A0A077ZKN4_TRITR Loading...

Translation initiation factor IF-2, chloroplastic

One of the essential components for the initiation of protein synthesis. Protects formylmethionyl-tRNA from spontaneous hydrolysis and promotes its binding to the 30S ribosomal subunits. Also involved in the hydrolysis of GTP during the formation of the 70S ribosomal complex.

AlphaFold DB , UniProt , Accession A0A077ZKN4, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 890 aa.

						>A0A077ZKN4_TRITR|A0A077ZKN4
MTDVTIKTLAAERQTSVERLVQQFADAGIRKSADDSVSAQEKQTLIDHLNQKNSGPDKLTLQRKTRSTLNIPGTGGKSKSVQIEVRKKRTFVKRDPQEAERLAAEEQAQREAEEQARREAEESAKREAQQKAEREAAEQAKREAAEQAKREAAEKDKVSNQQDDMTKNAQAEKARREQEAAELKRKAEEEARRKLEEEARRVAEEARRMAEENKWTDNAEPTEDSSDYHVTTSQHARQAEDESDREVEGGRGRGRNAKAARPKKGNKHAESKADREEARAAVRGGKGGKRKGSSLQQGFQKPAQAVNRDVVIGETITVGELANKMAVKGSQVIKAMMKLGAMATINQVIDQETAQLVAEEMGHKVILRRENELEEAVMSDRDTGAAAEPRAPVVTIMGHVDHGKTSLLDYIRSTKVASGEAGGITQHIGAYHVETENGMITFLDTPGHAAFTSMRARGAQATDIVVLVVAADDGVMPQTIEAIQHAKAAQVPVVVAVNKIDKPEADPDRVKNELSQYGILPEEWGGESQFVHVSAKAGTGIDELLDAILLQAEVLELKAVRKGMASGAVIESFLDKGRGPVATVLVREGTLHKGDIVLCGFEYGRVRAMRNELGQEVLEAGPSIPVEILGLSGVPAAGDEVTVVRDEKKAREVALYRQGKFREVKLARQQKSKLENMFANMTEGEVHEVNIVLKADVQGSVEAISDSLLKLSTDEVKVKIIGSGVGGITETDATLAAASNAILVGFNVRADASARKVIEAESLDLRYYSVIYNLIDEVKAAMSGMLSPELKQQIIGLAEVRDVFKSPKFGAIAGCMVTEGVVKRHNPIRVLRDNVVIYEGELESLRRFKDDVNEVRNGMECGIGVKNYNDVRTGDVIEVFEIIEIQRTIA
					

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	49.7	Very low	79.2	Confident	239 Å²	239	76.4 Å²	76.4	100%	1.177	43%	0.431	S	S	*	.				0	116.2	0	-70.6	-150	-108	0	0	106.8
2	T	64.1	Low	79.6	Confident	129 Å²	129	81 Å²	81	79%	0.791	45%	0.447	S	S	*	.	P	Polyproline II helix	trans	-78.6	136.3	-169.4	42	0	0	0	0	111.3	V4	T2-V4 WeakPolarHBondContact O-CG2 3.43Å; T2-V4 PolarHBondContact O-N 3.24Å
3	D	73.1	Confident	79.7	Confident	111 Å²	111	86.6 Å²	86.6	59%	0.594	46%	0.457	S	S	*	.	P	Polyproline II helix	trans	-57.7	127.9	170.8	-62	-40.1	0	0	0	109.8
4	V	83.3	Confident	79.9	Confident	45 Å²	45	93.7 Å²	93.7	27%	0.273	49%	0.486	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	129	-174.5	-178.4	0	0	0	0	108.4	T2 T8 L9 V37	T2-V4 WeakPolarHBondContact O-CG2 3.43Å; T2-V4 PolarHBondContact O-N 3.24Å; V4-T8 WeakPolarHBondContact CG1-OG1 3.47Å; V4-L9 HydrophobicContact CG1-CB 4.25Å; V4-L9 HydrophobicContact CG1-CD1 4.32Å; V4-V37 PolarHBondContact O-N 3Å
5	T	86.7	Confident	80.1	Confident	57 Å²	57	90.5 Å²	90.5	35%	0.35	47%	0.472	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.1	149.4	177.3	54.9	0	0	0	0	111.3	K7 T8 L9	T5-K7 PolarHBondContact O-N 3.11Å; T5-K7 VanDerWaalsContact O-N 3.14Å; T5-T8 PolarHBondContact N-OG1 3.12Å; T5-T8 VanDerWaalsContact N-OG1 3.11Å; T5-T8 PolarHBondContact O-N 3.16Å; T5-T8 PolarHBondContact O-OG1 3.2Å; T5-T8 PolarHBondContact OG1-OG1 3.23Å; T5-L9 PolarHBondContact O-N 3.16Å
6	I	86	Confident	80.6	Confident	0 Å²	0	89.1 Å²	89.1	0%	0	47%	0.473	C	S	.	.	H	α-helix	trans	-55.9	-35.2	178.3	-71.3	178.7	0	0	0	111.7	L9 A10 V17 L20 V21 F24 K31 S32 D35 V37	I6-L9 PolarHBondContact O-N 3.25Å; I6-A10 WeakPolarHBondContact O-CB 3.45Å; I6-A10 PolarHBondContact O-N 2.91Å; I6-V17 HydrophobicContact CG2-CG1 4.14Å; I6-L20 HydrophobicContact CG2-CD2 3.74Å; I6-L20 HydrophobicContact CG2-CG 4.31Å; I6-V21 HydrophobicContact CD1-CG2 4.47Å; I6-V21 HydrophobicContact CG2-CG2 4.03Å; I6-F24 HydrophobicContact CD1-CD2 4.29Å; I6-F24 HydrophobicContact CD1-CE2 4.48Å; I6-F24 HydrophobicContact CG1-CE2 4.4Å; I6-K31 HydrophobicContact CD1-CB 3.43Å; I6-K31 VanDerWaalsContact CD1-CB 3.43Å; I6-K31 HydrophobicContact CD1-CD 4.21Å; I6-K31 HydrophobicContact CD1-CG 4.2Å; I6-S32 WeakPolarHBondContact CD1-O 3.3Å; I6-D35 WeakPolarHBondContact CG1-O 3.31Å; I6-D35 PolarHBondContact N-O 2.9Å; I6-D35 VanDerWaalsContact N-O 3.08Å; I6-V37 HydrophobicContact CD1-CG2 4.13Å; I6-V37 HydrophobicContact CG1-CG2 3.36Å
7	K	86.4	Confident	80.9	Confident	106 Å²	106	86.5 Å²	86.5	46%	0.461	46%	0.461	S	S	.	.	H	α-helix	trans	-62.4	-41.7	174.7	-68.3	-178.5	-172.3	167.8	0	113.2	T5 A11 V17 D34	T5-K7 PolarHBondContact O-N 3.11Å; T5-K7 VanDerWaalsContact O-N 3.14Å; K7-A11 PolarHBondContact O-N 2.88Å; K7-A11 VanDerWaalsContact O-N 3.1Å; K7-V17 HydrophobicContact CG-CG1 4.4Å; K7-V17 HydrophobicContact CG-CG2 4.21Å; K7-D34 WeakPolarHBondContact CE-OD1 3.26Å; K7-D34 IonicContact NZ-OD1 3.18Å; K7-D34 PolarHBondContact NZ-OD1 3.28Å
8	T	86.2	Confident	81.3	Confident	72 Å²	72	90.8 Å²	90.8	44%	0.442	48%	0.478	S	S	.	.	H	α-helix	trans	-72.4	-38.3	178.2	43.3	0	0	0	0	111.2	V4 T5 A11 E12	V4-T8 WeakPolarHBondContact CG1-OG1 3.47Å; T5-T8 PolarHBondContact N-OG1 3.12Å; T5-T8 VanDerWaalsContact N-OG1 3.11Å; T5-T8 PolarHBondContact O-N 3.16Å; T5-T8 PolarHBondContact O-OG1 3.2Å; T5-T8 PolarHBondContact OG1-OG1 3.23Å; T8-A11 PolarHBondContact O-N 3.17Å; T8-E12 WeakPolarHBondContact O-CB 3.2Å; T8-E12 PolarHBondContact O-N 3.37Å
9	L	84.9	Confident	81.6	Confident	5 Å²	5	94.1 Å²	94.1	3%	0.026	48%	0.483	C	S	.	.	H	α-helix	trans	-64.8	-39.7	174.2	-159.4	106.5	0	0	0	112.4	V4 T5 I6 E12 R13 L20 F24 K42	V4-L9 HydrophobicContact CG1-CB 4.25Å; V4-L9 HydrophobicContact CG1-CD1 4.32Å; T5-L9 PolarHBondContact O-N 3.16Å; I6-L9 PolarHBondContact O-N 3.25Å; L9-E12 PolarHBondContact O-N 3.07Å; L9-R13 WeakPolarHBondContact O-CB 3.29Å; L9-R13 PolarHBondContact O-N 2.89Å; L9-L20 HydrophobicContact CB-CD2 4.04Å; L9-L20 HydrophobicContact CD2-CD1 3.96Å; L9-L20 HydrophobicContact CD2-CD2 3.55Å; L9-L20 HydrophobicContact CD2-CG 4.28Å; L9-L20 HydrophobicContact CG-CD2 4.33Å; L9-F24 HydrophobicContact CD2-CE2 4.26Å; L9-F24 HydrophobicContact CD2-CZ 4.35Å; L9-K42 HydrophobicContact CD1-CD 4.11Å
10	A	86	Confident	81.9	Confident	2 Å²	2	89.6 Å²	89.6	2%	0.017	46%	0.46	C	S	.	.	H	α-helix	trans	-63.6	-41.9	176.3	0	0	0	0	0	111.6	I6 R13 Q14 T15 V17 L20	I6-A10 WeakPolarHBondContact O-CB 3.45Å; I6-A10 PolarHBondContact O-N 2.91Å; A10-R13 PolarHBondContact O-N 2.83Å; A10-Q14 PolarHBondContact O-N 3.21Å; A10-T15 CarbonylContact C-O 3.55Å; A10-T15 WeakPolarHBondContact CB-O 3.26Å; A10-T15 PolarHBondContact O-N 2.79Å; A10-V17 HydrophobicContact CB-CG2 3.98Å; A10-L20 HydrophobicContact CB-CD2 3.86Å
11	A	84.9	Confident	82.2	Confident	74 Å²	74	87 Å²	87	61%	0.612	45%	0.448	S	S	*	.	H	α-helix	trans	-65.3	-43.3	174.6	0	0	0	0	0	112.2	K7 T8 R13 Q14	K7-A11 PolarHBondContact O-N 2.88Å; K7-A11 VanDerWaalsContact O-N 3.1Å; T8-A11 PolarHBondContact O-N 3.17Å; A11-R13 VanDerWaalsContact C-N 3.31Å; A11-R13 PolarHBondContact O-N 3.03Å; A11-Q14 PolarHBondContact O-N 3.27Å
12	E	84.2	Confident	84	Confident	132 Å²	132	81.5 Å²	81.5	62%	0.617	42%	0.42	S	S	*	.	H	α-helix	trans	-62	-38.3	177.5	-166.4	-175.1	-171.3	0	0	111.9	T8 L9	T8-E12 WeakPolarHBondContact O-CB 3.2Å; T8-E12 PolarHBondContact O-N 3.37Å; L9-E12 PolarHBondContact O-N 3.07Å
13	R	80.3	Confident	85.2	Confident	154 Å²	154	77.3 Å²	77.3	58%	0.581	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.5	-0.7	179.1	-69.8	-65.2	-173.2	173.4	0.6	114.8	L9 A10 A11 T15	L9-R13 WeakPolarHBondContact O-CB 3.29Å; L9-R13 PolarHBondContact O-N 2.89Å; A10-R13 PolarHBondContact O-N 2.83Å; A11-R13 VanDerWaalsContact C-N 3.31Å; A11-R13 PolarHBondContact O-N 3.03Å; R13-T15 HydrophobicContact CB-CG2 4.4Å; R13-T15 PolarHBondContact O-N 3.44Å
14	Q	83.1	Confident	86	Confident	186 Å²	186	72 Å²	72	87%	0.869	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.7	37.6	-174.5	-57.2	-179.2	-7.2	0	0	113.1	A10 A11	A10-Q14 PolarHBondContact O-N 3.21Å; A11-Q14 PolarHBondContact O-N 3.27Å
15	T	82.5	Confident	86.1	Confident	45 Å²	45	72.1 Å²	72.1	28%	0.276	37%	0.369	S	S	.	.			trans	-115	151.9	177.3	51	0	0	0	0	110.7	A10 R13	A10-T15 CarbonylContact C-O 3.55Å; A10-T15 WeakPolarHBondContact CB-O 3.26Å; A10-T15 PolarHBondContact O-N 2.79Å; R13-T15 HydrophobicContact CB-CG2 4.4Å; R13-T15 PolarHBondContact O-N 3.44Å
16	S	87.3	Confident	86	Confident	68 Å²	68	73.3 Å²	73.3	48%	0.476	37%	0.373	S	S	.	.			trans	-67.9	146.2	174.5	62	0	0	0	0	111.6	E18 R19 L20	S16-E18 VanDerWaalsContact C-N 3.29Å; S16-E18 PolarHBondContact O-N 2.71Å; S16-R19 PolarHBondContact O-N 2.99Å; S16-R19 VanDerWaalsContact O-N 3.15Å; S16-R19 WeakPolarHBondContact OG-CB 3.22Å; S16-R19 PolarHBondContact OG-N 3.16Å; S16-L20 PolarHBondContact O-N 3.24Å
17	V	87.2	Confident	86	Confident	45 Å²	45	74.6 Å²	74.6	27%	0.273	38%	0.383	S	S	.	.	H	α-helix	trans	-57.8	-42.9	-179.5	-178.2	0	0	0	0	111	I6 K7 A10 R19 L20 V21 A33	I6-V17 HydrophobicContact CG2-CG1 4.14Å; K7-V17 HydrophobicContact CG-CG1 4.4Å; K7-V17 HydrophobicContact CG-CG2 4.21Å; A10-V17 HydrophobicContact CB-CG2 3.98Å; V17-R19 PolarHBondContact O-N 3.1Å; V17-L20 PolarHBondContact O-N 3.27Å; V17-V21 HydrophobicContact CG1-CG2 4.48Å; V17-V21 VanDerWaalsContact O-CG2 3.32Å; V17-V21 WeakPolarHBondContact O-CG2 3.27Å; V17-V21 PolarHBondContact O-N 3.02Å; V17-A33 HydrophobicContact CG1-CB 3.79Å
18	E	87.7	Confident	86	Confident	165 Å²	165	72.8 Å²	72.8	77%	0.771	39%	0.394	S	S	*	.	H	α-helix	trans	-61	-42.2	177.4	-65.6	176.9	174.3	0	0	112.5	S16 L20 V21 Q22	S16-E18 VanDerWaalsContact C-N 3.29Å; S16-E18 PolarHBondContact O-N 2.71Å; E18-L20 VanDerWaalsContact C-N 3.35Å; E18-V21 PolarHBondContact O-N 3.46Å; E18-Q22 WeakPolarHBondContact O-CB 3.31Å; E18-Q22 PolarHBondContact O-N 3.13Å
19	R	87.3	Confident	86	Confident	152 Å²	152	71 Å²	71	57%	0.574	38%	0.382	S	S	*	.	H	α-helix	trans	-67.4	-38.9	179	-173.8	175.6	-176	136.2	0.5	111.2	S16 V17 Q22 Q23	S16-R19 PolarHBondContact O-N 2.99Å; S16-R19 VanDerWaalsContact O-N 3.15Å; S16-R19 WeakPolarHBondContact OG-CB 3.22Å; S16-R19 PolarHBondContact OG-N 3.16Å; V17-R19 PolarHBondContact O-N 3.1Å; R19-Q22 PolarHBondContact O-N 3.28Å; R19-Q23 VanDerWaalsContact O-CG 3.26Å; R19-Q23 WeakPolarHBondContact O-CG 3.44Å; R19-Q23 PolarHBondContact O-N 2.91Å
20	L	86.8	Confident	86	Confident	4 Å²	4	82.3 Å²	82.3	2%	0.021	42%	0.424	C	S	.	.	H	α-helix	trans	-68.2	-41.4	177.4	-170.8	69.1	0	0	0	111.4	I6 L9 A10 S16 V17 E18 Q22 Q23 F24 L45	I6-L20 HydrophobicContact CG2-CD2 3.74Å; I6-L20 HydrophobicContact CG2-CG 4.31Å; L9-L20 HydrophobicContact CB-CD2 4.04Å; L9-L20 HydrophobicContact CD2-CD1 3.96Å; L9-L20 HydrophobicContact CD2-CD2 3.55Å; L9-L20 HydrophobicContact CD2-CG 4.28Å; L9-L20 HydrophobicContact CG-CD2 4.33Å; A10-L20 HydrophobicContact CB-CD2 3.86Å; S16-L20 PolarHBondContact O-N 3.24Å; V17-L20 PolarHBondContact O-N 3.27Å; E18-L20 VanDerWaalsContact C-N 3.35Å; L20-Q22 VanDerWaalsContact C-N 3.31Å; L20-Q22 PolarHBondContact O-N 3.13Å; L20-Q23 PolarHBondContact O-N 3.32Å; L20-F24 HydrophobicContact CD1-CE2 4.15Å; L20-F24 HydrophobicContact CD2-CE2 4.26Å; L20-F24 HydrophobicContact CG-CD2 4.09Å; L20-F24 HydrophobicContact CG-CE2 3.88Å; L20-F24 VanDerWaalsContact O-CD2 3.27Å; L20-F24 WeakPolarHBondContact O-CD2 3.5Å; L20-F24 PolarHBondContact O-N 3.19Å; L20-L45 HydrophobicContact CD1-CD2 3.98Å
21	V	88.8	Confident	85.9	Confident	36 Å²	36	84.3 Å²	84.3	22%	0.218	43%	0.433	C	S	.	.	H	α-helix	trans	-59.3	-42.9	172.6	167.5	0	0	0	0	111	I6 V17 E18 F24 A25 K31	I6-V21 HydrophobicContact CD1-CG2 4.47Å; I6-V21 HydrophobicContact CG2-CG2 4.03Å; V17-V21 HydrophobicContact CG1-CG2 4.48Å; V17-V21 VanDerWaalsContact O-CG2 3.32Å; V17-V21 WeakPolarHBondContact O-CG2 3.27Å; V17-V21 PolarHBondContact O-N 3.02Å; E18-V21 PolarHBondContact O-N 3.46Å; V21-F24 PolarHBondContact O-N 3.4Å; V21-A25 WeakPolarHBondContact O-CB 3.17Å; V21-A25 PolarHBondContact O-N 2.81Å; V21-K31 VanDerWaalsContact CG1-O 3.29Å; V21-K31 WeakPolarHBondContact CG1-O 3.44Å
22	Q	87.7	Confident	86	Confident	124 Å²	124	83.5 Å²	83.5	58%	0.579	42%	0.423	S	S	*	.	H	α-helix	trans	-64.5	-38.6	175.4	-168.3	174.3	9.6	0	0	112.1	E18 R19 L20 A25 D26	E18-Q22 WeakPolarHBondContact O-CB 3.31Å; E18-Q22 PolarHBondContact O-N 3.13Å; R19-Q22 PolarHBondContact O-N 3.28Å; L20-Q22 VanDerWaalsContact C-N 3.31Å; L20-Q22 PolarHBondContact O-N 3.13Å; Q22-A25 PolarHBondContact O-N 3.49Å; Q22-D26 WeakPolarHBondContact O-CB 3.41Å; Q22-D26 PolarHBondContact O-N 2.99Å
23	Q	88.4	Confident	86	Confident	41 Å²	41	79.1 Å²	79.1	19%	0.192	41%	0.409	C	S	.	.	H	α-helix	trans	-66.6	-36.5	176.1	-72.6	173	-20.4	0	0	112.8	R19 L20 A27 L45	R19-Q23 VanDerWaalsContact O-CG 3.26Å; R19-Q23 WeakPolarHBondContact O-CG 3.44Å; R19-Q23 PolarHBondContact O-N 2.91Å; L20-Q23 PolarHBondContact O-N 3.32Å; Q23-A27 WeakPolarHBondContact O-CB 3.46Å; Q23-A27 PolarHBondContact O-N 3.43Å; Q23-L45 HydrophobicContact CB-CD1 3.82Å
24	F	89.4	Confident	86.1	Confident	0 Å²	0	77.1 Å²	77.1	0%	0	41%	0.41	C	S	.	.	H	α-helix	trans	-65.9	-42.1	170.8	-83.7	-68.5	0	0	0	111.6	I6 L9 L20 V21 D26 A27 G28 I29 V37 E41 L45	I6-F24 HydrophobicContact CD1-CD2 4.29Å; I6-F24 HydrophobicContact CD1-CE2 4.48Å; I6-F24 HydrophobicContact CG1-CE2 4.4Å; L9-F24 HydrophobicContact CD2-CE2 4.26Å; L9-F24 HydrophobicContact CD2-CZ 4.35Å; L20-F24 HydrophobicContact CD1-CE2 4.15Å; L20-F24 HydrophobicContact CD2-CE2 4.26Å; L20-F24 HydrophobicContact CG-CD2 4.09Å; L20-F24 HydrophobicContact CG-CE2 3.88Å; L20-F24 VanDerWaalsContact O-CD2 3.27Å; L20-F24 WeakPolarHBondContact O-CD2 3.5Å; L20-F24 PolarHBondContact O-N 3.19Å; V21-F24 PolarHBondContact O-N 3.4Å; F24-D26 PolarHBondContact O-N 2.88Å; F24-A27 CarbonylContact O-C 3.54Å; F24-A27 PolarHBondContact O-N 3.23Å; F24-G28 PolarHBondContact O-N 2.96Å; F24-I29 CarbonylContact C-O 3.01Å; F24-I29 WeakPolarHBondContact CB-O 3.41Å; F24-I29 HydrophobicContact CD1-CB 4.43Å; F24-I29 HydrophobicContact CD1-CD1 4.47Å; F24-I29 CarbonylContact O-C 3.56Å; F24-I29 WeakPolarHBondContact O-CA 3.42Å; F24-I29 PolarHBondContact O-N 2.94Å; F24-V37 HydrophobicContact CE1-CG1 3.91Å; F24-V37 HydrophobicContact CE2-CG2 3.92Å; F24-V37 HydrophobicContact CZ-CB 4.32Å; F24-V37 HydrophobicContact CZ-CG1 3.55Å; F24-V37 HydrophobicContact CZ-CG2 3.72Å; F24-E41 HydrophobicContact CE1-CB 4.4Å; F24-L45 HydrophobicContact CD1-CB 4.31Å; F24-L45 HydrophobicContact CD1-CD1 4.4Å; F24-L45 HydrophobicContact CD1-CD2 4.47Å; F24-L45 HydrophobicContact CD2-CD2 4.4Å; F24-L45 HydrophobicContact CE1-CB 3.82Å; F24-L45 HydrophobicContact CE1-CD2 3.9Å; F24-L45 HydrophobicContact CE1-CG 4.28Å; F24-L45 HydrophobicContact CE2-CD2 3.82Å; F24-L45 HydrophobicContact CZ-CB 4.29Å; F24-L45 HydrophobicContact CZ-CD2 3.53Å; F24-L45 HydrophobicContact CZ-CG 4.39Å
25	A	87	Confident	86.3	Confident	47 Å²	47	71.6 Å²	71.6	39%	0.388	39%	0.386	S	S	.	.	H	α-helix	trans	-62.4	-41.9	176.2	0	0	0	0	0	112.3	V21 Q22 A27 G28 I29	V21-A25 WeakPolarHBondContact O-CB 3.17Å; V21-A25 PolarHBondContact O-N 2.81Å; Q22-A25 PolarHBondContact O-N 3.49Å; A25-A27 VanDerWaalsContact C-N 3.31Å; A25-A27 PolarHBondContact O-N 2.87Å; A25-G28 PolarHBondContact O-N 3.38Å; A25-I29 PolarHBondContact N-O 3.28Å
26	D	84.9	Confident	86.5	Confident	82 Å²	82	72 Å²	72	44%	0.439	39%	0.39	S	S	.	.	H	α-helix	trans	-62	-37.4	173.9	-80.2	8.3	0	0	0	111.8	Q22 F24 G28 K52	Q22-D26 WeakPolarHBondContact O-CB 3.41Å; Q22-D26 PolarHBondContact O-N 2.99Å; F24-D26 PolarHBondContact O-N 2.88Å; D26-G28 PolarHBondContact O-N 2.81Å; D26-K52 IonicContact OD2-NZ 3.31Å; D26-K52 PolarHBondContact OD2-NZ 3.08Å
27	A	85.4	Confident	86.4	Confident	27 Å²	27	69 Å²	69	22%	0.223	37%	0.37	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.5	3.5	174.9	0	0	0	0	0	113.5	Q23 F24 A25 H48	Q23-A27 WeakPolarHBondContact O-CB 3.46Å; Q23-A27 PolarHBondContact O-N 3.43Å; F24-A27 CarbonylContact O-C 3.54Å; F24-A27 PolarHBondContact O-N 3.23Å; A25-A27 VanDerWaalsContact C-N 3.31Å; A25-A27 PolarHBondContact O-N 2.87Å; A27-H48 HydrophobicContact CB-CB 3.92Å
28	G	85.4	Confident	86.3	Confident	67 Å²	67	68.6 Å²	68.6	69%	0.691	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	87.9	6.1	178.2	0	0	0	0	0	115.4	F24 A25 D26	F24-G28 PolarHBondContact O-N 2.96Å; A25-G28 PolarHBondContact O-N 3.38Å; D26-G28 PolarHBondContact O-N 2.81Å
29	I	86.4	Confident	86.1	Confident	36 Å²	36	64.3 Å²	64.3	19%	0.185	36%	0.362	C	S	.	.			trans	-111.5	105	-178.6	-56.9	165.2	0	0	0	109.1	F24 A25 K31 E41 T44	F24-I29 CarbonylContact C-O 3.01Å; F24-I29 WeakPolarHBondContact CB-O 3.41Å; F24-I29 HydrophobicContact CD1-CB 4.43Å; F24-I29 HydrophobicContact CD1-CD1 4.47Å; F24-I29 CarbonylContact O-C 3.56Å; F24-I29 WeakPolarHBondContact O-CA 3.42Å; F24-I29 PolarHBondContact O-N 2.94Å; A25-I29 PolarHBondContact N-O 3.28Å; I29-K31 HydrophobicContact CG2-CG 3.81Å; I29-K31 PolarHBondContact O-N 3.47Å; I29-E41 HydrophobicContact CD1-CB 4.06Å; I29-E41 HydrophobicContact CD1-CG 4Å; I29-T44 VanDerWaalsContact CD1-OG1 3.29Å; I29-T44 WeakPolarHBondContact CD1-OG1 3.24Å
30	R	85.7	Confident	85.9	Confident	242 Å²	242	64.4 Å²	64.4	91%	0.913	37%	0.369	S	S	*	.			trans	-79.6	111.4	175.3	-70.9	-176.8	177.7	176	-0.4	110.3
31	K	84.3	Confident	85.8	Confident	43 Å²	43	66.2 Å²	66.2	19%	0.187	38%	0.377	C	S	.	.			trans	-125.6	150.7	173.2	-65.7	-121.6	162.5	168.8	0	111.1	I6 V21 I29 D35 S36 E41	I6-K31 HydrophobicContact CD1-CB 3.43Å; I6-K31 VanDerWaalsContact CD1-CB 3.43Å; I6-K31 HydrophobicContact CD1-CD 4.21Å; I6-K31 HydrophobicContact CD1-CG 4.2Å; V21-K31 VanDerWaalsContact CG1-O 3.29Å; V21-K31 WeakPolarHBondContact CG1-O 3.44Å; I29-K31 HydrophobicContact CG2-CG 3.81Å; I29-K31 PolarHBondContact O-N 3.47Å; K31-D35 HydrophobicContact CB-CB 4.27Å; K31-D35 HydrophobicContact CD-CB 3.73Å; K31-S36 PolarHBondContact NZ-O 3.48Å; K31-E41 WeakPolarHBondContact CE-OE1 3.16Å; K31-E41 WeakPolarHBondContact CE-OE2 3.38Å; K31-E41 IonicContact NZ-OE1 2.68Å; K31-E41 PolarHBondContact NZ-OE1 3.45Å; K31-E41 IonicContact NZ-OE2 2.78Å; K31-E41 PolarHBondContact NZ-OE2 2.98Å
32	S	86.4	Confident	85.6	Confident	58 Å²	58	67.6 Å²	67.6	41%	0.406	38%	0.38	S	S	.	.			trans	-92.8	167.4	171.1	74.8	0	0	0	0	111.1	I6 D34 D35	I6-S32 WeakPolarHBondContact CD1-O 3.3Å; S32-D34 PolarHBondContact O-N 3.07Å; S32-D34 VanDerWaalsContact O-N 3.07Å; S32-D35 WeakPolarHBondContact CB-OD2 3.34Å; S32-D35 PolarHBondContact N-OD2 3.17Å; S32-D35 PolarHBondContact O-N 3.07Å; S32-D35 VanDerWaalsContact OG-CG 3.24Å; S32-D35 PolarHBondContact OG-OD2 3.48Å
33	A	83.2	Confident	85.3	Confident	39 Å²	39	67.5 Å²	67.5	32%	0.322	38%	0.379	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.3	-20.6	-175.9	0	0	0	0	0	114.9	V17	V17-A33 HydrophobicContact CG1-CB 3.79Å
34	D	83	Confident	85.2	Confident	113 Å²	113	68.5 Å²	68.5	60%	0.604	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.8	-3.4	-176.5	-64.8	-42.8	0	0	0	113.5	K7 S32	K7-D34 WeakPolarHBondContact CE-OD1 3.26Å; K7-D34 IonicContact NZ-OD1 3.18Å; K7-D34 PolarHBondContact NZ-OD1 3.28Å; S32-D34 PolarHBondContact O-N 3.07Å; S32-D34 VanDerWaalsContact O-N 3.07Å
35	D	87.6	Confident	85	Confident	69 Å²	69	69 Å²	69	37%	0.369	39%	0.391	S	S	.	.	P	Polyproline II helix	trans	-74.9	151.6	-179.7	-66.9	-40.1	0	0	0	112.3	I6 K31 S32	I6-D35 WeakPolarHBondContact CG1-O 3.31Å; I6-D35 PolarHBondContact N-O 2.9Å; I6-D35 VanDerWaalsContact N-O 3.08Å; K31-D35 HydrophobicContact CB-CB 4.27Å; K31-D35 HydrophobicContact CD-CB 3.73Å; S32-D35 WeakPolarHBondContact CB-OD2 3.34Å; S32-D35 PolarHBondContact N-OD2 3.17Å; S32-D35 PolarHBondContact O-N 3.07Å; S32-D35 VanDerWaalsContact OG-CG 3.24Å; S32-D35 PolarHBondContact OG-OD2 3.48Å
36	S	86.6	Confident	84.8	Confident	53 Å²	53	69.5 Å²	69.5	37%	0.371	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	145.2	173	62.9	0	0	0	0	111.6	K31	K31-S36 PolarHBondContact NZ-O 3.48Å
37	V	85.3	Confident	84.8	Confident	6 Å²	6	70.2 Å²	70.2	4%	0.036	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	125.3	179.4	-176.8	0	0	0	0	109.3	V4 I6 F24 E41 K42	V4-V37 PolarHBondContact O-N 3Å; I6-V37 HydrophobicContact CD1-CG2 4.13Å; I6-V37 HydrophobicContact CG1-CG2 3.36Å; F24-V37 HydrophobicContact CE1-CG1 3.91Å; F24-V37 HydrophobicContact CE2-CG2 3.92Å; F24-V37 HydrophobicContact CZ-CB 4.32Å; F24-V37 HydrophobicContact CZ-CG1 3.55Å; F24-V37 HydrophobicContact CZ-CG2 3.72Å; V37-E41 WeakPolarHBondContact CA-OE2 3.23Å; V37-E41 HydrophobicContact CG1-CB 3.85Å; V37-K42 HydrophobicContact CG1-CB 4.34Å
38	S	86	Confident	84.5	Confident	37 Å²	37	70.9 Å²	70.9	26%	0.259	39%	0.389	S	S	.	.	P	Polyproline II helix	trans	-78.4	160.7	174.9	83.1	0	0	0	0	111.5	Q40 E41 K42	S38-Q40 PolarHBondContact O-N 3.19Å; S38-E41 PolarHBondContact N-OE2 2.9Å; S38-E41 PolarHBondContact O-N 3.2Å; S38-E41 WeakPolarHBondContact OG-CG 3.34Å; S38-E41 PolarHBondContact OG-N 3.34Å; S38-K42 PolarHBondContact O-N 3.34Å
39	A	81.6	Confident	84.3	Confident	75 Å²	75	70.3 Å²	70.3	62%	0.62	37%	0.37	S	S	*	.	H	α-helix	trans	-59.8	-33.6	177.8	0	0	0	0	0	113.2	K42 Q43	A39-K42 PolarHBondContact O-N 3.47Å; A39-Q43 PolarHBondContact O-N 2.94Å; A39-Q43 VanDerWaalsContact O-N 3.13Å
40	Q	83.2	Confident	83.7	Confident	154 Å²	154	73.4 Å²	73.4	72%	0.72	39%	0.387	S	S	*	.	H	α-helix	trans	-69	-41.2	176.9	-68.7	-179.6	-11.6	0	0	111.5	S38 K42 Q43 T44	S38-Q40 PolarHBondContact O-N 3.19Å; Q40-K42 VanDerWaalsContact C-N 3.29Å; Q40-K42 PolarHBondContact O-N 3.42Å; Q40-Q43 WeakPolarHBondContact O-CB 3.22Å; Q40-Q43 PolarHBondContact O-N 3.14Å; Q40-T44 PolarHBondContact O-N 2.94Å; Q40-T44 PolarHBondContact O-OG1 2.86Å
41	E	85.6	Confident	82.9	Confident	42 Å²	42	69.3 Å²	69.3	20%	0.196	38%	0.378	C	S	.	.	H	α-helix	trans	-67.1	-32.6	175.9	-65.5	170.9	164.2	0	0	112	F24 I29 K31 V37 S38 Q43 T44 L45	F24-E41 HydrophobicContact CE1-CB 4.4Å; I29-E41 HydrophobicContact CD1-CB 4.06Å; I29-E41 HydrophobicContact CD1-CG 4Å; K31-E41 WeakPolarHBondContact CE-OE1 3.16Å; K31-E41 WeakPolarHBondContact CE-OE2 3.38Å; K31-E41 IonicContact NZ-OE1 2.68Å; K31-E41 PolarHBondContact NZ-OE1 3.45Å; K31-E41 IonicContact NZ-OE2 2.78Å; K31-E41 PolarHBondContact NZ-OE2 2.98Å; V37-E41 WeakPolarHBondContact CA-OE2 3.23Å; V37-E41 HydrophobicContact CG1-CB 3.85Å; S38-E41 PolarHBondContact N-OE2 2.9Å; S38-E41 PolarHBondContact O-N 3.2Å; S38-E41 WeakPolarHBondContact OG-CG 3.34Å; S38-E41 PolarHBondContact OG-N 3.34Å; E41-Q43 VanDerWaalsContact C-N 3.34Å; E41-T44 WeakPolarHBondContact CA-OG1 3.37Å; E41-T44 PolarHBondContact O-OG1 3.22Å; E41-L45 WeakPolarHBondContact O-CB 3.24Å; E41-L45 PolarHBondContact O-N 3.43Å
42	K	83.6	Confident	81.6	Confident	64 Å²	64	73.4 Å²	73.4	28%	0.278	40%	0.396	S	S	.	.	H	α-helix	trans	-65	-39.5	173	-169.2	173.9	-177.9	170.3	0	111.1	L9 V37 S38 A39 Q40 I46	L9-K42 HydrophobicContact CD1-CD 4.11Å; V37-K42 HydrophobicContact CG1-CB 4.34Å; S38-K42 PolarHBondContact O-N 3.34Å; A39-K42 PolarHBondContact O-N 3.47Å; Q40-K42 VanDerWaalsContact C-N 3.29Å; Q40-K42 PolarHBondContact O-N 3.42Å; K42-I46 HydrophobicContact CG-CD1 4.2Å; K42-I46 WeakPolarHBondContact O-CD1 3.44Å; K42-I46 WeakPolarHBondContact O-CG1 3.35Å; K42-I46 PolarHBondContact O-N 3.2Å; K42-I46 VanDerWaalsContact O-N 3.11Å
43	Q	82.9	Confident	79.8	Confident	122 Å²	122	75.6 Å²	75.6	57%	0.57	40%	0.403	S	S	*	.	H	α-helix	trans	-66.3	-46.8	174.9	-87.5	175	-25.5	0	0	112	A39 Q40 E41 L45 I46 D47	A39-Q43 PolarHBondContact O-N 2.94Å; A39-Q43 VanDerWaalsContact O-N 3.13Å; Q40-Q43 WeakPolarHBondContact O-CB 3.22Å; Q40-Q43 PolarHBondContact O-N 3.14Å; E41-Q43 VanDerWaalsContact C-N 3.34Å; Q43-L45 VanDerWaalsContact C-N 3.3Å; Q43-L45 PolarHBondContact O-N 2.76Å; Q43-I46 WeakPolarHBondContact O-CB 3.24Å; Q43-I46 PolarHBondContact O-N 3.24Å; Q43-D47 VanDerWaalsContact O-CG 3.27Å; Q43-D47 PolarHBondContact O-N 2.93Å
44	T	85.3	Confident	77.8	Confident	63 Å²	63	78.8 Å²	78.8	39%	0.387	42%	0.423	S	S	.	.	H	α-helix	trans	-62.8	-35.8	178.4	51.1	0	0	0	0	112.8	I29 Q40 E41 H48	I29-T44 VanDerWaalsContact CD1-OG1 3.29Å; I29-T44 WeakPolarHBondContact CD1-OG1 3.24Å; Q40-T44 PolarHBondContact O-N 2.94Å; Q40-T44 PolarHBondContact O-OG1 2.86Å; E41-T44 WeakPolarHBondContact CA-OG1 3.37Å; E41-T44 PolarHBondContact O-OG1 3.22Å; T44-H48 WeakPolarHBondContact O-CB 3.39Å; T44-H48 PolarHBondContact O-N 3.21Å
45	L	84.8	Confident	75.8	Confident	9 Å²	9	75.5 Å²	75.5	5%	0.047	42%	0.416	C	S	.	.	H	α-helix	trans	-63.1	-43.1	171.4	179	68.9	0	0	0	111.9	L20 Q23 F24 E41 Q43 H48 L49	L20-L45 HydrophobicContact CD1-CD2 3.98Å; Q23-L45 HydrophobicContact CB-CD1 3.82Å; F24-L45 HydrophobicContact CD1-CB 4.31Å; F24-L45 HydrophobicContact CD1-CD1 4.4Å; F24-L45 HydrophobicContact CD1-CD2 4.47Å; F24-L45 HydrophobicContact CD2-CD2 4.4Å; F24-L45 HydrophobicContact CE1-CB 3.82Å; F24-L45 HydrophobicContact CE1-CD2 3.9Å; F24-L45 HydrophobicContact CE1-CG 4.28Å; F24-L45 HydrophobicContact CE2-CD2 3.82Å; F24-L45 HydrophobicContact CZ-CB 4.29Å; F24-L45 HydrophobicContact CZ-CD2 3.53Å; F24-L45 HydrophobicContact CZ-CG 4.39Å; E41-L45 WeakPolarHBondContact O-CB 3.24Å; E41-L45 PolarHBondContact O-N 3.43Å; Q43-L45 VanDerWaalsContact C-N 3.3Å; Q43-L45 PolarHBondContact O-N 2.76Å; L45-H48 PolarHBondContact O-N 3.12Å; L45-L49 HydrophobicContact CD1-CD1 4.26Å; L45-L49 HydrophobicContact CD1-CG 4.44Å; L45-L49 HydrophobicContact CG-CD1 4.02Å; L45-L49 WeakPolarHBondContact O-CB 3.47Å; L45-L49 VanDerWaalsContact O-CG 3.32Å; L45-L49 WeakPolarHBondContact O-CG 3.22Å; L45-L49 PolarHBondContact O-N 3.36Å
46	I	84	Confident	73.5	Confident	59 Å²	59	76.6 Å²	76.6	30%	0.303	43%	0.427	S	S	.	.	H	α-helix	trans	-64.2	-44.3	178.4	-70.6	163.6	0	0	0	110.4	K42 Q43 H48 L49 N50	K42-I46 HydrophobicContact CG-CD1 4.2Å; K42-I46 WeakPolarHBondContact O-CD1 3.44Å; K42-I46 WeakPolarHBondContact O-CG1 3.35Å; K42-I46 PolarHBondContact O-N 3.2Å; K42-I46 VanDerWaalsContact O-N 3.11Å; Q43-I46 WeakPolarHBondContact O-CB 3.24Å; Q43-I46 PolarHBondContact O-N 3.24Å; I46-H48 PolarHBondContact O-N 3.44Å; I46-L49 PolarHBondContact O-N 3.13Å; I46-N50 WeakPolarHBondContact O-CB 3.25Å; I46-N50 VanDerWaalsContact O-CG 3.29Å; I46-N50 PolarHBondContact O-N 3.41Å
47	D	83.7	Confident	71.3	Confident	97 Å²	97	79.7 Å²	79.7	52%	0.519	44%	0.439	S	S	.	.	H	α-helix	trans	-63.8	-42.4	179.4	-65.3	-22.4	0	0	0	111.1	Q43 N50 Q51	Q43-D47 VanDerWaalsContact O-CG 3.27Å; Q43-D47 PolarHBondContact O-N 2.93Å; D47-N50 PolarHBondContact O-N 2.9Å; D47-Q51 WeakPolarHBondContact O-CB 3.36Å; D47-Q51 PolarHBondContact O-N 3.37Å
48	H	80.5	Confident	69.5	Low	40 Å²	40	86.1 Å²	86.1	19%	0.185	47%	0.467	C	S	.	.	H	α-helix	trans	-65.1	-41	175.4	175.8	-102.1	0	0	0	112.6	A27 T44 L45 I46 Q51 K52	A27-H48 HydrophobicContact CB-CB 3.92Å; T44-H48 WeakPolarHBondContact O-CB 3.39Å; T44-H48 PolarHBondContact O-N 3.21Å; L45-H48 PolarHBondContact O-N 3.12Å; I46-H48 PolarHBondContact O-N 3.44Å; H48-Q51 PolarHBondContact O-N 2.86Å; H48-K52 PolarHBondContact O-N 2.8Å
49	L	79.8	Confident	67.7	Low	55 Å²	55	89.7 Å²	89.7	29%	0.288	48%	0.482	S	S	.	.	H	α-helix	trans	-66.2	-39.6	175.4	-75.7	169.7	0	0	0	112	L45 I46 K52 N53	L45-L49 HydrophobicContact CD1-CD1 4.26Å; L45-L49 HydrophobicContact CD1-CG 4.44Å; L45-L49 HydrophobicContact CG-CD1 4.02Å; L45-L49 WeakPolarHBondContact O-CB 3.47Å; L45-L49 VanDerWaalsContact O-CG 3.32Å; L45-L49 WeakPolarHBondContact O-CG 3.22Å; L45-L49 PolarHBondContact O-N 3.36Å; I46-L49 PolarHBondContact O-N 3.13Å; L49-K52 PolarHBondContact O-N 3.01Å; L49-N53 WeakPolarHBondContact O-CB 3.25Å; L49-N53 PolarHBondContact O-N 2.86Å
50	N	73.7	Confident	66.3	Low	101 Å²	101	89 Å²	89	54%	0.54	47%	0.47	S	S	.	.	H	α-helix	trans	-67.4	-37.2	176	-75.3	-14.5	0	0	0	111.7	I46 D47 N53 S54	I46-N50 WeakPolarHBondContact O-CB 3.25Å; I46-N50 VanDerWaalsContact O-CG 3.29Å; I46-N50 PolarHBondContact O-N 3.41Å; D47-N50 PolarHBondContact O-N 2.9Å; N50-N53 CarbonylContact O-C 3.48Å; N50-N53 PolarHBondContact O-N 2.83Å; N50-S54 PolarHBondContact O-N 2.76Å; N50-S54 VanDerWaalsContact O-N 3.12Å
51	Q	69.8	Low	64.8	Low	156 Å²	156	86.9 Å²	86.9	73%	0.729	46%	0.463	S	S	*	.	H	α-helix	trans	-65.3	-43.7	173.5	-101.4	-178.9	-4.4	0	0	112.6	D47 H48 N53 S54	D47-Q51 WeakPolarHBondContact O-CB 3.36Å; D47-Q51 PolarHBondContact O-N 3.37Å; H48-Q51 PolarHBondContact O-N 2.86Å; Q51-N53 PolarHBondContact O-N 2.94Å; Q51-S54 VanDerWaalsContact O-CB 3.3Å; Q51-S54 WeakPolarHBondContact O-CB 3.04Å; Q51-S54 PolarHBondContact O-N 3.4Å; Q51-S54 VanDerWaalsContact O-N 3.15Å
52	K	57.4	Low	63.4	Low	129 Å²	129	91 Å²	91	56%	0.561	48%	0.483	S	S	*	.	H	α-helix	trans	-63.7	-31.4	174.4	-97.9	-175.6	-178.7	176.9	0	112.3	D26 H48 L49 S54	D26-K52 IonicContact OD2-NZ 3.31Å; D26-K52 PolarHBondContact OD2-NZ 3.08Å; H48-K52 PolarHBondContact O-N 2.8Å; L49-K52 PolarHBondContact O-N 3.01Å; K52-S54 VanDerWaalsContact C-N 3.32Å
53	N	48.3	Very low	62.3	Low	105 Å²	105	97.2 Å²	97.2	56%	0.561	50%	0.504	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.7	10.7	176.4	-72.7	-4.6	0	0	0	113.8	L49 N50 Q51 G55	L49-N53 WeakPolarHBondContact O-CB 3.25Å; L49-N53 PolarHBondContact O-N 2.86Å; N50-N53 CarbonylContact O-C 3.48Å; N50-N53 PolarHBondContact O-N 2.83Å; Q51-N53 PolarHBondContact O-N 2.94Å; N53-G55 PolarHBondContact O-N 2.83Å
54	S	42	Very low	61.6	Low	105 Å²	105	97 Å²	97	73%	0.734	50%	0.501	S	S	*	.			trans	-77.3	21.3	178.5	-153.1	0	0	0	0	113.8	N50 Q51 K52	N50-S54 PolarHBondContact O-N 2.76Å; N50-S54 VanDerWaalsContact O-N 3.12Å; Q51-S54 VanDerWaalsContact O-CB 3.3Å; Q51-S54 WeakPolarHBondContact O-CB 3.04Å; Q51-S54 PolarHBondContact O-N 3.4Å; Q51-S54 VanDerWaalsContact O-N 3.15Å; K52-S54 VanDerWaalsContact C-N 3.32Å
55	G	40	Very low	60.6	Low	45 Å²	45	97.4 Å²	97.4	46%	0.464	50%	0.504	S	S	.	.	S	Bend	trans	-95	140	161.1	0	0	0	0	0	109.4	N53 D57	N53-G55 PolarHBondContact O-N 2.83Å; G55-D57 PolarHBondContact O-N 3.32Å; G55-D57 VanDerWaalsContact O-N 3.13Å
56	P	39.1	Very low	60.1	Low	92 Å²	92	105.8 Å²	105.8	60%	0.597	54%	0.535	S	S	*	.			trans	-56.3	121.2	-171.2	21.8	-33	0	0	0	111.6	K58 V92	P56-K58 PolarHBondContact O-N 3.45Å; P56-V92 HydrophobicContact CB-CG1 4.48Å
57	D	41.1	Very low	59.1	Low	117 Å²	117	106 Å²	106	63%	0.626	54%	0.542	S	S	*	.			trans	-61.2	93.5	177	-89.5	-21.6	0	0	0	110.1	G55 L59	G55-D57 PolarHBondContact O-N 3.32Å; G55-D57 VanDerWaalsContact O-N 3.13Å; D57-L59 PolarHBondContact O-N 2.95Å
58	K	47.9	Very low	58.6	Low	142 Å²	142	105.9 Å²	105.9	62%	0.617	55%	0.545	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.6	94.3	173.2	-73.6	175	-177.2	173.6	0	108.7	P56 T60 V92	P56-K58 PolarHBondContact O-N 3.45Å; K58-T60 PolarHBondContact O-N 3.5Å; K58-V92 HydrophobicContact CG-CG2 4.48Å
59	L	47.8	Very low	58.3	Low	112 Å²	112	108.5 Å²	108.5	59%	0.586	56%	0.56	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-75.3	112.2	169.8	-159.5	88.9	0	0	0	108.7	D57 L61 F91	D57-L59 PolarHBondContact O-N 2.95Å; L59-L61 HydrophobicContact CD2-CD2 4.25Å; L59-L61 HydrophobicContact CD2-CG 4.22Å; L59-F91 PolarHBondContact N-O 3.01Å; L59-F91 PolarHBondContact O-N 3.32Å
60	T	51.2	Low	58	Low	60 Å²	60	111 Å²	111	37%	0.368	57%	0.573	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-104	106	175.3	37.2	0	0	0	0	110.3	K58 Q62 K88 T90	K58-T60 PolarHBondContact O-N 3.5Å; T60-Q62 PolarHBondContact O-N 2.97Å; T60-K88 VanDerWaalsContact CG2-CE 3.46Å; T60-K88 HydrophobicContact CG2-CG 4.34Å; T60-T90 HydrophobicContact CG2-CG2 3.24Å
61	L	52.6	Low	58.3	Low	109 Å²	109	110.3 Å²	110.3	57%	0.571	57%	0.569	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-84.4	116.1	172.8	-66.6	171.5	0	0	0	108.7	L59 R89	L59-L61 HydrophobicContact CD2-CD2 4.25Å; L59-L61 HydrophobicContact CD2-CG 4.22Å; L61-R89 PolarHBondContact N-O 2.88Å; L61-R89 VanDerWaalsContact N-O 3.08Å; L61-R89 PolarHBondContact O-N 3.5Å
62	Q	56	Low	57.9	Low	130 Å²	130	108.4 Å²	108.4	61%	0.607	57%	0.57	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-98.9	108.9	173.5	-63	-174.7	9.5	0	0	108.9	T60	T60-Q62 PolarHBondContact O-N 2.97Å
63	R	60.7	Low	57.5	Low	193 Å²	193	104 Å²	104	73%	0.728	56%	0.561	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-96.3	124	171	-166.1	174.5	179.9	177.6	-0.9	108.8	K87	R63-K87 PolarHBondContact N-O 2.9Å; R63-K87 VanDerWaalsContact N-O 3.13Å; R63-K87 PolarHBondContact O-N 3.46Å; R63-K87 VanDerWaalsContact O-N 3.13Å
64	K	68.4	Low	57.6	Low	117 Å²	117	106.9 Å²	106.9	51%	0.509	58%	0.583	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-102.9	120.3	173	-60.8	-176.9	-179.8	176.1	0	108.3	R86	K64-R86 HydrophobicContact CG-CG 4.33Å
65	T	64.1	Low	58.3	Low	72 Å²	72	105.4 Å²	105.4	44%	0.442	58%	0.584	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-113.1	123.4	169.7	42.3	0	0	0	0	108.6	V85	T65-V85 PolarHBondContact N-O 3.35Å; T65-V85 PolarHBondContact O-N 2.88Å; T65-V85 PolarHBondContact OG1-O 3.5Å
66	R	74.4	Confident	58.9	Low	186 Å²	186	107 Å²	107	70%	0.702	60%	0.601	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-97.7	130	177.9	-62.3	-175.9	163.2	167.5	-6	108.8	E84	R66-E84 HydrophobicContact CG-CG 4.17Å; R66-E84 IonicContact CZ-OE1 2.68Å; R66-E84 VanDerWaalsContact CZ-OE1 3.27Å; R66-E84 IonicContact NE-OE1 2.82Å; R66-E84 PolarHBondContact NE-OE1 3.28Å; R66-E84 IonicContact NH2-OE1 3.58Å; R66-E84 PolarHBondContact NH2-OE1 3.42Å
67	S	62	Low	59.4	Low	64 Å²	64	111.4 Å²	111.4	45%	0.448	61%	0.61	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-133.7	141.2	173.1	58	0	0	0	0	109.4	I83	S67-I83 PolarHBondContact N-O 2.9Å; S67-I83 PolarHBondContact O-N 3.48Å; S67-I83 PolarHBondContact OG-O 2.82Å
68	T	73.2	Confident	60.6	Low	94 Å²	94	109.9 Å²	109.9	58%	0.577	61%	0.609	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-102.1	120.4	179.2	45.2	0	0	0	0	109.3	Q82	T68-Q82 HydrophobicContact CG2-CG 3.63Å
69	L	75.3	Confident	61.2	Low	95 Å²	95	111 Å²	111	50%	0.497	61%	0.614	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-105.5	118.2	175.6	-156	119.8	0	0	0	108.9	I71 V81 I83	L69-I71 HydrophobicContact CD2-CG1 3.94Å; L69-V81 PolarHBondContact N-O 2.89Å; L69-V81 PolarHBondContact O-N 3.49Å; L69-I83 HydrophobicContact CB-CD1 3.87Å; L69-I83 HydrophobicContact CD1-CD1 4.24Å
70	N	74.1	Confident	62.5	Low	106 Å²	106	109.6 Å²	109.6	57%	0.567	61%	0.613	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-87.9	113	179	-77	-16.4	0	0	0	109.4	S80	N70-S80 WeakPolarHBondContact OD1-CA 3.36Å; N70-S80 WeakPolarHBondContact OD1-CB 3.25Å
71	I	78.8	Confident	63.3	Low	88 Å²	88	110.1 Å²	110.1	45%	0.451	62%	0.616	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-97	121.4	177.2	-53.2	173.8	0	0	0	108	L69 G73 K79 V81	L69-I71 HydrophobicContact CD2-CG1 3.94Å; I71-G73 PolarHBondContact O-N 2.84Å; I71-K79 PolarHBondContact N-O 2.84Å; I71-K79 PolarHBondContact O-N 2.74Å; I71-K79 VanDerWaalsContact O-N 3.1Å; I71-V81 HydrophobicContact CD1-CB 4.47Å; I71-V81 HydrophobicContact CD1-CG2 3.75Å; I71-V81 HydrophobicContact CG1-CG2 4.4Å
72	P	61.2	Low	64.2	Low	116 Å²	116	111.6 Å²	111.6	75%	0.753	62%	0.62	S	S	*	*	P	Polyproline II helix	trans	-70.1	117	174.4	26.7	-30.2	0	0	0	109.4
73	G	49.3	Very low	64.8	Low	37 Å²	37	108.9 Å²	108.9	38%	0.381	61%	0.609	S	S	.	*	P	Polyproline II helix	trans	-96.7	148.2	175	0	0	0	0	0	112	I71 G75 G76	I71-G73 PolarHBondContact O-N 2.84Å; G73-G75 PolarHBondContact O-N 3.49Å; G73-G75 VanDerWaalsContact O-N 3.14Å; G73-G76 PolarHBondContact O-N 2.76Å
74	T	51.7	Low	65.3	Low	165 Å²	165	102.9 Å²	102.9	100%	1.012	59%	0.589	S	S	*	*	T	Hydrogen-bonded Turn	trans	-56.3	113.5	177.3	-46.3	0	0	0	0	110.5
75	G	55.5	Low	65.2	Low	74 Å²	74	100.3 Å²	100.3	76%	0.763	58%	0.583	S	S	*	*	T	Hydrogen-bonded Turn	trans	115.7	13.4	-177.6	0	0	0	0	0	116	G73 K77	G73-G75 PolarHBondContact O-N 3.49Å; G73-G75 VanDerWaalsContact O-N 3.14Å; G75-K77 VanDerWaalsContact C-N 3.31Å; G75-K77 PolarHBondContact O-N 2.87Å
76	G	52.6	Low	65.3	Low	79 Å²	79	104.7 Å²	104.7	81%	0.814	59%	0.592	S	S	*	*	S	Bend	trans	78.2	4.7	167.2	0	0	0	0	0	116	G73	G73-G76 PolarHBondContact O-N 2.76Å
77	K	50.1	Low	64.5	Low	184 Å²	184	103.5 Å²	103.5	80%	0.8	59%	0.592	S	S	*	*			trans	-106.9	103.7	171.7	-67	-177.7	-177.8	177.9	0	109.6	G75	G75-K77 VanDerWaalsContact C-N 3.31Å; G75-K77 PolarHBondContact O-N 2.87Å
78	S	66	Low	64.7	Low	84 Å²	84	107.3 Å²	107.3	59%	0.587	60%	0.6	S	S	*	*	P	Polyproline II helix	trans	-65.7	131.7	176.6	53.5	0	0	0	0	111.3
79	K	60.8	Low	63.8	Low	167 Å²	167	112 Å²	112	73%	0.726	61%	0.607	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-99.2	120.1	170.8	-78	-179.4	179.6	175	0	109	I71	I71-K79 PolarHBondContact N-O 2.84Å; I71-K79 PolarHBondContact O-N 2.74Å; I71-K79 VanDerWaalsContact O-N 3.1Å
80	S	74.2	Confident	62.7	Low	82 Å²	82	111.5 Å²	111.5	57%	0.573	61%	0.608	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-81.8	119.1	174.2	59.4	0	0	0	0	110.2	N70	N70-S80 WeakPolarHBondContact OD1-CA 3.36Å; N70-S80 WeakPolarHBondContact OD1-CB 3.25Å
81	V	67.8	Low	61.4	Low	70 Å²	70	113 Å²	113	42%	0.424	61%	0.61	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-103.7	119.7	173.3	-174.7	0	0	0	0	108.7	L69 I71	L69-V81 PolarHBondContact N-O 2.89Å; L69-V81 PolarHBondContact O-N 3.49Å; I71-V81 HydrophobicContact CD1-CB 4.47Å; I71-V81 HydrophobicContact CD1-CG2 3.75Å; I71-V81 HydrophobicContact CG1-CG2 4.4Å
82	Q	71.3	Confident	60.3	Low	140 Å²	140	112.7 Å²	112.7	65%	0.654	61%	0.612	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-80.3	120.4	174.8	-81.2	178	1.2	0	0	109.9	T68	T68-Q82 HydrophobicContact CG2-CG 3.63Å
83	I	68.7	Low	59.5	Low	73 Å²	73	116 Å²	116	37%	0.374	62%	0.615	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-105.7	115.7	176.5	-55	174.7	0	0	0	108.2	S67 L69 V85	S67-I83 PolarHBondContact N-O 2.9Å; S67-I83 PolarHBondContact O-N 3.48Å; S67-I83 PolarHBondContact OG-O 2.82Å; L69-I83 HydrophobicContact CB-CD1 3.87Å; L69-I83 HydrophobicContact CD1-CD1 4.24Å; I83-V85 HydrophobicContact CG2-CG2 4.34Å
84	E	72.8	Confident	59.9	Low	68 Å²	68	123.9 Å²	123.9	32%	0.318	63%	0.633	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-96.4	114.7	172.1	-59.5	-160.2	145.3	0	0	110.3	R66 R86	R66-E84 HydrophobicContact CG-CG 4.17Å; R66-E84 IonicContact CZ-OE1 2.68Å; R66-E84 VanDerWaalsContact CZ-OE1 3.27Å; R66-E84 IonicContact NE-OE1 2.82Å; R66-E84 PolarHBondContact NE-OE1 3.28Å; R66-E84 IonicContact NH2-OE1 3.58Å; R66-E84 PolarHBondContact NH2-OE1 3.42Å; E84-R86 IonicContact OE2-CZ 3.37Å; E84-R86 IonicContact OE2-NE 3.46Å; E84-R86 IonicContact OE2-NH2 2.82Å; E84-R86 PolarHBondContact OE2-NH2 3.42Å
85	V	65.4	Low	60.2	Low	63 Å²	63	122 Å²	122	38%	0.382	62%	0.616	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-96.4	124.9	172.4	-177.4	0	0	0	0	109.3	T65 I83	T65-V85 PolarHBondContact N-O 3.35Å; T65-V85 PolarHBondContact O-N 2.88Å; T65-V85 PolarHBondContact OG1-O 3.5Å; I83-V85 HydrophobicContact CG2-CG2 4.34Å
86	R	66.6	Low	60.6	Low	164 Å²	164	122.8 Å²	122.8	62%	0.619	61%	0.608	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-110.9	112.8	179.4	-58.2	-175.2	179.8	174.1	3.3	109.3	K64 E84	K64-R86 HydrophobicContact CG-CG 4.33Å; E84-R86 IonicContact OE2-CZ 3.37Å; E84-R86 IonicContact OE2-NE 3.46Å; E84-R86 IonicContact OE2-NH2 2.82Å; E84-R86 PolarHBondContact OE2-NH2 3.42Å
87	K	57.7	Low	61	Low	161 Å²	161	126.4 Å²	126.4	70%	0.7	60%	0.604	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-104.9	128.2	171.7	-72.3	-175.5	179.6	179.3	0	109.7	R63	R63-K87 PolarHBondContact N-O 2.9Å; R63-K87 VanDerWaalsContact N-O 3.13Å; R63-K87 PolarHBondContact O-N 3.46Å; R63-K87 VanDerWaalsContact O-N 3.13Å
88	K	66.5	Low	61.9	Low	143 Å²	143	123 Å²	123	62%	0.622	59%	0.591	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-107	120	177.3	-173.4	-178	-179.5	-177.9	0	108.4	T60	T60-K88 VanDerWaalsContact CG2-CE 3.46Å; T60-K88 HydrophobicContact CG2-CG 4.34Å
89	R	54.2	Low	62.2	Low	192 Å²	192	121.6 Å²	121.6	73%	0.725	58%	0.584	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-118.3	126.7	166.9	-82.2	-174.6	170.4	177.6	-3.7	109.5	L61	L61-R89 PolarHBondContact N-O 2.88Å; L61-R89 VanDerWaalsContact N-O 3.08Å; L61-R89 PolarHBondContact O-N 3.5Å
90	T	52.2	Low	62.7	Low	86 Å²	86	120.6 Å²	120.6	53%	0.528	58%	0.582	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-98	120.6	179	22.8	0	0	0	0	109.3	T60	T60-T90 HydrophobicContact CG2-CG2 3.24Å
91	F	45.8	Very low	62.8	Low	138 Å²	138	126 Å²	126	61%	0.605	59%	0.59	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-108.2	131.9	165.6	-77.4	-84.9	0	0	0	109.4	L59	L59-F91 PolarHBondContact N-O 3.01Å; L59-F91 PolarHBondContact O-N 3.32Å
92	V	55.2	Low	63.3	Low	81 Å²	81	127.2 Å²	127.2	49%	0.491	59%	0.594	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-106.2	114.4	176.1	-177.8	0	0	0	0	106.5	P56 K58 R94	P56-V92 HydrophobicContact CB-CG1 4.48Å; K58-V92 HydrophobicContact CG-CG2 4.48Å; V92-R94 PolarHBondContact O-N 3.41Å
93	K	44.5	Very low	63.7	Low	186 Å²	186	122.8 Å²	122.8	81%	0.809	58%	0.581	S	S	*	*	P	Polyproline II helix	trans	-73.6	117	171	-79.1	-178.2	174.4	-179.1	0	108.2
94	R	58.8	Low	64.3	Low	201 Å²	201	122 Å²	122	76%	0.758	59%	0.585	S	S	*	*	P	Polyproline II helix	trans	-80.5	158.7	177.5	-70.9	179.8	176.4	168.8	-3.5	111	V92	V92-R94 PolarHBondContact O-N 3.41Å
95	D	58.5	Low	64.8	Low	125 Å²	125	124.2 Å²	124.2	67%	0.668	60%	0.596	S	S	*	*	P	Polyproline II helix	trans	-56.6	142.6	-173.2	-98	-55.2	0	0	0	113.6	Q97 E98 A99	D95-Q97 VanDerWaalsContact C-N 3.3Å; D95-Q97 PolarHBondContact O-N 2.99Å; D95-E98 PolarHBondContact O-N 3.18Å; D95-A99 PolarHBondContact O-N 2.82Å
96	P	63.1	Low	65.6	Low	91 Å²	91	125.8 Å²	125.8	59%	0.591	60%	0.599	S	S	*	*	H	α-helix	trans	-64.2	-29.4	-173	22.6	-31.2	0	0	0	113.9	E98 A99 E100	P96-E98 VanDerWaalsContact C-N 3.35Å; P96-E98 PolarHBondContact O-N 3.3Å; P96-A99 PolarHBondContact O-N 2.96Å; P96-E100 PolarHBondContact O-N 2.8Å
97	Q	61.9	Low	66.4	Low	155 Å²	155	124 Å²	124	72%	0.724	60%	0.598	S	S	*	*	H	α-helix	trans	-69.1	-32.2	179.1	-68.6	-173.6	-18.9	0	0	112.9	D95 R101	D95-Q97 VanDerWaalsContact C-N 3.3Å; D95-Q97 PolarHBondContact O-N 2.99Å; Q97-R101 WeakPolarHBondContact O-CG 3.21Å; Q97-R101 PolarHBondContact O-N 3.14Å
98	E	67.5	Low	67.6	Low	113 Å²	113	119 Å²	119	53%	0.528	59%	0.587	S	S	.	*	H	α-helix	trans	-79.9	-35	178	-151.8	178	-157.2	0	0	110.6	D95 P96 R101 L102	D95-E98 PolarHBondContact O-N 3.18Å; P96-E98 VanDerWaalsContact C-N 3.35Å; P96-E98 PolarHBondContact O-N 3.3Å; E98-R101 PolarHBondContact O-N 3.24Å; E98-L102 PolarHBondContact O-N 3.08Å
99	A	72.3	Confident	68.6	Low	55 Å²	55	118.3 Å²	118.3	46%	0.455	59%	0.585	S	S	.	*	H	α-helix	trans	-65.8	-40.5	174	0	0	0	0	0	112.9	D95 P96 A103	D95-A99 PolarHBondContact O-N 2.82Å; P96-A99 PolarHBondContact O-N 2.96Å; A99-A103 VanDerWaalsContact O-CB 3.26Å; A99-A103 WeakPolarHBondContact O-CB 3.42Å; A99-A103 PolarHBondContact O-N 2.92Å
100	E	72	Confident	70.1	Confident	146 Å²	146	116.6 Å²	116.6	68%	0.682	58%	0.579	S	S	*	*	H	α-helix	trans	-66	-39.6	174.5	-88.5	-176.8	157.4	0	0	112.4	P96 A103 A104	P96-E100 PolarHBondContact O-N 2.8Å; E100-A103 PolarHBondContact O-N 2.68Å; E100-A104 WeakPolarHBondContact O-CB 3.46Å; E100-A104 PolarHBondContact O-N 2.84Å
101	R	76.8	Confident	71.7	Confident	194 Å²	194	118.7 Å²	118.7	73%	0.732	58%	0.583	S	S	*	*	H	α-helix	trans	-62.8	-47.4	176.6	-77.4	-178.5	-180	-164.8	0.8	112	Q97 E98 A104 E105	Q97-R101 WeakPolarHBondContact O-CG 3.21Å; Q97-R101 PolarHBondContact O-N 3.14Å; E98-R101 PolarHBondContact O-N 3.24Å; R101-A104 PolarHBondContact O-N 2.92Å; R101-E105 WeakPolarHBondContact O-CB 3.37Å; R101-E105 PolarHBondContact O-N 3.13Å
102	L	78.2	Confident	73.7	Confident	96 Å²	96	114.8 Å²	114.8	50%	0.503	58%	0.576	S	S	.	*	H	α-helix	trans	-65.9	-38.3	177.7	-78.8	161.4	0	0	0	112	E98 E105 E106	E98-L102 PolarHBondContact O-N 3.08Å; L102-E105 PolarHBondContact O-N 2.85Å; L102-E106 WeakPolarHBondContact O-CB 3.46Å; L102-E106 PolarHBondContact O-N 2.79Å
103	A	79.4	Confident	75.2	Confident	47 Å²	47	117.7 Å²	117.7	39%	0.388	58%	0.584	S	S	.	*	H	α-helix	trans	-65.4	-38.6	175.7	0	0	0	0	0	112.2	A99 E100 Q107	A99-A103 VanDerWaalsContact O-CB 3.26Å; A99-A103 WeakPolarHBondContact O-CB 3.42Å; A99-A103 PolarHBondContact O-N 2.92Å; E100-A103 PolarHBondContact O-N 2.68Å; A103-Q107 WeakPolarHBondContact O-CB 3.43Å; A103-Q107 PolarHBondContact O-N 3.45Å
104	A	81.3	Confident	77.2	Confident	56 Å²	56	113.8 Å²	113.8	46%	0.463	57%	0.569	S	S	.	*	H	α-helix	trans	-67.5	-38.7	174.4	0	0	0	0	0	112	E100 R101 Q107 A108	E100-A104 WeakPolarHBondContact O-CB 3.46Å; E100-A104 PolarHBondContact O-N 2.84Å; R101-A104 PolarHBondContact O-N 2.92Å; A104-Q107 PolarHBondContact O-N 3.08Å; A104-A108 WeakPolarHBondContact O-CB 3.33Å; A104-A108 PolarHBondContact O-N 3.34Å
105	E	82.5	Confident	78.6	Confident	116 Å²	116	110.4 Å²	110.4	54%	0.542	56%	0.562	S	S	.	*	H	α-helix	trans	-68.8	-39.3	176.7	-161.6	170.2	-162.3	0	0	111.7	R101 L102 A108 Q109	R101-E105 WeakPolarHBondContact O-CB 3.37Å; R101-E105 PolarHBondContact O-N 3.13Å; L102-E105 PolarHBondContact O-N 2.85Å; E105-A108 PolarHBondContact O-N 3.35Å; E105-Q109 PolarHBondContact O-N 3.33Å
106	E	82.3	Confident	79.9	Confident	96 Å²	96	107.2 Å²	107.2	45%	0.449	55%	0.552	S	S	.	*	H	α-helix	trans	-68.2	-38.6	175	-166.2	-178.3	171.1	0	0	111.8	L102 Q109 R110	L102-E106 WeakPolarHBondContact O-CB 3.46Å; L102-E106 PolarHBondContact O-N 2.79Å; E106-Q109 PolarHBondContact O-N 2.93Å; E106-R110 VanDerWaalsContact O-CG 3.31Å; E106-R110 WeakPolarHBondContact O-CG 3.36Å; E106-R110 PolarHBondContact O-N 2.95Å; E106-R110 IonicContact OE1-CZ 3.67Å; E106-R110 IonicContact OE1-NE 2.67Å; E106-R110 IonicContact OE1-NH2 3.82Å; E106-R110 PolarHBondContact OE1-NH2 3.47Å
107	Q	82.8	Confident	81.2	Confident	127 Å²	127	111.8 Å²	111.8	59%	0.593	56%	0.558	S	S	*	*	H	α-helix	trans	-64.1	-44.1	171.8	-91.3	-177.1	-41.6	0	0	111.8	A103 A104 Q109 R110 E111	A103-Q107 WeakPolarHBondContact O-CB 3.43Å; A103-Q107 PolarHBondContact O-N 3.45Å; A104-Q107 PolarHBondContact O-N 3.08Å; Q107-Q109 VanDerWaalsContact C-N 3.32Å; Q107-Q109 PolarHBondContact O-N 3.37Å; Q107-R110 PolarHBondContact O-N 3Å; Q107-E111 WeakPolarHBondContact O-CG 3.13Å; Q107-E111 PolarHBondContact O-N 2.98Å
108	A	84.4	Confident	82.4	Confident	56 Å²	56	111.9 Å²	111.9	46%	0.463	55%	0.552	S	S	.	*	H	α-helix	trans	-62.3	-38.9	177.1	0	0	0	0	0	112.2	A104 E105 A112	A104-A108 WeakPolarHBondContact O-CB 3.33Å; A104-A108 PolarHBondContact O-N 3.34Å; E105-A108 PolarHBondContact O-N 3.35Å; A108-A112 WeakPolarHBondContact O-CB 3.42Å; A108-A112 PolarHBondContact O-N 2.9Å
109	Q	86.3	Confident	83.3	Confident	128 Å²	128	112.8 Å²	112.8	60%	0.598	56%	0.556	S	S	*	*	H	α-helix	trans	-65.2	-43.9	174.1	-81.2	-177.3	-6.8	0	0	112.4	E105 E106 Q107 A112 E113	E105-Q109 PolarHBondContact O-N 3.33Å; E106-Q109 PolarHBondContact O-N 2.93Å; Q107-Q109 VanDerWaalsContact C-N 3.32Å; Q107-Q109 PolarHBondContact O-N 3.37Å; Q109-A112 PolarHBondContact O-N 3.34Å; Q109-E113 WeakPolarHBondContact O-CB 3.49Å; Q109-E113 PolarHBondContact O-N 3.34Å
110	R	86.5	Confident	84	Confident	155 Å²	155	112.8 Å²	112.8	59%	0.585	56%	0.556	S	S	*	*	H	α-helix	trans	-64.8	-40	178.3	-72.6	177.4	-173.5	-166.3	4.9	112.3	E106 Q107 E113 E114	E106-R110 VanDerWaalsContact O-CG 3.31Å; E106-R110 WeakPolarHBondContact O-CG 3.36Å; E106-R110 PolarHBondContact O-N 2.95Å; E106-R110 IonicContact OE1-CZ 3.67Å; E106-R110 IonicContact OE1-NE 2.67Å; E106-R110 IonicContact OE1-NH2 3.82Å; E106-R110 PolarHBondContact OE1-NH2 3.47Å; Q107-R110 PolarHBondContact O-N 3Å; R110-E113 PolarHBondContact O-N 3.28Å; R110-E114 WeakPolarHBondContact O-CB 3.33Å; R110-E114 PolarHBondContact O-N 3.07Å
111	E	86.6	Confident	84.7	Confident	130 Å²	130	110.4 Å²	110.4	61%	0.607	55%	0.545	S	S	*	.	H	α-helix	trans	-66.3	-40.5	176	-73.3	-179.6	179	0	0	111.8	Q107 E114 Q115	Q107-E111 WeakPolarHBondContact O-CG 3.13Å; Q107-E111 PolarHBondContact O-N 2.98Å; E111-E114 PolarHBondContact O-N 3.2Å; E111-Q115 WeakPolarHBondContact O-CB 3.36Å; E111-Q115 PolarHBondContact O-N 2.91Å
112	A	87.5	Confident	85	Confident	56 Å²	56	107.9 Å²	107.9	46%	0.463	54%	0.541	S	S	.	.	H	α-helix	trans	-65.2	-41.3	175.3	0	0	0	0	0	112.3	A108 Q109 Q115 A116	A108-A112 WeakPolarHBondContact O-CB 3.42Å; A108-A112 PolarHBondContact O-N 2.9Å; Q109-A112 PolarHBondContact O-N 3.34Å; A112-Q115 PolarHBondContact O-N 2.87Å; A112-A116 WeakPolarHBondContact O-CB 3.48Å; A112-A116 PolarHBondContact O-N 3.31Å
113	E	86.5	Confident	85.4	Confident	143 Å²	143	106.3 Å²	106.3	67%	0.668	54%	0.538	S	S	*	.	H	α-helix	trans	-67.5	-39.3	176.6	-166.4	179.7	177	0	0	111.6	Q109 R110 A116 R117	Q109-E113 WeakPolarHBondContact O-CB 3.49Å; Q109-E113 PolarHBondContact O-N 3.34Å; R110-E113 PolarHBondContact O-N 3.28Å; E113-A116 PolarHBondContact O-N 2.89Å; E113-R117 VanDerWaalsContact O-CB 3.31Å; E113-R117 WeakPolarHBondContact O-CB 3.47Å; E113-R117 PolarHBondContact O-N 3.37Å
114	E	86.7	Confident	85.7	Confident	104 Å²	104	106.7 Å²	106.7	49%	0.486	54%	0.541	S	S	.	.	H	α-helix	trans	-68.9	-38.1	176.7	-161.4	-177.4	165	0	0	112.1	R110 E111 R117 R118	R110-E114 WeakPolarHBondContact O-CB 3.33Å; R110-E114 PolarHBondContact O-N 3.07Å; E111-E114 PolarHBondContact O-N 3.2Å; E114-R117 PolarHBondContact O-N 2.96Å; E114-R118 WeakPolarHBondContact O-CG 3.46Å; E114-R118 PolarHBondContact O-N 3.31Å; E114-R118 IonicContact OE1-CZ 3.36Å; E114-R118 IonicContact OE1-NE 2.63Å; E114-R118 IonicContact OE1-NH2 2.7Å; E114-R118 PolarHBondContact OE1-NH2 3.42Å
