L593 M599	I551-A595 HydrophobicContact CB-CB 4.3Å; I551-A595 HydrophobicContact CG2-CB 3.75Å; I551-A595 WeakPolarHBondContact O-CB 3.23Å; F591-A595 WeakPolarHBondContact O-CB 3.38Å; F591-A595 PolarHBondContact O-N 3.34Å; I592-A595 PolarHBondContact O-N 2.91Å; L593-A595 VanDerWaalsContact C-N 3.31Å; L593-A595 PolarHBondContact O-N 3.33Å; A595-M599 PolarHBondContact O-N 3.29Å
596	K	92.5	Very high	91.7	Very high	82 Å²	82	44 Å²	44	36%	0.357	23%	0.23	S	C	.	.	H	α-helix	trans	-62.7	-48.3	177.7	-178.4	-177.7	174.1	-175.7	0	111.7	A558 I592 L593 M599 E600	A558-K596 HydrophobicContact CB-CG 4.2Å; I592-K596 WeakPolarHBondContact O-CB 3.41Å; I592-K596 PolarHBondContact O-N 3.01Å; L593-K596 PolarHBondContact O-N 2.96Å; K596-M599 WeakPolarHBondContact O-CB 3.36Å; K596-M599 PolarHBondContact O-N 3.2Å; K596-E600 WeakPolarHBondContact CE-OE1 3.26Å; K596-E600 PolarHBondContact O-N 3.42Å
597	Y	93	Very high	91.9	Very high	66 Å²	66	47.4 Å²	47.4	26%	0.259	25%	0.25	S	C	.	.	H	α-helix	trans	-73.9	-31.2	179.5	-67.6	-62.6	0	0	0	112.5	Y502 L593 M599 E600 D601	Y502-Y597 AromaticContact CE1-CD2 3.9Å; Y502-Y597 HydrophobicContact CE1-CD2 3.9Å; Y502-Y597 AromaticContact CE1-CG 4Å; Y502-Y597 HydrophobicContact CE1-CG 4Å; Y502-Y597 VanDerWaalsContact CE2-CB 3.49Å; Y502-Y597 HydrophobicContact CE2-CG 4.33Å; Y502-Y597 AromaticContact CZ-CD2 3.89Å; Y502-Y597 AromaticContact CZ-CG 3.69Å; Y502-Y597 WeakPolarHBondContact OH-CB 3.38Å; Y502-Y597 WeakPolarHBondContact OH-CD2 3.47Å; L593-Y597 HydrophobicContact CB-CD2 4.24Å; L593-Y597 HydrophobicContact CB-CE2 4.09Å; L593-Y597 HydrophobicContact CD2-CE2 4.11Å; L593-Y597 WeakPolarHBondContact O-CD2 3.21Å; L593-Y597 PolarHBondContact O-N 3.45Å; Y597-M599 PolarHBondContact O-N 2.98Å; Y597-E600 WeakPolarHBondContact CD1-OE2 3.45Å; Y597-E600 WeakPolarHBondContact O-CA 3.3Å; Y597-E600 WeakPolarHBondContact O-CB 3.26Å; Y597-E600 PolarHBondContact O-N 3.43Å; Y597-D601 PolarHBondContact O-N 3.24Å
598	A	94	Very high	92	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-57.1	-40.8	167.7	0	0	0	0	0	111.4	F500 Y502 F574 A594 D601 V602	F500-A598 HydrophobicContact CD2-CB 3.85Å; F500-A598 HydrophobicContact CE2-CB 4.41Å; F500-A598 HydrophobicContact CG-CB 4.34Å; Y502-A598 HydrophobicContact CG-CB 4.49Å; F574-A598 HydrophobicContact CZ-CB 4.42Å; A594-A598 WeakPolarHBondContact O-CB 3.49Å; A594-A598 PolarHBondContact O-N 3.42Å; A598-D601 PolarHBondContact O-N 3.06Å; A598-V602 WeakPolarHBondContact O-CG2 3.37Å; A598-V602 PolarHBondContact O-N 3Å; A598-V602 VanDerWaalsContact O-N 3.08Å
599	M	93.1	Very high	92.1	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-67.8	-33.6	172.7	-77.8	-60	-60.1	0	0	113	F555 A558 I572 F574 A595 K596 Y597 D601 V602 F603	F555-M599 HydrophobicContact CD2-CE 4.26Å; F555-M599 HydrophobicContact CD2-CG 3.87Å; F555-M599 HydrophobicContact CD2-SD 3.68Å; F555-M599 HydrophobicContact CE2-CE 4.1Å; F555-M599 HydrophobicContact CE2-SD 3.91Å; A558-M599 HydrophobicContact CB-CB 3.66Å; A558-M599 HydrophobicContact CB-CG 4.05Å; I572-M599 HydrophobicContact CD1-CE 3.78Å; F574-M599 HydrophobicContact CD2-CG 4.29Å; F574-M599 HydrophobicContact CD2-SD 3.4Å; F574-M599 WeakPolarHBondContact CD2-SD 3.29Å; F574-M599 HydrophobicContact CE2-CG 3.87Å; F574-M599 HydrophobicContact CE2-SD 3.39Å; F574-M599 WeakPolarHBondContact CE2-SD 3.46Å; A595-M599 PolarHBondContact O-N 3.29Å; K596-M599 WeakPolarHBondContact O-CB 3.36Å; K596-M599 PolarHBondContact O-N 3.2Å; Y597-M599 PolarHBondContact O-N 2.98Å; M599-D601 VanDerWaalsContact C-N 3.33Å; M599-V602 CarbonylContact O-C 3.39Å; M599-V602 PolarHBondContact O-N 2.97Å; M599-F603 HydrophobicContact CB-CZ 4.49Å; M599-F603 HydrophobicContact CE-CD1 4.41Å; M599-F603 HydrophobicContact CE-CE1 3.65Å; M599-F603 HydrophobicContact CE-CZ 4.04Å; M599-F603 WeakPolarHBondContact O-CD1 3.46Å; M599-F603 WeakPolarHBondContact O-CD2 3.32Å; M599-F603 WeakPolarHBondContact O-CG 3.28Å; M599-F603 PolarHBondContact O-N 3.44Å
600	E	90.3	Very high	92.2	Very high	74 Å²	74	39.5 Å²	39.5	35%	0.346	21%	0.207	S	C	.	.	H	α-helix	trans	-64.9	-35.6	173	-69.6	178.6	-167.4	0	0	112.1	K596 Y597 F603 C604	K596-E600 WeakPolarHBondContact CE-OE1 3.26Å; K596-E600 PolarHBondContact O-N 3.42Å; Y597-E600 WeakPolarHBondContact CD1-OE2 3.45Å; Y597-E600 WeakPolarHBondContact O-CA 3.3Å; Y597-E600 WeakPolarHBondContact O-CB 3.26Å; Y597-E600 PolarHBondContact O-N 3.43Å; E600-F603 HydrophobicContact CG-CD2 4.42Å; E600-F603 WeakPolarHBondContact O-CB 3.33Å; E600-F603 PolarHBondContact O-N 2.82Å; E600-C604 PolarHBondContact O-N 3.47Å; E600-C604 VanDerWaalsContact O-N 3.16Å; E600-C604 PolarHBondContact O-SG 3Å
601	D	91.1	Very high	92.1	Very high	60 Å²	60	39.7 Å²	39.7	32%	0.321	21%	0.208	S	C	.	.	H	α-helix	trans	-65.2	-44.4	170.9	-70	-10.5	0	0	0	110.7	Y502 Y597 A598 M599 F603 C604 D605	Y502-D601 WeakPolarHBondContact CD2-OD2 3.39Å; Y597-D601 PolarHBondContact O-N 3.24Å; A598-D601 PolarHBondContact O-N 3.06Å; M599-D601 VanDerWaalsContact C-N 3.33Å; D601-F603 PolarHBondContact O-N 2.8Å; D601-C604 PolarHBondContact O-N 3.38Å; D601-D605 PolarHBondContact O-N 3.43Å
602	V	92.7	Very high	92	Very high	0 Å²	0	40 Å²	40	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-62.1	-32.1	174	178.9	0	0	0	0	111.8	C498 F500 C521 A598 M599 C604 G606 W608	C498-V602 HydrophobicContact CB-CG1 4.16Å; F500-V602 HydrophobicContact CB-CG2 3.77Å; F500-V602 HydrophobicContact CD1-CG2 3.67Å; F500-V602 HydrophobicContact CG-CG2 4.05Å; C521-V602 HydrophobicContact CB-CG1 3.88Å; C521-V602 HydrophobicContact CB-CG2 4.2Å; A598-V602 WeakPolarHBondContact O-CG2 3.37Å; A598-V602 PolarHBondContact O-N 3Å; A598-V602 VanDerWaalsContact O-N 3.08Å; M599-V602 CarbonylContact O-C 3.39Å; M599-V602 PolarHBondContact O-N 2.97Å; V602-C604 VanDerWaalsContact C-N 3.29Å; V602-C604 PolarHBondContact O-N 3.44Å; V602-G606 VanDerWaalsContact O-CA 3.23Å; V602-G606 WeakPolarHBondContact O-CA 3.32Å; V602-G606 PolarHBondContact O-N 2.98Å; V602-W608 HydrophobicContact CG1-CZ2 4.09Å; V602-W608 PolarHBondContact O-NE1 3.39Å
603	F	92.3	Very high	91.9	Very high	34 Å²	34	38.2 Å²	38.2	15%	0.149	20%	0.201	C	C	.	.	H	α-helix	trans	-65.8	-31.7	173.1	-68.3	-19.9	0	0	0	112.6	P563 V569 M599 E600 D601 W608	P563-F603 HydrophobicContact CB-CB 4.04Å; P563-F603 HydrophobicContact CB-CG 4.32Å; P563-F603 HydrophobicContact CG-CB 4.22Å; P563-F603 HydrophobicContact CG-CD1 4.06Å; P563-F603 HydrophobicContact CG-CG 4.23Å; V569-F603 HydrophobicContact CG2-CE1 4.06Å; V569-F603 HydrophobicContact CG2-CZ 4.27Å; M599-F603 HydrophobicContact CB-CZ 4.49Å; M599-F603 HydrophobicContact CE-CD1 4.41Å; M599-F603 HydrophobicContact CE-CE1 3.65Å; M599-F603 HydrophobicContact CE-CZ 4.04Å; M599-F603 WeakPolarHBondContact O-CD1 3.46Å; M599-F603 WeakPolarHBondContact O-CD2 3.32Å; M599-F603 WeakPolarHBondContact O-CG 3.28Å; M599-F603 PolarHBondContact O-N 3.44Å; E600-F603 HydrophobicContact CG-CD2 4.42Å; E600-F603 WeakPolarHBondContact O-CB 3.33Å; E600-F603 PolarHBondContact O-N 2.82Å; D601-F603 PolarHBondContact O-N 2.8Å; F603-W608 AromaticContact CD1-CE2 3.85Å; F603-W608 AromaticContact CD1-CH2 3.83Å; F603-W608 HydrophobicContact CD1-CH2 3.83Å; F603-W608 AromaticContact CD1-CZ2 3.33Å; F603-W608 HydrophobicContact CD1-CZ2 3.33Å; F603-W608 AromaticContact CE1-CH2 3.64Å; F603-W608 HydrophobicContact CE1-CH2 3.64Å; F603-W608 AromaticContact CE1-CZ2 3.65Å; F603-W608 HydrophobicContact CE1-CZ2 3.65Å; F603-W608 HydrophobicContact CE1-CZ3 4.48Å
604	C	89.9	Confident	91.7	Very high	103 Å²	103	37 Å²	37	70%	0.696	20%	0.195	S	C	*	.	H	α-helix	trans	-84.4	-45.7	179.2	-63.2	0	0	0	0	112.6	E600 D601 V602	E600-C604 PolarHBondContact O-N 3.47Å; E600-C604 VanDerWaalsContact O-N 3.16Å; E600-C604 PolarHBondContact O-SG 3Å; D601-C604 PolarHBondContact O-N 3.38Å; V602-C604 VanDerWaalsContact C-N 3.29Å; V602-C604 PolarHBondContact O-N 3.44Å
605	D	91.5	Very high	91.5	Very high	127 Å²	127	37.9 Å²	37.9	68%	0.679	20%	0.199	S	C	*	.	H	α-helix	trans	-91.4	-19.6	-172.5	-66.5	-20	0	0	0	113	D601	D601-D605 PolarHBondContact O-N 3.43Å
606	G	89.3	Confident	91.4	Very high	13 Å²	13	42.6 Å²	42.6	13%	0.134	22%	0.219	C	C	.	.	S	Bend	trans	-76.3	152.3	-179.7	0	0	0	0	0	113.5	V602 W608	V602-G606 VanDerWaalsContact O-CA 3.23Å; V602-G606 WeakPolarHBondContact O-CA 3.32Å; V602-G606 PolarHBondContact O-N 2.98Å; G606-W608 VanDerWaalsContact O-CD1 3.24Å
607	V	91.5	Very high	91.2	Very high	91 Å²	91	38.7 Å²	38.7	55%	0.552	20%	0.202	S	C	*	.			trans	-92.2	109.8	171.4	-177.1	0	0	0	0	108.8	S495	S495-V607 WeakPolarHBondContact CB-O 3.24Å; S495-V607 PolarHBondContact N-O 2.84Å
608	W	92.2	Very high	91	Very high	29 Å²	29	40.1 Å²	40.1	11%	0.11	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	145.8	-175.9	-68.2	86.3	0	0	0	112.3	E492 T493 L494 P563 L564 V569 I572 V602 F603 G606	E492-W608 HydrophobicContact CB-CE3 4.26Å; T493-W608 WeakPolarHBondContact O-CA 3.43Å; L494-W608 HydrophobicContact CD1-CD2 4.35Å; L494-W608 HydrophobicContact CD1-CZ2 4.07Å; P563-W608 HydrophobicContact CG-CB 4.37Å; P563-W608 HydrophobicContact CG-CD2 3.71Å; P563-W608 HydrophobicContact CG-CE3 4.22Å; P563-W608 HydrophobicContact CG-CG 3.72Å; L564-W608 HydrophobicContact CD1-CB 3.8Å; L564-W608 HydrophobicContact CD2-CB 4.38Å; L564-W608 HydrophobicContact CG-CB 4.01Å; V569-W608 HydrophobicContact CB-CZ3 4.36Å; V569-W608 HydrophobicContact CG1-CH2 3.84Å; V569-W608 HydrophobicContact CG1-CZ3 3.63Å; V569-W608 HydrophobicContact CG2-CH2 4.15Å; V569-W608 HydrophobicContact CG2-CZ3 3.83Å; I572-W608 HydrophobicContact CD1-CH2 4.46Å; V602-W608 HydrophobicContact CG1-CZ2 4.09Å; V602-W608 PolarHBondContact O-NE1 3.39Å; F603-W608 AromaticContact CD1-CE2 3.85Å; F603-W608 AromaticContact CD1-CH2 3.83Å; F603-W608 HydrophobicContact CD1-CH2 3.83Å; F603-W608 AromaticContact CD1-CZ2 3.33Å; F603-W608 HydrophobicContact CD1-CZ2 3.33Å; F603-W608 AromaticContact CE1-CH2 3.64Å; F603-W608 HydrophobicContact CE1-CH2 3.64Å; F603-W608 AromaticContact CE1-CZ2 3.65Å; F603-W608 HydrophobicContact CE1-CZ2 3.65Å; F603-W608 HydrophobicContact CE1-CZ3 4.48Å; G606-W608 VanDerWaalsContact O-CD1 3.24Å
609	Q	92.3	Very high	90.7	Very high	66 Å²	66	40.1 Å²	40.1	31%	0.308	21%	0.212	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	152.1	173.1	66.4	-176	-14.7	0	0	111	T493 S495	T493-Q609 HydrophobicContact CG2-CG 3.51Å; T493-Q609 PolarHBondContact N-O 3.32Å; T493-Q609 PolarHBondContact O-N 3.01Å; S495-Q609 VanDerWaalsContact OG-CG 3.29Å; S495-Q609 WeakPolarHBondContact OG-CG 3.48Å
610	L	92.2	Very high	90.2	Very high	2 Å²	2	42.1 Å²	42.1	1%	0.01	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	142.7	171.9	-62.1	-177.7	0	0	0	110.2	R491 E492 L564 I565 P687 V688 T693 L696	R491-L610 WeakPolarHBondContact O-CA 3.25Å; E492-L610 HydrophobicContact CG-CD2 3.73Å; L564-L610 HydrophobicContact CB-CD2 4.09Å; L564-L610 HydrophobicContact CD1-CD2 3.89Å; L564-L610 HydrophobicContact CD1-CG 4.09Å; I565-L610 HydrophobicContact CD1-CD1 4.05Å; I565-L610 HydrophobicContact CD1-CD2 3.76Å; I565-L610 HydrophobicContact CG1-CD2 3.81Å; I565-L610 HydrophobicContact CG2-CD1 4.09Å; I565-L610 HydrophobicContact CG2-CD2 4.41Å; L610-P687 WeakPolarHBondContact O-CA 3.46Å; L610-V688 HydrophobicContact CB-CB 4.04Å; L610-V688 HydrophobicContact CB-CG2 3.77Å; L610-V688 WeakPolarHBondContact O-CG2 3.32Å; L610-V688 PolarHBondContact O-N 3Å; L610-T693 HydrophobicContact CD1-CG2 3.9Å; L610-T693 HydrophobicContact CG-CG2 4.11Å; L610-L696 HydrophobicContact CD1-CB 4.22Å; L610-L696 HydrophobicContact CD1-CD1 3.92Å
611	I	91.2	Very high	90	Very high	3 Å²	3	38.6 Å²	38.6	2%	0.015	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	140.8	169.2	61.9	179.2	0	0	0	109.8	R491 T493 N529 Y685 A686	R491-I611 HydrophobicContact CB-CD1 3.87Å; R491-I611 HydrophobicContact CB-CG1 3.59Å; R491-I611 PolarHBondContact N-O 3.21Å; R491-I611 PolarHBondContact O-N 2.95Å; T493-I611 HydrophobicContact CG2-CG2 3.67Å; N529-I611 HydrophobicContact CB-CD1 4.49Å; I611-Y685 HydrophobicContact CB-CD1 4.26Å; I611-Y685 HydrophobicContact CD1-CD1 4.16Å; I611-Y685 HydrophobicContact CD1-CG 4.26Å; I611-Y685 HydrophobicContact CG1-CD1 3.85Å; I611-Y685 HydrophobicContact CG1-CG 4.4Å; I611-A686 CarbonylContact C-O 3.48Å; I611-A686 WeakPolarHBondContact CA-O 3.23Å
612	E	90.8	Very high	89.6	Confident	8 Å²	8	36.6 Å²	36.6	4%	0.037	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	152.7	177.7	62.5	-175.3	148.2	0	0	111.7	F490 V614 P657 Y685 A686 V688	F490-E612 HydrophobicContact CD1-CB 3.81Å; F490-E612 HydrophobicContact CE1-CB 3.72Å; E612-V614 PolarHBondContact O-N 3.3Å; E612-P657 HydrophobicContact CG-CB 4.38Å; E612-Y685 CarbonylContact O-C 3.54Å; E612-Y685 VanDerWaalsContact O-CA 3.29Å; E612-Y685 WeakPolarHBondContact O-CA 3.3Å; E612-A686 PolarHBondContact N-O 3.49Å; E612-A686 PolarHBondContact O-N 3.07Å; E612-V688 HydrophobicContact CB-CG2 3.63Å; E612-V688 HydrophobicContact CG-CG2 3.73Å
613	P	89	Confident	89.4	Confident	6 Å²	6	41.7 Å²	41.7	4%	0.039	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.5	128.2	174.1	27.8	-32.1	0	0	0	110.7	V488 L658 Y682 Y685	V488-P613 HydrophobicContact CG1-CG 3.64Å; P613-L658 HydrophobicContact CG-CB 4.03Å; P613-L658 HydrophobicContact CG-CD2 3.98Å; P613-L658 WeakPolarHBondContact O-CB 3.47Å; P613-L658 PolarHBondContact O-N 3.13Å; P613-Y682 HydrophobicContact CB-CD2 4.21Å; P613-Y682 HydrophobicContact CB-CE2 4.17Å; P613-Y685 HydrophobicContact CB-CE1 4.12Å; P613-Y685 HydrophobicContact CB-CE2 4.32Å; P613-Y685 HydrophobicContact CG-CE1 4.28Å
614	V	90.3	Very high	89.1	Confident	12 Å²	12	47.6 Å²	47.6	7%	0.073	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	130.8	172.5	-179.2	0	0	0	0	108.7	E612 E655 S683 R684 A686	E612-V614 PolarHBondContact O-N 3.3Å; V614-E655 HydrophobicContact CG1-CB 3.73Å; V614-E655 HydrophobicContact CG1-CG 4.36Å; V614-S683 WeakPolarHBondContact O-CB 3.31Å; V614-S683 PolarHBondContact O-N 3.22Å; V614-R684 WeakPolarHBondContact CA-O 3.3Å; V614-R684 HydrophobicContact CB-CG 4.39Å; V614-R684 WeakPolarHBondContact CB-O 3.37Å; V614-R684 PolarHBondContact N-O 3.06Å; V614-R684 PolarHBondContact O-N 3.11Å; V614-A686 HydrophobicContact CG2-CB 3.54Å
615	M	89.8	Confident	89.2	Confident	19 Å²	19	43.8 Å²	43.8	9%	0.094	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	135.6	179.9	-53.6	-58	-71.2	0	0	109.8	V617 E655 A656 L658 M680 E681	M615-V617 HydrophobicContact CB-CG2 4.14Å; M615-E655 CarbonylContact O-C 3.54Å; M615-E655 VanDerWaalsContact O-CA 3.3Å; M615-E655 WeakPolarHBondContact O-CA 3.4Å; M615-A656 PolarHBondContact N-O 3.01Å; M615-A656 PolarHBondContact O-N 3.47Å; M615-L658 HydrophobicContact CE-CD1 4.43Å; M615-L658 HydrophobicContact CG-CB 3.77Å; M615-L658 HydrophobicContact CG-CD1 3.79Å; M615-L658 HydrophobicContact CG-CG 4.32Å; M615-L658 HydrophobicContact SD-CB 4.16Å; M615-L658 HydrophobicContact SD-CD1 4.05Å; M615-L658 HydrophobicContact SD-CD2 4.39Å; M615-L658 HydrophobicContact SD-CG 4.42Å; M615-M680 HydrophobicContact CB-CB 4.23Å; M615-M680 HydrophobicContact CE-CB 4.34Å; M615-M680 HydrophobicContact CE-CG 4Å; M615-M680 HydrophobicContact CE-SD 4.29Å; M615-M680 HydrophobicContact CG-SD 4.34Å; M615-E681 CarbonylContact C-O 3.53Å; M615-E681 VanDerWaalsContact CA-O 3.25Å; M615-E681 WeakPolarHBondContact CA-O 3.49Å; M615-E681 VanDerWaalsContact CE-C 3.41Å
616	K	89.6	Confident	89.1	Confident	99 Å²	99	41.6 Å²	41.6	43%	0.43	21%	0.207	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	115.9	162.3	-174.6	179.9	179	-171.9	0	107.3	I653 C654 M680 E681	K616-I653 HydrophobicContact CG-CG2 4.17Å; K616-C654 CarbonylContact C-O 3.43Å; K616-M680 CarbonylContact O-C 3.47Å; K616-M680 VanDerWaalsContact O-CA 3.24Å; K616-M680 WeakPolarHBondContact O-CA 3.26Å; K616-E681 PolarHBondContact N-O 2.77Å; K616-E681 PolarHBondContact O-N 2.81Å
617	V	89.7	Confident	89.3	Confident	0 Å²	0	43.3 Å²	43.3	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	125.5	-176	-179.9	0	0	0	0	108.6	M615 I653 C654 A656 M661 Y678 T679 M680	M615-V617 HydrophobicContact CB-CG2 4.14Å; V617-I653 CarbonylContact O-C 3.54Å; V617-I653 WeakPolarHBondContact O-CA 3.41Å; V617-C654 PolarHBondContact N-O 2.83Å; V617-C654 PolarHBondContact O-N 2.86Å; V617-A656 HydrophobicContact CG2-CB 4.14Å; V617-M661 HydrophobicContact CB-CE 4.49Å; V617-M661 HydrophobicContact CG1-CE 3.91Å; V617-M661 HydrophobicContact CG2-CE 3.77Å; V617-M661 HydrophobicContact CG2-CG 4.45Å; V617-M661 HydrophobicContact CG2-SD 4.17Å; V617-Y678 HydrophobicContact CG1-CD2 3.96Å; V617-Y678 HydrophobicContact CG1-CG 4.49Å; V617-T679 WeakPolarHBondContact CA-O 3.29Å; V617-M680 HydrophobicContact CG2-CB 3.96Å
618	E	87.4	Confident	89.4	Confident	96 Å²	96	41.6 Å²	41.6	45%	0.449	22%	0.217	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	120.3	170.1	-178.2	178.1	179.7	0	0	108.2	V652 I653 Y678 T679	E618-V652 WeakPolarHBondContact CA-O 3.19Å; E618-I653 HydrophobicContact CB-CG1 4.46Å; E618-I653 HydrophobicContact CG-CG1 4.17Å; E618-Y678 CarbonylContact O-C 3.57Å; E618-Y678 WeakPolarHBondContact O-CA 3.43Å; E618-Y678 WeakPolarHBondContact O-CB 3.15Å; E618-T679 PolarHBondContact N-O 3.34Å; E618-T679 PolarHBondContact O-N 3.02Å
619	C	88	Confident	89.4	Confident	0 Å²	0	40.2 Å²	40.2	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	129.4	-178.7	180	0	0	0	0	109.9	S651 V652 E677	C619-S651 CarbonylContact O-C 3.48Å; C619-S651 WeakPolarHBondContact O-CA 3.46Å; C619-V652 HydrophobicContact CB-CG1 3.77Å; C619-V652 PolarHBondContact N-O 3.21Å; C619-V652 PolarHBondContact O-N 2.84Å; C619-E677 CarbonylContact C-O 3.54Å; C619-E677 WeakPolarHBondContact CA-O 3.23Å
620	S	83.6	Confident	89.5	Confident	42 Å²	42	39.4 Å²	39.4	29%	0.294	21%	0.209	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	133.3	176.9	-172.3	0	0	0	0	110.6	F650 G676 E677	S620-F650 WeakPolarHBondContact CA-O 3.39Å; S620-G676 WeakPolarHBondContact O-CA 3.33Å; S620-E677 PolarHBondContact N-O 3.25Å; S620-E677 PolarHBondContact O-N 3.21Å
621	C	86.1	Confident	89.6	Confident	0 Å²	0	42.1 Å²	42.1	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.8	166	174.7	69.8	0	0	0	0	111	V629 F649 F650 T672	C621-V629 HydrophobicContact CB-CG2 4.22Å; C621-F649 CarbonylContact O-C 3.46Å; C621-F649 WeakPolarHBondContact O-CA 3.12Å; C621-F650 PolarHBondContact N-O 2.92Å; C621-F650 PolarHBondContact O-N 2.77Å; C621-F650 VanDerWaalsContact O-O 3.13Å; C621-T672 HydrophobicContact CB-CG2 3.85Å