115	Q	86.9	Confident	86	Confident	130 Å²	130	109.9 Å²	109.9	61%	0.607	55%	0.545	S	S	*	.	H	α-helix	trans	-63.8	-48.8	171.9	-89.9	-178.4	-27.6	0	0	111.8	E111 A112 R117 R118 E119	E111-Q115 WeakPolarHBondContact O-CB 3.36Å; E111-Q115 PolarHBondContact O-N 2.91Å; A112-Q115 PolarHBondContact O-N 2.87Å; Q115-R117 PolarHBondContact O-N 3.13Å; Q115-R118 PolarHBondContact O-N 3.41Å; Q115-R118 VanDerWaalsContact O-N 3.1Å; Q115-E119 WeakPolarHBondContact O-CG 3.42Å; Q115-E119 PolarHBondContact O-N 3.39Å
116	A	87.3	Confident	86.1	Confident	57 Å²	57	112.6 Å²	112.6	47%	0.471	55%	0.55	S	S	.	*	H	α-helix	trans	-58.6	-38.9	177.4	0	0	0	0	0	111.7	A112 E113 A120	A112-A116 WeakPolarHBondContact O-CB 3.48Å; A112-A116 PolarHBondContact O-N 3.31Å; E113-A116 PolarHBondContact O-N 2.89Å; A116-A120 VanDerWaalsContact O-CB 3.3Å; A116-A120 WeakPolarHBondContact O-CB 3.45Å; A116-A120 PolarHBondContact O-N 3Å
117	R	89	Confident	86.3	Confident	188 Å²	188	114.7 Å²	114.7	71%	0.709	56%	0.56	S	S	*	*	H	α-helix	trans	-67.7	-39.3	176.1	-171.2	177.5	174.7	-152	-2.4	112.6	E113 E114 Q115 E121	E113-R117 VanDerWaalsContact O-CB 3.31Å; E113-R117 WeakPolarHBondContact O-CB 3.47Å; E113-R117 PolarHBondContact O-N 3.37Å; E114-R117 PolarHBondContact O-N 2.96Å; Q115-R117 PolarHBondContact O-N 3.13Å; R117-E121 WeakPolarHBondContact O-CB 3.4Å; R117-E121 PolarHBondContact O-N 2.88Å
118	R	87.1	Confident	86.3	Confident	157 Å²	157	111.6 Å²	111.6	59%	0.592	56%	0.556	S	S	*	*	H	α-helix	trans	-67.6	-41.4	176.1	-74.5	177.6	-173.4	-172.2	5.6	111.8	E114 Q115 E121 E122	E114-R118 WeakPolarHBondContact O-CG 3.46Å; E114-R118 PolarHBondContact O-N 3.31Å; E114-R118 IonicContact OE1-CZ 3.36Å; E114-R118 IonicContact OE1-NE 2.63Å; E114-R118 IonicContact OE1-NH2 2.7Å; E114-R118 PolarHBondContact OE1-NH2 3.42Å; Q115-R118 PolarHBondContact O-N 3.41Å; Q115-R118 VanDerWaalsContact O-N 3.1Å; R118-E121 PolarHBondContact O-N 3.47Å; R118-E122 WeakPolarHBondContact O-CB 3.38Å; R118-E122 PolarHBondContact O-N 2.78Å
119	E	86.5	Confident	86.4	Confident	132 Å²	132	115.5 Å²	115.5	62%	0.617	56%	0.564	S	S	*	*	H	α-helix	trans	-64.9	-39.4	175.2	-71.1	179.6	177.8	0	0	111.9	Q115 E122 S123	Q115-E119 WeakPolarHBondContact O-CG 3.42Å; Q115-E119 PolarHBondContact O-N 3.39Å; E119-E122 PolarHBondContact O-N 3.19Å; E119-S123 WeakPolarHBondContact O-CB 3.49Å; E119-S123 PolarHBondContact O-N 2.84Å; E119-S123 PolarHBondContact O-OG 2.72Å
120	A	86.5	Confident	86.4	Confident	55 Å²	55	113.6 Å²	113.6	46%	0.455	56%	0.556	S	S	.	*	H	α-helix	trans	-64.7	-40.8	173	0	0	0	0	0	112.2	A116 S123 A124	A116-A120 VanDerWaalsContact O-CB 3.3Å; A116-A120 WeakPolarHBondContact O-CB 3.45Å; A116-A120 PolarHBondContact O-N 3Å; A120-S123 WeakPolarHBondContact CA-OG 3.44Å; A120-S123 PolarHBondContact O-OG 3.34Å; A120-A124 VanDerWaalsContact O-CB 3.27Å; A120-A124 WeakPolarHBondContact O-CB 3.4Å; A120-A124 PolarHBondContact O-N 3.22Å
121	E	86.8	Confident	86.4	Confident	95 Å²	95	112.7 Å²	112.7	44%	0.444	56%	0.556	S	S	.	*	H	α-helix	trans	-70.2	-36.8	177	-162	-173.5	149.3	0	0	112.2	R117 R118 K125	R117-E121 WeakPolarHBondContact O-CB 3.4Å; R117-E121 PolarHBondContact O-N 2.88Å; R118-E121 PolarHBondContact O-N 3.47Å; E121-K125 WeakPolarHBondContact O-CB 3.39Å; E121-K125 WeakPolarHBondContact O-CG 3.3Å; E121-K125 PolarHBondContact O-N 3.14Å; E121-K125 WeakPolarHBondContact OE1-CE 3.42Å; E121-K125 IonicContact OE1-NZ 3.19Å; E121-K125 PolarHBondContact OE1-NZ 3.23Å
122	E	84.2	Confident	86.3	Confident	141 Å²	141	109.1 Å²	109.1	66%	0.659	55%	0.549	S	S	*	.	H	α-helix	trans	-72.1	-40.7	178.5	-164.1	173.8	-175.1	0	0	111.9	R118 E119 K125 R126	R118-E122 WeakPolarHBondContact O-CB 3.38Å; R118-E122 PolarHBondContact O-N 2.78Å; E119-E122 PolarHBondContact O-N 3.19Å; E122-K125 PolarHBondContact O-N 3.41Å; E122-R126 WeakPolarHBondContact O-CB 3.46Å; E122-R126 PolarHBondContact O-N 2.86Å
123	S	85.2	Confident	86.1	Confident	63 Å²	63	113.3 Å²	113.3	44%	0.441	56%	0.559	S	S	.	*	H	α-helix	trans	-63.4	-44.2	172.4	53.3	0	0	0	0	111.8	E119 A120 K125 R126 E127	E119-S123 WeakPolarHBondContact O-CB 3.49Å; E119-S123 PolarHBondContact O-N 2.84Å; E119-S123 PolarHBondContact O-OG 2.72Å; A120-S123 WeakPolarHBondContact CA-OG 3.44Å; A120-S123 PolarHBondContact O-OG 3.34Å; S123-K125 PolarHBondContact O-N 2.9Å; S123-R126 PolarHBondContact O-N 2.95Å; S123-R126 VanDerWaalsContact O-N 3.15Å; S123-E127 PolarHBondContact O-N 3.33Å
124	A	86.4	Confident	85.9	Confident	55 Å²	55	115.3 Å²	115.3	46%	0.455	56%	0.56	S	S	.	*	H	α-helix	trans	-61.2	-40.7	174.9	0	0	0	0	0	112.6	A120 A128	A120-A124 VanDerWaalsContact O-CB 3.27Å; A120-A124 WeakPolarHBondContact O-CB 3.4Å; A120-A124 PolarHBondContact O-N 3.22Å; A124-A128 WeakPolarHBondContact O-CB 3.44Å; A124-A128 PolarHBondContact O-N 2.82Å
125	K	87.6	Confident	85.9	Confident	124 Å²	124	115.4 Å²	115.4	54%	0.539	56%	0.56	S	S	.	*	H	α-helix	trans	-65.2	-38.4	174	-79.7	175.5	-173.3	160.3	0	112.3	E121 E122 S123 A128 Q129	E121-K125 WeakPolarHBondContact O-CB 3.39Å; E121-K125 WeakPolarHBondContact O-CG 3.3Å; E121-K125 PolarHBondContact O-N 3.14Å; E121-K125 WeakPolarHBondContact OE1-CE 3.42Å; E121-K125 IonicContact OE1-NZ 3.19Å; E121-K125 PolarHBondContact OE1-NZ 3.23Å; E122-K125 PolarHBondContact O-N 3.41Å; S123-K125 PolarHBondContact O-N 2.9Å; K125-A128 PolarHBondContact O-N 2.97Å; K125-Q129 WeakPolarHBondContact O-CB 3.5Å; K125-Q129 PolarHBondContact O-N 2.88Å
126	R	85.7	Confident	85.7	Confident	173 Å²	173	111.9 Å²	111.9	65%	0.653	55%	0.554	S	S	*	*	H	α-helix	trans	-70.2	-39.7	179.8	-153.6	174.9	-169.9	174.8	2	111.7	E122 S123 Q129 Q130	E122-R126 WeakPolarHBondContact O-CB 3.46Å; E122-R126 PolarHBondContact O-N 2.86Å; S123-R126 PolarHBondContact O-N 2.95Å; S123-R126 VanDerWaalsContact O-N 3.15Å; R126-Q129 PolarHBondContact O-N 3.15Å; R126-Q130 WeakPolarHBondContact O-CB 3.35Å; R126-Q130 WeakPolarHBondContact O-CG 3.28Å; R126-Q130 PolarHBondContact O-N 3.42Å
127	E	84.9	Confident	85.6	Confident	140 Å²	140	111.7 Å²	111.7	65%	0.654	55%	0.552	S	S	*	*	H	α-helix	trans	-65.7	-42.9	172.4	-75.4	-172.4	159.3	0	0	111.8	S123 Q129 Q130 K131	S123-E127 PolarHBondContact O-N 3.33Å; E127-Q129 VanDerWaalsContact C-N 3.35Å; E127-Q129 PolarHBondContact O-N 2.81Å; E127-Q130 PolarHBondContact O-N 2.92Å; E127-K131 WeakPolarHBondContact O-CB 3.42Å; E127-K131 PolarHBondContact O-N 2.82Å
128	A	84.7	Confident	85.3	Confident	61 Å²	61	107.4 Å²	107.4	50%	0.504	54%	0.54	S	S	.	.	H	α-helix	trans	-61.7	-41.2	175	0	0	0	0	0	112.1	A124 K125 A132	A124-A128 WeakPolarHBondContact O-CB 3.44Å; A124-A128 PolarHBondContact O-N 2.82Å; K125-A128 PolarHBondContact O-N 2.97Å; A128-A132 WeakPolarHBondContact O-CB 3.29Å; A128-A132 PolarHBondContact O-N 3.35Å
129	Q	85.7	Confident	85	Confident	138 Å²	138	105.8 Å²	105.8	65%	0.645	54%	0.539	S	S	*	.	H	α-helix	trans	-65.5	-44.6	173.8	-88.3	-176.2	-21.5	0	0	112.5	K125 R126 E127 K131 A132 E133	K125-Q129 WeakPolarHBondContact O-CB 3.5Å; K125-Q129 PolarHBondContact O-N 2.88Å; R126-Q129 PolarHBondContact O-N 3.15Å; E127-Q129 VanDerWaalsContact C-N 3.35Å; E127-Q129 PolarHBondContact O-N 2.81Å; Q129-K131 VanDerWaalsContact C-N 3.31Å; Q129-K131 PolarHBondContact O-N 2.97Å; Q129-A132 PolarHBondContact O-N 3.15Å; Q129-E133 WeakPolarHBondContact O-CB 3.39Å; Q129-E133 PolarHBondContact O-N 3.03Å
130	Q	85.4	Confident	84.9	Confident	89 Å²	89	102.1 Å²	102.1	42%	0.416	53%	0.531	S	S	.	.	H	α-helix	trans	-64.4	-37.1	177.4	-75.9	-177.2	21.2	0	0	112.2	R126 E127 R134	R126-Q130 WeakPolarHBondContact O-CB 3.35Å; R126-Q130 WeakPolarHBondContact O-CG 3.28Å; R126-Q130 PolarHBondContact O-N 3.42Å; E127-Q130 PolarHBondContact O-N 2.92Å; Q130-R134 WeakPolarHBondContact O-CB 3.35Å; Q130-R134 VanDerWaalsContact O-CG 3.27Å; Q130-R134 WeakPolarHBondContact O-CG 3.32Å; Q130-R134 PolarHBondContact O-N 3.12Å
131	K	87	Confident	84.7	Confident	135 Å²	135	107.1 Å²	107.1	59%	0.587	54%	0.543	S	S	*	.	H	α-helix	trans	-66.9	-44.9	175.3	-166.7	176.9	179.4	-178.4	0	110.8	E127 Q129 E133 R134 E135	E127-K131 WeakPolarHBondContact O-CB 3.42Å; E127-K131 PolarHBondContact O-N 2.82Å; Q129-K131 VanDerWaalsContact C-N 3.31Å; Q129-K131 PolarHBondContact O-N 2.97Å; K131-E133 PolarHBondContact O-N 3.18Å; K131-R134 PolarHBondContact O-N 3.18Å; K131-E135 WeakPolarHBondContact CE-OE1 3.41Å; K131-E135 WeakPolarHBondContact O-CB 3.22Å; K131-E135 WeakPolarHBondContact O-CG 3.24Å; K131-E135 PolarHBondContact O-N 3.11Å
132	A	83.9	Confident	84.5	Confident	55 Å²	55	110.6 Å²	110.6	46%	0.455	55%	0.552	S	S	.	*	H	α-helix	trans	-62.9	-39.8	175.1	0	0	0	0	0	112.7	A128 Q129 A136	A128-A132 WeakPolarHBondContact O-CB 3.29Å; A128-A132 PolarHBondContact O-N 3.35Å; Q129-A132 PolarHBondContact O-N 3.15Å; A132-A136 VanDerWaalsContact O-CB 3.24Å; A132-A136 WeakPolarHBondContact O-CB 3.27Å; A132-A136 PolarHBondContact O-N 3.25Å
133	E	83.6	Confident	84.5	Confident	144 Å²	144	109.6 Å²	109.6	67%	0.673	55%	0.547	S	S	*	.	H	α-helix	trans	-66.9	-39.4	173.8	-82.7	-173.5	154.2	0	0	112.3	Q129 K131 A137	Q129-E133 WeakPolarHBondContact O-CB 3.39Å; Q129-E133 PolarHBondContact O-N 3.03Å; K131-E133 PolarHBondContact O-N 3.18Å; E133-A137 WeakPolarHBondContact O-CB 3.31Å; E133-A137 PolarHBondContact O-N 2.63Å
134	R	83.8	Confident	84.2	Confident	185 Å²	185	109.2 Å²	109.2	70%	0.698	55%	0.548	S	S	*	.	H	α-helix	trans	-65.4	-44.7	175.1	-78.8	178.9	-175.2	-174.1	4.8	111.6	Q130 K131 A137 E138	Q130-R134 WeakPolarHBondContact O-CB 3.35Å; Q130-R134 VanDerWaalsContact O-CG 3.27Å; Q130-R134 WeakPolarHBondContact O-CG 3.32Å; Q130-R134 PolarHBondContact O-N 3.12Å; K131-R134 PolarHBondContact O-N 3.18Å; R134-A137 PolarHBondContact O-N 2.91Å; R134-E138 WeakPolarHBondContact O-CB 3.3Å; R134-E138 PolarHBondContact O-N 2.96Å
135	E	85.1	Confident	84	Confident	106 Å²	106	109.1 Å²	109.1	50%	0.495	55%	0.547	S	S	.	.	H	α-helix	trans	-63.3	-45.4	176.4	-74.8	175.2	-171	0	0	110.6	K131 A137 E138 Q139	K131-E135 WeakPolarHBondContact CE-OE1 3.41Å; K131-E135 WeakPolarHBondContact O-CB 3.22Å; K131-E135 WeakPolarHBondContact O-CG 3.24Å; K131-E135 PolarHBondContact O-N 3.11Å; E135-A137 PolarHBondContact O-N 2.52Å; E135-E138 PolarHBondContact O-N 2.94Å; E135-Q139 WeakPolarHBondContact O-CB 3.47Å; E135-Q139 PolarHBondContact O-N 2.96Å
136	A	83.1	Confident	83.6	Confident	56 Å²	56	107.9 Å²	107.9	46%	0.463	54%	0.543	S	S	.	.	H	α-helix	trans	-63.3	-39	175.3	0	0	0	0	0	112.6	A132 Q139 A140	A132-A136 VanDerWaalsContact O-CB 3.24Å; A132-A136 WeakPolarHBondContact O-CB 3.27Å; A132-A136 PolarHBondContact O-N 3.25Å; A136-Q139 PolarHBondContact O-N 3.41Å; A136-A140 VanDerWaalsContact O-CB 3.3Å; A136-A140 WeakPolarHBondContact O-CB 3.24Å; A136-A140 PolarHBondContact O-N 3.4Å
137	A	85	Confident	83.1	Confident	53 Å²	53	105.6 Å²	105.6	44%	0.438	54%	0.54	S	S	.	.	H	α-helix	trans	-70.1	-35.5	175.9	0	0	0	0	0	112.5	E133 R134 E135 K141	E133-A137 WeakPolarHBondContact O-CB 3.31Å; E133-A137 PolarHBondContact O-N 2.63Å; R134-A137 PolarHBondContact O-N 2.91Å; E135-A137 PolarHBondContact O-N 2.52Å; A137-K141 WeakPolarHBondContact O-CB 3.46Å; A137-K141 WeakPolarHBondContact O-CG 3.36Å; A137-K141 PolarHBondContact O-N 2.91Å
138	E	82.1	Confident	82.8	Confident	99 Å²	99	101.6 Å²	101.6	46%	0.463	53%	0.531	S	S	.	.	H	α-helix	trans	-68.7	-41.6	173.6	-165.8	-173	156	0	0	110.9	R134 E135 K141 R142	R134-E138 WeakPolarHBondContact O-CB 3.3Å; R134-E138 PolarHBondContact O-N 2.96Å; E135-E138 PolarHBondContact O-N 2.94Å; E138-K141 PolarHBondContact O-N 2.92Å; E138-R142 WeakPolarHBondContact O-CB 3.26Å; E138-R142 WeakPolarHBondContact O-CG 3.41Å; E138-R142 PolarHBondContact O-N 3.01Å; E138-R142 IonicContact OE1-CZ 3.41Å; E138-R142 VanDerWaalsContact OE1-CZ 3.31Å; E138-R142 IonicContact OE1-NE 3.59Å; E138-R142 PolarHBondContact OE1-NE 3.32Å; E138-R142 IonicContact OE1-NH2 3.31Å; E138-R142 PolarHBondContact OE1-NH2 3.24Å
139	Q	82.4	Confident	82.5	Confident	123 Å²	123	106.3 Å²	106.3	58%	0.575	54%	0.54	S	S	*	.	H	α-helix	trans	-64	-45.2	176.3	-142.2	169.3	9.7	0	0	110.8	E135 A136 K141 R142 E143	E135-Q139 WeakPolarHBondContact O-CB 3.47Å; E135-Q139 PolarHBondContact O-N 2.96Å; A136-Q139 PolarHBondContact O-N 3.41Å; Q139-K141 VanDerWaalsContact C-N 3.34Å; Q139-K141 PolarHBondContact O-N 2.96Å; Q139-R142 PolarHBondContact O-N 2.92Å; Q139-E143 WeakPolarHBondContact O-CB 2.88Å; Q139-E143 WeakPolarHBondContact O-CG 3.23Å; Q139-E143 PolarHBondContact O-N 3.35Å
140	A	83	Confident	82.1	Confident	54 Å²	54	107.2 Å²	107.2	45%	0.446	54%	0.538	S	S	.	.	H	α-helix	trans	-62.3	-37.5	174	0	0	0	0	0	112.7	A136 A144	A136-A140 VanDerWaalsContact O-CB 3.3Å; A136-A140 WeakPolarHBondContact O-CB 3.24Å; A136-A140 PolarHBondContact O-N 3.4Å; A140-A144 VanDerWaalsContact O-CB 3.27Å; A140-A144 WeakPolarHBondContact O-CB 3.45Å; A140-A144 PolarHBondContact O-N 3.03Å
141	K	83.5	Confident	81.6	Confident	161 Å²	161	108.3 Å²	108.3	70%	0.7	54%	0.543	S	S	*	.	H	α-helix	trans	-67.5	-39.5	173	-83.3	-177.7	178.2	180	0	112.4	A137 E138 Q139 A145	A137-K141 WeakPolarHBondContact O-CB 3.46Å; A137-K141 WeakPolarHBondContact O-CG 3.36Å; A137-K141 PolarHBondContact O-N 2.91Å; E138-K141 PolarHBondContact O-N 2.92Å; Q139-K141 VanDerWaalsContact C-N 3.34Å; Q139-K141 PolarHBondContact O-N 2.96Å; K141-A145 VanDerWaalsContact O-CB 3.24Å; K141-A145 WeakPolarHBondContact O-CB 3.31Å; K141-A145 PolarHBondContact O-N 2.92Å
142	R	83	Confident	80.8	Confident	167 Å²	167	104.2 Å²	104.2	63%	0.63	53%	0.534	S	S	*	.	H	α-helix	trans	-65.3	-44.6	175.4	-77.4	-178.6	-174.5	-164.3	3.7	111	E138 Q139 A145 E146	E138-R142 WeakPolarHBondContact O-CB 3.26Å; E138-R142 WeakPolarHBondContact O-CG 3.41Å; E138-R142 PolarHBondContact O-N 3.01Å; E138-R142 IonicContact OE1-CZ 3.41Å; E138-R142 VanDerWaalsContact OE1-CZ 3.31Å; E138-R142 IonicContact OE1-NE 3.59Å; E138-R142 PolarHBondContact OE1-NE 3.32Å; E138-R142 IonicContact OE1-NH2 3.31Å; E138-R142 PolarHBondContact OE1-NH2 3.24Å; Q139-R142 PolarHBondContact O-N 2.92Å; R142-A145 PolarHBondContact O-N 3.42Å; R142-E146 WeakPolarHBondContact O-CB 3.04Å; R142-E146 PolarHBondContact O-N 3.36Å
143	E	82.7	Confident	80.1	Confident	121 Å²	121	103.8 Å²	103.8	57%	0.565	53%	0.53	S	S	*	.	H	α-helix	trans	-62.8	-45.3	175.9	-73.2	178.9	-177.2	0	0	111.3	Q139 A145 E146 Q147	Q139-E143 WeakPolarHBondContact O-CB 2.88Å; Q139-E143 WeakPolarHBondContact O-CG 3.23Å; Q139-E143 PolarHBondContact O-N 3.35Å; E143-A145 VanDerWaalsContact C-N 3.35Å; E143-A145 PolarHBondContact O-N 3.05Å; E143-E146 PolarHBondContact O-N 3.35Å; E143-Q147 WeakPolarHBondContact O-CB 3.29Å; E143-Q147 PolarHBondContact O-N 3.28Å
144	A	80.8	Confident	78.9	Confident	55 Å²	55	103.5 Å²	103.5	46%	0.455	53%	0.529	S	S	.	.	H	α-helix	trans	-63.2	-38.7	175.2	0	0	0	0	0	112.5	A140 Q147 A148	A140-A144 VanDerWaalsContact O-CB 3.27Å; A140-A144 WeakPolarHBondContact O-CB 3.45Å; A140-A144 PolarHBondContact O-N 3.03Å; A144-Q147 PolarHBondContact O-N 3.41Å; A144-A148 VanDerWaalsContact O-CB 3.31Å; A144-A148 WeakPolarHBondContact O-CB 3.27Å; A144-A148 PolarHBondContact O-N 2.63Å
145	A	81.2	Confident	77.6	Confident	53 Å²	53	102.2 Å²	102.2	44%	0.438	53%	0.528	S	S	.	.	H	α-helix	trans	-68.9	-35.1	174.9	0	0	0	0	0	112.2	K141 R142 E143 K149	K141-A145 VanDerWaalsContact O-CB 3.24Å; K141-A145 WeakPolarHBondContact O-CB 3.31Å; K141-A145 PolarHBondContact O-N 2.92Å; R142-A145 PolarHBondContact O-N 3.42Å; E143-A145 VanDerWaalsContact C-N 3.35Å; E143-A145 PolarHBondContact O-N 3.05Å; A145-K149 WeakPolarHBondContact O-CB 3.48Å; A145-K149 WeakPolarHBondContact O-CG 3.41Å; A145-K149 PolarHBondContact O-N 3.2Å
146	E	78.3	Confident	76.1	Confident	97 Å²	97	103.5 Å²	103.5	45%	0.453	54%	0.538	S	S	.	.	H	α-helix	trans	-71.3	-40.3	175.1	-156.5	-165.8	156.7	0	0	111.2	R142 E143 K149 R150	R142-E146 WeakPolarHBondContact O-CB 3.04Å; R142-E146 PolarHBondContact O-N 3.36Å; E143-E146 PolarHBondContact O-N 3.35Å; E146-K149 PolarHBondContact O-N 3.39Å; E146-R150 WeakPolarHBondContact O-CB 3.33Å; E146-R150 WeakPolarHBondContact O-CG 3.29Å; E146-R150 PolarHBondContact O-N 3.44Å; E146-R150 IonicContact OE1-CZ 2.9Å; E146-R150 VanDerWaalsContact OE1-CZ 3.31Å; E146-R150 IonicContact OE1-NE 2.86Å; E146-R150 PolarHBondContact OE1-NE 3.4Å; E146-R150 IonicContact OE1-NH2 2.76Å; E146-R150 PolarHBondContact OE1-NH2 2.94Å
147	Q	77	Confident	74.5	Confident	125 Å²	125	109 Å²	109	58%	0.584	55%	0.552	S	S	*	*	H	α-helix	trans	-62.9	-45.1	173.4	-124	171.8	-5.5	0	0	111.1	E143 A144 K149 R150 E151	E143-Q147 WeakPolarHBondContact O-CB 3.29Å; E143-Q147 PolarHBondContact O-N 3.28Å; A144-Q147 PolarHBondContact O-N 3.41Å; Q147-K149 VanDerWaalsContact C-N 3.32Å; Q147-K149 PolarHBondContact O-N 2.89Å; Q147-R150 PolarHBondContact O-N 3.15Å; Q147-R150 VanDerWaalsContact O-N 3.13Å; Q147-E151 WeakPolarHBondContact O-CG 3.35Å; Q147-E151 PolarHBondContact O-N 2.91Å
148	A	78	Confident	72.2	Confident	56 Å²	56	112.3 Å²	112.3	46%	0.463	57%	0.567	S	S	.	*	H	α-helix	trans	-62.5	-37.8	174.8	0	0	0	0	0	112.3	A144 A152	A144-A148 VanDerWaalsContact O-CB 3.31Å; A144-A148 WeakPolarHBondContact O-CB 3.27Å; A144-A148 PolarHBondContact O-N 2.63Å; A148-A152 VanDerWaalsContact O-CB 3.29Å; A148-A152 WeakPolarHBondContact O-CB 3.31Å; A148-A152 PolarHBondContact O-N 3.43Å
149	K	78	Confident	70	Confident	160 Å²	160	112 Å²	112	70%	0.696	58%	0.576	S	S	*	*	H	α-helix	trans	-66.9	-37.4	172.6	-81.6	-177.9	177.6	-177.6	0	112.4	A145 E146 Q147 A153	A145-K149 WeakPolarHBondContact O-CB 3.48Å; A145-K149 WeakPolarHBondContact O-CG 3.41Å; A145-K149 PolarHBondContact O-N 3.2Å; E146-K149 PolarHBondContact O-N 3.39Å; Q147-K149 VanDerWaalsContact C-N 3.32Å; Q147-K149 PolarHBondContact O-N 2.89Å; K149-A153 VanDerWaalsContact O-CB 3.24Å; K149-A153 WeakPolarHBondContact O-CB 3.37Å; K149-A153 PolarHBondContact O-N 2.99Å
150	R	76.8	Confident	67.7	Low	158 Å²	158	113.3 Å²	113.3	60%	0.596	59%	0.587	S	S	*	*	H	α-helix	trans	-69	-41.4	175.6	-74	176.2	-174.8	-167.1	4	111.5	E146 Q147 A153 E154	E146-R150 WeakPolarHBondContact O-CB 3.33Å; E146-R150 WeakPolarHBondContact O-CG 3.29Å; E146-R150 PolarHBondContact O-N 3.44Å; E146-R150 IonicContact OE1-CZ 2.9Å; E146-R150 VanDerWaalsContact OE1-CZ 3.31Å; E146-R150 IonicContact OE1-NE 2.86Å; E146-R150 PolarHBondContact OE1-NE 3.4Å; E146-R150 IonicContact OE1-NH2 2.76Å; E146-R150 PolarHBondContact OE1-NH2 2.94Å; Q147-R150 PolarHBondContact O-N 3.15Å; Q147-R150 VanDerWaalsContact O-N 3.13Å; R150-A153 CarbonylContact O-C 3.46Å; R150-A153 PolarHBondContact O-N 3.16Å; R150-E154 PolarHBondContact O-N 2.94Å
151	E	75.4	Confident	65.2	Low	112 Å²	112	119.8 Å²	119.8	52%	0.523	61%	0.607	S	S	.	*	H	α-helix	trans	-66.9	-37.5	174.6	-73.2	-177.7	-174.2	0	0	112.1	Q147 E154 K155	Q147-E151 WeakPolarHBondContact O-CG 3.35Å; Q147-E151 PolarHBondContact O-N 2.91Å; E151-E154 PolarHBondContact O-N 3.41Å; E151-K155 WeakPolarHBondContact O-CB 3.43Å; E151-K155 WeakPolarHBondContact O-CG 3.46Å; E151-K155 PolarHBondContact O-N 3.4Å
152	A	70.1	Confident	62.6	Low	49 Å²	49	120.4 Å²	120.4	41%	0.405	61%	0.613	S	S	.	*	H	α-helix	trans	-64.5	-42.7	171.3	0	0	0	0	0	111.2	A148 E154 K155 D156	A148-A152 VanDerWaalsContact O-CB 3.29Å; A148-A152 WeakPolarHBondContact O-CB 3.31Å; A148-A152 PolarHBondContact O-N 3.43Å; A152-E154 VanDerWaalsContact C-N 3.33Å; A152-E154 PolarHBondContact O-N 3.11Å; A152-K155 PolarHBondContact O-N 3.11Å; A152-D156 PolarHBondContact O-N 3.24Å
153	A	68.4	Low	60.2	Low	45 Å²	45	119 Å²	119	37%	0.372	62%	0.618	S	S	.	*	H	α-helix	trans	-69.4	-26.5	176.6	0	0	0	0	0	113.6	K149 R150 K157	K149-A153 VanDerWaalsContact O-CB 3.24Å; K149-A153 WeakPolarHBondContact O-CB 3.37Å; K149-A153 PolarHBondContact O-N 2.99Å; R150-A153 CarbonylContact O-C 3.46Å; R150-A153 PolarHBondContact O-N 3.16Å; A153-K157 VanDerWaalsContact O-CG 3.28Å; A153-K157 WeakPolarHBondContact O-CG 3.22Å; A153-K157 PolarHBondContact O-N 3.49Å
154	E	58.6	Low	58.2	Low	139 Å²	139	120.5 Å²	120.5	65%	0.65	63%	0.63	S	S	*	*	H	α-helix	trans	-76.3	-42.1	169.9	-88.2	-162.3	150.9	0	0	111.5	R150 E151 A152 D156 K157 V158	R150-E154 PolarHBondContact O-N 2.94Å; E151-E154 PolarHBondContact O-N 3.41Å; A152-E154 VanDerWaalsContact C-N 3.33Å; A152-E154 PolarHBondContact O-N 3.11Å; E154-D156 VanDerWaalsContact C-N 3.26Å; E154-D156 PolarHBondContact O-N 3.29Å; E154-K157 PolarHBondContact O-N 3.3Å; E154-V158 VanDerWaalsContact O-CG2 3.28Å; E154-V158 WeakPolarHBondContact O-CG2 3.48Å; E154-V158 PolarHBondContact O-N 3.44Å
155	K	57.1	Low	56.1	Low	158 Å²	158	124 Å²	124	69%	0.687	64%	0.638	S	S	*	*	H	α-helix	trans	-61.1	-36.6	175.3	-77.1	177.9	-178.4	174.3	0	112.2	E151 A152 K157	E151-K155 WeakPolarHBondContact O-CB 3.43Å; E151-K155 WeakPolarHBondContact O-CG 3.46Å; E151-K155 PolarHBondContact O-N 3.4Å; A152-K155 PolarHBondContact O-N 3.11Å; K155-K157 VanDerWaalsContact C-N 3.26Å; K155-K157 PolarHBondContact O-N 2.71Å
156	D	53.6	Low	54.6	Low	132 Å²	132	126.9 Å²	126.9	71%	0.706	65%	0.651	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.7	-18.8	175.6	-77.2	-16.8	0	0	0	113.4	A152 E154	A152-D156 PolarHBondContact O-N 3.24Å; E154-D156 VanDerWaalsContact C-N 3.26Å; E154-D156 PolarHBondContact O-N 3.29Å
157	K	49.8	Very low	53.1	Low	171 Å²	171	131.1 Å²	131.1	74%	0.743	67%	0.667	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98	-5.9	-179.8	-74.5	-179.4	-177.5	-177.3	0	114.8	A153 E154 K155	A153-K157 VanDerWaalsContact O-CG 3.28Å; A153-K157 WeakPolarHBondContact O-CG 3.22Å; A153-K157 PolarHBondContact O-N 3.49Å; E154-K157 PolarHBondContact O-N 3.3Å; K155-K157 VanDerWaalsContact C-N 3.26Å; K155-K157 PolarHBondContact O-N 2.71Å
158	V	37.4	Very low	51.9	Low	124 Å²	124	129.7 Å²	129.7	75%	0.752	66%	0.664	S	S	*	*	S	Bend	trans	-105.8	15.6	-177.1	-172.9	0	0	0	0	112.6	E154	E154-V158 VanDerWaalsContact O-CG2 3.28Å; E154-V158 WeakPolarHBondContact O-CG2 3.48Å; E154-V158 PolarHBondContact O-N 3.44Å
159	S	35.4	Very low	51	Low	93 Å²	93	130.1 Å²	130.1	65%	0.65	67%	0.667	S	S	*	*	S	Bend	trans	-108.5	39.3	172.8	67.9	0	0	0	0	114
160	N	34.5	Very low	50.1	Low	150 Å²	150	129.9 Å²	129.9	80%	0.802	67%	0.669	S	S	*	*	S	Bend	trans	-167.4	133.2	150.1	-104.3	-24.6	0	0	0	110.9
161	Q	30.6	Very low	49.7	Very low	189 Å²	189	125 Å²	125	88%	0.883	66%	0.662	S	S	*	*			trans	84.2	88.8	172.7	-60.2	-179.5	-10.9	0	0	115.7
162	Q	28.9	Very low	49.5	Very low	175 Å²	175	124.5 Å²	124.5	82%	0.818	66%	0.66	S	S	*	*			trans	-50	139.1	161.6	-82.1	161.2	-54.4	0	0	114
163	D	31.5	Very low	49.8	Very low	138 Å²	138	128.7 Å²	128.7	74%	0.738	67%	0.669	S	S	*	*	S	Bend	trans	70.9	119	136	-55	-23.2	0	0	0	120
164	D	42	Very low	50.1	Low	151 Å²	151	128.7 Å²	128.7	81%	0.807	67%	0.669	S	S	*	*	S	Bend	trans	83.5	37.5	157.7	-68.7	-20.1	0	0	0	121.6
165	M	36.1	Very low	51	Low	130 Å²	130	130 Å²	130	64%	0.64	67%	0.668	S	S	*	*			trans	-124.3	6.3	163	-83	-80.2	-74.1	0	0	115.9	K167 N168	M165-K167 PolarHBondContact O-N 3.36Å; M165-K167 VanDerWaalsContact O-N 3.07Å; M165-N168 HydrophobicContact CE-CB 4.01Å; M165-N168 PolarHBondContact O-N 3.29Å; M165-N168 HydrophobicContact SD-CB 4.18Å; M165-N168 PolarHBondContact SD-ND2 3.02Å; M165-N168 VanDerWaalsContact SD-ND2 3.4Å
166	T	48.8	Very low	51.9	Low	113 Å²	113	130.2 Å²	130.2	69%	0.693	66%	0.664	S	S	*	*	H	α-helix	trans	-66.6	-10	-178.4	42.6	0	0	0	0	115.3
167	K	47.3	Very low	53.1	Low	185 Å²	185	129.8 Å²	129.8	80%	0.804	66%	0.658	S	S	*	*	H	α-helix	trans	-81.5	-28.2	168.8	-77.5	-177.1	178.1	174.7	0	113.7	M165 A171	M165-K167 PolarHBondContact O-N 3.36Å; M165-K167 VanDerWaalsContact O-N 3.07Å; K167-A171 PolarHBondContact O-N 3.01Å
168	N	52	Low	54.5	Low	96 Å²	96	128.2 Å²	128.2	51%	0.513	65%	0.653	S	S	.	*	H	α-helix	trans	-80.5	-31.9	-179.3	-81.8	-7.5	0	0	0	112.6	M165 Q170 A171 E172	M165-N168 HydrophobicContact CE-CB 4.01Å; M165-N168 PolarHBondContact O-N 3.29Å; M165-N168 HydrophobicContact SD-CB 4.18Å; M165-N168 PolarHBondContact SD-ND2 3.02Å; M165-N168 VanDerWaalsContact SD-ND2 3.4Å; N168-Q170 PolarHBondContact O-N 2.92Å; N168-A171 PolarHBondContact O-N 3.4Å; N168-E172 PolarHBondContact O-N 2.87Å
169	A	58.9	Low	56.5	Low	65 Å²	65	127.3 Å²	127.3	54%	0.537	64%	0.641	S	S	.	*	H	α-helix	trans	-67.7	-35.7	178	0	0	0	0	0	113	K173	A169-K173 PolarHBondContact O-N 3.24Å; A169-K173 VanDerWaalsContact O-N 3.12Å
170	Q	59.4	Low	58.8	Low	155 Å²	155	125.6 Å²	125.6	72%	0.724	63%	0.632	S	S	*	*	H	α-helix	trans	-71.4	-36.2	173.2	-69.8	-174.4	-11.8	0	0	111.8	N168 A174	N168-Q170 PolarHBondContact O-N 2.92Å; Q170-A174 WeakPolarHBondContact O-CB 3.42Å; Q170-A174 PolarHBondContact O-N 3.07Å; Q170-A174 VanDerWaalsContact O-N 3.07Å
171	A	67.9	Low	61	Low	55 Å²	55	121.4 Å²	121.4	46%	0.455	62%	0.618	S	S	.	*	H	α-helix	trans	-67	-37.7	174.5	0	0	0	0	0	112.3	K167 N168 R175	K167-A171 PolarHBondContact O-N 3.01Å; N168-A171 PolarHBondContact O-N 3.4Å; A171-R175 VanDerWaalsContact O-CB 3.29Å; A171-R175 WeakPolarHBondContact O-CB 3.23Å; A171-R175 PolarHBondContact O-N 3.12Å
172	E	71.3	Confident	63.4	Low	102 Å²	102	116.7 Å²	116.7	48%	0.477	60%	0.596	S	S	.	*	H	α-helix	trans	-70.3	-40.5	177.8	-161.7	-168	154.1	0	0	112	N168 R175 R176	N168-E172 PolarHBondContact O-N 2.87Å; E172-R175 PolarHBondContact O-N 2.84Å; E172-R176 PolarHBondContact O-N 3.49Å; E172-R176 IonicContact OE1-CZ 3.94Å; E172-R176 VanDerWaalsContact OE1-CZ 3.25Å; E172-R176 IonicContact OE1-NE 3.58Å; E172-R176 PolarHBondContact OE1-NE 3.01Å; E172-R176 IonicContact OE1-NH2 3.24Å; E172-R176 PolarHBondContact OE1-NH2 3.38Å
173	K	75.9	Confident	66	Low	137 Å²	137	114.3 Å²	114.3	60%	0.596	59%	0.589	S	S	*	*	H	α-helix	trans	-63.4	-44.4	175.1	-172.7	176.8	177.4	-176.4	0	111.7	A169 R175 R176 E177	A169-K173 PolarHBondContact O-N 3.24Å; A169-K173 VanDerWaalsContact O-N 3.12Å; K173-R175 VanDerWaalsContact C-N 3.28Å; K173-R175 PolarHBondContact O-N 2.97Å; K173-R176 PolarHBondContact O-N 3.27Å; K173-E177 WeakPolarHBondContact CE-OE1 3.46Å; K173-E177 PolarHBondContact O-N 3.5Å
174	A	74.7	Confident	68.4	Low	44 Å²	44	115.1 Å²	115.1	36%	0.364	59%	0.585	S	S	.	*	H	α-helix	trans	-62.2	-36.9	174.8	0	0	0	0	0	112	Q170 Q178	Q170-A174 WeakPolarHBondContact O-CB 3.42Å; Q170-A174 PolarHBondContact O-N 3.07Å; Q170-A174 VanDerWaalsContact O-N 3.07Å; A174-Q178 WeakPolarHBondContact O-CB 3.44Å; A174-Q178 VanDerWaalsContact O-CG 3.28Å; A174-Q178 WeakPolarHBondContact O-CG 3.29Å; A174-Q178 PolarHBondContact O-N 3.49Å
175	R	77.5	Confident	70.3	Confident	168 Å²	168	115 Å²	115	63%	0.634	57%	0.574	S	S	*	*	H	α-helix	trans	-68.6	-39	176.9	-166.3	177.6	167.5	-162	-6.9	112.4	A171 E172 K173 Q178 E179	A171-R175 VanDerWaalsContact O-CB 3.29Å; A171-R175 WeakPolarHBondContact O-CB 3.23Å; A171-R175 PolarHBondContact O-N 3.12Å; E172-R175 PolarHBondContact O-N 2.84Å; K173-R175 VanDerWaalsContact C-N 3.28Å; K173-R175 PolarHBondContact O-N 2.97Å; R175-Q178 PolarHBondContact O-N 3.4Å; R175-E179 PolarHBondContact O-N 3.34Å
176	R	77.4	Confident	72.6	Confident	162 Å²	162	114.1 Å²	114.1	61%	0.611	57%	0.566	S	S	*	*	H	α-helix	trans	-67.6	-39.1	174.8	-74.3	-175.6	-176.6	179.4	3.5	112.8	E172 K173 Q178 E179 A180	E172-R176 PolarHBondContact O-N 3.49Å; E172-R176 IonicContact OE1-CZ 3.94Å; E172-R176 VanDerWaalsContact OE1-CZ 3.25Å; E172-R176 IonicContact OE1-NE 3.58Å; E172-R176 PolarHBondContact OE1-NE 3.01Å; E172-R176 IonicContact OE1-NH2 3.24Å; E172-R176 PolarHBondContact OE1-NH2 3.38Å; K173-R176 PolarHBondContact O-N 3.27Å; R176-Q178 VanDerWaalsContact C-N 3.33Å; R176-E179 PolarHBondContact O-N 2.85Å; R176-A180 WeakPolarHBondContact O-CB 3.31Å; R176-A180 PolarHBondContact O-N 2.75Å
177	E	78.5	Confident	74.3	Confident	123 Å²	123	111.4 Å²	111.4	58%	0.575	56%	0.555	S	S	*	*	H	α-helix	trans	-66	-37.9	174.6	-75.1	175.8	-172.4	0	0	111.4	K173 A181	K173-E177 WeakPolarHBondContact CE-OE1 3.46Å; K173-E177 PolarHBondContact O-N 3.5Å; E177-A181 WeakPolarHBondContact O-CB 3.35Å; E177-A181 PolarHBondContact O-N 3.33Å
178	Q	77.7	Confident	76.2	Confident	138 Å²	138	109.2 Å²	109.2	65%	0.645	55%	0.548	S	S	*	.	H	α-helix	trans	-66.6	-43.1	172.9	-74.6	178.5	0.2	0	0	112.5	A174 R175 R176 A181 E182	A174-Q178 WeakPolarHBondContact O-CB 3.44Å; A174-Q178 VanDerWaalsContact O-CG 3.28Å; A174-Q178 WeakPolarHBondContact O-CG 3.29Å; A174-Q178 PolarHBondContact O-N 3.49Å; R175-Q178 PolarHBondContact O-N 3.4Å; R176-Q178 VanDerWaalsContact C-N 3.33Å; Q178-A181 PolarHBondContact O-N 2.92Å; Q178-E182 WeakPolarHBondContact O-CB 3.41Å; Q178-E182 PolarHBondContact O-N 3.26Å
179	E	80.3	Confident	77.5	Confident	105 Å²	105	109.9 Å²	109.9	49%	0.491	55%	0.548	S	S	.	.	H	α-helix	trans	-62.1	-43.1	174.9	-104.5	176.4	169.9	0	0	111.9	R175 R176 E182 L183	R175-E179 PolarHBondContact O-N 3.34Å; R176-E179 PolarHBondContact O-N 2.85Å; E179-E182 PolarHBondContact O-N 2.88Å; E179-L183 WeakPolarHBondContact O-CB 3.14Å; E179-L183 PolarHBondContact O-N 3.42Å
180	A	82.8	Confident	78.6	Confident	57 Å²	57	111.8 Å²	111.8	47%	0.471	55%	0.546	S	S	.	.	H	α-helix	trans	-65.9	-38.6	177.9	0	0	0	0	0	112.4	R176 K184	R176-A180 WeakPolarHBondContact O-CB 3.31Å; R176-A180 PolarHBondContact O-N 2.75Å; A180-K184 PolarHBondContact O-N 2.99Å
181	A	81.7	Confident	79.9	Confident	61 Å²	61	106.9 Å²	106.9	50%	0.504	53%	0.531	S	S	.	.	H	α-helix	trans	-68	-38.5	174.4	0	0	0	0	0	111.9	E177 Q178 K184 R185	E177-A181 WeakPolarHBondContact O-CB 3.35Å; E177-A181 PolarHBondContact O-N 3.33Å; Q178-A181 PolarHBondContact O-N 2.92Å; A181-K184 PolarHBondContact O-N 2.83Å; A181-R185 PolarHBondContact O-N 2.76Å
182	E	81.4	Confident	80.6	Confident	91 Å²	91	112.9 Å²	112.9	43%	0.425	54%	0.542	S	S	.	.	H	α-helix	trans	-69.9	-37.2	177	-156.5	-171.3	150.6	0	0	112	Q178 E179 R185 K186	Q178-E182 WeakPolarHBondContact O-CB 3.41Å; Q178-E182 PolarHBondContact O-N 3.26Å; E179-E182 PolarHBondContact O-N 2.88Å; E182-R185 PolarHBondContact O-N 2.86Å; E182-K186 WeakPolarHBondContact O-CB 3.48Å; E182-K186 WeakPolarHBondContact O-CG 3.36Å; E182-K186 PolarHBondContact O-N 2.93Å; E182-K186 VanDerWaalsContact OE1-CE 3.25Å; E182-K186 WeakPolarHBondContact OE1-CE 3.47Å; E182-K186 IonicContact OE1-NZ 3.82Å; E182-K186 PolarHBondContact OE1-NZ 3.39Å
183	L	82.2	Confident	81.2	Confident	125 Å²	125	115.8 Å²	115.8	65%	0.654	55%	0.549	S	S	*	.	H	α-helix	trans	-63.5	-43.5	173.1	-114.9	149.3	0	0	0	111.8	E179 K186 A187	E179-L183 WeakPolarHBondContact O-CB 3.14Å; E179-L183 PolarHBondContact O-N 3.42Å; L183-K186 PolarHBondContact O-N 2.82Å; L183-A187 WeakPolarHBondContact O-CB 3.44Å; L183-A187 PolarHBondContact O-N 2.81Å
184	K	83.4	Confident	81.7	Confident	155 Å²	155	114.9 Å²	114.9	67%	0.674	55%	0.545	S	S	*	.	H	α-helix	trans	-62.6	-42.9	173.2	-84.4	-172.6	174	-176	0	112	A180 A181 K186 A187 E188	A180-K184 PolarHBondContact O-N 2.99Å; A181-K184 PolarHBondContact O-N 2.83Å; K184-K186 PolarHBondContact O-N 2.88Å; K184-A187 PolarHBondContact O-N 2.83Å; K184-E188 WeakPolarHBondContact O-CG 3.44Å; K184-E188 PolarHBondContact O-N 2.91Å
185	R	82.1	Confident	82.1	Confident	148 Å²	148	118.5 Å²	118.5	56%	0.558	56%	0.558	S	S	*	*	H	α-helix	trans	-64.6	-40.8	178.1	-158.4	-174.5	81	-179.6	2.1	112	A181 E182 E188 E189	A181-R185 PolarHBondContact O-N 2.76Å; E182-R185 PolarHBondContact O-N 2.86Å; R185-E188 PolarHBondContact O-N 3.36Å; R185-E189 WeakPolarHBondContact O-CB 3.47Å; R185-E189 WeakPolarHBondContact O-CG 3.23Å; R185-E189 PolarHBondContact O-N 2.77Å
186	K	83.3	Confident	82.4	Confident	111 Å²	111	116.7 Å²	116.7	48%	0.483	56%	0.556	S	S	.	*	H	α-helix	trans	-65.4	-40.4	174.3	-76.9	175.2	-175.4	160.9	0	111.8	E182 L183 K184 E189 E190	E182-K186 WeakPolarHBondContact O-CB 3.48Å; E182-K186 WeakPolarHBondContact O-CG 3.36Å; E182-K186 PolarHBondContact O-N 2.93Å; E182-K186 VanDerWaalsContact OE1-CE 3.25Å; E182-K186 WeakPolarHBondContact OE1-CE 3.47Å; E182-K186 IonicContact OE1-NZ 3.82Å; E182-K186 PolarHBondContact OE1-NZ 3.39Å; L183-K186 PolarHBondContact O-N 2.82Å; K184-K186 PolarHBondContact O-N 2.88Å; K186-E189 PolarHBondContact O-N 2.89Å; K186-E190 VanDerWaalsContact O-CB 3.25Å; K186-E190 WeakPolarHBondContact O-CB 3.43Å; K186-E190 PolarHBondContact O-N 3Å
187	A	85.2	Confident	82.6	Confident	56 Å²	56	113.5 Å²	113.5	46%	0.463	55%	0.548	S	S	.	.	H	α-helix	trans	-65.1	-40.7	176.2	0	0	0	0	0	112.3	L183 K184 E190 A191	L183-A187 WeakPolarHBondContact O-CB 3.44Å; L183-A187 PolarHBondContact O-N 2.81Å; K184-A187 PolarHBondContact O-N 2.83Å; A187-E190 PolarHBondContact O-N 3.07Å; A187-A191 VanDerWaalsContact O-CB 3.25Å; A187-A191 WeakPolarHBondContact O-CB 3.47Å; A187-A191 PolarHBondContact O-N 3.48Å
188	E	85.6	Confident	82.9	Confident	139 Å²	139	113.8 Å²	113.8	65%	0.65	55%	0.55	S	S	*	.	H	α-helix	trans	-68.6	-41	174.5	-75.4	-179.5	174.1	0	0	112.2	K184 R185 A191 R192	K184-E188 WeakPolarHBondContact O-CG 3.44Å; K184-E188 PolarHBondContact O-N 2.91Å; R185-E188 PolarHBondContact O-N 3.36Å; E188-A191 PolarHBondContact O-N 2.86Å; E188-R192 WeakPolarHBondContact O-CB 3.35Å; E188-R192 PolarHBondContact O-N 3.37Å
189	E	80.4	Confident	83.1	Confident	110 Å²	110	110.2 Å²	110.2	51%	0.514	54%	0.544	S	S	.	.	H	α-helix	trans	-64.2	-39.6	173.9	-80.7	179.3	161.2	0	0	111.7	R185 K186 R192 R193	R185-E189 WeakPolarHBondContact O-CB 3.47Å; R185-E189 WeakPolarHBondContact O-CG 3.23Å; R185-E189 PolarHBondContact O-N 2.77Å; K186-E189 PolarHBondContact O-N 2.89Å; E189-R192 PolarHBondContact O-N 3.44Å; E189-R193 VanDerWaalsContact O-CB 3.22Å; E189-R193 WeakPolarHBondContact O-CB 3.27Å; E189-R193 PolarHBondContact O-N 2.84Å
190	E	82.4	Confident	83.2	Confident	106 Å²	106	113.8 Å²	113.8	50%	0.495	55%	0.552	S	S	.	*	H	α-helix	trans	-71.4	-40.2	177.4	-159.6	-170.2	151.5	0	0	111.7	K186 A187 R192 R193 K194	K186-E190 VanDerWaalsContact O-CB 3.25Å; K186-E190 WeakPolarHBondContact O-CB 3.43Å; K186-E190 PolarHBondContact O-N 3Å; A187-E190 PolarHBondContact O-N 3.07Å; E190-R192 VanDerWaalsContact C-N 3.35Å; E190-R193 PolarHBondContact O-N 2.84Å; E190-K194 WeakPolarHBondContact O-CB 3.17Å; E190-K194 WeakPolarHBondContact O-CG 3.19Å; E190-K194 PolarHBondContact O-N 2.86Å; E190-K194 VanDerWaalsContact OE1-CE 3.24Å; E190-K194 WeakPolarHBondContact OE1-CE 3.23Å; E190-K194 IonicContact OE1-NZ 3.19Å; E190-K194 PolarHBondContact OE1-NZ 3.21Å
191	A	85.7	Confident	83.2	Confident	51 Å²	51	119.7 Å²	119.7	42%	0.421	56%	0.563	S	S	.	*	H	α-helix	trans	-63.2	-41.8	173.2	0	0	0	0	0	111.4	A187 E188 K194 L195	A187-A191 VanDerWaalsContact O-CB 3.25Å; A187-A191 WeakPolarHBondContact O-CB 3.47Å; A187-A191 PolarHBondContact O-N 3.48Å; E188-A191 PolarHBondContact O-N 2.86Å; A191-K194 PolarHBondContact O-N 3.04Å; A191-L195 WeakPolarHBondContact O-CB 3.33Å; A191-L195 PolarHBondContact O-N 3.28Å
192	R	83.7	Confident	83.4	Confident	182 Å²	182	121 Å²	121	69%	0.687	57%	0.565	S	S	*	*	H	α-helix	trans	-68	-37.6	176.6	-165.2	170.9	-179.4	-93.2	-6.1	111.7	E188 E189 E190 L195 E196	E188-R192 WeakPolarHBondContact O-CB 3.35Å; E188-R192 PolarHBondContact O-N 3.37Å; E189-R192 PolarHBondContact O-N 3.44Å; E190-R192 VanDerWaalsContact C-N 3.35Å; R192-L195 PolarHBondContact O-N 3.06Å; R192-E196 WeakPolarHBondContact O-CB 3.29Å; R192-E196 PolarHBondContact O-N 3.15Å
193	R	84.1	Confident	83.3	Confident	163 Å²	163	119.4 Å²	119.4	62%	0.615	57%	0.566	S	S	*	*	H	α-helix	trans	-67.8	-39.5	174.2	-174.5	178.5	165.9	-172.1	-5.1	112	E189 E190 E196 E197	E189-R193 VanDerWaalsContact O-CB 3.22Å; E189-R193 WeakPolarHBondContact O-CB 3.27Å; E189-R193 PolarHBondContact O-N 2.84Å; E190-R193 PolarHBondContact O-N 2.84Å; R193-E196 PolarHBondContact O-N 3.27Å; R193-E197 HydrophobicContact CG-CG 4.41Å; R193-E197 IonicContact CZ-OE1 2.67Å; R193-E197 IonicContact NE-OE1 3.31Å; R193-E197 PolarHBondContact NE-OE1 3Å; R193-E197 IonicContact NH2-OE1 3.96Å; R193-E197 PolarHBondContact NH2-OE1 3.01Å; R193-E197 VanDerWaalsContact NH2-OE1 3.08Å; R193-E197 WeakPolarHBondContact O-CB 3.24Å; R193-E197 WeakPolarHBondContact O-CG 3.25Å; R193-E197 PolarHBondContact O-N 2.95Å
194	K	85.2	Confident	83.2	Confident	118 Å²	118	119.2 Å²	119.2	51%	0.513	56%	0.562	S	S	.	*	H	α-helix	trans	-63.5	-44.4	173.7	-77	174.6	-175.6	164.7	0	111.5	E190 A191 E196 E197 E198	E190-K194 WeakPolarHBondContact O-CB 3.17Å; E190-K194 WeakPolarHBondContact O-CG 3.19Å; E190-K194 PolarHBondContact O-N 2.86Å; E190-K194 VanDerWaalsContact OE1-CE 3.24Å; E190-K194 WeakPolarHBondContact OE1-CE 3.23Å; E190-K194 IonicContact OE1-NZ 3.19Å; E190-K194 PolarHBondContact OE1-NZ 3.21Å; A191-K194 PolarHBondContact O-N 3.04Å; K194-E196 VanDerWaalsContact C-N 3.33Å; K194-E196 PolarHBondContact O-N 2.8Å; K194-E197 PolarHBondContact O-N 3.26Å; K194-E198 VanDerWaalsContact O-CB 3.22Å; K194-E198 WeakPolarHBondContact O-CB 3.49Å; K194-E198 PolarHBondContact O-N 3.25Å
195	L	82.9	Confident	82.9	Confident	120 Å²	120	116 Å²	116	63%	0.628	55%	0.55	S	S	*	.	H	α-helix	trans	-61.3	-39.4	173.9	-102.5	145	0	0	0	112.5	A191 R192 A199	A191-L195 WeakPolarHBondContact O-CB 3.33Å; A191-L195 PolarHBondContact O-N 3.28Å; R192-L195 PolarHBondContact O-N 3.06Å; L195-A199 VanDerWaalsContact O-CB 3.24Å; L195-A199 WeakPolarHBondContact O-CB 3.43Å; L195-A199 PolarHBondContact O-N 2.92Å
196	E	84.2	Confident	82.7	Confident	130 Å²	130	111.5 Å²	111.5	61%	0.607	54%	0.544	S	S	*	.	H	α-helix	trans	-72.5	-39.3	177	-169.3	170.9	-176.5	0	0	112.4	R192 R193 K194 R200	R192-E196 WeakPolarHBondContact O-CB 3.29Å; R192-E196 PolarHBondContact O-N 3.15Å; R193-E196 PolarHBondContact O-N 3.27Å; K194-E196 VanDerWaalsContact C-N 3.33Å; K194-E196 PolarHBondContact O-N 2.8Å; E196-R200 VanDerWaalsContact O-CB 3.23Å; E196-R200 WeakPolarHBondContact O-CB 3.45Å; E196-R200 PolarHBondContact O-N 3.36Å
197	E	81.2	Confident	82.2	Confident	95 Å²	95	114.9 Å²	114.9	44%	0.444	55%	0.554	S	S	.	*	H	α-helix	trans	-66.7	-37.9	174	-77.4	178.1	-176.2	0	0	111.7	R193 K194 R200 R201	R193-E197 HydrophobicContact CG-CG 4.41Å; R193-E197 IonicContact CZ-OE1 2.67Å; R193-E197 IonicContact NE-OE1 3.31Å; R193-E197 PolarHBondContact NE-OE1 3Å; R193-E197 IonicContact NH2-OE1 3.96Å; R193-E197 PolarHBondContact NH2-OE1 3.01Å; R193-E197 VanDerWaalsContact NH2-OE1 3.08Å; R193-E197 WeakPolarHBondContact O-CB 3.24Å; R193-E197 WeakPolarHBondContact O-CG 3.25Å; R193-E197 PolarHBondContact O-N 2.95Å; K194-E197 PolarHBondContact O-N 3.26Å; E197-R200 PolarHBondContact O-N 2.9Å; E197-R201 PolarHBondContact O-N 3.19Å
198	E	84.5	Confident	81.5	Confident	129 Å²	129	119.1 Å²	119.1	60%	0.603	56%	0.558	S	S	*	*	H	α-helix	trans	-70.4	-44.5	176.2	-165.4	174	-158.7	0	0	111.4	K194 R200 R201 V202	K194-E198 VanDerWaalsContact O-CB 3.22Å; K194-E198 WeakPolarHBondContact O-CB 3.49Å; K194-E198 PolarHBondContact O-N 3.25Å; E198-R200 VanDerWaalsContact C-N 3.27Å; E198-R200 PolarHBondContact O-N 3.24Å; E198-R201 PolarHBondContact O-N 2.98Å; E198-V202 WeakPolarHBondContact O-CG2 3.22Å; E198-V202 PolarHBondContact O-N 2.93Å
199	A	82.7	Confident	80.7	Confident	62 Å²	62	117.8 Å²	117.8	51%	0.512	55%	0.553	S	S	.	*	H	α-helix	trans	-61	-36.7	172.2	0	0	0	0	0	112	L195 A203	L195-A199 VanDerWaalsContact O-CB 3.24Å; L195-A199 WeakPolarHBondContact O-CB 3.43Å; L195-A199 PolarHBondContact O-N 2.92Å; A199-A203 WeakPolarHBondContact O-CB 3.48Å; A199-A203 PolarHBondContact O-N 2.96Å
200	R	81.9	Confident	80	Confident	180 Å²	180	115.2 Å²	115.2	68%	0.679	55%	0.55	S	S	*	*	H	α-helix	trans	-69.8	-40	175.1	-171.2	177.4	170.8	-156.4	-6.2	112	E196 E197 E198 A203 E204	E196-R200 VanDerWaalsContact O-CB 3.23Å; E196-R200 WeakPolarHBondContact O-CB 3.45Å; E196-R200 PolarHBondContact O-N 3.36Å; E197-R200 PolarHBondContact O-N 2.9Å; E198-R200 VanDerWaalsContact C-N 3.27Å; E198-R200 PolarHBondContact O-N 3.24Å; R200-A203 PolarHBondContact O-N 2.76Å; R200-E204 VanDerWaalsContact O-CB 3.31Å; R200-E204 WeakPolarHBondContact O-CB 3.3Å; R200-E204 PolarHBondContact O-N 2.86Å
201	R	83.7	Confident	79.1	Confident	181 Å²	181	116.6 Å²	116.6	68%	0.683	56%	0.557	S	S	*	*	H	α-helix	trans	-61.3	-46.6	173.1	-87.9	-174.9	73.3	-168.4	1.5	111.7	E197 E198 A203 E204 E205	E197-R201 PolarHBondContact O-N 3.19Å; E198-R201 PolarHBondContact O-N 2.98Å; R201-A203 VanDerWaalsContact C-N 3.32Å; R201-A203 PolarHBondContact O-N 3.5Å; R201-E204 PolarHBondContact O-N 3.38Å; R201-E205 VanDerWaalsContact O-CB 3.27Å; R201-E205 WeakPolarHBondContact O-CB 3.34Å; R201-E205 PolarHBondContact O-N 3.31Å
202	V	86.3	Confident	77.6	Confident	90 Å²	90	120.2 Å²	120.2	55%	0.545	57%	0.565	S	S	.	*	H	α-helix	trans	-63	-40.3	177.9	175.1	0	0	0	0	110.9	E198 A206	E198-V202 WeakPolarHBondContact O-CG2 3.22Å; E198-V202 PolarHBondContact O-N 2.93Å; V202-A206 WeakPolarHBondContact O-CB 3.39Å; V202-A206 PolarHBondContact O-N 3.06Å
203	A	79.4	Confident	76.3	Confident	56 Å²	56	117.8 Å²	117.8	46%	0.463	57%	0.566	S	S	.	*	H	α-helix	trans	-67.7	-36.3	175.9	0	0	0	0	0	113.1	A199 R200 R201 R207	A199-A203 WeakPolarHBondContact O-CB 3.48Å; A199-A203 PolarHBondContact O-N 2.96Å; R200-A203 PolarHBondContact O-N 2.76Å; R201-A203 VanDerWaalsContact C-N 3.32Å; R201-A203 PolarHBondContact O-N 3.5Å; A203-R207 WeakPolarHBondContact O-CB 3.5Å; A203-R207 WeakPolarHBondContact O-CG 3.14Å; A203-R207 PolarHBondContact O-N 2.91Å
204	E	79.8	Confident	74.4	Confident	122 Å²	122	118.7 Å²	118.7	57%	0.57	57%	0.574	S	S	*	*	H	α-helix	trans	-73.4	-37	176.9	-165.4	168	-155.9	0	0	111.7	R200 R201 R207 R208	R200-E204 VanDerWaalsContact O-CB 3.31Å; R200-E204 WeakPolarHBondContact O-CB 3.3Å; R200-E204 PolarHBondContact O-N 2.86Å; R201-E204 PolarHBondContact O-N 3.38Å; E204-R207 CarbonylContact O-C 3.54Å; E204-R207 WeakPolarHBondContact O-CB 3.42Å; E204-R207 PolarHBondContact O-N 3.37Å; E204-R208 WeakPolarHBondContact O-CB 3.38Å; E204-R208 PolarHBondContact O-N 3.2Å
205	E	76.3	Confident	71.8	Confident	88 Å²	88	124.4 Å²	124.4	41%	0.411	59%	0.592	S	S	.	*	H	α-helix	trans	-70.4	-38.7	174.7	-162.2	163.9	-142.7	0	0	111.7	R201 R207 R208 M209	R201-E205 VanDerWaalsContact O-CB 3.27Å; R201-E205 WeakPolarHBondContact O-CB 3.34Å; R201-E205 PolarHBondContact O-N 3.31Å; E205-R207 VanDerWaalsContact C-N 3.32Å; E205-R207 PolarHBondContact O-N 2.95Å; E205-R208 PolarHBondContact O-N 3.18Å; E205-M209 PolarHBondContact O-N 3.39Å
206	A	77.5	Confident	69.4	Low	53 Å²	53	123.7 Å²	123.7	44%	0.438	59%	0.593	S	S	.	*	H	α-helix	trans	-64.1	-36	169.7	0	0	0	0	0	112.2	V202 A210	V202-A206 WeakPolarHBondContact O-CB 3.39Å; V202-A206 PolarHBondContact O-N 3.06Å; A206-A210 VanDerWaalsContact O-CB 3.26Å; A206-A210 WeakPolarHBondContact O-CB 3.37Å; A206-A210 PolarHBondContact O-N 2.95Å
207	R	74	Confident	66.9	Low	182 Å²	182	124.4 Å²	124.4	69%	0.687	60%	0.601	S	S	*	*	H	α-helix	trans	-68.9	-40.7	171.8	-85.1	-176	132.1	-146.8	-6.1	112.3	A203 E204 E205 A210 E211	A203-R207 WeakPolarHBondContact O-CB 3.5Å; A203-R207 WeakPolarHBondContact O-CG 3.14Å; A203-R207 PolarHBondContact O-N 2.91Å; E204-R207 CarbonylContact O-C 3.54Å; E204-R207 WeakPolarHBondContact O-CB 3.42Å; E204-R207 PolarHBondContact O-N 3.37Å; E205-R207 VanDerWaalsContact C-N 3.32Å; E205-R207 PolarHBondContact O-N 2.95Å; R207-A210 CarbonylContact O-C 3.03Å; R207-A210 PolarHBondContact O-N 2.81Å; R207-E211 PolarHBondContact O-N 3.46Å
208	R	70.4	Confident	64.5	Low	145 Å²	145	128.5 Å²	128.5	55%	0.547	63%	0.626	S	S	.	*	H	α-helix	trans	-62.8	-47.2	176.8	-164	-174.9	77.1	-154.2	-5.5	110.8	E204 E205 A210 E211 E212	E204-R208 WeakPolarHBondContact O-CB 3.38Å; E204-R208 PolarHBondContact O-N 3.2Å; E205-R208 PolarHBondContact O-N 3.18Å; R208-A210 VanDerWaalsContact C-N 3.27Å; R208-A210 PolarHBondContact O-N 3.21Å; R208-E211 PolarHBondContact O-N 2.94Å; R208-E212 VanDerWaalsContact O-CB 3.3Å; R208-E212 WeakPolarHBondContact O-CB 3.32Å; R208-E212 PolarHBondContact O-N 3.04Å
209	M	68.7	Low	61.9	Low	111 Å²	111	125.5 Å²	125.5	55%	0.547	62%	0.624	S	S	.	*	H	α-helix	trans	-61.9	-34.9	174	-73.9	-155.5	-76.1	0	0	112.4	E205 N213	E205-M209 PolarHBondContact O-N 3.39Å; M209-N213 VanDerWaalsContact O-CB 3.31Å; M209-N213 WeakPolarHBondContact O-CB 3.38Å; M209-N213 PolarHBondContact O-N 2.99Å
210	A	65.9	Low	59.5	Low	55 Å²	55	131.6 Å²	131.6	46%	0.455	64%	0.641	S	S	.	*	H	α-helix	trans	-73.9	-25.5	176	0	0	0	0	0	114.1	A206 R207 R208 K214	A206-A210 VanDerWaalsContact O-CB 3.26Å; A206-A210 WeakPolarHBondContact O-CB 3.37Å; A206-A210 PolarHBondContact O-N 2.95Å; R207-A210 CarbonylContact O-C 3.03Å; R207-A210 PolarHBondContact O-N 2.81Å; R208-A210 VanDerWaalsContact C-N 3.27Å; R208-A210 PolarHBondContact O-N 3.21Å; A210-K214 WeakPolarHBondContact O-CG 3.09Å
211	E	64	Low	57.3	Low	136 Å²	136	128.7 Å²	128.7	64%	0.636	65%	0.646	S	S	*	*	H	α-helix	trans	-85.2	-37	173.7	-76	-175	166.5	0	0	112	R207 R208 K214	R207-E211 PolarHBondContact O-N 3.46Å; R208-E211 PolarHBondContact O-N 2.94Å; E211-K214 PolarHBondContact O-N 3.44Å; E211-K214 VanDerWaalsContact O-N 3.12Å
212	E	54.2	Low	55.1	Low	126 Å²	126	126.2 Å²	126.2	59%	0.589	65%	0.651	S	S	*	*	H	α-helix	trans	-66	-41.5	176.2	-160.8	167	-165.1	0	0	110.9	R208 K214 W215	R208-E212 VanDerWaalsContact O-CB 3.3Å; R208-E212 WeakPolarHBondContact O-CB 3.32Å; R208-E212 PolarHBondContact O-N 3.04Å; E212-K214 PolarHBondContact O-N 2.75Å; E212-K214 VanDerWaalsContact O-N 3.16Å; E212-W215 PolarHBondContact O-N 2.93Å
213	N	55.7	Low	52.8	Low	132 Å²	132	130.7 Å²	130.7	71%	0.706	67%	0.666	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.5	-5.6	172.9	-77.4	8.1	0	0	0	114.5	M209	M209-N213 VanDerWaalsContact O-CB 3.31Å; M209-N213 WeakPolarHBondContact O-CB 3.38Å; M209-N213 PolarHBondContact O-N 2.99Å
214	K	43.6	Very low	50.8	Low	181 Å²	181	135.3 Å²	135.3	79%	0.787	68%	0.683	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.4	-8.5	175.2	-86.5	-178.5	178.3	-178.1	0	113.9	A210 E211 E212	A210-K214 WeakPolarHBondContact O-CG 3.09Å; E211-K214 PolarHBondContact O-N 3.44Å; E211-K214 VanDerWaalsContact O-N 3.12Å; E212-K214 PolarHBondContact O-N 2.75Å; E212-K214 VanDerWaalsContact O-N 3.16Å
215	W	31.2	Very low	48.7	Very low	238 Å²	238	135.4 Å²	135.4	90%	0.902	70%	0.697	S	S	*	*	S	Bend	trans	-112.7	15.5	-177.2	-140	-24.8	0	0	0	115.5	E212	E212-W215 PolarHBondContact O-N 2.93Å
216	T	31.4	Very low	47	Very low	106 Å²	106	135.5 Å²	135.5	65%	0.65	71%	0.708	S	S	*	*	S	Bend	trans	-144.8	85.4	167.7	55.4	0	0	0	0	110
217	D	33	Very low	45.9	Very low	145 Å²	145	137.4 Å²	137.4	78%	0.775	71%	0.711	S	S	*	*			trans	178.9	82.2	132.9	-96.6	-17.8	0	0	0	109.4	A219	D217-A219 PolarHBondContact O-N 2.95Å
218	N	29.8	Very low	45.3	Very low	180 Å²	180	137 Å²	137	96%	0.963	71%	0.71	S	S	*	*			trans	-75.4	82.1	143.5	-88.9	-10.4	0	0	0	106.3
219	A	31.1	Very low	45.3	Very low	67 Å²	67	131.6 Å²	131.6	55%	0.554	69%	0.691	S	S	*	*			trans	-134.3	109	162.7	0	0	0	0	0	106.2	D217	D217-A219 PolarHBondContact O-N 2.95Å
220	E	31.2	Very low	45.5	Very low	189 Å²	189	132.9 Å²	132.9	88%	0.883	71%	0.705	S	S	*	*			trans	-55.6	124.8	179.7	-68.5	176.4	153.9	0	0	109.7	T222	E220-T222 PolarHBondContact O-N 3.29Å
221	P	36.4	Very low	45.6	Very low	119 Å²	119	132.6 Å²	132.6	77%	0.773	70%	0.697	S	S	*	*			trans	-73.3	115.1	173.9	28.5	-30.1	0	0	0	108.2	E223	P221-E223 PolarHBondContact O-N 3Å; P221-E223 VanDerWaalsContact O-N 3.11Å
222	T	37.6	Very low	46.2	Very low	129 Å²	129	132.7 Å²	132.7	79%	0.791	71%	0.708	S	S	*	*			trans	-64.6	106.8	164.6	44.2	0	0	0	0	108.1	E220 D224	E220-T222 PolarHBondContact O-N 3.29Å; T222-D224 PolarHBondContact O-N 3.47Å; T222-D224 VanDerWaalsContact O-N 3.16Å
223	E	36.7	Very low	47.2	Very low	185 Å²	185	129.8 Å²	129.8	86%	0.864	70%	0.701	S	S	*	*			trans	-63.5	108.6	172	-69.7	-177.7	160.3	0	0	109.2	P221 S225	P221-E223 PolarHBondContact O-N 3Å; P221-E223 VanDerWaalsContact O-N 3.11Å; E223-S225 PolarHBondContact O-N 2.91Å
224	D	37.5	Very low	48.2	Very low	152 Å²	152	131.3 Å²	131.3	81%	0.813	70%	0.704	S	S	*	*			trans	-65	101.8	165.8	-84.2	-34.2	0	0	0	108.4	T222 S226	T222-D224 PolarHBondContact O-N 3.47Å; T222-D224 VanDerWaalsContact O-N 3.16Å; D224-S226 PolarHBondContact O-N 2.93Å
225	S	37	Very low	49.7	Very low	124 Å²	124	130.2 Å²	130.2	87%	0.867	70%	0.702	S	S	*	*			trans	-75.4	64.5	174.3	-169.1	0	0	0	0	110.2	E223	E223-S225 PolarHBondContact O-N 2.91Å
226	S	39.7	Very low	52	Low	91 Å²	91	120.3 Å²	120.3	64%	0.636	67%	0.67	S	S	*	*			trans	-94.2	101.4	166.9	61.6	0	0	0	0	109.2	D224 Y228	D224-S226 PolarHBondContact O-N 2.93Å; S226-Y228 PolarHBondContact O-N 3.32Å
227	D	54.1	Low	54.4	Low	93 Å²	93	119 Å²	119	50%	0.497	65%	0.654	S	S	.	*			trans	-55.3	112.5	172.2	-176	5.6	0	0	0	110	H229 R237	D227-H229 IonicContact OD1-CD2 2.71Å; D227-H229 PolarHBondContact OD1-CD2 3.07Å; D227-H229 IonicContact OD1-CG 3.96Å; D227-H229 PolarHBondContact OD1-N 2.97Å; D227-R237 IonicContact OD1-NH1 3.21Å; D227-R237 IonicContact OD2-CZ 3.59Å; D227-R237 IonicContact OD2-NH1 3.92Å; D227-R237 PolarHBondContact OD2-NH1 3.44Å; D227-R237 IonicContact OD2-NH2 3.27Å; D227-R237 PolarHBondContact OD2-NH2 2.83Å