622	P	83.1	Confident	89.7	Confident	18 Å²	18	42.2 Å²	42.2	12%	0.117	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61	149.1	169.8	-20.2	30.3	0	0	0	112.2	E624 F625 K675	P622-E624 PolarHBondContact O-N 3.41Å; P622-E624 VanDerWaalsContact O-N 3.07Å; P622-F625 HydrophobicContact CB-CD2 3.97Å; P622-F625 HydrophobicContact CB-CE2 4.25Å; P622-F625 HydrophobicContact CG-CD2 4.01Å; P622-F625 HydrophobicContact CG-CE2 4.16Å; P622-F625 PolarHBondContact O-N 3.31Å; P622-K675 HydrophobicContact CG-CB 3.62Å; P622-K675 HydrophobicContact CG-CD 3.56Å; P622-K675 HydrophobicContact CG-CG 4.18Å
623	K	86.8	Confident	89.8	Confident	107 Å²	107	41.9 Å²	41.9	47%	0.465	23%	0.231	S	C	.	.	G	3₁₀ helix	trans	-52.1	-33	-179.8	-175.1	-179.5	-178.7	176.8	0	113.9	F625 Q626 L645 S648	K623-F625 PolarHBondContact O-N 3.37Å; K623-Q626 VanDerWaalsContact O-CG 3.31Å; K623-Q626 WeakPolarHBondContact O-CG 3.1Å; K623-Q626 PolarHBondContact O-N 3.45Å; K623-L645 HydrophobicContact CB-CD1 4.06Å; K623-L645 HydrophobicContact CD-CD1 3.97Å; K623-L645 HydrophobicContact CD-CD2 4.13Å; K623-L645 HydrophobicContact CG-CD1 3.88Å; K623-S648 PolarHBondContact N-O 3.35Å
624	E	87.6	Confident	90	Very high	159 Å²	159	46 Å²	46	74%	0.743	25%	0.253	S	S	*	.	G	3₁₀ helix	trans	-58.3	-30	179.9	-61.8	172.2	-177.9	0	0	113	P622	P622-E624 PolarHBondContact O-N 3.41Å; P622-E624 VanDerWaalsContact O-N 3.07Å
625	F	90.3	Very high	90.1	Very high	23 Å²	23	52.5 Å²	52.5	10%	0.101	28%	0.28	C	S	.	.	G	3₁₀ helix	trans	-102	5	-174.6	-55.1	-74.3	0	0	0	113.9	P622 K623 G627 S628 V629 L671 T672 E673 K675	P622-F625 HydrophobicContact CB-CD2 3.97Å; P622-F625 HydrophobicContact CB-CE2 4.25Å; P622-F625 HydrophobicContact CG-CD2 4.01Å; P622-F625 HydrophobicContact CG-CE2 4.16Å; P622-F625 PolarHBondContact O-N 3.31Å; K623-F625 PolarHBondContact O-N 3.37Å; F625-G627 VanDerWaalsContact C-N 3.27Å; F625-G627 PolarHBondContact O-N 3.46Å; F625-G627 VanDerWaalsContact O-N 3.17Å; F625-S628 PolarHBondContact O-N 2.98Å; F625-S628 VanDerWaalsContact O-N 3.14Å; F625-V629 WeakPolarHBondContact O-CG2 3.36Å; F625-V629 PolarHBondContact O-N 3.33Å; F625-L671 WeakPolarHBondContact CD1-O 3.31Å; F625-T672 HydrophobicContact CB-CG2 3.98Å; F625-T672 HydrophobicContact CG-CG2 4.35Å; F625-E673 HydrophobicContact CE1-CG 3.96Å; F625-E673 HydrophobicContact CZ-CB 4.42Å; F625-E673 HydrophobicContact CZ-CG 3.79Å; F625-K675 HydrophobicContact CE2-CD 4.03Å
626	Q	91.2	Very high	90.2	Very high	81 Å²	81	53.4 Å²	53.4	38%	0.379	28%	0.283	S	S	.	.	H	α-helix	trans	-53.2	-42.1	-174.2	68.8	-177.8	-5	0	0	112.9	K623 V629 L630 F650	K623-Q626 VanDerWaalsContact O-CG 3.31Å; K623-Q626 WeakPolarHBondContact O-CG 3.1Å; K623-Q626 PolarHBondContact O-N 3.45Å; Q626-V629 PolarHBondContact O-N 2.99Å; Q626-L630 WeakPolarHBondContact O-CB 3.43Å; Q626-L630 WeakPolarHBondContact O-CG 3.45Å; Q626-L630 PolarHBondContact O-N 3.12Å; Q626-F650 HydrophobicContact CB-CB 4.36Å; Q626-F650 HydrophobicContact CB-CD1 3.9Å; Q626-F650 HydrophobicContact CB-CD2 4.09Å; Q626-F650 HydrophobicContact CB-CE1 4.16Å; Q626-F650 HydrophobicContact CB-CE2 4.34Å; Q626-F650 HydrophobicContact CB-CG 3.85Å; Q626-F650 HydrophobicContact CB-CZ 4.38Å
627	G	92.5	Very high	90.2	Very high	48 Å²	48	53.8 Å²	53.8	50%	0.495	29%	0.285	S	S	.	.	H	α-helix	trans	-68	-42.4	-177.9	0	0	0	0	0	112.5	F625 A631	F625-G627 VanDerWaalsContact C-N 3.27Å; F625-G627 PolarHBondContact O-N 3.46Å; F625-G627 VanDerWaalsContact O-N 3.17Å; G627-A631 WeakPolarHBondContact O-CB 3.07Å; G627-A631 PolarHBondContact O-N 3.05Å
628	S	93.8	Very high	90.3	Very high	56 Å²	56	54.2 Å²	54.2	39%	0.392	29%	0.288	S	S	.	.	H	α-helix	trans	-67	-39.7	178.3	-62.2	0	0	0	0	111.9	F625 A631 A632	F625-S628 PolarHBondContact O-N 2.98Å; F625-S628 VanDerWaalsContact O-N 3.14Å; S628-A631 PolarHBondContact O-N 3.41Å; S628-A632 WeakPolarHBondContact O-CB 3.33Å; S628-A632 PolarHBondContact O-N 2.93Å
629	V	92.8	Very high	90.5	Very high	0 Å²	0	54.2 Å²	54.2	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-66.5	-46.4	177	174.3	0	0	0	0	111.2	C621 F625 Q626 A631 A632 L633 V652 L668 T672	C621-V629 HydrophobicContact CB-CG2 4.22Å; F625-V629 WeakPolarHBondContact O-CG2 3.36Å; F625-V629 PolarHBondContact O-N 3.33Å; Q626-V629 PolarHBondContact O-N 2.99Å; V629-A631 VanDerWaalsContact C-N 3.33Å; V629-A631 PolarHBondContact O-N 3.33Å; V629-A632 PolarHBondContact O-N 3.28Å; V629-L633 HydrophobicContact CG1-CD1 4.03Å; V629-L633 HydrophobicContact CG1-CG 4.45Å; V629-L633 WeakPolarHBondContact O-CG 3.42Å; V629-L633 PolarHBondContact O-N 3.12Å; V629-V652 HydrophobicContact CG1-CG1 4.38Å; V629-L668 HydrophobicContact CG1-CD1 4.19Å; V629-L668 HydrophobicContact CG2-CD1 3.77Å; V629-T672 HydrophobicContact CG2-CG2 3.53Å
630	L	93.8	Very high	90.8	Very high	48 Å²	48	57 Å²	57	25%	0.251	31%	0.311	S	S	.	.	H	α-helix	trans	-61.3	-40.7	176.6	-73.9	171.9	0	0	0	112.1	Q626 A632 L633 N634 V640 F650 V652	Q626-L630 WeakPolarHBondContact O-CB 3.43Å; Q626-L630 WeakPolarHBondContact O-CG 3.45Å; Q626-L630 PolarHBondContact O-N 3.12Å; L630-A632 PolarHBondContact O-N 3.44Å; L630-L633 PolarHBondContact O-N 3.48Å; L630-N634 WeakPolarHBondContact O-CB 3.44Å; L630-N634 VanDerWaalsContact O-CG 3.3Å; L630-N634 PolarHBondContact O-N 2.99Å; L630-N634 PolarHBondContact O-ND2 3.19Å; L630-V640 HydrophobicContact CD2-CG2 4.14Å; L630-F650 HydrophobicContact CD1-CZ 4.07Å; L630-F650 HydrophobicContact CD2-CZ 4.2Å; L630-F650 HydrophobicContact CG-CE1 4.33Å; L630-F650 HydrophobicContact CG-CZ 4.13Å; L630-V652 HydrophobicContact CD2-CG2 4.11Å
631	A	94	Very high	91.2	Very high	60 Å²	60	59.7 Å²	59.7	50%	0.496	32%	0.321	S	S	.	.	H	α-helix	trans	-62.5	-41.6	175.4	0	0	0	0	0	112.2	G627 S628 V629 N634 K635	G627-A631 WeakPolarHBondContact O-CB 3.07Å; G627-A631 PolarHBondContact O-N 3.05Å; S628-A631 PolarHBondContact O-N 3.41Å; V629-A631 VanDerWaalsContact C-N 3.33Å; V629-A631 PolarHBondContact O-N 3.33Å; A631-N634 PolarHBondContact O-N 3.32Å; A631-K635 WeakPolarHBondContact O-CB 3.49Å; A631-K635 PolarHBondContact O-N 3.24Å
632	A	94	Very high	91.3	Very high	5 Å²	5	61.6 Å²	61.6	4%	0.041	34%	0.335	C	S	.	.	H	α-helix	trans	-66.7	-40.7	177.5	0	0	0	0	0	112.6	S628 V629 L630 K635 R636 F664 L671	S628-A632 WeakPolarHBondContact O-CB 3.33Å; S628-A632 PolarHBondContact O-N 2.93Å; V629-A632 PolarHBondContact O-N 3.28Å; L630-A632 PolarHBondContact O-N 3.44Å; A632-K635 WeakPolarHBondContact O-CB 3.42Å; A632-K635 PolarHBondContact O-N 2.88Å; A632-R636 PolarHBondContact O-N 2.88Å; A632-F664 HydrophobicContact CB-CE2 4.2Å; A632-L671 HydrophobicContact CB-CD1 3.51Å
633	L	93.4	Very high	91.7	Very high	0 Å²	0	64.4 Å²	64.4	0%	0	35%	0.351	C	S	.	.	H	α-helix	trans	-63.8	-43.4	174.6	-72.5	173.7	0	0	0	111.5	V629 L630 K635 R636 F637 A638 V652 F664	V629-L633 HydrophobicContact CG1-CD1 4.03Å; V629-L633 HydrophobicContact CG1-CG 4.45Å; V629-L633 WeakPolarHBondContact O-CG 3.42Å; V629-L633 PolarHBondContact O-N 3.12Å; L630-L633 PolarHBondContact O-N 3.48Å; L633-K635 VanDerWaalsContact C-N 3.34Å; L633-K635 PolarHBondContact O-N 3.4Å; L633-R636 CarbonylContact O-C 3.5Å; L633-R636 WeakPolarHBondContact O-CA 3.15Å; L633-R636 PolarHBondContact O-N 2.7Å; L633-F637 PolarHBondContact O-N 2.99Å; L633-A638 HydrophobicContact CB-CB 3.95Å; L633-A638 HydrophobicContact CD2-CB 4.35Å; L633-A638 VanDerWaalsContact O-CB 3.27Å; L633-A638 WeakPolarHBondContact O-CB 3.4Å; L633-A638 PolarHBondContact O-N 2.62Å; L633-V652 HydrophobicContact CD1-CG1 3.63Å; L633-V652 HydrophobicContact CD1-CG2 4.31Å; L633-F664 HydrophobicContact CD2-CE1 3.97Å; L633-F664 HydrophobicContact CD2-CE2 4.06Å; L633-F664 HydrophobicContact CD2-CZ 3.47Å; L633-F664 VanDerWaalsContact CD2-CZ 3.47Å; L633-F664 HydrophobicContact CG-CZ 4.05Å
634	N	92.9	Very high	91.6	Very high	94 Å²	94	64.7 Å²	64.7	50%	0.503	35%	0.354	S	S	.	.	H	α-helix	trans	-62	-40	175.7	-77.3	-30.7	0	0	0	112.5	L630 A631 R636 F637	L630-N634 WeakPolarHBondContact O-CB 3.44Å; L630-N634 VanDerWaalsContact O-CG 3.3Å; L630-N634 PolarHBondContact O-N 2.99Å; L630-N634 PolarHBondContact O-ND2 3.19Å; A631-N634 PolarHBondContact O-N 3.32Å; N634-R636 PolarHBondContact O-N 3Å; N634-F637 PolarHBondContact O-N 2.87Å
635	K	92.6	Very high	91.4	Very high	147 Å²	147	61.3 Å²	61.3	64%	0.639	34%	0.341	S	S	*	.	H	α-helix	trans	-61	-27	174.8	-175.8	-177.7	171.1	-165.4	0	112.5	A631 A632 L633 F637 E667	A631-K635 WeakPolarHBondContact O-CB 3.49Å; A631-K635 PolarHBondContact O-N 3.24Å; A632-K635 WeakPolarHBondContact O-CB 3.42Å; A632-K635 PolarHBondContact O-N 2.88Å; L633-K635 VanDerWaalsContact C-N 3.34Å; L633-K635 PolarHBondContact O-N 3.4Å; K635-F637 VanDerWaalsContact C-N 3.31Å; K635-E667 IonicContact NZ-OE1 3.68Å; K635-E667 PolarHBondContact NZ-OE1 3.01Å
636	R	90.1	Very high	90.4	Very high	38 Å²	38	64.2 Å²	64.2	14%	0.143	36%	0.36	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.5	10.5	176	-67.3	177.3	179.4	-102.4	6	113.3	A632 L633 N634 A638 N660 F662 E667	A632-R636 PolarHBondContact O-N 2.88Å; L633-R636 CarbonylContact O-C 3.5Å; L633-R636 WeakPolarHBondContact O-CA 3.15Å; L633-R636 PolarHBondContact O-N 2.7Å; N634-R636 PolarHBondContact O-N 3Å; R636-A638 PolarHBondContact O-N 3Å; R636-N660 HydrophobicContact CB-CB 4.25Å; R636-N660 VanDerWaalsContact CD-O 3.32Å; R636-N660 WeakPolarHBondContact CD-O 3.23Å; R636-N660 PolarHBondContact NH1-O 3.22Å; R636-N660 WeakPolarHBondContact O-CB 3.47Å; R636-N660 PolarHBondContact O-ND2 2.92Å; R636-F662 PolarHBondContact NH1-O 2.88Å; R636-E667 IonicContact CZ-OE2 2.62Å; R636-E667 VanDerWaalsContact CZ-OE2 3.28Å; R636-E667 IonicContact NE-OE2 2.81Å; R636-E667 PolarHBondContact NE-OE2 3.04Å; R636-E667 IonicContact NH2-OE2 3.24Å; R636-E667 PolarHBondContact NH2-OE2 2.88Å
637	F	90.2	Very high	89.4	Confident	108 Å²	108	67.6 Å²	67.6	47%	0.474	38%	0.381	S	S	.	.	T	Hydrogen-bonded Turn	trans	59.5	32.4	-178.5	-50.6	-64.6	0	0	0	113.7	L633 N634 K635	L633-F637 PolarHBondContact O-N 2.99Å; N634-F637 PolarHBondContact O-N 2.87Å; K635-F637 VanDerWaalsContact C-N 3.31Å
638	A	91.4	Very high	88.6	Confident	8 Å²	8	69.2 Å²	69.2	7%	0.066	39%	0.385	C	S	.	.			trans	-70.6	139.9	172.1	0	0	0	0	0	110.8	L633 R636 C654 E655 A656	L633-A638 HydrophobicContact CB-CB 3.95Å; L633-A638 HydrophobicContact CD2-CB 4.35Å; L633-A638 VanDerWaalsContact O-CB 3.27Å; L633-A638 WeakPolarHBondContact O-CB 3.4Å; L633-A638 PolarHBondContact O-N 2.62Å; R636-A638 PolarHBondContact O-N 3Å; A638-C654 HydrophobicContact CB-CB 4.18Å; A638-E655 CarbonylContact C-O 3.59Å; A638-E655 VanDerWaalsContact CA-O 3.23Å; A638-E655 WeakPolarHBondContact CA-O 3.45Å; A638-A656 HydrophobicContact CB-CB 3.85Å
639	V	93.2	Very high	87.7	Confident	96 Å²	96	71.7 Å²	71.7	58%	0.582	39%	0.389	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-100.8	112.2	172	-179.2	0	0	0	0	107.8	I641 C654 E655	V639-I641 PolarHBondContact O-N 2.98Å; V639-C654 CarbonylContact O-C 3.59Å; V639-C654 WeakPolarHBondContact O-CA 3.33Å; V639-C654 WeakPolarHBondContact O-CB 3.39Å; V639-E655 PolarHBondContact N-O 2.78Å; V639-E655 PolarHBondContact O-N 3.47Å
640	V	93.6	Very high	87.3	Confident	58 Å²	58	72.2 Å²	72.2	35%	0.352	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.9	125.9	179.3	179.7	0	0	0	0	109.8	L630 T643 V652 C654	L630-V640 HydrophobicContact CD2-CG2 4.14Å; V640-T643 HydrophobicContact CG1-CG2 3.88Å; V640-V652 HydrophobicContact CG1-CG2 3.88Å; V640-V652 HydrophobicContact CG2-CG2 4.3Å; V640-C654 HydrophobicContact CG2-CB 4.36Å
641	I	91.2	Very high	86.8	Confident	99 Å²	99	70.8 Å²	70.8	51%	0.508	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	-53.1	174.5	-63.5	166.1	0	0	0	109.4	V639 I653 E655	V639-I641 PolarHBondContact O-N 2.98Å; I641-I653 HydrophobicContact CB-CG2 4.41Å; I641-I653 HydrophobicContact CD1-CG2 4.18Å; I641-I653 PolarHBondContact N-O 3.4Å; I641-E655 HydrophobicContact CD1-CG 3.64Å; I641-E655 HydrophobicContact CG1-CG 4.32Å
642	S	89.9	Confident	86.7	Confident	40 Å²	40	67.9 Å²	67.9	28%	0.28	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.7	155.7	-178.1	62.9	0	0	0	0	111.6	I653	S642-I653 PolarHBondContact N-O 2.91Å; S642-I653 VanDerWaalsContact N-O 3.14Å; S642-I653 PolarHBondContact O-N 3.28Å
643	T	91.2	Very high	86.4	Confident	77 Å²	77	69.2 Å²	69.2	47%	0.472	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	134.2	173.5	54.8	0	0	0	0	108.4	V640 F650 S651 V652	V640-T643 HydrophobicContact CG1-CG2 3.88Å; T643-F650 HydrophobicContact CG2-CE2 3.98Å; T643-F650 HydrophobicContact CG2-CZ 3.76Å; T643-S651 CarbonylContact C-O 3.38Å; T643-S651 WeakPolarHBondContact CA-O 3.25Å; T643-V652 HydrophobicContact CG2-CB 4.23Å; T643-V652 HydrophobicContact CG2-CG2 3.88Å
644	E	84	Confident	86.4	Confident	113 Å²	113	69.2 Å²	69.2	53%	0.528	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	141.1	179.4	-66.5	-178.3	-173.9	0	0	109.5	S651	E644-S651 PolarHBondContact N-O 3.01Å; E644-S651 PolarHBondContact O-N 3.41Å
645	L	82.6	Confident	86.5	Confident	89 Å²	89	66.1 Å²	66.1	47%	0.466	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	112.5	172.8	-173.9	75.3	0	0	0	107.6	K623 F649 F650	K623-L645 HydrophobicContact CB-CD1 4.06Å; K623-L645 HydrophobicContact CD-CD1 3.97Å; K623-L645 HydrophobicContact CD-CD2 4.13Å; K623-L645 HydrophobicContact CG-CD1 3.88Å; L645-F649 WeakPolarHBondContact CD1-O 3.39Å; L645-F650 HydrophobicContact CD1-CB 4.23Å
646	V	70.2	Confident	86.5	Confident	83 Å²	83	59.1 Å²	59.1	50%	0.503	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	112.3	178.3	-176.3	0	0	0	0	107.8	S648 F649	V646-S648 PolarHBondContact O-N 3.05Å; V646-F649 PolarHBondContact N-O 2.99Å; V646-F649 PolarHBondContact O-N 2.86Å; V646-F649 VanDerWaalsContact O-O 3.09Å
647	D	69.9	Low	86.6	Confident	152 Å²	152	58.1 Å²	58.1	81%	0.813	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.1	-106.6	-174.4	-57.3	-41.7	0	0	0	113.1
648	S	75.8	Confident	86.5	Confident	83 Å²	83	54.7 Å²	54.7	58%	0.58	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.7	-4.7	-178.9	-48.4	0	0	0	0	112.8	K623 V646	K623-S648 PolarHBondContact N-O 3.35Å; V646-S648 PolarHBondContact O-N 3.05Å
649	F	74.5	Confident	86.4	Confident	107 Å²	107	56.6 Å²	56.6	47%	0.469	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	135.2	-174.3	-74.4	-93.8	0	0	0	111.2	C621 L645 V646	C621-F649 CarbonylContact O-C 3.46Å; C621-F649 WeakPolarHBondContact O-CA 3.12Å; L645-F649 WeakPolarHBondContact CD1-O 3.39Å; V646-F649 PolarHBondContact N-O 2.99Å; V646-F649 PolarHBondContact O-N 2.86Å; V646-F649 VanDerWaalsContact O-O 3.09Å
650	F	85.4	Confident	86.2	Confident	11 Å²	11	53.9 Å²	53.9	5%	0.048	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	122.9	171	172.4	-100.3	0	0	0	108.3	S620 C621 Q626 L630 T643 L645 V652	S620-F650 WeakPolarHBondContact CA-O 3.39Å; C621-F650 PolarHBondContact N-O 2.92Å; C621-F650 PolarHBondContact O-N 2.77Å; C621-F650 VanDerWaalsContact O-O 3.13Å; Q626-F650 HydrophobicContact CB-CB 4.36Å; Q626-F650 HydrophobicContact CB-CD1 3.9Å; Q626-F650 HydrophobicContact CB-CD2 4.09Å; Q626-F650 HydrophobicContact CB-CE1 4.16Å; Q626-F650 HydrophobicContact CB-CE2 4.34Å; Q626-F650 HydrophobicContact CB-CG 3.85Å; Q626-F650 HydrophobicContact CB-CZ 4.38Å; L630-F650 HydrophobicContact CD1-CZ 4.07Å; L630-F650 HydrophobicContact CD2-CZ 4.2Å; L630-F650 HydrophobicContact CG-CE1 4.33Å; L630-F650 HydrophobicContact CG-CZ 4.13Å; T643-F650 HydrophobicContact CG2-CE2 3.98Å; T643-F650 HydrophobicContact CG2-CZ 3.76Å; L645-F650 HydrophobicContact CD1-CB 4.23Å; F650-V652 HydrophobicContact CE1-CB 3.76Å; F650-V652 HydrophobicContact CE1-CG1 3.89Å; F650-V652 HydrophobicContact CZ-CB 3.95Å
651	S	83	Confident	85.9	Confident	18 Å²	18	51.3 Å²	51.3	13%	0.126	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	137.4	170.9	-168.3	0	0	0	0	109.7	C619 T643 E644	C619-S651 CarbonylContact O-C 3.48Å; C619-S651 WeakPolarHBondContact O-CA 3.46Å; T643-S651 CarbonylContact C-O 3.38Å; T643-S651 WeakPolarHBondContact CA-O 3.25Å; E644-S651 PolarHBondContact N-O 3.01Å; E644-S651 PolarHBondContact O-N 3.41Å
652	V	90.9	Very high	85.6	Confident	0 Å²	0	48.5 Å²	48.5	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	127.3	175.3	57.8	0	0	0	0	110	E618 C619 V629 L630 L633 V640 T643 F650	E618-V652 WeakPolarHBondContact CA-O 3.19Å; C619-V652 HydrophobicContact CB-CG1 3.77Å; C619-V652 PolarHBondContact N-O 3.21Å; C619-V652 PolarHBondContact O-N 2.84Å; V629-V652 HydrophobicContact CG1-CG1 4.38Å; L630-V652 HydrophobicContact CD2-CG2 4.11Å; L633-V652 HydrophobicContact CD1-CG1 3.63Å; L633-V652 HydrophobicContact CD1-CG2 4.31Å; V640-V652 HydrophobicContact CG1-CG2 3.88Å; V640-V652 HydrophobicContact CG2-CG2 4.3Å; T643-V652 HydrophobicContact CG2-CB 4.23Å; T643-V652 HydrophobicContact CG2-CG2 3.88Å; F650-V652 HydrophobicContact CE1-CB 3.76Å; F650-V652 HydrophobicContact CE1-CG1 3.89Å; F650-V652 HydrophobicContact CZ-CB 3.95Å
653	I	89.3	Confident	85.3	Confident	32 Å²	32	47.9 Å²	47.9	16%	0.164	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	122.7	172	-58	176.5	0	0	0	107.5	K616 V617 E618 I641 S642	K616-I653 HydrophobicContact CG-CG2 4.17Å; V617-I653 CarbonylContact O-C 3.54Å; V617-I653 WeakPolarHBondContact O-CA 3.41Å; E618-I653 HydrophobicContact CB-CG1 4.46Å; E618-I653 HydrophobicContact CG-CG1 4.17Å; I641-I653 HydrophobicContact CB-CG2 4.41Å; I641-I653 HydrophobicContact CD1-CG2 4.18Å; I641-I653 PolarHBondContact N-O 3.4Å; S642-I653 PolarHBondContact N-O 2.91Å; S642-I653 VanDerWaalsContact N-O 3.14Å; S642-I653 PolarHBondContact O-N 3.28Å
654	C	93.1	Very high	85.1	Confident	0 Å²	0	44.2 Å²	44.2	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	163.8	-179.7	63.3	0	0	0	0	111.7	K616 V617 A638 V639 V640	K616-C654 CarbonylContact C-O 3.43Å; V617-C654 PolarHBondContact N-O 2.83Å; V617-C654 PolarHBondContact O-N 2.86Å; A638-C654 HydrophobicContact CB-CB 4.18Å; V639-C654 CarbonylContact O-C 3.59Å; V639-C654 WeakPolarHBondContact O-CA 3.33Å; V639-C654 WeakPolarHBondContact O-CB 3.39Å; V640-C654 HydrophobicContact CG2-CB 4.36Å
655	E	93.8	Very high	85.2	Confident	30 Å²	30	39 Å²	39	14%	0.14	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	123.9	170	-72.2	-166.6	152.5	0	0	109.8	V614 M615 A638 V639 I641 S683 R684	V614-E655 HydrophobicContact CG1-CB 3.73Å; V614-E655 HydrophobicContact CG1-CG 4.36Å; M615-E655 CarbonylContact O-C 3.54Å; M615-E655 VanDerWaalsContact O-CA 3.3Å; M615-E655 WeakPolarHBondContact O-CA 3.4Å; A638-E655 CarbonylContact C-O 3.59Å; A638-E655 VanDerWaalsContact CA-O 3.23Å; A638-E655 WeakPolarHBondContact CA-O 3.45Å; V639-E655 PolarHBondContact N-O 2.78Å; V639-E655 PolarHBondContact O-N 3.47Å; I641-E655 HydrophobicContact CD1-CG 3.64Å; I641-E655 HydrophobicContact CG1-CG 4.32Å; E655-S683 PolarHBondContact OE1-OG 3.38Å; E655-R684 IonicContact OE1-NE 3.7Å; E655-R684 IonicContact OE1-NH2 3.4Å; E655-R684 IonicContact OE2-CZ 3.77Å; E655-R684 IonicContact OE2-NE 2.94Å; E655-R684 PolarHBondContact OE2-NE 2.92Å; E655-R684 IonicContact OE2-NH2 3.52Å; E655-R684 PolarHBondContact OE2-NH2 3.16Å