228	Y	62.6	Low	56.6	Low	172 Å²	172	118 Å²	118	68%	0.675	64%	0.644	S	S	*	*			trans	-95.2	9.9	-174	55.8	-95.7	0	0	0	113.9	S226	S226-Y228 PolarHBondContact O-N 3.32Å
229	H	70.7	Confident	59	Low	32 Å²	32	111.9 Å²	111.9	15%	0.148	62%	0.619	C	S	.	*			trans	-79.7	125.1	176.7	-64.5	-69.4	0	0	0	112.5	D227 T231 R237 E240 D241	D227-H229 IonicContact OD1-CD2 2.71Å; D227-H229 PolarHBondContact OD1-CD2 3.07Å; D227-H229 IonicContact OD1-CG 3.96Å; D227-H229 PolarHBondContact OD1-N 2.97Å; H229-T231 VanDerWaalsContact C-N 3.31Å; H229-T231 PolarHBondContact O-N 3.15Å; H229-R237 HydrophobicContact CB-CG 4.01Å; H229-E240 IonicContact CG-OE2 3.27Å; H229-E240 IonicContact ND1-OE2 3.43Å; H229-E240 PolarHBondContact ND1-OE2 3.08Å; H229-E240 VanDerWaalsContact ND1-OE2 3.07Å; H229-D241 IonicContact CE1-OD1 3.93Å; H229-D241 PolarHBondContact CE1-OD1 2.8Å; H229-D241 IonicContact NE2-OD1 3.02Å; H229-D241 PolarHBondContact NE2-OD1 3.01Å
230	V	72.2	Confident	61.4	Low	139 Å²	139	111.7 Å²	111.7	84%	0.842	61%	0.606	S	S	*	*			trans	-76	-20	-179.1	-177.7	0	0	0	0	112.1
231	T	67.6	Low	63.8	Low	48 Å²	48	105.5 Å²	105.5	29%	0.294	58%	0.579	S	S	.	*			trans	-103.7	145.2	-173.4	62.8	0	0	0	0	113.1	H229 R237 E240	H229-T231 VanDerWaalsContact C-N 3.31Å; H229-T231 PolarHBondContact O-N 3.15Å; T231-R237 PolarHBondContact O-NE 3.01Å; T231-E240 WeakPolarHBondContact CG2-OE1 3.27Å; T231-E240 PolarHBondContact OG1-OE1 3.29Å; T231-E240 VanDerWaalsContact OG1-OE1 3.07Å
232	T	76	Confident	65.8	Low	139 Å²	139	106.4 Å²	106.4	85%	0.853	57%	0.573	S	S	*	*			trans	-93.6	-14.5	-170.2	51.1	0	0	0	0	114.9
233	S	76.4	Confident	67.7	Low	65 Å²	65	103.5 Å²	103.5	46%	0.455	56%	0.558	S	S	.	*			trans	-90	135.5	-177.7	74.9	0	0	0	0	111.6	H235 A236 R237	S233-H235 VanDerWaalsContact C-N 3.27Å; S233-H235 PolarHBondContact O-N 3.27Å; S233-A236 PolarHBondContact O-N 3.38Å; S233-A236 VanDerWaalsContact O-N 3.1Å; S233-A236 WeakPolarHBondContact OG-CB 3.01Å; S233-A236 PolarHBondContact OG-N 3.32Å; S233-R237 PolarHBondContact O-N 2.83Å; S233-R237 VanDerWaalsContact O-N 3.16Å
234	Q	76	Confident	69.7	Low	163 Å²	163	98.5 Å²	98.5	76%	0.762	54%	0.537	S	S	*	.	H	α-helix	trans	-60.2	-35.1	-177.7	-73	-169.5	-10.5	0	0	113.2	Q238	Q234-Q238 PolarHBondContact O-N 3.16Å; Q234-Q238 VanDerWaalsContact O-N 3.13Å
235	H	76.3	Confident	71.5	Confident	159 Å²	159	100.3 Å²	100.3	74%	0.736	53%	0.533	S	S	*	.	H	α-helix	trans	-69.5	-33.5	176.5	-76.5	-51	0	0	0	112.9	S233 A239	S233-H235 VanDerWaalsContact C-N 3.27Å; S233-H235 PolarHBondContact O-N 3.27Å; H235-A239 PolarHBondContact O-N 2.94Å
236	A	78.2	Confident	73.2	Confident	30 Å²	30	101.8 Å²	101.8	25%	0.248	53%	0.526	C	S	.	.	H	α-helix	trans	-70.5	-41.5	176.1	0	0	0	0	0	111.4	S233 Q238 A239 E240	S233-A236 PolarHBondContact O-N 3.38Å; S233-A236 VanDerWaalsContact O-N 3.1Å; S233-A236 WeakPolarHBondContact OG-CB 3.01Å; S233-A236 PolarHBondContact OG-N 3.32Å; A236-Q238 PolarHBondContact O-N 3.45Å; A236-A239 PolarHBondContact O-N 3.44Å; A236-A239 VanDerWaalsContact O-N 3.17Å; A236-E240 PolarHBondContact O-N 3.43Å
237	R	82.5	Confident	74.8	Confident	79 Å²	79	103 Å²	103	30%	0.298	53%	0.53	S	S	.	.	H	α-helix	trans	-60.3	-44.6	175.4	-67.3	-179.7	176.3	-151.8	-12.3	112.5	D227 H229 T231 S233 A239 E240 D241	D227-R237 IonicContact OD1-NH1 3.21Å; D227-R237 IonicContact OD2-CZ 3.59Å; D227-R237 IonicContact OD2-NH1 3.92Å; D227-R237 PolarHBondContact OD2-NH1 3.44Å; D227-R237 IonicContact OD2-NH2 3.27Å; D227-R237 PolarHBondContact OD2-NH2 2.83Å; H229-R237 HydrophobicContact CB-CG 4.01Å; T231-R237 PolarHBondContact O-NE 3.01Å; S233-R237 PolarHBondContact O-N 2.83Å; S233-R237 VanDerWaalsContact O-N 3.16Å; R237-A239 VanDerWaalsContact C-N 3.29Å; R237-A239 PolarHBondContact O-N 2.94Å; R237-E240 PolarHBondContact O-N 3.35Å; R237-D241 WeakPolarHBondContact O-CB 3.28Å; R237-D241 PolarHBondContact O-N 3.34Å
238	Q	79.4	Confident	75.5	Confident	122 Å²	122	106 Å²	106	57%	0.57	54%	0.541	S	S	*	.	H	α-helix	trans	-62.2	-36.8	175.7	-78	178.4	-10.3	0	0	112.4	Q234 A236 E242	Q234-Q238 PolarHBondContact O-N 3.16Å; Q234-Q238 VanDerWaalsContact O-N 3.13Å; A236-Q238 PolarHBondContact O-N 3.45Å; Q238-E242 WeakPolarHBondContact O-CB 2.97Å; Q238-E242 PolarHBondContact O-N 2.88Å
239	A	80.5	Confident	74.8	Confident	52 Å²	52	100.1 Å²	100.1	43%	0.43	53%	0.532	S	S	.	.	H	α-helix	trans	-72.8	-36.2	177.4	0	0	0	0	0	113	H235 A236 R237 S243	H235-A239 PolarHBondContact O-N 2.94Å; A236-A239 PolarHBondContact O-N 3.44Å; A236-A239 VanDerWaalsContact O-N 3.17Å; R237-A239 VanDerWaalsContact C-N 3.29Å; R237-A239 PolarHBondContact O-N 2.94Å; A239-S243 WeakPolarHBondContact O-CB 3.34Å; A239-S243 PolarHBondContact O-N 3.22Å; A239-S243 PolarHBondContact O-OG 3.45Å
240	E	80.2	Confident	73.5	Confident	64 Å²	64	101.9 Å²	101.9	30%	0.299	56%	0.558	S	S	.	*	H	α-helix	trans	-63	-50.7	171.5	-75.8	176.1	-168.7	0	0	110.5	H229 T231 A236 R237 E242 S243 D244	H229-E240 IonicContact CG-OE2 3.27Å; H229-E240 IonicContact ND1-OE2 3.43Å; H229-E240 PolarHBondContact ND1-OE2 3.08Å; H229-E240 VanDerWaalsContact ND1-OE2 3.07Å; T231-E240 WeakPolarHBondContact CG2-OE1 3.27Å; T231-E240 PolarHBondContact OG1-OE1 3.29Å; T231-E240 VanDerWaalsContact OG1-OE1 3.07Å; A236-E240 PolarHBondContact O-N 3.43Å; R237-E240 PolarHBondContact O-N 3.35Å; E240-E242 VanDerWaalsContact C-N 3.3Å; E240-E242 PolarHBondContact O-N 3.29Å; E240-S243 PolarHBondContact O-N 3.35Å; E240-D244 PolarHBondContact O-N 3.44Å
241	D	82	Confident	72.2	Confident	58 Å²	58	106.9 Å²	106.9	31%	0.31	56%	0.562	S	S	.	*	H	α-helix	trans	-59.5	-38.7	176.6	-85.8	-17.1	0	0	0	112.9	H229 R237 R245	H229-D241 IonicContact CE1-OD1 3.93Å; H229-D241 PolarHBondContact CE1-OD1 2.8Å; H229-D241 IonicContact NE2-OD1 3.02Å; H229-D241 PolarHBondContact NE2-OD1 3.01Å; R237-D241 WeakPolarHBondContact O-CB 3.28Å; R237-D241 PolarHBondContact O-N 3.34Å; D241-R245 VanDerWaalsContact O-CB 3.26Å; D241-R245 WeakPolarHBondContact O-CB 3.35Å; D241-R245 VanDerWaalsContact O-CG 3.29Å; D241-R245 WeakPolarHBondContact O-CG 3.48Å; D241-R245 PolarHBondContact O-N 2.9Å
242	E	78.9	Confident	70.7	Confident	138 Å²	138	107.3 Å²	107.3	65%	0.645	58%	0.576	S	S	*	*	H	α-helix	trans	-71.6	-37.6	179	-162.7	164.5	-147.5	0	0	111.3	Q238 E240 E246	Q238-E242 WeakPolarHBondContact O-CB 2.97Å; Q238-E242 PolarHBondContact O-N 2.88Å; E240-E242 VanDerWaalsContact C-N 3.3Å; E240-E242 PolarHBondContact O-N 3.29Å; E242-E246 PolarHBondContact O-N 2.99Å
243	S	76.8	Confident	68.8	Low	68 Å²	68	113.2 Å²	113.2	48%	0.476	58%	0.583	S	S	.	*	H	α-helix	trans	-65.1	-47	171.5	-76.3	0	0	0	0	112.1	A239 E240 R245 E246 V247	A239-S243 WeakPolarHBondContact O-CB 3.34Å; A239-S243 PolarHBondContact O-N 3.22Å; A239-S243 PolarHBondContact O-OG 3.45Å; E240-S243 PolarHBondContact O-N 3.35Å; S243-R245 VanDerWaalsContact C-N 3.3Å; S243-R245 PolarHBondContact O-N 3.42Å; S243-E246 PolarHBondContact O-N 2.81Å; S243-E246 VanDerWaalsContact O-N 3.14Å; S243-V247 VanDerWaalsContact O-CG2 3.24Å; S243-V247 WeakPolarHBondContact O-CG2 3.25Å; S243-V247 PolarHBondContact O-N 3.07Å
244	D	79.1	Confident	66.7	Low	81 Å²	81	113 Å²	113	43%	0.433	59%	0.592	S	S	.	*	H	α-helix	trans	-62.5	-40.8	178.1	-75.9	-16	0	0	0	110.8	E240 E246 V247 E248	E240-D244 PolarHBondContact O-N 3.44Å; D244-E246 PolarHBondContact O-N 2.97Å; D244-V247 PolarHBondContact O-N 3.03Å; D244-E248 WeakPolarHBondContact O-CB 3.14Å; D244-E248 WeakPolarHBondContact O-CG 3.47Å; D244-E248 PolarHBondContact O-N 2.84Å
245	R	75.4	Confident	64.8	Low	190 Å²	190	117.5 Å²	117.5	72%	0.717	60%	0.601	S	S	*	*	H	α-helix	trans	-65	-33.6	173	-81.7	178.9	178.7	169.1	5.4	113.9	D241 S243 G249	D241-R245 VanDerWaalsContact O-CB 3.26Å; D241-R245 WeakPolarHBondContact O-CB 3.35Å; D241-R245 VanDerWaalsContact O-CG 3.29Å; D241-R245 WeakPolarHBondContact O-CG 3.48Å; D241-R245 PolarHBondContact O-N 2.9Å; S243-R245 VanDerWaalsContact C-N 3.3Å; S243-R245 PolarHBondContact O-N 3.42Å; R245-G249 WeakPolarHBondContact O-CA 3.23Å; R245-G249 PolarHBondContact O-N 2.6Å
246	E	71.9	Confident	62.7	Low	154 Å²	154	117.6 Å²	117.6	72%	0.72	61%	0.607	S	S	*	*	H	α-helix	trans	-70.6	-42.4	174	-83.9	-160.9	151.2	0	0	111.7	E242 S243 D244 G249 G250	E242-E246 PolarHBondContact O-N 2.99Å; S243-E246 PolarHBondContact O-N 2.81Å; S243-E246 VanDerWaalsContact O-N 3.14Å; D244-E246 PolarHBondContact O-N 2.97Å; E246-G249 PolarHBondContact O-N 3.25Å; E246-G250 PolarHBondContact O-N 2.87Å
247	V	73.4	Confident	60.4	Low	118 Å²	118	120.7 Å²	120.7	72%	0.715	63%	0.633	S	S	*	*	H	α-helix	trans	-65.7	-41.8	179.7	177.9	0	0	0	0	110.8	S243 D244	S243-V247 VanDerWaalsContact O-CG2 3.24Å; S243-V247 WeakPolarHBondContact O-CG2 3.25Å; S243-V247 PolarHBondContact O-N 3.07Å; D244-V247 PolarHBondContact O-N 3.03Å
248	E	68.3	Low	57.9	Low	156 Å²	156	126.5 Å²	126.5	73%	0.729	66%	0.66	S	S	*	*	H	α-helix	trans	-77.9	-35.9	174.8	-69	-164	148.7	0	0	112.9	D244 G250 R251	D244-E248 WeakPolarHBondContact O-CB 3.14Å; D244-E248 WeakPolarHBondContact O-CG 3.47Å; D244-E248 PolarHBondContact O-N 2.84Å; E248-G250 PolarHBondContact O-N 2.87Å; E248-R251 PolarHBondContact O-N 3.35Å; E248-R251 VanDerWaalsContact O-N 3.12Å
249	G	49.3	Very low	55.6	Low	48 Å²	48	125.5 Å²	125.5	50%	0.495	67%	0.673	S	S	.	*	H	α-helix	trans	-64.5	-21.4	-178	0	0	0	0	0	114.1	R245 E246 R251 G252	R245-G249 WeakPolarHBondContact O-CA 3.23Å; R245-G249 PolarHBondContact O-N 2.6Å; E246-G249 PolarHBondContact O-N 3.25Å; G249-R251 PolarHBondContact O-N 2.64Å; G249-R251 VanDerWaalsContact O-N 3.13Å; G249-G252 PolarHBondContact O-N 2.73Å
250	G	42.3	Very low	53.2	Low	68 Å²	68	127.6 Å²	127.6	70%	0.701	69%	0.69	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62	-13.9	172.1	0	0	0	0	0	114.8	E246 E248	E246-G250 PolarHBondContact O-N 2.87Å; E248-G250 PolarHBondContact O-N 2.87Å
251	R	46.5	Very low	50.6	Low	245 Å²	245	136.2 Å²	136.2	93%	0.925	72%	0.72	S	S	*	*	T	Hydrogen-bonded Turn	trans	-120.3	8.7	-178.2	-72.7	-176.7	173.6	170.6	0.2	115.3	E248 G249	E248-R251 PolarHBondContact O-N 3.35Å; E248-R251 VanDerWaalsContact O-N 3.12Å; G249-R251 PolarHBondContact O-N 2.64Å; G249-R251 VanDerWaalsContact O-N 3.13Å
252	G	36.4	Very low	48.1	Very low	57 Å²	57	139.6 Å²	139.6	59%	0.588	75%	0.745	S	S	*	*			trans	-137.2	55.9	-174.1	0	0	0	0	0	114.4	G249 G254	G249-G252 PolarHBondContact O-N 2.73Å; G252-G254 VanDerWaalsContact C-N 3.34Å; G252-G254 PolarHBondContact O-N 3.14Å
253	R	35.6	Very low	45.7	Very low	262 Å²	262	142.4 Å²	142.4	99%	0.989	76%	0.755	S	S	*	*			trans	-63.7	95.3	170.6	-117	-176.1	179.2	178.3	0.5	110.7
254	G	32.5	Very low	43.4	Very low	62 Å²	62	149 Å²	149	64%	0.639	78%	0.775	S	S	*	*			trans	60.4	89.6	134.7	0	0	0	0	0	117.7	G252 N256	G252-G254 VanDerWaalsContact C-N 3.34Å; G252-G254 PolarHBondContact O-N 3.14Å; G254-N256 VanDerWaalsContact C-N 3.33Å; G254-N256 PolarHBondContact O-N 3.37Å
255	R	35.5	Very low	41.1	Very low	257 Å²	257	148.6 Å²	148.6	97%	0.97	79%	0.789	S	S	*	*			trans	-89.5	77.8	145.5	-81.4	-176.1	172.1	164.7	-0.3	108.9	A257	R255-A257 PolarHBondContact O-N 3.27Å
256	N	32.1	Very low	39.2	Very low	161 Å²	161	146.9 Å²	146.9	86%	0.861	80%	0.795	S	S	*	*			trans	-65.2	116.3	159.6	-103.6	12.3	0	0	0	108.4	G254 K258	G254-N256 VanDerWaalsContact C-N 3.33Å; G254-N256 PolarHBondContact O-N 3.37Å; N256-K258 PolarHBondContact O-N 3.22Å
257	A	30.8	Very low	37.5	Very low	94 Å²	94	149.4 Å²	149.4	78%	0.777	80%	0.803	S	S	*	*			trans	-64.7	107.2	165.8	0	0	0	0	0	109.5	R255	R255-A257 PolarHBondContact O-N 3.27Å
258	K	29.9	Very low	35.7	Very low	202 Å²	202	151.7 Å²	151.7	88%	0.878	81%	0.806	S	S	*	*			trans	165.4	137.3	134.6	-94.3	168.9	179.7	173.4	0	111.1	N256	N256-K258 PolarHBondContact O-N 3.22Å
259	A	29.9	Very low	34.6	Very low	101 Å²	101	147.9 Å²	147.9	84%	0.835	80%	0.801	S	S	*	*			trans	84.9	121.3	154.5	0	0	0	0	0	119.8
260	A	31.3	Very low	34.7	Very low	96 Å²	96	154.1 Å²	154.1	79%	0.793	82%	0.817	S	S	*	*			trans	72.7	106.2	148.9	0	0	0	0	0	119.6
261	R	25.5	Very low	35	Very low	245 Å²	245	155.2 Å²	155.2	93%	0.925	81%	0.814	S	S	*	*			trans	-36.3	137.4	152.9	-68.3	168.3	134.8	-179	-3.3	111.7
262	P	28.8	Very low	35	Very low	128 Å²	128	151.4 Å²	151.4	83%	0.831	80%	0.804	S	S	*	*				-131.7	158	105.8	33.3	-21.9	0	0	0	113.9
263	K	29.3	Very low	35.6	Very low	198 Å²	198	151.5 Å²	151.5	86%	0.861	80%	0.8	S	S	*	*			trans	-63.6	141.5	-174.5	-74.3	174.5	171	173.8	0	113.5
264	K	27.2	Very low	36.5	Very low	207 Å²	207	145 Å²	145	90%	0.9	78%	0.784	S	S	*	*				51.1	103.4	126.2	-149.2	178	-170.7	-178.7	0	117.2
265	G	31.3	Very low	37.6	Very low	71 Å²	71	150.7 Å²	150.7	73%	0.732	79%	0.787	S	S	*	*			trans	-163.6	109.7	162	0	0	0	0	0	110.8	K267	G265-K267 PolarHBondContact O-N 3.43Å
266	N	34.8	Very low	38.3	Very low	155 Å²	155	145.3 Å²	145.3	83%	0.829	77%	0.773	S	S	*	*			trans	-45.8	127.8	180	-73.7	5.8	0	0	0	113.6
267	K	37.4	Very low	39.3	Very low	206 Å²	206	144.7 Å²	144.7	90%	0.896	76%	0.764	S	S	*	*			trans	-119.9	65.2	158	-72.1	-172	179.3	-177.8	0	109.7	G265	G265-K267 PolarHBondContact O-N 3.43Å
268	H	35.2	Very low	40.4	Very low	167 Å²	167	143.5 Å²	143.5	77%	0.773	76%	0.755	S	S	*	*			trans	-105.7	81.2	156.5	-129	-37.7	0	0	0	105.1
269	A	45.6	Very low	41.2	Very low	76 Å²	76	142.3 Å²	142.3	63%	0.628	75%	0.745	S	S	*	*			trans	-134.7	15.5	-171.1	0	0	0	0	0	114.5
270	E	50	Low	42.3	Very low	179 Å²	179	141 Å²	141	84%	0.836	73%	0.734	S	S	*	*	S	Bend	trans	-99.4	-24.4	173.4	-75.7	-178.4	158.8	0	0	113.5	K272	E270-K272 PolarHBondContact O-N 2.93Å
271	S	48.8	Very low	43.2	Very low	91 Å²	91	140.6 Å²	140.6	64%	0.636	73%	0.731	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.7	0.7	-178.2	54	0	0	0	0	115.6
272	K	46.7	Very low	44.3	Very low	164 Å²	164	134.9 Å²	134.9	71%	0.713	72%	0.723	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.8	-19.3	173.9	-86.9	-172.4	176.5	-178.4	0	114.1	E270 E276	E270-K272 PolarHBondContact O-N 2.93Å; K272-E276 PolarHBondContact O-N 3.03Å
273	A	49.6	Very low	44.9	Very low	59 Å²	59	140.2 Å²	140.2	49%	0.488	73%	0.726	S	S	.	*	H	α-helix	trans	-66.5	-46.5	-176.4	0	0	0	0	0	111.4	R275 E276 E277	A273-R275 VanDerWaalsContact C-N 3.3Å; A273-R275 PolarHBondContact O-N 3.06Å; A273-E276 PolarHBondContact O-N 2.77Å; A273-E277 PolarHBondContact O-N 2.81Å
274	D	54.3	Low	45.1	Very low	125 Å²	125	134.1 Å²	134.1	67%	0.668	72%	0.719	S	S	*	*	H	α-helix	trans	-66.9	-29.7	-176.9	-69.6	-32.2	0	0	0	113.6	A278	D274-A278 PolarHBondContact O-N 3.42Å
275	R	55.2	Low	45.5	Very low	182 Å²	182	127.8 Å²	127.8	69%	0.687	71%	0.713	S	S	*	*	H	α-helix	trans	-84.8	-21.9	-177.9	-154.8	169.3	-168.4	166.3	3.2	113.1	A273 R279	A273-R275 VanDerWaalsContact C-N 3.3Å; A273-R275 PolarHBondContact O-N 3.06Å; R275-R279 WeakPolarHBondContact O-CG 3.45Å
276	E	50.5	Low	45.6	Very low	145 Å²	145	134.8 Å²	134.8	68%	0.678	72%	0.723	S	S	*	*	H	α-helix	trans	-80	-37.2	173.7	-165.5	168	178.6	0	0	110.9	K272 A273 A278 R279 A280	K272-E276 PolarHBondContact O-N 3.03Å; A273-E276 PolarHBondContact O-N 2.77Å; E276-A278 PolarHBondContact O-N 2.82Å; E276-R279 PolarHBondContact O-N 3.18Å; E276-R279 VanDerWaalsContact O-N 3.13Å; E276-A280 PolarHBondContact O-N 2.9Å
277	E	53.1	Low	45.5	Very low	147 Å²	147	131.5 Å²	131.5	69%	0.687	73%	0.726	S	S	*	*	H	α-helix	trans	-64.5	-41.4	177.2	-165.3	167	-167.7	0	0	112.3	A273 R279 A280	A273-E277 PolarHBondContact O-N 2.81Å; E277-R279 VanDerWaalsContact C-N 3.25Å; E277-R279 PolarHBondContact O-N 3.46Å; E277-A280 PolarHBondContact O-N 3.36Å
278	A	54.4	Low	45.4	Very low	70 Å²	70	125 Å²	125	58%	0.579	72%	0.718	S	S	*	*	H	α-helix	trans	-66.7	-23.1	174.9	0	0	0	0	0	113.8	D274 E276	D274-A278 PolarHBondContact O-N 3.42Å; E276-A278 PolarHBondContact O-N 2.82Å
279	R	47.3	Very low	45.4	Very low	176 Å²	176	127.5 Å²	127.5	66%	0.664	73%	0.726	S	S	*	*	H	α-helix	trans	-91.1	-27.3	178.9	-76.6	-179.3	173.3	-175.6	-1.3	113.1	R275 E276 E277 A281	R275-R279 WeakPolarHBondContact O-CG 3.45Å; E276-R279 PolarHBondContact O-N 3.18Å; E276-R279 VanDerWaalsContact O-N 3.13Å; E277-R279 VanDerWaalsContact C-N 3.25Å; E277-R279 PolarHBondContact O-N 3.46Å; R279-A281 VanDerWaalsContact C-N 3.27Å; R279-A281 PolarHBondContact O-N 3.12Å
280	A	51.4	Low	45.3	Very low	75 Å²	75	135.5 Å²	135.5	62%	0.62	74%	0.74	S	S	*	*	H	α-helix	trans	-65.9	-30.6	176.3	0	0	0	0	0	112.3	E276 E277 V282	E276-A280 PolarHBondContact O-N 2.9Å; E277-A280 PolarHBondContact O-N 3.36Å; A280-V282 PolarHBondContact O-N 2.84Å
281	A	51.5	Low	44.7	Very low	86 Å²	86	136.8 Å²	136.8	71%	0.711	74%	0.743	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.7	-23.6	-176.7	0	0	0	0	0	114.8	R279	R279-A281 VanDerWaalsContact C-N 3.27Å; R279-A281 PolarHBondContact O-N 3.12Å
282	V	48.9	Very low	44.3	Very low	125 Å²	125	136.3 Å²	136.3	76%	0.758	75%	0.752	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107.4	-12.1	-167.6	-174	0	0	0	0	113.8	A280	A280-V282 PolarHBondContact O-N 2.84Å
283	R	41.3	Very low	44.5	Very low	241 Å²	241	133.2 Å²	133.2	91%	0.909	75%	0.751	S	S	*	*	S	Bend	trans	-122.1	25.2	-172	-94.3	-173.9	171.5	178.8	-1.7	116.7
284	G	32.6	Very low	44.6	Very low	69 Å²	69	136.3 Å²	136.3	71%	0.711	77%	0.77	S	S	*	*			trans	-118.9	52	-177.8	0	0	0	0	0	115.2
285	G	36.4	Very low	44.6	Very low	75 Å²	75	136.8 Å²	136.8	77%	0.773	77%	0.771	S	S	*	*			trans	-64.7	131.1	163.7	0	0	0	0	0	111.6
286	K	33.6	Very low	44.4	Very low	217 Å²	217	137.3 Å²	137.3	94%	0.943	78%	0.781	S	S	*	*	S	Bend	trans	58.1	91.1	150.4	-141.6	174.4	-172.1	176.5	0	117.1
287	G	32.4	Very low	44.5	Very low	86 Å²	86	138.6 Å²	138.6	89%	0.887	79%	0.787	S	S	*	*			trans	135	79.3	154	0	0	0	0	0	115.4
288	G	35.1	Very low	44.5	Very low	70 Å²	70	134.9 Å²	134.9	72%	0.722	79%	0.789	S	S	*	*			trans	178	82.5	169	0	0	0	0	0	112.2	R290	G288-R290 VanDerWaalsContact C-N 3.32Å; G288-R290 PolarHBondContact O-N 2.89Å
289	K	34.5	Very low	45.3	Very low	220 Å²	220	140 Å²	140	96%	0.957	80%	0.798	S	S	*	*			trans	-56.9	94.8	165.6	-82	175	176.1	174	0	108.9
290	R	42.9	Very low	45.6	Very low	244 Å²	244	140.3 Å²	140.3	92%	0.921	81%	0.807	S	S	*	*			trans	-97.6	110.9	158.2	-78.3	-171.4	175.1	176	0.1	107.8	G288	G288-R290 VanDerWaalsContact C-N 3.32Å; G288-R290 PolarHBondContact O-N 2.89Å
291	K	38.7	Very low	46.5	Very low	206 Å²	206	144.9 Å²	144.9	90%	0.896	81%	0.813	S	S	*	*			trans	-36.1	133.9	172	-100.2	172.5	165.3	177.8	0	111.5	S293	K291-S293 PolarHBondContact O-N 3.21Å
292	G	39.4	Very low	46.4	Very low	80 Å²	80	145.9 Å²	145.9	83%	0.825	81%	0.813	S	S	*	*			trans	-59.2	122.2	172.2	0	0	0	0	0	111.5
293	S	50.9	Low	47	Very low	99 Å²	99	144.9 Å²	144.9	69%	0.692	82%	0.817	S	S	*	*			trans	-94.7	99.9	150.1	61.4	0	0	0	0	106.4	K291 L295	K291-S293 PolarHBondContact O-N 3.21Å; S293-L295 PolarHBondContact O-N 2.75Å
294	S	52.9	Low	47.9	Very low	125 Å²	125	141.5 Å²	141.5	87%	0.874	81%	0.812	S	S	*	*			trans	-69	39.7	174	59.7	0	0	0	0	112.5
295	L	53.2	Low	49.5	Very low	135 Å²	135	142.1 Å²	142.1	71%	0.707	81%	0.81	S	S	*	*			trans	-136.2	44.4	-175.3	-141.3	78.4	0	0	0	111	S293 Q297	S293-L295 PolarHBondContact O-N 2.75Å; L295-Q297 PolarHBondContact O-N 2.88Å; L295-Q297 VanDerWaalsContact O-N 3.16Å
296	Q	50.9	Low	51.3	Low	192 Å²	192	143.1 Å²	143.1	90%	0.897	80%	0.801	S	S	*	*			trans	-78.3	81.6	156.4	-91.1	178	-39.8	0	0	107.5	G298	Q296-G298 VanDerWaalsContact C-N 3.27Å; Q296-G298 PolarHBondContact O-N 3.25Å
297	Q	53.3	Low	53.4	Low	172 Å²	172	138.2 Å²	138.2	80%	0.804	79%	0.785	S	S	*	*			trans	-67.2	95.2	159.1	-78.1	-179	-16.6	0	0	106.9	L295 F299	L295-Q297 PolarHBondContact O-N 2.88Å; L295-Q297 VanDerWaalsContact O-N 3.16Å; Q297-F299 PolarHBondContact O-N 2.9Å
298	G	52.6	Low	55.7	Low	69 Å²	69	139.4 Å²	139.4	71%	0.711	76%	0.763	S	S	*	*			trans	-63.2	101	170	0	0	0	0	0	108.9	Q296 Q300	Q296-G298 VanDerWaalsContact C-N 3.27Å; Q296-G298 PolarHBondContact O-N 3.25Å; G298-Q300 VanDerWaalsContact C-N 3.31Å; G298-Q300 PolarHBondContact O-N 3.33Å
299	F	70.8	Confident	58.1	Low	177 Å²	177	140.9 Å²	140.9	78%	0.776	75%	0.754	S	S	*	*			trans	-67.6	89.2	173.3	-178.1	-100.9	0	0	0	109.2	Q297 K301	Q297-F299 PolarHBondContact O-N 2.9Å; F299-K301 HydrophobicContact CD1-CB 4.35Å; F299-K301 HydrophobicContact CE1-CB 3.85Å; F299-K301 HydrophobicContact CE1-CD 4.42Å; F299-K301 HydrophobicContact CE1-CG 4.09Å; F299-K301 PolarHBondContact O-N 3.33Å
300	Q	54	Low	60.7	Low	183 Å²	183	130.4 Å²	130.4	86%	0.855	71%	0.709	S	S	*	*			trans	-77.7	98.8	167.1	-95.3	172.7	-22.3	0	0	108.2	G298 P302	G298-Q300 VanDerWaalsContact C-N 3.31Å; G298-Q300 PolarHBondContact O-N 3.33Å; Q300-P302 VanDerWaalsContact O-CD 3.31Å; Q300-P302 WeakPolarHBondContact O-CD 3.4Å
301	K	69.9	Low	62.7	Low	171 Å²	171	121.9 Å²	121.9	74%	0.743	68%	0.683	S	S	*	*			trans	-64.6	118.2	170.8	-162.4	176.9	-176.1	-178.7	0	108	F299 A303	F299-K301 HydrophobicContact CD1-CB 4.35Å; F299-K301 HydrophobicContact CE1-CB 3.85Å; F299-K301 HydrophobicContact CE1-CD 4.42Å; F299-K301 HydrophobicContact CE1-CG 4.09Å; F299-K301 PolarHBondContact O-N 3.33Å; K301-A303 PolarHBondContact O-N 2.64Å; K301-A303 VanDerWaalsContact O-N 3.08Å
302	P	49.5	Very low	64.9	Low	108 Å²	108	112 Å²	112	70%	0.701	64%	0.641	S	S	*	*			trans	-67.9	111.2	179.1	25.8	-31.3	0	0	0	108.8	Q300 Q304	Q300-P302 VanDerWaalsContact O-CD 3.31Å; Q300-P302 WeakPolarHBondContact O-CD 3.4Å; P302-Q304 PolarHBondContact O-N 3.05Å; P302-Q304 VanDerWaalsContact O-N 3.11Å
303	A	61.7	Low	66.9	Low	103 Å²	103	108.7 Å²	108.7	85%	0.851	61%	0.606	S	S	*	*			trans	-73.8	97	168.8	0	0	0	0	0	107.5	K301	K301-A303 PolarHBondContact O-N 2.64Å; K301-A303 VanDerWaalsContact O-N 3.08Å
304	Q	61.6	Low	68.3	Low	171 Å²	171	106.9 Å²	106.9	80%	0.799	59%	0.587	S	S	*	*			trans	-64.3	135.3	170.3	-72.3	-178.3	-5.5	0	0	109	P302 V306	P302-Q304 PolarHBondContact O-N 3.05Å; P302-Q304 VanDerWaalsContact O-N 3.11Å; Q304-V306 PolarHBondContact O-N 2.95Å
305	A	65.9	Low	69.6	Low	82 Å²	82	103.4 Å²	103.4	68%	0.678	56%	0.56	S	S	*	*			trans	-59.7	123.9	175.3	0	0	0	0	0	109.4	N307	A305-N307 PolarHBondContact O-N 2.78Å
306	V	73.7	Confident	71.2	Confident	95 Å²	95	97.2 Å²	97.2	58%	0.576	53%	0.528	S	S	*	.			trans	-87.9	98.3	-179.8	-178.1	0	0	0	0	108.1	Q304 R308 H363	Q304-V306 PolarHBondContact O-N 2.95Å; V306-R308 HydrophobicContact CG1-CG 4.14Å; V306-R308 PolarHBondContact O-N 2.6Å; V306-H363 PolarHBondContact O-CE1 2.75Å
307	N	78.4	Confident	73.1	Confident	115 Å²	115	89.6 Å²	89.6	62%	0.615	50%	0.495	S	S	*	.			trans	-72.5	121.7	176.7	-60.3	-2.9	0	0	0	108.9	A305 G362	A305-N307 PolarHBondContact O-N 2.78Å; N307-G362 PolarHBondContact OD1-O 3.2Å
308	R	80.6	Confident	74.8	Confident	110 Å²	110	81.4 Å²	81.4	42%	0.415	46%	0.456	S	S	.	.			trans	-122.9	154.6	177.1	-69.6	-169.2	176.1	138.3	-7.4	110.3	V306 M325 H363 K364	V306-R308 HydrophobicContact CG1-CG 4.14Å; V306-R308 PolarHBondContact O-N 2.6Å; R308-M325 PolarHBondContact NH1-O 2.91Å; R308-M325 VanDerWaalsContact NH1-O 3.11Å; R308-H363 PolarHBondContact N-ND1 3.32Å; R308-H363 WeakPolarHBondContact O-CB 3.41Å; R308-K364 PolarHBondContact O-N 2.91Å
309	D	85.5	Confident	76.6	Confident	101 Å²	101	78.8 Å²	78.8	54%	0.54	43%	0.429	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	112.1	170	-62.8	-12.8	0	0	0	108.3	K364 I366	D309-K364 CarbonylContact C-O 3.52Å; D309-K364 VanDerWaalsContact CA-O 3.31Å; D309-K364 WeakPolarHBondContact CA-O 3.32Å; D309-K364 WeakPolarHBondContact OD1-CB 3.24Å; D309-I366 HydrophobicContact CB-CD1 3.92Å; D309-I366 HydrophobicContact CB-CG1 4.41Å
310	V	87.5	Confident	77.5	Confident	1 Å²	1	74.7 Å²	74.7	1%	0.006	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	115.2	-178.7	179.5	0	0	0	0	107.9	I312 L321 K324 M325 H363 K364 I366	V310-I312 HydrophobicContact CG1-CD1 4.2Å; V310-I312 HydrophobicContact CG1-CG1 3.75Å; V310-I312 PolarHBondContact O-N 2.87Å; V310-L321 HydrophobicContact CG1-CD1 3.89Å; V310-K324 HydrophobicContact CG1-CB 3.94Å; V310-K324 HydrophobicContact CG1-CD 4.41Å; V310-M325 HydrophobicContact CG2-CG 3.62Å; V310-H363 HydrophobicContact CG2-CB 3.67Å; V310-K364 PolarHBondContact N-O 3.09Å; V310-I366 PolarHBondContact O-N 2.86Å
311	V	85.1	Confident	79.3	Confident	64 Å²	64	66 Å²	66	39%	0.388	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	114.2	174.2	-175.4	0	0	0	0	109	K324 I366 R368	V311-K324 WeakPolarHBondContact O-CD 3.39Å; V311-K324 WeakPolarHBondContact O-CE 3.48Å; V311-K324 PolarHBondContact O-NZ 2.96Å; V311-I366 WeakPolarHBondContact CA-O 3.38Å; V311-R368 HydrophobicContact CG1-CB 3.8Å
312	I	86	Confident	80.3	Confident	0 Å²	0	58 Å²	58	0%	0	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	122.2	-179.1	-54.3	-175	0	0	0	108.8	V310 I316 L321 Q351 A354 A358 V365 I366 R368	V310-I312 HydrophobicContact CG1-CD1 4.2Å; V310-I312 HydrophobicContact CG1-CG1 3.75Å; V310-I312 PolarHBondContact O-N 2.87Å; I312-I316 HydrophobicContact CG2-CG2 4.34Å; I312-L321 HydrophobicContact CD1-CD1 4.09Å; I312-L321 HydrophobicContact CG1-CD1 4.39Å; I312-Q351 HydrophobicContact CG2-CG 4.12Å; I312-Q351 PolarHBondContact O-NE2 3.29Å; I312-A354 HydrophobicContact CD1-CB 4.07Å; I312-A354 HydrophobicContact CG2-CB 3.8Å; I312-A358 HydrophobicContact CD1-CB 4.09Å; I312-V365 HydrophobicContact CB-CG1 4.24Å; I312-V365 HydrophobicContact CD1-CB 4.37Å; I312-V365 HydrophobicContact CD1-CG1 3.51Å; I312-V365 HydrophobicContact CD1-CG2 3.95Å; I312-V365 HydrophobicContact CG1-CG1 3.86Å; I312-I366 PolarHBondContact N-O 2.99Å; I312-R368 PolarHBondContact O-N 2.78Å
313	G	81.9	Confident	82.3	Confident	10 Å²	10	58.9 Å²	58.9	10%	0.103	34%	0.336	C	S	.	.			trans	-79.1	-165.6	171.6	0	0	0	0	0	111.6	Q351	G313-Q351 WeakPolarHBondContact O-CB 3.43Å; G313-Q351 WeakPolarHBondContact O-CG 3.36Å; G313-Q351 PolarHBondContact O-NE2 3.45Å
314	E	78.8	Confident	83.6	Confident	61 Å²	61	58.3 Å²	58.3	29%	0.285	32%	0.315	S	S	.	.	S	Bend	trans	-68.4	-35.8	177.2	-68.2	-171.6	-176.5	0	0	113.1	Q351 N371 K660	E314-Q351 WeakPolarHBondContact O-CB 3.2Å; E314-Q351 PolarHBondContact O-N 3.14Å; E314-N371 PolarHBondContact OE1-ND2 3.26Å; E314-N371 PolarHBondContact OE1-OD1 3.45Å; E314-K660 VanDerWaalsContact CD-NZ 3.31Å; E314-K660 IonicContact OE1-NZ 3.05Å; E314-K660 WeakPolarHBondContact OE2-CE 3.35Å; E314-K660 IonicContact OE2-NZ 3.93Å; E314-K660 PolarHBondContact OE2-NZ 3.46Å
315	T	80.9	Confident	84.8	Confident	52 Å²	52	50.4 Å²	50.4	32%	0.319	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	142.8	175.4	49.7	0	0	0	0	109.7	V348	T315-V348 HydrophobicContact CG2-CG1 4.13Å
316	I	87.6	Confident	85.8	Confident	4 Å²	4	49.7 Å²	49.7	2%	0.021	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.4	145.5	176.2	-166.9	168.8	0	0	0	110.1	I312 E320 L321 K324 I349 A354	I312-I316 HydrophobicContact CG2-CG2 4.34Å; I316-E320 HydrophobicContact CD1-CB 4.15Å; I316-E320 HydrophobicContact CG1-CB 3.75Å; I316-L321 HydrophobicContact CD1-CB 4.01Å; I316-L321 HydrophobicContact CD1-CD1 4.2Å; I316-L321 HydrophobicContact CG1-CB 4.35Å; I316-L321 HydrophobicContact CG2-CB 4.3Å; I316-K324 HydrophobicContact CD1-CD 3.8Å; I316-I349 HydrophobicContact CG2-CD1 4.17Å; I316-I349 HydrophobicContact CG2-CG1 3.81Å; I316-I349 PolarHBondContact N-O 2.87Å; I316-I349 WeakPolarHBondContact O-CG1 3.41Å; I316-I349 PolarHBondContact O-N 3.2Å; I316-A354 HydrophobicContact CG2-CB 3.58Å
317	T	89.6	Confident	86.5	Confident	33 Å²	33	46.3 Å²	46.3	20%	0.202	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	151.5	170.6	61.6	0	0	0	0	111.3	G319 E320 L321 Q347 V348	T317-G319 PolarHBondContact O-N 3.43Å; T317-E320 PolarHBondContact N-OE2 3.02Å; T317-E320 VanDerWaalsContact N-OE2 3.15Å; T317-E320 PolarHBondContact O-N 2.89Å; T317-E320 VanDerWaalsContact OG1-CB 3.25Å; T317-E320 WeakPolarHBondContact OG1-CB 3.42Å; T317-E320 WeakPolarHBondContact OG1-CG 3.25Å; T317-E320 PolarHBondContact OG1-N 3.43Å; T317-E320 PolarHBondContact OG1-OE2 3.34Å; T317-L321 WeakPolarHBondContact O-CB 3.28Å; T317-L321 PolarHBondContact O-N 3.48Å; T317-Q347 WeakPolarHBondContact CA-O 3.32Å; T317-V348 HydrophobicContact CG2-CG2 4.02Å
318	V	90	Very high	87.2	Confident	0 Å²	0	48.4 Å²	48.4	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-57.6	-36	174	176.5	0	0	0	0	111.2	A322 V332 I333 M336 A343 Q347 I349	V318-A322 VanDerWaalsContact O-CB 3.24Å; V318-A322 WeakPolarHBondContact O-CB 3.41Å; V318-A322 PolarHBondContact O-N 3.03Å; V318-V332 HydrophobicContact CG1-CB 4.14Å; V318-V332 HydrophobicContact CG1-CG1 3.85Å; V318-I333 HydrophobicContact CG1-CG1 3.99Å; V318-M336 HydrophobicContact CG2-SD 3.79Å; V318-A343 HydrophobicContact CG2-CB 4.08Å; V318-Q347 PolarHBondContact N-O 3.42Å; V318-I349 HydrophobicContact CG2-CD1 4.33Å; V318-I349 HydrophobicContact CG2-CG2 4.01Å
319	G	90.3	Very high	87.5	Confident	14 Å²	14	44 Å²	44	14%	0.144	24%	0.244	C	C	.	.	H	α-helix	trans	-64.7	-44.7	175.1	0	0	0	0	0	113.6	T317 A322 N323 I345	T317-G319 PolarHBondContact O-N 3.43Å; G319-A322 WeakPolarHBondContact O-CB 3.1Å; G319-A322 PolarHBondContact O-N 3.27Å; G319-N323 VanDerWaalsContact O-CG 3.24Å; G319-N323 PolarHBondContact O-N 2.94Å; G319-N323 PolarHBondContact O-ND2 3.05Å; G319-I345 PolarHBondContact N-O 3.12Å
320	E	89.7	Confident	87.8	Confident	91 Å²	91	42.4 Å²	42.4	43%	0.425	24%	0.241	S	C	.	.	H	α-helix	trans	-69.1	-39.7	175.6	-73.6	162.4	159.7	0	0	112.3	I316 T317 A322 N323 K324	I316-E320 HydrophobicContact CD1-CB 4.15Å; I316-E320 HydrophobicContact CG1-CB 3.75Å; T317-E320 PolarHBondContact N-OE2 3.02Å; T317-E320 VanDerWaalsContact N-OE2 3.15Å; T317-E320 PolarHBondContact O-N 2.89Å; T317-E320 VanDerWaalsContact OG1-CB 3.25Å; T317-E320 WeakPolarHBondContact OG1-CB 3.42Å; T317-E320 WeakPolarHBondContact OG1-CG 3.25Å; T317-E320 PolarHBondContact OG1-N 3.43Å; T317-E320 PolarHBondContact OG1-OE2 3.34Å; E320-A322 VanDerWaalsContact C-N 3.28Å; E320-A322 PolarHBondContact O-N 3.3Å; E320-N323 PolarHBondContact O-N 3.42Å; E320-N323 VanDerWaalsContact O-N 3.16Å; E320-K324 WeakPolarHBondContact O-CG 3.43Å; E320-K324 PolarHBondContact O-N 3.4Å
321	L	91	Very high	87.9	Confident	0 Å²	0	47.1 Å²	47.1	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-59.4	-45	174.4	-176.1	64.6	0	0	0	110	V310 I312 I316 T317 N323 K324 M325 V332 I349 A354 V357	V310-L321 HydrophobicContact CG1-CD1 3.89Å; I312-L321 HydrophobicContact CD1-CD1 4.09Å; I312-L321 HydrophobicContact CG1-CD1 4.39Å; I316-L321 HydrophobicContact CD1-CB 4.01Å; I316-L321 HydrophobicContact CD1-CD1 4.2Å; I316-L321 HydrophobicContact CG1-CB 4.35Å; I316-L321 HydrophobicContact CG2-CB 4.3Å; T317-L321 WeakPolarHBondContact O-CB 3.28Å; T317-L321 PolarHBondContact O-N 3.48Å; L321-N323 VanDerWaalsContact C-N 3.34Å; L321-N323 PolarHBondContact O-N 3.45Å; L321-K324 PolarHBondContact O-N 2.91Å; L321-M325 HydrophobicContact CD2-CE 4.34Å; L321-M325 HydrophobicContact CG-CE 3.84Å; L321-M325 HydrophobicContact CG-SD 4.41Å; L321-M325 WeakPolarHBondContact O-CG 3.31Å; L321-M325 PolarHBondContact O-N 3.34Å; L321-V332 HydrophobicContact CD2-CG1 4.23Å; L321-I349 HydrophobicContact CD2-CD1 3.68Å; L321-A354 HydrophobicContact CD2-CB 4.24Å; L321-V357 HydrophobicContact CD2-CB 4.2Å; L321-V357 HydrophobicContact CD2-CG1 3.95Å
322	A	91.3	Very high	88.1	Confident	2 Å²	2	44.1 Å²	44.1	2%	0.017	25%	0.245	C	C	.	.	H	α-helix	trans	-59.2	-43.9	174.2	0	0	0	0	0	112	V318 G319 E320 M325 A326 V327 V332	V318-A322 VanDerWaalsContact O-CB 3.24Å; V318-A322 WeakPolarHBondContact O-CB 3.41Å; V318-A322 PolarHBondContact O-N 3.03Å; G319-A322 WeakPolarHBondContact O-CB 3.1Å; G319-A322 PolarHBondContact O-N 3.27Å; E320-A322 VanDerWaalsContact C-N 3.28Å; E320-A322 PolarHBondContact O-N 3.3Å; A322-M325 CarbonylContact O-C 3.38Å; A322-M325 PolarHBondContact O-N 2.92Å; A322-A326 CarbonylContact O-C 3.5Å; A322-A326 VanDerWaalsContact O-CA 3.29Å; A322-A326 WeakPolarHBondContact O-CA 3.42Å; A322-A326 PolarHBondContact O-N 3.32Å; A322-V327 CarbonylContact C-O 3.43Å; A322-V327 WeakPolarHBondContact CB-O 3.25Å; A322-V327 PolarHBondContact O-N 3.26Å; A322-V327 VanDerWaalsContact O-O 3.1Å; A322-V332 HydrophobicContact CB-CB 4.49Å; A322-V332 HydrophobicContact CB-CG2 3.62Å
323	N	91.4	Very high	88.2	Confident	127 Å²	127	45.4 Å²	45.4	68%	0.679	25%	0.251	S	S	*	.	H	α-helix	trans	-64.6	-42.4	176.9	-72.3	-20.6	0	0	0	112.6	G319 E320 L321 M325 A326	G319-N323 VanDerWaalsContact O-CG 3.24Å; G319-N323 PolarHBondContact O-N 2.94Å; G319-N323 PolarHBondContact O-ND2 3.05Å; E320-N323 PolarHBondContact O-N 3.42Å; E320-N323 VanDerWaalsContact O-N 3.16Å; L321-N323 VanDerWaalsContact C-N 3.34Å; L321-N323 PolarHBondContact O-N 3.45Å; N323-M325 VanDerWaalsContact C-N 3.3Å; N323-M325 PolarHBondContact O-N 2.91Å; N323-A326 WeakPolarHBondContact O-CA 3.46Å; N323-A326 PolarHBondContact O-N 3.25Å
324	K	88.9	Confident	88.7	Confident	92 Å²	92	51.5 Å²	51.5	40%	0.4	28%	0.275	S	S	.	.	H	α-helix	trans	-64.8	-33.8	176.6	-70.9	-176.3	-178.5	172.4	0	112.2	V310 V311 I316 E320 L321 A326	V310-K324 HydrophobicContact CG1-CB 3.94Å; V310-K324 HydrophobicContact CG1-CD 4.41Å; V311-K324 WeakPolarHBondContact O-CD 3.39Å; V311-K324 WeakPolarHBondContact O-CE 3.48Å; V311-K324 PolarHBondContact O-NZ 2.96Å; I316-K324 HydrophobicContact CD1-CD 3.8Å; E320-K324 WeakPolarHBondContact O-CG 3.43Å; E320-K324 PolarHBondContact O-N 3.4Å; L321-K324 PolarHBondContact O-N 2.91Å; K324-A326 VanDerWaalsContact C-N 3.29Å
325	M	87.2	Confident	89.2	Confident	4 Å²	4	48.9 Å²	48.9	2%	0.02	26%	0.264	C	S	.	.	H	α-helix	trans	-77.4	-15	170.7	-65.9	-176	-55	0	0	112.8	R308 V310 L321 A322 N323 V327 V332 A358 M361 H363	R308-M325 PolarHBondContact NH1-O 2.91Å; R308-M325 VanDerWaalsContact NH1-O 3.11Å; V310-M325 HydrophobicContact CG2-CG 3.62Å; L321-M325 HydrophobicContact CD2-CE 4.34Å; L321-M325 HydrophobicContact CG-CE 3.84Å; L321-M325 HydrophobicContact CG-SD 4.41Å; L321-M325 WeakPolarHBondContact O-CG 3.31Å; L321-M325 PolarHBondContact O-N 3.34Å; A322-M325 CarbonylContact O-C 3.38Å; A322-M325 PolarHBondContact O-N 2.92Å; N323-M325 VanDerWaalsContact C-N 3.3Å; N323-M325 PolarHBondContact O-N 2.91Å; M325-V327 HydrophobicContact CB-CB 4.02Å; M325-V327 HydrophobicContact CB-CG2 3.8Å; M325-V327 PolarHBondContact O-N 3.22Å; M325-V332 HydrophobicContact CE-CB 4.36Å; M325-V332 HydrophobicContact CE-CG1 4.1Å; M325-V332 HydrophobicContact CE-CG2 3.34Å; M325-A358 HydrophobicContact SD-CB 4.29Å; M325-M361 HydrophobicContact SD-CB 4.37Å; M325-H363 PolarHBondContact SD-CD2 3.27Å
326	A	86.3	Confident	89.4	Confident	68 Å²	68	46.6 Å²	46.6	56%	0.562	25%	0.25	S	C	*	.	T	Hydrogen-bonded Turn	trans	40.9	42.5	-157.4	0	0	0	0	0	114.1	A322 N323 K324	A322-A326 CarbonylContact O-C 3.5Å; A322-A326 VanDerWaalsContact O-CA 3.29Å; A322-A326 WeakPolarHBondContact O-CA 3.42Å; A322-A326 PolarHBondContact O-N 3.32Å; N323-A326 WeakPolarHBondContact O-CA 3.46Å; N323-A326 PolarHBondContact O-N 3.25Å; K324-A326 VanDerWaalsContact C-N 3.29Å
327	V	89.5	Confident	89.5	Confident	24 Å²	24	51.4 Å²	51.4	15%	0.145	27%	0.273	C	S	.	.			trans	-98.6	148.1	171.1	169.1	0	0	0	0	107.6	A322 M325 G329 Q331 V332 M361	A322-V327 CarbonylContact C-O 3.43Å; A322-V327 WeakPolarHBondContact CB-O 3.25Å; A322-V327 PolarHBondContact O-N 3.26Å; A322-V327 VanDerWaalsContact O-O 3.1Å; M325-V327 HydrophobicContact CB-CB 4.02Å; M325-V327 HydrophobicContact CB-CG2 3.8Å; M325-V327 PolarHBondContact O-N 3.22Å; V327-G329 PolarHBondContact O-N 2.84Å; V327-Q331 HydrophobicContact CG1-CB 3.5Å; V327-Q331 VanDerWaalsContact CG1-CB 3.5Å; V327-Q331 HydrophobicContact CG1-CG 4.3Å; V327-Q331 VanDerWaalsContact CG1-OE1 3.27Å; V327-V332 HydrophobicContact CB-CG2 4.42Å; V327-V332 HydrophobicContact CG1-CG2 3.98Å; V327-M361 HydrophobicContact CG1-CE 4.08Å; V327-M361 HydrophobicContact CG2-CE 4.32Å
328	K	92	Very high	89.4	Confident	158 Å²	158	58.4 Å²	58.4	69%	0.687	30%	0.301	S	S	*	.			trans	-64.3	135.8	173.5	-69.1	-176.6	178.7	-179.5	0	109.2	S330 Q331	K328-S330 PolarHBondContact O-N 3.17Å; K328-Q331 WeakPolarHBondContact O-CB 3.24Å; K328-Q331 PolarHBondContact O-N 2.88Å
329	G	88	Confident	89.3	Confident	18 Å²	18	62.8 Å²	62.8	19%	0.186	32%	0.324	C	S	.	.	H	α-helix	trans	-51.3	-30.1	179.1	0	0	0	0	0	114.3	V327 Q331 V332 I333	V327-G329 PolarHBondContact O-N 2.84Å; G329-Q331 VanDerWaalsContact C-N 3.33Å; G329-Q331 PolarHBondContact O-N 2.99Å; G329-V332 PolarHBondContact O-N 3.23Å; G329-I333 VanDerWaalsContact O-CG1 3.32Å; G329-I333 WeakPolarHBondContact O-CG1 3.39Å; G329-I333 PolarHBondContact O-N 3.49Å
330	S	90.2	Very high	89	Confident	68 Å²	68	65.4 Å²	65.4	48%	0.476	35%	0.351	S	S	.	.	H	α-helix	trans	-65.9	-27.6	175.2	59.6	0	0	0	0	114.9	K328 K334	K328-S330 PolarHBondContact O-N 3.17Å; S330-K334 WeakPolarHBondContact O-CG 3.38Å; S330-K334 PolarHBondContact O-N 3.24Å
331	Q	89.8	Confident	88.6	Confident	100 Å²	100	63 Å²	63	47%	0.467	35%	0.346	S	S	.	.	H	α-helix	trans	-76.4	-37.4	174.7	-70.3	-175.8	-7.5	0	0	111.1	V327 K328 G329 K334 A335	V327-Q331 HydrophobicContact CG1-CB 3.5Å; V327-Q331 VanDerWaalsContact CG1-CB 3.5Å; V327-Q331 HydrophobicContact CG1-CG 4.3Å; V327-Q331 VanDerWaalsContact CG1-OE1 3.27Å; K328-Q331 WeakPolarHBondContact O-CB 3.24Å; K328-Q331 PolarHBondContact O-N 2.88Å; G329-Q331 VanDerWaalsContact C-N 3.33Å; G329-Q331 PolarHBondContact O-N 2.99Å; Q331-K334 WeakPolarHBondContact O-CB 3.39Å; Q331-K334 PolarHBondContact O-N 3.12Å; Q331-A335 PolarHBondContact O-N 2.93Å
332	V	90	Very high	88.4	Confident	0 Å²	0	70.7 Å²	70.7	0%	0	38%	0.384	C	S	.	.	H	α-helix	trans	-64.2	-44.3	174.8	-171.4	0	0	0	0	110.6	V318 L321 A322 M325 V327 G329 K334 A335 M336 V357	V318-V332 HydrophobicContact CG1-CB 4.14Å; V318-V332 HydrophobicContact CG1-CG1 3.85Å; L321-V332 HydrophobicContact CD2-CG1 4.23Å; A322-V332 HydrophobicContact CB-CB 4.49Å; A322-V332 HydrophobicContact CB-CG2 3.62Å; M325-V332 HydrophobicContact CE-CB 4.36Å; M325-V332 HydrophobicContact CE-CG1 4.1Å; M325-V332 HydrophobicContact CE-CG2 3.34Å; V327-V332 HydrophobicContact CB-CG2 4.42Å; V327-V332 HydrophobicContact CG1-CG2 3.98Å; G329-V332 PolarHBondContact O-N 3.23Å; V332-K334 VanDerWaalsContact C-N 3.3Å; V332-K334 PolarHBondContact O-N 3.27Å; V332-A335 WeakPolarHBondContact O-CB 3.34Å; V332-A335 PolarHBondContact O-N 3.37Å; V332-A335 VanDerWaalsContact O-N 3.12Å; V332-M336 PolarHBondContact O-N 2.92Å; V332-V357 HydrophobicContact CG1-CG1 3.69Å
333	I	89.1	Confident	88.1	Confident	28 Å²	28	71 Å²	71	14%	0.144	39%	0.387	C	S	.	.	H	α-helix	trans	-60.1	-40.1	174.4	-66.8	168.2	0	0	0	111.3	V318 G329 M336 M337 A343 I345	V318-I333 HydrophobicContact CG1-CG1 3.99Å; G329-I333 VanDerWaalsContact O-CG1 3.32Å; G329-I333 WeakPolarHBondContact O-CG1 3.39Å; G329-I333 PolarHBondContact O-N 3.49Å; I333-M336 PolarHBondContact O-N 3.25Å; I333-M337 HydrophobicContact CG2-CE 3.85Å; I333-M337 HydrophobicContact CG2-SD 4.41Å; I333-M337 WeakPolarHBondContact O-CG 3.44Å; I333-M337 PolarHBondContact O-N 3.47Å; I333-A343 WeakPolarHBondContact CG2-O 3.34Å; I333-I345 HydrophobicContact CD1-CG1 3.61Å
334	K	90.5	Very high	87.9	Confident	137 Å²	137	69.1 Å²	69.1	60%	0.596	38%	0.38	S	S	*	.	H	α-helix	trans	-65.2	-38	174.8	-78.3	179.2	-176.3	-174.6	0	112.7	S330 Q331 V332 M337 K338	S330-K334 WeakPolarHBondContact O-CG 3.38Å; S330-K334 PolarHBondContact O-N 3.24Å; Q331-K334 WeakPolarHBondContact O-CB 3.39Å; Q331-K334 PolarHBondContact O-N 3.12Å; V332-K334 VanDerWaalsContact C-N 3.3Å; V332-K334 PolarHBondContact O-N 3.27Å; K334-M337 PolarHBondContact O-N 3Å; K334-K338 PolarHBondContact O-N 2.83Å; K334-K338 VanDerWaalsContact O-N 3.15Å
335	A	89.2	Confident	87.9	Confident	7 Å²	7	69 Å²	69	6%	0.058	38%	0.383	C	S	.	.	H	α-helix	trans	-64.6	-44.1	174.8	0	0	0	0	0	110.6	Q331 V332 M337 K338 L339 M361	Q331-A335 PolarHBondContact O-N 2.93Å; V332-A335 WeakPolarHBondContact O-CB 3.34Å; V332-A335 PolarHBondContact O-N 3.37Å; V332-A335 VanDerWaalsContact O-N 3.12Å; A335-M337 PolarHBondContact O-N 3.29Å; A335-K338 WeakPolarHBondContact O-CB 2.7Å; A335-K338 PolarHBondContact O-N 2.84Å; A335-L339 PolarHBondContact O-N 2.97Å; A335-M361 HydrophobicContact CB-CG 4.3Å; A335-M361 HydrophobicContact CB-SD 3.91Å
336	M	87.1	Confident	87.8	Confident	4 Å²	4	74.5 Å²	74.5	2%	0.02	41%	0.413	C	S	.	.	H	α-helix	trans	-61.2	-41.3	173.8	-70.9	-167.9	77.8	0	0	112.7	V318 V332 I333 K338 L339 G340 A341 A343 I349 T353 V357	V318-M336 HydrophobicContact CG2-SD 3.79Å; V332-M336 PolarHBondContact O-N 2.92Å; I333-M336 PolarHBondContact O-N 3.25Å; M336-K338 VanDerWaalsContact C-N 3.28Å; M336-K338 PolarHBondContact O-N 3.01Å; M336-L339 CarbonylContact O-C 3.57Å; M336-L339 WeakPolarHBondContact O-CA 3.01Å; M336-L339 WeakPolarHBondContact O-CB 3.14Å; M336-L339 PolarHBondContact O-N 3.39Å; M336-G340 PolarHBondContact O-N 3.23Å; M336-G340 VanDerWaalsContact O-N 3.17Å; M336-A341 CarbonylContact C-O 3.6Å; M336-A341 WeakPolarHBondContact CB-O 3.29Å; M336-A341 HydrophobicContact CE-CB 4.16Å; M336-A341 PolarHBondContact O-N 2.61Å; M336-A343 HydrophobicContact CE-CB 3.69Å; M336-A343 HydrophobicContact SD-CB 3.52Å; M336-A343 VanDerWaalsContact SD-CB 3.52Å; M336-I349 HydrophobicContact CE-CG2 3.63Å; M336-I349 HydrophobicContact SD-CG2 4.24Å; M336-T353 HydrophobicContact CE-CG2 4Å; M336-V357 HydrophobicContact CG-CG1 4.41Å; M336-V357 HydrophobicContact CG-CG2 3.63Å; M336-V357 HydrophobicContact SD-CG2 4.5Å
337	M	88.4	Confident	87.8	Confident	104 Å²	104	74.9 Å²	74.9	51%	0.512	40%	0.403	S	S	.	.	H	α-helix	trans	-59.7	-37.6	175.2	-76.3	177.1	176.4	0	0	112.4	I333 K334 A335 L339 G340 A341 M342	I333-M337 HydrophobicContact CG2-CE 3.85Å; I333-M337 HydrophobicContact CG2-SD 4.41Å; I333-M337 WeakPolarHBondContact O-CG 3.44Å; I333-M337 PolarHBondContact O-N 3.47Å; K334-M337 PolarHBondContact O-N 3Å; A335-M337 PolarHBondContact O-N 3.29Å; M337-L339 VanDerWaalsContact C-N 3.32Å; M337-G340 PolarHBondContact O-N 3.3Å; M337-G340 VanDerWaalsContact O-N 3.12Å; M337-A341 PolarHBondContact N-O 3.25Å; M337-M342 HydrophobicContact CG-CG 4.46Å
338	K	88.4	Confident	87.6	Confident	180 Å²	180	76 Å²	76	78%	0.783	41%	0.41	S	S	*	.	H	α-helix	trans	-67.3	-32.8	175.3	-72.1	178.3	178.5	-177.3	0	112.7	K334 A335 M336 G340	K334-K338 PolarHBondContact O-N 2.83Å; K334-K338 VanDerWaalsContact O-N 3.15Å; A335-K338 WeakPolarHBondContact O-CB 2.7Å; A335-K338 PolarHBondContact O-N 2.84Å; M336-K338 VanDerWaalsContact C-N 3.28Å; M336-K338 PolarHBondContact O-N 3.01Å; K338-G340 PolarHBondContact O-N 2.87Å
339	L	86.6	Confident	87.4	Confident	92 Å²	92	68.9 Å²	68.9	48%	0.482	38%	0.379	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.9	-3.9	173.4	-64.1	172	0	0	0	112.7	A335 M336 M337 V357	A335-L339 PolarHBondContact O-N 2.97Å; M336-L339 CarbonylContact O-C 3.57Å; M336-L339 WeakPolarHBondContact O-CA 3.01Å; M336-L339 WeakPolarHBondContact O-CB 3.14Å; M336-L339 PolarHBondContact O-N 3.39Å; M337-L339 VanDerWaalsContact C-N 3.32Å; L339-V357 HydrophobicContact CD1-CG2 3.81Å
340	G	84.7	Confident	87.4	Confident	70 Å²	70	71.5 Å²	71.5	72%	0.722	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	91.1	4.2	178.6	0	0	0	0	0	114.9	M336 M337 K338	M336-G340 PolarHBondContact O-N 3.23Å; M336-G340 VanDerWaalsContact O-N 3.17Å; M337-G340 PolarHBondContact O-N 3.3Å; M337-G340 VanDerWaalsContact O-N 3.12Å; K338-G340 PolarHBondContact O-N 2.87Å
341	A	80.9	Confident	87.2	Confident	39 Å²	39	70.1 Å²	70.1	32%	0.322	38%	0.375	S	S	.	.			trans	-106.8	117.3	178.7	0	0	0	0	0	111	M336 M337	M336-A341 CarbonylContact C-O 3.6Å; M336-A341 WeakPolarHBondContact CB-O 3.29Å; M336-A341 HydrophobicContact CE-CB 4.16Å; M336-A341 PolarHBondContact O-N 2.61Å; M337-A341 PolarHBondContact N-O 3.25Å
342	M	86.7	Confident	87.2	Confident	162 Å²	162	72.4 Å²	72.4	80%	0.798	39%	0.385	S	S	*	.			trans	-80.2	124.3	168.2	-73.1	-168.4	-83.2	0	0	109.3	M337	M337-M342 HydrophobicContact CG-CG 4.46Å
343	A	84.7	Confident	87.1	Confident	9 Å²	9	74.3 Å²	74.3	7%	0.074	40%	0.397	C	S	.	.			trans	-133.2	150.2	177.9	0	0	0	0	0	113.1	V318 I333 M336	V318-A343 HydrophobicContact CG2-CB 4.08Å; I333-A343 WeakPolarHBondContact CG2-O 3.34Å; M336-A343 HydrophobicContact CE-CB 3.69Å; M336-A343 HydrophobicContact SD-CB 3.52Å; M336-A343 VanDerWaalsContact SD-CB 3.52Å
344	T	88.2	Confident	87.2	Confident	87 Å²	87	73 Å²	73	53%	0.534	39%	0.39	S	S	.	.			trans	-96.3	163.9	172	68.2	0	0	0	0	111.4	N346 Q347	T344-N346 VanDerWaalsContact C-N 3.25Å; T344-N346 PolarHBondContact O-N 3.28Å; T344-Q347 VanDerWaalsContact N-OE1 3.14Å; T344-Q347 WeakPolarHBondContact O-CB 3.37Å; T344-Q347 PolarHBondContact O-N 3.25Å; T344-Q347 VanDerWaalsContact O-N 3.12Å
345	I	88.2	Confident	87.2	Confident	89 Å²	89	69.2 Å²	69.2	46%	0.456	38%	0.375	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60	-35.7	-177.3	-59.6	175.1	0	0	0	112	G319 I333	G319-I345 PolarHBondContact N-O 3.12Å; I333-I345 HydrophobicContact CD1-CG1 3.61Å
346	N	85.7	Confident	87.3	Confident	120 Å²	120	73.8 Å²	73.8	64%	0.642	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.6	-0.2	-178	-61.6	-17.6	0	0	0	112.9	T344 V348	T344-N346 VanDerWaalsContact C-N 3.25Å; T344-N346 PolarHBondContact O-N 3.28Å; N346-V348 PolarHBondContact O-N 2.86Å
347	Q	84.9	Confident	87.5	Confident	76 Å²	76	73.6 Å²	73.6	36%	0.355	40%	0.397	S	S	.	.			trans	-71.5	131.8	-179.7	-173.6	166.8	-14.9	0	0	110	T317 V318 T344	T317-Q347 WeakPolarHBondContact CA-O 3.32Å; V318-Q347 PolarHBondContact N-O 3.42Å; T344-Q347 VanDerWaalsContact N-OE1 3.14Å; T344-Q347 WeakPolarHBondContact O-CB 3.37Å; T344-Q347 PolarHBondContact O-N 3.25Å; T344-Q347 VanDerWaalsContact O-N 3.12Å
348	V	85.6	Confident	87.5	Confident	48 Å²	48	68.6 Å²	68.6	29%	0.291	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	131.6	172.8	-175.6	0	0	0	0	108.5	T315 T317 N346 A667	T315-V348 HydrophobicContact CG2-CG1 4.13Å; T317-V348 HydrophobicContact CG2-CG2 4.02Å; N346-V348 PolarHBondContact O-N 2.86Å; V348-A667 HydrophobicContact CB-CB 4.46Å; V348-A667 HydrophobicContact CG2-CB 4.27Å
349	I	88.2	Confident	87.6	Confident	9 Å²	9	64.8 Å²	64.8	5%	0.046	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	148.7	173.8	53.7	172.8	0	0	0	109.5	I316 V318 L321 M336 A354	I316-I349 HydrophobicContact CG2-CD1 4.17Å; I316-I349 HydrophobicContact CG2-CG1 3.81Å; I316-I349 PolarHBondContact N-O 2.87Å; I316-I349 WeakPolarHBondContact O-CG1 3.41Å; I316-I349 PolarHBondContact O-N 3.2Å; V318-I349 HydrophobicContact CG2-CD1 4.33Å; V318-I349 HydrophobicContact CG2-CG2 4.01Å; L321-I349 HydrophobicContact CD2-CD1 3.68Å; M336-I349 HydrophobicContact CE-CG2 3.63Å; M336-I349 HydrophobicContact SD-CG2 4.24Å; I349-A354 HydrophobicContact CD1-CB 3.7Å; I349-A354 HydrophobicContact CG1-CB 4.08Å
350	D	88	Confident	87.6	Confident	72 Å²	72	66.5 Å²	66.5	39%	0.385	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.6	157.8	174.9	59.7	-60.6	0	0	0	111.7	E352 T353 A354	D350-E352 VanDerWaalsContact C-N 3.27Å; D350-E352 PolarHBondContact O-N 3.42Å; D350-E352 WeakPolarHBondContact OD2-CB 3.41Å; D350-E352 PolarHBondContact OD2-N 3.47Å; D350-T353 VanDerWaalsContact CG-OG1 3.22Å; D350-T353 PolarHBondContact O-N 3.03Å; D350-T353 WeakPolarHBondContact OD1-CB 3.17Å; D350-T353 PolarHBondContact OD1-OG1 3.31Å; D350-T353 PolarHBondContact OD2-N 2.69Å; D350-T353 PolarHBondContact OD2-OG1 3.1Å; D350-T353 VanDerWaalsContact OD2-OG1 3.09Å; D350-A354 VanDerWaalsContact O-CB 3.27Å; D350-A354 WeakPolarHBondContact O-CB 3.37Å; D350-A354 PolarHBondContact O-N 2.96Å
351	Q	86.7	Confident	87.7	Confident	39 Å²	39	65.9 Å²	65.9	18%	0.182	34%	0.342	C	S	.	.	H	α-helix	trans	-55.3	-39.5	178.9	-174.6	171.2	62.8	0	0	113	I312 G313 E314 A354 Q355 L367	I312-Q351 HydrophobicContact CG2-CG 4.12Å; I312-Q351 PolarHBondContact O-NE2 3.29Å; G313-Q351 WeakPolarHBondContact O-CB 3.43Å; G313-Q351 WeakPolarHBondContact O-CG 3.36Å; G313-Q351 PolarHBondContact O-NE2 3.45Å; E314-Q351 WeakPolarHBondContact O-CB 3.2Å; E314-Q351 PolarHBondContact O-N 3.14Å; Q351-A354 PolarHBondContact O-N 3.02Å; Q351-Q355 VanDerWaalsContact O-CB 3.3Å; Q351-Q355 WeakPolarHBondContact O-CB 3.49Å; Q351-Q355 PolarHBondContact O-N 3.47Å; Q351-L367 HydrophobicContact CG-CD2 3.68Å
352	E	89	Confident	87.8	Confident	148 Å²	148	65.7 Å²	65.7	69%	0.692	34%	0.344	S	S	*	.	H	α-helix	trans	-69.2	-48.9	-178.2	-59	-176.6	173.4	0	0	111.1	D350 A354 Q355 L356	D350-E352 VanDerWaalsContact C-N 3.27Å; D350-E352 PolarHBondContact O-N 3.42Å; D350-E352 WeakPolarHBondContact OD2-CB 3.41Å; D350-E352 PolarHBondContact OD2-N 3.47Å; E352-A354 VanDerWaalsContact C-N 3.33Å; E352-A354 PolarHBondContact O-N 2.76Å; E352-Q355 WeakPolarHBondContact O-CB 3.34Å; E352-Q355 PolarHBondContact O-N 2.76Å; E352-L356 WeakPolarHBondContact O-CG 3.4Å; E352-L356 PolarHBondContact O-N 3.02Å