656	A	92.9	Very high	85.2	Confident	0 Å²	0	37.7 Å²	37.7	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	142.3	-179.7	0	0	0	0	0	111.3	M615 V617 A638 L658 M661	M615-A656 PolarHBondContact N-O 3.01Å; M615-A656 PolarHBondContact O-N 3.47Å; V617-A656 HydrophobicContact CG2-CB 4.14Å; A638-A656 HydrophobicContact CB-CB 3.85Å; A656-L658 PolarHBondContact O-N 2.99Å; A656-M661 HydrophobicContact CB-CG 3.94Å; A656-M661 HydrophobicContact CB-SD 3.53Å; A656-M661 VanDerWaalsContact CB-SD 3.53Å
657	P	92.4	Very high	86.2	Confident	17 Å²	17	36 Å²	36	11%	0.11	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-60.6	131.8	173.5	-22	33	0	0	0	111.6	E612 N659 N660 M661	E612-P657 HydrophobicContact CG-CB 4.38Å; P657-N659 PolarHBondContact O-N 2.99Å; P657-N659 VanDerWaalsContact O-N 3.16Å; P657-N660 PolarHBondContact O-N 3.22Å; P657-M661 PolarHBondContact O-N 3.2Å
658	L	89.1	Confident	87.1	Confident	35 Å²	35	28.8 Å²	28.8	18%	0.183	16%	0.161	C	C	.	.	H	α-helix	trans	-55.3	-37.6	-178.9	179.4	60.1	0	0	0	111.9	P613 M615 A656 N660 M661 F662 M680	P613-L658 HydrophobicContact CG-CB 4.03Å; P613-L658 HydrophobicContact CG-CD2 3.98Å; P613-L658 WeakPolarHBondContact O-CB 3.47Å; P613-L658 PolarHBondContact O-N 3.13Å; M615-L658 HydrophobicContact CE-CD1 4.43Å; M615-L658 HydrophobicContact CG-CB 3.77Å; M615-L658 HydrophobicContact CG-CD1 3.79Å; M615-L658 HydrophobicContact CG-CG 4.32Å; M615-L658 HydrophobicContact SD-CB 4.16Å; M615-L658 HydrophobicContact SD-CD1 4.05Å; M615-L658 HydrophobicContact SD-CD2 4.39Å; M615-L658 HydrophobicContact SD-CG 4.42Å; A656-L658 PolarHBondContact O-N 2.99Å; L658-N660 PolarHBondContact O-N 2.86Å; L658-M661 PolarHBondContact O-N 3.22Å; L658-F662 HydrophobicContact CG-CZ 4.36Å; L658-M680 HydrophobicContact CD1-CE 4.05Å; L658-M680 HydrophobicContact CD1-SD 4.27Å
659	N	87.9	Confident	87.5	Confident	48 Å²	48	26.7 Å²	26.7	26%	0.257	14%	0.141	S	C	.	.	H	α-helix	trans	-57.8	-32.6	178.6	-169.2	31.7	0	0	0	113	V488 F490 P657 F662	V488-N659 HydrophobicContact CG2-CB 4.11Å; F490-N659 HydrophobicContact CZ-CB 4.4Å; P657-N659 PolarHBondContact O-N 2.99Å; P657-N659 VanDerWaalsContact O-N 3.16Å; N659-F662 WeakPolarHBondContact O-CD2 3.38Å
660	N	89.1	Confident	88.1	Confident	40 Å²	40	26.1 Å²	26.1	21%	0.214	15%	0.15	C	C	.	.	H	α-helix	trans	-92.5	-2.6	179.9	-64.6	-28.4	0	0	0	113.4	R636 P657 L658	R636-N660 HydrophobicContact CB-CB 4.25Å; R636-N660 VanDerWaalsContact CD-O 3.32Å; R636-N660 WeakPolarHBondContact CD-O 3.23Å; R636-N660 PolarHBondContact NH1-O 3.22Å; R636-N660 WeakPolarHBondContact O-CB 3.47Å; R636-N660 PolarHBondContact O-ND2 2.92Å; P657-N660 PolarHBondContact O-N 3.22Å; L658-N660 PolarHBondContact O-N 2.86Å
661	M	88.6	Confident	88.3	Confident	3 Å²	3	28.4 Å²	28.4	2%	0.015	16%	0.162	C	C	.	.	H	α-helix	trans	-90.1	-13.6	179.9	-69.6	-56.8	-63.4	0	0	113.4	V617 A656 P657 L658 G663 F664 Y678 M680	V617-M661 HydrophobicContact CB-CE 4.49Å; V617-M661 HydrophobicContact CG1-CE 3.91Å; V617-M661 HydrophobicContact CG2-CE 3.77Å; V617-M661 HydrophobicContact CG2-CG 4.45Å; V617-M661 HydrophobicContact CG2-SD 4.17Å; A656-M661 HydrophobicContact CB-CG 3.94Å; A656-M661 HydrophobicContact CB-SD 3.53Å; A656-M661 VanDerWaalsContact CB-SD 3.53Å; P657-M661 PolarHBondContact O-N 3.2Å; L658-M661 PolarHBondContact O-N 3.22Å; M661-G663 PolarHBondContact O-N 3.47Å; M661-F664 HydrophobicContact CE-CB 4Å; M661-F664 HydrophobicContact CE-CD1 3.39Å; M661-F664 HydrophobicContact CE-CE1 4.06Å; M661-F664 HydrophobicContact CE-CG 3.84Å; M661-F664 WeakPolarHBondContact O-CB 3.21Å; M661-F664 PolarHBondContact O-N 3.21Å; M661-F664 VanDerWaalsContact O-N 3.08Å; M661-Y678 HydrophobicContact CE-CD2 4.3Å; M661-Y678 HydrophobicContact CE-CE2 4.01Å; M661-M680 HydrophobicContact CB-SD 4.28Å
662	F	84.2	Confident	88.4	Confident	40 Å²	40	27.6 Å²	27.6	18%	0.175	16%	0.156	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.4	132	176.5	-61.9	-61.9	0	0	0	111.7	K485 P486 V488 R636 L658 N659 F664	K485-F662 HydrophobicContact CD-CB 4.46Å; P486-F662 HydrophobicContact CB-CE1 4.21Å; P486-F662 HydrophobicContact CB-CZ 4.27Å; P486-F662 HydrophobicContact CG-CE1 3.81Å; P486-F662 HydrophobicContact CG-CZ 4.36Å; V488-F662 HydrophobicContact CG2-CE2 3.54Å; V488-F662 HydrophobicContact CG2-CZ 3.92Å; R636-F662 PolarHBondContact NH1-O 2.88Å; L658-F662 HydrophobicContact CG-CZ 4.36Å; N659-F662 WeakPolarHBondContact O-CD2 3.38Å; F662-F664 PolarHBondContact O-N 3.23Å
663	G	82.8	Confident	87.8	Confident	28 Å²	28	33.3 Å²	33.3	29%	0.289	18%	0.183	S	C	.	.	T	Hydrogen-bonded Turn	trans	71.9	8.9	-176.5	0	0	0	0	0	114.9	M661 I665 T666 E667	M661-G663 PolarHBondContact O-N 3.47Å; G663-I665 VanDerWaalsContact C-N 3.34Å; G663-I665 PolarHBondContact O-N 3.46Å; G663-T666 PolarHBondContact O-N 2.9Å; G663-E667 PolarHBondContact O-N 3.05Å
664	F	88.4	Confident	87.1	Confident	0 Å²	0	32.5 Å²	32.5	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-64.6	-36.4	179.3	-179.8	-121.8	0	0	0	112.4	A632 L633 M661 F662 T666 E667 L668 Y678	A632-F664 HydrophobicContact CB-CE2 4.2Å; L633-F664 HydrophobicContact CD2-CE1 3.97Å; L633-F664 HydrophobicContact CD2-CE2 4.06Å; L633-F664 HydrophobicContact CD2-CZ 3.47Å; L633-F664 VanDerWaalsContact CD2-CZ 3.47Å; L633-F664 HydrophobicContact CG-CZ 4.05Å; M661-F664 HydrophobicContact CE-CB 4Å; M661-F664 HydrophobicContact CE-CD1 3.39Å; M661-F664 HydrophobicContact CE-CE1 4.06Å; M661-F664 HydrophobicContact CE-CG 3.84Å; M661-F664 WeakPolarHBondContact O-CB 3.21Å; M661-F664 PolarHBondContact O-N 3.21Å; M661-F664 VanDerWaalsContact O-N 3.08Å; F662-F664 PolarHBondContact O-N 3.23Å; F664-T666 VanDerWaalsContact C-N 3.27Å; F664-T666 PolarHBondContact O-N 3.18Å; F664-E667 PolarHBondContact O-N 3.25Å; F664-L668 HydrophobicContact CE1-CB 4.34Å; F664-L668 HydrophobicContact CE1-CD2 4.07Å; F664-L668 HydrophobicContact CE2-CB 4.39Å; F664-L668 HydrophobicContact CZ-CB 4.24Å; F664-L668 HydrophobicContact CZ-CD1 4.11Å; F664-L668 HydrophobicContact CZ-CD2 4.46Å; F664-L668 HydrophobicContact CZ-CG 4.5Å; F664-L668 VanDerWaalsContact O-CB 3.25Å; F664-L668 WeakPolarHBondContact O-CB 3.44Å; F664-L668 PolarHBondContact O-N 2.88Å; F664-Y678 HydrophobicContact CB-CE1 4.44Å; F664-Y678 AromaticContact CD1-CD1 3.64Å; F664-Y678 HydrophobicContact CD1-CD1 3.64Å; F664-Y678 HydrophobicContact CD1-CD2 4.34Å; F664-Y678 AromaticContact CD1-CE1 3.64Å; F664-Y678 HydrophobicContact CD1-CE1 3.64Å; F664-Y678 HydrophobicContact CD1-CE2 4.38Å; F664-Y678 HydrophobicContact CD1-CG 4Å; F664-Y678 AromaticContact CE1-CD1 3.96Å; F664-Y678 HydrophobicContact CE1-CD1 3.96Å; F664-Y678 HydrophobicContact CE1-CE1 4.41Å; F664-Y678 HydrophobicContact CE1-CG 4.09Å; F664-Y678 HydrophobicContact CG-CE1 4.45Å
665	I	84.7	Confident	86.3	Confident	4 Å²	4	34.4 Å²	34.4	2%	0.021	19%	0.191	C	C	.	.	H	α-helix	trans	-58.9	-39.4	179.5	-165.6	60.9	0	0	0	112.4	V415 V416 G663 L668 R669 Y678	V415-I665 HydrophobicContact CG2-CD1 4.34Å; V415-I665 HydrophobicContact CG2-CG1 4.07Å; V416-I665 HydrophobicContact CG2-CB 4.41Å; V416-I665 HydrophobicContact CG2-CG2 3.37Å; G663-I665 VanDerWaalsContact C-N 3.34Å; G663-I665 PolarHBondContact O-N 3.46Å; I665-L668 HydrophobicContact CD1-CD2 4.46Å; I665-L668 PolarHBondContact O-N 2.86Å; I665-R669 HydrophobicContact CD1-CG 4.23Å; I665-R669 HydrophobicContact CG1-CG 4.32Å; I665-R669 WeakPolarHBondContact O-CB 3.47Å; I665-R669 VanDerWaalsContact O-CG 3.3Å; I665-R669 WeakPolarHBondContact O-CG 3.44Å; I665-R669 PolarHBondContact O-N 3.4Å; I665-Y678 HydrophobicContact CB-CE1 3.79Å; I665-Y678 HydrophobicContact CD1-CD1 3.89Å; I665-Y678 HydrophobicContact CD1-CE1 3.85Å; I665-Y678 HydrophobicContact CG1-CE1 4.36Å
666	T	84.4	Confident	85.5	Confident	61 Å²	61	33 Å²	33	37%	0.374	19%	0.185	S	C	.	.	H	α-helix	trans	-68.9	-42.3	-177.3	-53.6	0	0	0	0	110	E463 G663 F664 S670	E463-T666 PolarHBondContact OE2-OG1 3.35Å; G663-T666 PolarHBondContact O-N 2.9Å; F664-T666 VanDerWaalsContact C-N 3.27Å; F664-T666 PolarHBondContact O-N 3.18Å; T666-S670 WeakPolarHBondContact O-CB 3.46Å; T666-S670 PolarHBondContact O-N 2.92Å; T666-S670 VanDerWaalsContact O-N 3.14Å; T666-S670 PolarHBondContact O-OG 2.8Å
667	E	89.7	Confident	84.9	Confident	47 Å²	47	38.5 Å²	38.5	22%	0.22	21%	0.21	C	C	.	.	H	α-helix	trans	-66.7	-46.5	173.3	-171.3	173.8	-153.4	0	0	111.2	K635 R636 G663 F664 R669 S670 L671	K635-E667 IonicContact NZ-OE1 3.68Å; K635-E667 PolarHBondContact NZ-OE1 3.01Å; R636-E667 IonicContact CZ-OE2 2.62Å; R636-E667 VanDerWaalsContact CZ-OE2 3.28Å; R636-E667 IonicContact NE-OE2 2.81Å; R636-E667 PolarHBondContact NE-OE2 3.04Å; R636-E667 IonicContact NH2-OE2 3.24Å; R636-E667 PolarHBondContact NH2-OE2 2.88Å; G663-E667 PolarHBondContact O-N 3.05Å; F664-E667 PolarHBondContact O-N 3.25Å; E667-R669 PolarHBondContact O-N 3.07Å; E667-S670 WeakPolarHBondContact O-CB 3.5Å; E667-S670 PolarHBondContact O-N 3.5Å; E667-S670 VanDerWaalsContact O-N 3.14Å; E667-L671 HydrophobicContact CG-CD1 3.96Å; E667-L671 HydrophobicContact CG-CG 4.46Å; E667-L671 VanDerWaalsContact O-CG 3.29Å; E667-L671 WeakPolarHBondContact O-CG 3.33Å; E667-L671 PolarHBondContact O-N 3.37Å