353	T	88.9	Confident	87.8	Confident	40 Å²	40	58.8 Å²	58.8	25%	0.245	31%	0.31	C	S	.	.	H	α-helix	trans	-62	-40.7	174.3	-56.6	0	0	0	0	111.8	M336 D350 Q355 L356 V357	M336-T353 HydrophobicContact CE-CG2 4Å; D350-T353 VanDerWaalsContact CG-OG1 3.22Å; D350-T353 PolarHBondContact O-N 3.03Å; D350-T353 WeakPolarHBondContact OD1-CB 3.17Å; D350-T353 PolarHBondContact OD1-OG1 3.31Å; D350-T353 PolarHBondContact OD2-N 2.69Å; D350-T353 PolarHBondContact OD2-OG1 3.1Å; D350-T353 VanDerWaalsContact OD2-OG1 3.09Å; T353-Q355 VanDerWaalsContact C-N 3.33Å; T353-Q355 PolarHBondContact O-N 3.06Å; T353-L356 PolarHBondContact O-N 3.09Å; T353-V357 HydrophobicContact CG2-CG2 4.41Å; T353-V357 VanDerWaalsContact O-CG2 3.26Å; T353-V357 WeakPolarHBondContact O-CG2 3.11Å; T353-V357 PolarHBondContact O-N 2.84Å
354	A	89.9	Confident	87.9	Confident	0 Å²	0	65.4 Å²	65.4	0%	0	34%	0.337	C	S	.	.	H	α-helix	trans	-64.1	-38.1	176.9	0	0	0	0	0	112.2	I312 I316 L321 I349 D350 Q351 E352 V357 A358	I312-A354 HydrophobicContact CD1-CB 4.07Å; I312-A354 HydrophobicContact CG2-CB 3.8Å; I316-A354 HydrophobicContact CG2-CB 3.58Å; L321-A354 HydrophobicContact CD2-CB 4.24Å; I349-A354 HydrophobicContact CD1-CB 3.7Å; I349-A354 HydrophobicContact CG1-CB 4.08Å; D350-A354 VanDerWaalsContact O-CB 3.27Å; D350-A354 WeakPolarHBondContact O-CB 3.37Å; D350-A354 PolarHBondContact O-N 2.96Å; Q351-A354 PolarHBondContact O-N 3.02Å; E352-A354 VanDerWaalsContact C-N 3.33Å; E352-A354 PolarHBondContact O-N 2.76Å; A354-V357 PolarHBondContact O-N 2.68Å; A354-A358 WeakPolarHBondContact O-CB 3.22Å; A354-A358 PolarHBondContact O-N 2.77Å
355	Q	91.1	Very high	87.9	Confident	58 Å²	58	62.8 Å²	62.8	27%	0.271	32%	0.32	S	S	.	.	H	α-helix	trans	-62	-49.1	173.7	178	-179.8	-7.1	0	0	110.9	Q351 E352 T353 V357 A358 E359 V365	Q351-Q355 VanDerWaalsContact O-CB 3.3Å; Q351-Q355 WeakPolarHBondContact O-CB 3.49Å; Q351-Q355 PolarHBondContact O-N 3.47Å; E352-Q355 WeakPolarHBondContact O-CB 3.34Å; E352-Q355 PolarHBondContact O-N 2.76Å; T353-Q355 VanDerWaalsContact C-N 3.33Å; T353-Q355 PolarHBondContact O-N 3.06Å; Q355-V357 VanDerWaalsContact C-N 3.32Å; Q355-V357 PolarHBondContact O-N 3.05Å; Q355-A358 PolarHBondContact O-N 2.84Å; Q355-E359 HydrophobicContact CG-CG 4.34Å; Q355-E359 WeakPolarHBondContact CG-OE1 3.27Å; Q355-E359 PolarHBondContact NE2-OE1 3.32Å; Q355-E359 WeakPolarHBondContact O-CB 2.97Å; Q355-E359 WeakPolarHBondContact O-CG 3.29Å; Q355-E359 PolarHBondContact O-N 3Å; Q355-V365 HydrophobicContact CB-CG1 4.34Å; Q355-V365 HydrophobicContact CG-CB 4.27Å; Q355-V365 HydrophobicContact CG-CG1 4.13Å; Q355-V365 HydrophobicContact CG-CG2 4.2Å
356	L	91.1	Very high	87.8	Confident	103 Å²	103	62.6 Å²	62.6	54%	0.539	32%	0.319	S	S	.	.	H	α-helix	trans	-58.5	-43.4	178.2	-70.6	172.7	0	0	0	112.1	E352 T353 E359 E360	E352-L356 WeakPolarHBondContact O-CG 3.4Å; E352-L356 PolarHBondContact O-N 3.02Å; T353-L356 PolarHBondContact O-N 3.09Å; L356-E359 PolarHBondContact O-N 3.17Å; L356-E360 VanDerWaalsContact O-CB 3.32Å; L356-E360 WeakPolarHBondContact O-CB 3.36Å; L356-E360 PolarHBondContact O-N 3.42Å
357	V	90.7	Very high	87.6	Confident	0 Å²	0	60.4 Å²	60.4	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-66.4	-40.2	178.7	173.6	0	0	0	0	111.6	L321 V332 M336 L339 T353 A354 Q355 M361	L321-V357 HydrophobicContact CD2-CB 4.2Å; L321-V357 HydrophobicContact CD2-CG1 3.95Å; V332-V357 HydrophobicContact CG1-CG1 3.69Å; M336-V357 HydrophobicContact CG-CG1 4.41Å; M336-V357 HydrophobicContact CG-CG2 3.63Å; M336-V357 HydrophobicContact SD-CG2 4.5Å; L339-V357 HydrophobicContact CD1-CG2 3.81Å; T353-V357 HydrophobicContact CG2-CG2 4.41Å; T353-V357 VanDerWaalsContact O-CG2 3.26Å; T353-V357 WeakPolarHBondContact O-CG2 3.11Å; T353-V357 PolarHBondContact O-N 2.84Å; A354-V357 PolarHBondContact O-N 2.68Å; Q355-V357 VanDerWaalsContact C-N 3.32Å; Q355-V357 PolarHBondContact O-N 3.05Å; V357-M361 WeakPolarHBondContact O-CB 3.46Å; V357-M361 WeakPolarHBondContact O-CG 3.26Å; V357-M361 PolarHBondContact O-N 3.35Å
358	A	90	Very high	86.9	Confident	0 Å²	0	63.2 Å²	63.2	0%	0	32%	0.315	C	S	.	.	H	α-helix	trans	-69.6	-39.9	178	0	0	0	0	0	112.2	I312 M325 A354 Q355 M361 G362 H363 V365	I312-A358 HydrophobicContact CD1-CB 4.09Å; M325-A358 HydrophobicContact SD-CB 4.29Å; A354-A358 WeakPolarHBondContact O-CB 3.22Å; A354-A358 PolarHBondContact O-N 2.77Å; Q355-A358 PolarHBondContact O-N 2.84Å; A358-M361 PolarHBondContact O-N 2.77Å; A358-G362 PolarHBondContact O-N 3.29Å; A358-H363 HydrophobicContact CB-CB 4.47Å; A358-H363 PolarHBondContact O-N 3.1Å; A358-V365 HydrophobicContact CB-CG2 3.49Å; A358-V365 VanDerWaalsContact CB-CG2 3.49Å
359	E	89.7	Confident	85.9	Confident	100 Å²	100	69.2 Å²	69.2	47%	0.467	33%	0.332	S	S	.	.	H	α-helix	trans	-65.6	-44.4	175.8	-74.8	179.8	-173.9	0	0	112	Q355 L356 M361 G362 V365	Q355-E359 HydrophobicContact CG-CG 4.34Å; Q355-E359 WeakPolarHBondContact CG-OE1 3.27Å; Q355-E359 PolarHBondContact NE2-OE1 3.32Å; Q355-E359 WeakPolarHBondContact O-CB 2.97Å; Q355-E359 WeakPolarHBondContact O-CG 3.29Å; Q355-E359 PolarHBondContact O-N 3Å; L356-E359 PolarHBondContact O-N 3.17Å; E359-M361 PolarHBondContact O-N 2.84Å; E359-G362 WeakPolarHBondContact O-CA 3.44Å; E359-G362 PolarHBondContact O-N 3.23Å; E359-V365 HydrophobicContact CG-CG2 4.25Å
360	E	86.7	Confident	84.5	Confident	128 Å²	128	71.6 Å²	71.6	60%	0.598	34%	0.343	S	S	*	.	H	α-helix	trans	-61.6	-30.8	176.6	-177	65.2	-166.8	0	0	112	L356 G362	L356-E360 VanDerWaalsContact O-CB 3.32Å; L356-E360 WeakPolarHBondContact O-CB 3.36Å; L356-E360 PolarHBondContact O-N 3.42Å; E360-G362 VanDerWaalsContact C-N 3.3Å
361	M	86.2	Confident	83.4	Confident	56 Å²	56	70.5 Å²	70.5	28%	0.276	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.8	-4.9	175.2	-68	-67.1	-63.6	0	0	113.4	M325 V327 A335 V357 A358 E359	M325-M361 HydrophobicContact SD-CB 4.37Å; V327-M361 HydrophobicContact CG1-CE 4.08Å; V327-M361 HydrophobicContact CG2-CE 4.32Å; A335-M361 HydrophobicContact CB-CG 4.3Å; A335-M361 HydrophobicContact CB-SD 3.91Å; V357-M361 WeakPolarHBondContact O-CB 3.46Å; V357-M361 WeakPolarHBondContact O-CG 3.26Å; V357-M361 PolarHBondContact O-N 3.35Å; A358-M361 PolarHBondContact O-N 2.77Å; E359-M361 PolarHBondContact O-N 2.84Å
362	G	83.5	Confident	82.3	Confident	36 Å²	36	74.9 Å²	74.9	37%	0.371	36%	0.358	S	S	.	.	T	Hydrogen-bonded Turn	trans	87	14.7	177.1	0	0	0	0	0	115.3	N307 A358 E359 E360	N307-G362 PolarHBondContact OD1-O 3.2Å; A358-G362 PolarHBondContact O-N 3.29Å; E359-G362 WeakPolarHBondContact O-CA 3.44Å; E359-G362 PolarHBondContact O-N 3.23Å; E360-G362 VanDerWaalsContact C-N 3.3Å
363	H	87.1	Confident	81.1	Confident	16 Å²	16	70.8 Å²	70.8	7%	0.074	34%	0.34	C	S	.	.	P	Polyproline II helix	trans	-89.3	145.1	175.8	-64.2	-77.8	0	0	0	111.3	V306 R308 V310 M325 A358	V306-H363 PolarHBondContact O-CE1 2.75Å; R308-H363 PolarHBondContact N-ND1 3.32Å; R308-H363 WeakPolarHBondContact O-CB 3.41Å; V310-H363 HydrophobicContact CG2-CB 3.67Å; M325-H363 PolarHBondContact SD-CD2 3.27Å; A358-H363 HydrophobicContact CB-CB 4.47Å; A358-H363 PolarHBondContact O-N 3.1Å
364	K	85.9	Confident	80	Confident	148 Å²	148	70.8 Å²	70.8	64%	0.643	34%	0.338	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.5	132.3	172.3	-75.4	-179.9	178.6	178.9	0	108.6	R308 D309 V310	R308-K364 PolarHBondContact O-N 2.91Å; D309-K364 CarbonylContact C-O 3.52Å; D309-K364 VanDerWaalsContact CA-O 3.31Å; D309-K364 WeakPolarHBondContact CA-O 3.32Å; D309-K364 WeakPolarHBondContact OD1-CB 3.24Å; V310-K364 PolarHBondContact N-O 3.09Å
365	V	88.2	Confident	78.9	Confident	32 Å²	32	77.1 Å²	77.1	19%	0.194	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	125.7	-177.8	178.2	0	0	0	0	109.9	I312 Q355 A358 E359 L367	I312-V365 HydrophobicContact CB-CG1 4.24Å; I312-V365 HydrophobicContact CD1-CB 4.37Å; I312-V365 HydrophobicContact CD1-CG1 3.51Å; I312-V365 HydrophobicContact CD1-CG2 3.95Å; I312-V365 HydrophobicContact CG1-CG1 3.86Å; Q355-V365 HydrophobicContact CB-CG1 4.34Å; Q355-V365 HydrophobicContact CG-CB 4.27Å; Q355-V365 HydrophobicContact CG-CG1 4.13Å; Q355-V365 HydrophobicContact CG-CG2 4.2Å; A358-V365 HydrophobicContact CB-CG2 3.49Å; A358-V365 VanDerWaalsContact CB-CG2 3.49Å; E359-V365 HydrophobicContact CG-CG2 4.25Å; V365-L367 HydrophobicContact CG1-CD2 3.64Å; V365-L367 HydrophobicContact CG1-CG 4.23Å
366	I	86.3	Confident	77.6	Confident	85 Å²	85	76.8 Å²	76.8	44%	0.436	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	110.2	166.4	-58.2	175.7	0	0	0	106.9	D309 V310 V311 I312 R368	D309-I366 HydrophobicContact CB-CD1 3.92Å; D309-I366 HydrophobicContact CB-CG1 4.41Å; V310-I366 PolarHBondContact O-N 2.86Å; V311-I366 WeakPolarHBondContact CA-O 3.38Å; I312-I366 PolarHBondContact N-O 2.99Å; I366-R368 PolarHBondContact O-N 3.09Å
367	L	81	Confident	76.4	Confident	74 Å²	74	72.6 Å²	72.6	39%	0.387	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	109.7	175	-58.8	177	0	0	0	108.4	Q351 V365	Q351-L367 HydrophobicContact CG-CD2 3.68Å; V365-L367 HydrophobicContact CG1-CD2 3.64Å; V365-L367 HydrophobicContact CG1-CG 4.23Å
368	R	71.9	Confident	75.3	Confident	136 Å²	136	76.5 Å²	76.5	51%	0.513	37%	0.372	S	S	.	.			trans	-92.7	109.4	172.2	-164.5	-177.1	-169.9	-167.1	9	108.2	V311 I312 I366 E370	V311-R368 HydrophobicContact CG1-CB 3.8Å; I312-R368 PolarHBondContact O-N 2.78Å; I366-R368 PolarHBondContact O-N 3.09Å; R368-E370 HydrophobicContact CG-CG 3.83Å; R368-E370 IonicContact CZ-OE1 3.93Å; R368-E370 IonicContact NE-OE1 3.81Å; R368-E370 IonicContact NH1-OE1 3.79Å; R368-E370 PolarHBondContact NH1-OE1 3.08Å; R368-E370 PolarHBondContact O-N 3.37Å
369	R	64.3	Low	73.9	Confident	173 Å²	173	80.9 Å²	80.9	65%	0.653	40%	0.403	S	S	*	.			trans	-83.2	88.6	168	-68.4	-178.2	-178	176	0.3	107.5	N371 E372	R369-N371 PolarHBondContact O-N 3.44Å; R369-E372 WeakPolarHBondContact O-CG 3.34Å; R369-E372 PolarHBondContact O-N 3.25Å
370	E	58.8	Low	72.6	Confident	60 Å²	60	79.1 Å²	79.1	28%	0.28	40%	0.397	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.5	-6.4	-179.2	-72.2	179.5	159.4	0	0	113.6	R368 E372 L373 Y656	R368-E370 HydrophobicContact CG-CG 3.83Å; R368-E370 IonicContact CZ-OE1 3.93Å; R368-E370 IonicContact NE-OE1 3.81Å; R368-E370 IonicContact NH1-OE1 3.79Å; R368-E370 PolarHBondContact NH1-OE1 3.08Å; R368-E370 PolarHBondContact O-N 3.37Å; E370-E372 PolarHBondContact O-N 3.26Å; E370-E372 VanDerWaalsContact O-N 3.15Å; E370-L373 PolarHBondContact O-N 2.67Å; E370-Y656 HydrophobicContact CB-CE1 4.45Å; E370-Y656 HydrophobicContact CB-CE2 4.23Å; E370-Y656 VanDerWaalsContact CB-OH 3.25Å; E370-Y656 WeakPolarHBondContact CB-OH 3.24Å; E370-Y656 WeakPolarHBondContact OE2-CE2 3.43Å; E370-Y656 PolarHBondContact OE2-OH 3.03Å
371	N	64.5	Low	71.6	Confident	49 Å²	49	76.2 Å²	76.2	26%	0.262	38%	0.38	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.3	-16	165.6	-59.5	-17.7	0	0	0	113.3	E314 R369 L373 E374 E375	E314-N371 PolarHBondContact OE1-ND2 3.26Å; E314-N371 PolarHBondContact OE1-OD1 3.45Å; R369-N371 PolarHBondContact O-N 3.44Å; N371-L373 PolarHBondContact O-N 3.01Å; N371-E374 PolarHBondContact O-N 3.31Å; N371-E375 PolarHBondContact O-N 2.93Å
372	E	64.2	Low	70.6	Confident	130 Å²	130	77.5 Å²	77.5	61%	0.607	39%	0.388	S	S	*	.	H	α-helix	trans	-53.1	-35.2	172.4	-77.6	175.7	-177.3	0	0	112.6	R369 E370 A376	R369-E372 WeakPolarHBondContact O-CG 3.34Å; R369-E372 PolarHBondContact O-N 3.25Å; E370-E372 PolarHBondContact O-N 3.26Å; E370-E372 VanDerWaalsContact O-N 3.15Å; E372-A376 VanDerWaalsContact O-CB 3.26Å; E372-A376 WeakPolarHBondContact O-CB 3.4Å; E372-A376 PolarHBondContact O-N 2.93Å
373	L	62.4	Low	69.6	Low	63 Å²	63	82.3 Å²	82.3	33%	0.33	41%	0.411	S	S	.	.	H	α-helix	trans	-68.5	-40.8	177.3	-176.3	66.8	0	0	0	111.4	E370 N371 A376 V377 E652 V653	E370-L373 PolarHBondContact O-N 2.67Å; N371-L373 PolarHBondContact O-N 3.01Å; L373-A376 PolarHBondContact O-N 3.45Å; L373-V377 PolarHBondContact O-N 2.91Å; L373-E652 HydrophobicContact CD2-CB 4.29Å; L373-V653 HydrophobicContact CD2-CG2 3.83Å; L373-V653 HydrophobicContact CG-CG2 3.82Å
374	E	66.2	Low	68.4	Low	40 Å²	40	85.4 Å²	85.4	19%	0.187	45%	0.447	C	S	.	.	H	α-helix	trans	-67.7	-44.9	176.5	-56.7	-160.8	172.4	0	0	110.7	N371 A376 V377 M378 V653 R657	N371-E374 PolarHBondContact O-N 3.31Å; E374-A376 VanDerWaalsContact C-N 3.29Å; E374-A376 PolarHBondContact O-N 3.01Å; E374-V377 PolarHBondContact O-N 2.87Å; E374-M378 WeakPolarHBondContact O-CB 3.37Å; E374-M378 VanDerWaalsContact O-CG 3.22Å; E374-M378 WeakPolarHBondContact O-CG 3.43Å; E374-M378 PolarHBondContact O-N 2.88Å; E374-V653 HydrophobicContact CG-CG1 4.14Å; E374-R657 WeakPolarHBondContact OE1-CG 3.39Å; E374-R657 IonicContact OE1-CZ 2.68Å; E374-R657 IonicContact OE1-NE 3.33Å; E374-R657 PolarHBondContact OE1-NE 3.39Å; E374-R657 IonicContact OE1-NH2 2.79Å; E374-R657 IonicContact OE2-CZ 2.92Å; E374-R657 IonicContact OE2-NE 3.73Å; E374-R657 PolarHBondContact OE2-NE 3.32Å; E374-R657 IonicContact OE2-NH2 3.77Å; E374-R657 PolarHBondContact OE2-NH2 3.45Å
375	E	67.3	Low	67.6	Low	132 Å²	132	80.1 Å²	80.1	62%	0.617	43%	0.431	S	S	*	.	H	α-helix	trans	-60.5	-36.9	175	-72.5	-179.1	179	0	0	112	N371 M378 S379	N371-E375 PolarHBondContact O-N 2.93Å; E375-M378 PolarHBondContact O-N 2.74Å; E375-S379 VanDerWaalsContact O-CB 3.23Å; E375-S379 WeakPolarHBondContact O-CB 3.33Å; E375-S379 PolarHBondContact O-N 3.05Å; E375-S379 PolarHBondContact O-OG 3.18Å
376	A	63.2	Low	67.1	Low	52 Å²	52	82.3 Å²	82.3	43%	0.43	45%	0.452	S	S	.	.	H	α-helix	trans	-64.6	-40.5	175.3	0	0	0	0	0	112.4	E372 L373 E374 S379 D380	E372-A376 VanDerWaalsContact O-CB 3.26Å; E372-A376 WeakPolarHBondContact O-CB 3.4Å; E372-A376 PolarHBondContact O-N 2.93Å; L373-A376 PolarHBondContact O-N 3.45Å; E374-A376 VanDerWaalsContact C-N 3.29Å; E374-A376 PolarHBondContact O-N 3.01Å; A376-S379 WeakPolarHBondContact CA-OG 3.42Å; A376-S379 PolarHBondContact O-OG 3.09Å; A376-D380 PolarHBondContact O-N 2.85Å
377	V	66.7	Low	67	Low	15 Å²	15	81.2 Å²	81.2	9%	0.091	46%	0.456	C	S	.	.	H	α-helix	trans	-70	-37.4	175.4	174.3	0	0	0	0	111.1	L373 E374 V644 K649 V653	L373-V377 PolarHBondContact O-N 2.91Å; E374-V377 PolarHBondContact O-N 2.87Å; V377-V644 HydrophobicContact CG1-CG1 3.93Å; V377-V644 HydrophobicContact CG1-CG2 3.72Å; V377-K649 HydrophobicContact CG2-CB 4.27Å; V377-V653 HydrophobicContact CG2-CG2 4.12Å
378	M	66.5	Low	67.4	Low	81 Å²	81	81.4 Å²	81.4	40%	0.399	46%	0.455	S	S	.	.	H	α-helix	trans	-75.4	-23.5	179.2	-65.1	-67.3	-96.5	0	0	113.4	E374 E375 R381	E374-M378 WeakPolarHBondContact O-CB 3.37Å; E374-M378 VanDerWaalsContact O-CG 3.22Å; E374-M378 WeakPolarHBondContact O-CG 3.43Å; E374-M378 PolarHBondContact O-N 2.88Å; E375-M378 PolarHBondContact O-N 2.74Å; M378-R381 WeakPolarHBondContact O-CD 3.27Å; M378-R381 WeakPolarHBondContact O-CG 3.46Å
379	S	61	Low	68.2	Low	92 Å²	92	80.6 Å²	80.6	64%	0.643	47%	0.467	S	S	*	.	H	α-helix	trans	-87	-20.1	178.1	55.6	0	0	0	0	114.1	E375 A376 R381	E375-S379 VanDerWaalsContact O-CB 3.23Å; E375-S379 WeakPolarHBondContact O-CB 3.33Å; E375-S379 PolarHBondContact O-N 3.05Å; E375-S379 PolarHBondContact O-OG 3.18Å; A376-S379 WeakPolarHBondContact CA-OG 3.42Å; A376-S379 PolarHBondContact O-OG 3.09Å; S379-R381 PolarHBondContact O-N 2.9Å
380	D	62.6	Low	69.5	Low	64 Å²	64	75 Å²	75	34%	0.342	45%	0.446	S	S	.	.	S	Bend	trans	-73.9	20.3	174.4	-163.2	28.5	0	0	0	113.5	A376 R645	A376-D380 PolarHBondContact O-N 2.85Å; D380-R645 IonicContact OD1-CZ 2.76Å; D380-R645 IonicContact OD1-NH1 3.69Å; D380-R645 PolarHBondContact OD1-NH1 2.84Å; D380-R645 IonicContact OD1-NH2 3.08Å; D380-R645 WeakPolarHBondContact OD2-CD 3.27Å; D380-R645 IonicContact OD2-CZ 2.86Å; D380-R645 IonicContact OD2-NE 3.7Å; D380-R645 IonicContact OD2-NH1 2.74Å; D380-R645 PolarHBondContact OD2-NH1 3.28Å
381	R	66.2	Low	71.1	Confident	67 Å²	67	72.9 Å²	72.9	25%	0.253	44%	0.439	S	S	.	.	S	Bend	trans	-83.9	142	-178.1	-67.2	-180	80.4	-172.2	-4.6	111.1	M378 S379 T383 E588	M378-R381 WeakPolarHBondContact O-CD 3.27Å; M378-R381 WeakPolarHBondContact O-CG 3.46Å; S379-R381 PolarHBondContact O-N 2.9Å; R381-T383 PolarHBondContact O-N 2.91Å; R381-E588 IonicContact NH2-OE2 3.04Å; R381-E588 PolarHBondContact NH2-OE2 2.83Å
382	D	64.6	Low	72.5	Confident	82 Å²	82	70.8 Å²	70.8	44%	0.439	43%	0.428	S	S	.	.			trans	-71.6	94.9	172.8	-60.9	-39.1	0	0	0	109.8	R645	D382-R645 IonicContact OD1-NH2 3.42Å; D382-R645 PolarHBondContact OD1-NH2 3.45Å
383	T	62.1	Low	73.9	Confident	138 Å²	138	64.8 Å²	64.8	85%	0.847	40%	0.4	S	S	*	.			trans	-91.4	6.1	-176.8	47.1	0	0	0	0	114.2	R381	R381-T383 PolarHBondContact O-N 2.91Å
384	G	61.8	Low	75.5	Confident	81 Å²	81	61.8 Å²	61.8	84%	0.835	39%	0.385	S	S	*	.			trans	-109	4.9	-165.6	0	0	0	0	0	117.3
385	A	69.1	Low	76.7	Confident	37 Å²	37	59.9 Å²	59.9	31%	0.306	38%	0.376	S	S	.	.	S	Bend	trans	-90.3	152	-175.3	0	0	0	0	0	113	A387 V560 K562	A385-A387 PolarHBondContact O-N 2.88Å; A385-V560 HydrophobicContact CB-CG1 3.43Å; A385-V560 VanDerWaalsContact CB-CG1 3.43Å; A385-K562 HydrophobicContact CB-CB 4.42Å; A385-K562 VanDerWaalsContact CB-O 3.22Å; A385-K562 WeakPolarHBondContact CB-O 3.45Å
386	A	79.1	Confident	77.9	Confident	78 Å²	78	53.6 Å²	53.6	65%	0.645	35%	0.346	S	S	*	.	P	Polyproline II helix	trans	-64.4	133.6	179.5	0	0	0	0	0	110.5	E388	A386-E388 PolarHBondContact O-N 3.37Å
387	A	84.2	Confident	79.3	Confident	61 Å²	61	51.1 Å²	51.1	50%	0.504	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	120.9	173.9	0	0	0	0	0	109	A385 K558	A385-A387 PolarHBondContact O-N 2.88Å; A387-K558 HydrophobicContact CB-CB 4Å
388	E	88.2	Confident	80.4	Confident	78 Å²	78	50.4 Å²	50.4	36%	0.364	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	151.7	175.4	-70.2	177.6	-173.1	0	0	109	A386 R390 K558 A559 R561	A386-E388 PolarHBondContact O-N 3.37Å; E388-R390 PolarHBondContact O-N 2.93Å; E388-K558 CarbonylContact O-C 3.55Å; E388-K558 VanDerWaalsContact O-CA 3.29Å; E388-K558 WeakPolarHBondContact O-CA 3.31Å; E388-A559 PolarHBondContact N-O 3.33Å; E388-A559 PolarHBondContact O-N 3.47Å; E388-R561 WeakPolarHBondContact OE2-CD 3.39Å; E388-R561 IonicContact OE2-NH1 3.51Å
389	P	89.6	Confident	81.5	Confident	120 Å²	120	47.7 Å²	47.7	78%	0.779	31%	0.308	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-60.1	134.3	171.6	26.8	-33.6	0	0	0	109.5	L557	P389-L557 WeakPolarHBondContact CA-O 3.1Å
390	R	90.9	Very high	82.6	Confident	54 Å²	54	45.3 Å²	45.3	20%	0.204	29%	0.289	C	S	.	.			trans	-113.1	155.5	179.2	68.1	166.2	175.3	99.6	0.5	111.5	E388 D463 L557 A559	E388-R390 PolarHBondContact O-N 2.93Å; R390-D463 IonicContact CZ-OD1 3.36Å; R390-D463 IonicContact CZ-OD2 3.27Å; R390-D463 IonicContact NH1-OD1 3.25Å; R390-D463 IonicContact NH1-OD2 3.77Å; R390-D463 PolarHBondContact NH1-OD2 2.88Å; R390-D463 VanDerWaalsContact NH2-CG 3.29Å; R390-D463 IonicContact NH2-OD1 3.85Å; R390-D463 PolarHBondContact NH2-OD1 2.93Å; R390-D463 IonicContact NH2-OD2 2.93Å; R390-D463 PolarHBondContact NH2-OD2 3.35Å; R390-L557 HydrophobicContact CG-CB 3.99Å; R390-L557 PolarHBondContact N-O 3.17Å; R390-A559 HydrophobicContact CB-CB 4.13Å; R390-A559 HydrophobicContact CG-CB 4.18Å
391	A	92.1	Very high	83.8	Confident	17 Å²	17	47.3 Å²	47.3	14%	0.14	30%	0.3	C	S	.	.	P	Polyproline II helix	trans	-61.6	140.1	172.1	0	0	0	0	0	111	M439 S623	A391-M439 HydrophobicContact CB-CB 4.06Å; A391-M439 HydrophobicContact CB-CG 4.2Å; A391-M439 WeakPolarHBondContact CB-O 3.4Å; A391-S623 WeakPolarHBondContact O-CB 3.31Å; A391-S623 PolarHBondContact O-OG 3.04Å
392	P	94.7	Very high	84.9	Confident	4 Å²	4	44.1 Å²	44.1	3%	0.026	29%	0.288	C	S	.	.	P	Polyproline II helix	trans	-67.3	143.7	171.6	27.9	-34.3	0	0	0	111.3	V394 M439 I440 T441 I464 I548 L549 A552 L557	P392-V394 HydrophobicContact CB-CG2 4.33Å; P392-M439 WeakPolarHBondContact CD-O 3.19Å; P392-I440 HydrophobicContact CG-CG1 4.38Å; P392-I440 HydrophobicContact CG-CG2 4.41Å; P392-T441 PolarHBondContact O-N 3.36Å; P392-I464 HydrophobicContact CB-CD1 4.23Å; P392-I548 HydrophobicContact CG-CG2 4.34Å; P392-L549 HydrophobicContact CG-CD2 4.47Å; P392-A552 HydrophobicContact CB-CB 3.69Å; P392-A552 HydrophobicContact CG-CB 3.67Å; P392-L557 HydrophobicContact CB-CD1 3.77Å
393	V	94.4	Very high	86	Confident	4 Å²	4	40.9 Å²	40.9	2%	0.024	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	124	169.1	-166.2	0	0	0	0	108.4	T441 L443 T462 D463 I464 L585	V393-T441 CarbonylContact C-O 3.54Å; V393-T441 WeakPolarHBondContact CA-O 3.17Å; V393-T441 HydrophobicContact CG1-CG2 4.11Å; V393-L443 HydrophobicContact CG1-CD1 4.11Å; V393-L443 HydrophobicContact CG1-CD2 4.38Å; V393-L443 HydrophobicContact CG1-CG 3.9Å; V393-T462 HydrophobicContact CB-CG2 4.19Å; V393-T462 HydrophobicContact CG1-CG2 3.63Å; V393-T462 VanDerWaalsContact O-CB 3.24Å; V393-T462 WeakPolarHBondContact O-CB 3.41Å; V393-D463 PolarHBondContact N-OD2 3.48Å; V393-D463 PolarHBondContact O-N 3.43Å; V393-I464 PolarHBondContact O-N 3.48Å; V393-L585 HydrophobicContact CB-CD2 4.42Å; V393-L585 HydrophobicContact CG1-CD1 4.4Å; V393-L585 HydrophobicContact CG1-CD2 3.71Å; V393-L585 HydrophobicContact CG2-CD1 4.38Å; V393-L585 HydrophobicContact CG2-CD2 4.12Å
394	V	94.5	Very high	87.2	Confident	0 Å²	0	34.5 Å²	34.5	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	123.3	-167.5	-176.6	0	0	0	0	110.1	P392 I440 T441 F442 L443 I464 V466 I548	P392-V394 HydrophobicContact CB-CG2 4.33Å; V394-I440 HydrophobicContact CB-CG2 4.45Å; V394-I440 HydrophobicContact CG2-CG2 3.74Å; V394-T441 PolarHBondContact N-O 3.49Å; V394-F442 HydrophobicContact CB-CD1 3.99Å; V394-F442 HydrophobicContact CB-CE1 4.11Å; V394-F442 HydrophobicContact CG1-CD1 4.11Å; V394-F442 HydrophobicContact CG1-CE1 4Å; V394-F442 CarbonylContact O-C 3.51Å; V394-F442 VanDerWaalsContact O-CA 3.3Å; V394-F442 WeakPolarHBondContact O-CA 3.49Å; V394-L443 PolarHBondContact O-N 2.99Å; V394-I464 VanDerWaalsContact CA-O 3.31Å; V394-I464 WeakPolarHBondContact CA-O 3.42Å; V394-I464 HydrophobicContact CG2-CB 4.38Å; V394-V466 HydrophobicContact CG1-CB 4.3Å; V394-V466 HydrophobicContact CG1-CG2 3.41Å; V394-V466 VanDerWaalsContact CG1-CG2 3.41Å; V394-I548 HydrophobicContact CG1-CD1 4.29Å; V394-I548 HydrophobicContact CG2-CG2 3.56Å
395	T	92.7	Very high	88.3	Confident	0 Å²	0	31.6 Å²	31.6	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97	135.7	172.1	-63.4	0	0	0	0	110.4	M397 L443 T445 G458 T462 I464 V465 V466	T395-M397 HydrophobicContact CG2-CE 3.59Å; T395-M397 HydrophobicContact CG2-CG 3.81Å; T395-L443 WeakPolarHBondContact CA-O 3.19Å; T395-T445 HydrophobicContact CG2-CG2 3.54Å; T395-G458 PolarHBondContact OG1-O 2.97Å; T395-G458 VanDerWaalsContact OG1-O 3.1Å; T395-T462 WeakPolarHBondContact OG1-CG2 3.32Å; T395-T462 PolarHBondContact OG1-OG1 3.4Å; T395-T462 VanDerWaalsContact OG1-OG1 3.09Å; T395-I464 PolarHBondContact N-O 2.96Å; T395-V465 WeakPolarHBondContact O-CA 3.27Å; T395-V466 PolarHBondContact O-N 3.23Å
396	I	92.2	Very high	89	Confident	0 Å²	0	32.9 Å²	32.9	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95	122.2	170.5	-53.2	-151.4	0	0	0	110.3	K404 L407 L408 F442 L443 T445 V466 V468	I396-K404 HydrophobicContact CG2-CB 4.34Å; I396-K404 HydrophobicContact CG2-CD 4.2Å; I396-K404 HydrophobicContact CG2-CG 4.08Å; I396-L407 HydrophobicContact CD1-CD2 3.42Å; I396-L407 VanDerWaalsContact CD1-CD2 3.42Å; I396-L408 HydrophobicContact CB-CD2 4.32Å; I396-L408 HydrophobicContact CD1-CD2 3.25Å; I396-L408 HydrophobicContact CD1-CG 3.94Å; I396-L408 HydrophobicContact CG1-CD2 3.74Å; I396-F442 HydrophobicContact CD1-CD1 4.11Å; I396-F442 HydrophobicContact CD1-CE1 4.28Å; I396-F442 HydrophobicContact CG1-CD1 4.17Å; I396-L443 PolarHBondContact N-O 3.42Å; I396-L443 VanDerWaalsContact N-O 3.11Å; I396-T445 PolarHBondContact O-OG1 2.94Å; I396-V466 WeakPolarHBondContact CA-O 3.3Å; I396-V466 HydrophobicContact CG1-CB 4.31Å; I396-V468 HydrophobicContact CG2-CG2 3.42Å; I396-V468 VanDerWaalsContact CG2-CG2 3.42Å
397	M	91.5	Very high	89.5	Confident	0 Å²	0	29.2 Å²	29.2	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	159.1	-179.5	-60.2	-165.9	177.2	0	0	112	T395 R455 A459 V465 V466 V468 A482	T395-M397 HydrophobicContact CG2-CE 3.59Å; T395-M397 HydrophobicContact CG2-CG 3.81Å; M397-R455 HydrophobicContact CE-CB 4.49Å; M397-R455 WeakPolarHBondContact CE-O 3.48Å; M397-A459 HydrophobicContact CE-CB 3.82Å; M397-V465 HydrophobicContact CB-CG1 4.14Å; M397-V465 HydrophobicContact CE-CG2 4.45Å; M397-V465 HydrophobicContact CG-CG1 3.87Å; M397-V465 HydrophobicContact SD-CG1 3.89Å; M397-V466 PolarHBondContact N-O 3.1Å; M397-V468 PolarHBondContact O-N 3.3Å; M397-A482 HydrophobicContact CB-CB 3.85Å; M397-A482 HydrophobicContact SD-CB 4.2Å
398	G	89.5	Confident	89.6	Confident	0 Å²	0	26.3 Å²	26.3	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	150.7	-174.8	-177.2	0	0	0	0	0	113	K404	G398-K404 VanDerWaalsContact C-CE 3.45Å; G398-K404 WeakPolarHBondContact O-CE 3.48Å; G398-K404 PolarHBondContact O-NZ 2.91Å
399	H	90.1	Very high	89.3	Confident	24 Å²	24	23.4 Å²	23.4	11%	0.111	14%	0.14	C	C	.	.			trans	-76.2	156.4	175.6	-173.5	63.3	0	0	0	112	D401 H402 K404 M476 Q478	H399-D401 VanDerWaalsContact C-N 3.33Å; H399-D401 PolarHBondContact CD2-N 2.87Å; H399-D401 IonicContact NE2-OD2 3.52Å; H399-D401 PolarHBondContact O-N 3.44Å; H399-H402 HydrophobicContact CB-CB 4.47Å; H399-H402 VanDerWaalsContact CB-CE1 3.43Å; H399-H402 WeakPolarHBondContact CB-CE1 3.48Å; H399-H402 WeakPolarHBondContact CB-ND1 3.42Å; H399-H402 WeakPolarHBondContact CB-NE2 3.17Å; H399-H402 AromaticContact CD2-CD2 3.95Å; H399-H402 PolarHBondContact O-N 2.83Å; H399-K404 WeakPolarHBondContact O-CE 3.4Å; H399-M476 HydrophobicContact CB-CB 4.19Å; H399-M476 PolarHBondContact CD2-SD 3.48Å; H399-M476 VanDerWaalsContact CE1-SD 3.59Å; H399-M476 PolarHBondContact NE2-SD 3.25Å; H399-Q478 HydrophobicContact CB-CB 4.48Å; H399-Q478 PolarHBondContact CE1-OE1 3.01Å; H399-Q478 VanDerWaalsContact ND1-CD 3.3Å; H399-Q478 PolarHBondContact ND1-OE1 2.89Å
400	V	84.9	Confident	89.1	Confident	42 Å²	42	23.1 Å²	23.1	26%	0.255	12%	0.124	S	C	.	.	G	3₁₀ helix	trans	-56.9	-44.7	-179.1	-177.3	0	0	0	0	111.7	H402 I424 G447 H448	V400-H402 VanDerWaalsContact C-N 3.31Å; V400-H402 PolarHBondContact O-N 2.87Å; V400-I424 HydrophobicContact CG1-CG2 3.85Å; V400-G447 VanDerWaalsContact CG2-C 3.49Å; V400-G447 WeakPolarHBondContact CG2-O 3.33Å; V400-H448 HydrophobicContact CG2-CB 4.06Å
401	D	87	Confident	88.9	Confident	106 Å²	106	21.4 Å²	21.4	57%	0.567	12%	0.119	S	C	*	.	G	3₁₀ helix	trans	-86.3	4.4	-175	-61.5	-37.3	0	0	0	114.7	H399 G403 K499	H399-D401 VanDerWaalsContact C-N 3.33Å; H399-D401 PolarHBondContact CD2-N 2.87Å; H399-D401 IonicContact NE2-OD2 3.52Å; H399-D401 PolarHBondContact O-N 3.44Å; D401-G403 PolarHBondContact O-N 3.01Å; D401-K499 WeakPolarHBondContact O-CE 3.35Å; D401-K499 PolarHBondContact O-NZ 3.5Å; D401-K499 VanDerWaalsContact O-NZ 3.08Å
402	H	90.5	Very high	88.3	Confident	0 Å²	0	22.8 Å²	22.8	0%	0	12%	0.12	C	C	.	.	G	3₁₀ helix	trans	-80.1	-2.5	177.8	-66.9	-179.5	0	0	0	113.7	H399 V400 V468 V469 A470 G474 T479 N498	H399-H402 HydrophobicContact CB-CB 4.47Å; H399-H402 VanDerWaalsContact CB-CE1 3.43Å; H399-H402 WeakPolarHBondContact CB-CE1 3.48Å; H399-H402 WeakPolarHBondContact CB-ND1 3.42Å; H399-H402 WeakPolarHBondContact CB-NE2 3.17Å; H399-H402 AromaticContact CD2-CD2 3.95Å; H399-H402 PolarHBondContact O-N 2.83Å; V400-H402 VanDerWaalsContact C-N 3.31Å; V400-H402 PolarHBondContact O-N 2.87Å; H402-V468 HydrophobicContact CB-CG1 4.14Å; H402-V468 PolarHBondContact ND1-O 3.07Å; H402-V469 WeakPolarHBondContact ND1-CA 3.42Å; H402-A470 HydrophobicContact CB-CB 4.17Å; H402-G474 PolarHBondContact CE1-O 3.43Å; H402-G474 PolarHBondContact NE2-O 3.03Å; H402-T479 PolarHBondContact CE1-OG1 3.29Å; H402-N498 PolarHBondContact O-ND2 3.48Å
403	G	87	Confident	87.2	Confident	14 Å²	14	28.1 Å²	28.1	14%	0.144	16%	0.158	C	C	.	.			trans	83.9	31.9	174.2	0	0	0	0	0	115	D401 S406 L407	D401-G403 PolarHBondContact O-N 3.01Å; G403-S406 PolarHBondContact O-N 3.13Å; G403-L407 PolarHBondContact O-N 2.94Å
404	K	88	Confident	85.5	Confident	5 Å²	5	31.8 Å²	31.8	2%	0.022	18%	0.18	C	C	.	.	H	α-helix	trans	-61	-52.6	178.2	-69.9	-174.1	-74.3	167.6	0	113.4	I396 G398 H399 S406 L407 L408 V468	I396-K404 HydrophobicContact CG2-CB 4.34Å; I396-K404 HydrophobicContact CG2-CD 4.2Å; I396-K404 HydrophobicContact CG2-CG 4.08Å; G398-K404 VanDerWaalsContact C-CE 3.45Å; G398-K404 WeakPolarHBondContact O-CE 3.48Å; G398-K404 PolarHBondContact O-NZ 2.91Å; H399-K404 WeakPolarHBondContact O-CE 3.4Å; K404-S406 PolarHBondContact O-N 3.37Å; K404-L407 PolarHBondContact O-N 3.31Å; K404-L407 VanDerWaalsContact O-N 3.13Å; K404-L408 WeakPolarHBondContact O-CG 3.35Å; K404-L408 PolarHBondContact O-N 3.16Å; K404-V468 HydrophobicContact CD-CB 4.49Å; K404-V468 HydrophobicContact CG-CB 3.81Å; K404-V468 HydrophobicContact CG-CG1 4.19Å; K404-V468 HydrophobicContact CG-CG2 4.02Å
405	T	83.7	Confident	83.8	Confident	20 Å²	20	39.8 Å²	39.8	12%	0.123	22%	0.215	C	C	.	.	H	α-helix	trans	-60.9	-37.2	177.2	-47.6	0	0	0	0	110.8	L408 D409 A417 T425	T405-L408 PolarHBondContact O-N 3.49Å; T405-D409 VanDerWaalsContact O-CB 3.26Å; T405-D409 WeakPolarHBondContact O-CB 3.21Å; T405-D409 PolarHBondContact O-N 3Å; T405-A417 HydrophobicContact CG2-CB 3.97Å; T405-T425 HydrophobicContact CG2-CG2 3.64Å; T405-T425 WeakPolarHBondContact OG1-CG2 3.19Å
406	S	85.3	Confident	82	Confident	64 Å²	64	41.6 Å²	41.6	45%	0.448	23%	0.226	S	C	.	.	H	α-helix	trans	-64.6	-40	175.4	-51.8	0	0	0	0	112.9	G403 K404 D409 Y410	G403-S406 PolarHBondContact O-N 3.13Å; K404-S406 PolarHBondContact O-N 3.37Å; S406-D409 PolarHBondContact O-N 3.33Å; S406-Y410 PolarHBondContact O-N 2.88Å; S406-Y410 VanDerWaalsContact O-N 3.1Å
407	L	88.1	Confident	80	Confident	0 Å²	0	43.2 Å²	43.2	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-65.3	-45.4	176.7	-177.5	140.7	0	0	0	110.8	I396 G403 K404 Y410 I411 V533 A535 L544	I396-L407 HydrophobicContact CD1-CD2 3.42Å; I396-L407 VanDerWaalsContact CD1-CD2 3.42Å; G403-L407 PolarHBondContact O-N 2.94Å; K404-L407 PolarHBondContact O-N 3.31Å; K404-L407 VanDerWaalsContact O-N 3.13Å; L407-Y410 PolarHBondContact O-N 3.47Å; L407-I411 HydrophobicContact CD2-CD1 3.6Å; L407-I411 HydrophobicContact CG-CD1 4.32Å; L407-I411 WeakPolarHBondContact O-CG1 3.49Å; L407-I411 PolarHBondContact O-N 2.96Å; L407-I411 VanDerWaalsContact O-N 3.11Å; L407-V533 HydrophobicContact CD1-CG2 3.89Å; L407-A535 HydrophobicContact CB-CB 3.94Å; L407-L544 HydrophobicContact CD1-CD2 4.13Å; L407-L544 HydrophobicContact CD2-CD2 4.4Å
408	L	86	Confident	78.4	Confident	0 Å²	0	48 Å²	48	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-66.6	-37.9	176.8	-64.5	166.6	0	0	0	112.3	I396 K404 T405 Y410 I411 R412 Y431 D444	I396-L408 HydrophobicContact CB-CD2 4.32Å; I396-L408 HydrophobicContact CD1-CD2 3.25Å; I396-L408 HydrophobicContact CD1-CG 3.94Å; I396-L408 HydrophobicContact CG1-CD2 3.74Å; K404-L408 WeakPolarHBondContact O-CG 3.35Å; K404-L408 PolarHBondContact O-N 3.16Å; T405-L408 PolarHBondContact O-N 3.49Å; L408-Y410 VanDerWaalsContact C-N 3.31Å; L408-Y410 PolarHBondContact O-N 3.38Å; L408-I411 PolarHBondContact O-N 3.24Å; L408-R412 WeakPolarHBondContact O-CB 3.32Å; L408-R412 VanDerWaalsContact O-CG 3.29Å; L408-R412 WeakPolarHBondContact O-CG 3.5Å; L408-R412 PolarHBondContact O-N 3.27Å; L408-R412 PolarHBondContact O-NE 3.24Å; L408-Y431 WeakPolarHBondContact CA-OH 3.27Å; L408-Y431 HydrophobicContact CB-CE1 4.5Å; L408-Y431 WeakPolarHBondContact CB-OH 3.37Å; L408-Y431 HydrophobicContact CD2-CE1 3.81Å; L408-Y431 WeakPolarHBondContact CD2-OH 3.44Å; L408-Y431 PolarHBondContact O-OH 3.31Å; L408-D444 HydrophobicContact CD1-CB 3.64Å; L408-D444 WeakPolarHBondContact CD1-OD1 3.49Å; L408-D444 WeakPolarHBondContact CD1-OD2 3.45Å
409	D	83.2	Confident	77.1	Confident	17 Å²	17	51.3 Å²	51.3	9%	0.091	31%	0.307	C	S	.	.	H	α-helix	trans	-64.1	-37.1	176.5	-81.1	-2.1	0	0	0	111.9	T405 S406 R412 S413 T414 V416 A417	T405-D409 VanDerWaalsContact O-CB 3.26Å; T405-D409 WeakPolarHBondContact O-CB 3.21Å; T405-D409 PolarHBondContact O-N 3Å; S406-D409 PolarHBondContact O-N 3.33Å; D409-R412 IonicContact OD1-CZ 2.76Å; D409-R412 IonicContact OD1-NE 2.71Å; D409-R412 IonicContact OD1-NH2 3.6Å; D409-R412 PolarHBondContact OD1-NH2 2.87Å; D409-S413 PolarHBondContact O-N 3.36Å; D409-T414 VanDerWaalsContact CA-O 3.29Å; D409-T414 WeakPolarHBondContact CA-O 3.34Å; D409-T414 WeakPolarHBondContact CB-O 3.44Å; D409-T414 PolarHBondContact O-N 2.94Å; D409-T414 VanDerWaalsContact O-O 3.12Å; D409-V416 PolarHBondContact OD1-N 3.43Å; D409-V416 PolarHBondContact OD2-N 3.24Å; D409-A417 VanDerWaalsContact OD2-CB 3.23Å; D409-A417 WeakPolarHBondContact OD2-CB 3.48Å; D409-A417 PolarHBondContact OD2-N 3.4Å; D409-A417 VanDerWaalsContact OD2-N 3.09Å
410	Y	85.6	Confident	76	Confident	115 Å²	115	52.6 Å²	52.6	45%	0.451	31%	0.313	S	S	.	.	H	α-helix	trans	-64.4	-48.6	172.9	-171.7	-81.3	0	0	0	111	S406 L407 L408 R412 S413 G538 I541	S406-Y410 PolarHBondContact O-N 2.88Å; S406-Y410 VanDerWaalsContact O-N 3.1Å; L407-Y410 PolarHBondContact O-N 3.47Å; L408-Y410 VanDerWaalsContact C-N 3.31Å; L408-Y410 PolarHBondContact O-N 3.38Å; Y410-R412 VanDerWaalsContact C-N 3.35Å; Y410-R412 PolarHBondContact O-N 3.49Å; Y410-S413 PolarHBondContact O-N 2.9Å; Y410-S413 VanDerWaalsContact O-N 3.12Å; Y410-G538 VanDerWaalsContact CE2-CA 3.47Å; Y410-G538 WeakPolarHBondContact OH-CA 3.49Å; Y410-I541 HydrophobicContact CD1-CB 4.46Å; Y410-I541 HydrophobicContact CD1-CD1 3.13Å; Y410-I541 HydrophobicContact CD1-CG1 4.34Å; Y410-I541 HydrophobicContact CD1-CG2 4.19Å; Y410-I541 HydrophobicContact CD2-CD1 4.28Å; Y410-I541 HydrophobicContact CE1-CB 4.37Å; Y410-I541 HydrophobicContact CE1-CD1 3.57Å; Y410-I541 HydrophobicContact CE1-CG2 4.37Å; Y410-I541 HydrophobicContact CG-CD1 3.53Å
411	I	85.4	Confident	74.9	Confident	18 Å²	18	52.7 Å²	52.7	9%	0.092	32%	0.318	C	S	.	.	H	α-helix	trans	-61.1	-42.3	179.7	-67	169.9	0	0	0	111.3	L407 L408 S413 Y431 V433 F442 I541 L545	L407-I411 HydrophobicContact CD2-CD1 3.6Å; L407-I411 HydrophobicContact CG-CD1 4.32Å; L407-I411 WeakPolarHBondContact O-CG1 3.49Å; L407-I411 PolarHBondContact O-N 2.96Å; L407-I411 VanDerWaalsContact O-N 3.11Å; L408-I411 PolarHBondContact O-N 3.24Å; I411-S413 PolarHBondContact O-N 3.12Å; I411-Y431 HydrophobicContact CG2-CE2 4.09Å; I411-V433 HydrophobicContact CG2-CG1 4.34Å; I411-V433 HydrophobicContact CG2-CG2 3.64Å; I411-F442 HydrophobicContact CD1-CZ 4.37Å; I411-F442 HydrophobicContact CG2-CE2 4.1Å; I411-I541 HydrophobicContact CD1-CG2 4.4Å; I411-I541 HydrophobicContact CG1-CG2 3.79Å; I411-L545 HydrophobicContact CD1-CD2 4.49Å
412	R	79.4	Confident	73.9	Confident	45 Å²	45	50.7 Å²	50.7	17%	0.17	32%	0.323	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.9	-10.8	178.6	-72.3	-176.2	-70.5	-156.7	-2.8	114	L408 D409 Y410 T414 Y431	L408-R412 WeakPolarHBondContact O-CB 3.32Å; L408-R412 VanDerWaalsContact O-CG 3.29Å; L408-R412 WeakPolarHBondContact O-CG 3.5Å; L408-R412 PolarHBondContact O-N 3.27Å; L408-R412 PolarHBondContact O-NE 3.24Å; D409-R412 IonicContact OD1-CZ 2.76Å; D409-R412 IonicContact OD1-NE 2.71Å; D409-R412 IonicContact OD1-NH2 3.6Å; D409-R412 PolarHBondContact OD1-NH2 2.87Å; Y410-R412 VanDerWaalsContact C-N 3.35Å; Y410-R412 PolarHBondContact O-N 3.49Å; R412-T414 PolarHBondContact O-N 3.37Å; R412-T414 PolarHBondContact O-OG1 3.19Å; R412-Y431 HydrophobicContact CG-CD1 4.36Å; R412-Y431 HydrophobicContact CG-CD2 3.83Å; R412-Y431 HydrophobicContact CG-CE1 4.01Å; R412-Y431 HydrophobicContact CG-CE2 3.44Å; R412-Y431 VanDerWaalsContact CG-CE2 3.44Å; R412-Y431 HydrophobicContact CG-CG 4.25Å
413	S	71.6	Confident	72.9	Confident	116 Å²	116	52.5 Å²	52.5	81%	0.811	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.1	23.4	-165.4	-60.9	0	0	0	0	113.1	D409 Y410 I411	D409-S413 PolarHBondContact O-N 3.36Å; Y410-S413 PolarHBondContact O-N 2.9Å; Y410-S413 VanDerWaalsContact O-N 3.12Å; I411-S413 PolarHBondContact O-N 3.12Å
414	T	60.4	Low	72.4	Confident	81 Å²	81	54 Å²	54	50%	0.497	35%	0.346	S	S	.	.	S	Bend	trans	-138.2	138	-172.6	-57.3	0	0	0	0	108.7	D409 R412 V416	D409-T414 VanDerWaalsContact CA-O 3.29Å; D409-T414 WeakPolarHBondContact CA-O 3.34Å; D409-T414 WeakPolarHBondContact CB-O 3.44Å; D409-T414 PolarHBondContact O-N 2.94Å; D409-T414 VanDerWaalsContact O-O 3.12Å; R412-T414 PolarHBondContact O-N 3.37Å; R412-T414 PolarHBondContact O-OG1 3.19Å; T414-V416 PolarHBondContact O-N 3.15Å
415	K	57.1	Low	71.8	Confident	169 Å²	169	54 Å²	54	74%	0.735	35%	0.346	S	S	*	.			trans	-94.5	92.9	-179.8	-65.5	-178.5	-179.1	-179.7	0	110.8	S418	K415-S418 PolarHBondContact O-OG 3.35Å; K415-S418 VanDerWaalsContact O-OG 3.06Å
416	V	56.6	Low	71.5	Confident	38 Å²	38	53.6 Å²	53.6	23%	0.23	34%	0.343	C	S	.	.			trans	-77	-31.4	172.7	179.1	0	0	0	0	110.8	D409 T414 S418 G419 E420	D409-V416 PolarHBondContact OD1-N 3.43Å; D409-V416 PolarHBondContact OD2-N 3.24Å; T414-V416 PolarHBondContact O-N 3.15Å; V416-S418 PolarHBondContact O-N 3.02Å; V416-G419 PolarHBondContact O-N 2.68Å; V416-E420 HydrophobicContact CG1-CG 4.25Å; V416-E420 WeakPolarHBondContact CG1-OE1 3.45Å; V416-E420 PolarHBondContact O-N 3.47Å
417	A	49.9	Very low	71.3	Confident	34 Å²	34	52.6 Å²	52.6	28%	0.281	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.8	-25.8	-179.9	0	0	0	0	0	114.3	T405 D409	T405-A417 HydrophobicContact CG2-CB 3.97Å; D409-A417 VanDerWaalsContact OD2-CB 3.23Å; D409-A417 WeakPolarHBondContact OD2-CB 3.48Å; D409-A417 PolarHBondContact OD2-N 3.4Å; D409-A417 VanDerWaalsContact OD2-N 3.09Å
418	S	57.9	Low	71	Confident	99 Å²	99	52.9 Å²	52.9	69%	0.692	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.9	-18.4	175.5	46.5	0	0	0	0	114.6	K415 V416	K415-S418 PolarHBondContact O-OG 3.35Å; K415-S418 VanDerWaalsContact O-OG 3.06Å; V416-S418 PolarHBondContact O-N 3.02Å
419	G	60.9	Low	70.9	Confident	70 Å²	70	53.9 Å²	53.9	72%	0.722	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.2	-30.5	-177.7	0	0	0	0	0	114.1	V416	V416-G419 PolarHBondContact O-N 2.68Å
420	E	67.4	Low	71.2	Confident	51 Å²	51	53.3 Å²	53.3	24%	0.238	34%	0.341	C	S	.	.	S	Bend	trans	-87.2	141.5	-177.2	-67.4	-167.9	-144.5	0	0	113.1	V416 G422 G423 I424 T425 Q426	V416-E420 HydrophobicContact CG1-CG 4.25Å; V416-E420 WeakPolarHBondContact CG1-OE1 3.45Å; V416-E420 PolarHBondContact O-N 3.47Å; E420-G422 PolarHBondContact O-N 3.24Å; E420-G423 PolarHBondContact O-N 2.89Å; E420-I424 WeakPolarHBondContact CB-O 3.48Å; E420-T425 VanDerWaalsContact OE2-CA 3.24Å; E420-T425 WeakPolarHBondContact OE2-CA 3.36Å; E420-Q426 PolarHBondContact OE2-N 2.91Å
421	A	61.2	Low	71.3	Confident	44 Å²	44	48 Å²	48	36%	0.364	32%	0.32	S	S	.	.	G	3₁₀ helix	trans	-64.8	125.6	178.1	0	0	0	0	0	110.5	Q426	A421-Q426 PolarHBondContact O-NE2 3.02Å
422	G	66.1	Low	71.5	Confident	65 Å²	65	50 Å²	50	67%	0.67	33%	0.328	S	S	*	.	G	3₁₀ helix	trans	85.6	0.2	-177.9	0	0	0	0	0	115	E420 I424	E420-G422 PolarHBondContact O-N 3.24Å; G422-I424 PolarHBondContact O-N 3.34Å
423	G	71	Confident	71.9	Confident	38 Å²	38	49 Å²	49	39%	0.392	33%	0.327	S	S	.	.	G	3₁₀ helix	trans	68.7	15.3	177.4	0	0	0	0	0	114.9	E420	E420-G423 PolarHBondContact O-N 2.89Å
424	I	75.4	Confident	72.5	Confident	45 Å²	45	51.1 Å²	51.1	23%	0.231	33%	0.325	C	S	.	.	S	Bend	trans	-116.2	154.2	178.5	60.7	171.7	0	0	0	109.7	V400 E420 G422 Q426	V400-I424 HydrophobicContact CG1-CG2 3.85Å; E420-I424 WeakPolarHBondContact CB-O 3.48Å; G422-I424 PolarHBondContact O-N 3.34Å; I424-Q426 HydrophobicContact CG1-CG 4.32Å
425	T	75.9	Confident	73.4	Confident	6 Å²	6	48.9 Å²	48.9	4%	0.037	31%	0.311	C	S	.	.			trans	-76.7	123.4	171.9	50.5	0	0	0	0	109.6	T405 E420 D444 P446	T405-T425 HydrophobicContact CG2-CG2 3.64Å; T405-T425 WeakPolarHBondContact OG1-CG2 3.19Å; E420-T425 VanDerWaalsContact OE2-CA 3.24Å; E420-T425 WeakPolarHBondContact OE2-CA 3.36Å; T425-D444 WeakPolarHBondContact CG2-OD2 3.44Å; T425-P446 VanDerWaalsContact O-CB 3.3Å; T425-P446 WeakPolarHBondContact O-CB 3.36Å
426	Q	77.5	Confident	74.4	Confident	11 Å²	11	50.3 Å²	50.3	5%	0.051	32%	0.32	C	S	.	.			trans	-103.1	-28.3	-179.4	-59	-165.7	38.4	0	0	113.4	E420 A421 I424 F451 S769	E420-Q426 PolarHBondContact OE2-N 2.91Å; A421-Q426 PolarHBondContact O-NE2 3.02Å; I424-Q426 HydrophobicContact CG1-CG 4.32Å; Q426-F451 WeakPolarHBondContact O-CE1 3.5Å; Q426-S769 PolarHBondContact NE2-O 3.45Å; Q426-S769 PolarHBondContact OE1-O 3.14Å; Q426-S769 VanDerWaalsContact OE1-O 3.09Å
427	H	80.1	Confident	75.3	Confident	42 Å²	42	54.1 Å²	54.1	19%	0.194	34%	0.339	C	S	.	.	S	Bend	trans	-110.3	159.3	-178.1	-55.1	-54.2	0	0	0	110.6	G429 E571 D696 V697	H427-G429 PolarHBondContact O-N 2.95Å; H427-E571 WeakPolarHBondContact CA-OE1 3.12Å; H427-D696 IonicContact CE1-OD1 3.73Å; H427-D696 IonicContact CE1-OD2 2.84Å; H427-D696 PolarHBondContact CE1-OD2 3.38Å; H427-D696 IonicContact NE2-OD2 3.78Å; H427-D696 PolarHBondContact NE2-OD2 3.09Å; H427-D696 VanDerWaalsContact NE2-OD2 3.12Å; H427-V697 WeakPolarHBondContact ND1-CG2 3.47Å
428	I	83.1	Confident	76.8	Confident	6 Å²	6	53.9 Å²	53.9	3%	0.031	34%	0.34	C	S	.	.			trans	-78.1	102.3	170.4	-50.7	175.4	0	0	0	108.5	D444 T445 M454 I570 E571	I428-D444 VanDerWaalsContact CA-O 3.22Å; I428-D444 WeakPolarHBondContact CA-O 3.29Å; I428-D444 WeakPolarHBondContact CG2-O 3.43Å; I428-T445 HydrophobicContact CG2-CG2 4.32Å; I428-M454 HydrophobicContact CD1-CB 3.9Å; I428-M454 HydrophobicContact CD1-CG 4.17Å; I428-M454 HydrophobicContact CD1-SD 4.29Å; I428-M454 HydrophobicContact CG1-CB 4.22Å; I428-M454 HydrophobicContact CG1-CG 4.4Å; I428-M454 HydrophobicContact CG1-SD 3.89Å; I428-I570 HydrophobicContact CB-CG2 3.82Å; I428-I570 HydrophobicContact CG2-CG2 3.36Å; I428-E571 HydrophobicContact CB-CG 4Å; I428-E571 HydrophobicContact CG1-CG 4.43Å; I428-E571 VanDerWaalsContact N-CD 3.34Å; I428-E571 PolarHBondContact N-OE1 3.22Å
429	G	84.2	Confident	78.2	Confident	22 Å²	22	51.6 Å²	51.6	23%	0.227	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	149.5	172.3	0	0	0	0	0	111.3	H427 L443 D444	H427-G429 PolarHBondContact O-N 2.95Å; G429-L443 CarbonylContact O-C 3.56Å; G429-L443 WeakPolarHBondContact O-CA 3.38Å; G429-D444 PolarHBondContact N-O 2.75Å; G429-D444 PolarHBondContact O-N 3.34Å
430	A	88.5	Confident	79.7	Confident	5 Å²	5	48.3 Å²	48.3	4%	0.041	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	106.4	-176.6	0	0	0	0	0	111.3	F442 L443 I570 E612 P625	A430-F442 CarbonylContact C-O 3.57Å; A430-F442 WeakPolarHBondContact CA-O 2.83Å; A430-L443 HydrophobicContact CB-CD2 3.43Å; A430-L443 VanDerWaalsContact CB-CD2 3.43Å; A430-I570 HydrophobicContact CB-CD1 3.51Å; A430-E612 PolarHBondContact N-OE1 2.97Å; A430-E612 WeakPolarHBondContact O-CG 3.47Å; A430-P625 HydrophobicContact CB-CB 3.72Å; A430-P625 HydrophobicContact CB-CG 4.21Å; A430-P625 WeakPolarHBondContact O-CB 3.33Å; A430-P625 WeakPolarHBondContact O-CG 3.39Å
431	Y	88.5	Confident	80.9	Confident	4 Å²	4	45.9 Å²	45.9	2%	0.016	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	163.7	-174.6	59.6	-85.6	0	0	0	113.1	L408 I411 R412 V433 T441 F442 E612	L408-Y431 WeakPolarHBondContact CA-OH 3.27Å; L408-Y431 HydrophobicContact CB-CE1 4.5Å; L408-Y431 WeakPolarHBondContact CB-OH 3.37Å; L408-Y431 HydrophobicContact CD2-CE1 3.81Å; L408-Y431 WeakPolarHBondContact CD2-OH 3.44Å; L408-Y431 PolarHBondContact O-OH 3.31Å; I411-Y431 HydrophobicContact CG2-CE2 4.09Å; R412-Y431 HydrophobicContact CG-CD1 4.36Å; R412-Y431 HydrophobicContact CG-CD2 3.83Å; R412-Y431 HydrophobicContact CG-CE1 4.01Å; R412-Y431 HydrophobicContact CG-CE2 3.44Å; R412-Y431 VanDerWaalsContact CG-CE2 3.44Å; R412-Y431 HydrophobicContact CG-CG 4.25Å; Y431-V433 HydrophobicContact CD2-CG2 3.58Å; Y431-V433 HydrophobicContact CE2-CG2 3.52Å; Y431-T441 CarbonylContact O-C 3.51Å; Y431-T441 VanDerWaalsContact O-CA 3.27Å; Y431-T441 WeakPolarHBondContact O-CA 3.3Å; Y431-T441 WeakPolarHBondContact O-CG2 3.36Å; Y431-F442 HydrophobicContact CD1-CB 3.9Å; Y431-F442 HydrophobicContact CD2-CB 4.07Å; Y431-F442 HydrophobicContact CD2-CD2 4.07Å; Y431-F442 HydrophobicContact CE1-CB 3.62Å; Y431-F442 HydrophobicContact CE1-CG 4.48Å; Y431-F442 HydrophobicContact CE2-CB 3.79Å; Y431-F442 AromaticContact CE2-CD2 3.56Å; Y431-F442 HydrophobicContact CE2-CD2 3.56Å; Y431-F442 HydrophobicContact CE2-CE2 4.49Å; Y431-F442 AromaticContact CE2-CG 3.95Å; Y431-F442 HydrophobicContact CE2-CG 3.95Å; Y431-F442 HydrophobicContact CG-CB 4.1Å; Y431-F442 AromaticContact CZ-CG 3.94Å; Y431-F442 PolarHBondContact N-O 3.11Å; Y431-F442 PolarHBondContact O-N 2.81Å; Y431-E612 WeakPolarHBondContact CA-OE1 3.29Å; Y431-E612 WeakPolarHBondContact CA-OE2 3.3Å; Y431-E612 WeakPolarHBondContact CB-OE1 3.36Å; Y431-E612 WeakPolarHBondContact CB-OE2 3.31Å; Y431-E612 PolarHBondContact N-OE1 2.96Å
432	H	89.2	Confident	82.4	Confident	58 Å²	58	43.8 Å²	43.8	27%	0.269	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	147.6	169.2	63.6	-83	0	0	0	111.2	M439 I440	H432-M439 HydrophobicContact CB-CE 3.35Å; H432-M439 WeakPolarHBondContact CD2-CE 3.4Å; H432-I440 CarbonylContact C-O 3.54Å; H432-I440 WeakPolarHBondContact CA-O 3.46Å
433	V	87.4	Confident	83.7	Confident	24 Å²	24	40.7 Å²	40.7	15%	0.145	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	129.9	176.9	-175.2	0	0	0	0	108	I411 Y431 T435 M439 I440 F442	I411-V433 HydrophobicContact CG2-CG1 4.34Å; I411-V433 HydrophobicContact CG2-CG2 3.64Å; Y431-V433 HydrophobicContact CD2-CG2 3.58Å; Y431-V433 HydrophobicContact CE2-CG2 3.52Å; V433-T435 HydrophobicContact CG1-CG2 4.32Å; V433-M439 WeakPolarHBondContact O-CA 3.24Å; V433-I440 PolarHBondContact N-O 2.97Å; V433-I440 PolarHBondContact O-N 3.34Å; V433-F442 HydrophobicContact CB-CE2 4.35Å; V433-F442 HydrophobicContact CG2-CD2 3.86Å; V433-F442 HydrophobicContact CG2-CE2 3.93Å
434	E	83.5	Confident	84.5	Confident	162 Å²	162	39 Å²	39	76%	0.757	21%	0.206	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-90.4	117.8	170.6	-66.2	-176.6	169.4	0	0	108.6
435	T	80.2	Confident	85.1	Confident	34 Å²	34	36.9 Å²	36.9	21%	0.209	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	165.6	172.2	72.1	0	0	0	0	109.5	V433 N437 G438 I440 L545 L549	V433-T435 HydrophobicContact CG1-CG2 4.32Å; T435-N437 PolarHBondContact O-N 3.48Å; T435-G438 WeakPolarHBondContact CA-O 3.43Å; T435-G438 WeakPolarHBondContact CB-O 3.34Å; T435-G438 PolarHBondContact N-O 3.35Å; T435-G438 PolarHBondContact O-N 3.21Å; T435-G438 PolarHBondContact OG1-N 3.38Å; T435-G438 PolarHBondContact OG1-O 3.1Å; T435-I440 HydrophobicContact CG2-CD1 4.17Å; T435-L545 HydrophobicContact CG2-CB 4.46Å; T435-L545 HydrophobicContact CG2-CD1 4.02Å; T435-L549 WeakPolarHBondContact OG1-CD1 3.22Å
436	E	77.1	Confident	85.4	Confident	199 Å²	199	36.6 Å²	36.6	93%	0.93	19%	0.194	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.9	-34.1	178.2	-60.3	-171.9	172.8	0	0	112.7
437	N	75.4	Confident	85.4	Confident	117 Å²	117	36.4 Å²	36.4	63%	0.626	19%	0.194	S	C	*	.	T	Hydrogen-bonded Turn	trans	-93.3	-10.1	-174.2	-67.1	-24	0	0	0	113.4	T435 D546 L549	T435-N437 PolarHBondContact O-N 3.48Å; N437-D546 PolarHBondContact ND2-OD1 3.26Å; N437-L549 HydrophobicContact CB-CD1 3.67Å
438	G	82.3	Confident	85.3	Confident	29 Å²	29	35.1 Å²	35.1	30%	0.299	19%	0.189	S	C	.	.	E	Extended strand (participates in β ladder)	trans	158.3	178.8	-178.4	0	0	0	0	0	114.6	T435	T435-G438 WeakPolarHBondContact CA-O 3.43Å; T435-G438 WeakPolarHBondContact CB-O 3.34Å; T435-G438 PolarHBondContact N-O 3.35Å; T435-G438 PolarHBondContact O-N 3.21Å; T435-G438 PolarHBondContact OG1-N 3.38Å; T435-G438 PolarHBondContact OG1-O 3.1Å
439	M	88	Confident	84.7	Confident	52 Å²	52	36.9 Å²	36.9	26%	0.256	20%	0.204	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-97	140.8	177.5	-176.1	-177.9	-169.9	0	0	110.1	A391 P392 H432 V433 I624	A391-M439 HydrophobicContact CB-CB 4.06Å; A391-M439 HydrophobicContact CB-CG 4.2Å; A391-M439 WeakPolarHBondContact CB-O 3.4Å; P392-M439 WeakPolarHBondContact CD-O 3.19Å; H432-M439 HydrophobicContact CB-CE 3.35Å; H432-M439 WeakPolarHBondContact CD2-CE 3.4Å; V433-M439 WeakPolarHBondContact O-CA 3.24Å; M439-I624 HydrophobicContact CE-CD1 4.38Å; M439-I624 HydrophobicContact CE-CG1 3.91Å
440	I	92.2	Very high	83.9	Confident	0 Å²	0	36.1 Å²	36.1	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	135.1	176.3	-54.7	170.3	0	0	0	108.7	P392 V394 H432 V433 T435 F442 L545 I548 L549	P392-I440 HydrophobicContact CG-CG1 4.38Å; P392-I440 HydrophobicContact CG-CG2 4.41Å; V394-I440 HydrophobicContact CB-CG2 4.45Å; V394-I440 HydrophobicContact CG2-CG2 3.74Å; H432-I440 CarbonylContact C-O 3.54Å; H432-I440 WeakPolarHBondContact CA-O 3.46Å; V433-I440 PolarHBondContact N-O 2.97Å; V433-I440 PolarHBondContact O-N 3.34Å; T435-I440 HydrophobicContact CG2-CD1 4.17Å; I440-F442 HydrophobicContact CB-CE2 4.02Å; I440-F442 HydrophobicContact CB-CZ 4.39Å; I440-F442 HydrophobicContact CG2-CD2 4.12Å; I440-F442 HydrophobicContact CG2-CE1 4.19Å; I440-F442 HydrophobicContact CG2-CE2 3.6Å; I440-F442 HydrophobicContact CG2-CZ 3.64Å; I440-L545 HydrophobicContact CD1-CB 4.26Å; I440-L545 HydrophobicContact CD1-CD2 3.95Å; I440-I548 HydrophobicContact CD1-CG2 4.14Å; I440-I548 HydrophobicContact CG2-CG2 4.16Å; I440-L549 HydrophobicContact CD1-CD1 4.25Å; I440-L549 HydrophobicContact CD1-CD2 4Å; I440-L549 HydrophobicContact CD1-CG 3.82Å; I440-L549 HydrophobicContact CG1-CD2 3.65Å; I440-L549 HydrophobicContact CG1-CG 4.08Å
441	T	93	Very high	83.5	Confident	0 Å²	0	36.1 Å²	36.1	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	123.9	174.4	-61.4	0	0	0	0	109.7	P392 V393 V394 Y431 L585 S623 P625	P392-T441 PolarHBondContact O-N 3.36Å; V393-T441 CarbonylContact C-O 3.54Å; V393-T441 WeakPolarHBondContact CA-O 3.17Å; V393-T441 HydrophobicContact CG1-CG2 4.11Å; V394-T441 PolarHBondContact N-O 3.49Å; Y431-T441 CarbonylContact O-C 3.51Å; Y431-T441 VanDerWaalsContact O-CA 3.27Å; Y431-T441 WeakPolarHBondContact O-CA 3.3Å; Y431-T441 WeakPolarHBondContact O-CG2 3.36Å; T441-L585 HydrophobicContact CG2-CD1 4.12Å; T441-S623 WeakPolarHBondContact CB-O 3.43Å; T441-S623 WeakPolarHBondContact CG2-O 3.29Å; T441-S623 PolarHBondContact OG1-O 3.44Å; T441-P625 HydrophobicContact CG2-CG 4.28Å
442	F	92.8	Very high	83.2	Confident	0 Å²	0	37.4 Å²	37.4	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	133.5	178.3	-70.9	-79.9	0	0	0	111.2	V394 I396 I411 A430 Y431 V433 I440 L545 I548	V394-F442 HydrophobicContact CB-CD1 3.99Å; V394-F442 HydrophobicContact CB-CE1 4.11Å; V394-F442 HydrophobicContact CG1-CD1 4.11Å; V394-F442 HydrophobicContact CG1-CE1 4Å; V394-F442 CarbonylContact O-C 3.51Å; V394-F442 VanDerWaalsContact O-CA 3.3Å; V394-F442 WeakPolarHBondContact O-CA 3.49Å; I396-F442 HydrophobicContact CD1-CD1 4.11Å; I396-F442 HydrophobicContact CD1-CE1 4.28Å; I396-F442 HydrophobicContact CG1-CD1 4.17Å; I411-F442 HydrophobicContact CD1-CZ 4.37Å; I411-F442 HydrophobicContact CG2-CE2 4.1Å; A430-F442 CarbonylContact C-O 3.57Å; A430-F442 WeakPolarHBondContact CA-O 2.83Å; Y431-F442 HydrophobicContact CD1-CB 3.9Å; Y431-F442 HydrophobicContact CD2-CB 4.07Å; Y431-F442 HydrophobicContact CD2-CD2 4.07Å; Y431-F442 HydrophobicContact CE1-CB 3.62Å; Y431-F442 HydrophobicContact CE1-CG 4.48Å; Y431-F442 HydrophobicContact CE2-CB 3.79Å; Y431-F442 AromaticContact CE2-CD2 3.56Å; Y431-F442 HydrophobicContact CE2-CD2 3.56Å; Y431-F442 HydrophobicContact CE2-CE2 4.49Å; Y431-F442 AromaticContact CE2-CG 3.95Å; Y431-F442 HydrophobicContact CE2-CG 3.95Å; Y431-F442 HydrophobicContact CG-CB 4.1Å; Y431-F442 AromaticContact CZ-CG 3.94Å; Y431-F442 PolarHBondContact N-O 3.11Å; Y431-F442 PolarHBondContact O-N 2.81Å; V433-F442 HydrophobicContact CB-CE2 4.35Å; V433-F442 HydrophobicContact CG2-CD2 3.86Å; V433-F442 HydrophobicContact CG2-CE2 3.93Å; I440-F442 HydrophobicContact CB-CE2 4.02Å; I440-F442 HydrophobicContact CB-CZ 4.39Å; I440-F442 HydrophobicContact CG2-CD2 4.12Å; I440-F442 HydrophobicContact CG2-CE1 4.19Å; I440-F442 HydrophobicContact CG2-CE2 3.6Å; I440-F442 HydrophobicContact CG2-CZ 3.64Å; F442-L545 HydrophobicContact CE2-CD2 4.1Å; F442-L545 HydrophobicContact CZ-CD2 3.63Å; F442-I548 HydrophobicContact CE1-CD1 4.14Å; F442-I548 HydrophobicContact CZ-CD1 4.3Å
443	L	91.5	Very high	82.8	Confident	0 Å²	0	36.3 Å²	36.3	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	116.3	163.3	-56.5	-170.5	0	0	0	108.7	V393 V394 T395 I396 G429 A430 A461 T462 I570 L585	V393-L443 HydrophobicContact CG1-CD1 4.11Å; V393-L443 HydrophobicContact CG1-CD2 4.38Å; V393-L443 HydrophobicContact CG1-CG 3.9Å; V394-L443 PolarHBondContact O-N 2.99Å; T395-L443 WeakPolarHBondContact CA-O 3.19Å; I396-L443 PolarHBondContact N-O 3.42Å; I396-L443 VanDerWaalsContact N-O 3.11Å; G429-L443 CarbonylContact O-C 3.56Å; G429-L443 WeakPolarHBondContact O-CA 3.38Å; A430-L443 HydrophobicContact CB-CD2 3.43Å; A430-L443 VanDerWaalsContact CB-CD2 3.43Å; L443-A461 HydrophobicContact CD1-CB 3.74Å; L443-T462 HydrophobicContact CB-CG2 4.33Å; L443-T462 HydrophobicContact CD1-CG2 3.45Å; L443-T462 VanDerWaalsContact CD1-CG2 3.45Å; L443-T462 HydrophobicContact CG-CG2 3.88Å; L443-I570 HydrophobicContact CD1-CD1 4.48Å; L443-I570 HydrophobicContact CD2-CD1 3.54Å; L443-L585 HydrophobicContact CD1-CD2 4.49Å
444	D	89.6	Confident	82.7	Confident	3 Å²	3	35.2 Å²	35.2	2%	0.016	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	123	172.2	-171.9	-1.7	0	0	0	108.5	L408 T425 I428 G429	L408-D444 HydrophobicContact CD1-CB 3.64Å; L408-D444 WeakPolarHBondContact CD1-OD1 3.49Å; L408-D444 WeakPolarHBondContact CD1-OD2 3.45Å; T425-D444 WeakPolarHBondContact CG2-OD2 3.44Å; I428-D444 VanDerWaalsContact CA-O 3.22Å; I428-D444 WeakPolarHBondContact CA-O 3.29Å; I428-D444 WeakPolarHBondContact CG2-O 3.43Å; G429-D444 PolarHBondContact N-O 2.75Å; G429-D444 PolarHBondContact O-N 3.34Å
445	T	86.5	Confident	82.9	Confident	1 Å²	1	27.5 Å²	27.5	1%	0.006	16%	0.159	C	C	.	.			trans	-115.3	139.2	175.5	58	0	0	0	0	111.3	T395 I396 I428 G447	T395-T445 HydrophobicContact CG2-CG2 3.54Å; I396-T445 PolarHBondContact O-OG1 2.94Å; I428-T445 HydrophobicContact CG2-CG2 4.32Å; T445-G447 PolarHBondContact O-N 2.87Å
446	P	83.5	Confident	83.2	Confident	0 Å²	0	27.2 Å²	27.2	0%	0	16%	0.16	C	C	.	.			trans	-58.6	136.3	178.9	21.7	-32.3	0	0	0	111.4	T425 H448 F451 M454 R455	T425-P446 VanDerWaalsContact O-CB 3.3Å; T425-P446 WeakPolarHBondContact O-CB 3.36Å; P446-H448 PolarHBondContact O-N 3.1Å; P446-F451 HydrophobicContact CB-CB 4.18Å; P446-F451 HydrophobicContact CB-CD1 4.02Å; P446-F451 HydrophobicContact CB-CD2 3.89Å; P446-F451 HydrophobicContact CB-CE1 4.19Å; P446-F451 HydrophobicContact CB-CE2 4.07Å; P446-F451 HydrophobicContact CB-CG 3.79Å; P446-F451 HydrophobicContact CB-CZ 4.16Å; P446-F451 HydrophobicContact CG-CB 3.69Å; P446-F451 HydrophobicContact CG-CD1 3.51Å; P446-F451 HydrophobicContact CG-CD2 4.18Å; P446-F451 HydrophobicContact CG-CE1 3.98Å; P446-F451 HydrophobicContact CG-CG 3.55Å; P446-F451 HydrophobicContact CG-CZ 4.45Å; P446-M454 HydrophobicContact CG-CB 4.23Å; P446-M454 HydrophobicContact CG-CG 4.49Å; P446-M454 HydrophobicContact CG-SD 3.46Å; P446-M454 WeakPolarHBondContact CG-SD 3.4Å; P446-R455 PolarHBondContact O-NE 3.33Å
447	G	76.9	Confident	83.6	Confident	6 Å²	6	19.3 Å²	19.3	6%	0.062	12%	0.122	C	C	.	.			trans	-80.2	3.1	-176.7	0	0	0	0	0	116	V400 T445 R455 Q478	V400-G447 VanDerWaalsContact CG2-C 3.49Å; V400-G447 WeakPolarHBondContact CG2-O 3.33Å; T445-G447 PolarHBondContact O-N 2.87Å; G447-R455 PolarHBondContact O-NH2 3.11Å; G447-Q478 VanDerWaalsContact O-CD 3.24Å; G447-Q478 PolarHBondContact O-OE1 3.04Å
448	H	77	Confident	84.1	Confident	16 Å²	16	13.8 Å²	13.8	7%	0.074	9%	0.093	C	C	.	.	S	Bend	trans	-98.2	144.2	-163.7	-167.8	59.5	0	0	0	112.7	V400 P446 A450 F451 R455 Q478 Y772	V400-H448 HydrophobicContact CG2-CB 4.06Å; P446-H448 PolarHBondContact O-N 3.1Å; H448-A450 PolarHBondContact CD2-N 3.39Å; H448-A450 PolarHBondContact O-N 3.09Å; H448-A450 VanDerWaalsContact O-N 3.17Å; H448-F451 HydrophobicContact CB-CD2 3.54Å; H448-F451 HydrophobicContact CB-CE2 3.69Å; H448-F451 WeakPolarHBondContact O-CB 3.15Å; H448-F451 PolarHBondContact O-N 3.38Å; H448-R455 VanDerWaalsContact O-CZ 3.28Å; H448-R455 PolarHBondContact O-NH2 2.96Å; H448-Q478 PolarHBondContact CE1-NE2 3.46Å; H448-Y772 AromaticContact CD2-CE2 3.46Å; H448-Y772 VanDerWaalsContact CD2-CE2 3.46Å; H448-Y772 WeakPolarHBondContact CD2-CE2 3.12Å; H448-Y772 AromaticContact CD2-CZ 3.75Å; H448-Y772 AromaticContact CE1-CE2 3.21Å; H448-Y772 WeakPolarHBondContact CE1-CE2 3.33Å; H448-Y772 AromaticContact CE1-CZ 3.18Å; H448-Y772 PolarHBondContact CE1-OH 3.3Å; H448-Y772 AromaticContact CG-CE2 3.59Å; H448-Y772 AromaticContact ND1-CE2 3.29Å; H448-Y772 VanDerWaalsContact ND1-CE2 3.29Å; H448-Y772 WeakPolarHBondContact ND1-CE2 3.17Å; H448-Y772 AromaticContact ND1-CZ 3.78Å; H448-Y772 AromaticContact NE2-CE2 3.27Å; H448-Y772 VanDerWaalsContact NE2-CE2 3.27Å; H448-Y772 WeakPolarHBondContact NE2-CE2 3.1Å; H448-Y772 AromaticContact NE2-CZ 3.07Å; H448-Y772 PolarHBondContact NE2-OH 3.27Å
449	A	71.4	Confident	84.3	Confident	42 Å²	42	12.5 Å²	12.5	35%	0.347	8%	0.079	S	C	.	.	G	3₁₀ helix	trans	-58.9	-26.1	-174.3	0	0	0	0	0	114.3	F451 T452 Q478	A449-F451 PolarHBondContact O-N 2.91Å; A449-T452 WeakPolarHBondContact O-CG2 3.28Å; A449-Q478 HydrophobicContact CB-CG 4.44Å
450	A	66.7	Low	84.3	Confident	7 Å²	7	16.7 Å²	16.7	6%	0.058	10%	0.098	C	C	.	.	G	3₁₀ helix	trans	-64.7	-16.1	172.4	0	0	0	0	0	114	H448 S707 I771	H448-A450 PolarHBondContact CD2-N 3.39Å; H448-A450 PolarHBondContact O-N 3.09Å; H448-A450 VanDerWaalsContact O-N 3.17Å; A450-S707 VanDerWaalsContact CB-OG 3.3Å; A450-S707 WeakPolarHBondContact CB-OG 3.44Å; A450-I771 HydrophobicContact CB-CG2 4.24Å
451	F	80.9	Confident	84.1	Confident	4 Å²	4	17.3 Å²	17.3	2%	0.018	10%	0.103	C	C	.	.	G	3₁₀ helix	trans	-105.6	31.9	-170.6	-61.7	-90.2	0	0	0	113.8	Q426 P446 H448 A449 S453 M454 R455 A703 I771	Q426-F451 WeakPolarHBondContact O-CE1 3.5Å; P446-F451 HydrophobicContact CB-CB 4.18Å; P446-F451 HydrophobicContact CB-CD1 4.02Å; P446-F451 HydrophobicContact CB-CD2 3.89Å; P446-F451 HydrophobicContact CB-CE1 4.19Å; P446-F451 HydrophobicContact CB-CE2 4.07Å; P446-F451 HydrophobicContact CB-CG 3.79Å; P446-F451 HydrophobicContact CB-CZ 4.16Å; P446-F451 HydrophobicContact CG-CB 3.69Å; P446-F451 HydrophobicContact CG-CD1 3.51Å; P446-F451 HydrophobicContact CG-CD2 4.18Å; P446-F451 HydrophobicContact CG-CE1 3.98Å; P446-F451 HydrophobicContact CG-CG 3.55Å; P446-F451 HydrophobicContact CG-CZ 4.45Å; H448-F451 HydrophobicContact CB-CD2 3.54Å; H448-F451 HydrophobicContact CB-CE2 3.69Å; H448-F451 WeakPolarHBondContact O-CB 3.15Å; H448-F451 PolarHBondContact O-N 3.38Å; A449-F451 PolarHBondContact O-N 2.91Å; F451-S453 VanDerWaalsContact C-N 3.27Å; F451-S453 PolarHBondContact O-N 3.46Å; F451-M454 HydrophobicContact CB-CB 4.22Å; F451-M454 HydrophobicContact CB-CG 4.39Å; F451-M454 HydrophobicContact CB-SD 4.49Å; F451-M454 HydrophobicContact CD1-CE 3.55Å; F451-M454 HydrophobicContact CD1-CG 4.1Å; F451-M454 HydrophobicContact CD1-SD 3.42Å; F451-M454 WeakPolarHBondContact CD1-SD 3.28Å; F451-M454 HydrophobicContact CE1-CE 3.73Å; F451-M454 HydrophobicContact CE1-SD 3.98Å; F451-M454 HydrophobicContact CG-SD 4.37Å; F451-M454 PolarHBondContact O-N 3.14Å; F451-M454 VanDerWaalsContact O-N 3.12Å; F451-R455 PolarHBondContact O-N 3.26Å; F451-R455 VanDerWaalsContact O-N 3.09Å; F451-A703 HydrophobicContact CD1-CB 3.73Å; F451-A703 HydrophobicContact CE1-CB 4.13Å; F451-A703 HydrophobicContact CG-CB 4.4Å; F451-I771 HydrophobicContact CD1-CD1 4.4Å; F451-I771 HydrophobicContact CE1-CD1 3.49Å; F451-I771 VanDerWaalsContact CE1-CD1 3.49Å; F451-I771 HydrophobicContact CE2-CD1 3.79Å; F451-I771 HydrophobicContact CZ-CD1 3.15Å; F451-I771 HydrophobicContact CZ-CG1 4.14Å
452	T	81.6	Confident	84	Confident	31 Å²	31	17.7 Å²	17.7	19%	0.19	11%	0.106	C	C	.	.	H	α-helix	trans	-54.6	-43.1	-179.7	65.7	0	0	0	0	112.1	A449 M454 R455 A456 E481	A449-T452 WeakPolarHBondContact O-CG2 3.28Å; T452-M454 PolarHBondContact O-N 3.36Å; T452-R455 PolarHBondContact O-N 2.87Å; T452-A456 PolarHBondContact O-N 2.97Å; T452-E481 WeakPolarHBondContact CB-OE1 3.38Å; T452-E481 WeakPolarHBondContact CG2-OE1 3.43Å
453	S	81.4	Confident	84.1	Confident	36 Å²	36	19.1 Å²	19.1	25%	0.252	11%	0.113	S	C	.	.	H	α-helix	trans	-62.5	-40.5	178.3	58.1	0	0	0	0	112.5	F451 A456 R457	F451-S453 VanDerWaalsContact C-N 3.27Å; F451-S453 PolarHBondContact O-N 3.46Å; S453-A456 PolarHBondContact O-N 3.43Å; S453-R457 WeakPolarHBondContact O-CB 3.46Å; S453-R457 PolarHBondContact O-N 3.22Å
454	M	84.4	Confident	84.3	Confident	0 Å²	0	19.1 Å²	19.1	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-66.6	-40	177.4	-66	-161.4	-174.3	0	0	112.1	I428 P446 F451 T452 R457 G458 G699 A703	I428-M454 HydrophobicContact CD1-CB 3.9Å; I428-M454 HydrophobicContact CD1-CG 4.17Å; I428-M454 HydrophobicContact CD1-SD 4.29Å; I428-M454 HydrophobicContact CG1-CB 4.22Å; I428-M454 HydrophobicContact CG1-CG 4.4Å; I428-M454 HydrophobicContact CG1-SD 3.89Å; P446-M454 HydrophobicContact CG-CB 4.23Å; P446-M454 HydrophobicContact CG-CG 4.49Å; P446-M454 HydrophobicContact CG-SD 3.46Å; P446-M454 WeakPolarHBondContact CG-SD 3.4Å; F451-M454 HydrophobicContact CB-CB 4.22Å; F451-M454 HydrophobicContact CB-CG 4.39Å; F451-M454 HydrophobicContact CB-SD 4.49Å; F451-M454 HydrophobicContact CD1-CE 3.55Å; F451-M454 HydrophobicContact CD1-CG 4.1Å; F451-M454 HydrophobicContact CD1-SD 3.42Å; F451-M454 WeakPolarHBondContact CD1-SD 3.28Å; F451-M454 HydrophobicContact CE1-CE 3.73Å; F451-M454 HydrophobicContact CE1-SD 3.98Å; F451-M454 HydrophobicContact CG-SD 4.37Å; F451-M454 PolarHBondContact O-N 3.14Å; F451-M454 VanDerWaalsContact O-N 3.12Å; T452-M454 PolarHBondContact O-N 3.36Å; M454-R457 PolarHBondContact O-N 3.13Å; M454-G458 PolarHBondContact O-N 2.84Å; M454-G699 VanDerWaalsContact CE-CA 3.44Å; M454-G699 WeakPolarHBondContact CE-O 3.39Å; M454-A703 HydrophobicContact CE-CB 4.42Å
455	R	88.5	Confident	84.5	Confident	1 Å²	1	19 Å²	19	0%	0.004	11%	0.113	C	C	.	.	H	α-helix	trans	-65.8	-43.7	176.3	-64.6	-179.7	-166.1	144	-19.6	111.4	M397 P446 G447 H448 F451 T452 R457 G458 A459 E481	M397-R455 HydrophobicContact CE-CB 4.49Å; M397-R455 WeakPolarHBondContact CE-O 3.48Å; P446-R455 PolarHBondContact O-NE 3.33Å; G447-R455 PolarHBondContact O-NH2 3.11Å; H448-R455 VanDerWaalsContact O-CZ 3.28Å; H448-R455 PolarHBondContact O-NH2 2.96Å; F451-R455 PolarHBondContact O-N 3.26Å; F451-R455 VanDerWaalsContact O-N 3.09Å; T452-R455 PolarHBondContact O-N 2.87Å; R455-R457 VanDerWaalsContact C-N 3.3Å; R455-R457 PolarHBondContact O-N 3.47Å; R455-G458 PolarHBondContact O-N 3.38Å; R455-A459 PolarHBondContact O-N 3.09Å; R455-E481 IonicContact CZ-OE1 3.51Å; R455-E481 IonicContact CZ-OE2 3.12Å; R455-E481 IonicContact NH1-OE1 2.69Å; R455-E481 PolarHBondContact NH1-OE1 3.28Å; R455-E481 IonicContact NH1-OE2 3.44Å; R455-E481 PolarHBondContact NH1-OE2 2.97Å
456	A	86.1	Confident	84.9	Confident	27 Å²	27	19 Å²	19	22%	0.223	11%	0.112	C	C	.	.	H	α-helix	trans	-59.7	-41.8	175.5	0	0	0	0	0	111.9	T452 S453 A459 Q460	T452-A456 PolarHBondContact O-N 2.97Å; S453-A456 PolarHBondContact O-N 3.43Å; A456-A459 PolarHBondContact O-N 3.45Å; A456-Q460 WeakPolarHBondContact O-CG 3.39Å; A456-Q460 PolarHBondContact O-N 3.45Å; A456-Q460 VanDerWaalsContact O-N 3.13Å
457	R	85.1	Confident	85.4	Confident	33 Å²	33	19 Å²	19	13%	0.125	11%	0.113	C	C	.	.	H	α-helix	trans	-63.6	-47	174.6	-175.2	-174.2	-62.9	122.3	4.5	111.8	S453 M454 R455 A459 Q460 A461 A637 E702	S453-R457 WeakPolarHBondContact O-CB 3.46Å; S453-R457 PolarHBondContact O-N 3.22Å; M454-R457 PolarHBondContact O-N 3.13Å; R455-R457 VanDerWaalsContact C-N 3.3Å; R455-R457 PolarHBondContact O-N 3.47Å; R457-A459 VanDerWaalsContact C-N 3.33Å; R457-A459 PolarHBondContact O-N 3.12Å; R457-Q460 PolarHBondContact O-N 3.23Å; R457-A461 WeakPolarHBondContact O-CB 3.39Å; R457-A461 PolarHBondContact O-N 3.32Å; R457-A637 VanDerWaalsContact NE-C 3.26Å; R457-A637 PolarHBondContact NE-O 2.98Å; R457-A637 VanDerWaalsContact NE-O 3.08Å; R457-A637 PolarHBondContact NH2-O 3.44Å; R457-E702 IonicContact CZ-OE2 3.69Å; R457-E702 IonicContact NH1-OE2 3.48Å; R457-E702 IonicContact NH2-OE1 3.09Å; R457-E702 IonicContact NH2-OE2 2.66Å; R457-E702 PolarHBondContact NH2-OE2 2.95Å
458	G	86.4	Confident	86.2	Confident	2 Å²	2	18.8 Å²	18.8	2%	0.021	11%	0.11	C	C	.	.	H	α-helix	trans	-55.1	-48.2	175.6	0	0	0	0	0	111.5	T395 M454 R455 Q460 A461 T462	T395-G458 PolarHBondContact OG1-O 2.97Å; T395-G458 VanDerWaalsContact OG1-O 3.1Å; M454-G458 PolarHBondContact O-N 2.84Å; R455-G458 PolarHBondContact O-N 3.38Å; G458-Q460 PolarHBondContact O-N 3Å; G458-A461 PolarHBondContact O-N 3.3Å; G458-A461 VanDerWaalsContact O-N 3.14Å; G458-T462 WeakPolarHBondContact O-CG2 3.39Å; G458-T462 PolarHBondContact O-N 3.15Å; G458-T462 PolarHBondContact O-OG1 3.05Å
459	A	86.9	Confident	87	Confident	1 Å²	1	18 Å²	18	1%	0.008	11%	0.106	C	C	.	.	H	α-helix	trans	-57.4	-44.6	177.1	0	0	0	0	0	112.7	M397 R455 A456 R457 A461 T462 A489	M397-A459 HydrophobicContact CE-CB 3.82Å; R455-A459 PolarHBondContact O-N 3.09Å; A456-A459 PolarHBondContact O-N 3.45Å; R457-A459 VanDerWaalsContact C-N 3.33Å; R457-A459 PolarHBondContact O-N 3.12Å; A459-A461 VanDerWaalsContact C-N 3.3Å; A459-A461 PolarHBondContact O-N 3.43Å; A459-T462 PolarHBondContact O-N 3.3Å; A459-T462 PolarHBondContact O-OG1 2.95Å; A459-A489 HydrophobicContact CB-CB 3.75Å
460	Q	88.3	Confident	88.1	Confident	140 Å²	140	16 Å²	16	65%	0.654	9%	0.09	S	C	*	.	H	α-helix	trans	-71.3	-25.2	179.9	-70.6	175	2.3	0	0	113.4	A456 R457 G458 T462 R587	A456-Q460 WeakPolarHBondContact O-CG 3.39Å; A456-Q460 PolarHBondContact O-N 3.45Å; A456-Q460 VanDerWaalsContact O-N 3.13Å; R457-Q460 PolarHBondContact O-N 3.23Å; G458-Q460 PolarHBondContact O-N 3Å; Q460-T462 VanDerWaalsContact C-N 3.34Å; Q460-R587 PolarHBondContact O-NH2 2.81Å
461	A	88.2	Confident	89.3	Confident	14 Å²	14	15.8 Å²	15.8	12%	0.116	9%	0.088	C	C	.	.	H	α-helix	trans	-78	-22	179.9	0	0	0	0	0	112.7	L443 R457 G458 A459	L443-A461 HydrophobicContact CD1-CB 3.74Å; R457-A461 WeakPolarHBondContact O-CB 3.39Å; R457-A461 PolarHBondContact O-N 3.32Å; G458-A461 PolarHBondContact O-N 3.3Å; G458-A461 VanDerWaalsContact O-N 3.14Å; A459-A461 VanDerWaalsContact C-N 3.3Å; A459-A461 PolarHBondContact O-N 3.43Å
462	T	91.3	Very high	89.7	Confident	8 Å²	8	16.8 Å²	16.8	5%	0.049	9%	0.093	C	C	.	.			trans	-113	159.5	-166.8	54	0	0	0	0	115.4	V393 T395 L443 G458 A459 Q460	V393-T462 HydrophobicContact CB-CG2 4.19Å; V393-T462 HydrophobicContact CG1-CG2 3.63Å; V393-T462 VanDerWaalsContact O-CB 3.24Å; V393-T462 WeakPolarHBondContact O-CB 3.41Å; T395-T462 WeakPolarHBondContact OG1-CG2 3.32Å; T395-T462 PolarHBondContact OG1-OG1 3.4Å; T395-T462 VanDerWaalsContact OG1-OG1 3.09Å; L443-T462 HydrophobicContact CB-CG2 4.33Å; L443-T462 HydrophobicContact CD1-CG2 3.45Å; L443-T462 VanDerWaalsContact CD1-CG2 3.45Å; L443-T462 HydrophobicContact CG-CG2 3.88Å; G458-T462 WeakPolarHBondContact O-CG2 3.39Å; G458-T462 PolarHBondContact O-N 3.15Å; G458-T462 PolarHBondContact O-OG1 3.05Å; A459-T462 PolarHBondContact O-N 3.3Å; A459-T462 PolarHBondContact O-OG1 2.95Å; Q460-T462 VanDerWaalsContact C-N 3.34Å
463	D	94.5	Very high	90.1	Very high	29 Å²	29	18.1 Å²	18.1	16%	0.155	10%	0.1	C	C	.	.	S	Bend	trans	-95	-24.5	179.8	-51.6	-62.4	0	0	0	112.6	R390 V393 V491 L557	R390-D463 IonicContact CZ-OD1 3.36Å; R390-D463 IonicContact CZ-OD2 3.27Å; R390-D463 IonicContact NH1-OD1 3.25Å; R390-D463 IonicContact NH1-OD2 3.77Å; R390-D463 PolarHBondContact NH1-OD2 2.88Å; R390-D463 VanDerWaalsContact NH2-CG 3.29Å; R390-D463 IonicContact NH2-OD1 3.85Å; R390-D463 PolarHBondContact NH2-OD1 2.93Å; R390-D463 IonicContact NH2-OD2 2.93Å; R390-D463 PolarHBondContact NH2-OD2 3.35Å; V393-D463 PolarHBondContact N-OD2 3.48Å; V393-D463 PolarHBondContact O-N 3.43Å; D463-V491 VanDerWaalsContact O-CG1 3.24Å; D463-V491 WeakPolarHBondContact O-CG1 3.39Å; D463-L557 HydrophobicContact CB-CD1 3.83Å; D463-L557 HydrophobicContact CB-CD2 4.16Å
464	I	94.3	Very high	90.5	Very high	0 Å²	0	16.5 Å²	16.5	0%	0	9%	0.088	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	138.5	-179	-58.8	168.8	0	0	0	108.5	P392 V393 V394 T395 V494 I548 Q551 A552 L555	P392-I464 HydrophobicContact CB-CD1 4.23Å; V393-I464 PolarHBondContact O-N 3.48Å; V394-I464 VanDerWaalsContact CA-O 3.31Å; V394-I464 WeakPolarHBondContact CA-O 3.42Å; V394-I464 HydrophobicContact CG2-CB 4.38Å; T395-I464 PolarHBondContact N-O 2.96Å; I464-V494 HydrophobicContact CG2-CG2 3.87Å; I464-I548 HydrophobicContact CD1-CG2 4.35Å; I464-Q551 HydrophobicContact CD1-CB 3.87Å; I464-Q551 HydrophobicContact CD1-CG 3.87Å; I464-Q551 HydrophobicContact CG1-CG 4.22Å; I464-A552 HydrophobicContact CD1-CB 4.32Å; I464-L555 HydrophobicContact CD1-CD1 4.5Å; I464-L555 HydrophobicContact CG1-CD1 4.08Å
465	V	94.5	Very high	90.8	Very high	1 Å²	1	17.7 Å²	17.7	1%	0.006	10%	0.096	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	125.7	171.5	174.4	0	0	0	0	109.4	T395 M397 A486 V491 P492 V493 V494	T395-V465 WeakPolarHBondContact O-CA 3.27Å; M397-V465 HydrophobicContact CB-CG1 4.14Å; M397-V465 HydrophobicContact CE-CG2 4.45Å; M397-V465 HydrophobicContact CG-CG1 3.87Å; M397-V465 HydrophobicContact SD-CG1 3.89Å; V465-A486 HydrophobicContact CB-CB 4.33Å; V465-A486 HydrophobicContact CG1-CB 4.32Å; V465-A486 HydrophobicContact CG2-CB 4.22Å; V465-V491 HydrophobicContact CG2-CB 4.23Å; V465-V491 HydrophobicContact CG2-CG1 3.87Å; V465-P492 PolarHBondContact N-O 3.13Å; V465-V493 WeakPolarHBondContact O-CA 3.39Å; V465-V494 PolarHBondContact O-N 2.76Å
466	V	94.9	Very high	91	Very high	0 Å²	0	19.9 Å²	19.9	0%	0	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	110.2	170.2	176.6	0	0	0	0	108.8	V394 T395 I396 M397 V468 V494 A496 L544 I548	V394-V466 HydrophobicContact CG1-CB 4.3Å; V394-V466 HydrophobicContact CG1-CG2 3.41Å; V394-V466 VanDerWaalsContact CG1-CG2 3.41Å; T395-V466 PolarHBondContact O-N 3.23Å; I396-V466 WeakPolarHBondContact CA-O 3.3Å; I396-V466 HydrophobicContact CG1-CB 4.31Å; M397-V466 PolarHBondContact N-O 3.1Å; V466-V468 HydrophobicContact CG1-CG2 4.29Å; V466-V494 CarbonylContact C-O 3.55Å; V466-V494 VanDerWaalsContact CA-O 3.27Å; V466-V494 WeakPolarHBondContact CA-O 3.47Å; V466-V494 HydrophobicContact CG2-CB 4.43Å; V466-A496 HydrophobicContact CG1-CB 3.84Å; V466-L544 HydrophobicContact CG1-CD1 4.3Å; V466-L544 HydrophobicContact CG1-CD2 4.44Å; V466-I548 HydrophobicContact CG2-CD1 3.76Å; V466-I548 HydrophobicContact CG2-CG1 4.1Å
467	L	94.2	Very high	91.1	Very high	2 Å²	2	23.5 Å²	23.5	1%	0.01	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	110.2	176.7	-173.3	70.7	0	0	0	110	V469 T479 A482 I483 V493 V494 V495 A496 L514 I519	L467-V469 HydrophobicContact CD2-CG2 4.03Å; L467-V469 HydrophobicContact CG-CG2 3.95Å; L467-T479 HydrophobicContact CD1-CG2 3.91Å; L467-T479 HydrophobicContact CD2-CG2 4Å; L467-T479 HydrophobicContact CG-CG2 4.17Å; L467-A482 HydrophobicContact CD1-CB 3.96Å; L467-I483 HydrophobicContact CD1-CG1 4.38Å; L467-I483 HydrophobicContact CD2-CD1 3.95Å; L467-I483 HydrophobicContact CD2-CG1 3.7Å; L467-V493 HydrophobicContact CB-CG1 3.8Å; L467-V494 PolarHBondContact N-O 2.82Å; L467-V495 WeakPolarHBondContact O-CA 3.28Å; L467-A496 PolarHBondContact O-N 2.89Å; L467-L514 HydrophobicContact CD2-CD2 3.92Å; L467-I519 HydrophobicContact CD2-CD1 3.97Å
468	V	93.8	Very high	91.3	Very high	0 Å²	0	23 Å²	23	0%	0	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	114.6	177.6	-175	0	0	0	0	109.7	I396 M397 H402 K404 V466 A496 N498	I396-V468 HydrophobicContact CG2-CG2 3.42Å; I396-V468 VanDerWaalsContact CG2-CG2 3.42Å; M397-V468 PolarHBondContact O-N 3.3Å; H402-V468 HydrophobicContact CB-CG1 4.14Å; H402-V468 PolarHBondContact ND1-O 3.07Å; K404-V468 HydrophobicContact CD-CB 4.49Å; K404-V468 HydrophobicContact CG-CB 3.81Å; K404-V468 HydrophobicContact CG-CG1 4.19Å; K404-V468 HydrophobicContact CG-CG2 4.02Å; V466-V468 HydrophobicContact CG1-CG2 4.29Å; V468-A496 WeakPolarHBondContact CA-O 3.28Å; V468-A496 HydrophobicContact CG2-CB 4.32Å; V468-N498 HydrophobicContact CG1-CB 3.9Å
469	V	93.9	Very high	91.5	Very high	0 Å²	0	22.9 Å²	22.9	0%	0	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	131.9	177	-173.1	0	0	0	0	108.8	H402 L467 G474 T479 A496 V497 N498 V510 L514	H402-V469 WeakPolarHBondContact ND1-CA 3.42Å; L467-V469 HydrophobicContact CD2-CG2 4.03Å; L467-V469 HydrophobicContact CG-CG2 3.95Å; V469-G474 WeakPolarHBondContact CG1-O 3.19Å; V469-T479 HydrophobicContact CG2-CG2 3.76Å; V469-A496 PolarHBondContact N-O 3.42Å; V469-V497 CarbonylContact O-C 3.55Å; V469-V497 WeakPolarHBondContact O-CA 3.48Å; V469-N498 PolarHBondContact O-N 2.85Å; V469-V510 HydrophobicContact CB-CG1 4.02Å; V469-V510 HydrophobicContact CG1-CG1 3.65Å; V469-V510 HydrophobicContact CG1-CG2 4.25Å; V469-L514 HydrophobicContact CG2-CD1 4.23Å; V469-L514 HydrophobicContact CG2-CD2 4.48Å
470	A	93.2	Very high	91.7	Very high	0 Å²	0	24.6 Å²	24.6	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	135	178.2	0	0	0	0	0	110.7	H402 D472 D473 G474 K499	H402-A470 HydrophobicContact CB-CB 4.17Å; A470-D472 WeakPolarHBondContact CB-OD1 3.43Å; A470-D472 PolarHBondContact O-N 2.66Å; A470-D473 HydrophobicContact CB-CB 4.29Å; A470-G474 PolarHBondContact O-N 3.33Å; A470-K499 HydrophobicContact CB-CD 3.99Å; A470-K499 HydrophobicContact CB-CG 4.24Å
471	A	92.1	Very high	91.7	Very high	2 Å²	2	19.6 Å²	19.6	2%	0.017	11%	0.111	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.1	-18.7	-178.4	0	0	0	0	0	113.8	V497 N498 A505 D506	A471-V497 HydrophobicContact CB-CG1 3.83Å; A471-N498 WeakPolarHBondContact CB-O 3.4Å; A471-N498 PolarHBondContact N-O 3Å; A471-A505 HydrophobicContact CB-CB 3.67Å; A471-D506 PolarHBondContact O-N 3.25Å
472	D	91.1	Very high	91.8	Very high	25 Å²	25	19 Å²	19	13%	0.134	11%	0.106	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85	-45.4	175.7	55.6	-19.4	0	0	0	112.2	A470 K499 K502	A470-D472 WeakPolarHBondContact CB-OD1 3.43Å; A470-D472 PolarHBondContact O-N 2.66Å; D472-K499 WeakPolarHBondContact OD1-CD 3.4Å; D472-K499 IonicContact OD1-NZ 2.77Å; D472-K499 PolarHBondContact OD1-NZ 2.87Å; D472-K499 WeakPolarHBondContact OD2-CD 3.49Å; D472-K499 IonicContact OD2-NZ 3.85Å; D472-K499 PolarHBondContact OD2-NZ 2.92Å; D472-K499 VanDerWaalsContact OD2-NZ 3.09Å; D472-K502 HydrophobicContact CB-CD 4.24Å; D472-K502 WeakPolarHBondContact OD2-CD 3.31Å; D472-K502 IonicContact OD2-NZ 3.57Å; D472-K502 PolarHBondContact OD2-NZ 3.43Å
473	D	89.9	Confident	91.8	Very high	60 Å²	60	19.2 Å²	19.2	32%	0.321	11%	0.107	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86	-35.5	-172.2	-66.2	-39.4	0	0	0	113.2	A470 M476 K499	A470-D473 HydrophobicContact CB-CB 4.29Å; D473-M476 HydrophobicContact CB-CE 3.52Å; D473-K499 IonicContact OD2-NZ 2.68Å; D473-K499 PolarHBondContact OD2-NZ 3.15Å
474	G	89.3	Confident	91.6	Very high	1 Å²	1	23.8 Å²	23.8	1%	0.01	13%	0.127	C	C	.	.	B	Isolated β-bridge	trans	79.5	-155.8	-173.7	0	0	0	0	0	114	H402 V469 A470 M476 E513	H402-G474 PolarHBondContact CE1-O 3.43Å; H402-G474 PolarHBondContact NE2-O 3.03Å; V469-G474 WeakPolarHBondContact CG1-O 3.19Å; A470-G474 PolarHBondContact O-N 3.33Å; G474-M476 PolarHBondContact O-N 2.85Å; G474-E513 WeakPolarHBondContact CA-OE2 3.36Å
475	V	91.2	Very high	91.4	Very high	26 Å²	26	25.7 Å²	25.7	16%	0.158	14%	0.136	C	C	.	.			trans	-81.4	111.3	-176.5	-179.2	0	0	0	0	110.9	T479 I480 E513 L514 Y517	V475-T479 HydrophobicContact CG1-CG2 4.15Å; V475-I480 HydrophobicContact CG1-CG1 3.82Å; V475-E513 HydrophobicContact CB-CB 4.11Å; V475-E513 HydrophobicContact CG2-CB 3.55Å; V475-E513 PolarHBondContact N-OE2 3.21Å; V475-L514 HydrophobicContact CG2-CD2 3.58Å; V475-L514 HydrophobicContact CG2-CG 3.73Å; V475-Y517 HydrophobicContact CG1-CD2 4.23Å; V475-Y517 HydrophobicContact CG1-CE2 3.88Å
476	M	91.1	Very high	91.2	Very high	46 Å²	46	25.8 Å²	25.8	23%	0.227	14%	0.136	C	C	.	.			trans	-94.4	162.8	175.5	-67	-146.4	-171.3	0	0	113.5	H399 D473 G474 Q478 T479 I480	H399-M476 HydrophobicContact CB-CB 4.19Å; H399-M476 PolarHBondContact CD2-SD 3.48Å; H399-M476 VanDerWaalsContact CE1-SD 3.59Å; H399-M476 PolarHBondContact NE2-SD 3.25Å; D473-M476 HydrophobicContact CB-CE 3.52Å; G474-M476 PolarHBondContact O-N 2.85Å; M476-Q478 VanDerWaalsContact C-N 3.29Å; M476-Q478 PolarHBondContact O-N 3.09Å; M476-Q478 VanDerWaalsContact O-N 3.15Å; M476-T479 WeakPolarHBondContact O-CA 3.39Å; M476-T479 WeakPolarHBondContact O-CB 3.19Å; M476-T479 PolarHBondContact O-N 3.27Å; M476-T479 PolarHBondContact O-OG1 2.96Å; M476-I480 PolarHBondContact O-N 3.39Å; M476-I480 VanDerWaalsContact O-N 3.13Å
477	P	89.5	Confident	91	Very high	104 Å²	104	33.1 Å²	33.1	68%	0.675	17%	0.169	S	C	*	.	H	α-helix	trans	-52.7	-38.6	179.9	-29.2	35.9	0	0	0	115.2	T479 I480 E481	P477-T479 VanDerWaalsContact C-N 3.27Å; P477-T479 PolarHBondContact O-N 3.45Å; P477-I480 WeakPolarHBondContact O-CB 3.44Å; P477-I480 PolarHBondContact O-N 2.62Å; P477-E481 PolarHBondContact O-N 3.33Å
478	Q	88.8	Confident	90.7	Very high	21 Å²	21	37 Å²	37	10%	0.098	20%	0.201	C	C	.	.	H	α-helix	trans	-68.6	-27.5	176.1	-68.3	175	-5.8	0	0	112.8	H399 G447 H448 A449 M476 A482	H399-Q478 HydrophobicContact CB-CB 4.48Å; H399-Q478 PolarHBondContact CE1-OE1 3.01Å; H399-Q478 VanDerWaalsContact ND1-CD 3.3Å; H399-Q478 PolarHBondContact ND1-OE1 2.89Å; G447-Q478 VanDerWaalsContact O-CD 3.24Å; G447-Q478 PolarHBondContact O-OE1 3.04Å; H448-Q478 PolarHBondContact CE1-NE2 3.46Å; A449-Q478 HydrophobicContact CB-CG 4.44Å; M476-Q478 VanDerWaalsContact C-N 3.29Å; M476-Q478 PolarHBondContact O-N 3.09Å; M476-Q478 VanDerWaalsContact O-N 3.15Å; Q478-A482 WeakPolarHBondContact O-CB 3.26Å; Q478-A482 PolarHBondContact O-N 2.88Å
479	T	90.2	Very high	90.5	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-68.8	-43.8	172.8	-49.7	0	0	0	0	109.4	H402 L467 V469 V475 M476 P477 E481 A482 I483	H402-T479 PolarHBondContact CE1-OG1 3.29Å; L467-T479 HydrophobicContact CD1-CG2 3.91Å; L467-T479 HydrophobicContact CD2-CG2 4Å; L467-T479 HydrophobicContact CG-CG2 4.17Å; V469-T479 HydrophobicContact CG2-CG2 3.76Å; V475-T479 HydrophobicContact CG1-CG2 4.15Å; M476-T479 WeakPolarHBondContact O-CA 3.39Å; M476-T479 WeakPolarHBondContact O-CB 3.19Å; M476-T479 PolarHBondContact O-N 3.27Å; M476-T479 PolarHBondContact O-OG1 2.96Å; P477-T479 VanDerWaalsContact C-N 3.27Å; P477-T479 PolarHBondContact O-N 3.45Å; T479-E481 VanDerWaalsContact C-N 3.31Å; T479-E481 PolarHBondContact O-N 3.38Å; T479-A482 WeakPolarHBondContact O-CB 3.32Å; T479-A482 PolarHBondContact O-N 3.46Å; T479-I483 HydrophobicContact CG2-CD1 4.34Å; T479-I483 VanDerWaalsContact O-CG1 3.23Å; T479-I483 WeakPolarHBondContact O-CG1 3.32Å; T479-I483 PolarHBondContact O-N 2.81Å
480	I	91.4	Very high	90.3	Very high	37 Å²	37	46.9 Å²	46.9	19%	0.19	25%	0.252	C	S	.	.	H	α-helix	trans	-59.6	-44.5	175.9	-56.1	170.1	0	0	0	110.6	V475 M476 P477 I483 Q484 Y517	V475-I480 HydrophobicContact CG1-CG1 3.82Å; M476-I480 PolarHBondContact O-N 3.39Å; M476-I480 VanDerWaalsContact O-N 3.13Å; P477-I480 WeakPolarHBondContact O-CB 3.44Å; P477-I480 PolarHBondContact O-N 2.62Å; I480-I483 WeakPolarHBondContact O-CB 3.33Å; I480-I483 PolarHBondContact O-N 3.47Å; I480-Q484 WeakPolarHBondContact O-CG 3.41Å; I480-Q484 PolarHBondContact O-N 2.99Å; I480-Y517 HydrophobicContact CB-CE1 4.48Å; I480-Y517 HydrophobicContact CD1-CE1 3.9Å; I480-Y517 HydrophobicContact CD1-CE2 4.29Å; I480-Y517 WeakPolarHBondContact CD1-OH 3.46Å; I480-Y517 HydrophobicContact CG1-CD1 4.48Å; I480-Y517 HydrophobicContact CG1-CE1 3.91Å; I480-Y517 HydrophobicContact CG1-CE2 4.09Å; I480-Y517 HydrophobicContact CG2-CD1 4.01Å; I480-Y517 HydrophobicContact CG2-CE1 3.77Å
481	E	89.3	Confident	90.2	Very high	36 Å²	36	47.9 Å²	47.9	17%	0.168	26%	0.258	C	S	.	.	H	α-helix	trans	-62	-43.6	176.6	-163.6	-159.4	137.8	0	0	112	T452 R455 P477 T479 I483 Q484 H485	T452-E481 WeakPolarHBondContact CB-OE1 3.38Å; T452-E481 WeakPolarHBondContact CG2-OE1 3.43Å; R455-E481 IonicContact CZ-OE1 3.51Å; R455-E481 IonicContact CZ-OE2 3.12Å; R455-E481 IonicContact NH1-OE1 2.69Å; R455-E481 PolarHBondContact NH1-OE1 3.28Å; R455-E481 IonicContact NH1-OE2 3.44Å; R455-E481 PolarHBondContact NH1-OE2 2.97Å; P477-E481 PolarHBondContact O-N 3.33Å; T479-E481 VanDerWaalsContact C-N 3.31Å; T479-E481 PolarHBondContact O-N 3.38Å; E481-I483 VanDerWaalsContact C-N 3.32Å; E481-I483 PolarHBondContact O-N 3.09Å; E481-Q484 WeakPolarHBondContact O-CB 3.38Å; E481-Q484 PolarHBondContact O-N 3.31Å; E481-Q484 VanDerWaalsContact O-N 3.15Å; E481-H485 PolarHBondContact O-CD2 2.8Å; E481-H485 PolarHBondContact O-N 3.07Å; E481-H485 IonicContact OE1-CD2 3.51Å; E481-H485 IonicContact OE1-NE2 2.6Å; E481-H485 PolarHBondContact OE1-NE2 2.84Å
482	A	89.1	Confident	90.2	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-59.8	-41.2	174.7	0	0	0	0	0	112.4	M397 L467 Q478 T479 Q484 H485 A486	M397-A482 HydrophobicContact CB-CB 3.85Å; M397-A482 HydrophobicContact SD-CB 4.2Å; L467-A482 HydrophobicContact CD1-CB 3.96Å; Q478-A482 WeakPolarHBondContact O-CB 3.26Å; Q478-A482 PolarHBondContact O-N 2.88Å; T479-A482 WeakPolarHBondContact O-CB 3.32Å; T479-A482 PolarHBondContact O-N 3.46Å; A482-Q484 VanDerWaalsContact C-N 3.32Å; A482-Q484 PolarHBondContact O-N 3.44Å; A482-H485 PolarHBondContact O-N 3.34Å; A482-A486 PolarHBondContact O-N 3.48Å
483	I	91.5	Very high	90.3	Very high	14 Å²	14	49.5 Å²	49.5	7%	0.072	27%	0.269	C	S	.	.	H	α-helix	trans	-62	-41.2	175.4	-64.4	166.6	0	0	0	110.7	L467 T479 I480 E481 H485 A486 K487 L514 I519	L467-I483 HydrophobicContact CD1-CG1 4.38Å; L467-I483 HydrophobicContact CD2-CD1 3.95Å; L467-I483 HydrophobicContact CD2-CG1 3.7Å; T479-I483 HydrophobicContact CG2-CD1 4.34Å; T479-I483 VanDerWaalsContact O-CG1 3.23Å; T479-I483 WeakPolarHBondContact O-CG1 3.32Å; T479-I483 PolarHBondContact O-N 2.81Å; I480-I483 WeakPolarHBondContact O-CB 3.33Å; I480-I483 PolarHBondContact O-N 3.47Å; E481-I483 VanDerWaalsContact C-N 3.32Å; E481-I483 PolarHBondContact O-N 3.09Å; I483-H485 VanDerWaalsContact C-N 3.34Å; I483-H485 PolarHBondContact O-N 3.18Å; I483-A486 PolarHBondContact O-N 3.29Å; I483-K487 VanDerWaalsContact O-CB 3.31Å; I483-K487 WeakPolarHBondContact O-CB 3.33Å; I483-K487 PolarHBondContact O-N 2.97Å; I483-L514 HydrophobicContact CD1-CD2 3.64Å; I483-I519 HydrophobicContact CB-CD1 4.3Å; I483-I519 HydrophobicContact CD1-CD1 3.81Å; I483-I519 HydrophobicContact CG1-CD1 3.59Å; I483-I519 HydrophobicContact CG2-CD1 3.81Å; I483-I519 HydrophobicContact CG2-CG1 4.26Å
484	Q	91.1	Very high	90.6	Very high	124 Å²	124	46.7 Å²	46.7	58%	0.579	25%	0.254	S	S	*	.	H	α-helix	trans	-62	-42	176.7	-70.5	175.4	5.2	0	0	111.8	I480 E481 A482 A488	I480-Q484 WeakPolarHBondContact O-CG 3.41Å; I480-Q484 PolarHBondContact O-N 2.99Å; E481-Q484 WeakPolarHBondContact O-CB 3.38Å; E481-Q484 PolarHBondContact O-N 3.31Å; E481-Q484 VanDerWaalsContact O-N 3.15Å; A482-Q484 VanDerWaalsContact C-N 3.32Å; A482-Q484 PolarHBondContact O-N 3.44Å; Q484-A488 VanDerWaalsContact O-CB 3.27Å; Q484-A488 WeakPolarHBondContact O-CB 3.45Å; Q484-A488 PolarHBondContact O-N 3.32Å
485	H	89.8	Confident	90.8	Very high	41 Å²	41	46.6 Å²	46.6	19%	0.19	25%	0.254	C	S	.	.	H	α-helix	trans	-67	-43	176.8	-70.8	-54.8	0	0	0	112.8	E481 A482 I483 K487 A488 A489	E481-H485 PolarHBondContact O-CD2 2.8Å; E481-H485 PolarHBondContact O-N 3.07Å; E481-H485 IonicContact OE1-CD2 3.51Å; E481-H485 IonicContact OE1-NE2 2.6Å; E481-H485 PolarHBondContact OE1-NE2 2.84Å; A482-H485 PolarHBondContact O-N 3.34Å; I483-H485 VanDerWaalsContact C-N 3.34Å; I483-H485 PolarHBondContact O-N 3.18Å; H485-K487 VanDerWaalsContact C-N 3.35Å; H485-K487 PolarHBondContact O-N 3.17Å; H485-A488 PolarHBondContact O-N 3.5Å; H485-A489 WeakPolarHBondContact O-CB 3.45Å; H485-A489 PolarHBondContact O-N 3.45Å
486	A	89.8	Confident	91	Very high	2 Å²	2	45.4 Å²	45.4	2%	0.017	25%	0.246	C	C	.	.	H	α-helix	trans	-61.2	-43.9	175.8	0	0	0	0	0	111.7	V465 A482 I483 A489 Q490 V491 V493	V465-A486 HydrophobicContact CB-CB 4.33Å; V465-A486 HydrophobicContact CG1-CB 4.32Å; V465-A486 HydrophobicContact CG2-CB 4.22Å; A482-A486 PolarHBondContact O-N 3.48Å; I483-A486 PolarHBondContact O-N 3.29Å; A486-A489 PolarHBondContact O-N 3.27Å; A486-Q490 PolarHBondContact O-N 2.89Å; A486-Q490 VanDerWaalsContact O-N 3.13Å; A486-V491 PolarHBondContact O-N 2.8Å; A486-V493 HydrophobicContact CB-CG2 3.73Å
487	K	90	Very high	91.2	Very high	155 Å²	155	43.2 Å²	43.2	67%	0.674	24%	0.236	S	C	*	.	H	α-helix	trans	-66.1	-38.4	176.6	-170.2	171.2	-174.3	168.6	0	112.6	I483 H485 A489 Q490	I483-K487 VanDerWaalsContact O-CB 3.31Å; I483-K487 WeakPolarHBondContact O-CB 3.33Å; I483-K487 PolarHBondContact O-N 2.97Å; H485-K487 VanDerWaalsContact C-N 3.35Å; H485-K487 PolarHBondContact O-N 3.17Å; K487-A489 VanDerWaalsContact C-N 3.31Å; K487-Q490 PolarHBondContact O-N 2.9Å
488	A	89.6	Confident	91.4	Very high	83 Å²	83	38.4 Å²	38.4	69%	0.686	21%	0.205	S	C	*	.	H	α-helix	trans	-66	-34.4	176.2	0	0	0	0	0	112.3	Q484 H485 Q490	Q484-A488 VanDerWaalsContact O-CB 3.27Å; Q484-A488 WeakPolarHBondContact O-CB 3.45Å; Q484-A488 PolarHBondContact O-N 3.32Å; H485-A488 PolarHBondContact O-N 3.5Å; A488-Q490 VanDerWaalsContact C-N 3.31Å
489	A	88.1	Confident	91.6	Very high	32 Å²	32	38.8 Å²	38.8	26%	0.264	21%	0.206	S	C	.	.	H	α-helix	trans	-81.8	-6.5	176.1	0	0	0	0	0	113.8	A459 H485 A486 K487 V491	A459-A489 HydrophobicContact CB-CB 3.75Å; H485-A489 WeakPolarHBondContact O-CB 3.45Å; H485-A489 PolarHBondContact O-N 3.45Å; A486-A489 PolarHBondContact O-N 3.27Å; K487-A489 VanDerWaalsContact C-N 3.31Å; A489-V491 HydrophobicContact CB-CG2 3.73Å; A489-V491 PolarHBondContact O-N 2.82Å
490	Q	89.4	Confident	91.6	Very high	176 Å²	176	41.7 Å²	41.7	82%	0.822	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	57.6	34.8	-176	-56.9	-178.8	-10.7	0	0	113.4	A486 K487 A488	A486-Q490 PolarHBondContact O-N 2.89Å; A486-Q490 VanDerWaalsContact O-N 3.13Å; K487-Q490 PolarHBondContact O-N 2.9Å; A488-Q490 VanDerWaalsContact C-N 3.31Å
491	V	91.3	Very high	91.5	Very high	20 Å²	20	43.7 Å²	43.7	12%	0.121	23%	0.232	C	C	.	.			trans	-98.3	133.2	-176.8	-178.1	0	0	0	0	110.2	D463 V465 A486 A489	D463-V491 VanDerWaalsContact O-CG1 3.24Å; D463-V491 WeakPolarHBondContact O-CG1 3.39Å; V465-V491 HydrophobicContact CG2-CB 4.23Å; V465-V491 HydrophobicContact CG2-CG1 3.87Å; A486-V491 PolarHBondContact O-N 2.8Å; A489-V491 HydrophobicContact CB-CG2 3.73Å; A489-V491 PolarHBondContact O-N 2.82Å
492	P	93.5	Very high	91.5	Very high	39 Å²	39	46.1 Å²	46.1	25%	0.253	24%	0.242	S	C	.	.			trans	-56.8	140.1	173.4	-26.5	36.1	0	0	0	112.6	V465 L555	V465-P492 PolarHBondContact N-O 3.13Å; P492-L555 HydrophobicContact CG-CD1 4.12Å; P492-L555 HydrophobicContact CG-CD2 4.1Å
493	V	93.2	Very high	91.3	Very high	22 Å²	22	52.5 Å²	52.5	13%	0.133	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	123.3	-177.3	-176	0	0	0	0	110.3	V465 L467 A486 V495 I519 S528	V465-V493 WeakPolarHBondContact O-CA 3.39Å; L467-V493 HydrophobicContact CB-CG1 3.8Å; A486-V493 HydrophobicContact CB-CG2 3.73Å; V493-V495 HydrophobicContact CG1-CG2 4.34Å; V493-I519 HydrophobicContact CG1-CD1 4.1Å; V493-S528 WeakPolarHBondContact O-CB 3.49Å; V493-S528 PolarHBondContact O-OG 3.41Å
494	V	94.5	Very high	91.1	Very high	1 Å²	1	59.5 Å²	59.5	1%	0.006	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	126.6	167.8	178.1	0	0	0	0	107.6	I464 V465 V466 L467 Q529 L544	I464-V494 HydrophobicContact CG2-CG2 3.87Å; V465-V494 PolarHBondContact O-N 2.76Å; V466-V494 CarbonylContact C-O 3.55Å; V466-V494 VanDerWaalsContact CA-O 3.27Å; V466-V494 WeakPolarHBondContact CA-O 3.47Å; V466-V494 HydrophobicContact CG2-CB 4.43Å; L467-V494 PolarHBondContact N-O 2.82Å; V494-Q529 HydrophobicContact CG1-CB 4.34Å; V494-L544 HydrophobicContact CG1-CD1 3.99Å
495	V	94.7	Very high	90.9	Very high	0 Å²	0	55 Å²	55	0%	0	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	118.6	-178.3	-177.2	0	0	0	0	109.4	L467 V493 V497 L514 I519 Q529 F530 V531	L467-V495 WeakPolarHBondContact O-CA 3.28Å; V493-V495 HydrophobicContact CG1-CG2 4.34Å; V495-V497 HydrophobicContact CG1-CG2 4.14Å; V495-L514 HydrophobicContact CB-CD1 4.5Å; V495-L514 HydrophobicContact CG1-CD1 3.61Å; V495-L514 HydrophobicContact CG2-CD1 4.1Å; V495-I519 HydrophobicContact CG2-CG2 3.69Å; V495-Q529 PolarHBondContact N-O 3.28Å; V495-F530 HydrophobicContact CB-CD1 3.95Å; V495-F530 HydrophobicContact CB-CD2 4.33Å; V495-F530 HydrophobicContact CB-CE1 4Å; V495-F530 HydrophobicContact CB-CE2 4.34Å; V495-F530 HydrophobicContact CB-CG 4.13Å; V495-F530 HydrophobicContact CB-CZ 4.2Å; V495-F530 HydrophobicContact CG1-CD1 3.88Å; V495-F530 HydrophobicContact CG1-CE1 3.8Å; V495-F530 HydrophobicContact CG1-CZ 4.37Å; V495-F530 HydrophobicContact CG2-CD2 4.45Å; V495-F530 HydrophobicContact CG2-CE1 4.18Å; V495-F530 HydrophobicContact CG2-CE2 4.04Å; V495-F530 HydrophobicContact CG2-CZ 3.9Å; V495-F530 WeakPolarHBondContact O-CA 3.24Å; V495-V531 PolarHBondContact O-N 3.43Å
496	A	94.4	Very high	90.9	Very high	0 Å²	0	56.5 Å²	56.5	0%	0	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	104.5	171.9	0	0	0	0	0	109.4	V466 L467 V468 V469 N498 V531 V533 L544	V466-A496 HydrophobicContact CG1-CB 3.84Å; L467-A496 PolarHBondContact O-N 2.89Å; V468-A496 WeakPolarHBondContact CA-O 3.28Å; V468-A496 HydrophobicContact CG2-CB 4.32Å; V469-A496 PolarHBondContact N-O 3.42Å; A496-N498 PolarHBondContact O-N 3.38Å; A496-V531 CarbonylContact C-O 3.58Å; A496-V531 WeakPolarHBondContact CA-O 3.2Å; A496-V533 HydrophobicContact CB-CG2 4.11Å; A496-L544 HydrophobicContact CB-CD1 4.15Å; A496-L544 HydrophobicContact CB-CD2 4.15Å
497	V	94.9	Very high	90.9	Very high	0 Å²	0	58 Å²	58	0%	0	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	99.3	176.8	-178.7	0	0	0	0	108.5	V469 A471 V495 P507 V510 F530 V531 V533	V469-V497 CarbonylContact O-C 3.55Å; V469-V497 WeakPolarHBondContact O-CA 3.48Å; A471-V497 HydrophobicContact CB-CG1 3.83Å; V495-V497 HydrophobicContact CG1-CG2 4.14Å; V497-P507 HydrophobicContact CG1-CB 4.31Å; V497-V510 HydrophobicContact CG2-CG1 4.28Å; V497-F530 HydrophobicContact CG2-CD1 4.1Å; V497-V531 PolarHBondContact N-O 3Å; V497-V533 PolarHBondContact O-N 2.77Å
498	N	94	Very high	90.9	Very high	4 Å²	4	55.1 Å²	55.1	2%	0.021	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	167.2	-174.8	-164.2	21.9	0	0	0	112.8	H402 V468 V469 A471 A496 V533 A535	H402-N498 PolarHBondContact O-ND2 3.48Å; V468-N498 HydrophobicContact CG1-CB 3.9Å; V469-N498 PolarHBondContact O-N 2.85Å; A471-N498 WeakPolarHBondContact CB-O 3.4Å; A471-N498 PolarHBondContact N-O 3Å; A496-N498 PolarHBondContact O-N 3.38Å; N498-V533 CarbonylContact C-O 3.56Å; N498-V533 VanDerWaalsContact CA-O 3.24Å; N498-V533 WeakPolarHBondContact CA-O 3.35Å; N498-V533 HydrophobicContact CB-CG2 3.95Å; N498-V533 PolarHBondContact OD1-O 3.36Å; N498-A535 PolarHBondContact OD1-N 2.67Å
499	K	93.4	Very high	90.9	Very high	29 Å²	29	56.4 Å²	56.4	13%	0.126	30%	0.298	C	S	.	.			trans	65.8	31.7	177.6	-48.5	-170.2	-155.7	148.1	0	115.1	D401 A470 D472 D473 D501 K502 V533	D401-K499 WeakPolarHBondContact O-CE 3.35Å; D401-K499 PolarHBondContact O-NZ 3.5Å; D401-K499 VanDerWaalsContact O-NZ 3.08Å; A470-K499 HydrophobicContact CB-CD 3.99Å; A470-K499 HydrophobicContact CB-CG 4.24Å; D472-K499 WeakPolarHBondContact OD1-CD 3.4Å; D472-K499 IonicContact OD1-NZ 2.77Å; D472-K499 PolarHBondContact OD1-NZ 2.87Å; D472-K499 WeakPolarHBondContact OD2-CD 3.49Å; D472-K499 IonicContact OD2-NZ 3.85Å; D472-K499 PolarHBondContact OD2-NZ 2.92Å; D472-K499 VanDerWaalsContact OD2-NZ 3.09Å; D473-K499 IonicContact OD2-NZ 2.68Å; D473-K499 PolarHBondContact OD2-NZ 3.15Å; K499-D501 WeakPolarHBondContact CA-OD1 3.38Å; K499-D501 PolarHBondContact O-N 2.99Å; K499-D501 VanDerWaalsContact O-N 3.15Å; K499-K502 HydrophobicContact CB-CD 4.37Å; K499-K502 HydrophobicContact CD-CD 4.31Å; K499-K502 PolarHBondContact O-N 3.13Å; K499-K502 VanDerWaalsContact O-N 3.15Å; K499-V533 PolarHBondContact N-O 3.42Å
500	I	89.9	Confident	91	Very high	61 Å²	61	54.9 Å²	54.9	31%	0.313	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.3	-12.2	173.4	67.5	177.7	0	0	0	113.8	K502 H532	I500-K502 PolarHBondContact O-N 2.91Å; I500-H532 HydrophobicContact CD1-CB 4.1Å; I500-H532 HydrophobicContact CG2-CB 4.17Å
501	D	89.8	Confident	91.1	Very high	79 Å²	79	47 Å²	47	42%	0.422	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.7	-17.6	173.6	56.6	-70.7	0	0	0	113	K499 S534	K499-D501 WeakPolarHBondContact CA-OD1 3.38Å; K499-D501 PolarHBondContact O-N 2.99Å; K499-D501 VanDerWaalsContact O-N 3.15Å; D501-S534 VanDerWaalsContact CG-OG 3.27Å; D501-S534 PolarHBondContact OD1-OG 3.35Å
502	K	88.8	Confident	91.1	Very high	87 Å²	87	50 Å²	50	38%	0.378	26%	0.264	S	S	.	.	S	Bend	trans	-79.5	139.8	177.3	-69.6	-173	174.5	-172.4	0	111	D472 K499 I500 E504 A505	D472-K502 HydrophobicContact CB-CD 4.24Å; D472-K502 WeakPolarHBondContact OD2-CD 3.31Å; D472-K502 IonicContact OD2-NZ 3.57Å; D472-K502 PolarHBondContact OD2-NZ 3.43Å; K499-K502 HydrophobicContact CB-CD 4.37Å; K499-K502 HydrophobicContact CD-CD 4.31Å; K499-K502 PolarHBondContact O-N 3.13Å; K499-K502 VanDerWaalsContact O-N 3.15Å; I500-K502 PolarHBondContact O-N 2.91Å; K502-E504 PolarHBondContact O-N 3.45Å; K502-A505 WeakPolarHBondContact O-CB 3.26Å; K502-A505 PolarHBondContact O-N 3.45Å; K502-A505 VanDerWaalsContact O-N 3.17Å
503	P	85.1	Confident	91	Very high	134 Å²	134	50.1 Å²	50.1	87%	0.87	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.6	-19.8	177.4	28.7	-35.1	0	0	0	113.4	A505	P503-A505 VanDerWaalsContact C-N 3.3Å
504	E	88.3	Confident	91	Very high	160 Å²	160	49 Å²	49	75%	0.748	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.7	5.1	177.9	-59.5	175.9	-169.4	0	0	112.9	K502 D506	K502-E504 PolarHBondContact O-N 3.45Å; E504-D506 PolarHBondContact O-N 2.86Å
505	A	86	Confident	90.8	Very high	29 Å²	29	50.8 Å²	50.8	24%	0.24	27%	0.267	C	S	.	.			trans	-68.7	122.7	-177.9	0	0	0	0	0	111.7	A471 K502 P503	A471-A505 HydrophobicContact CB-CB 3.67Å; K502-A505 WeakPolarHBondContact O-CB 3.26Å; K502-A505 PolarHBondContact O-N 3.45Å; K502-A505 VanDerWaalsContact O-N 3.17Å; P503-A505 VanDerWaalsContact C-N 3.3Å
506	D	90.7	Very high	90.5	Very high	73 Å²	73	57.9 Å²	57.9	39%	0.39	30%	0.3	S	S	.	.			trans	-122	90.8	175.7	-172.3	-14.1	0	0	0	110.5	A471 E504 D508 R509 V510	A471-D506 PolarHBondContact O-N 3.25Å; E504-D506 PolarHBondContact O-N 2.86Å; D506-D508 VanDerWaalsContact C-N 3.29Å; D506-D508 PolarHBondContact O-N 3.16Å; D506-D508 PolarHBondContact OD1-N 3.43Å; D506-D508 VanDerWaalsContact OD1-N 3.14Å; D506-R509 HydrophobicContact CB-CB 3.97Å; D506-R509 VanDerWaalsContact CG-CB 3.45Å; D506-R509 PolarHBondContact O-N 3.4Å; D506-R509 PolarHBondContact OD1-N 3.04Å; D506-R509 WeakPolarHBondContact OD2-CB 3.23Å; D506-V510 PolarHBondContact O-N 2.97Å
507	P	89.3	Confident	90.3	Very high	35 Å²	35	62.1 Å²	62.1	23%	0.227	32%	0.316	C	S	.	.	H	α-helix	trans	-67.7	-28.2	179.3	27.1	-33.6	0	0	0	113	V497 V510 K511 H532	V497-P507 HydrophobicContact CG1-CB 4.31Å; P507-V510 PolarHBondContact O-N 3.48Å; P507-K511 WeakPolarHBondContact O-CG 3.24Å; P507-K511 PolarHBondContact O-N 3.41Å; P507-H532 WeakPolarHBondContact CB-NE2 3.36Å
508	D	89.1	Confident	89.9	Confident	94 Å²	94	64.6 Å²	64.6	50%	0.503	34%	0.341	S	S	.	.	H	α-helix	trans	-72	-35.8	-179.1	-69.4	-39.2	0	0	0	111.1	D506 V510 K511 N512	D506-D508 VanDerWaalsContact C-N 3.29Å; D506-D508 PolarHBondContact O-N 3.16Å; D506-D508 PolarHBondContact OD1-N 3.43Å; D506-D508 VanDerWaalsContact OD1-N 3.14Å; D508-V510 VanDerWaalsContact C-N 3.33Å; D508-V510 PolarHBondContact O-N 3.1Å; D508-K511 PolarHBondContact O-N 2.82Å; D508-N512 PolarHBondContact O-N 3Å; D508-N512 PolarHBondContact O-ND2 2.86Å
509	R	90.5	Very high	89.8	Confident	109 Å²	109	64.9 Å²	64.9	41%	0.411	34%	0.343	S	S	.	.	H	α-helix	trans	-58.2	-45	169.8	178.9	177.8	168.1	-145.4	-14.7	111.7	D506 N512 E513	D506-R509 HydrophobicContact CB-CB 3.97Å; D506-R509 VanDerWaalsContact CG-CB 3.45Å; D506-R509 PolarHBondContact O-N 3.4Å; D506-R509 PolarHBondContact OD1-N 3.04Å; D506-R509 WeakPolarHBondContact OD2-CB 3.23Å; R509-N512 PolarHBondContact O-N 3.14Å; R509-E513 HydrophobicContact CG-CG 4.46Å; R509-E513 IonicContact CZ-OE1 3.09Å; R509-E513 IonicContact NE-OE1 2.7Å; R509-E513 PolarHBondContact NE-OE1 3.38Å; R509-E513 IonicContact NH2-OE1 3.63Å; R509-E513 PolarHBondContact NH2-OE1 3.04Å; R509-E513 WeakPolarHBondContact O-CG 3.44Å; R509-E513 PolarHBondContact O-N 2.91Å
510	V	91	Very high	89.7	Confident	0 Å²	0	67 Å²	67	0%	0	36%	0.355	C	S	.	.	H	α-helix	trans	-62.9	-43.6	178.2	177.4	0	0	0	0	111.6	V469 V497 D506 P507 D508 N512 E513 L514	V469-V510 HydrophobicContact CB-CG1 4.02Å; V469-V510 HydrophobicContact CG1-CG1 3.65Å; V469-V510 HydrophobicContact CG1-CG2 4.25Å; V497-V510 HydrophobicContact CG2-CG1 4.28Å; D506-V510 PolarHBondContact O-N 2.97Å; P507-V510 PolarHBondContact O-N 3.48Å; D508-V510 VanDerWaalsContact C-N 3.33Å; D508-V510 PolarHBondContact O-N 3.1Å; V510-N512 VanDerWaalsContact C-N 3.32Å; V510-N512 PolarHBondContact O-N 2.95Å; V510-E513 PolarHBondContact O-N 3.13Å; V510-L514 HydrophobicContact CG1-CD1 3.8Å; V510-L514 HydrophobicContact CG1-CG 4.28Å; V510-L514 WeakPolarHBondContact O-CB 3.15Å; V510-L514 WeakPolarHBondContact O-CG 3.03Å; V510-L514 PolarHBondContact O-N 3.36Å