668	L	89	Confident	84.6	Confident	0 Å²	0	38.4 Å²	38.4	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-58.9	-48.7	-180	179.1	64.6	0	0	0	111.5	V629 F664 I665 S670 L671 T672 Y678	V629-L668 HydrophobicContact CG1-CD1 4.19Å; V629-L668 HydrophobicContact CG2-CD1 3.77Å; F664-L668 HydrophobicContact CE1-CB 4.34Å; F664-L668 HydrophobicContact CE1-CD2 4.07Å; F664-L668 HydrophobicContact CE2-CB 4.39Å; F664-L668 HydrophobicContact CZ-CB 4.24Å; F664-L668 HydrophobicContact CZ-CD1 4.11Å; F664-L668 HydrophobicContact CZ-CD2 4.46Å; F664-L668 HydrophobicContact CZ-CG 4.5Å; F664-L668 VanDerWaalsContact O-CB 3.25Å; F664-L668 WeakPolarHBondContact O-CB 3.44Å; F664-L668 PolarHBondContact O-N 2.88Å; I665-L668 HydrophobicContact CD1-CD2 4.46Å; I665-L668 PolarHBondContact O-N 2.86Å; L668-S670 VanDerWaalsContact C-N 3.3Å; L668-S670 PolarHBondContact O-N 3.35Å; L668-L671 PolarHBondContact O-N 2.75Å; L668-T672 HydrophobicContact CD1-CG2 3.85Å; L668-T672 HydrophobicContact CG-CG2 4.47Å; L668-T672 WeakPolarHBondContact O-CB 3.46Å; L668-T672 WeakPolarHBondContact O-CG2 3.38Å; L668-T672 PolarHBondContact O-N 3.34Å; L668-T672 PolarHBondContact O-OG1 3.32Å; L668-Y678 HydrophobicContact CD2-CD1 3.81Å; L668-Y678 HydrophobicContact CD2-CG 4.48Å
669	R	84.5	Confident	84	Confident	40 Å²	40	40.7 Å²	40.7	15%	0.151	22%	0.224	C	C	.	.	H	α-helix	trans	-64.2	-36.7	177.4	-73.2	-179.8	-179.4	166.6	4.9	111.4	D89 M461 I665 E667 E673 G674	D89-R669 IonicContact OD1-CZ 3.4Å; D89-R669 IonicContact OD1-NH1 3.4Å; D89-R669 PolarHBondContact OD1-NH1 3.06Å; D89-R669 IonicContact OD1-NH2 3.81Å; M461-R669 PolarHBondContact O-NH2 2.97Å; I665-R669 HydrophobicContact CD1-CG 4.23Å; I665-R669 HydrophobicContact CG1-CG 4.32Å; I665-R669 WeakPolarHBondContact O-CB 3.47Å; I665-R669 VanDerWaalsContact O-CG 3.3Å; I665-R669 WeakPolarHBondContact O-CG 3.44Å; I665-R669 PolarHBondContact O-N 3.4Å; E667-R669 PolarHBondContact O-N 3.07Å; R669-E673 CarbonylContact O-C 3.5Å; R669-E673 PolarHBondContact O-N 3.25Å; R669-E673 VanDerWaalsContact O-N 3.16Å; R669-G674 PolarHBondContact O-N 2.93Å
670	S	87	Confident	83.9	Confident	94 Å²	94	41.5 Å²	41.5	66%	0.657	23%	0.227	S	C	*	.	H	α-helix	trans	-64.6	-41.4	175.5	-58.7	0	0	0	0	111.9	T666 E667 L668	T666-S670 WeakPolarHBondContact O-CB 3.46Å; T666-S670 PolarHBondContact O-N 2.92Å; T666-S670 VanDerWaalsContact O-N 3.14Å; T666-S670 PolarHBondContact O-OG 2.8Å; E667-S670 WeakPolarHBondContact O-CB 3.5Å; E667-S670 PolarHBondContact O-N 3.5Å; E667-S670 VanDerWaalsContact O-N 3.14Å; L668-S670 VanDerWaalsContact C-N 3.3Å; L668-S670 PolarHBondContact O-N 3.35Å
671	L	90.5	Very high	83.3	Confident	60 Å²	60	46.4 Å²	46.4	31%	0.314	25%	0.248	S	C	.	.	H	α-helix	trans	-73.7	-30.3	-179.2	-68.4	171.4	0	0	0	113.9	F625 A632 E667 L668	F625-L671 WeakPolarHBondContact CD1-O 3.31Å; A632-L671 HydrophobicContact CB-CD1 3.51Å; E667-L671 HydrophobicContact CG-CD1 3.96Å; E667-L671 HydrophobicContact CG-CG 4.46Å; E667-L671 VanDerWaalsContact O-CG 3.29Å; E667-L671 WeakPolarHBondContact O-CG 3.33Å; E667-L671 PolarHBondContact O-N 3.37Å; L668-L671 PolarHBondContact O-N 2.75Å
672	T	83.8	Confident	83	Confident	0 Å²	0	52 Å²	52	0%	0	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104.4	13.4	-175	59.7	0	0	0	0	113	C621 F625 V629 L668 G674 K675 G676	C621-T672 HydrophobicContact CB-CG2 3.85Å; F625-T672 HydrophobicContact CB-CG2 3.98Å; F625-T672 HydrophobicContact CG-CG2 4.35Å; V629-T672 HydrophobicContact CG2-CG2 3.53Å; L668-T672 HydrophobicContact CD1-CG2 3.85Å; L668-T672 HydrophobicContact CG-CG2 4.47Å; L668-T672 WeakPolarHBondContact O-CB 3.46Å; L668-T672 WeakPolarHBondContact O-CG2 3.38Å; L668-T672 PolarHBondContact O-N 3.34Å; L668-T672 PolarHBondContact O-OG1 3.32Å; T672-G674 PolarHBondContact O-N 2.84Å; T672-G674 VanDerWaalsContact O-N 3.11Å; T672-K675 WeakPolarHBondContact O-CB 3.46Å; T672-K675 WeakPolarHBondContact O-CG 3.45Å; T672-K675 PolarHBondContact O-N 3.28Å; T672-G676 WeakPolarHBondContact OG1-CA 3.34Å; T672-G676 PolarHBondContact OG1-N 2.97Å
673	E	79.4	Confident	82.9	Confident	120 Å²	120	52.2 Å²	52.2	56%	0.561	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.5	25.8	-172.4	-53.3	177.1	155.8	0	0	113.4	S116 F625 R669 K675	S116-E673 WeakPolarHBondContact CB-O 3.2Å; S116-E673 PolarHBondContact OG-O 3.01Å; F625-E673 HydrophobicContact CE1-CG 3.96Å; F625-E673 HydrophobicContact CZ-CB 4.42Å; F625-E673 HydrophobicContact CZ-CG 3.79Å; R669-E673 CarbonylContact O-C 3.5Å; R669-E673 PolarHBondContact O-N 3.25Å; R669-E673 VanDerWaalsContact O-N 3.16Å; E673-K675 IonicContact OE2-NZ 3.97Å; E673-K675 PolarHBondContact OE2-NZ 3.21Å
674	G	73.8	Confident	83	Confident	15 Å²	15	57.1 Å²	57.1	16%	0.155	29%	0.286	C	S	.	.	T	Hydrogen-bonded Turn	trans	86.4	9.3	-178.6	0	0	0	0	0	114.8	R669 T672	R669-G674 PolarHBondContact O-N 2.93Å; T672-G674 PolarHBondContact O-N 2.84Å; T672-G674 VanDerWaalsContact O-N 3.11Å
675	K	76.1	Confident	83.1	Confident	41 Å²	41	58.1 Å²	58.1	18%	0.178	29%	0.29	C	S	.	.			trans	-91.7	-11.4	178.9	-56	172	-172.5	145.8	0	113.4	P622 F625 T672 E673	P622-K675 HydrophobicContact CG-CB 3.62Å; P622-K675 HydrophobicContact CG-CD 3.56Å; P622-K675 HydrophobicContact CG-CG 4.18Å; F625-K675 HydrophobicContact CE2-CD 4.03Å; T672-K675 WeakPolarHBondContact O-CB 3.46Å; T672-K675 WeakPolarHBondContact O-CG 3.45Å; T672-K675 PolarHBondContact O-N 3.28Å; E673-K675 IonicContact OE2-NZ 3.97Å; E673-K675 PolarHBondContact OE2-NZ 3.21Å
676	G	77.7	Confident	83.3	Confident	1 Å²	1	59.1 Å²	59.1	1%	0.01	30%	0.299	C	S	.	.			trans	-85.5	132.5	-179.2	0	0	0	0	0	112.2	S620 T672	S620-G676 WeakPolarHBondContact O-CA 3.33Å; T672-G676 WeakPolarHBondContact OG1-CA 3.34Å; T672-G676 PolarHBondContact OG1-N 2.97Å
677	E	80.6	Confident	83.6	Confident	114 Å²	114	60.1 Å²	60.1	53%	0.533	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	149.7	174.1	-65.6	177.7	-178.4	0	0	108.8	C619 S620	C619-E677 CarbonylContact C-O 3.54Å; C619-E677 WeakPolarHBondContact CA-O 3.23Å; S620-E677 PolarHBondContact N-O 3.25Å; S620-E677 PolarHBondContact O-N 3.21Å
678	Y	85.3	Confident	83.7	Confident	15 Å²	15	58.5 Å²	58.5	6%	0.059	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	152.2	169.7	81.4	-86.1	0	0	0	111.4	V415 V617 E618 M661 F664 I665 L668 M680	V415-Y678 PolarHBondContact O-OH 2.9Å; V617-Y678 HydrophobicContact CG1-CD2 3.96Å; V617-Y678 HydrophobicContact CG1-CG 4.49Å; E618-Y678 CarbonylContact O-C 3.57Å; E618-Y678 WeakPolarHBondContact O-CA 3.43Å; E618-Y678 WeakPolarHBondContact O-CB 3.15Å; M661-Y678 HydrophobicContact CE-CD2 4.3Å; M661-Y678 HydrophobicContact CE-CE2 4.01Å; F664-Y678 HydrophobicContact CB-CE1 4.44Å; F664-Y678 AromaticContact CD1-CD1 3.64Å; F664-Y678 HydrophobicContact CD1-CD1 3.64Å; F664-Y678 HydrophobicContact CD1-CD2 4.34Å; F664-Y678 AromaticContact CD1-CE1 3.64Å; F664-Y678 HydrophobicContact CD1-CE1 3.64Å; F664-Y678 HydrophobicContact CD1-CE2 4.38Å; F664-Y678 HydrophobicContact CD1-CG 4Å; F664-Y678 AromaticContact CE1-CD1 3.96Å; F664-Y678 HydrophobicContact CE1-CD1 3.96Å; F664-Y678 HydrophobicContact CE1-CE1 4.41Å; F664-Y678 HydrophobicContact CE1-CG 4.09Å; F664-Y678 HydrophobicContact CG-CE1 4.45Å; I665-Y678 HydrophobicContact CB-CE1 3.79Å; I665-Y678 HydrophobicContact CD1-CD1 3.89Å; I665-Y678 HydrophobicContact CD1-CE1 3.85Å; I665-Y678 HydrophobicContact CG1-CE1 4.36Å; L668-Y678 HydrophobicContact CD2-CD1 3.81Å; L668-Y678 HydrophobicContact CD2-CG 4.48Å; Y678-M680 HydrophobicContact CD2-CB 4.47Å; Y678-M680 HydrophobicContact CE2-CB 4.35Å; Y678-M680 HydrophobicContact CE2-CG 4.18Å; Y678-M680 HydrophobicContact CE2-SD 4.05Å
679	T	77.2	Confident	83.7	Confident	84 Å²	84	63.2 Å²	63.2	52%	0.515	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	154.7	168.5	58.1	0	0	0	0	108.6	V617 E618	V617-T679 WeakPolarHBondContact CA-O 3.29Å; E618-T679 PolarHBondContact N-O 3.34Å; E618-T679 PolarHBondContact O-N 3.02Å
680	M	84.8	Confident	83.9	Confident	65 Å²	65	67.7 Å²	67.7	32%	0.32	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	139.2	175.6	68.3	178.9	-179.4	0	0	111.6	M615 K616 V617 L658 M661 Y678	M615-M680 HydrophobicContact CB-CB 4.23Å; M615-M680 HydrophobicContact CE-CB 4.34Å; M615-M680 HydrophobicContact CE-CG 4Å; M615-M680 HydrophobicContact CE-SD 4.29Å; M615-M680 HydrophobicContact CG-SD 4.34Å; K616-M680 CarbonylContact O-C 3.47Å; K616-M680 VanDerWaalsContact O-CA 3.24Å; K616-M680 WeakPolarHBondContact O-CA 3.26Å; V617-M680 HydrophobicContact CG2-CB 3.96Å; L658-M680 HydrophobicContact CD1-CE 4.05Å; L658-M680 HydrophobicContact CD1-SD 4.27Å; M661-M680 HydrophobicContact CB-SD 4.28Å; Y678-M680 HydrophobicContact CD2-CB 4.47Å; Y678-M680 HydrophobicContact CE2-CB 4.35Å; Y678-M680 HydrophobicContact CE2-CG 4.18Å; Y678-M680 HydrophobicContact CE2-SD 4.05Å
681	E	76.7	Confident	84	Confident	142 Å²	142	68.8 Å²	68.8	66%	0.664	35%	0.345	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-129	150.7	178.3	-64.7	-175.5	166	0	0	110.1	M615 K616 S683	M615-E681 CarbonylContact C-O 3.53Å; M615-E681 VanDerWaalsContact CA-O 3.25Å; M615-E681 WeakPolarHBondContact CA-O 3.49Å; M615-E681 VanDerWaalsContact CE-C 3.41Å; K616-E681 PolarHBondContact N-O 2.77Å; K616-E681 PolarHBondContact O-N 2.81Å; E681-S683 PolarHBondContact O-N 3.25Å