511	K	90.7	Very high	89.7	Confident	10 Å²	10	64.1 Å²	64.1	4%	0.043	34%	0.341	C	S	.	.	H	α-helix	trans	-56.9	-45.3	174.7	-71.7	178.1	176.2	-177.5	0	111.4	P507 D508 S515 P521 E523 W524 F530	P507-K511 WeakPolarHBondContact O-CG 3.24Å; P507-K511 PolarHBondContact O-N 3.41Å; D508-K511 PolarHBondContact O-N 2.82Å; K511-S515 WeakPolarHBondContact O-CB 2.86Å; K511-S515 PolarHBondContact O-N 2.89Å; K511-S515 VanDerWaalsContact O-N 3.11Å; K511-P521 HydrophobicContact CB-CG 4.18Å; K511-P521 HydrophobicContact CD-CG 4.24Å; K511-P521 HydrophobicContact CG-CG 4.01Å; K511-E523 IonicContact NZ-OE1 3.25Å; K511-E523 PolarHBondContact NZ-OE1 2.94Å; K511-E523 IonicContact NZ-OE2 2.83Å; K511-E523 PolarHBondContact NZ-OE2 3.05Å; K511-W524 HydrophobicContact CB-CH2 3.96Å; K511-W524 HydrophobicContact CB-CZ2 4.38Å; K511-F530 HydrophobicContact CG-CD1 3.9Å; K511-F530 HydrophobicContact CG-CE1 3.87Å
512	N	91.1	Very high	89.6	Confident	85 Å²	85	65.7 Å²	65.7	46%	0.455	35%	0.346	S	S	.	.	H	α-helix	trans	-64.3	-45.2	177.7	-74.3	-44.9	0	0	0	112.5	D508 R509 V510 S515 W524	D508-N512 PolarHBondContact O-N 3Å; D508-N512 PolarHBondContact O-ND2 2.86Å; R509-N512 PolarHBondContact O-N 3.14Å; V510-N512 VanDerWaalsContact C-N 3.32Å; V510-N512 PolarHBondContact O-N 2.95Å; N512-S515 PolarHBondContact O-N 2.99Å; N512-S515 PolarHBondContact O-OG 3.3Å; N512-W524 WeakPolarHBondContact OD1-CH2 3.3Å
513	E	92.5	Very high	89.6	Confident	40 Å²	40	68 Å²	68	19%	0.187	36%	0.358	C	S	.	.	H	α-helix	trans	-66.6	-42	-179.3	-72	176.6	-179.1	0	0	111.9	G474 V475 R509 V510 S515 Q516 Y517	G474-E513 WeakPolarHBondContact CA-OE2 3.36Å; V475-E513 HydrophobicContact CB-CB 4.11Å; V475-E513 HydrophobicContact CG2-CB 3.55Å; V475-E513 PolarHBondContact N-OE2 3.21Å; R509-E513 HydrophobicContact CG-CG 4.46Å; R509-E513 IonicContact CZ-OE1 3.09Å; R509-E513 IonicContact NE-OE1 2.7Å; R509-E513 PolarHBondContact NE-OE1 3.38Å; R509-E513 IonicContact NH2-OE1 3.63Å; R509-E513 PolarHBondContact NH2-OE1 3.04Å; R509-E513 WeakPolarHBondContact O-CG 3.44Å; R509-E513 PolarHBondContact O-N 2.91Å; V510-E513 PolarHBondContact O-N 3.13Å; E513-S515 VanDerWaalsContact C-N 3.34Å; E513-S515 PolarHBondContact O-N 2.79Å; E513-Q516 WeakPolarHBondContact O-CB 3.21Å; E513-Q516 PolarHBondContact O-N 3.01Å; E513-Y517 VanDerWaalsContact O-CD2 3.26Å; E513-Y517 WeakPolarHBondContact O-CD2 3.37Å
514	L	92.1	Very high	89.8	Confident	0 Å²	0	67.4 Å²	67.4	0%	0	34%	0.338	C	S	.	.	H	α-helix	trans	-68.7	-30.7	177.6	-73.1	175.8	0	0	0	113.4	L467 V469 V475 I483 V495 V510 Q516 Y517 G518 I519 F530	L467-L514 HydrophobicContact CD2-CD2 3.92Å; V469-L514 HydrophobicContact CG2-CD1 4.23Å; V469-L514 HydrophobicContact CG2-CD2 4.48Å; V475-L514 HydrophobicContact CG2-CD2 3.58Å; V475-L514 HydrophobicContact CG2-CG 3.73Å; I483-L514 HydrophobicContact CD1-CD2 3.64Å; V495-L514 HydrophobicContact CB-CD1 4.5Å; V495-L514 HydrophobicContact CG1-CD1 3.61Å; V495-L514 HydrophobicContact CG2-CD1 4.1Å; V510-L514 HydrophobicContact CG1-CD1 3.8Å; V510-L514 HydrophobicContact CG1-CG 4.28Å; V510-L514 WeakPolarHBondContact O-CB 3.15Å; V510-L514 WeakPolarHBondContact O-CG 3.03Å; V510-L514 PolarHBondContact O-N 3.36Å; L514-Q516 PolarHBondContact O-N 3.48Å; L514-Y517 PolarHBondContact O-N 3.25Å; L514-G518 PolarHBondContact O-N 2.71Å; L514-I519 CarbonylContact C-O 3.59Å; L514-I519 HydrophobicContact CB-CB 4.29Å; L514-I519 HydrophobicContact CB-CG2 4.48Å; L514-I519 PolarHBondContact O-N 3.42Å; L514-F530 HydrophobicContact CB-CZ 4.42Å; L514-F530 HydrophobicContact CD1-CE1 3.78Å; L514-F530 HydrophobicContact CD1-CZ 3.98Å
515	S	90.1	Very high	89.7	Confident	38 Å²	38	63.2 Å²	63.2	27%	0.266	34%	0.338	S	S	.	.	H	α-helix	trans	-60	-32.7	177.2	78.9	0	0	0	0	112.7	K511 N512 E513 Y517 G518 I519	K511-S515 WeakPolarHBondContact O-CB 2.86Å; K511-S515 PolarHBondContact O-N 2.89Å; K511-S515 VanDerWaalsContact O-N 3.11Å; N512-S515 PolarHBondContact O-N 2.99Å; N512-S515 PolarHBondContact O-OG 3.3Å; E513-S515 VanDerWaalsContact C-N 3.34Å; E513-S515 PolarHBondContact O-N 2.79Å; S515-Y517 PolarHBondContact O-N 3.13Å; S515-G518 PolarHBondContact O-N 3.3Å; S515-G518 VanDerWaalsContact O-N 3.12Å; S515-I519 WeakPolarHBondContact CA-O 3.42Å; S515-I519 PolarHBondContact N-O 2.86Å
516	Q	89.6	Confident	89.8	Confident	148 Å²	148	62.8 Å²	62.8	69%	0.692	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.5	-26.8	176.8	-60.7	178.3	18.7	0	0	112.4	E513 L514	E513-Q516 WeakPolarHBondContact O-CB 3.21Å; E513-Q516 PolarHBondContact O-N 3.01Å; L514-Q516 PolarHBondContact O-N 3.48Å
517	Y	89.7	Confident	89.5	Confident	90 Å²	90	67.9 Å²	67.9	35%	0.353	36%	0.358	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.2	4.8	179.1	-61.3	-74.4	0	0	0	113.1	V475 I480 E513 L514 S515	V475-Y517 HydrophobicContact CG1-CD2 4.23Å; V475-Y517 HydrophobicContact CG1-CE2 3.88Å; I480-Y517 HydrophobicContact CB-CE1 4.48Å; I480-Y517 HydrophobicContact CD1-CE1 3.9Å; I480-Y517 HydrophobicContact CD1-CE2 4.29Å; I480-Y517 WeakPolarHBondContact CD1-OH 3.46Å; I480-Y517 HydrophobicContact CG1-CD1 4.48Å; I480-Y517 HydrophobicContact CG1-CE1 3.91Å; I480-Y517 HydrophobicContact CG1-CE2 4.09Å; I480-Y517 HydrophobicContact CG2-CD1 4.01Å; I480-Y517 HydrophobicContact CG2-CE1 3.77Å; E513-Y517 VanDerWaalsContact O-CD2 3.26Å; E513-Y517 WeakPolarHBondContact O-CD2 3.37Å; L514-Y517 PolarHBondContact O-N 3.25Å; S515-Y517 PolarHBondContact O-N 3.13Å
518	G	86.7	Confident	89.5	Confident	51 Å²	51	66.9 Å²	66.9	53%	0.526	35%	0.352	S	S	.	.	T	Hydrogen-bonded Turn	trans	87.2	13.5	176.5	0	0	0	0	0	114.8	L514 S515	L514-G518 PolarHBondContact O-N 2.71Å; S515-G518 PolarHBondContact O-N 3.3Å; S515-G518 VanDerWaalsContact O-N 3.12Å
519	I	90.6	Very high	89.6	Confident	10 Å²	10	63.4 Å²	63.4	5%	0.051	33%	0.332	C	S	.	.			trans	-97.8	103.1	170.1	-64.4	-179.6	0	0	0	107.3	L467 I483 V493 V495 L514 S515 F530	L467-I519 HydrophobicContact CD2-CD1 3.97Å; I483-I519 HydrophobicContact CB-CD1 4.3Å; I483-I519 HydrophobicContact CD1-CD1 3.81Å; I483-I519 HydrophobicContact CG1-CD1 3.59Å; I483-I519 HydrophobicContact CG2-CD1 3.81Å; I483-I519 HydrophobicContact CG2-CG1 4.26Å; V493-I519 HydrophobicContact CG1-CD1 4.1Å; V495-I519 HydrophobicContact CG2-CG2 3.69Å; L514-I519 CarbonylContact C-O 3.59Å; L514-I519 HydrophobicContact CB-CB 4.29Å; L514-I519 HydrophobicContact CB-CG2 4.48Å; L514-I519 PolarHBondContact O-N 3.42Å; S515-I519 WeakPolarHBondContact CA-O 3.42Å; S515-I519 PolarHBondContact N-O 2.86Å; I519-F530 HydrophobicContact CG2-CE2 4.19Å; I519-F530 HydrophobicContact CG2-CZ 4.09Å
520	L	91.7	Very high	89.8	Confident	73 Å²	73	59.7 Å²	59.7	38%	0.382	32%	0.319	S	S	.	.			trans	-102.2	136	-179.5	-77.3	120.8	0	0	0	110.9	G526 S528	L520-G526 WeakPolarHBondContact O-CA 3.44Å; L520-S528 WeakPolarHBondContact O-CB 3.36Å; L520-S528 PolarHBondContact O-N 2.67Å
521	P	90.5	Very high	89.9	Confident	2 Å²	2	60.3 Å²	60.3	1%	0.013	32%	0.323	C	S	.	.	B	Isolated β-bridge	trans	-63.8	147.5	171.1	-16.9	27.9	0	0	0	112.7	K511 E523 W524 G526 F530	K511-P521 HydrophobicContact CB-CG 4.18Å; K511-P521 HydrophobicContact CD-CG 4.24Å; K511-P521 HydrophobicContact CG-CG 4.01Å; P521-E523 PolarHBondContact O-N 3.17Å; P521-W524 HydrophobicContact CG-CD2 4.24Å; P521-W524 HydrophobicContact CG-CE3 4.14Å; P521-W524 PolarHBondContact O-N 3.29Å; P521-G526 WeakPolarHBondContact O-CA 3.49Å; P521-G526 PolarHBondContact O-N 2.75Å; P521-F530 VanDerWaalsContact CA-CE2 3.46Å; P521-F530 HydrophobicContact CB-CD2 3.65Å; P521-F530 HydrophobicContact CB-CE2 3.73Å; P521-F530 HydrophobicContact CB-CG 4.34Å; P521-F530 HydrophobicContact CB-CZ 4.44Å; P521-F530 HydrophobicContact CG-CD2 3.89Å; P521-F530 HydrophobicContact CG-CE1 4.35Å; P521-F530 HydrophobicContact CG-CE2 3.54Å; P521-F530 HydrophobicContact CG-CG 4.46Å; P521-F530 HydrophobicContact CG-CZ 3.78Å
522	E	88	Confident	90	Very high	112 Å²	112	62.7 Å²	62.7	52%	0.523	33%	0.334	S	S	.	.	G	3₁₀ helix	trans	-54.7	-35.7	171.9	-68.2	-172.6	161.6	0	0	113.1	W524 G525 S528 Q529	E522-W524 PolarHBondContact O-N 2.56Å; E522-W524 VanDerWaalsContact O-N 3.12Å; E522-G525 PolarHBondContact O-N 3.49Å; E522-S528 PolarHBondContact N-O 3.39Å; E522-Q529 HydrophobicContact CG-CG 4.46Å; E522-Q529 VanDerWaalsContact OE1-CG 3.23Å; E522-Q529 WeakPolarHBondContact OE1-CG 3.46Å
523	E	87.5	Confident	90.1	Very high	136 Å²	136	58.7 Å²	58.7	64%	0.636	31%	0.313	S	S	*	.	G	3₁₀ helix	trans	-55.5	-30.7	175.8	-65.6	172.1	-167.7	0	0	112.9	K511 P521	K511-E523 IonicContact NZ-OE1 3.25Å; K511-E523 PolarHBondContact NZ-OE1 2.94Å; K511-E523 IonicContact NZ-OE2 2.83Å; K511-E523 PolarHBondContact NZ-OE2 3.05Å; P521-E523 PolarHBondContact O-N 3.17Å
524	W	89.2	Confident	90.1	Very high	120 Å²	120	56.8 Å²	56.8	46%	0.455	30%	0.304	S	S	.	.	G	3₁₀ helix	trans	-99.6	11.4	-179.8	-60.9	-6.5	0	0	0	112.2	K511 N512 P521 E522	K511-W524 HydrophobicContact CB-CH2 3.96Å; K511-W524 HydrophobicContact CB-CZ2 4.38Å; N512-W524 WeakPolarHBondContact OD1-CH2 3.3Å; P521-W524 HydrophobicContact CG-CD2 4.24Å; P521-W524 HydrophobicContact CG-CE3 4.14Å; P521-W524 PolarHBondContact O-N 3.29Å; E522-W524 PolarHBondContact O-N 2.56Å; E522-W524 VanDerWaalsContact O-N 3.12Å
525	G	87.2	Confident	89.8	Confident	72 Å²	72	57.2 Å²	57.2	74%	0.742	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.4	21.9	-175.5	0	0	0	0	0	113.9	E522	E522-G525 PolarHBondContact O-N 3.49Å
526	G	87.2	Confident	89.6	Confident	20 Å²	20	64 Å²	64	21%	0.206	33%	0.332	C	S	.	.			trans	-83.3	-179.6	171.2	0	0	0	0	0	113.7	L520 P521	L520-G526 WeakPolarHBondContact O-CA 3.44Å; P521-G526 WeakPolarHBondContact O-CA 3.49Å; P521-G526 PolarHBondContact O-N 2.75Å
527	E	85.5	Confident	89.4	Confident	180 Å²	180	59.9 Å²	59.9	84%	0.841	32%	0.323	S	S	*	.	S	Bend	trans	-104.3	-6.8	-178.8	-61.8	177.7	174.5	0	0	113
528	S	89.7	Confident	89.2	Confident	14 Å²	14	56.1 Å²	56.1	10%	0.098	31%	0.312	C	S	.	.	B	Isolated β-bridge	trans	-99.6	125.1	-173.6	-58.9	0	0	0	0	111.3	V493 L520 E522 F530	V493-S528 WeakPolarHBondContact O-CB 3.49Å; V493-S528 PolarHBondContact O-OG 3.41Å; L520-S528 WeakPolarHBondContact O-CB 3.36Å; L520-S528 PolarHBondContact O-N 2.67Å; E522-S528 PolarHBondContact N-O 3.39Å; S528-F530 WeakPolarHBondContact O-CD2 3.12Å
529	Q	91.5	Very high	89.3	Confident	22 Å²	22	56.9 Å²	56.9	10%	0.103	31%	0.307	C	S	.	.			trans	-74.4	134.2	172.7	-66	-178.4	46.4	0	0	110.1	V494 V495 E522 A547	V494-Q529 HydrophobicContact CG1-CB 4.34Å; V495-Q529 PolarHBondContact N-O 3.28Å; E522-Q529 HydrophobicContact CG-CG 4.46Å; E522-Q529 VanDerWaalsContact OE1-CG 3.23Å; E522-Q529 WeakPolarHBondContact OE1-CG 3.46Å; Q529-A547 VanDerWaalsContact OE1-CB 3.26Å
530	F	93	Very high	89.2	Confident	30 Å²	30	57.2 Å²	57.2	13%	0.132	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	114.3	176.4	-81	-111.7	0	0	0	109.2	V495 V497 K511 L514 I519 P521 S528	V495-F530 HydrophobicContact CB-CD1 3.95Å; V495-F530 HydrophobicContact CB-CD2 4.33Å; V495-F530 HydrophobicContact CB-CE1 4Å; V495-F530 HydrophobicContact CB-CE2 4.34Å; V495-F530 HydrophobicContact CB-CG 4.13Å; V495-F530 HydrophobicContact CB-CZ 4.2Å; V495-F530 HydrophobicContact CG1-CD1 3.88Å; V495-F530 HydrophobicContact CG1-CE1 3.8Å; V495-F530 HydrophobicContact CG1-CZ 4.37Å; V495-F530 HydrophobicContact CG2-CD2 4.45Å; V495-F530 HydrophobicContact CG2-CE1 4.18Å; V495-F530 HydrophobicContact CG2-CE2 4.04Å; V495-F530 HydrophobicContact CG2-CZ 3.9Å; V495-F530 WeakPolarHBondContact O-CA 3.24Å; V497-F530 HydrophobicContact CG2-CD1 4.1Å; K511-F530 HydrophobicContact CG-CD1 3.9Å; K511-F530 HydrophobicContact CG-CE1 3.87Å; L514-F530 HydrophobicContact CB-CZ 4.42Å; L514-F530 HydrophobicContact CD1-CE1 3.78Å; L514-F530 HydrophobicContact CD1-CZ 3.98Å; I519-F530 HydrophobicContact CG2-CE2 4.19Å; I519-F530 HydrophobicContact CG2-CZ 4.09Å; P521-F530 VanDerWaalsContact CA-CE2 3.46Å; P521-F530 HydrophobicContact CB-CD2 3.65Å; P521-F530 HydrophobicContact CB-CE2 3.73Å; P521-F530 HydrophobicContact CB-CG 4.34Å; P521-F530 HydrophobicContact CB-CZ 4.44Å; P521-F530 HydrophobicContact CG-CD2 3.89Å; P521-F530 HydrophobicContact CG-CE1 4.35Å; P521-F530 HydrophobicContact CG-CE2 3.54Å; P521-F530 HydrophobicContact CG-CG 4.46Å; P521-F530 HydrophobicContact CG-CZ 3.78Å; S528-F530 WeakPolarHBondContact O-CD2 3.12Å
531	V	93.5	Very high	89.1	Confident	13 Å²	13	53.9 Å²	53.9	8%	0.079	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	129.1	178.8	-172.7	0	0	0	0	109.6	V495 A496 V497 V533 E543 L544 A547	V495-V531 PolarHBondContact O-N 3.43Å; A496-V531 CarbonylContact C-O 3.58Å; A496-V531 WeakPolarHBondContact CA-O 3.2Å; V497-V531 PolarHBondContact N-O 3Å; V531-V533 HydrophobicContact CB-CG1 4.5Å; V531-V533 HydrophobicContact CG1-CG1 3.89Å; V531-E543 HydrophobicContact CG1-CB 4.05Å; V531-L544 HydrophobicContact CB-CD1 4.2Å; V531-L544 HydrophobicContact CG1-CB 4.04Å; V531-L544 HydrophobicContact CG2-CD1 4.26Å; V531-A547 HydrophobicContact CG2-CB 3.83Å
532	H	93.9	Very high	89	Confident	61 Å²	61	59.3 Å²	59.3	28%	0.282	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	117.4	179.4	-61.7	91.2	0	0	0	109.2	I500 P507	I500-H532 HydrophobicContact CD1-CB 4.1Å; I500-H532 HydrophobicContact CG2-CB 4.17Å; P507-H532 WeakPolarHBondContact CB-NE2 3.36Å
533	V	93.2	Very high	89.2	Confident	0 Å²	0	60 Å²	60	0%	0	33%	0.327	C	S	.	.			trans	-127.1	152	-174.1	-56.2	0	0	0	0	112.5	L407 A496 V497 N498 K499 V531 T539 G540 L544	L407-V533 HydrophobicContact CD1-CG2 3.89Å; A496-V533 HydrophobicContact CB-CG2 4.11Å; V497-V533 PolarHBondContact O-N 2.77Å; N498-V533 CarbonylContact C-O 3.56Å; N498-V533 VanDerWaalsContact CA-O 3.24Å; N498-V533 WeakPolarHBondContact CA-O 3.35Å; N498-V533 HydrophobicContact CB-CG2 3.95Å; N498-V533 PolarHBondContact OD1-O 3.36Å; K499-V533 PolarHBondContact N-O 3.42Å; V531-V533 HydrophobicContact CB-CG1 4.5Å; V531-V533 HydrophobicContact CG1-CG1 3.89Å; V533-T539 CarbonylContact C-O 3.52Å; V533-T539 WeakPolarHBondContact CA-O 3.35Å; V533-G540 WeakPolarHBondContact CG1-O 3.26Å; V533-L544 HydrophobicContact CG1-CB 4.16Å; V533-L544 HydrophobicContact CG1-CD2 4.32Å
534	S	92	Very high	89.4	Confident	0 Å²	0	53.6 Å²	53.6	0%	0	30%	0.297	C	S	.	.			trans	-124.6	107.6	161	179.5	0	0	0	0	109.1	D501 K536 A537 G538 T539	D501-S534 VanDerWaalsContact CG-OG 3.27Å; D501-S534 PolarHBondContact OD1-OG 3.35Å; S534-K536 PolarHBondContact O-N 3.25Å; S534-K536 VanDerWaalsContact O-N 3.14Å; S534-A537 PolarHBondContact O-N 2.75Å; S534-A537 PolarHBondContact OG-N 3Å; S534-A537 VanDerWaalsContact OG-N 3.16Å; S534-G538 WeakPolarHBondContact O-CA 3.26Å; S534-G538 PolarHBondContact O-N 3.49Å; S534-T539 WeakPolarHBondContact CB-OG1 3.38Å; S534-T539 PolarHBondContact N-O 2.67Å
535	A	86.4	Confident	89.5	Confident	9 Å²	9	48.8 Å²	48.8	7%	0.074	28%	0.28	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.1	-24.8	174.7	0	0	0	0	0	113.3	L407 N498	L407-A535 HydrophobicContact CB-CB 3.94Å; N498-A535 PolarHBondContact OD1-N 2.67Å
536	K	85.6	Confident	89.7	Confident	181 Å²	181	48.9 Å²	48.9	79%	0.787	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.2	-43.6	-178.7	-172.9	-179.9	178.8	-175.2	0	112.7	S534	S534-K536 PolarHBondContact O-N 3.25Å; S534-K536 VanDerWaalsContact O-N 3.14Å
537	A	85.8	Confident	89.9	Confident	61 Å²	61	48.4 Å²	48.4	50%	0.504	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.4	-17.1	-179.4	0	0	0	0	0	112.9	S534 T539	S534-A537 PolarHBondContact O-N 2.75Å; S534-A537 PolarHBondContact OG-N 3Å; S534-A537 VanDerWaalsContact OG-N 3.16Å; A537-T539 VanDerWaalsContact C-N 3.26Å; A537-T539 HydrophobicContact CB-CG2 4.02Å
538	G	84.5	Confident	90.3	Very high	12 Å²	12	39.8 Å²	39.8	12%	0.124	22%	0.218	C	C	.	.			trans	81.6	1.6	-175	0	0	0	0	0	114.2	Y410 S534	Y410-G538 VanDerWaalsContact CE2-CA 3.47Å; Y410-G538 WeakPolarHBondContact OH-CA 3.49Å; S534-G538 WeakPolarHBondContact O-CA 3.26Å; S534-G538 PolarHBondContact O-N 3.49Å
539	T	89.2	Confident	90.4	Very high	66 Å²	66	40.4 Å²	40.4	41%	0.405	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.5	134.1	-176.3	57.5	0	0	0	0	110.9	V533 S534 A537 I541	V533-T539 CarbonylContact C-O 3.52Å; V533-T539 WeakPolarHBondContact CA-O 3.35Å; S534-T539 WeakPolarHBondContact CB-OG1 3.38Å; S534-T539 PolarHBondContact N-O 2.67Å; A537-T539 VanDerWaalsContact C-N 3.26Å; A537-T539 HydrophobicContact CB-CG2 4.02Å; T539-I541 VanDerWaalsContact C-N 3.27Å; T539-I541 PolarHBondContact O-N 3.36Å
540	G	89.2	Confident	90.4	Very high	17 Å²	17	43.9 Å²	43.9	18%	0.175	24%	0.239	C	C	.	.	T	Hydrogen-bonded Turn	trans	77.4	2.4	175.9	0	0	0	0	0	115.3	V533 E543 L544	V533-G540 WeakPolarHBondContact CG1-O 3.26Å; G540-E543 PolarHBondContact O-N 2.99Å; G540-L544 PolarHBondContact O-N 3.38Å
541	I	88.1	Confident	90.3	Very high	3 Å²	3	43.7 Å²	43.7	2%	0.015	24%	0.238	C	C	.	.	H	α-helix	trans	-70.7	-41.4	179.5	-66.2	177.3	0	0	0	110.9	Y410 I411 T539 E543 L544 L545	Y410-I541 HydrophobicContact CD1-CB 4.46Å; Y410-I541 HydrophobicContact CD1-CD1 3.13Å; Y410-I541 HydrophobicContact CD1-CG1 4.34Å; Y410-I541 HydrophobicContact CD1-CG2 4.19Å; Y410-I541 HydrophobicContact CD2-CD1 4.28Å; Y410-I541 HydrophobicContact CE1-CB 4.37Å; Y410-I541 HydrophobicContact CE1-CD1 3.57Å; Y410-I541 HydrophobicContact CE1-CG2 4.37Å; Y410-I541 HydrophobicContact CG-CD1 3.53Å; I411-I541 HydrophobicContact CD1-CG2 4.4Å; I411-I541 HydrophobicContact CG1-CG2 3.79Å; T539-I541 VanDerWaalsContact C-N 3.27Å; T539-I541 PolarHBondContact O-N 3.36Å; I541-E543 VanDerWaalsContact C-N 3.31Å; I541-E543 PolarHBondContact O-N 2.8Å; I541-L544 WeakPolarHBondContact O-CB 3.44Å; I541-L544 PolarHBondContact O-N 3.42Å; I541-L544 VanDerWaalsContact O-N 3.13Å; I541-L545 HydrophobicContact CG2-CD1 4.44Å; I541-L545 WeakPolarHBondContact O-CG 3.21Å; I541-L545 PolarHBondContact O-N 2.79Å
542	D	89.8	Confident	90.1	Very high	117 Å²	117	43.6 Å²	43.6	63%	0.626	24%	0.239	S	C	*	.	H	α-helix	trans	-62.3	-41.5	175.2	-58.9	-28.6	0	0	0	111	L544 L545 D546	D542-L544 VanDerWaalsContact C-N 3.28Å; D542-L544 PolarHBondContact O-N 2.86Å; D542-L545 PolarHBondContact O-N 3.39Å; D542-L545 VanDerWaalsContact O-N 3.15Å; D542-D546 PolarHBondContact O-N 2.89Å
543	E	90.9	Very high	89.9	Confident	126 Å²	126	47.7 Å²	47.7	59%	0.589	26%	0.258	S	S	*	.	H	α-helix	trans	-60.7	-36.9	174	-62.7	177.6	-176.7	0	0	112.1	V531 G540 I541 A547	V531-E543 HydrophobicContact CG1-CB 4.05Å; G540-E543 PolarHBondContact O-N 2.99Å; I541-E543 VanDerWaalsContact C-N 3.31Å; I541-E543 PolarHBondContact O-N 2.8Å; E543-A547 WeakPolarHBondContact O-CB 3.43Å; E543-A547 PolarHBondContact O-N 3.47Å
544	L	91.8	Very high	89.8	Confident	2 Å²	2	52.7 Å²	52.7	1%	0.01	29%	0.288	C	S	.	.	H	α-helix	trans	-67	-41.6	175.4	178.2	64.9	0	0	0	111.4	L407 V466 V494 A496 V531 V533 G540 I541 D542 A547 I548	L407-L544 HydrophobicContact CD1-CD2 4.13Å; L407-L544 HydrophobicContact CD2-CD2 4.4Å; V466-L544 HydrophobicContact CG1-CD1 4.3Å; V466-L544 HydrophobicContact CG1-CD2 4.44Å; V494-L544 HydrophobicContact CG1-CD1 3.99Å; A496-L544 HydrophobicContact CB-CD1 4.15Å; A496-L544 HydrophobicContact CB-CD2 4.15Å; V531-L544 HydrophobicContact CB-CD1 4.2Å; V531-L544 HydrophobicContact CG1-CB 4.04Å; V531-L544 HydrophobicContact CG2-CD1 4.26Å; V533-L544 HydrophobicContact CG1-CB 4.16Å; V533-L544 HydrophobicContact CG1-CD2 4.32Å; G540-L544 PolarHBondContact O-N 3.38Å; I541-L544 WeakPolarHBondContact O-CB 3.44Å; I541-L544 PolarHBondContact O-N 3.42Å; I541-L544 VanDerWaalsContact O-N 3.13Å; D542-L544 VanDerWaalsContact C-N 3.28Å; D542-L544 PolarHBondContact O-N 2.86Å; L544-A547 PolarHBondContact O-N 2.96Å; L544-I548 HydrophobicContact CD1-CD1 4.31Å; L544-I548 HydrophobicContact CG-CD1 4.08Å; L544-I548 WeakPolarHBondContact O-CD1 3.22Å; L544-I548 WeakPolarHBondContact O-CG1 3.44Å; L544-I548 PolarHBondContact O-N 3.37Å
545	L	91.6	Very high	89.7	Confident	18 Å²	18	56 Å²	56	9%	0.094	31%	0.305	C	S	.	.	H	α-helix	trans	-65.5	-43.2	177.5	-63.1	174.9	0	0	0	111.1	I411 T435 I440 F442 I541 D542 I548 L549	I411-L545 HydrophobicContact CD1-CD2 4.49Å; T435-L545 HydrophobicContact CG2-CB 4.46Å; T435-L545 HydrophobicContact CG2-CD1 4.02Å; I440-L545 HydrophobicContact CD1-CB 4.26Å; I440-L545 HydrophobicContact CD1-CD2 3.95Å; F442-L545 HydrophobicContact CE2-CD2 4.1Å; F442-L545 HydrophobicContact CZ-CD2 3.63Å; I541-L545 HydrophobicContact CG2-CD1 4.44Å; I541-L545 WeakPolarHBondContact O-CG 3.21Å; I541-L545 PolarHBondContact O-N 2.79Å; D542-L545 PolarHBondContact O-N 3.39Å; D542-L545 VanDerWaalsContact O-N 3.15Å; L545-I548 PolarHBondContact O-N 3.31Å; L545-L549 WeakPolarHBondContact O-CG 3.49Å; L545-L549 PolarHBondContact O-N 3.37Å
546	D	91.9	Very high	89.8	Confident	75 Å²	75	61.6 Å²	61.6	40%	0.401	33%	0.33	S	S	.	.	H	α-helix	trans	-64.3	-41.6	175.5	-76.3	-25.2	0	0	0	111.9	N437 D542 I548 L549 L550	N437-D546 PolarHBondContact ND2-OD1 3.26Å; D542-D546 PolarHBondContact O-N 2.89Å; D546-I548 VanDerWaalsContact C-N 3.33Å; D546-I548 PolarHBondContact O-N 3.3Å; D546-L549 PolarHBondContact O-N 3.25Å; D546-L550 WeakPolarHBondContact O-CB 3.48Å; D546-L550 PolarHBondContact O-N 3.22Å
547	A	91.7	Very high	89.9	Confident	9 Å²	9	54.2 Å²	54.2	7%	0.074	30%	0.299	C	S	.	.	H	α-helix	trans	-59.2	-42.6	174.7	0	0	0	0	0	112.4	Q529 V531 E543 L544 L550 Q551	Q529-A547 VanDerWaalsContact OE1-CB 3.26Å; V531-A547 HydrophobicContact CG2-CB 3.83Å; E543-A547 WeakPolarHBondContact O-CB 3.43Å; E543-A547 PolarHBondContact O-N 3.47Å; L544-A547 PolarHBondContact O-N 2.96Å; A547-L550 PolarHBondContact O-N 3.23Å; A547-Q551 WeakPolarHBondContact O-CB 3.02Å; A547-Q551 PolarHBondContact O-N 3.49Å
548	I	92.5	Very high	90.1	Very high	0 Å²	0	56.9 Å²	56.9	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-63.4	-44.8	176	-72.1	163.9	0	0	0	111	P392 V394 I440 F442 I464 V466 L544 L545 D546 Q551 A552	P392-I548 HydrophobicContact CG-CG2 4.34Å; V394-I548 HydrophobicContact CG1-CD1 4.29Å; V394-I548 HydrophobicContact CG2-CG2 3.56Å; I440-I548 HydrophobicContact CD1-CG2 4.14Å; I440-I548 HydrophobicContact CG2-CG2 4.16Å; F442-I548 HydrophobicContact CE1-CD1 4.14Å; F442-I548 HydrophobicContact CZ-CD1 4.3Å; I464-I548 HydrophobicContact CD1-CG2 4.35Å; V466-I548 HydrophobicContact CG2-CD1 3.76Å; V466-I548 HydrophobicContact CG2-CG1 4.1Å; L544-I548 HydrophobicContact CD1-CD1 4.31Å; L544-I548 HydrophobicContact CG-CD1 4.08Å; L544-I548 WeakPolarHBondContact O-CD1 3.22Å; L544-I548 WeakPolarHBondContact O-CG1 3.44Å; L544-I548 PolarHBondContact O-N 3.37Å; L545-I548 PolarHBondContact O-N 3.31Å; D546-I548 VanDerWaalsContact C-N 3.33Å; D546-I548 PolarHBondContact O-N 3.3Å; I548-Q551 PolarHBondContact O-N 2.84Å; I548-A552 PolarHBondContact O-N 3.41Å
549	L	91.9	Very high	90.2	Very high	27 Å²	27	56.5 Å²	56.5	14%	0.141	30%	0.295	C	S	.	.	H	α-helix	trans	-65.9	-41.2	178.7	-72.1	171.3	0	0	0	111.8	P392 T435 N437 I440 L545 D546 Q551 A552 E553	P392-L549 HydrophobicContact CG-CD2 4.47Å; T435-L549 WeakPolarHBondContact OG1-CD1 3.22Å; N437-L549 HydrophobicContact CB-CD1 3.67Å; I440-L549 HydrophobicContact CD1-CD1 4.25Å; I440-L549 HydrophobicContact CD1-CD2 4Å; I440-L549 HydrophobicContact CD1-CG 3.82Å; I440-L549 HydrophobicContact CG1-CD2 3.65Å; I440-L549 HydrophobicContact CG1-CG 4.08Å; L545-L549 WeakPolarHBondContact O-CG 3.49Å; L545-L549 PolarHBondContact O-N 3.37Å; D546-L549 PolarHBondContact O-N 3.25Å; L549-Q551 VanDerWaalsContact C-N 3.31Å; L549-Q551 PolarHBondContact O-N 3.32Å; L549-A552 WeakPolarHBondContact O-CB 3.49Å; L549-A552 PolarHBondContact O-N 3.35Å; L549-A552 VanDerWaalsContact O-N 3.14Å; L549-E553 PolarHBondContact O-N 2.84Å
550	L	92.3	Very high	90.2	Very high	95 Å²	95	55 Å²	55	50%	0.497	29%	0.286	S	S	.	.	H	α-helix	trans	-59.8	-44.3	174.5	-174	69.9	0	0	0	110.8	D546 A547 A552 E553 V554	D546-L550 WeakPolarHBondContact O-CB 3.48Å; D546-L550 PolarHBondContact O-N 3.22Å; A547-L550 PolarHBondContact O-N 3.23Å; L550-A552 VanDerWaalsContact C-N 3.29Å; L550-A552 PolarHBondContact O-N 3.41Å; L550-E553 WeakPolarHBondContact O-CB 3.32Å; L550-E553 PolarHBondContact O-N 2.93Å; L550-V554 WeakPolarHBondContact O-CG2 3.47Å; L550-V554 PolarHBondContact O-N 3.03Å
551	Q	90.4	Very high	90.1	Very high	26 Å²	26	60.3 Å²	60.3	12%	0.121	30%	0.301	C	S	.	.	H	α-helix	trans	-63.1	-36.8	176.3	-169	66.8	20.7	0	0	112	I464 A547 I548 L549 V554 L555	I464-Q551 HydrophobicContact CD1-CB 3.87Å; I464-Q551 HydrophobicContact CD1-CG 3.87Å; I464-Q551 HydrophobicContact CG1-CG 4.22Å; A547-Q551 WeakPolarHBondContact O-CB 3.02Å; A547-Q551 PolarHBondContact O-N 3.49Å; I548-Q551 PolarHBondContact O-N 2.84Å; L549-Q551 VanDerWaalsContact C-N 3.31Å; L549-Q551 PolarHBondContact O-N 3.32Å; Q551-V554 PolarHBondContact O-N 3.45Å; Q551-L555 WeakPolarHBondContact O-CG 3.42Å; Q551-L555 PolarHBondContact O-N 2.88Å; Q551-L555 VanDerWaalsContact O-N 3.1Å
552	A	89.6	Confident	90	Very high	11 Å²	11	67.9 Å²	67.9	9%	0.091	33%	0.334	C	S	.	.	H	α-helix	trans	-67.1	-36.3	175.6	0	0	0	0	0	112.6	P392 I464 I548 L549 L550 L555 E556 L557	P392-A552 HydrophobicContact CB-CB 3.69Å; P392-A552 HydrophobicContact CG-CB 3.67Å; I464-A552 HydrophobicContact CD1-CB 4.32Å; I548-A552 PolarHBondContact O-N 3.41Å; L549-A552 WeakPolarHBondContact O-CB 3.49Å; L549-A552 PolarHBondContact O-N 3.35Å; L549-A552 VanDerWaalsContact O-N 3.14Å; L550-A552 VanDerWaalsContact C-N 3.29Å; L550-A552 PolarHBondContact O-N 3.41Å; A552-L555 PolarHBondContact O-N 3.39Å; A552-E556 PolarHBondContact O-N 3.13Å; A552-L557 HydrophobicContact CB-CD1 4.15Å
553	E	90	Very high	89.8	Confident	147 Å²	147	63.5 Å²	63.5	69%	0.687	32%	0.316	S	S	*	.	H	α-helix	trans	-64.7	-43	174.1	-171.1	175.6	-178.6	0	0	111.1	L549 L550 L555 E556	L549-E553 PolarHBondContact O-N 2.84Å; L550-E553 WeakPolarHBondContact O-CB 3.32Å; L550-E553 PolarHBondContact O-N 2.93Å; E553-L555 VanDerWaalsContact C-N 3.29Å; E553-L555 PolarHBondContact O-N 3.44Å; E553-E556 PolarHBondContact O-N 3.17Å; E553-E556 VanDerWaalsContact O-N 3.09Å
554	V	90.5	Very high	89.7	Confident	105 Å²	105	59 Å²	59	64%	0.636	30%	0.295	S	S	*	.	H	α-helix	trans	-61	-37.3	175.5	173.8	0	0	0	0	112.1	L550 Q551 E556	L550-V554 WeakPolarHBondContact O-CG2 3.47Å; L550-V554 PolarHBondContact O-N 3.03Å; Q551-V554 PolarHBondContact O-N 3.45Å; V554-E556 VanDerWaalsContact C-N 3.28Å; V554-E556 PolarHBondContact O-N 3.22Å
555	L	89.4	Confident	89.6	Confident	69 Å²	69	59.1 Å²	59.1	36%	0.361	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.5	-10	177.4	-68.5	173.6	0	0	0	114	I464 P492 Q551 A552 E553 L557	I464-L555 HydrophobicContact CD1-CD1 4.5Å; I464-L555 HydrophobicContact CG1-CD1 4.08Å; P492-L555 HydrophobicContact CG-CD1 4.12Å; P492-L555 HydrophobicContact CG-CD2 4.1Å; Q551-L555 WeakPolarHBondContact O-CG 3.42Å; Q551-L555 PolarHBondContact O-N 2.88Å; Q551-L555 VanDerWaalsContact O-N 3.1Å; A552-L555 PolarHBondContact O-N 3.39Å; E553-L555 VanDerWaalsContact C-N 3.29Å; E553-L555 PolarHBondContact O-N 3.44Å; L555-L557 VanDerWaalsContact C-N 3.35Å; L555-L557 HydrophobicContact CB-CD2 3.98Å; L555-L557 HydrophobicContact CB-CG 4.1Å; L555-L557 PolarHBondContact O-N 3.12Å
556	E	88.1	Confident	89.6	Confident	127 Å²	127	59.1 Å²	59.1	59%	0.593	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	47.1	50.2	-175.3	-63	-168.3	-171	0	0	113.9	A552 E553 V554 K558	A552-E556 PolarHBondContact O-N 3.13Å; E553-E556 PolarHBondContact O-N 3.17Å; E553-E556 VanDerWaalsContact O-N 3.09Å; V554-E556 VanDerWaalsContact C-N 3.28Å; V554-E556 PolarHBondContact O-N 3.22Å; E556-K558 WeakPolarHBondContact O-CG 3.48Å; E556-K558 PolarHBondContact O-N 3.11Å; E556-K558 VanDerWaalsContact O-N 3.1Å; E556-K558 IonicContact OE2-NZ 2.75Å; E556-K558 PolarHBondContact OE2-NZ 3.38Å
557	L	89	Confident	89.6	Confident	25 Å²	25	55.8 Å²	55.8	13%	0.131	28%	0.281	C	S	.	.			trans	-61.9	115	-177.5	-59.8	178.3	0	0	0	111.6	P389 R390 P392 D463 A552 L555	P389-L557 WeakPolarHBondContact CA-O 3.1Å; R390-L557 HydrophobicContact CG-CB 3.99Å; R390-L557 PolarHBondContact N-O 3.17Å; P392-L557 HydrophobicContact CB-CD1 3.77Å; D463-L557 HydrophobicContact CB-CD1 3.83Å; D463-L557 HydrophobicContact CB-CD2 4.16Å; A552-L557 HydrophobicContact CB-CD1 4.15Å; L555-L557 VanDerWaalsContact C-N 3.35Å; L555-L557 HydrophobicContact CB-CD2 3.98Å; L555-L557 HydrophobicContact CB-CG 4.1Å; L555-L557 PolarHBondContact O-N 3.12Å
558	K	89	Confident	89.6	Confident	117 Å²	117	56 Å²	56	51%	0.509	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	145.5	179	-66.8	164.2	-164.6	159.6	0	110.4	A387 E388 E556	A387-K558 HydrophobicContact CB-CB 4Å; E388-K558 CarbonylContact O-C 3.55Å; E388-K558 VanDerWaalsContact O-CA 3.29Å; E388-K558 WeakPolarHBondContact O-CA 3.31Å; E556-K558 WeakPolarHBondContact O-CG 3.48Å; E556-K558 PolarHBondContact O-N 3.11Å; E556-K558 VanDerWaalsContact O-N 3.1Å; E556-K558 IonicContact OE2-NZ 2.75Å; E556-K558 PolarHBondContact OE2-NZ 3.38Å
559	A	88	Confident	89.7	Confident	5 Å²	5	56 Å²	56	4%	0.041	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	154.5	168.5	0	0	0	0	0	112	E388 R390 R561 R587 P622	E388-A559 PolarHBondContact N-O 3.33Å; E388-A559 PolarHBondContact O-N 3.47Å; R390-A559 HydrophobicContact CB-CB 4.13Å; R390-A559 HydrophobicContact CG-CB 4.18Å; A559-R561 PolarHBondContact O-N 2.74Å; A559-R587 WeakPolarHBondContact CB-O 3.24Å; A559-P622 HydrophobicContact CB-CB 4.02Å
560	V	89.3	Confident	89.7	Confident	35 Å²	35	55 Å²	55	21%	0.212	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	112.1	174.8	177.5	0	0	0	0	108.4	A385 K562 G589	A385-V560 HydrophobicContact CB-CG1 3.43Å; A385-V560 VanDerWaalsContact CB-CG1 3.43Å; V560-K562 WeakPolarHBondContact CG1-O 3.37Å; V560-G589 WeakPolarHBondContact O-CA 3.49Å; V560-G589 PolarHBondContact O-N 2.79Å
561	R	86.1	Confident	89.7	Confident	127 Å²	127	51 Å²	51	48%	0.479	26%	0.256	S	S	.	.			trans	-76.7	-41.8	-179.9	-172.1	175.2	179.6	-175.1	2.9	112.7	E388 A559 G589 T590 P622	E388-R561 WeakPolarHBondContact OE2-CD 3.39Å; E388-R561 IonicContact OE2-NH1 3.51Å; A559-R561 PolarHBondContact O-N 2.74Å; R561-G589 CarbonylContact O-C 3.59Å; R561-G589 WeakPolarHBondContact O-CA 3.18Å; R561-T590 PolarHBondContact O-N 3.26Å; R561-T590 PolarHBondContact O-OG1 3.01Å; R561-P622 HydrophobicContact CG-CG 4.5Å
562	K	85.2	Confident	89.8	Confident	163 Å²	163	49.8 Å²	49.8	71%	0.709	25%	0.251	S	S	*	.	S	Bend	trans	-92.9	111.5	-177.9	-67.4	-178.5	-179.2	176	0	110.6	A385 V560	A385-K562 HydrophobicContact CB-CB 4.42Å; A385-K562 VanDerWaalsContact CB-O 3.22Å; A385-K562 WeakPolarHBondContact CB-O 3.45Å; V560-K562 WeakPolarHBondContact CG1-O 3.37Å
563	G	85.9	Confident	90	Very high	24 Å²	24	51.5 Å²	51.5	25%	0.247	26%	0.256	C	S	.	.	S	Bend	trans	156.3	-178.2	177.6	0	0	0	0	0	111.6	A565 G589 T590	G563-A565 PolarHBondContact O-N 3.21Å; G563-G589 WeakPolarHBondContact O-CA 3.17Å; G563-T590 PolarHBondContact O-N 2.77Å
564	M	88.7	Confident	90.1	Very high	31 Å²	31	48.1 Å²	48.1	15%	0.153	24%	0.242	C	C	.	.	S	Bend	trans	-61.4	128.4	176.3	-65.1	170.5	63.5	0	0	110.5	V643 R645	M564-V643 HydrophobicContact CB-CB 4.43Å; M564-V643 WeakPolarHBondContact CE-O 3.47Å; M564-R645 HydrophobicContact CE-CG 4.18Å; M564-R645 HydrophobicContact SD-CG 4.32Å
565	A	90.9	Very high	90.1	Very high	5 Å²	5	45.8 Å²	45.8	4%	0.041	23%	0.226	C	C	.	.			trans	-69.2	138.9	-176.6	0	0	0	0	0	111.8	G563 V586 E588 L591 V643	G563-A565 PolarHBondContact O-N 3.21Å; A565-V586 HydrophobicContact CB-CG1 4.43Å; A565-E588 CarbonylContact C-O 3.56Å; A565-E588 VanDerWaalsContact CA-O 3.23Å; A565-E588 WeakPolarHBondContact CA-O 3.47Å; A565-L591 HydrophobicContact CB-CB 3.73Å; A565-L591 HydrophobicContact CB-CD1 4.08Å; A565-V643 HydrophobicContact CB-CG2 3.68Å; A565-V643 PolarHBondContact O-N 2.89Å
566	S	90.8	Very high	89.7	Confident	19 Å²	19	49.4 Å²	49.4	13%	0.133	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	139.1	168.6	-177.8	0	0	0	0	109.1	R587 E588 V641	S566-R587 PolarHBondContact O-N 3.38Å; S566-E588 PolarHBondContact N-O 2.87Å; S566-E588 PolarHBondContact O-N 2.82Å; S566-V641 CarbonylContact C-O 3.56Å; S566-V641 VanDerWaalsContact CA-O 3.27Å; S566-V641 WeakPolarHBondContact CA-O 3.49Å
567	G	92.7	Very high	89.6	Confident	4 Å²	4	46.8 Å²	46.8	4%	0.041	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.4	-174.7	-178.9	0	0	0	0	0	112.4	L585 V641	G567-L585 CarbonylContact C-O 3.19Å; G567-L585 WeakPolarHBondContact CA-O 3.27Å; G567-V641 PolarHBondContact N-O 2.96Å; G567-V641 PolarHBondContact O-N 3.18Å
568	A	92.3	Very high	89.5	Confident	13 Å²	13	48.4 Å²	48.4	11%	0.107	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	141.4	173.7	0	0	0	0	0	109.6	I570 V584 L585	A568-I570 PolarHBondContact O-N 3.41Å; A568-V584 WeakPolarHBondContact O-CA 3.42Å; A568-L585 PolarHBondContact N-O 2.67Å; A568-L585 PolarHBondContact O-N 2.9Å
569	V	93.2	Very high	89.6	Confident	1 Å²	1	43.9 Å²	43.9	1%	0.006	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.9	119.1	170.1	-179.6	0	0	0	0	108.7	E571 A582 V584 C599 P635 G638 D639 V641	V569-E571 VanDerWaalsContact CG1-O 3.29Å; V569-E571 WeakPolarHBondContact CG1-O 3.41Å; V569-A582 HydrophobicContact CG1-CB 4.32Å; V569-V584 HydrophobicContact CG2-CG2 4.37Å; V569-C599 WeakPolarHBondContact CG2-SG 3.13Å; V569-P635 HydrophobicContact CG1-CG 4.44Å; V569-P635 HydrophobicContact CG2-CB 4.44Å; V569-P635 HydrophobicContact CG2-CG 4.26Å; V569-G638 VanDerWaalsContact O-CA 3.27Å; V569-G638 WeakPolarHBondContact O-CA 3.45Å; V569-G638 PolarHBondContact O-N 2.83Å; V569-D639 HydrophobicContact CG2-CB 4.33Å; V569-D639 PolarHBondContact N-O 2.77Å; V569-V641 HydrophobicContact CG2-CG2 3.5Å
570	I	92	Very high	89.9	Confident	6 Å²	6	44.6 Å²	44.6	3%	0.031	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	-53.2	171.3	-62.5	171.2	0	0	0	108.7	I428 A430 L443 A568 T583 L585	I428-I570 HydrophobicContact CB-CG2 3.82Å; I428-I570 HydrophobicContact CG2-CG2 3.36Å; A430-I570 HydrophobicContact CB-CD1 3.51Å; L443-I570 HydrophobicContact CD1-CD1 4.48Å; L443-I570 HydrophobicContact CD2-CD1 3.54Å; A568-I570 PolarHBondContact O-N 3.41Å; I570-T583 HydrophobicContact CB-CG2 4.47Å; I570-T583 PolarHBondContact N-O 3.45Å; I570-L585 HydrophobicContact CD1-CB 3.68Å; I570-L585 HydrophobicContact CG1-CB 3.97Å
571	E	92.1	Very high	90	Very high	11 Å²	11	42.9 Å²	42.9	5%	0.051	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	161.7	179.8	-79.1	-158.2	161.5	0	0	112.2	H427 I428 V569 A582 T583	H427-E571 WeakPolarHBondContact CA-OE1 3.12Å; I428-E571 HydrophobicContact CB-CG 4Å; I428-E571 HydrophobicContact CG1-CG 4.43Å; I428-E571 VanDerWaalsContact N-CD 3.34Å; I428-E571 PolarHBondContact N-OE1 3.22Å; V569-E571 VanDerWaalsContact CG1-O 3.29Å; V569-E571 WeakPolarHBondContact CG1-O 3.41Å; E571-A582 CarbonylContact O-C 3.49Å; E571-A582 WeakPolarHBondContact O-CA 3.2Å; E571-T583 PolarHBondContact N-O 2.89Å; E571-T583 PolarHBondContact O-N 2.88Å
572	S	93.1	Very high	90.4	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	144.5	176.4	61.6	0	0	0	0	110.5	V581 V634 P635 V697 Q698	S572-V581 WeakPolarHBondContact CA-O 3.37Å; S572-V634 VanDerWaalsContact OG-CG1 3.3Å; S572-V634 WeakPolarHBondContact OG-CG1 3.5Å; S572-P635 WeakPolarHBondContact CB-O 3.45Å; S572-P635 PolarHBondContact OG-O 3.39Å; S572-V697 WeakPolarHBondContact O-CA 3.35Å; S572-Q698 PolarHBondContact O-N 3.03Å; S572-Q698 VanDerWaalsContact OG-CB 3.26Å; S572-Q698 WeakPolarHBondContact OG-CB 3.19Å
573	F	93.4	Very high	90.8	Very high	47 Å²	47	30 Å²	30	21%	0.206	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.2	161	-178.8	62.8	-89.5	0	0	0	111.4	D575 V581 D696 V697	F573-D575 HydrophobicContact CE2-CB 4.45Å; F573-V581 HydrophobicContact CD1-CB 4.15Å; F573-V581 HydrophobicContact CD1-CG1 4.45Å; F573-V581 HydrophobicContact CD2-CB 4.01Å; F573-V581 HydrophobicContact CD2-CG2 4.06Å; F573-V581 HydrophobicContact CE1-CB 3.8Å; F573-V581 HydrophobicContact CE1-CG1 3.67Å; F573-V581 HydrophobicContact CE2-CB 3.64Å; F573-V581 HydrophobicContact CE2-CG1 4.07Å; F573-V581 HydrophobicContact CE2-CG2 3.55Å; F573-V581 HydrophobicContact CG-CB 4.26Å; F573-V581 HydrophobicContact CZ-CB 3.54Å; F573-V581 HydrophobicContact CZ-CG1 3.45Å; F573-V581 VanDerWaalsContact CZ-CG1 3.45Å; F573-V581 HydrophobicContact CZ-CG2 3.87Å; F573-V581 PolarHBondContact N-O 3.31Å; F573-V581 PolarHBondContact O-N 2.96Å; F573-V581 VanDerWaalsContact O-O 3.11Å; F573-D696 VanDerWaalsContact CB-O 3.29Å; F573-D696 WeakPolarHBondContact CB-O 3.32Å; F573-V697 HydrophobicContact CB-CB 4.48Å; F573-V697 HydrophobicContact CB-CG1 4.06Å
574	L	91.8	Very high	91.2	Very high	76 Å²	76	29 Å²	29	40%	0.398	17%	0.169	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	114.9	178.4	-175	63.4	0	0	0	110.6	P580 V634 V725	L574-P580 HydrophobicContact CD1-CB 4.28Å; L574-V634 HydrophobicContact CB-CG2 3.85Å; L574-V634 HydrophobicContact CD1-CG2 4.17Å; L574-V634 HydrophobicContact CG-CG2 4.49Å; L574-V725 HydrophobicContact CB-CG1 4.23Å
575	D	90.4	Very high	91.4	Very high	56 Å²	56	27.6 Å²	27.6	30%	0.299	16%	0.162	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	133.4	173	-175.6	-5.2	0	0	0	110.5	F573 G577 R578 G579 V581	F573-D575 HydrophobicContact CE2-CB 4.45Å; D575-G577 VanDerWaalsContact C-N 3.27Å; D575-G577 PolarHBondContact O-N 2.89Å; D575-G577 PolarHBondContact OD1-N 2.82Å; D575-G577 VanDerWaalsContact OD1-N 3.08Å; D575-R578 HydrophobicContact CB-CB 4.1Å; D575-R578 VanDerWaalsContact OD2-CD 3.23Å; D575-R578 WeakPolarHBondContact OD2-CD 3.36Å; D575-R578 WeakPolarHBondContact OD2-CG 3.39Å; D575-G579 PolarHBondContact N-O 2.84Å; D575-G579 VanDerWaalsContact O-CA 3.29Å; D575-G579 WeakPolarHBondContact O-CA 3.21Å; D575-G579 PolarHBondContact O-N 3.21Å; D575-V581 HydrophobicContact CB-CG2 4.26Å
576	K	82.2	Confident	91.6	Very high	145 Å²	145	27.4 Å²	27.4	63%	0.63	16%	0.161	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.7	-30.6	179.8	-62	-175.1	-176	-174.9	0	112.8	D751	K576-D751 WeakPolarHBondContact CE-OD1 3.32Å; K576-D751 IonicContact NZ-OD1 3.99Å; K576-D751 PolarHBondContact NZ-OD1 3.48Å
577	G	85	Confident	91.6	Very high	73 Å²	73	31.3 Å²	31.3	75%	0.753	17%	0.173	S	C	*	.	T	Hydrogen-bonded Turn	trans	-92.8	-38.9	-179.1	0	0	0	0	0	113.7	D575	D575-G577 VanDerWaalsContact C-N 3.27Å; D575-G577 PolarHBondContact O-N 2.89Å; D575-G577 PolarHBondContact OD1-N 2.82Å; D575-G577 VanDerWaalsContact OD1-N 3.08Å
578	R	87.1	Confident	91.5	Very high	59 Å²	59	35.1 Å²	35.1	22%	0.223	19%	0.19	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96.6	-16.9	-173.2	-66.1	169.7	63.7	-167	-2.9	113.7	D575 E627 L629	D575-R578 HydrophobicContact CB-CB 4.1Å; D575-R578 VanDerWaalsContact OD2-CD 3.23Å; D575-R578 WeakPolarHBondContact OD2-CD 3.36Å; D575-R578 WeakPolarHBondContact OD2-CG 3.39Å; R578-E627 IonicContact NH1-OE2 2.76Å; R578-E627 IonicContact NH2-OE2 2.72Å; R578-E627 PolarHBondContact NH2-OE2 3.23Å; R578-L629 HydrophobicContact CB-CD1 4.38Å; R578-L629 HydrophobicContact CB-CD2 4.07Å; R578-L629 HydrophobicContact CG-CD1 4.47Å; R578-L629 VanDerWaalsContact NH2-CD1 3.33Å
579	G	91.1	Very high	91.4	Very high	22 Å²	22	34.6 Å²	34.6	23%	0.227	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	84.6	-158.7	-171.7	0	0	0	0	0	112	D575	D575-G579 PolarHBondContact N-O 2.84Å; D575-G579 VanDerWaalsContact O-CA 3.29Å; D575-G579 WeakPolarHBondContact O-CA 3.21Å; D575-G579 PolarHBondContact O-N 3.21Å
580	P	93.6	Very high	91.4	Very high	19 Å²	19	35.4 Å²	35.4	12%	0.123	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.1	134.1	179.4	29	-34.4	0	0	0	111.1	L574 L631 G633 V634	L574-P580 HydrophobicContact CD1-CB 4.28Å; P580-L631 HydrophobicContact CG-CB 4.18Å; P580-L631 WeakPolarHBondContact CG-O 3.46Å; P580-G633 VanDerWaalsContact CB-C 3.49Å; P580-G633 VanDerWaalsContact CB-O 3.27Å; P580-G633 WeakPolarHBondContact CB-O 3.39Å; P580-V634 HydrophobicContact CB-CG2 4.04Å
581	V	93.3	Very high	91.5	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	139.5	178.9	-168.3	0	0	0	0	108.1	S572 F573 D575 E627 I628 L629	S572-V581 WeakPolarHBondContact CA-O 3.37Å; F573-V581 HydrophobicContact CD1-CB 4.15Å; F573-V581 HydrophobicContact CD1-CG1 4.45Å; F573-V581 HydrophobicContact CD2-CB 4.01Å; F573-V581 HydrophobicContact CD2-CG2 4.06Å; F573-V581 HydrophobicContact CE1-CB 3.8Å; F573-V581 HydrophobicContact CE1-CG1 3.67Å; F573-V581 HydrophobicContact CE2-CB 3.64Å; F573-V581 HydrophobicContact CE2-CG1 4.07Å; F573-V581 HydrophobicContact CE2-CG2 3.55Å; F573-V581 HydrophobicContact CG-CB 4.26Å; F573-V581 HydrophobicContact CZ-CB 3.54Å; F573-V581 HydrophobicContact CZ-CG1 3.45Å; F573-V581 VanDerWaalsContact CZ-CG1 3.45Å; F573-V581 HydrophobicContact CZ-CG2 3.87Å; F573-V581 PolarHBondContact N-O 3.31Å; F573-V581 PolarHBondContact O-N 2.96Å; F573-V581 VanDerWaalsContact O-O 3.11Å; D575-V581 HydrophobicContact CB-CG2 4.26Å; V581-E627 HydrophobicContact CG1-CB 4.17Å; V581-I628 WeakPolarHBondContact CA-O 3.39Å; V581-L629 HydrophobicContact CB-CD2 3.92Å; V581-L629 HydrophobicContact CG1-CD2 3.72Å; V581-L629 HydrophobicContact CG2-CD2 3.29Å
582	A	93.9	Very high	91.6	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	133.9	171.6	0	0	0	0	0	109.9	V569 E571 V584 E627 I628 L631 P635	V569-A582 HydrophobicContact CG1-CB 4.32Å; E571-A582 CarbonylContact O-C 3.49Å; E571-A582 WeakPolarHBondContact O-CA 3.2Å; A582-V584 HydrophobicContact CB-CG2 4.3Å; A582-E627 CarbonylContact O-C 3.44Å; A582-E627 WeakPolarHBondContact O-CA 3.23Å; A582-I628 HydrophobicContact CB-CD1 4.3Å; A582-I628 HydrophobicContact CB-CG1 3.92Å; A582-I628 PolarHBondContact N-O 3.43Å; A582-I628 VanDerWaalsContact N-O 3.15Å; A582-I628 VanDerWaalsContact O-CG1 3.31Å; A582-I628 WeakPolarHBondContact O-CG1 3.39Å; A582-I628 PolarHBondContact O-N 2.88Å; A582-L631 HydrophobicContact CB-CD1 3.76Å; A582-P635 HydrophobicContact CB-CG 3.69Å
583	T	93.2	Very high	91.6	Very high	20 Å²	20	42.9 Å²	42.9	12%	0.123	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	114.8	170.6	-56.6	0	0	0	0	107.8	I570 E571	I570-T583 HydrophobicContact CB-CG2 4.47Å; I570-T583 PolarHBondContact N-O 3.45Å; E571-T583 PolarHBondContact N-O 2.89Å; E571-T583 PolarHBondContact O-N 2.88Å
584	V	94.1	Very high	91.6	Very high	2 Å²	2	42.4 Å²	42.4	1%	0.012	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	133.3	-173.2	-179.2	0	0	0	0	109.7	A568 V569 A582 P625 V626 I628 V641	A568-V584 WeakPolarHBondContact O-CA 3.42Å; V569-V584 HydrophobicContact CG2-CG2 4.37Å; A582-V584 HydrophobicContact CB-CG2 4.3Å; V584-P625 WeakPolarHBondContact O-CA 3.36Å; V584-V626 HydrophobicContact CB-CG1 4.44Å; V584-V626 PolarHBondContact N-O 2.78Å; V584-V626 PolarHBondContact O-N 3.36Å; V584-I628 HydrophobicContact CG2-CD1 3.68Å; V584-I628 HydrophobicContact CG2-CG1 3.81Å; V584-V641 HydrophobicContact CB-CG2 4.47Å; V584-V641 HydrophobicContact CG1-CB 3.95Å; V584-V641 HydrophobicContact CG1-CG1 4.19Å; V584-V641 HydrophobicContact CG1-CG2 3.77Å; V584-V641 HydrophobicContact CG2-CG2 3.81Å
585	L	93.8	Very high	91.7	Very high	1 Å²	1	40.6 Å²	40.6	1%	0.005	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	113.1	167.9	-175.7	63.9	0	0	0	109.4	V393 T441 L443 G567 A568 I570 R587	V393-L585 HydrophobicContact CB-CD2 4.42Å; V393-L585 HydrophobicContact CG1-CD1 4.4Å; V393-L585 HydrophobicContact CG1-CD2 3.71Å; V393-L585 HydrophobicContact CG2-CD1 4.38Å; V393-L585 HydrophobicContact CG2-CD2 4.12Å; T441-L585 HydrophobicContact CG2-CD1 4.12Å; L443-L585 HydrophobicContact CD1-CD2 4.49Å; G567-L585 CarbonylContact C-O 3.19Å; G567-L585 WeakPolarHBondContact CA-O 3.27Å; A568-L585 PolarHBondContact N-O 2.67Å; A568-L585 PolarHBondContact O-N 2.9Å; I570-L585 HydrophobicContact CD1-CB 3.68Å; I570-L585 HydrophobicContact CG1-CB 3.97Å; L585-R587 PolarHBondContact O-N 3.23Å
586	V	94.2	Very high	91.8	Very high	2 Å²	2	38.9 Å²	38.9	1%	0.012	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	123.6	175.5	-176.3	0	0	0	0	108.7	A565 E588 L591 A620 G621 S623 I624 V626	A565-V586 HydrophobicContact CB-CG1 4.43Å; V586-E588 WeakPolarHBondContact CG1-O 3.36Å; V586-L591 HydrophobicContact CG2-CB 4.21Å; V586-A620 HydrophobicContact CG2-CB 4.25Å; V586-G621 WeakPolarHBondContact CB-O 3.38Å; V586-S623 WeakPolarHBondContact O-CA 3.24Å; V586-S623 PolarHBondContact O-N 2.76Å; V586-I624 PolarHBondContact N-O 2.74Å; V586-V626 HydrophobicContact CG2-CG1 4.21Å
587	R	91	Very high	92.4	Very high	100 Å²	100	32 Å²	32	38%	0.377	18%	0.184	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	-42.2	176.7	-71.2	-178.3	167	-174.3	-10.2	111.9	Q460 A559 S566 L585	Q460-R587 PolarHBondContact O-NH2 2.81Å; A559-R587 WeakPolarHBondContact CB-O 3.24Å; S566-R587 PolarHBondContact O-N 3.38Å; L585-R587 PolarHBondContact O-N 3.23Å
588	E	89.8	Confident	92.7	Very high	85 Å²	85	29 Å²	29	40%	0.397	15%	0.15	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-138	154.7	-178.1	-62.4	179.4	161.4	0	0	109.9	R381 A565 S566 V586	R381-E588 IonicContact NH2-OE2 3.04Å; R381-E588 PolarHBondContact NH2-OE2 2.83Å; A565-E588 CarbonylContact C-O 3.56Å; A565-E588 VanDerWaalsContact CA-O 3.23Å; A565-E588 WeakPolarHBondContact CA-O 3.47Å; S566-E588 PolarHBondContact N-O 2.87Å; S566-E588 PolarHBondContact O-N 2.82Å; V586-E588 WeakPolarHBondContact CG1-O 3.36Å
589	G	90.9	Very high	92.9	Very high	2 Å²	2	26.2 Å²	26.2	2%	0.021	14%	0.14	C	C	.	.	S	Bend	trans	72.9	-169.6	179.9	0	0	0	0	0	113.5	V560 R561 G563	V560-G589 WeakPolarHBondContact O-CA 3.49Å; V560-G589 PolarHBondContact O-N 2.79Å; R561-G589 CarbonylContact O-C 3.59Å; R561-G589 WeakPolarHBondContact O-CA 3.18Å; G563-G589 WeakPolarHBondContact O-CA 3.17Å
590	T	92.3	Very high	92.8	Very high	18 Å²	18	25.7 Å²	25.7	11%	0.11	13%	0.134	C	C	.	.			trans	-127.3	122.4	175.5	-58.4	0	0	0	0	108.5	R561 G563 H592 E619 A620	R561-T590 PolarHBondContact O-N 3.26Å; R561-T590 PolarHBondContact O-OG1 3.01Å; G563-T590 PolarHBondContact O-N 2.77Å; T590-H592 PolarHBondContact O-CE1 3.37Å; T590-H592 PolarHBondContact O-ND1 3.39Å; T590-H592 VanDerWaalsContact O-ND1 3.14Å; T590-E619 HydrophobicContact CG2-CB 4.01Å; T590-A620 CarbonylContact C-O 3.48Å; T590-A620 WeakPolarHBondContact CA-O 3.2Å
591	L	94.1	Very high	92.5	Very high	2 Å²	2	27.9 Å²	27.9	1%	0.01	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	129	178.2	-176.1	69.6	0	0	0	109.4	A565 V586 D595 V597 M609 E619 A620 V626 I628 V643	A565-L591 HydrophobicContact CB-CB 3.73Å; A565-L591 HydrophobicContact CB-CD1 4.08Å; V586-L591 HydrophobicContact CG2-CB 4.21Å; L591-D595 HydrophobicContact CD1-CB 4.19Å; L591-V597 HydrophobicContact CD1-CG1 3.87Å; L591-M609 HydrophobicContact CB-SD 4.42Å; L591-M609 HydrophobicContact CD2-SD 3.65Å; L591-M609 HydrophobicContact CG-SD 3.69Å; L591-E619 CarbonylContact O-C 3.54Å; L591-E619 VanDerWaalsContact O-CA 3.27Å; L591-E619 WeakPolarHBondContact O-CA 3.48Å; L591-A620 HydrophobicContact CB-CB 4.41Å; L591-A620 PolarHBondContact N-O 3.04Å; L591-A620 PolarHBondContact O-N 2.93Å; L591-V626 HydrophobicContact CD2-CG1 3.86Å; L591-I628 HydrophobicContact CD2-CG2 3.69Å; L591-V643 HydrophobicContact CD1-CG2 3.42Å; L591-V643 VanDerWaalsContact CD1-CG2 3.42Å
592	H	94.8	Very high	92.5	Very high	78 Å²	78	29.5 Å²	29.5	36%	0.361	15%	0.149	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	153.8	179.5	-58.7	84.5	0	0	0	112.1	T590 G594 D595 L618	T590-H592 PolarHBondContact O-CE1 3.37Å; T590-H592 PolarHBondContact O-ND1 3.39Å; T590-H592 VanDerWaalsContact O-ND1 3.14Å; H592-G594 PolarHBondContact O-N 2.84Å; H592-D595 PolarHBondContact N-OD2 3.37Å; H592-D595 IonicContact ND1-OD2 2.76Å; H592-D595 WeakPolarHBondContact O-CB 3.47Å; H592-D595 VanDerWaalsContact O-CG 3.31Å; H592-D595 PolarHBondContact O-N 2.81Å; H592-L618 WeakPolarHBondContact CA-O 3.5Å
593	K	94.4	Very high	92.4	Very high	93 Å²	93	31.6 Å²	31.6	40%	0.404	16%	0.157	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.3	125.1	170.5	-176.8	-180	-179.5	174.5	0	109.5	R607 M609 L618	K593-R607 WeakPolarHBondContact CE-O 3.21Å; K593-M609 HydrophobicContact CB-CE 4.21Å; K593-M609 VanDerWaalsContact N-CE 3.28Å; K593-L618 HydrophobicContact CD-CD2 4.02Å; K593-L618 PolarHBondContact N-O 2.93Å
594	G	91.9	Very high	92.4	Very high	37 Å²	37	31 Å²	31	38%	0.381	16%	0.155	S	C	.	.	T	Hydrogen-bonded Turn	trans	101.2	-7.8	-177.1	0	0	0	0	0	114.2	H592 R605 V606	H592-G594 PolarHBondContact O-N 2.84Å; G594-R605 WeakPolarHBondContact O-CG 3.29Å; G594-V606 WeakPolarHBondContact CA-O 3.5Å; G594-V606 PolarHBondContact N-O 2.69Å
595	D	94.1	Very high	92.4	Very high	39 Å²	39	37.1 Å²	37.1	21%	0.209	18%	0.178	C	C	.	.			trans	-62	150.1	174.2	-74	-8.8	0	0	0	111.3	L591 H592 R605 V606 V643	L591-D595 HydrophobicContact CD1-CB 4.19Å; H592-D595 PolarHBondContact N-OD2 3.37Å; H592-D595 IonicContact ND1-OD2 2.76Å; H592-D595 WeakPolarHBondContact O-CB 3.47Å; H592-D595 VanDerWaalsContact O-CG 3.31Å; H592-D595 PolarHBondContact O-N 2.81Å; D595-R605 WeakPolarHBondContact O-CA 3.34Å; D595-V606 WeakPolarHBondContact O-CG2 3.27Å; D595-V606 PolarHBondContact O-N 3.23Å; D595-V643 HydrophobicContact CB-CG1 4.05Å; D595-V643 HydrophobicContact CB-CG2 4.21Å
596	I	93.4	Very high	92.4	Very high	20 Å²	20	37.2 Å²	37.2	10%	0.103	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	121.5	173.6	-64.1	151.7	0	0	0	106.9	G604 R605 V643 V644 E647 A650	I596-G604 WeakPolarHBondContact CA-O 3.41Å; I596-R605 HydrophobicContact CG1-CG 4.49Å; I596-V643 CarbonylContact O-C 3.59Å; I596-V643 VanDerWaalsContact O-CA 3.3Å; I596-V643 WeakPolarHBondContact O-CA 3.45Å; I596-V644 WeakPolarHBondContact CB-O 3.31Å; I596-V644 PolarHBondContact O-N 3.3Å; I596-E647 HydrophobicContact CD1-CB 3.79Å; I596-E647 HydrophobicContact CG1-CB 4.29Å; I596-E647 HydrophobicContact CG2-CB 4.32Å; I596-E647 HydrophobicContact CG2-CG 4.34Å; I596-A650 HydrophobicContact CG2-CB 4.09Å
597	V	93.6	Very high	92.4	Very high	1 Å²	1	45.8 Å²	45.8	1%	0.006	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	137.5	-178.3	-69.2	0	0	0	0	110	L591 Y603 G604 V606 I628 L631 V641 V643	L591-V597 HydrophobicContact CD1-CG1 3.87Å; V597-Y603 WeakPolarHBondContact O-CA 3.46Å; V597-G604 WeakPolarHBondContact CG2-O 3.15Å; V597-G604 PolarHBondContact N-O 3.36Å; V597-G604 PolarHBondContact O-N 3.08Å; V597-V606 HydrophobicContact CB-CG2 4.48Å; V597-V606 HydrophobicContact CG1-CG2 3.74Å; V597-V606 HydrophobicContact CG2-CG2 3.88Å; V597-I628 HydrophobicContact CG2-CD1 4.2Å; V597-L631 HydrophobicContact CG2-CD2 3.54Å; V597-V641 HydrophobicContact CB-CG1 4.21Å; V597-V641 HydrophobicContact CG1-CG1 4.19Å; V597-V643 HydrophobicContact CG1-CG2 3.99Å
598	L	92.3	Very high	92.5	Very high	10 Å²	10	41.6 Å²	41.6	5%	0.052	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	124.1	166	178.7	67	0	0	0	107.3	V641 T642 V644 V653 A654	L598-V641 WeakPolarHBondContact O-CA 3.5Å; L598-T642 PolarHBondContact N-O 2.89Å; L598-T642 PolarHBondContact O-N 3.39Å; L598-V644 HydrophobicContact CB-CG2 3.92Å; L598-V653 HydrophobicContact CD2-CB 4.42Å; L598-V653 HydrophobicContact CD2-CG1 3.82Å; L598-A654 HydrophobicContact CD1-CB 3.97Å
599	C	91.9	Very high	92.7	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	94.3	-175.6	-175.1	0	0	0	0	109.4	V569 F601 E602 P635 E640 V641	V569-C599 WeakPolarHBondContact CG2-SG 3.13Å; C599-F601 PolarHBondContact O-N 3.38Å; C599-E602 CarbonylContact C-O 3.57Å; C599-E602 PolarHBondContact N-O 2.96Å; C599-E602 PolarHBondContact O-N 3.27Å; C599-E602 VanDerWaalsContact O-O 3.13Å; C599-P635 HydrophobicContact CB-CB 4.29Å; C599-P635 WeakPolarHBondContact SG-CB 3.35Å; C599-E640 WeakPolarHBondContact CA-O 3.3Å; C599-V641 HydrophobicContact CB-CG2 4.31Å
600	G	87.4	Confident	92.8	Very high	10 Å²	10	40.6 Å²	40.6	10%	0.103	19%	0.19	C	C	.	.	T	Hydrogen-bonded Turn	trans	57.5	-107.9	-176.6	0	0	0	0	0	112.9	E640 R657	G600-E640 PolarHBondContact N-O 2.95Å; G600-R657 WeakPolarHBondContact O-CD 3.25Å; G600-R657 PolarHBondContact O-NH1 3.39Å; G600-R657 VanDerWaalsContact O-NH1 3.07Å
601	F	88.3	Confident	92.6	Very high	65 Å²	65	40.8 Å²	40.8	29%	0.285	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.2	-9.9	176.6	-61.4	-73.3	0	0	0	114.3	C599 R657 Q658 F661	C599-F601 PolarHBondContact O-N 3.38Å; F601-R657 HydrophobicContact CD1-CB 3.55Å; F601-R657 HydrophobicContact CE1-CB 3.78Å; F601-R657 WeakPolarHBondContact CE1-O 3.33Å; F601-Q658 HydrophobicContact CB-CG 3.99Å; F601-Q658 HydrophobicContact CD1-CG 4.33Å; F601-Q658 PolarHBondContact O-NE2 2.83Å; F601-F661 HydrophobicContact CE1-CB 3.74Å; F601-F661 HydrophobicContact CE1-CD2 4.44Å; F601-F661 HydrophobicContact CE1-CG 4.16Å; F601-F661 HydrophobicContact CZ-CB 4.06Å; F601-F661 AromaticContact CZ-CD2 3.89Å; F601-F661 HydrophobicContact CZ-CD2 3.89Å; F601-F661 AromaticContact CZ-CG 3.99Å; F601-F661 HydrophobicContact CZ-CG 3.99Å
602	E	92.2	Very high	92	Very high	35 Å²	35	44.1 Å²	44.1	16%	0.164	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	152.5	-175.3	-58.9	-57.4	154.3	0	0	110.2	C599 S632 G633	C599-E602 CarbonylContact C-O 3.57Å; C599-E602 PolarHBondContact N-O 2.96Å; C599-E602 PolarHBondContact O-N 3.27Å; C599-E602 VanDerWaalsContact O-O 3.13Å; E602-S632 WeakPolarHBondContact OE2-CB 3.46Å; E602-S632 PolarHBondContact OE2-OG 2.91Å; E602-G633 PolarHBondContact OE2-N 3.34Å; E602-G633 VanDerWaalsContact OE2-N 3.12Å
603	Y	93.2	Very high	91.3	Very high	43 Å²	43	46.5 Å²	46.5	17%	0.169	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	156.9	175.4	69.2	-79.9	0	0	0	108.9	V597 S632 R651 A654	V597-Y603 WeakPolarHBondContact O-CA 3.46Å; Y603-S632 PolarHBondContact N-OG 3.43Å; Y603-S632 VanDerWaalsContact N-OG 3.11Å; Y603-S632 WeakPolarHBondContact O-CB 3.35Å; Y603-S632 PolarHBondContact O-N 3.41Å; Y603-S632 PolarHBondContact O-OG 2.97Å; Y603-R651 HydrophobicContact CD2-CB 4.1Å; Y603-R651 HydrophobicContact CE1-CB 4.22Å; Y603-R651 HydrophobicContact CE1-CG 3.96Å; Y603-R651 HydrophobicContact CE2-CB 3.73Å; Y603-R651 HydrophobicContact CE2-CG 3.96Å; Y603-R651 WeakPolarHBondContact OH-CD 3.37Å; Y603-R651 WeakPolarHBondContact OH-CG 2.81Å; Y603-R651 PolarHBondContact OH-NE 3.15Å; Y603-A654 HydrophobicContact CD1-CB 3.47Å; Y603-A654 VanDerWaalsContact CD1-CB 3.47Å; Y603-A654 HydrophobicContact CE1-CB 4.31Å; Y603-A654 HydrophobicContact CG-CB 4.14Å
604	G	92.9	Very high	90.8	Very high	7 Å²	7	44 Å²	44	7%	0.072	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-176.1	167.8	178.2	0	0	0	0	0	113	I596 V597 G630	I596-G604 WeakPolarHBondContact CA-O 3.41Å; V597-G604 WeakPolarHBondContact CG2-O 3.15Å; V597-G604 PolarHBondContact N-O 3.36Å; V597-G604 PolarHBondContact O-N 3.08Å; G604-G630 WeakPolarHBondContact CA-O 3.24Å
605	R	93.2	Very high	90.6	Very high	132 Å²	132	48 Å²	48	50%	0.498	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	128.3	169.7	-171.1	-179	-60.1	-158.8	-0.6	108.4	G594 D595 I596 R607 G630 E647	G594-R605 WeakPolarHBondContact O-CG 3.29Å; D595-R605 WeakPolarHBondContact O-CA 3.34Å; I596-R605 HydrophobicContact CG1-CG 4.49Å; R605-R607 PolarHBondContact O-N 3Å; R605-G630 PolarHBondContact N-O 3.22Å; R605-E647 IonicContact CZ-OE2 3.13Å; R605-E647 IonicContact NE-OE2 3.87Å; R605-E647 IonicContact NH2-OE2 2.74Å; R605-E647 PolarHBondContact NH2-OE2 3.31Å
606	V	94.6	Very high	90.5	Very high	3 Å²	3	51.8 Å²	51.8	2%	0.018	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.7	102.8	178.6	-179.4	0	0	0	0	109.5	G594 D595 V597 M609 I628 L629	G594-V606 WeakPolarHBondContact CA-O 3.5Å; G594-V606 PolarHBondContact N-O 2.69Å; D595-V606 WeakPolarHBondContact O-CG2 3.27Å; D595-V606 PolarHBondContact O-N 3.23Å; V597-V606 HydrophobicContact CB-CG2 4.48Å; V597-V606 HydrophobicContact CG1-CG2 3.74Å; V597-V606 HydrophobicContact CG2-CG2 3.88Å; V606-M609 HydrophobicContact CG1-CG 3.27Å; V606-M609 HydrophobicContact CG1-SD 3.92Å; V606-I628 HydrophobicContact CG1-CG2 4.39Å; V606-I628 HydrophobicContact CG2-CG2 4.44Å; V606-L629 CarbonylContact C-O 3.58Å; V606-L629 WeakPolarHBondContact CA-O 3.46Å
607	R	93.5	Very high	90.5	Very high	181 Å²	181	52.6 Å²	52.6	68%	0.683	25%	0.252	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76.9	-39.8	-178.5	-70.2	176.8	66.7	-172.6	0.3	111.9	K593 R605 L629	K593-R607 WeakPolarHBondContact CE-O 3.21Å; R605-R607 PolarHBondContact O-N 3Å; R607-L629 PolarHBondContact N-O 3.27Å
608	A	93.8	Very high	90.5	Very high	12 Å²	12	58.6 Å²	58.6	10%	0.099	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.2	153.6	173.5	0	0	0	0	0	108.7	L629	A608-L629 HydrophobicContact CB-CD1 4.06Å; A608-L629 PolarHBondContact O-N 3.05Å; A608-L629 VanDerWaalsContact O-N 3.08Å
609	M	94.5	Very high	90.6	Very high	1 Å²	1	64.1 Å²	64.1	1%	0.005	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	140.5	173.3	-64.1	-170.7	-54.1	0	0	108.4	L591 K593 V606 E616 V617 L618 V626 E627 I628	L591-M609 HydrophobicContact CB-SD 4.42Å; L591-M609 HydrophobicContact CD2-SD 3.65Å; L591-M609 HydrophobicContact CG-SD 3.69Å; K593-M609 HydrophobicContact CB-CE 4.21Å; K593-M609 VanDerWaalsContact N-CE 3.28Å; V606-M609 HydrophobicContact CG1-CG 3.27Å; V606-M609 HydrophobicContact CG1-SD 3.92Å; M609-E616 WeakPolarHBondContact O-CA 3.42Å; M609-V617 HydrophobicContact CB-CG2 3.81Å; M609-V617 PolarHBondContact O-N 3.19Å; M609-L618 WeakPolarHBondContact CE-O 3.39Å; M609-V626 HydrophobicContact CB-CG2 3.66Å; M609-V626 HydrophobicContact CG-CG2 4.17Å; M609-V626 HydrophobicContact SD-CG2 4.23Å; M609-E627 CarbonylContact C-O 3.54Å; M609-E627 VanDerWaalsContact CA-O 3.24Å; M609-E627 WeakPolarHBondContact CA-O 3.3Å; M609-I628 HydrophobicContact CG-CG2 4.36Å
610	R	92	Very high	90.6	Very high	66 Å²	66	64.2 Å²	64.2	25%	0.249	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	141.7	172.3	-63.8	-172.6	178.1	173.4	-5.2	110.6	Q615 E616 V626 E627	R610-Q615 CarbonylContact C-O 3.58Å; R610-Q615 VanDerWaalsContact CA-O 3.24Å; R610-Q615 WeakPolarHBondContact CA-O 3.08Å; R610-E616 HydrophobicContact CG-CG 4.29Å; R610-E616 IonicContact NH2-OE1 3.64Å; R610-V626 WeakPolarHBondContact O-CG2 3.31Å; R610-E627 HydrophobicContact CB-CB 4.22Å; R610-E627 PolarHBondContact N-O 3.48Å; R610-E627 PolarHBondContact O-N 3.46Å
611	N	89.4	Confident	90.8	Very high	21 Å²	21	64.2 Å²	64.2	11%	0.112	31%	0.31	C	S	.	.			trans	-73.1	171.6	164.5	68.5	8.9	0	0	0	109.5	L613 G614 Q615 V617	N611-L613 PolarHBondContact O-N 3.21Å; N611-L613 PolarHBondContact OD1-N 3.02Å; N611-G614 WeakPolarHBondContact O-CA 3.33Å; N611-G614 PolarHBondContact O-N 2.9Å; N611-G614 PolarHBondContact OD1-N 3.15Å; N611-G614 VanDerWaalsContact OD1-N 3.14Å; N611-Q615 PolarHBondContact N-O 2.76Å; N611-Q615 PolarHBondContact ND2-OE1 2.72Å; N611-Q615 WeakPolarHBondContact OD1-CA 3.25Å; N611-Q615 WeakPolarHBondContact OD1-CB 3.46Å; N611-Q615 PolarHBondContact OD1-N 3.28Å; N611-Q615 PolarHBondContact OD1-O 3.41Å; N611-V617 HydrophobicContact CB-CG1 3.86Å
612	E	80.7	Confident	91	Very high	73 Å²	73	62.3 Å²	62.3	34%	0.341	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.9	-20.3	-178.8	-160.4	-150.5	-160	0	0	113.9	A430 Y431 G614	A430-E612 PolarHBondContact N-OE1 2.97Å; A430-E612 WeakPolarHBondContact O-CG 3.47Å; Y431-E612 WeakPolarHBondContact CA-OE1 3.29Å; Y431-E612 WeakPolarHBondContact CA-OE2 3.3Å; Y431-E612 WeakPolarHBondContact CB-OE1 3.36Å; Y431-E612 WeakPolarHBondContact CB-OE2 3.31Å; Y431-E612 PolarHBondContact N-OE1 2.96Å; E612-G614 PolarHBondContact O-N 2.93Å
613	L	80.9	Confident	91	Very high	128 Å²	128	60.7 Å²	60.7	67%	0.67	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.8	3	170	-60.7	175.1	0	0	0	113	N611 Q615	N611-L613 PolarHBondContact O-N 3.21Å; N611-L613 PolarHBondContact OD1-N 3.02Å; L613-Q615 VanDerWaalsContact C-N 3.3Å; L613-Q615 HydrophobicContact CB-CG 4.48Å; L613-Q615 PolarHBondContact O-N 3.41Å
614	G	83.7	Confident	90.9	Very high	41 Å²	41	61 Å²	61	42%	0.423	30%	0.3	S	S	.	.	S	Bend	trans	78.3	5.8	179.1	0	0	0	0	0	115.2	N611 E612	N611-G614 WeakPolarHBondContact O-CA 3.33Å; N611-G614 PolarHBondContact O-N 2.9Å; N611-G614 PolarHBondContact OD1-N 3.15Å; N611-G614 VanDerWaalsContact OD1-N 3.14Å; E612-G614 PolarHBondContact O-N 2.93Å
615	Q	87.8	Confident	91	Very high	121 Å²	121	60.8 Å²	60.8	57%	0.565	30%	0.297	S	S	*	.			trans	-82.5	143.5	176.6	-55.2	174	-14.6	0	0	110.5	R610 N611 L613	R610-Q615 CarbonylContact C-O 3.58Å; R610-Q615 VanDerWaalsContact CA-O 3.24Å; R610-Q615 WeakPolarHBondContact CA-O 3.08Å; N611-Q615 PolarHBondContact N-O 2.76Å; N611-Q615 PolarHBondContact ND2-OE1 2.72Å; N611-Q615 WeakPolarHBondContact OD1-CA 3.25Å; N611-Q615 WeakPolarHBondContact OD1-CB 3.46Å; N611-Q615 PolarHBondContact OD1-N 3.28Å; N611-Q615 PolarHBondContact OD1-O 3.41Å; L613-Q615 VanDerWaalsContact C-N 3.3Å; L613-Q615 HydrophobicContact CB-CG 4.48Å; L613-Q615 PolarHBondContact O-N 3.41Å
616	E	92.1	Very high	91	Very high	118 Å²	118	54.6 Å²	54.6	55%	0.551	27%	0.274	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73	130.9	177.6	-63.4	-165.8	171.3	0	0	111.4	M609 R610	M609-E616 WeakPolarHBondContact O-CA 3.42Å; R610-E616 HydrophobicContact CG-CG 4.29Å; R610-E616 IonicContact NH2-OE1 3.64Å
617	V	93.2	Very high	91	Very high	37 Å²	37	56.5 Å²	56.5	22%	0.224	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	150.4	177.3	-65.9	0	0	0	0	110.7	M609 N611 V626	M609-V617 HydrophobicContact CB-CG2 3.81Å; M609-V617 PolarHBondContact O-N 3.19Å; N611-V617 HydrophobicContact CB-CG1 3.86Å; V617-V626 HydrophobicContact CG2-CG2 4Å
618	L	93.5	Very high	91.1	Very high	126 Å²	126	47.9 Å²	47.9	66%	0.66	25%	0.251	S	S	*	.	S	Bend	trans	-98.3	-28.9	-178.4	-65.5	176.9	0	0	0	112.9	H592 K593 M609	H592-L618 WeakPolarHBondContact CA-O 3.5Å; K593-L618 HydrophobicContact CD-CD2 4.02Å; K593-L618 PolarHBondContact N-O 2.93Å; M609-L618 WeakPolarHBondContact CE-O 3.39Å
619	E	93.3	Very high	91.1	Very high	127 Å²	127	48.1 Å²	48.1	59%	0.593	25%	0.25	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-138.6	146.6	179.3	61.5	-178.8	-167.3	0	0	110	T590 L591	T590-E619 HydrophobicContact CG2-CB 4.01Å; L591-E619 CarbonylContact O-C 3.54Å; L591-E619 VanDerWaalsContact O-CA 3.27Å; L591-E619 WeakPolarHBondContact O-CA 3.48Å
620	A	92.5	Very high	90.9	Very high	2 Å²	2	49 Å²	49	2%	0.017	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	117.7	172.9	0	0	0	0	0	109.3	V586 T590 L591 I624 V626	V586-A620 HydrophobicContact CG2-CB 4.25Å; T590-A620 CarbonylContact C-O 3.48Å; T590-A620 WeakPolarHBondContact CA-O 3.2Å; L591-A620 HydrophobicContact CB-CB 4.41Å; L591-A620 PolarHBondContact N-O 3.04Å; L591-A620 PolarHBondContact O-N 2.93Å; A620-I624 HydrophobicContact CB-CG2 4.47Å; A620-V626 HydrophobicContact CB-CB 4.07Å; A620-V626 HydrophobicContact CB-CG1 4.06Å; A620-V626 HydrophobicContact CB-CG2 4.27Å
621	G	92.1	Very high	91	Very high	10 Å²	10	46.4 Å²	46.4	10%	0.103	25%	0.25	C	S	.	.			trans	-83.5	-176.9	178.4	0	0	0	0	0	113.5	V586 I624	V586-G621 WeakPolarHBondContact CB-O 3.38Å; G621-I624 WeakPolarHBondContact O-CB 3.18Å; G621-I624 PolarHBondContact O-N 2.93Å
622	P	92.2	Very high	91.1	Very high	24 Å²	24	48.4 Å²	48.4	16%	0.156	27%	0.266	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.9	146.5	179.1	27.7	-34.8	0	0	0	111.7	A559 R561 I624	A559-P622 HydrophobicContact CB-CB 4.02Å; R561-P622 HydrophobicContact CG-CG 4.5Å; P622-I624 PolarHBondContact O-N 2.69Å
623	S	91.3	Very high	91.6	Very high	1 Å²	1	45.7 Å²	45.7	1%	0.007	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	64.6	5.9	-174.9	-54.8	0	0	0	0	115.6	A391 T441 V586	A391-S623 WeakPolarHBondContact O-CB 3.31Å; A391-S623 PolarHBondContact O-OG 3.04Å; T441-S623 WeakPolarHBondContact CB-O 3.43Å; T441-S623 WeakPolarHBondContact CG2-O 3.29Å; T441-S623 PolarHBondContact OG1-O 3.44Å; V586-S623 WeakPolarHBondContact O-CA 3.24Å; V586-S623 PolarHBondContact O-N 2.76Å
624	I	92.5	Very high	92.2	Very high	49 Å²	49	41.4 Å²	41.4	25%	0.251	24%	0.237	S	C	.	.			trans	-94.5	124.8	178.2	-63	171.5	0	0	0	109.7	M439 V586 A620 G621 P622	M439-I624 HydrophobicContact CE-CD1 4.38Å; M439-I624 HydrophobicContact CE-CG1 3.91Å; V586-I624 PolarHBondContact N-O 2.74Å; A620-I624 HydrophobicContact CB-CG2 4.47Å; G621-I624 WeakPolarHBondContact O-CB 3.18Å; G621-I624 PolarHBondContact O-N 2.93Å; P622-I624 PolarHBondContact O-N 2.69Å
625	P	93.8	Very high	92.6	Very high	3 Å²	3	39.5 Å²	39.5	2%	0.019	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	136.8	172.4	30.1	-31.3	0	0	0	110.8	A430 T441 V584	A430-P625 HydrophobicContact CB-CB 3.72Å; A430-P625 HydrophobicContact CB-CG 4.21Å; A430-P625 WeakPolarHBondContact O-CB 3.33Å; A430-P625 WeakPolarHBondContact O-CG 3.39Å; T441-P625 HydrophobicContact CG2-CG 4.28Å; V584-P625 WeakPolarHBondContact O-CA 3.36Å
626	V	94.3	Very high	92.7	Very high	2 Å²	2	35.5 Å²	35.5	1%	0.012	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143	134.5	-177.1	66.1	0	0	0	0	111.7	V584 V586 L591 M609 R610 V617 A620 I628	V584-V626 HydrophobicContact CB-CG1 4.44Å; V584-V626 PolarHBondContact N-O 2.78Å; V584-V626 PolarHBondContact O-N 3.36Å; V586-V626 HydrophobicContact CG2-CG1 4.21Å; L591-V626 HydrophobicContact CD2-CG1 3.86Å; M609-V626 HydrophobicContact CB-CG2 3.66Å; M609-V626 HydrophobicContact CG-CG2 4.17Å; M609-V626 HydrophobicContact SD-CG2 4.23Å; R610-V626 WeakPolarHBondContact O-CG2 3.31Å; V617-V626 HydrophobicContact CG2-CG2 4Å; A620-V626 HydrophobicContact CB-CB 4.07Å; A620-V626 HydrophobicContact CB-CG1 4.06Å; A620-V626 HydrophobicContact CB-CG2 4.27Å; V626-I628 HydrophobicContact CG1-CG2 4.26Å
627	E	94.1	Very high	92.4	Very high	43 Å²	43	30.3 Å²	30.3	20%	0.201	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	120.2	169.6	-67	-175.5	176.9	0	0	109.9	R578 V581 A582 M609 R610	R578-E627 IonicContact NH1-OE2 2.76Å; R578-E627 IonicContact NH2-OE2 2.72Å; R578-E627 PolarHBondContact NH2-OE2 3.23Å; V581-E627 HydrophobicContact CG1-CB 4.17Å; A582-E627 CarbonylContact O-C 3.44Å; A582-E627 WeakPolarHBondContact O-CA 3.23Å; M609-E627 CarbonylContact C-O 3.54Å; M609-E627 VanDerWaalsContact CA-O 3.24Å; M609-E627 WeakPolarHBondContact CA-O 3.3Å; R610-E627 HydrophobicContact CB-CB 4.22Å; R610-E627 PolarHBondContact N-O 3.48Å; R610-E627 PolarHBondContact O-N 3.46Å
628	I	94.8	Very high	92.2	Very high	1 Å²	1	30.4 Å²	30.4	1%	0.005	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	138.1	174.9	60.9	167.4	0	0	0	111.4	V581 A582 V584 L591 V597 V606 M609 V626 L631	V581-I628 WeakPolarHBondContact CA-O 3.39Å; A582-I628 HydrophobicContact CB-CD1 4.3Å; A582-I628 HydrophobicContact CB-CG1 3.92Å; A582-I628 PolarHBondContact N-O 3.43Å; A582-I628 VanDerWaalsContact N-O 3.15Å; A582-I628 VanDerWaalsContact O-CG1 3.31Å; A582-I628 WeakPolarHBondContact O-CG1 3.39Å; A582-I628 PolarHBondContact O-N 2.88Å; V584-I628 HydrophobicContact CG2-CD1 3.68Å; V584-I628 HydrophobicContact CG2-CG1 3.81Å; L591-I628 HydrophobicContact CD2-CG2 3.69Å; V597-I628 HydrophobicContact CG2-CD1 4.2Å; V606-I628 HydrophobicContact CG1-CG2 4.39Å; V606-I628 HydrophobicContact CG2-CG2 4.44Å; M609-I628 HydrophobicContact CG-CG2 4.36Å; V626-I628 HydrophobicContact CG1-CG2 4.26Å; I628-L631 HydrophobicContact CD1-CD1 4.02Å; I628-L631 HydrophobicContact CD1-CD2 4.16Å; I628-L631 HydrophobicContact CD1-CG 4.27Å; I628-L631 HydrophobicContact CG1-CD1 4.44Å
629	L	93.7	Very high	92	Very high	16 Å²	16	26 Å²	26	8%	0.084	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	146.9	173.7	-62.1	-179.9	0	0	0	111.4	R578 V581 V606 R607 A608	R578-L629 HydrophobicContact CB-CD1 4.38Å; R578-L629 HydrophobicContact CB-CD2 4.07Å; R578-L629 HydrophobicContact CG-CD1 4.47Å; R578-L629 VanDerWaalsContact NH2-CD1 3.33Å; V581-L629 HydrophobicContact CB-CD2 3.92Å; V581-L629 HydrophobicContact CG1-CD2 3.72Å; V581-L629 HydrophobicContact CG2-CD2 3.29Å; V606-L629 CarbonylContact C-O 3.58Å; V606-L629 WeakPolarHBondContact CA-O 3.46Å; R607-L629 PolarHBondContact N-O 3.27Å; A608-L629 HydrophobicContact CB-CD1 4.06Å; A608-L629 PolarHBondContact O-N 3.05Å; A608-L629 VanDerWaalsContact O-N 3.08Å
630	G	91.7	Very high	91.9	Very high	19 Å²	19	25.9 Å²	25.9	20%	0.196	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	105.6	21.6	170.9	0	0	0	0	0	115.3	G604 R605	G604-G630 WeakPolarHBondContact CA-O 3.24Å; R605-G630 PolarHBondContact N-O 3.22Å
631	L	92.7	Very high	91.9	Very high	12 Å²	12	26 Å²	26	6%	0.063	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	158.3	168.3	-61.9	176.3	0	0	0	111.2	P580 A582 V597 I628 G633 P635	P580-L631 HydrophobicContact CG-CB 4.18Å; P580-L631 WeakPolarHBondContact CG-O 3.46Å; A582-L631 HydrophobicContact CB-CD1 3.76Å; V597-L631 HydrophobicContact CG2-CD2 3.54Å; I628-L631 HydrophobicContact CD1-CD1 4.02Å; I628-L631 HydrophobicContact CD1-CD2 4.16Å; I628-L631 HydrophobicContact CD1-CG 4.27Å; I628-L631 HydrophobicContact CG1-CD1 4.44Å; L631-G633 VanDerWaalsContact C-N 3.32Å; L631-G633 WeakPolarHBondContact CB-O 3.43Å; L631-P635 HydrophobicContact CD1-CG 3.75Å
632	S	91.8	Very high	91.9	Very high	63 Å²	63	26 Å²	26	44%	0.441	17%	0.165	S	C	.	.	S	Bend	trans	-67.4	-31.9	175.1	45.6	0	0	0	0	113.4	E602 Y603	E602-S632 WeakPolarHBondContact OE2-CB 3.46Å; E602-S632 PolarHBondContact OE2-OG 2.91Å; Y603-S632 PolarHBondContact N-OG 3.43Å; Y603-S632 VanDerWaalsContact N-OG 3.11Å; Y603-S632 WeakPolarHBondContact O-CB 3.35Å; Y603-S632 PolarHBondContact O-N 3.41Å; Y603-S632 PolarHBondContact O-OG 2.97Å
633	G	91.7	Very high	91.9	Very high	17 Å²	17	25.4 Å²	25.4	18%	0.175	16%	0.161	C	C	.	.	S	Bend	trans	-154.2	-178.4	-177.8	0	0	0	0	0	111	P580 E602 L631 P635	P580-G633 VanDerWaalsContact CB-C 3.49Å; P580-G633 VanDerWaalsContact CB-O 3.27Å; P580-G633 WeakPolarHBondContact CB-O 3.39Å; E602-G633 PolarHBondContact OE2-N 3.34Å; E602-G633 VanDerWaalsContact OE2-N 3.12Å; L631-G633 VanDerWaalsContact C-N 3.32Å; L631-G633 WeakPolarHBondContact CB-O 3.43Å; G633-P635 VanDerWaalsContact O-CD 3.31Å; G633-P635 WeakPolarHBondContact O-CD 3.4Å
634	V	92.6	Very high	91.8	Very high	38 Å²	38	25.9 Å²	25.9	23%	0.23	16%	0.164	C	C	.	.			trans	-80.5	113.3	175.3	-179.7	0	0	0	0	107.6	S572 L574 P580 V725	S572-V634 VanDerWaalsContact OG-CG1 3.3Å; S572-V634 WeakPolarHBondContact OG-CG1 3.5Å; L574-V634 HydrophobicContact CB-CG2 3.85Å; L574-V634 HydrophobicContact CD1-CG2 4.17Å; L574-V634 HydrophobicContact CG-CG2 4.49Å; P580-V634 HydrophobicContact CB-CG2 4.04Å; V634-V725 HydrophobicContact CG1-CB 4.31Å; V634-V725 HydrophobicContact CG1-CG1 4.37Å; V634-V725 HydrophobicContact CG1-CG2 4.29Å
635	P	93	Very high	91.5	Very high	1 Å²	1	29.6 Å²	29.6	1%	0.006	18%	0.175	C	C	.	.	P	Polyproline II helix	trans	-69.4	160.2	178.5	29.8	-35.5	0	0	0	111.3	V569 S572 A582 C599 L631 G633	V569-P635 HydrophobicContact CG1-CG 4.44Å; V569-P635 HydrophobicContact CG2-CB 4.44Å; V569-P635 HydrophobicContact CG2-CG 4.26Å; S572-P635 WeakPolarHBondContact CB-O 3.45Å; S572-P635 PolarHBondContact OG-O 3.39Å; A582-P635 HydrophobicContact CB-CG 3.69Å; C599-P635 HydrophobicContact CB-CB 4.29Å; C599-P635 WeakPolarHBondContact SG-CB 3.35Å; L631-P635 HydrophobicContact CD1-CG 3.75Å; G633-P635 VanDerWaalsContact O-CD 3.31Å; G633-P635 WeakPolarHBondContact O-CD 3.4Å
636	A	89.9	Confident	91.2	Very high	36 Å²	36	33 Å²	33	30%	0.298	19%	0.193	S	C	.	.	P	Polyproline II helix	trans	-71.4	146.4	173.9	0	0	0	0	0	110.1	G638 D639	A636-G638 PolarHBondContact O-N 2.95Å; A636-D639 WeakPolarHBondContact CB-OD2 3.15Å; A636-D639 PolarHBondContact N-OD2 3.18Å; A636-D639 WeakPolarHBondContact O-CB 3.41Å; A636-D639 PolarHBondContact O-N 3.33Å
637	A	86.6	Confident	90.9	Very high	10 Å²	10	35.6 Å²	35.6	8%	0.083	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.1	125.2	177.7	0	0	0	0	0	109.5	R457 Q698	R457-A637 VanDerWaalsContact NE-C 3.26Å; R457-A637 PolarHBondContact NE-O 2.98Å; R457-A637 VanDerWaalsContact NE-O 3.08Å; R457-A637 PolarHBondContact NH2-O 3.44Å; A637-Q698 HydrophobicContact CB-CG 4.17Å
638	G	87	Confident	90.6	Very high	39 Å²	39	41 Å²	41	40%	0.402	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	97.4	-3.5	-171.8	0	0	0	0	0	114.9	V569 A636	V569-G638 VanDerWaalsContact O-CA 3.27Å; V569-G638 WeakPolarHBondContact O-CA 3.45Å; V569-G638 PolarHBondContact O-N 2.83Å; A636-G638 PolarHBondContact O-N 2.95Å
639	D	90.7	Very high	90	Very high	32 Å²	32	45 Å²	45	17%	0.171	25%	0.245	C	C	.	.	P	Polyproline II helix	trans	-61.9	143.5	175	-80.9	-15.2	0	0	0	111.4	V569 A636	V569-D639 HydrophobicContact CG2-CB 4.33Å; V569-D639 PolarHBondContact N-O 2.77Å; A636-D639 WeakPolarHBondContact CB-OD2 3.15Å; A636-D639 PolarHBondContact N-OD2 3.18Å; A636-D639 WeakPolarHBondContact O-CB 3.41Å; A636-D639 PolarHBondContact O-N 3.33Å
640	E	90.8	Very high	89.7	Confident	126 Å²	126	44.2 Å²	44.2	59%	0.589	24%	0.241	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-74.2	131.7	173.1	-66.6	-177.2	174.6	0	0	110.5	C599 G600	C599-E640 WeakPolarHBondContact CA-O 3.3Å; G600-E640 PolarHBondContact N-O 2.95Å
641	V	92.5	Very high	89.4	Confident	4 Å²	4	47.3 Å²	47.3	2%	0.024	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	123.6	174.9	-177.1	0	0	0	0	108.2	S566 G567 V569 V584 V597 L598 C599	S566-V641 CarbonylContact C-O 3.56Å; S566-V641 VanDerWaalsContact CA-O 3.27Å; S566-V641 WeakPolarHBondContact CA-O 3.49Å; G567-V641 PolarHBondContact N-O 2.96Å; G567-V641 PolarHBondContact O-N 3.18Å; V569-V641 HydrophobicContact CG2-CG2 3.5Å; V584-V641 HydrophobicContact CB-CG2 4.47Å; V584-V641 HydrophobicContact CG1-CB 3.95Å; V584-V641 HydrophobicContact CG1-CG1 4.19Å; V584-V641 HydrophobicContact CG1-CG2 3.77Å; V584-V641 HydrophobicContact CG2-CG2 3.81Å; V597-V641 HydrophobicContact CB-CG1 4.21Å; V597-V641 HydrophobicContact CG1-CG1 4.19Å; L598-V641 WeakPolarHBondContact O-CA 3.5Å; C599-V641 HydrophobicContact CB-CG2 4.31Å
642	T	91.6	Very high	89.1	Confident	10 Å²	10	52.1 Å²	52.1	6%	0.061	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	129	175.7	-59.8	0	0	0	0	109.4	L598	L598-T642 PolarHBondContact N-O 2.89Å; L598-T642 PolarHBondContact O-N 3.39Å
643	V	92	Very high	88.9	Confident	11 Å²	11	49.2 Å²	49.2	7%	0.067	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	135.9	169.1	173.5	0	0	0	0	108.9	M564 A565 L591 D595 I596 V597	M564-V643 HydrophobicContact CB-CB 4.43Å; M564-V643 WeakPolarHBondContact CE-O 3.47Å; A565-V643 HydrophobicContact CB-CG2 3.68Å; A565-V643 PolarHBondContact O-N 2.89Å; L591-V643 HydrophobicContact CD1-CG2 3.42Å; L591-V643 VanDerWaalsContact CD1-CG2 3.42Å; D595-V643 HydrophobicContact CB-CG1 4.05Å; D595-V643 HydrophobicContact CB-CG2 4.21Å; I596-V643 CarbonylContact O-C 3.59Å; I596-V643 VanDerWaalsContact O-CA 3.3Å; I596-V643 WeakPolarHBondContact O-CA 3.45Å; V597-V643 HydrophobicContact CG1-CG2 3.99Å
644	V	89.5	Confident	88.6	Confident	11 Å²	11	48.4 Å²	48.4	7%	0.067	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	147.3	178.6	-176.7	0	0	0	0	108.7	V377 I596 L598 A650	V377-V644 HydrophobicContact CG1-CG1 3.93Å; V377-V644 HydrophobicContact CG1-CG2 3.72Å; I596-V644 WeakPolarHBondContact CB-O 3.31Å; I596-V644 PolarHBondContact O-N 3.3Å; L598-V644 HydrophobicContact CB-CG2 3.92Å; V644-A650 HydrophobicContact CB-CB 4.29Å; V644-A650 HydrophobicContact CG1-CB 4.38Å; V644-A650 HydrophobicContact CG2-CB 4.46Å
645	R	86.8	Confident	88.4	Confident	127 Å²	127	50.9 Å²	50.9	48%	0.479	25%	0.252	S	S	.	.	S	Bend	trans	-71.3	-42.8	179.7	-63.6	-177.7	179.4	154.1	-1	113.1	D380 D382 M564	D380-R645 IonicContact OD1-CZ 2.76Å; D380-R645 IonicContact OD1-NH1 3.69Å; D380-R645 PolarHBondContact OD1-NH1 2.84Å; D380-R645 IonicContact OD1-NH2 3.08Å; D380-R645 WeakPolarHBondContact OD2-CD 3.27Å; D380-R645 IonicContact OD2-CZ 2.86Å; D380-R645 IonicContact OD2-NE 3.7Å; D380-R645 IonicContact OD2-NH1 2.74Å; D380-R645 PolarHBondContact OD2-NH1 3.28Å; D382-R645 IonicContact OD1-NH2 3.42Å; D382-R645 PolarHBondContact OD1-NH2 3.45Å; M564-R645 HydrophobicContact CE-CG 4.18Å; M564-R645 HydrophobicContact SD-CG 4.32Å
646	D	87.1	Confident	88	Confident	75 Å²	75	53.9 Å²	53.9	40%	0.401	26%	0.264	S	S	.	.			trans	-108.4	123.6	-173.9	-70.3	-42.8	0	0	0	112.4	K648 K649 A650	D646-K648 VanDerWaalsContact C-N 3.27Å; D646-K648 PolarHBondContact O-N 2.85Å; D646-K649 HydrophobicContact CB-CB 4.18Å; D646-K649 HydrophobicContact CB-CD 4.09Å; D646-K649 HydrophobicContact CB-CG 4.05Å; D646-K649 PolarHBondContact O-N 2.82Å; D646-K649 WeakPolarHBondContact OD2-CE 3.42Å; D646-K649 IonicContact OD2-NZ 2.84Å; D646-K649 PolarHBondContact OD2-NZ 2.95Å; D646-A650 PolarHBondContact O-N 3.35Å; D646-A650 VanDerWaalsContact O-N 3.13Å
647	E	87.8	Confident	87.7	Confident	57 Å²	57	55.1 Å²	55.1	27%	0.266	26%	0.26	S	S	.	.	H	α-helix	trans	-64.1	-32.9	176.4	-161.7	-175	129.8	0	0	112.3	I596 R605 R651	I596-E647 HydrophobicContact CD1-CB 3.79Å; I596-E647 HydrophobicContact CG1-CB 4.29Å; I596-E647 HydrophobicContact CG2-CB 4.32Å; I596-E647 HydrophobicContact CG2-CG 4.34Å; R605-E647 IonicContact CZ-OE2 3.13Å; R605-E647 IonicContact NE-OE2 3.87Å; R605-E647 IonicContact NH2-OE2 2.74Å; R605-E647 PolarHBondContact NH2-OE2 3.31Å; E647-R651 VanDerWaalsContact O-CB 3.3Å; E647-R651 WeakPolarHBondContact O-CB 2.96Å; E647-R651 PolarHBondContact O-N 2.84Å; E647-R651 IonicContact OE1-CZ 3.21Å; E647-R651 IonicContact OE1-NH2 3.07Å; E647-R651 PolarHBondContact OE1-NH2 3.15Å
648	K	87.9	Confident	87.6	Confident	155 Å²	155	57.8 Å²	57.8	67%	0.674	27%	0.271	S	S	*	.	H	α-helix	trans	-65.3	-46.1	178.4	-68.4	-176	179.9	179.5	0	111.7	D646 R651 E652	D646-K648 VanDerWaalsContact C-N 3.27Å; D646-K648 PolarHBondContact O-N 2.85Å; K648-R651 PolarHBondContact O-N 3.24Å; K648-E652 WeakPolarHBondContact O-CG 3.36Å; K648-E652 PolarHBondContact O-N 3.48Å
649	K	83	Confident	87.4	Confident	86 Å²	86	57.5 Å²	57.5	37%	0.374	27%	0.268	S	S	.	.	H	α-helix	trans	-64.9	-45.1	177.5	-68.2	178.8	-175.9	145.3	0	110.9	V377 D646 R651 E652 V653	V377-K649 HydrophobicContact CG2-CB 4.27Å; D646-K649 HydrophobicContact CB-CB 4.18Å; D646-K649 HydrophobicContact CB-CD 4.09Å; D646-K649 HydrophobicContact CB-CG 4.05Å; D646-K649 PolarHBondContact O-N 2.82Å; D646-K649 WeakPolarHBondContact OD2-CE 3.42Å; D646-K649 IonicContact OD2-NZ 2.84Å; D646-K649 PolarHBondContact OD2-NZ 2.95Å; K649-R651 VanDerWaalsContact C-N 3.3Å; K649-R651 PolarHBondContact O-N 3.17Å; K649-E652 PolarHBondContact O-N 3.26Å; K649-V653 WeakPolarHBondContact O-CG2 3.26Å; K649-V653 PolarHBondContact O-N 3.27Å
650	A	86	Confident	86.9	Confident	0 Å²	0	58.9 Å²	58.9	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-58.1	-42.7	176	0	0	0	0	0	111.9	I596 V644 D646 A654	I596-A650 HydrophobicContact CG2-CB 4.09Å; V644-A650 HydrophobicContact CB-CB 4.29Å; V644-A650 HydrophobicContact CG1-CB 4.38Å; V644-A650 HydrophobicContact CG2-CB 4.46Å; D646-A650 PolarHBondContact O-N 3.35Å; D646-A650 VanDerWaalsContact O-N 3.13Å; A650-A654 VanDerWaalsContact O-CB 3.29Å; A650-A654 WeakPolarHBondContact O-CB 3.36Å; A650-A654 PolarHBondContact O-N 3.48Å
651	R	86.7	Confident	86.5	Confident	83 Å²	83	58.2 Å²	58.2	31%	0.313	27%	0.268	S	S	.	.	H	α-helix	trans	-63.1	-46.4	175.3	178.2	179.8	-57.5	126.4	7.3	112.8	Y603 E647 K648 K649 A654 L655	Y603-R651 HydrophobicContact CD2-CB 4.1Å; Y603-R651 HydrophobicContact CE1-CB 4.22Å; Y603-R651 HydrophobicContact CE1-CG 3.96Å; Y603-R651 HydrophobicContact CE2-CB 3.73Å; Y603-R651 HydrophobicContact CE2-CG 3.96Å; Y603-R651 WeakPolarHBondContact OH-CD 3.37Å; Y603-R651 WeakPolarHBondContact OH-CG 2.81Å; Y603-R651 PolarHBondContact OH-NE 3.15Å; E647-R651 VanDerWaalsContact O-CB 3.3Å; E647-R651 WeakPolarHBondContact O-CB 2.96Å; E647-R651 PolarHBondContact O-N 2.84Å; E647-R651 IonicContact OE1-CZ 3.21Å; E647-R651 IonicContact OE1-NH2 3.07Å; E647-R651 PolarHBondContact OE1-NH2 3.15Å; K648-R651 PolarHBondContact O-N 3.24Å; K649-R651 VanDerWaalsContact C-N 3.3Å; K649-R651 PolarHBondContact O-N 3.17Å; R651-A654 PolarHBondContact O-N 3.41Å; R651-L655 HydrophobicContact CG-CD1 3.8Å; R651-L655 HydrophobicContact CG-CG 4.28Å; R651-L655 WeakPolarHBondContact O-CB 3.32Å; R651-L655 VanDerWaalsContact O-CG 3.31Å; R651-L655 WeakPolarHBondContact O-CG 3.38Å; R651-L655 PolarHBondContact O-N 2.66Å
652	E	86	Confident	85.8	Confident	114 Å²	114	67.4 Å²	67.4	53%	0.533	30%	0.302	S	S	.	.	H	α-helix	trans	-61.8	-44.9	179.2	-75.7	174.6	-172	0	0	111.3	L373 K648 K649 Y656	L373-E652 HydrophobicContact CD2-CB 4.29Å; K648-E652 WeakPolarHBondContact O-CG 3.36Å; K648-E652 PolarHBondContact O-N 3.48Å; K649-E652 PolarHBondContact O-N 3.26Å; E652-Y656 WeakPolarHBondContact O-CB 3.37Å; E652-Y656 PolarHBondContact O-N 2.99Å
653	V	86.8	Confident	85.2	Confident	1 Å²	1	71.7 Å²	71.7	1%	0.006	32%	0.321	C	S	.	.	H	α-helix	trans	-62	-47.3	175.7	172.9	0	0	0	0	111.4	L373 E374 V377 L598 K649 Y656 R657	L373-V653 HydrophobicContact CD2-CG2 3.83Å; L373-V653 HydrophobicContact CG-CG2 3.82Å; E374-V653 HydrophobicContact CG-CG1 4.14Å; V377-V653 HydrophobicContact CG2-CG2 4.12Å; L598-V653 HydrophobicContact CD2-CB 4.42Å; L598-V653 HydrophobicContact CD2-CG1 3.82Å; K649-V653 WeakPolarHBondContact O-CG2 3.26Å; K649-V653 PolarHBondContact O-N 3.27Å; V653-Y656 WeakPolarHBondContact O-CB 3.35Å; V653-Y656 PolarHBondContact O-N 3.09Å; V653-R657 WeakPolarHBondContact O-CG 3.3Å; V653-R657 PolarHBondContact O-N 3.48Å
654	A	87	Confident	84.5	Confident	0 Å²	0	74.8 Å²	74.8	0%	0	34%	0.34	C	S	.	.	H	α-helix	trans	-62.8	-47.8	179.8	0	0	0	0	0	112.5	L598 Y603 A650 R651 Y656 R657 Q658	L598-A654 HydrophobicContact CD1-CB 3.97Å; Y603-A654 HydrophobicContact CD1-CB 3.47Å; Y603-A654 VanDerWaalsContact CD1-CB 3.47Å; Y603-A654 HydrophobicContact CE1-CB 4.31Å; Y603-A654 HydrophobicContact CG-CB 4.14Å; A650-A654 VanDerWaalsContact O-CB 3.29Å; A650-A654 WeakPolarHBondContact O-CB 3.36Å; A650-A654 PolarHBondContact O-N 3.48Å; R651-A654 PolarHBondContact O-N 3.41Å; A654-Y656 VanDerWaalsContact C-N 3.29Å; A654-Y656 PolarHBondContact O-N 2.88Å; A654-R657 PolarHBondContact O-N 3.26Å; A654-Q658 WeakPolarHBondContact O-CG 3.2Å; A654-Q658 PolarHBondContact O-N 3.21Å
655	L	87.5	Confident	83.9	Confident	90 Å²	90	79.7 Å²	79.7	47%	0.471	36%	0.36	S	S	.	.	H	α-helix	trans	-63.4	-36.5	177.7	-72.6	175.4	0	0	0	112.1	R651 Q658 G659	R651-L655 HydrophobicContact CG-CD1 3.8Å; R651-L655 HydrophobicContact CG-CG 4.28Å; R651-L655 WeakPolarHBondContact O-CB 3.32Å; R651-L655 VanDerWaalsContact O-CG 3.31Å; R651-L655 WeakPolarHBondContact O-CG 3.38Å; R651-L655 PolarHBondContact O-N 2.66Å; L655-Q658 PolarHBondContact O-N 2.85Å; L655-G659 PolarHBondContact O-N 3.34Å
656	Y	84	Confident	83.4	Confident	65 Å²	65	78.3 Å²	78.3	26%	0.255	36%	0.362	S	S	.	.	H	α-helix	trans	-61.7	-49.8	174.3	-179.7	-103	0	0	0	111.6	E370 E652 V653 A654 Q658 G659 K660	E370-Y656 HydrophobicContact CB-CE1 4.45Å; E370-Y656 HydrophobicContact CB-CE2 4.23Å; E370-Y656 VanDerWaalsContact CB-OH 3.25Å; E370-Y656 WeakPolarHBondContact CB-OH 3.24Å; E370-Y656 WeakPolarHBondContact OE2-CE2 3.43Å; E370-Y656 PolarHBondContact OE2-OH 3.03Å; E652-Y656 WeakPolarHBondContact O-CB 3.37Å; E652-Y656 PolarHBondContact O-N 2.99Å; V653-Y656 WeakPolarHBondContact O-CB 3.35Å; V653-Y656 PolarHBondContact O-N 3.09Å; A654-Y656 VanDerWaalsContact C-N 3.29Å; A654-Y656 PolarHBondContact O-N 2.88Å; Y656-Q658 VanDerWaalsContact C-N 3.31Å; Y656-Q658 PolarHBondContact O-N 3.13Å; Y656-G659 PolarHBondContact O-N 3.42Å; Y656-K660 HydrophobicContact CE1-CD 4.39Å; Y656-K660 PolarHBondContact O-N 3.04Å
657	R	85.2	Confident	82.7	Confident	62 Å²	62	76.3 Å²	76.3	23%	0.234	36%	0.356	C	S	.	.	H	α-helix	trans	-58.6	-42.3	176.1	-71.2	177.4	173.5	-174.2	-4.5	111.8	E374 G600 F601 V653 A654 F661	E374-R657 WeakPolarHBondContact OE1-CG 3.39Å; E374-R657 IonicContact OE1-CZ 2.68Å; E374-R657 IonicContact OE1-NE 3.33Å; E374-R657 PolarHBondContact OE1-NE 3.39Å; E374-R657 IonicContact OE1-NH2 2.79Å; E374-R657 IonicContact OE2-CZ 2.92Å; E374-R657 IonicContact OE2-NE 3.73Å; E374-R657 PolarHBondContact OE2-NE 3.32Å; E374-R657 IonicContact OE2-NH2 3.77Å; E374-R657 PolarHBondContact OE2-NH2 3.45Å; G600-R657 WeakPolarHBondContact O-CD 3.25Å; G600-R657 PolarHBondContact O-NH1 3.39Å; G600-R657 VanDerWaalsContact O-NH1 3.07Å; F601-R657 HydrophobicContact CD1-CB 3.55Å; F601-R657 HydrophobicContact CE1-CB 3.78Å; F601-R657 WeakPolarHBondContact CE1-O 3.33Å; V653-R657 WeakPolarHBondContact O-CG 3.3Å; V653-R657 PolarHBondContact O-N 3.48Å; A654-R657 PolarHBondContact O-N 3.26Å; R657-F661 VanDerWaalsContact O-CB 3.28Å; R657-F661 WeakPolarHBondContact O-CB 3.39Å; R657-F661 PolarHBondContact O-N 3.38Å
658	Q	83.3	Confident	82	Confident	66 Å²	66	83.2 Å²	83.2	31%	0.308	38%	0.38	S	S	.	.	H	α-helix	trans	-62.6	-44.1	175.9	-72.5	-177.6	6.1	0	0	112.4	F601 A654 L655 Y656 F661 R662	F601-Q658 HydrophobicContact CB-CG 3.99Å; F601-Q658 HydrophobicContact CD1-CG 4.33Å; F601-Q658 PolarHBondContact O-NE2 2.83Å; A654-Q658 WeakPolarHBondContact O-CG 3.2Å; A654-Q658 PolarHBondContact O-N 3.21Å; L655-Q658 PolarHBondContact O-N 2.85Å; Y656-Q658 VanDerWaalsContact C-N 3.31Å; Y656-Q658 PolarHBondContact O-N 3.13Å; Q658-F661 PolarHBondContact O-N 3.23Å; Q658-R662 WeakPolarHBondContact O-CB 3.27Å; Q658-R662 PolarHBondContact O-N 3.42Å
659	G	82.5	Confident	81.2	Confident	32 Å²	32	79.9 Å²	79.9	33%	0.33	37%	0.366	S	S	.	.	H	α-helix	trans	-60.1	-52.2	177	0	0	0	0	0	111.9	L655 Y656 F661 R662 E663	L655-G659 PolarHBondContact O-N 3.34Å; Y656-G659 PolarHBondContact O-N 3.42Å; G659-F661 PolarHBondContact O-N 2.7Å; G659-R662 PolarHBondContact O-N 3.31Å; G659-E663 WeakPolarHBondContact O-CG 3.42Å; G659-E663 PolarHBondContact O-N 3.15Å
660	K	81.4	Confident	80.6	Confident	61 Å²	61	80 Å²	80	27%	0.265	37%	0.368	S	S	.	.	H	α-helix	trans	-58.6	-46	177.7	-172.9	179.5	-177.2	179.8	0	111.9	E314 Y656 R662 E663 V664	E314-K660 VanDerWaalsContact CD-NZ 3.31Å; E314-K660 IonicContact OE1-NZ 3.05Å; E314-K660 WeakPolarHBondContact OE2-CE 3.35Å; E314-K660 IonicContact OE2-NZ 3.93Å; E314-K660 PolarHBondContact OE2-NZ 3.46Å; Y656-K660 HydrophobicContact CE1-CD 4.39Å; Y656-K660 PolarHBondContact O-N 3.04Å; K660-R662 VanDerWaalsContact C-N 3.34Å; K660-R662 PolarHBondContact O-N 3.46Å; K660-E663 PolarHBondContact O-N 3.13Å; K660-V664 VanDerWaalsContact O-CG2 3.31Å; K660-V664 WeakPolarHBondContact O-CG2 3.45Å; K660-V664 PolarHBondContact O-N 3.36Å
661	F	81	Confident	79.9	Confident	112 Å²	112	86.4 Å²	86.4	49%	0.491	40%	0.396	S	S	.	.	H	α-helix	trans	-62.5	-40.7	178.3	-177.9	-101.7	0	0	0	112.2	F601 R657 Q658 G659 V664 K665	F601-F661 HydrophobicContact CE1-CB 3.74Å; F601-F661 HydrophobicContact CE1-CD2 4.44Å; F601-F661 HydrophobicContact CE1-CG 4.16Å; F601-F661 HydrophobicContact CZ-CB 4.06Å; F601-F661 AromaticContact CZ-CD2 3.89Å; F601-F661 HydrophobicContact CZ-CD2 3.89Å; F601-F661 AromaticContact CZ-CG 3.99Å; F601-F661 HydrophobicContact CZ-CG 3.99Å; R657-F661 VanDerWaalsContact O-CB 3.28Å; R657-F661 WeakPolarHBondContact O-CB 3.39Å; R657-F661 PolarHBondContact O-N 3.38Å; Q658-F661 PolarHBondContact O-N 3.23Å; G659-F661 PolarHBondContact O-N 2.7Å; F661-V664 PolarHBondContact O-N 2.84Å; F661-K665 HydrophobicContact CE1-CD 4.18Å; F661-K665 VanDerWaalsContact O-CB 3.27Å; F661-K665 WeakPolarHBondContact O-CB 3.44Å; F661-K665 PolarHBondContact O-N 3.44Å
662	R	78.2	Confident	79	Confident	198 Å²	198	84.4 Å²	84.4	75%	0.747	40%	0.395	S	S	*	.	H	α-helix	trans	-63.9	-42.1	177.7	-176.1	178.5	178.4	172.7	-0	112	Q658 G659 K660 K665 L666	Q658-R662 WeakPolarHBondContact O-CB 3.27Å; Q658-R662 PolarHBondContact O-N 3.42Å; G659-R662 PolarHBondContact O-N 3.31Å; K660-R662 VanDerWaalsContact C-N 3.34Å; K660-R662 PolarHBondContact O-N 3.46Å; R662-K665 PolarHBondContact O-N 3.47Å; R662-L666 WeakPolarHBondContact O-CB 3.39Å; R662-L666 PolarHBondContact O-N 2.89Å
663	E	78.5	Confident	78.3	Confident	100 Å²	100	85.4 Å²	85.4	47%	0.467	40%	0.398	S	S	.	.	H	α-helix	trans	-64.2	-47.7	177.2	-72.6	177.1	-172.4	0	0	111.7	G659 K660 K665 L666 A667	G659-E663 WeakPolarHBondContact O-CG 3.42Å; G659-E663 PolarHBondContact O-N 3.15Å; K660-E663 PolarHBondContact O-N 3.13Å; E663-K665 VanDerWaalsContact C-N 3.32Å; E663-K665 PolarHBondContact O-N 2.96Å; E663-L666 PolarHBondContact O-N 2.83Å; E663-A667 WeakPolarHBondContact O-CB 3.36Å; E663-A667 PolarHBondContact O-N 2.92Å
664	V	79.1	Confident	77.4	Confident	75 Å²	75	90.5 Å²	90.5	46%	0.455	42%	0.424	S	S	.	.	H	α-helix	trans	-60.8	-42.3	176.5	173.6	0	0	0	0	111	K660 F661 A667 R668	K660-V664 VanDerWaalsContact O-CG2 3.31Å; K660-V664 WeakPolarHBondContact O-CG2 3.45Å; K660-V664 PolarHBondContact O-N 3.36Å; F661-V664 PolarHBondContact O-N 2.84Å; V664-A667 PolarHBondContact O-N 3.45Å; V664-R668 WeakPolarHBondContact O-CB 3.43Å; V664-R668 PolarHBondContact O-N 2.95Å
665	K	76.2	Confident	76.5	Confident	114 Å²	114	95.6 Å²	95.6	50%	0.496	45%	0.448	S	S	.	.	H	α-helix	trans	-64	-42.8	177.3	-171.4	175.5	-177.3	176.8	0	111.8	F661 R662 E663 R668 Q669	F661-K665 HydrophobicContact CE1-CD 4.18Å; F661-K665 VanDerWaalsContact O-CB 3.27Å; F661-K665 WeakPolarHBondContact O-CB 3.44Å; F661-K665 PolarHBondContact O-N 3.44Å; R662-K665 PolarHBondContact O-N 3.47Å; E663-K665 VanDerWaalsContact C-N 3.32Å; E663-K665 PolarHBondContact O-N 2.96Å; K665-R668 PolarHBondContact O-N 3.38Å; K665-Q669 WeakPolarHBondContact O-CB 3.03Å; K665-Q669 VanDerWaalsContact O-CG 3.32Å; K665-Q669 WeakPolarHBondContact O-CG 3.38Å; K665-Q669 PolarHBondContact O-N 3.43Å
666	L	77	Confident	75.4	Confident	99 Å²	99	94.8 Å²	94.8	52%	0.518	44%	0.444	S	S	.	.	H	α-helix	trans	-64.9	-43.9	177.3	-170.2	77.9	0	0	0	111.4	R662 E663 Q669 Q670	R662-L666 WeakPolarHBondContact O-CB 3.39Å; R662-L666 PolarHBondContact O-N 2.89Å; E663-L666 PolarHBondContact O-N 2.83Å; L666-Q669 PolarHBondContact O-N 2.99Å; L666-Q670 WeakPolarHBondContact O-CG 3.47Å; L666-Q670 PolarHBondContact O-N 3.12Å
667	A	71.2	Confident	74.5	Confident	33 Å²	33	98.5 Å²	98.5	27%	0.273	47%	0.465	S	S	.	.	H	α-helix	trans	-61.8	-44.5	177.3	0	0	0	0	0	111.5	V348 E663 V664 Q670 K671	V348-A667 HydrophobicContact CB-CB 4.46Å; V348-A667 HydrophobicContact CG2-CB 4.27Å; E663-A667 WeakPolarHBondContact O-CB 3.36Å; E663-A667 PolarHBondContact O-N 2.92Å; V664-A667 PolarHBondContact O-N 3.45Å; A667-Q670 PolarHBondContact O-N 3.14Å; A667-K671 PolarHBondContact O-N 2.75Å; A667-K671 VanDerWaalsContact O-N 3.16Å
668	R	73.9	Confident	73.7	Confident	202 Å²	202	102.9 Å²	102.9	76%	0.762	49%	0.487	S	S	*	.	H	α-helix	trans	-64	-41.4	176	-168.9	173.6	-179.3	178.1	-0.5	112	V664 K665 K671 S672	V664-R668 WeakPolarHBondContact O-CB 3.43Å; V664-R668 PolarHBondContact O-N 2.95Å; K665-R668 PolarHBondContact O-N 3.38Å; R668-K671 PolarHBondContact O-N 3.43Å; R668-S672 PolarHBondContact O-N 3.06Å; R668-S672 PolarHBondContact O-OG 3.37Å
669	Q	71.4	Confident	72.8	Confident	84 Å²	84	101.4 Å²	101.4	39%	0.393	49%	0.485	S	S	.	.	H	α-helix	trans	-66.3	-35.7	176.7	-78.5	-175.6	-5.7	0	0	113.2	K665 L666 S672 K673	K665-Q669 WeakPolarHBondContact O-CB 3.03Å; K665-Q669 VanDerWaalsContact O-CG 3.32Å; K665-Q669 WeakPolarHBondContact O-CG 3.38Å; K665-Q669 PolarHBondContact O-N 3.43Å; L666-Q669 PolarHBondContact O-N 2.99Å; Q669-S672 WeakPolarHBondContact CA-OG 3.44Å; Q669-S672 PolarHBondContact O-OG 3.24Å; Q669-S672 VanDerWaalsContact O-OG 3.13Å; Q669-K673 WeakPolarHBondContact O-CB 3.23Å; Q669-K673 WeakPolarHBondContact O-CG 3.13Å; Q669-K673 PolarHBondContact O-N 2.91Å
670	Q	70.3	Confident	71.6	Confident	88 Å²	88	105.2 Å²	105.2	41%	0.411	50%	0.498	S	S	.	.	H	α-helix	trans	-66.2	-42.2	175.3	-74.6	178.2	2.2	0	0	111.4	L666 A667 K673 L674	L666-Q670 WeakPolarHBondContact O-CG 3.47Å; L666-Q670 PolarHBondContact O-N 3.12Å; A667-Q670 PolarHBondContact O-N 3.14Å; Q670-K673 PolarHBondContact O-N 3Å; Q670-L674 PolarHBondContact O-N 3.49Å
671	K	69.8	Low	70.8	Confident	135 Å²	135	110.5 Å²	110.5	59%	0.587	53%	0.526	S	S	*	.	H	α-helix	trans	-61.8	-47.9	174.7	-173.1	178.9	175.5	-176.2	0	111.4	A667 R668 K673 L674 E675	A667-K671 PolarHBondContact O-N 2.75Å; A667-K671 VanDerWaalsContact O-N 3.16Å; R668-K671 PolarHBondContact O-N 3.43Å; K671-K673 PolarHBondContact O-N 3.5Å; K671-L674 PolarHBondContact O-N 3.37Å; K671-E675 WeakPolarHBondContact CE-OE1 3.4Å; K671-E675 PolarHBondContact O-N 3.29Å; K671-E675 VanDerWaalsContact O-N 3.09Å
672	S	69.1	Low	69.7	Low	41 Å²	41	111 Å²	111	29%	0.287	54%	0.539	S	S	.	.	H	α-helix	trans	-68.5	-32.6	-179.6	70.7	0	0	0	0	113	R668 Q669 L674 E675 N676	R668-S672 PolarHBondContact O-N 3.06Å; R668-S672 PolarHBondContact O-OG 3.37Å; Q669-S672 WeakPolarHBondContact CA-OG 3.44Å; Q669-S672 PolarHBondContact O-OG 3.24Å; Q669-S672 VanDerWaalsContact O-OG 3.13Å; S672-L674 VanDerWaalsContact C-N 3.34Å; S672-E675 PolarHBondContact O-N 2.89Å; S672-N676 WeakPolarHBondContact O-CB 3.27Å; S672-N676 PolarHBondContact O-N 2.99Å; S672-N676 PolarHBondContact O-ND2 3.11Å; S672-N676 PolarHBondContact O-OD1 2.77Å
673	K	71.8	Confident	68.5	Low	136 Å²	136	107.3 Å²	107.3	59%	0.591	53%	0.529	S	S	*	.	H	α-helix	trans	-65.3	-36.6	175.6	-79.1	175.1	-176.6	-175.8	0	112.4	Q669 Q670 K671 M677	Q669-K673 WeakPolarHBondContact O-CB 3.23Å; Q669-K673 WeakPolarHBondContact O-CG 3.13Å; Q669-K673 PolarHBondContact O-N 2.91Å; Q670-K673 PolarHBondContact O-N 3Å; K671-K673 PolarHBondContact O-N 3.5Å; K673-M677 PolarHBondContact O-N 3.49Å
674	L	66.7	Low	67.5	Low	107 Å²	107	105.7 Å²	105.7	56%	0.56	54%	0.54	S	S	*	.	H	α-helix	trans	-70.5	-45.4	175	-70.2	171.6	0	0	0	111.2	Q670 K671 S672 N676 M677 F678	Q670-L674 PolarHBondContact O-N 3.49Å; K671-L674 PolarHBondContact O-N 3.37Å; S672-L674 VanDerWaalsContact C-N 3.34Å; L674-N676 VanDerWaalsContact C-N 3.33Å; L674-N676 PolarHBondContact O-N 3.32Å; L674-M677 WeakPolarHBondContact O-CB 3.34Å; L674-M677 PolarHBondContact O-N 3.03Å; L674-M677 VanDerWaalsContact O-N 3.17Å; L674-F678 WeakPolarHBondContact O-CD2 3.48Å; L674-F678 PolarHBondContact O-N 3.42Å
675	E	68.7	Low	66.9	Low	108 Å²	108	111 Å²	111	51%	0.505	56%	0.56	S	S	.	*	H	α-helix	trans	-58.9	-43.6	173.5	-76.7	173.4	-179.8	0	0	111.5	K671 S672 M677 F678 A679	K671-E675 WeakPolarHBondContact CE-OE1 3.4Å; K671-E675 PolarHBondContact O-N 3.29Å; K671-E675 VanDerWaalsContact O-N 3.09Å; S672-E675 PolarHBondContact O-N 2.89Å; E675-M677 VanDerWaalsContact C-N 3.34Å; E675-M677 PolarHBondContact O-N 3.39Å; E675-F678 PolarHBondContact O-N 2.95Å; E675-F678 VanDerWaalsContact O-N 3.13Å; E675-A679 PolarHBondContact O-N 3.47Å
676	N	64.7	Low	66.7	Low	73 Å²	73	107.8 Å²	107.8	39%	0.39	55%	0.55	S	S	.	.	H	α-helix	trans	-65.5	-33.7	175.9	-68.5	-4.2	0	0	0	112.4	S672 L674 F678 A679 N680	S672-N676 WeakPolarHBondContact O-CB 3.27Å; S672-N676 PolarHBondContact O-N 2.99Å; S672-N676 PolarHBondContact O-ND2 3.11Å; S672-N676 PolarHBondContact O-OD1 2.77Å; L674-N676 VanDerWaalsContact C-N 3.33Å; L674-N676 PolarHBondContact O-N 3.32Å; N676-F678 VanDerWaalsContact C-N 3.26Å; N676-F678 PolarHBondContact O-N 3.26Å; N676-A679 PolarHBondContact O-N 2.94Å; N676-N680 VanDerWaalsContact O-CB 3.25Å; N676-N680 WeakPolarHBondContact O-CB 3.37Å; N676-N680 PolarHBondContact O-N 3.4Å; N676-N680 PolarHBondContact O-OD1 3.28Å
677	M	64.6	Low	66.8	Low	143 Å²	143	107.6 Å²	107.6	70%	0.704	55%	0.546	S	S	*	.	H	α-helix	trans	-62.3	-35.2	172.8	-93.9	-177	167.8	0	0	112	K673 L674 E675	K673-M677 PolarHBondContact O-N 3.49Å; L674-M677 WeakPolarHBondContact O-CB 3.34Å; L674-M677 PolarHBondContact O-N 3.03Å; L674-M677 VanDerWaalsContact O-N 3.17Å; E675-M677 VanDerWaalsContact C-N 3.34Å; E675-M677 PolarHBondContact O-N 3.39Å
678	F	68.4	Low	67.5	Low	154 Å²	154	109.8 Å²	109.8	68%	0.675	55%	0.551	S	S	*	*	H	α-helix	trans	-75.4	-40.8	175.2	-69.7	-68.1	0	0	0	112.3	L674 E675 N676 M681 T682	L674-F678 WeakPolarHBondContact O-CD2 3.48Å; L674-F678 PolarHBondContact O-N 3.42Å; E675-F678 PolarHBondContact O-N 2.95Å; E675-F678 VanDerWaalsContact O-N 3.13Å; N676-F678 VanDerWaalsContact C-N 3.26Å; N676-F678 PolarHBondContact O-N 3.26Å; F678-M681 PolarHBondContact O-N 3Å; F678-T682 PolarHBondContact O-N 3.12Å; F678-T682 PolarHBondContact O-OG1 3.26Å
679	A	63.4	Low	68.2	Low	34 Å²	34	100.4 Å²	100.4	28%	0.281	52%	0.516	S	S	.	.	H	α-helix	trans	-61.5	-47.5	175.8	0	0	0	0	0	111.5	E675 N676 M681 T682 E683	E675-A679 PolarHBondContact O-N 3.47Å; N676-A679 PolarHBondContact O-N 2.94Å; A679-M681 PolarHBondContact O-N 3.26Å; A679-M681 VanDerWaalsContact O-N 3.11Å; A679-T682 PolarHBondContact O-N 3.44Å; A679-E683 PolarHBondContact O-N 3.44Å
680	N	58.8	Low	69.2	Low	112 Å²	112	98 Å²	98	60%	0.599	51%	0.505	S	S	*	.	H	α-helix	trans	-65	-16.4	-179.7	-66.6	11.4	0	0	0	114.2	N676	N676-N680 VanDerWaalsContact O-CB 3.25Å; N676-N680 WeakPolarHBondContact O-CB 3.37Å; N676-N680 PolarHBondContact O-N 3.4Å; N676-N680 PolarHBondContact O-OD1 3.28Å
681	M	63.7	Low	70.3	Confident	173 Å²	173	93.9 Å²	93.9	85%	0.852	49%	0.486	S	S	*	.	H	α-helix	trans	-88.7	-22.4	173.7	-174.6	173.7	159.2	0	0	112.3	F678 A679	F678-M681 PolarHBondContact O-N 3Å; A679-M681 PolarHBondContact O-N 3.26Å; A679-M681 VanDerWaalsContact O-N 3.11Å
682	T	59	Low	71.5	Confident	123 Å²	123	87.5 Å²	87.5	76%	0.755	46%	0.458	S	S	*	.	H	α-helix	trans	-95.7	-35.3	-174.9	-45.9	0	0	0	0	111.7	F678 A679	F678-T682 PolarHBondContact O-N 3.12Å; F678-T682 PolarHBondContact O-OG1 3.26Å; A679-T682 PolarHBondContact O-N 3.44Å
683	E	52.5	Low	72.7	Confident	119 Å²	119	85.5 Å²	85.5	56%	0.556	45%	0.445	S	S	*	.	S	Bend	trans	-92.5	145.9	180	-71.8	166.4	-177.5	0	0	110.5	A679 V686	A679-E683 PolarHBondContact O-N 3.44Å; E683-V686 HydrophobicContact CB-CG2 4.43Å
684	G	58.1	Low	73.8	Confident	67 Å²	67	80.2 Å²	80.2	69%	0.691	42%	0.422	S	S	*	.			trans	-61.6	-172.8	176.9	0	0	0	0	0	113.1	V686	G684-V686 VanDerWaalsContact C-N 3.32Å; G684-V686 PolarHBondContact O-N 3.13Å
685	E	65.1	Low	75.1	Confident	186 Å²	186	75.1 Å²	75.1	87%	0.869	40%	0.395	S	S	*	.			trans	-62.3	90.6	175.5	-69.6	-176.1	162.5	0	0	110.7
686	V	71.8	Confident	76.2	Confident	47 Å²	47	71 Å²	71	29%	0.285	38%	0.377	S	S	.	.	P	Polyproline II helix	trans	-76.3	125.9	170	-177.9	0	0	0	0	108	E683 G684 E688 K717	E683-V686 HydrophobicContact CB-CG2 4.43Å; G684-V686 VanDerWaalsContact C-N 3.32Å; G684-V686 PolarHBondContact O-N 3.13Å; V686-E688 PolarHBondContact O-N 3.25Å; V686-K717 HydrophobicContact CG1-CB 3.91Å