682	Y	81.9	Confident	83.8	Confident	121 Å²	121	67.4 Å²	67.4	48%	0.475	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.1	126.5	175.8	168.1	-93.9	0	0	0	109.8	P613 Y685	P613-Y682 HydrophobicContact CB-CD2 4.21Å; P613-Y682 HydrophobicContact CB-CE2 4.17Å; Y682-Y685 AromaticContact CE2-CD2 3.76Å; Y682-Y685 HydrophobicContact CE2-CD2 3.76Å; Y682-Y685 AromaticContact CE2-CE2 3.61Å; Y682-Y685 HydrophobicContact CE2-CE2 3.61Å; Y682-Y685 AromaticContact CZ-CD2 3.91Å; Y682-Y685 AromaticContact CZ-CE2 3.99Å; Y682-Y685 WeakPolarHBondContact OH-CD2 3.48Å
683	S	82.8	Confident	84	Confident	45 Å²	45	68.3 Å²	68.3	32%	0.315	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	-65.1	176	-178.5	0	0	0	0	110.7	V614 E655 E681	V614-S683 WeakPolarHBondContact O-CB 3.31Å; V614-S683 PolarHBondContact O-N 3.22Å; E655-S683 PolarHBondContact OE1-OG 3.38Å; E681-S683 PolarHBondContact O-N 3.25Å
684	R	85.4	Confident	84.5	Confident	131 Å²	131	68.2 Å²	68.2	49%	0.494	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-163.6	170.9	-172.7	58.9	-176.5	171.6	-179.2	-0.9	111.3	V614 E655	V614-R684 WeakPolarHBondContact CA-O 3.3Å; V614-R684 HydrophobicContact CB-CG 4.39Å; V614-R684 WeakPolarHBondContact CB-O 3.37Å; V614-R684 PolarHBondContact N-O 3.06Å; V614-R684 PolarHBondContact O-N 3.11Å; E655-R684 IonicContact OE1-NE 3.7Å; E655-R684 IonicContact OE1-NH2 3.4Å; E655-R684 IonicContact OE2-CZ 3.77Å; E655-R684 IonicContact OE2-NE 2.94Å; E655-R684 PolarHBondContact OE2-NE 2.92Å; E655-R684 IonicContact OE2-NH2 3.52Å; E655-R684 PolarHBondContact OE2-NH2 3.16Å
685	Y	89.1	Confident	85.3	Confident	20 Å²	20	73.7 Å²	73.7	8%	0.078	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	145.1	162.7	-81.9	-101	0	0	0	111.3	A489 R491 N529 M530 I611 E612 P613 Y682	A489-Y685 VanDerWaalsContact O-CE1 3.25Å; A489-Y685 WeakPolarHBondContact O-CE1 3.34Å; A489-Y685 PolarHBondContact O-OH 3.45Å; A489-Y685 VanDerWaalsContact O-OH 3.12Å; R491-Y685 HydrophobicContact CG-CD1 4.35Å; R491-Y685 HydrophobicContact CG-CE1 3.79Å; N529-Y685 PolarHBondContact ND2-O 3.28Å; M530-Y685 HydrophobicContact CE-CD2 4.16Å; M530-Y685 HydrophobicContact CE-CE2 3.62Å; M530-Y685 HydrophobicContact CG-CD2 3.81Å; M530-Y685 HydrophobicContact CG-CE2 4.19Å; M530-Y685 HydrophobicContact SD-CD1 4.38Å; M530-Y685 HydrophobicContact SD-CD2 3.24Å; M530-Y685 WeakPolarHBondContact SD-CD2 3.4Å; M530-Y685 HydrophobicContact SD-CE1 4.43Å; M530-Y685 HydrophobicContact SD-CE2 3.35Å; M530-Y685 WeakPolarHBondContact SD-CE2 3.3Å; M530-Y685 HydrophobicContact SD-CG 3.82Å; I611-Y685 HydrophobicContact CB-CD1 4.26Å; I611-Y685 HydrophobicContact CD1-CD1 4.16Å; I611-Y685 HydrophobicContact CD1-CG 4.26Å; I611-Y685 HydrophobicContact CG1-CD1 3.85Å; I611-Y685 HydrophobicContact CG1-CG 4.4Å; E612-Y685 CarbonylContact O-C 3.54Å; E612-Y685 VanDerWaalsContact O-CA 3.29Å; E612-Y685 WeakPolarHBondContact O-CA 3.3Å; P613-Y685 HydrophobicContact CB-CE1 4.12Å; P613-Y685 HydrophobicContact CB-CE2 4.32Å; P613-Y685 HydrophobicContact CG-CE1 4.28Å; Y682-Y685 AromaticContact CE2-CD2 3.76Å; Y682-Y685 HydrophobicContact CE2-CD2 3.76Å; Y682-Y685 AromaticContact CE2-CE2 3.61Å; Y682-Y685 HydrophobicContact CE2-CE2 3.61Å; Y682-Y685 AromaticContact CZ-CD2 3.91Å; Y682-Y685 AromaticContact CZ-CE2 3.99Å; Y682-Y685 WeakPolarHBondContact OH-CD2 3.48Å
686	A	89.5	Confident	85.8	Confident	26 Å²	26	73 Å²	73	22%	0.215	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	156	174.5	0	0	0	0	0	111.3	I611 E612 V614 V688	I611-A686 CarbonylContact C-O 3.48Å; I611-A686 WeakPolarHBondContact CA-O 3.23Å; E612-A686 PolarHBondContact N-O 3.49Å; E612-A686 PolarHBondContact O-N 3.07Å; V614-A686 HydrophobicContact CG2-CB 3.54Å; A686-V688 PolarHBondContact O-N 3.31Å
687	P	90.9	Very high	86.4	Confident	81 Å²	81	74.5 Å²	74.5	53%	0.526	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-56.5	135.3	175.8	-25.3	35.2	0	0	0	113.1	L610	L610-P687 WeakPolarHBondContact O-CA 3.46Å
688	V	91	Very high	86.8	Confident	14 Å²	14	75 Å²	75	9%	0.085	37%	0.372	C	S	.	.	P	Polyproline II helix	trans	-75.2	143.2	178	-177.4	0	0	0	0	109.9	F490 L610 E612 A686 V692 T693	F490-V688 HydrophobicContact CD1-CG2 4.09Å; F490-V688 HydrophobicContact CE1-CG2 4.24Å; L610-V688 HydrophobicContact CB-CB 4.04Å; L610-V688 HydrophobicContact CB-CG2 3.77Å; L610-V688 WeakPolarHBondContact O-CG2 3.32Å; L610-V688 PolarHBondContact O-N 3Å; E612-V688 HydrophobicContact CB-CG2 3.63Å; E612-V688 HydrophobicContact CG-CG2 3.73Å; A686-V688 PolarHBondContact O-N 3.31Å; V688-V692 HydrophobicContact CG1-CB 3.63Å; V688-V692 HydrophobicContact CG1-CG1 3.67Å; V688-T693 WeakPolarHBondContact CG1-OG1 3.31Å
689	K	89.5	Confident	86.9	Confident	98 Å²	98	80.2 Å²	80.2	43%	0.426	40%	0.397	S	S	.	.	P	Polyproline II helix	trans	-61.7	143.7	172.7	-68.3	-170.5	176.4	-169.4	0	111.7	D691 V692 T693	K689-D691 VanDerWaalsContact C-N 3.31Å; K689-D691 PolarHBondContact O-N 2.81Å; K689-V692 PolarHBondContact O-N 2.89Å; K689-T693 PolarHBondContact O-N 3.05Å; K689-T693 PolarHBondContact O-OG1 2.88Å
690	L	88.3	Confident	87.3	Confident	135 Å²	135	78.8 Å²	78.8	71%	0.707	38%	0.382	S	S	*	.	H	α-helix	trans	-51.6	-45.9	-177.9	-66.5	171.7	0	0	0	113.1	V692 T693 E694	L690-V692 VanDerWaalsContact C-N 3.25Å; L690-V692 PolarHBondContact O-N 3.08Å; L690-T693 WeakPolarHBondContact O-CB 3.26Å; L690-T693 PolarHBondContact O-N 2.78Å; L690-T693 VanDerWaalsContact O-N 3.13Å; L690-E694 PolarHBondContact O-N 3.02Å
691	D	89.1	Confident	87.4	Confident	117 Å²	117	83.5 Å²	83.5	63%	0.626	40%	0.396	S	S	*	.	H	α-helix	trans	-58.9	-34.2	179.4	-56.1	-10	0	0	0	113.6	K689 K695	K689-D691 VanDerWaalsContact C-N 3.31Å; K689-D691 PolarHBondContact O-N 2.81Å; D691-K695 WeakPolarHBondContact O-CG 3.14Å
692	V	86.7	Confident	87.8	Confident	30 Å²	30	79.9 Å²	79.9	18%	0.182	39%	0.391	C	S	.	.	H	α-helix	trans	-80.8	-39.9	178.7	178.8	0	0	0	0	109.6	V688 K689 L690 E694 K695 L696	V688-V692 HydrophobicContact CG1-CB 3.63Å; V688-V692 HydrophobicContact CG1-CG1 3.67Å; K689-V692 PolarHBondContact O-N 2.89Å; L690-V692 VanDerWaalsContact C-N 3.25Å; L690-V692 PolarHBondContact O-N 3.08Å; V692-E694 PolarHBondContact O-N 3.36Å; V692-K695 PolarHBondContact O-N 3.26Å; V692-L696 HydrophobicContact CG1-CD1 4.04Å; V692-L696 HydrophobicContact CG1-CG 4.39Å; V692-L696 WeakPolarHBondContact O-CG 3.21Å; V692-L696 PolarHBondContact O-N 3.23Å
693	T	88.2	Confident	87.8	Confident	19 Å²	19	78.1 Å²	78.1	12%	0.117	39%	0.393	C	S	.	.	H	α-helix	trans	-56.7	-48.6	175	-61.2	0	0	0	0	111.7	L610 V688 K689 L690 K695 L696 I697	L610-T693 HydrophobicContact CD1-CG2 3.9Å; L610-T693 HydrophobicContact CG-CG2 4.11Å; V688-T693 WeakPolarHBondContact CG1-OG1 3.31Å; K689-T693 PolarHBondContact O-N 3.05Å; K689-T693 PolarHBondContact O-OG1 2.88Å; L690-T693 WeakPolarHBondContact O-CB 3.26Å; L690-T693 PolarHBondContact O-N 2.78Å; L690-T693 VanDerWaalsContact O-N 3.13Å; T693-K695 VanDerWaalsContact C-N 3.34Å; T693-K695 PolarHBondContact O-N 3.08Å; T693-L696 PolarHBondContact O-N 2.74Å; T693-I697 HydrophobicContact CG2-CD1 3.82Å; T693-I697 VanDerWaalsContact O-CG1 3.31Å; T693-I697 WeakPolarHBondContact O-CG1 3.47Å; T693-I697 PolarHBondContact O-N 2.95Å
694	E	90.2	Very high	87.6	Confident	119 Å²	119	78.3 Å²	78.3	56%	0.556	39%	0.389	S	S	*	.	H	α-helix	trans	-60.8	-41.8	178.9	-72.4	-177.7	178.4	0	0	112.4	L690 V692 I697 Q698	L690-E694 PolarHBondContact O-N 3.02Å; V692-E694 PolarHBondContact O-N 3.36Å; E694-I697 PolarHBondContact O-N 3.02Å; E694-Q698 VanDerWaalsContact O-CG 3.3Å; E694-Q698 WeakPolarHBondContact O-CG 3.38Å; E694-Q698 PolarHBondContact O-N 2.87Å
695	K	89.9	Confident	87.2	Confident	130 Å²	130	76.6 Å²	76.6	57%	0.565	39%	0.389	S	S	*	.	H	α-helix	trans	-62.4	-46.6	176.5	-73.5	175.2	-175.9	177.5	0	112	D691 V692 T693 I697 Q698 E699	D691-K695 WeakPolarHBondContact O-CG 3.14Å; V692-K695 PolarHBondContact O-N 3.26Å; T693-K695 VanDerWaalsContact C-N 3.34Å; T693-K695 PolarHBondContact O-N 3.08Å; K695-I697 VanDerWaalsContact C-N 3.32Å; K695-I697 PolarHBondContact O-N 2.79Å; K695-Q698 PolarHBondContact O-N 2.81Å; K695-E699 WeakPolarHBondContact O-CG 3.15Å; K695-E699 PolarHBondContact O-N 2.77Å
696	L	87.6	Confident	86.4	Confident	26 Å²	26	77 Å²	77	14%	0.136	40%	0.399	C	S	.	.	H	α-helix	trans	-63	-39	179.1	-68.6	171.1	0	0	0	111.9	F490 I565 L610 V692 T693 E699 Y700	F490-L696 HydrophobicContact CD1-CD1 3.94Å; F490-L696 HydrophobicContact CD2-CD1 4.06Å; F490-L696 HydrophobicContact CD2-CD2 4.4Å; F490-L696 HydrophobicContact CE1-CD1 3.68Å; F490-L696 HydrophobicContact CE2-CD1 3.78Å; F490-L696 HydrophobicContact CE2-CD2 3.83Å; F490-L696 HydrophobicContact CE2-CG 4.49Å; F490-L696 HydrophobicContact CG-CD1 4.13Å; F490-L696 HydrophobicContact CZ-CD1 3.59Å; F490-L696 HydrophobicContact CZ-CD2 4.2Å; I565-L696 HydrophobicContact CG2-CB 4.16Å; L610-L696 HydrophobicContact CD1-CB 4.22Å; L610-L696 HydrophobicContact CD1-CD1 3.92Å; V692-L696 HydrophobicContact CG1-CD1 4.04Å; V692-L696 HydrophobicContact CG1-CG 4.39Å; V692-L696 WeakPolarHBondContact O-CG 3.21Å; V692-L696 PolarHBondContact O-N 3.23Å; T693-L696 PolarHBondContact O-N 2.74Å; L696-E699 PolarHBondContact O-N 3.32Å; L696-Y700 WeakPolarHBondContact O-CB 3.09Å; L696-Y700 PolarHBondContact O-N 3.15Å
697	I	89.7	Confident	85.4	Confident	32 Å²	32	80.3 Å²	80.3	16%	0.164	41%	0.41	C	S	.	.	H	α-helix	trans	-64.6	-42.6	175.2	-67.8	167.6	0	0	0	110.8	L564 I565 T693 E694 K695 Y700 R701	L564-I697 HydrophobicContact CD2-CD1 4.35Å; I565-I697 HydrophobicContact CG2-CG1 4.04Å; T693-I697 HydrophobicContact CG2-CD1 3.82Å; T693-I697 VanDerWaalsContact O-CG1 3.31Å; T693-I697 WeakPolarHBondContact O-CG1 3.47Å; T693-I697 PolarHBondContact O-N 2.95Å; E694-I697 PolarHBondContact O-N 3.02Å; K695-I697 VanDerWaalsContact C-N 3.32Å; K695-I697 PolarHBondContact O-N 2.79Å; I697-Y700 PolarHBondContact O-N 3.27Å; I697-R701 WeakPolarHBondContact O-CB 3.39Å; I697-R701 VanDerWaalsContact O-CG 3.3Å; I697-R701 WeakPolarHBondContact O-CG 3.37Å; I697-R701 PolarHBondContact O-N 2.86Å
698	Q	89.6	Confident	84.3	Confident	124 Å²	124	80.6 Å²	80.6	58%	0.579	41%	0.407	S	S	*	.	H	α-helix	trans	-63.3	-44.6	176.3	-72.7	174.4	9.9	0	0	112	E694 K695 Y700 R701 A702	E694-Q698 VanDerWaalsContact O-CG 3.3Å; E694-Q698 WeakPolarHBondContact O-CG 3.38Å; E694-Q698 PolarHBondContact O-N 2.87Å; K695-Q698 PolarHBondContact O-N 2.81Å; Q698-Y700 PolarHBondContact O-N 2.87Å; Q698-R701 PolarHBondContact O-N 2.8Å; Q698-A702 PolarHBondContact O-N 3.05Å
699	E	86.5	Confident	83	Confident	125 Å²	125	86.5 Å²	86.5	58%	0.584	43%	0.434	S	S	*	.	H	α-helix	trans	-60.6	-44.9	176.4	-74.1	177.4	-175.3	0	0	111.6	K695 L696 A702 V703	K695-E699 WeakPolarHBondContact O-CG 3.15Å; K695-E699 PolarHBondContact O-N 2.77Å; L696-E699 PolarHBondContact O-N 3.32Å; E699-A702 PolarHBondContact O-N 2.93Å; E699-V703 WeakPolarHBondContact O-CG2 3.47Å; E699-V703 PolarHBondContact O-N 2.95Å
700	Y	86.1	Confident	81.7	Confident	55 Å²	55	89.1 Å²	89.1	22%	0.216	45%	0.445	C	S	.	.	H	α-helix	trans	-63.6	-43.5	177.2	-179.6	-112	0	0	0	112.3	K561 L564 I565 L696 I697 Q698 A702 V703 Q704	K561-Y700 VanDerWaalsContact CE-OH 3.24Å; K561-Y700 WeakPolarHBondContact CE-OH 3.19Å; L564-Y700 WeakPolarHBondContact O-CD1 3.34Å; I565-Y700 HydrophobicContact CB-CG 4.33Å; I565-Y700 WeakPolarHBondContact O-CD2 3.28Å; I565-Y700 WeakPolarHBondContact O-CE2 3.31Å; L696-Y700 WeakPolarHBondContact O-CB 3.09Å; L696-Y700 PolarHBondContact O-N 3.15Å; I697-Y700 PolarHBondContact O-N 3.27Å; Q698-Y700 PolarHBondContact O-N 2.87Å; Y700-A702 VanDerWaalsContact C-N 3.32Å; Y700-A702 PolarHBondContact O-N 2.97Å; Y700-V703 PolarHBondContact O-N 3.33Å; Y700-Q704 HydrophobicContact CD1-CG 4.28Å; Y700-Q704 HydrophobicContact CD2-CG 4.47Å; Y700-Q704 HydrophobicContact CE1-CG 3.9Å; Y700-Q704 HydrophobicContact CE2-CG 4.1Å; Y700-Q704 WeakPolarHBondContact O-CG 3.42Å; Y700-Q704 PolarHBondContact O-N 2.77Å; Y700-Q704 PolarHBondContact OH-NE2 3.43Å
701	R	87.5	Confident	80.4	Confident	163 Å²	163	88.1 Å²	88.1	62%	0.615	44%	0.437	S	S	*	.	H	α-helix	trans	-60.3	-40.3	175	-74.8	176.8	-178.4	-178	2.1	112.1	I697 Q698 Q704 N705	I697-R701 WeakPolarHBondContact O-CB 3.39Å; I697-R701 VanDerWaalsContact O-CG 3.3Å; I697-R701 WeakPolarHBondContact O-CG 3.37Å; I697-R701 PolarHBondContact O-N 2.86Å; Q698-R701 PolarHBondContact O-N 2.8Å; R701-Q704 PolarHBondContact O-N 3.31Å; R701-N705 WeakPolarHBondContact O-CB 3.43Å; R701-N705 VanDerWaalsContact O-CG 3.25Å; R701-N705 PolarHBondContact O-N 3.48Å
702	A	84.8	Confident	79.1	Confident	66 Å²	66	85.7 Å²	85.7	55%	0.545	43%	0.433	S	S	.	.	H	α-helix	trans	-63.5	-41.7	176.1	0	0	0	0	0	112.2	Q698 E699 Y700 G706	Q698-A702 PolarHBondContact O-N 3.05Å; E699-A702 PolarHBondContact O-N 2.93Å; Y700-A702 VanDerWaalsContact C-N 3.32Å; Y700-A702 PolarHBondContact O-N 2.97Å; A702-G706 PolarHBondContact O-N 2.82Å
703	V	81.8	Confident	77.9	Confident	85 Å²	85	88.4 Å²	88.4	52%	0.515	46%	0.459	S	S	.	.	H	α-helix	trans	-65.5	-42.6	176	174.1	0	0	0	0	111.5	E699 Y700 G706 Q707	E699-V703 WeakPolarHBondContact O-CG2 3.47Å; E699-V703 PolarHBondContact O-N 2.95Å; Y700-V703 PolarHBondContact O-N 3.33Å; V703-G706 PolarHBondContact O-N 2.69Å; V703-Q707 WeakPolarHBondContact O-CG 3.39Å; V703-Q707 PolarHBondContact O-N 2.87Å
704	Q	78.7	Confident	76.5	Confident	49 Å²	49	96.4 Å²	96.4	23%	0.229	49%	0.492	C	S	.	.	H	α-helix	trans	-62.8	-45.2	176.7	-74.3	-63.9	-38.1	0	0	111.7	Y700 R701 G706 Q707 N708	Y700-Q704 HydrophobicContact CD1-CG 4.28Å; Y700-Q704 HydrophobicContact CD2-CG 4.47Å; Y700-Q704 HydrophobicContact CE1-CG 3.9Å; Y700-Q704 HydrophobicContact CE2-CG 4.1Å; Y700-Q704 WeakPolarHBondContact O-CG 3.42Å; Y700-Q704 PolarHBondContact O-N 2.77Å; Y700-Q704 PolarHBondContact OH-NE2 3.43Å; R701-Q704 PolarHBondContact O-N 3.31Å; Q704-G706 PolarHBondContact O-N 3.39Å; Q704-Q707 PolarHBondContact O-N 2.9Å; Q704-N708 WeakPolarHBondContact O-CB 3.43Å; Q704-N708 VanDerWaalsContact O-CG 3.3Å; Q704-N708 PolarHBondContact O-N 2.77Å; Q704-N708 PolarHBondContact O-ND2 3.08Å
705	N	77	Confident	74.5	Confident	95 Å²	95	101.4 Å²	101.4	51%	0.508	51%	0.512	S	S	.	.	H	α-helix	trans	-61.4	-44.2	177.2	-71.6	-10.9	0	0	0	111.6	R701 Q707 N708 E709	R701-N705 WeakPolarHBondContact O-CB 3.43Å; R701-N705 VanDerWaalsContact O-CG 3.25Å; R701-N705 PolarHBondContact O-N 3.48Å; N705-Q707 VanDerWaalsContact C-N 3.3Å; N705-Q707 PolarHBondContact O-N 2.93Å; N705-N708 PolarHBondContact O-N 3.34Å; N705-E709 WeakPolarHBondContact O-CG 3.44Å; N705-E709 PolarHBondContact O-N 3.15Å
706	G	72	Confident	73.8	Confident	27 Å²	27	100 Å²	100	28%	0.278	51%	0.509	S	S	.	.	H	α-helix	trans	-67	-26.4	176.8	0	0	0	0	0	114.2	A702 V703 Q704 K710	A702-G706 PolarHBondContact O-N 2.82Å; V703-G706 PolarHBondContact O-N 2.69Å; Q704-G706 PolarHBondContact O-N 3.39Å; G706-K710 VanDerWaalsContact O-CG 3.31Å; G706-K710 WeakPolarHBondContact O-CG 3.45Å; G706-K710 PolarHBondContact O-N 2.98Å
707	Q	68.2	Low	73	Confident	97 Å²	97	103.9 Å²	103.9	45%	0.453	53%	0.529	S	S	.	.	H	α-helix	trans	-74.3	-45.1	171.2	-75.5	179.2	-5.9	0	0	111.4	V703 Q704 N705 E709 K710 E711	V703-Q707 WeakPolarHBondContact O-CG 3.39Å; V703-Q707 PolarHBondContact O-N 2.87Å; Q704-Q707 PolarHBondContact O-N 2.9Å; N705-Q707 VanDerWaalsContact C-N 3.3Å; N705-Q707 PolarHBondContact O-N 2.93Å; Q707-E709 VanDerWaalsContact C-N 3.32Å; Q707-E709 PolarHBondContact O-N 2.94Å; Q707-K710 PolarHBondContact O-N 3.44Å; Q707-K710 VanDerWaalsContact O-N 3.14Å; Q707-E711 PolarHBondContact O-N 2.83Å
708	N	68.4	Low	72.1	Confident	86 Å²	86	107.9 Å²	107.9	46%	0.46	55%	0.549	S	S	.	.	H	α-helix	trans	-61.5	-39.9	177.4	-71	-19.1	0	0	0	111.9	Q704 N705 E711 A712	Q704-N708 WeakPolarHBondContact O-CB 3.43Å; Q704-N708 VanDerWaalsContact O-CG 3.3Å; Q704-N708 PolarHBondContact O-N 2.77Å; Q704-N708 PolarHBondContact O-ND2 3.08Å; N705-N708 PolarHBondContact O-N 3.34Å; N708-E711 PolarHBondContact O-N 3.11Å; N708-A712 WeakPolarHBondContact O-CB 3.48Å; N708-A712 PolarHBondContact O-N 2.86Å
709	E	64.5	Low	71.1	Confident	139 Å²	139	106.9 Å²	106.9	65%	0.65	55%	0.547	S	S	*	.	H	α-helix	trans	-63.7	-40.6	173.7	-74.7	174.6	-177.5	0	0	112.2	N705 Q707 A712 A713	N705-E709 WeakPolarHBondContact O-CG 3.44Å; N705-E709 PolarHBondContact O-N 3.15Å; Q707-E709 VanDerWaalsContact C-N 3.32Å; Q707-E709 PolarHBondContact O-N 2.94Å; E709-A712 PolarHBondContact O-N 3.24Å; E709-A713 VanDerWaalsContact O-CB 3.27Å; E709-A713 WeakPolarHBondContact O-CB 3.27Å; E709-A713 PolarHBondContact O-N 2.8Å
710	K	61.2	Low	70.1	Confident	152 Å²	152	105.8 Å²	105.8	66%	0.661	55%	0.545	S	S	*	.	H	α-helix	trans	-68.8	-34.4	176	-77	176.4	-177.8	177	0	113	G706 Q707 K714	G706-K710 VanDerWaalsContact O-CG 3.31Å; G706-K710 WeakPolarHBondContact O-CG 3.45Å; G706-K710 PolarHBondContact O-N 2.98Å; Q707-K710 PolarHBondContact O-N 3.44Å; Q707-K710 VanDerWaalsContact O-N 3.14Å; K710-K714 WeakPolarHBondContact O-CG 3.42Å; K710-K714 PolarHBondContact O-N 3.25Å
711	E	60	Low	69.1	Low	115 Å²	115	109.2 Å²	109.2	54%	0.537	57%	0.567	S	S	.	*	H	α-helix	trans	-73.7	-39.6	174.3	-73.7	-169	174.7	0	0	111.7	Q707 N708 A713 K714 K715	Q707-E711 PolarHBondContact O-N 2.83Å; N708-E711 PolarHBondContact O-N 3.11Å; E711-A713 VanDerWaalsContact C-N 3.3Å; E711-A713 PolarHBondContact O-N 3.5Å; E711-K714 PolarHBondContact O-N 3.32Å; E711-K714 VanDerWaalsContact O-N 3.15Å; E711-K715 PolarHBondContact O-N 2.67Å; E711-K715 VanDerWaalsContact O-N 3.09Å
712	A	62.6	Low	67.8	Low	66 Å²	66	105.4 Å²	105.4	55%	0.545	56%	0.563	S	S	.	*	H	α-helix	trans	-64.4	-34.1	173	0	0	0	0	0	112	N708 E709 K714	N708-A712 WeakPolarHBondContact O-CB 3.48Å; N708-A712 PolarHBondContact O-N 2.86Å; E709-A712 PolarHBondContact O-N 3.24Å; A712-K714 VanDerWaalsContact C-N 3.31Å
713	A	62.5	Low	66.4	Low	87 Å²	87	108.4 Å²	108.4	72%	0.719	57%	0.565	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.7	-13.7	174	0	0	0	0	0	114.1	E709 E711	E709-A713 VanDerWaalsContact O-CB 3.27Å; E709-A713 WeakPolarHBondContact O-CB 3.27Å; E709-A713 PolarHBondContact O-N 2.8Å; E711-A713 VanDerWaalsContact C-N 3.3Å; E711-A713 PolarHBondContact O-N 3.5Å
714	K	57.7	Low	65.2	Low	187 Å²	187	110.3 Å²	110.3	81%	0.813	57%	0.569	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.2	-20.1	176.7	-84.2	-178.6	176.8	-177.4	0	113.6	K710 E711 A712	K710-K714 WeakPolarHBondContact O-CG 3.42Å; K710-K714 PolarHBondContact O-N 3.25Å; E711-K714 PolarHBondContact O-N 3.32Å; E711-K714 VanDerWaalsContact O-N 3.15Å; A712-K714 VanDerWaalsContact C-N 3.31Å
715	K	49.3	Very low	63.9	Low	224 Å²	224	115.9 Å²	115.9	97%	0.974	60%	0.6	S	S	*	*			trans	-86.2	0	170.6	-71.3	178.7	-179	173.4	0	109.2	E711	E711-K715 PolarHBondContact O-N 2.67Å; E711-K715 VanDerWaalsContact O-N 3.09Å

Retrieved 715 of 715 residues in 514.6 ms (Link to these results)

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