687	H	80.6	Confident	77.5	Confident	95 Å²	95	68 Å²	68	44%	0.44	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	118.5	175.4	-68.9	-63.3	0	0	0	109.7	E715 V716 K717	H687-E715 PolarHBondContact N-O 2.91Å; H687-V716 HydrophobicContact CB-CG2 4.37Å; H687-V716 CarbonylContact O-C 3.55Å; H687-V716 VanDerWaalsContact O-CA 3.31Å; H687-V716 WeakPolarHBondContact O-CA 3.33Å; H687-K717 PolarHBondContact O-N 3.19Å
688	E	85.4	Confident	78.7	Confident	79 Å²	79	63.1 Å²	63.1	37%	0.369	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	124.9	176	-64.4	-165.8	162.8	0	0	111.1	V686 K717 K719	V686-E688 PolarHBondContact O-N 3.25Å; E688-K717 CarbonylContact C-O 3.46Å; E688-K717 VanDerWaalsContact CA-O 3.3Å; E688-K717 WeakPolarHBondContact CA-O 3.45Å; E688-K719 IonicContact OE2-NZ 3.18Å; E688-K719 PolarHBondContact OE2-NZ 3.27Å
689	V	88.4	Confident	79.6	Confident	5 Å²	5	55.8 Å²	55.8	3%	0.03	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	106.9	167.8	-176.6	0	0	0	0	108.7	I691 V716 K717 K719 I742 M782 M785	V689-I691 HydrophobicContact CG1-CD1 4.25Å; V689-I691 HydrophobicContact CG1-CG1 4.03Å; V689-V716 HydrophobicContact CG2-CG1 3.95Å; V689-K717 PolarHBondContact N-O 3.48Å; V689-K719 PolarHBondContact O-N 3.26Å; V689-I742 HydrophobicContact CG1-CD1 4.23Å; V689-M782 HydrophobicContact CG2-CG 4.22Å; V689-M785 HydrophobicContact CG2-CE 3.94Å; V689-M785 HydrophobicContact CG2-SD 3.47Å; V689-M785 WeakPolarHBondContact CG2-SD 3.46Å
690	N	92.3	Very high	80.8	Confident	33 Å²	33	54.2 Å²	54.2	18%	0.176	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	127.4	178.1	-70.2	-28.3	0	0	0	110.5	K719 I721 S739 A741 I742	N690-K719 WeakPolarHBondContact CA-O 3.31Å; N690-I721 HydrophobicContact CB-CD1 3.53Å; N690-I721 HydrophobicContact CB-CG1 4.21Å; N690-I721 VanDerWaalsContact CG-CD1 3.49Å; N690-S739 PolarHBondContact ND2-O 3.44Å; N690-A741 HydrophobicContact CB-CB 3.69Å; N690-A741 CarbonylContact O-C 3.54Å; N690-A741 WeakPolarHBondContact O-CA 3.31Å; N690-A741 WeakPolarHBondContact O-CB 3.36Å; N690-I742 PolarHBondContact O-N 2.81Å
691	I	93.7	Very high	82.3	Confident	1 Å²	1	49.1 Å²	49.1	1%	0.005	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	135.3	-179	-58	-179.9	0	0	0	110	V689 L708 V718 K719 I720 I721 I742 V744 V778	V689-I691 HydrophobicContact CG1-CD1 4.25Å; V689-I691 HydrophobicContact CG1-CG1 4.03Å; I691-L708 HydrophobicContact CD1-CD1 4.15Å; I691-V718 HydrophobicContact CD1-CG1 3.64Å; I691-V718 HydrophobicContact CG1-CG1 4.33Å; I691-K719 PolarHBondContact N-O 2.93Å; I691-I720 CarbonylContact O-C 3.54Å; I691-I720 WeakPolarHBondContact O-CA 3.34Å; I691-I721 PolarHBondContact O-N 2.82Å; I691-I742 WeakPolarHBondContact CA-O 3.34Å; I691-V744 HydrophobicContact CG2-CB 4.21Å; I691-V744 HydrophobicContact CG2-CG2 3.76Å; I691-V778 HydrophobicContact CD1-CG1 4.15Å; I691-V778 HydrophobicContact CD1-CG2 4.23Å
692	V	95	Very high	83.5	Confident	1 Å²	1	43 Å²	43	1%	0.006	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	114	165.4	176.5	0	0	0	0	108	I721 G722 D732 L735 A736 A741 I742 V744	V692-I721 HydrophobicContact CG2-CB 4.49Å; V692-G722 WeakPolarHBondContact CA-O 3.38Å; V692-D732 HydrophobicContact CG1-CB 4.3Å; V692-L735 HydrophobicContact CG2-CD2 4.41Å; V692-A736 HydrophobicContact CG2-CB 4.03Å; V692-A741 HydrophobicContact CG2-CB 3.91Å; V692-I742 PolarHBondContact N-O 2.96Å; V692-V744 PolarHBondContact O-N 3.03Å
693	L	95	Very high	84.8	Confident	0 Å²	0	37.1 Å²	37.1	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	129	-174.3	179.4	65.8	0	0	0	111.1	V701 I704 G722 S723 G724 V744	L693-V701 HydrophobicContact CD2-CG1 4.24Å; L693-I704 HydrophobicContact CD1-CD1 4.27Å; L693-I704 HydrophobicContact CD1-CG2 3.95Å; L693-I704 HydrophobicContact CD2-CB 3.85Å; L693-I704 HydrophobicContact CD2-CG2 3.62Å; L693-I704 HydrophobicContact CG-CG2 4.46Å; L693-G722 PolarHBondContact N-O 3.26Å; L693-S723 WeakPolarHBondContact O-CA 3.32Å; L693-G724 PolarHBondContact O-N 2.97Å; L693-G724 VanDerWaalsContact O-N 3.14Å; L693-V744 HydrophobicContact CD1-CB 4.15Å; L693-V744 HydrophobicContact CD1-CG1 3.84Å
694	K	94.8	Very high	86.6	Confident	25 Å²	25	31.4 Å²	31.4	11%	0.109	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	133.2	166.8	-68.3	-68.4	176.7	154	0	110	G724 I728 D732 V744 G745 F746 V748	K694-G724 WeakPolarHBondContact CA-O 3.35Å; K694-I728 HydrophobicContact CB-CG1 3.84Å; K694-I728 HydrophobicContact CG-CG1 3.85Å; K694-D732 WeakPolarHBondContact CE-OD1 3.49Å; K694-D732 WeakPolarHBondContact CE-OD2 3.45Å; K694-D732 IonicContact NZ-OD1 2.63Å; K694-D732 PolarHBondContact NZ-OD1 2.91Å; K694-D732 IonicContact NZ-OD2 3.86Å; K694-D732 PolarHBondContact NZ-OD2 3.34Å; K694-V744 PolarHBondContact N-O 2.79Å; K694-G745 CarbonylContact O-C 3.6Å; K694-G745 WeakPolarHBondContact O-CA 3.42Å; K694-F746 PolarHBondContact O-N 3.25Å; K694-V748 HydrophobicContact CB-CG2 3.83Å; K694-V748 WeakPolarHBondContact O-CG2 3.23Å
695	A	92.8	Very high	88.2	Confident	0 Å²	0	29.7 Å²	29.7	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	166.6	174.2	0	0	0	0	0	111.5	V701 G724 V725 G726 F746 V748	A695-V701 HydrophobicContact CB-CG2 3.56Å; A695-G724 PolarHBondContact N-O 3.03Å; A695-V725 CarbonylContact O-C 3.5Å; A695-V725 WeakPolarHBondContact O-CA 3.27Å; A695-G726 PolarHBondContact O-N 3.36Å; A695-F746 WeakPolarHBondContact CA-O 3.49Å; A695-F746 HydrophobicContact CB-CB 3.9Å; A695-F746 HydrophobicContact CB-CD1 4.19Å; A695-F746 HydrophobicContact CB-CG 4.49Å; A695-V748 VanDerWaalsContact C-CG1 3.47Å
696	D	92	Very high	89.3	Confident	22 Å²	22	23.3 Å²	23.3	12%	0.118	12%	0.119	C	C	.	.	S	Bend	trans	-71.1	-44.5	178.4	55.5	-16.5	0	0	0	113.1	H427 F573 V725 F746 N747 V748	H427-D696 IonicContact CE1-OD1 3.73Å; H427-D696 IonicContact CE1-OD2 2.84Å; H427-D696 PolarHBondContact CE1-OD2 3.38Å; H427-D696 IonicContact NE2-OD2 3.78Å; H427-D696 PolarHBondContact NE2-OD2 3.09Å; H427-D696 VanDerWaalsContact NE2-OD2 3.12Å; F573-D696 VanDerWaalsContact CB-O 3.29Å; F573-D696 WeakPolarHBondContact CB-O 3.32Å; D696-V725 WeakPolarHBondContact O-CG1 3.4Å; D696-F746 PolarHBondContact N-O 3.17Å; D696-N747 HydrophobicContact CB-CB 4.07Å; D696-N747 WeakPolarHBondContact OD2-CB 3.16Å; D696-N747 PolarHBondContact OD2-ND2 2.7Å; D696-V748 HydrophobicContact CB-CG1 3.99Å
697	V	91.7	Very high	90	Very high	9 Å²	9	21.6 Å²	21.6	6%	0.055	11%	0.11	C	C	.	.	B	Isolated β-bridge	trans	-117.9	152.7	179.1	-49.7	0	0	0	0	111.3	H427 S572 F573 G699 S700	H427-V697 WeakPolarHBondContact ND1-CG2 3.47Å; S572-V697 WeakPolarHBondContact O-CA 3.35Å; F573-V697 HydrophobicContact CB-CB 4.48Å; F573-V697 HydrophobicContact CB-CG1 4.06Å; V697-G699 VanDerWaalsContact C-N 3.26Å; V697-G699 PolarHBondContact O-N 2.95Å; V697-S700 VanDerWaalsContact CG2-OG 3.22Å; V697-S700 WeakPolarHBondContact CG2-OG 3.47Å; V697-S700 PolarHBondContact O-N 2.69Å
698	Q	90.7	Very high	90.3	Very high	41 Å²	41	17 Å²	17	19%	0.192	9%	0.089	C	C	.	.	H	α-helix	trans	-59.5	-37.1	177.6	-180	59.5	21.7	0	0	112.5	S572 A637 S700 V701 E702 V725	S572-Q698 PolarHBondContact O-N 3.03Å; S572-Q698 VanDerWaalsContact OG-CB 3.26Å; S572-Q698 WeakPolarHBondContact OG-CB 3.19Å; A637-Q698 HydrophobicContact CB-CG 4.17Å; Q698-S700 PolarHBondContact O-N 2.99Å; Q698-V701 WeakPolarHBondContact O-CB 3.49Å; Q698-V701 PolarHBondContact O-N 2.8Å; Q698-E702 PolarHBondContact NE2-OE1 3.15Å; Q698-E702 PolarHBondContact O-N 2.98Å; Q698-V725 HydrophobicContact CB-CG2 3.97Å
699	G	87.2	Confident	90.4	Very high	0 Å²	0	17.7 Å²	17.7	0%	0	9%	0.094	C	C	.	.	H	α-helix	trans	-61.6	-41.6	179.9	0	0	0	0	0	113.6	M454 V697 V701 E702 A703	M454-G699 VanDerWaalsContact CE-CA 3.44Å; M454-G699 WeakPolarHBondContact CE-O 3.39Å; V697-G699 VanDerWaalsContact C-N 3.26Å; V697-G699 PolarHBondContact O-N 2.95Å; G699-V701 VanDerWaalsContact C-N 3.31Å; G699-V701 PolarHBondContact O-N 2.91Å; G699-E702 PolarHBondContact O-N 3.47Å; G699-A703 PolarHBondContact O-N 2.87Å
700	S	88	Confident	90.3	Very high	0 Å²	0	23.5 Å²	23.5	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-63.4	-38.7	177.6	-62	0	0	0	0	111.3	V697 Q698 E702 A703 I704 F746	V697-S700 VanDerWaalsContact CG2-OG 3.22Å; V697-S700 WeakPolarHBondContact CG2-OG 3.47Å; V697-S700 PolarHBondContact O-N 2.69Å; Q698-S700 PolarHBondContact O-N 2.99Å; S700-E702 VanDerWaalsContact C-N 3.32Å; S700-E702 PolarHBondContact O-N 3.3Å; S700-A703 PolarHBondContact O-N 2.97Å; S700-I704 WeakPolarHBondContact O-CB 3.39Å; S700-I704 WeakPolarHBondContact O-CD1 3.36Å; S700-I704 WeakPolarHBondContact O-CG1 3.43Å; S700-I704 PolarHBondContact O-N 3.1Å; S700-F746 WeakPolarHBondContact OG-CE1 3.4Å
701	V	91.2	Very high	89.9	Confident	5 Å²	5	23.3 Å²	23.3	3%	0.03	12%	0.118	C	C	.	.	H	α-helix	trans	-59	-46.3	175.9	-178.4	0	0	0	0	110.6	L693 A695 Q698 G699 S705 V725	L693-V701 HydrophobicContact CD2-CG1 4.24Å; A695-V701 HydrophobicContact CB-CG2 3.56Å; Q698-V701 WeakPolarHBondContact O-CB 3.49Å; Q698-V701 PolarHBondContact O-N 2.8Å; G699-V701 VanDerWaalsContact C-N 3.31Å; G699-V701 PolarHBondContact O-N 2.91Å; V701-S705 WeakPolarHBondContact O-CB 3.47Å; V701-S705 PolarHBondContact O-N 2.88Å; V701-S705 PolarHBondContact O-OG 2.91Å; V701-S705 VanDerWaalsContact O-OG 3.09Å; V701-V725 HydrophobicContact CG2-CG2 4.03Å
702	E	88.7	Confident	89.3	Confident	44 Å²	44	25.6 Å²	25.6	21%	0.206	13%	0.134	C	C	.	.	H	α-helix	trans	-64.4	-49.1	179.7	-69.2	171.1	-172.7	0	0	111.5	R457 Q698 G699 S700 I704 S705 D706	R457-E702 IonicContact CZ-OE2 3.69Å; R457-E702 IonicContact NH1-OE2 3.48Å; R457-E702 IonicContact NH2-OE1 3.09Å; R457-E702 IonicContact NH2-OE2 2.66Å; R457-E702 PolarHBondContact NH2-OE2 2.95Å; Q698-E702 PolarHBondContact NE2-OE1 3.15Å; Q698-E702 PolarHBondContact O-N 2.98Å; G699-E702 PolarHBondContact O-N 3.47Å; S700-E702 VanDerWaalsContact C-N 3.32Å; S700-E702 PolarHBondContact O-N 3.3Å; E702-I704 PolarHBondContact O-N 2.67Å; E702-S705 WeakPolarHBondContact CA-OG 3.46Å; E702-S705 PolarHBondContact O-N 3.04Å; E702-S705 PolarHBondContact O-OG 2.68Å; E702-D706 PolarHBondContact O-N 2.89Å
703	A	86.9	Confident	88.5	Confident	0 Å²	0	28.1 Å²	28.1	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-61.5	-45.2	-179.2	0	0	0	0	0	112.7	F451 M454 G699 S700 S707 I771	F451-A703 HydrophobicContact CD1-CB 3.73Å; F451-A703 HydrophobicContact CE1-CB 4.13Å; F451-A703 HydrophobicContact CG-CB 4.4Å; M454-A703 HydrophobicContact CE-CB 4.42Å; G699-A703 PolarHBondContact O-N 2.87Å; S700-A703 PolarHBondContact O-N 2.97Å; A703-S707 WeakPolarHBondContact O-CB 3.43Å; A703-S707 PolarHBondContact O-N 3.04Å; A703-S707 VanDerWaalsContact O-N 3.1Å; A703-S707 PolarHBondContact O-OG 3.03Å; A703-I771 HydrophobicContact CB-CD1 4.31Å
704	I	90.3	Very high	87.5	Confident	0 Å²	0	35.6 Å²	35.6	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-66.9	-41.7	176.9	-64.3	165.5	0	0	0	109.8	L693 S700 E702 D706 S707 L708 F746 I771 L774	L693-I704 HydrophobicContact CD1-CD1 4.27Å; L693-I704 HydrophobicContact CD1-CG2 3.95Å; L693-I704 HydrophobicContact CD2-CB 3.85Å; L693-I704 HydrophobicContact CD2-CG2 3.62Å; L693-I704 HydrophobicContact CG-CG2 4.46Å; S700-I704 WeakPolarHBondContact O-CB 3.39Å; S700-I704 WeakPolarHBondContact O-CD1 3.36Å; S700-I704 WeakPolarHBondContact O-CG1 3.43Å; S700-I704 PolarHBondContact O-N 3.1Å; E702-I704 PolarHBondContact O-N 2.67Å; I704-D706 PolarHBondContact O-N 2.82Å; I704-S707 PolarHBondContact O-N 3.08Å; I704-L708 HydrophobicContact CG2-CD1 3.67Å; I704-L708 HydrophobicContact CG2-CG 4.03Å; I704-L708 WeakPolarHBondContact O-CB 3.4Å; I704-L708 VanDerWaalsContact O-CG 3.26Å; I704-L708 WeakPolarHBondContact O-CG 3.43Å; I704-L708 PolarHBondContact O-N 3.25Å; I704-F746 HydrophobicContact CD1-CB 3.81Å; I704-F746 HydrophobicContact CD1-CD1 4.14Å; I704-F746 HydrophobicContact CD1-CD2 3.71Å; I704-F746 HydrophobicContact CD1-CE2 4.26Å; I704-F746 HydrophobicContact CD1-CG 3.61Å; I704-I771 HydrophobicContact CD1-CG1 4.41Å; I704-I771 HydrophobicContact CG1-CD1 4Å; I704-I771 HydrophobicContact CG1-CG1 4.07Å; I704-I771 HydrophobicContact CG1-CG2 4.13Å; I704-L774 HydrophobicContact CD1-CD1 4.04Å; I704-L774 HydrophobicContact CG1-CD1 4.48Å; I704-L774 HydrophobicContact CG2-CD1 3.98Å; I704-L774 HydrophobicContact CG2-CD2 3.97Å
705	S	90.1	Very high	86.7	Confident	30 Å²	30	38.7 Å²	38.7	21%	0.21	20%	0.204	C	C	.	.	H	α-helix	trans	-62.9	-43.7	-179.2	70.5	0	0	0	0	112.9	V701 E702 L709	V701-S705 WeakPolarHBondContact O-CB 3.47Å; V701-S705 PolarHBondContact O-N 2.88Å; V701-S705 PolarHBondContact O-OG 2.91Å; V701-S705 VanDerWaalsContact O-OG 3.09Å; E702-S705 WeakPolarHBondContact CA-OG 3.46Å; E702-S705 PolarHBondContact O-N 3.04Å; E702-S705 PolarHBondContact O-OG 2.68Å; S705-L709 WeakPolarHBondContact O-CB 3.48Å; S705-L709 WeakPolarHBondContact O-CG 3.26Å; S705-L709 PolarHBondContact O-N 2.86Å
706	D	88	Confident	86.2	Confident	52 Å²	52	38.7 Å²	38.7	28%	0.278	20%	0.204	S	C	.	.	H	α-helix	trans	-66.7	-40.9	178	-173.5	46	0	0	0	111.3	E702 I704 L709 K710	E702-D706 PolarHBondContact O-N 2.89Å; I704-D706 PolarHBondContact O-N 2.82Å; D706-L709 PolarHBondContact O-N 3.47Å; D706-K710 WeakPolarHBondContact O-CG 3.19Å; D706-K710 PolarHBondContact O-N 2.92Å; D706-K710 IonicContact OD1-NZ 2.69Å; D706-K710 VanDerWaalsContact OD2-CE 3.25Å; D706-K710 WeakPolarHBondContact OD2-CE 3.41Å; D706-K710 IonicContact OD2-NZ 3.79Å; D706-K710 PolarHBondContact OD2-NZ 2.95Å
707	S	86.6	Confident	85.9	Confident	11 Å²	11	42 Å²	42	8%	0.077	22%	0.218	C	C	.	.	H	α-helix	trans	-66.3	-41.9	177.9	-58	0	0	0	0	112.6	A450 A703 I704 L709 K710 L711	A450-S707 VanDerWaalsContact CB-OG 3.3Å; A450-S707 WeakPolarHBondContact CB-OG 3.44Å; A703-S707 WeakPolarHBondContact O-CB 3.43Å; A703-S707 PolarHBondContact O-N 3.04Å; A703-S707 VanDerWaalsContact O-N 3.1Å; A703-S707 PolarHBondContact O-OG 3.03Å; I704-S707 PolarHBondContact O-N 3.08Å; S707-L709 VanDerWaalsContact C-N 3.35Å; S707-K710 PolarHBondContact O-N 3.31Å; S707-L711 WeakPolarHBondContact O-CG 3.3Å; S707-L711 PolarHBondContact O-N 2.95Å
708	L	88.1	Confident	85.8	Confident	0 Å²	0	41.8 Å²	41.8	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-67.5	-34.8	176.5	-73.2	178.3	0	0	0	112.4	I691 I704 L711 V718 I720 L774 V778	I691-L708 HydrophobicContact CD1-CD1 4.15Å; I704-L708 HydrophobicContact CG2-CD1 3.67Å; I704-L708 HydrophobicContact CG2-CG 4.03Å; I704-L708 WeakPolarHBondContact O-CB 3.4Å; I704-L708 VanDerWaalsContact O-CG 3.26Å; I704-L708 WeakPolarHBondContact O-CG 3.43Å; I704-L708 PolarHBondContact O-N 3.25Å; L708-L711 HydrophobicContact CD2-CD1 4.37Å; L708-L711 PolarHBondContact O-N 3.47Å; L708-V718 HydrophobicContact CB-CG1 4.2Å; L708-I720 HydrophobicContact CB-CD1 4.35Å; L708-I720 HydrophobicContact CD1-CD1 4.26Å; L708-L774 HydrophobicContact CD1-CD2 4.33Å; L708-L774 HydrophobicContact CD2-CD2 3.96Å; L708-L774 HydrophobicContact CG-CD2 4.37Å; L708-V778 HydrophobicContact CD2-CB 4.12Å; L708-V778 HydrophobicContact CD2-CG1 3.87Å; L708-V778 HydrophobicContact CD2-CG2 4.14Å
709	L	87	Confident	85.7	Confident	92 Å²	92	44.3 Å²	44.3	48%	0.482	23%	0.227	S	C	.	.	H	α-helix	trans	-70.3	-36.4	175.1	-72.6	169.5	0	0	0	111.9	S705 D706 S707 L711 S712	S705-L709 WeakPolarHBondContact O-CB 3.48Å; S705-L709 WeakPolarHBondContact O-CG 3.26Å; S705-L709 PolarHBondContact O-N 2.86Å; D706-L709 PolarHBondContact O-N 3.47Å; S707-L709 VanDerWaalsContact C-N 3.35Å; L709-L711 PolarHBondContact O-N 2.94Å; L709-S712 PolarHBondContact O-N 3.3Å; L709-S712 PolarHBondContact O-OG 3.48Å
710	K	85.3	Confident	85.9	Confident	127 Å²	127	46.2 Å²	46.2	55%	0.552	24%	0.236	S	C	*	.	H	α-helix	trans	-64.7	-23.4	174.3	-75.7	166.3	177.2	165	0	113.5	D706 S707	D706-K710 WeakPolarHBondContact O-CG 3.19Å; D706-K710 PolarHBondContact O-N 2.92Å; D706-K710 IonicContact OD1-NZ 2.69Å; D706-K710 VanDerWaalsContact OD2-CE 3.25Å; D706-K710 WeakPolarHBondContact OD2-CE 3.41Å; D706-K710 IonicContact OD2-NZ 3.79Å; D706-K710 PolarHBondContact OD2-NZ 2.95Å; S707-K710 PolarHBondContact O-N 3.31Å
711	L	83.9	Confident	86	Confident	29 Å²	29	49 Å²	49	15%	0.152	25%	0.25	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.7	-12.2	177.9	-77.2	179.3	0	0	0	114	S707 L708 L709 T713 I775 M782	S707-L711 WeakPolarHBondContact O-CG 3.3Å; S707-L711 PolarHBondContact O-N 2.95Å; L708-L711 HydrophobicContact CD2-CD1 4.37Å; L708-L711 PolarHBondContact O-N 3.47Å; L709-L711 PolarHBondContact O-N 2.94Å; L711-T713 PolarHBondContact O-N 3.49Å; L711-I775 HydrophobicContact CD1-CG2 3.78Å; L711-M782 HydrophobicContact CB-CE 3.74Å; L711-M782 HydrophobicContact CD1-CE 4.18Å; L711-M782 HydrophobicContact CG-CE 4.4Å
712	S	81.7	Confident	85.9	Confident	49 Å²	49	49.6 Å²	49.6	34%	0.343	26%	0.258	S	S	.	.			trans	-66.7	129.7	-179.3	64.1	0	0	0	0	111.4	L709	L709-S712 PolarHBondContact O-N 3.3Å; L709-S712 PolarHBondContact O-OG 3.48Å
713	T	79.5	Confident	86	Confident	55 Å²	55	51.1 Å²	51.1	34%	0.337	27%	0.273	S	S	.	.			trans	-108.4	170.9	173.3	61	0	0	0	0	110.2	L711 E715 V716	L711-T713 PolarHBondContact O-N 3.49Å; T713-E715 PolarHBondContact O-N 2.82Å; T713-V716 PolarHBondContact N-O 2.93Å; T713-V716 CarbonylContact O-C 3.58Å; T713-V716 PolarHBondContact O-N 3.37Å; T713-V716 VanDerWaalsContact O-O 3.08Å; T713-V716 PolarHBondContact OG1-N 2.99Å; T713-V716 PolarHBondContact OG1-O 3.43Å
714	D	74.1	Confident	86.3	Confident	157 Å²	157	51.8 Å²	51.8	84%	0.84	28%	0.281	S	S	*	.	S	Bend	trans	-64	-29.5	179.2	-60.7	-26.9	0	0	0	112.3
715	E	77.2	Confident	86.4	Confident	89 Å²	89	52.7 Å²	52.7	42%	0.416	29%	0.286	S	S	.	.	S	Bend	trans	-86.7	-34.9	178.3	-65.9	-177.1	-174	0	0	112.9	H687 T713 L786 R887	H687-E715 PolarHBondContact N-O 2.91Å; T713-E715 PolarHBondContact O-N 2.82Å; E715-L786 HydrophobicContact CB-CD2 4.02Å; E715-L786 VanDerWaalsContact OE2-CD2 3.26Å; E715-L786 WeakPolarHBondContact OE2-CD2 3.41Å; E715-R887 IonicContact OE1-NH1 3.54Å; E715-R887 IonicContact OE2-NH1 3.96Å
716	V	82.7	Confident	86.5	Confident	0 Å²	0	51.4 Å²	51.4	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	114.2	-177.4	-174.5	0	0	0	0	110.9	H687 V689 T713 M782 M785 L786	H687-V716 HydrophobicContact CB-CG2 4.37Å; H687-V716 CarbonylContact O-C 3.55Å; H687-V716 VanDerWaalsContact O-CA 3.31Å; H687-V716 WeakPolarHBondContact O-CA 3.33Å; V689-V716 HydrophobicContact CG2-CG1 3.95Å; T713-V716 PolarHBondContact N-O 2.93Å; T713-V716 CarbonylContact O-C 3.58Å; T713-V716 PolarHBondContact O-N 3.37Å; T713-V716 VanDerWaalsContact O-O 3.08Å; T713-V716 PolarHBondContact OG1-N 2.99Å; T713-V716 PolarHBondContact OG1-O 3.43Å; V716-M782 HydrophobicContact CG1-CB 4.04Å; V716-M782 HydrophobicContact CG1-CG 3.76Å; V716-M782 HydrophobicContact CG1-SD 3.88Å; V716-M785 HydrophobicContact CG2-CB 4.46Å; V716-L786 HydrophobicContact CG2-CD2 3.67Å; V716-L786 HydrophobicContact CG2-CG 4.16Å
717	K	85.4	Confident	86.7	Confident	93 Å²	93	49.6 Å²	49.6	40%	0.404	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	119.3	-177.7	-168	170.9	-170.6	165.1	0	111.5	V686 H687 E688 V689	V686-K717 HydrophobicContact CG1-CB 3.91Å; H687-K717 PolarHBondContact O-N 3.19Å; E688-K717 CarbonylContact C-O 3.46Å; E688-K717 VanDerWaalsContact CA-O 3.3Å; E688-K717 WeakPolarHBondContact CA-O 3.45Å; V689-K717 PolarHBondContact N-O 3.48Å
718	V	89.1	Confident	87.1	Confident	4 Å²	4	49.1 Å²	49.1	2%	0.024	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	127.6	172.3	-174.8	0	0	0	0	109.8	I691 L708 M782	I691-V718 HydrophobicContact CD1-CG1 3.64Å; I691-V718 HydrophobicContact CG1-CG1 4.33Å; L708-V718 HydrophobicContact CB-CG1 4.2Å; V718-M782 HydrophobicContact CG2-CE 4.32Å; V718-M782 HydrophobicContact CG2-CG 4.34Å; V718-M782 HydrophobicContact CG2-SD 3.3Å; V718-M782 WeakPolarHBondContact CG2-SD 3.27Å
719	K	89.3	Confident	87.3	Confident	94 Å²	94	51.5 Å²	51.5	41%	0.409	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	117.1	-179.3	-171.2	177.9	-175.5	175.5	0	111	E688 V689 N690 I691 I721	E688-K719 IonicContact OE2-NZ 3.18Å; E688-K719 PolarHBondContact OE2-NZ 3.27Å; V689-K719 PolarHBondContact O-N 3.26Å; N690-K719 WeakPolarHBondContact CA-O 3.31Å; I691-K719 PolarHBondContact N-O 2.93Å; K719-I721 PolarHBondContact O-N 2.98Å
720	I	91.5	Very high	87.6	Confident	39 Å²	39	51.7 Å²	51.7	20%	0.2	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	106.9	175.1	-57	171.2	0	0	0	107.9	I691 L708	I691-I720 CarbonylContact O-C 3.54Å; I691-I720 WeakPolarHBondContact O-CA 3.34Å; L708-I720 HydrophobicContact CB-CD1 4.35Å; L708-I720 HydrophobicContact CD1-CD1 4.26Å
721	I	89.6	Confident	87.9	Confident	58 Å²	58	50.5 Å²	50.5	30%	0.297	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	-40.2	-176.8	-63.5	-173.1	0	0	0	110.8	N690 I691 V692 K719 L735 S739 A741	N690-I721 HydrophobicContact CB-CD1 3.53Å; N690-I721 HydrophobicContact CB-CG1 4.21Å; N690-I721 VanDerWaalsContact CG-CD1 3.49Å; I691-I721 PolarHBondContact O-N 2.82Å; V692-I721 HydrophobicContact CG2-CB 4.49Å; K719-I721 PolarHBondContact O-N 2.98Å; I721-L735 HydrophobicContact CG2-CD1 4.1Å; I721-L735 HydrophobicContact CG2-CD2 4.15Å; I721-L735 HydrophobicContact CG2-CG 4.09Å; I721-S739 WeakPolarHBondContact CD1-OG 3.38Å; I721-A741 HydrophobicContact CD1-CB 4.27Å
722	G	89.5	Confident	88.4	Confident	18 Å²	18	49.9 Å²	49.9	19%	0.186	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	134.8	176.5	0	0	0	0	0	109.7	V692 L693	V692-G722 WeakPolarHBondContact CA-O 3.38Å; L693-G722 PolarHBondContact N-O 3.26Å
723	S	91	Very high	89	Confident	76 Å²	76	47.6 Å²	47.6	53%	0.531	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	141.4	169.9	60.3	0	0	0	0	109.2	L693	L693-S723 WeakPolarHBondContact O-CA 3.32Å
724	G	91.8	Very high	89.6	Confident	15 Å²	15	48.1 Å²	48.1	16%	0.155	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-168.6	169.5	177.5	0	0	0	0	0	113.3	L693 K694 A695	L693-G724 PolarHBondContact O-N 2.97Å; L693-G724 VanDerWaalsContact O-N 3.14Å; K694-G724 WeakPolarHBondContact CA-O 3.35Å; A695-G724 PolarHBondContact N-O 3.03Å
725	V	92.4	Very high	90.5	Very high	19 Å²	19	43.9 Å²	43.9	12%	0.115	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	139.8	-177.8	-174.6	0	0	0	0	110.2	L574 V634 A695 D696 Q698 V701	L574-V725 HydrophobicContact CB-CG1 4.23Å; V634-V725 HydrophobicContact CG1-CB 4.31Å; V634-V725 HydrophobicContact CG1-CG1 4.37Å; V634-V725 HydrophobicContact CG1-CG2 4.29Å; A695-V725 CarbonylContact O-C 3.5Å; A695-V725 WeakPolarHBondContact O-CA 3.27Å; D696-V725 WeakPolarHBondContact O-CG1 3.4Å; Q698-V725 HydrophobicContact CB-CG2 3.97Å; V701-V725 HydrophobicContact CG2-CG2 4.03Å
726	G	92.4	Very high	91.2	Very high	3 Å²	3	39.6 Å²	39.6	3%	0.031	23%	0.225	C	C	.	.	S	Bend	trans	104.4	-171.5	178.8	0	0	0	0	0	114.4	A695 V748	A695-G726 PolarHBondContact O-N 3.36Å; G726-V748 WeakPolarHBondContact O-CG1 3.48Å
727	G	92.2	Very high	91.7	Very high	14 Å²	14	40.9 Å²	40.9	14%	0.144	24%	0.236	C	C	.	.	S	Bend	trans	-60	156.1	-179.1	0	0	0	0	0	113.7	T729	G727-T729 PolarHBondContact O-N 3.1Å
728	I	94.6	Very high	92	Very high	1 Å²	1	40.8 Å²	40.8	1%	0.005	25%	0.252	C	S	.	.	B	Isolated β-bridge	trans	-76.2	118.3	175	-59.8	165.2	0	0	0	108.4	K694 D732 L743 R749 A750 D751 A754 L765 Y767	K694-I728 HydrophobicContact CB-CG1 3.84Å; K694-I728 HydrophobicContact CG-CG1 3.85Å; I728-D732 HydrophobicContact CG2-CB 4.25Å; I728-L743 HydrophobicContact CG2-CD2 3.57Å; I728-R749 PolarHBondContact N-O 2.83Å; I728-A750 HydrophobicContact CB-CB 3.98Å; I728-A750 HydrophobicContact CD1-CB 4.46Å; I728-A750 HydrophobicContact CG2-CB 4.3Å; I728-D751 PolarHBondContact O-N 3.13Å; I728-A754 HydrophobicContact CG2-CB 4.4Å; I728-A754 VanDerWaalsContact O-CB 3.27Å; I728-A754 WeakPolarHBondContact O-CB 3.34Å; I728-L765 HydrophobicContact CD1-CD1 3.47Å; I728-L765 VanDerWaalsContact CD1-CD1 3.47Å; I728-Y767 HydrophobicContact CD1-CE1 4.12Å
729	T	92.7	Very high	91.9	Very high	49 Å²	49	42 Å²	42	30%	0.301	26%	0.26	S	S	.	.	P	Polyproline II helix	trans	-97.7	170.1	-177.1	70.8	0	0	0	0	112.1	G727 T731 D732 A733	G727-T729 PolarHBondContact O-N 3.1Å; T729-T731 VanDerWaalsContact C-N 3.31Å; T729-T731 PolarHBondContact O-N 2.84Å; T729-D732 WeakPolarHBondContact CB-OD2 3.35Å; T729-D732 PolarHBondContact N-OD2 3.47Å; T729-D732 PolarHBondContact O-N 3Å; T729-D732 VanDerWaalsContact OG1-CG 3.27Å; T729-D732 PolarHBondContact OG1-OD2 3.41Å; T729-A733 PolarHBondContact O-N 2.94Å
730	E	93.4	Very high	91.8	Very high	97 Å²	97	44.5 Å²	44.5	45%	0.453	28%	0.278	S	S	.	.	H	α-helix	trans	-59.9	-40.4	175.7	-173.7	176.5	166	0	0	112.1	D732 A733 T734 V757	E730-D732 PolarHBondContact O-N 3.39Å; E730-A733 PolarHBondContact O-N 2.96Å; E730-A733 VanDerWaalsContact O-N 3.15Å; E730-T734 WeakPolarHBondContact O-CG2 3.48Å; E730-T734 PolarHBondContact O-N 3.04Å; E730-T734 PolarHBondContact O-OG1 3.33Å; E730-V757 HydrophobicContact CG-CG2 4Å
731	T	93.1	Very high	91.8	Very high	101 Å²	101	42.9 Å²	42.9	62%	0.62	27%	0.271	S	S	*	.	H	α-helix	trans	-58.1	-38.6	176.7	-49.7	0	0	0	0	111.5	T729 T734 L735	T729-T731 VanDerWaalsContact C-N 3.31Å; T729-T731 PolarHBondContact O-N 2.84Å; T731-T734 WeakPolarHBondContact CA-OG1 3.38Å; T731-T734 PolarHBondContact O-N 2.83Å; T731-T734 PolarHBondContact O-OG1 2.92Å; T731-L735 WeakPolarHBondContact O-CB 3.32Å; T731-L735 PolarHBondContact O-N 3.37Å
732	D	94.1	Very high	91.9	Very high	17 Å²	17	41.6 Å²	41.6	9%	0.091	26%	0.264	C	S	.	.	H	α-helix	trans	-71	-39.5	179.1	-52.2	-55.1	0	0	0	111.7	V692 K694 I728 T729 E730 L735 A736	V692-D732 HydrophobicContact CG1-CB 4.3Å; K694-D732 WeakPolarHBondContact CE-OD1 3.49Å; K694-D732 WeakPolarHBondContact CE-OD2 3.45Å; K694-D732 IonicContact NZ-OD1 2.63Å; K694-D732 PolarHBondContact NZ-OD1 2.91Å; K694-D732 IonicContact NZ-OD2 3.86Å; K694-D732 PolarHBondContact NZ-OD2 3.34Å; I728-D732 HydrophobicContact CG2-CB 4.25Å; T729-D732 WeakPolarHBondContact CB-OD2 3.35Å; T729-D732 PolarHBondContact N-OD2 3.47Å; T729-D732 PolarHBondContact O-N 3Å; T729-D732 VanDerWaalsContact OG1-CG 3.27Å; T729-D732 PolarHBondContact OG1-OD2 3.41Å; E730-D732 PolarHBondContact O-N 3.39Å; D732-L735 PolarHBondContact O-N 2.85Å; D732-A736 WeakPolarHBondContact O-CB 3.46Å; D732-A736 PolarHBondContact O-N 2.96Å
733	A	93.8	Very high	92.1	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-63.5	-43	174	0	0	0	0	0	111.5	T729 E730 A736 A737 V757 I758 L763	T729-A733 PolarHBondContact O-N 2.94Å; E730-A733 PolarHBondContact O-N 2.96Å; E730-A733 VanDerWaalsContact O-N 3.15Å; A733-A736 PolarHBondContact O-N 2.95Å; A733-A737 PolarHBondContact O-N 3.09Å; A733-V757 HydrophobicContact CB-CB 4.08Å; A733-V757 HydrophobicContact CB-CG1 3.92Å; A733-I758 HydrophobicContact CB-CG1 4.01Å; A733-L763 HydrophobicContact CB-CD1 4.24Å; A733-L763 VanDerWaalsContact O-CD1 3.25Å; A733-L763 WeakPolarHBondContact O-CD1 3.44Å
734	T	93	Very high	92.3	Very high	66 Å²	66	37.2 Å²	37.2	41%	0.405	23%	0.231	S	C	.	.	H	α-helix	trans	-66.3	-37.2	176.2	60.9	0	0	0	0	112.7	E730 T731 A737 A738 V757	E730-T734 WeakPolarHBondContact O-CG2 3.48Å; E730-T734 PolarHBondContact O-N 3.04Å; E730-T734 PolarHBondContact O-OG1 3.33Å; T731-T734 WeakPolarHBondContact CA-OG1 3.38Å; T731-T734 PolarHBondContact O-N 2.83Å; T731-T734 PolarHBondContact O-OG1 2.92Å; T734-A737 PolarHBondContact O-N 2.83Å; T734-A738 WeakPolarHBondContact O-CB 3.45Å; T734-A738 PolarHBondContact O-N 2.94Å; T734-V757 HydrophobicContact CG2-CG1 4.46Å
735	L	92.5	Very high	92.4	Very high	68 Å²	68	36.5 Å²	36.5	36%	0.356	22%	0.224	S	C	.	.	H	α-helix	trans	-63	-45.3	174.6	-178.2	65.9	0	0	0	110.4	V692 I721 T731 D732 A738 S739	V692-L735 HydrophobicContact CG2-CD2 4.41Å; I721-L735 HydrophobicContact CG2-CD1 4.1Å; I721-L735 HydrophobicContact CG2-CD2 4.15Å; I721-L735 HydrophobicContact CG2-CG 4.09Å; T731-L735 WeakPolarHBondContact O-CB 3.32Å; T731-L735 PolarHBondContact O-N 3.37Å; D732-L735 PolarHBondContact O-N 2.85Å; L735-A738 PolarHBondContact O-N 3.25Å; L735-S739 PolarHBondContact O-N 3.01Å; L735-S739 PolarHBondContact O-OG 3.49Å
736	A	92.1	Very high	92.4	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-63.2	-42	178	0	0	0	0	0	112.4	V692 D732 A733 S739 N740 A741 L743 L763	V692-A736 HydrophobicContact CG2-CB 4.03Å; D732-A736 WeakPolarHBondContact O-CB 3.46Å; D732-A736 PolarHBondContact O-N 2.96Å; A733-A736 PolarHBondContact O-N 2.95Å; A736-S739 PolarHBondContact O-N 3.34Å; A736-N740 WeakPolarHBondContact O-CA 3.04Å; A736-N740 PolarHBondContact O-N 3.43Å; A736-A741 HydrophobicContact CB-CB 4.32Å; A736-A741 PolarHBondContact O-N 3.47Å; A736-L743 HydrophobicContact CB-CD1 3.37Å; A736-L743 HydrophobicContact CB-CD2 4.3Å; A736-L743 HydrophobicContact CB-CG 3.69Å; A736-L763 HydrophobicContact CB-CD1 4.41Å
737	A	92.4	Very high	92.3	Very high	27 Å²	27	40 Å²	40	22%	0.223	24%	0.241	C	C	.	.	H	α-helix	trans	-61.5	-44.6	174.4	0	0	0	0	0	112.3	A733 T734 S739 N740 E761 L763	A733-A737 PolarHBondContact O-N 3.09Å; T734-A737 PolarHBondContact O-N 2.83Å; A737-S739 PolarHBondContact O-N 3.01Å; A737-N740 PolarHBondContact O-N 2.94Å; A737-E761 HydrophobicContact CB-CG 4.39Å; A737-L763 HydrophobicContact CB-CD1 4.14Å; A737-L763 HydrophobicContact CB-CD2 3.86Å
738	A	90.9	Very high	92.3	Very high	91 Å²	91	40 Å²	40	75%	0.752	24%	0.238	S	C	*	.	H	α-helix	trans	-64.9	-25.4	-179.1	0	0	0	0	0	113.4	T734 L735	T734-A738 WeakPolarHBondContact O-CB 3.45Å; T734-A738 PolarHBondContact O-N 2.94Å; L735-A738 PolarHBondContact O-N 3.25Å
739	S	87.6	Confident	92.2	Very high	28 Å²	28	48.1 Å²	48.1	20%	0.196	27%	0.269	C	S	.	.	T	Hydrogen-bonded Turn	trans	-114	7.7	-177	60.4	0	0	0	0	115.1	N690 I721 L735 A736 A737 A741	N690-S739 PolarHBondContact ND2-O 3.44Å; I721-S739 WeakPolarHBondContact CD1-OG 3.38Å; L735-S739 PolarHBondContact O-N 3.01Å; L735-S739 PolarHBondContact O-OG 3.49Å; A736-S739 PolarHBondContact O-N 3.34Å; A737-S739 PolarHBondContact O-N 3.01Å; S739-A741 PolarHBondContact O-N 3.02Å; S739-A741 WeakPolarHBondContact OG-CB 3.36Å
740	N	87.8	Confident	92.2	Very high	147 Å²	147	45.9 Å²	45.9	79%	0.786	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	46	49	-171.2	-65.9	-27.5	0	0	0	112.2	A736 A737	A736-N740 WeakPolarHBondContact O-CA 3.04Å; A736-N740 PolarHBondContact O-N 3.43Å; A737-N740 PolarHBondContact O-N 2.94Å
741	A	91.1	Very high	92.1	Very high	5 Å²	5	43.6 Å²	43.6	4%	0.041	25%	0.246	C	C	.	.	P	Polyproline II helix	trans	-97.8	148.1	-177.7	0	0	0	0	0	112	N690 V692 I721 A736 S739	N690-A741 HydrophobicContact CB-CB 3.69Å; N690-A741 CarbonylContact O-C 3.54Å; N690-A741 WeakPolarHBondContact O-CA 3.31Å; N690-A741 WeakPolarHBondContact O-CB 3.36Å; V692-A741 HydrophobicContact CG2-CB 3.91Å; I721-A741 HydrophobicContact CD1-CB 4.27Å; A736-A741 HydrophobicContact CB-CB 4.32Å; A736-A741 PolarHBondContact O-N 3.47Å; S739-A741 PolarHBondContact O-N 3.02Å; S739-A741 WeakPolarHBondContact OG-CB 3.36Å
742	I	92.3	Very high	92	Very high	31 Å²	31	42 Å²	42	16%	0.159	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	128.6	171.7	-57.2	171.5	0	0	0	108.4	V689 N690 I691 V692 V744 D764 R766	V689-I742 HydrophobicContact CG1-CD1 4.23Å; N690-I742 PolarHBondContact O-N 2.81Å; I691-I742 WeakPolarHBondContact CA-O 3.34Å; V692-I742 PolarHBondContact N-O 2.96Å; I742-V744 HydrophobicContact CG2-CG2 4.15Å; I742-D764 HydrophobicContact CG2-CB 4.32Å; I742-R766 HydrophobicContact CG2-CG 4.4Å
743	L	93.7	Very high	91.9	Very high	1 Å²	1	43.5 Å²	43.5	1%	0.005	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	124.5	172.1	-75.1	109.6	0	0	0	110.3	I728 A736 L763 D764 L765 R766	I728-L743 HydrophobicContact CG2-CD2 3.57Å; A736-L743 HydrophobicContact CB-CD1 3.37Å; A736-L743 HydrophobicContact CB-CD2 4.3Å; A736-L743 HydrophobicContact CB-CG 3.69Å; L743-L763 HydrophobicContact CD1-CB 3.78Å; L743-L763 HydrophobicContact CD1-CD1 3.87Å; L743-L763 HydrophobicContact CD1-CG 4.39Å; L743-D764 PolarHBondContact N-O 2.79Å; L743-L765 HydrophobicContact CB-CD1 3.67Å; L743-L765 WeakPolarHBondContact O-CA 3.47Å; L743-R766 PolarHBondContact O-N 2.83Å
744	V	94.2	Very high	91.9	Very high	2 Å²	2	43.5 Å²	43.5	1%	0.012	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	117	178.9	178.3	0	0	0	0	109.4	I691 V692 L693 K694 I742 Y768 L774	I691-V744 HydrophobicContact CG2-CB 4.21Å; I691-V744 HydrophobicContact CG2-CG2 3.76Å; V692-V744 PolarHBondContact O-N 3.03Å; L693-V744 HydrophobicContact CD1-CB 4.15Å; L693-V744 HydrophobicContact CD1-CG1 3.84Å; K694-V744 PolarHBondContact N-O 2.79Å; I742-V744 HydrophobicContact CG2-CG2 4.15Å; V744-Y768 HydrophobicContact CG1-CD2 3.73Å; V744-Y768 HydrophobicContact CG1-CE2 3.8Å; V744-Y768 HydrophobicContact CG2-CE2 4.49Å; V744-L774 HydrophobicContact CG1-CD1 3.43Å; V744-L774 VanDerWaalsContact CG1-CD1 3.43Å; V744-L774 HydrophobicContact CG1-CG 3.94Å
745	G	94.4	Very high	91.8	Very high	0 Å²	0	45.8 Å²	45.8	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	113	174.8	0	0	0	0	0	111.6	K694 R766 Y767 Y768	K694-G745 CarbonylContact O-C 3.6Å; K694-G745 WeakPolarHBondContact O-CA 3.42Å; G745-R766 PolarHBondContact N-O 3.05Å; G745-Y767 WeakPolarHBondContact O-CA 3.43Å; G745-Y768 PolarHBondContact O-N 2.93Å
746	F	92.7	Very high	91.9	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	111.5	174.5	-172	-97.5	0	0	0	110.5	K694 A695 D696 S700 I704 V748 Y768 I771 L774	K694-F746 PolarHBondContact O-N 3.25Å; A695-F746 WeakPolarHBondContact CA-O 3.49Å; A695-F746 HydrophobicContact CB-CB 3.9Å; A695-F746 HydrophobicContact CB-CD1 4.19Å; A695-F746 HydrophobicContact CB-CG 4.49Å; D696-F746 PolarHBondContact N-O 3.17Å; S700-F746 WeakPolarHBondContact OG-CE1 3.4Å; I704-F746 HydrophobicContact CD1-CB 3.81Å; I704-F746 HydrophobicContact CD1-CD1 4.14Å; I704-F746 HydrophobicContact CD1-CD2 3.71Å; I704-F746 HydrophobicContact CD1-CE2 4.26Å; I704-F746 HydrophobicContact CD1-CG 3.61Å; F746-V748 PolarHBondContact O-N 3.06Å; F746-Y768 WeakPolarHBondContact CA-O 3.32Å; F746-I771 HydrophobicContact CD2-CG1 4.45Å; F746-I771 HydrophobicContact CE1-CG1 4.48Å; F746-I771 HydrophobicContact CE2-CB 4.41Å; F746-I771 HydrophobicContact CE2-CG1 3.51Å; F746-I771 HydrophobicContact CZ-CD1 4.27Å; F746-I771 HydrophobicContact CZ-CG1 3.49Å; F746-I771 VanDerWaalsContact CZ-CG1 3.49Å; F746-L774 HydrophobicContact CD2-CD1 4.42Å
747	N	89.6	Confident	92	Very high	94 Å²	94	51 Å²	51	50%	0.503	28%	0.279	S	S	.	.	S	Bend	trans	53	19.2	-175.3	-154.9	33.2	0	0	0	115	D696 Y768	D696-N747 HydrophobicContact CB-CB 4.07Å; D696-N747 WeakPolarHBondContact OD2-CB 3.16Å; D696-N747 PolarHBondContact OD2-ND2 2.7Å; N747-Y768 PolarHBondContact N-O 3.17Å
748	V	92.1	Very high	92	Very high	16 Å²	16	50.4 Å²	50.4	10%	0.097	27%	0.271	C	S	.	.			trans	-127.2	156.3	-180	-66	0	0	0	0	111.4	K694 A695 D696 G726 F746 Y767	K694-V748 HydrophobicContact CB-CG2 3.83Å; K694-V748 WeakPolarHBondContact O-CG2 3.23Å; A695-V748 VanDerWaalsContact C-CG1 3.47Å; D696-V748 HydrophobicContact CB-CG1 3.99Å; G726-V748 WeakPolarHBondContact O-CG1 3.48Å; F746-V748 PolarHBondContact O-N 3.06Å; V748-Y767 VanDerWaalsContact O-CD1 3.24Å; V748-Y767 WeakPolarHBondContact O-CD1 3.47Å; V748-Y767 WeakPolarHBondContact O-CE1 3.5Å
749	R	92.5	Very high	92.1	Very high	170 Å²	170	52.6 Å²	52.6	64%	0.642	27%	0.266	S	S	*	.			trans	-122.2	152.3	-179.3	-61.5	-66.1	-78.1	-93.5	0.2	111.4	I728	I728-R749 PolarHBondContact N-O 2.83Å
750	A	92.9	Very high	92.3	Very high	3 Å²	3	54.9 Å²	54.9	3%	0.025	29%	0.287	C	S	.	.	B	Isolated β-bridge	trans	-75.1	136.6	176	0	0	0	0	0	112	I728 A754 R755 I758 L765 Y767	I728-A750 HydrophobicContact CB-CB 3.98Å; I728-A750 HydrophobicContact CD1-CB 4.46Å; I728-A750 HydrophobicContact CG2-CB 4.3Å; A750-A754 HydrophobicContact CB-CB 4.23Å; A750-R755 PolarHBondContact O-NH2 2.63Å; A750-I758 HydrophobicContact CB-CD1 4.2Å; A750-L765 HydrophobicContact CB-CD2 4.22Å; A750-Y767 WeakPolarHBondContact CB-OH 3.25Å; A750-Y767 PolarHBondContact N-OH 3.33Å
751	D	91	Very high	92.5	Very high	48 Å²	48	53.8 Å²	53.8	26%	0.257	28%	0.277	S	S	.	.			trans	-66.5	163.1	174.9	-69.9	-27.1	0	0	0	111.8	K576 I728 S753 A754 R755	K576-D751 WeakPolarHBondContact CE-OD1 3.32Å; K576-D751 IonicContact NZ-OD1 3.99Å; K576-D751 PolarHBondContact NZ-OD1 3.48Å; I728-D751 PolarHBondContact O-N 3.13Å; D751-S753 VanDerWaalsContact C-N 3.26Å; D751-S753 PolarHBondContact O-N 3.29Å; D751-A754 HydrophobicContact CB-CB 4.43Å; D751-A754 PolarHBondContact O-N 3.03Å; D751-R755 PolarHBondContact O-N 3.45Å
752	A	91.8	Very high	92.5	Very high	67 Å²	67	58.6 Å²	58.6	55%	0.554	31%	0.311	S	S	*	.	H	α-helix	trans	-62.6	-32.5	-177.8	0	0	0	0	0	112.9	K756	A752-K756 WeakPolarHBondContact O-CG 3.26Å
753	S	92.2	Very high	92.4	Very high	49 Å²	49	58.5 Å²	58.5	34%	0.343	31%	0.31	S	S	.	.	H	α-helix	trans	-71.3	-47.3	173.3	49.8	0	0	0	0	111.6	D751 R755 K756 V757	D751-S753 VanDerWaalsContact C-N 3.26Å; D751-S753 PolarHBondContact O-N 3.29Å; S753-R755 VanDerWaalsContact C-N 3.31Å; S753-R755 PolarHBondContact O-N 2.82Å; S753-K756 PolarHBondContact O-N 3.44Å; S753-V757 PolarHBondContact O-N 3.15Å
754	A	92.5	Very high	92.2	Very high	0 Å²	0	61.6 Å²	61.6	0%	0	33%	0.327	C	S	.	.	H	α-helix	trans	-58.2	-42.3	178	0	0	0	0	0	112.1	I728 A750 D751 K756 V757 I758	I728-A754 HydrophobicContact CG2-CB 4.4Å; I728-A754 VanDerWaalsContact O-CB 3.27Å; I728-A754 WeakPolarHBondContact O-CB 3.34Å; A750-A754 HydrophobicContact CB-CB 4.23Å; D751-A754 HydrophobicContact CB-CB 4.43Å; D751-A754 PolarHBondContact O-N 3.03Å; A754-K756 VanDerWaalsContact C-N 3.31Å; A754-K756 PolarHBondContact O-N 3.27Å; A754-V757 PolarHBondContact O-N 3.36Å; A754-I758 WeakPolarHBondContact O-CD1 3.32Å; A754-I758 VanDerWaalsContact O-CG1 3.23Å; A754-I758 WeakPolarHBondContact O-CG1 3.39Å; A754-I758 PolarHBondContact O-N 2.93Å
755	R	92.7	Very high	92.2	Very high	114 Å²	114	63.5 Å²	63.5	43%	0.43	34%	0.336	S	S	.	.	H	α-helix	trans	-61	-38.1	179.1	-164.1	179.7	-52	127.1	13.9	113	A750 D751 S753 I758 E759	A750-R755 PolarHBondContact O-NH2 2.63Å; D751-R755 PolarHBondContact O-N 3.45Å; S753-R755 VanDerWaalsContact C-N 3.31Å; S753-R755 PolarHBondContact O-N 2.82Å; R755-I758 PolarHBondContact O-N 3.4Å; R755-E759 WeakPolarHBondContact CG-OE1 3.38Å; R755-E759 WeakPolarHBondContact O-CB 3.46Å; R755-E759 WeakPolarHBondContact O-CG 3.27Å; R755-E759 PolarHBondContact O-N 3.14Å
756	K	94	Very high	92.1	Very high	149 Å²	149	66.2 Å²	66.2	65%	0.648	35%	0.347	S	S	*	.	H	α-helix	trans	-63.7	-41.2	176.8	-69.5	175.2	-177.8	-178.7	0	111.9	A752 S753 A754 A760	A752-K756 WeakPolarHBondContact O-CG 3.26Å; S753-K756 PolarHBondContact O-N 3.44Å; A754-K756 VanDerWaalsContact C-N 3.31Å; A754-K756 PolarHBondContact O-N 3.27Å; K756-A760 VanDerWaalsContact O-CB 3.23Å; K756-A760 WeakPolarHBondContact O-CB 3.33Å; K756-A760 PolarHBondContact O-N 3.06Å
757	V	92.8	Very high	92.2	Very high	30 Å²	30	70.4 Å²	70.4	18%	0.182	36%	0.363	C	S	.	.	H	α-helix	trans	-68.8	-41.5	177.3	178.9	0	0	0	0	110.8	E730 A733 T734 S753 A754 E759 A760 E761	E730-V757 HydrophobicContact CG-CG2 4Å; A733-V757 HydrophobicContact CB-CB 4.08Å; A733-V757 HydrophobicContact CB-CG1 3.92Å; T734-V757 HydrophobicContact CG2-CG1 4.46Å; S753-V757 PolarHBondContact O-N 3.15Å; A754-V757 PolarHBondContact O-N 3.36Å; V757-E759 VanDerWaalsContact C-N 3.35Å; V757-E759 PolarHBondContact O-N 2.98Å; V757-A760 PolarHBondContact O-N 3.26Å; V757-E761 HydrophobicContact CG1-CG 4.31Å; V757-E761 WeakPolarHBondContact O-CB 3.27Å; V757-E761 PolarHBondContact O-N 3.43Å
758	I	92.7	Very high	92.3	Very high	13 Å²	13	66.6 Å²	66.6	7%	0.067	34%	0.342	C	S	.	.	H	α-helix	trans	-60.8	-44.2	176.7	-68.7	165	0	0	0	111.1	A733 A750 A754 R755 S762 L763 L765	A733-I758 HydrophobicContact CB-CG1 4.01Å; A750-I758 HydrophobicContact CB-CD1 4.2Å; A754-I758 WeakPolarHBondContact O-CD1 3.32Å; A754-I758 VanDerWaalsContact O-CG1 3.23Å; A754-I758 WeakPolarHBondContact O-CG1 3.39Å; A754-I758 PolarHBondContact O-N 2.93Å; R755-I758 PolarHBondContact O-N 3.4Å; I758-S762 CarbonylContact O-C 3.58Å; I758-S762 VanDerWaalsContact O-CA 3.28Å; I758-S762 WeakPolarHBondContact O-CA 3.44Å; I758-S762 PolarHBondContact O-N 3.23Å; I758-L763 HydrophobicContact CG1-CB 4.43Å; I758-L763 HydrophobicContact CG1-CD1 4.17Å; I758-L763 HydrophobicContact CG2-CB 4.2Å; I758-L763 PolarHBondContact O-N 3.49Å; I758-L765 HydrophobicContact CD1-CD1 4.4Å; I758-L765 HydrophobicContact CD1-CD2 3.77Å; I758-L765 HydrophobicContact CD1-CG 4.47Å; I758-L765 HydrophobicContact CG2-CB 4.13Å; I758-L765 HydrophobicContact CG2-CD2 4.37Å
759	E	92.8	Very high	92	Very high	137 Å²	137	68.7 Å²	68.7	64%	0.64	36%	0.357	S	S	*	.	H	α-helix	trans	-68.4	-39.6	176.4	-73.3	171.6	-168.2	0	0	112.2	R755 V757	R755-E759 WeakPolarHBondContact CG-OE1 3.38Å; R755-E759 WeakPolarHBondContact O-CB 3.46Å; R755-E759 WeakPolarHBondContact O-CG 3.27Å; R755-E759 PolarHBondContact O-N 3.14Å; V757-E759 VanDerWaalsContact C-N 3.35Å; V757-E759 PolarHBondContact O-N 2.98Å
760	A	93.4	Very high	91.7	Very high	77 Å²	77	61.9 Å²	61.9	64%	0.636	34%	0.335	S	S	*	.	H	α-helix	trans	-68.2	-42.7	-179.6	0	0	0	0	0	112.9	K756 V757	K756-A760 VanDerWaalsContact O-CB 3.23Å; K756-A760 WeakPolarHBondContact O-CB 3.33Å; K756-A760 PolarHBondContact O-N 3.06Å; V757-A760 PolarHBondContact O-N 3.26Å
761	E	91.4	Very high	91.2	Very high	123 Å²	123	62 Å²	62	58%	0.575	34%	0.335	S	S	*	.	H	α-helix	trans	-92.2	-1.3	-179.1	-62.7	-64.3	158.1	0	0	112.7	A737 V757 L763	A737-E761 HydrophobicContact CB-CG 4.39Å; V757-E761 HydrophobicContact CG1-CG 4.31Å; V757-E761 WeakPolarHBondContact O-CB 3.27Å; V757-E761 PolarHBondContact O-N 3.43Å; E761-L763 VanDerWaalsContact C-N 3.34Å; E761-L763 HydrophobicContact CB-CD1 4.4Å; E761-L763 HydrophobicContact CB-CD2 4.1Å; E761-L763 HydrophobicContact CB-CG 3.91Å; E761-L763 PolarHBondContact O-N 2.95Å
762	S	90.4	Very high	90.7	Very high	107 Å²	107	64.2 Å²	64.2	75%	0.748	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.9	46.2	-176.6	-57.7	0	0	0	0	113.5	I758	I758-S762 CarbonylContact O-C 3.58Å; I758-S762 VanDerWaalsContact O-CA 3.28Å; I758-S762 WeakPolarHBondContact O-CA 3.44Å; I758-S762 PolarHBondContact O-N 3.23Å
763	L	90	Very high	90.4	Very high	28 Å²	28	65.7 Å²	65.7	15%	0.147	34%	0.338	C	S	.	.			trans	-74.6	140.7	-180	-56.9	173.3	0	0	0	111.4	A733 A736 A737 L743 I758 E761 L765	A733-L763 HydrophobicContact CB-CD1 4.24Å; A733-L763 VanDerWaalsContact O-CD1 3.25Å; A733-L763 WeakPolarHBondContact O-CD1 3.44Å; A736-L763 HydrophobicContact CB-CD1 4.41Å; A737-L763 HydrophobicContact CB-CD1 4.14Å; A737-L763 HydrophobicContact CB-CD2 3.86Å; L743-L763 HydrophobicContact CD1-CB 3.78Å; L743-L763 HydrophobicContact CD1-CD1 3.87Å; L743-L763 HydrophobicContact CD1-CG 4.39Å; I758-L763 HydrophobicContact CG1-CB 4.43Å; I758-L763 HydrophobicContact CG1-CD1 4.17Å; I758-L763 HydrophobicContact CG2-CB 4.2Å; I758-L763 PolarHBondContact O-N 3.49Å; E761-L763 VanDerWaalsContact C-N 3.34Å; E761-L763 HydrophobicContact CB-CD1 4.4Å; E761-L763 HydrophobicContact CB-CD2 4.1Å; E761-L763 HydrophobicContact CB-CG 3.91Å; E761-L763 PolarHBondContact O-N 2.95Å; L763-L765 PolarHBondContact O-N 3.02Å
764	D	90.7	Very high	90.2	Very high	67 Å²	67	63.3 Å²	63.3	36%	0.358	32%	0.322	S	S	.	.			trans	-73.3	114.3	173.8	-171.7	-2.8	0	0	0	109.8	I742 L743 R766	I742-D764 HydrophobicContact CG2-CB 4.32Å; L743-D764 PolarHBondContact N-O 2.79Å; D764-R766 WeakPolarHBondContact OD1-CG 3.34Å; D764-R766 IonicContact OD1-NE 2.7Å; D764-R766 PolarHBondContact OD1-NE 2.82Å; D764-R766 IonicContact OD2-CZ 2.88Å; D764-R766 VanDerWaalsContact OD2-CZ 3.31Å; D764-R766 IonicContact OD2-NE 3.81Å; D764-R766 PolarHBondContact OD2-NE 3.11Å; D764-R766 IonicContact OD2-NH2 3.03Å; D764-R766 PolarHBondContact OD2-NH2 2.98Å
765	L	92.8	Very high	90	Very high	41 Å²	41	64.3 Å²	64.3	22%	0.215	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	119.1	-179.3	174.5	65.4	0	0	0	110	I728 L743 A750 I758 L763 Y767	I728-L765 HydrophobicContact CD1-CD1 3.47Å; I728-L765 VanDerWaalsContact CD1-CD1 3.47Å; L743-L765 HydrophobicContact CB-CD1 3.67Å; L743-L765 WeakPolarHBondContact O-CA 3.47Å; A750-L765 HydrophobicContact CB-CD2 4.22Å; I758-L765 HydrophobicContact CD1-CD1 4.4Å; I758-L765 HydrophobicContact CD1-CD2 3.77Å; I758-L765 HydrophobicContact CD1-CG 4.47Å; I758-L765 HydrophobicContact CG2-CB 4.13Å; I758-L765 HydrophobicContact CG2-CD2 4.37Å; L763-L765 PolarHBondContact O-N 3.02Å; L765-Y767 HydrophobicContact CD1-CE1 4.1Å; L765-Y767 HydrophobicContact CD2-CE1 4.28Å; L765-Y767 HydrophobicContact CD2-CE2 3.92Å; L765-Y767 WeakPolarHBondContact CD2-OH 3.2Å; L765-Y767 HydrophobicContact CG-CE1 4.28Å; L765-Y767 HydrophobicContact CG-CE2 4.19Å
766	R	93	Very high	89.6	Confident	57 Å²	57	63 Å²	63	22%	0.215	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	136.5	-178.1	-53.8	-170	-173.4	-173.1	8.5	111.3	I742 L743 G745 D764 Y768 E777	I742-R766 HydrophobicContact CG2-CG 4.4Å; L743-R766 PolarHBondContact O-N 2.83Å; G745-R766 PolarHBondContact N-O 3.05Å; D764-R766 WeakPolarHBondContact OD1-CG 3.34Å; D764-R766 IonicContact OD1-NE 2.7Å; D764-R766 PolarHBondContact OD1-NE 2.82Å; D764-R766 IonicContact OD2-CZ 2.88Å; D764-R766 VanDerWaalsContact OD2-CZ 3.31Å; D764-R766 IonicContact OD2-NE 3.81Å; D764-R766 PolarHBondContact OD2-NE 3.11Å; D764-R766 IonicContact OD2-NH2 3.03Å; D764-R766 PolarHBondContact OD2-NH2 2.98Å; R766-Y768 HydrophobicContact CB-CD2 4.44Å; R766-Y768 HydrophobicContact CB-CE2 3.54Å; R766-Y768 VanDerWaalsContact CD-OH 3.28Å; R766-Y768 WeakPolarHBondContact CD-OH 3.46Å; R766-E777 VanDerWaalsContact CD-OE1 3.28Å; R766-E777 WeakPolarHBondContact CD-OE1 3.36Å; R766-E777 IonicContact CZ-OE1 2.99Å; R766-E777 IonicContact NE-OE1 4Å; R766-E777 IonicContact NH1-OE1 3.03Å; R766-E777 PolarHBondContact NH1-OE1 2.96Å
767	Y	94.5	Very high	89.2	Confident	88 Å²	88	59.6 Å²	59.6	35%	0.345	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	132.6	179	-64	-60.4	0	0	0	110.5	I728 G745 V748 A750 L765	I728-Y767 HydrophobicContact CD1-CE1 4.12Å; G745-Y767 WeakPolarHBondContact O-CA 3.43Å; V748-Y767 VanDerWaalsContact O-CD1 3.24Å; V748-Y767 WeakPolarHBondContact O-CD1 3.47Å; V748-Y767 WeakPolarHBondContact O-CE1 3.5Å; A750-Y767 WeakPolarHBondContact CB-OH 3.25Å; A750-Y767 PolarHBondContact N-OH 3.33Å; L765-Y767 HydrophobicContact CD1-CE1 4.1Å; L765-Y767 HydrophobicContact CD2-CE1 4.28Å; L765-Y767 HydrophobicContact CD2-CE2 3.92Å; L765-Y767 WeakPolarHBondContact CD2-OH 3.2Å; L765-Y767 HydrophobicContact CG-CE1 4.28Å; L765-Y767 HydrophobicContact CG-CE2 4.19Å
768	Y	91.7	Very high	88.9	Confident	15 Å²	15	58.5 Å²	58.5	6%	0.059	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	150	178.3	-56.2	-83.2	0	0	0	111	V744 G745 F746 N747 R766 N773 L774 E777	V744-Y768 HydrophobicContact CG1-CD2 3.73Å; V744-Y768 HydrophobicContact CG1-CE2 3.8Å; V744-Y768 HydrophobicContact CG2-CE2 4.49Å; G745-Y768 PolarHBondContact O-N 2.93Å; F746-Y768 WeakPolarHBondContact CA-O 3.32Å; N747-Y768 PolarHBondContact N-O 3.17Å; R766-Y768 HydrophobicContact CB-CD2 4.44Å; R766-Y768 HydrophobicContact CB-CE2 3.54Å; R766-Y768 VanDerWaalsContact CD-OH 3.28Å; R766-Y768 WeakPolarHBondContact CD-OH 3.46Å; Y768-N773 HydrophobicContact CD1-CB 4.17Å; Y768-L774 HydrophobicContact CD1-CB 3.92Å; Y768-L774 HydrophobicContact CD2-CB 3.81Å; Y768-L774 HydrophobicContact CD2-CD1 3.85Å; Y768-L774 HydrophobicContact CD2-CG 3.77Å; Y768-L774 HydrophobicContact CE1-CB 4.23Å; Y768-L774 HydrophobicContact CE2-CB 4.12Å; Y768-L774 HydrophobicContact CE2-CD1 4.39Å; Y768-L774 HydrophobicContact CE2-CG 3.9Å; Y768-L774 HydrophobicContact CG-CB 3.68Å; Y768-L774 HydrophobicContact CG-CD1 4.3Å; Y768-L774 HydrophobicContact CG-CG 4.18Å; Y768-E777 HydrophobicContact CE1-CB 4.24Å; Y768-E777 WeakPolarHBondContact CE1-OE2 3.47Å; Y768-E777 PolarHBondContact OH-OE1 2.83Å; Y768-E777 PolarHBondContact OH-OE2 2.93Å; Y768-E777 VanDerWaalsContact OH-OE2 3.07Å
769	S	86.9	Confident	88.4	Confident	59 Å²	59	60 Å²	60	41%	0.413	31%	0.314	S	S	.	.	S	Bend	trans	-121.1	-4.9	172.7	-57.3	0	0	0	0	112.4	Q426	Q426-S769 PolarHBondContact NE2-O 3.45Å; Q426-S769 PolarHBondContact OE1-O 3.14Å; Q426-S769 VanDerWaalsContact OE1-O 3.09Å
770	V	84.7	Confident	88	Confident	28 Å²	28	56.4 Å²	56.4	17%	0.17	31%	0.308	C	S	.	.	S	Bend	trans	-136.6	129.5	178.7	-176.9	0	0	0	0	107.3	Y772 N773	V770-Y772 PolarHBondContact O-N 3.33Å; V770-N773 PolarHBondContact O-N 2.92Å
771	I	83.7	Confident	87.5	Confident	5 Å²	5	54 Å²	54	3%	0.026	29%	0.289	C	S	.	.	H	α-helix	trans	-60.4	-33	-173.6	-63.4	-172.9	0	0	0	111.6	A450 F451 A703 I704 F746 L774 I775	A450-I771 HydrophobicContact CB-CG2 4.24Å; F451-I771 HydrophobicContact CD1-CD1 4.4Å; F451-I771 HydrophobicContact CE1-CD1 3.49Å; F451-I771 VanDerWaalsContact CE1-CD1 3.49Å; F451-I771 HydrophobicContact CE2-CD1 3.79Å; F451-I771 HydrophobicContact CZ-CD1 3.15Å; F451-I771 HydrophobicContact CZ-CG1 4.14Å; A703-I771 HydrophobicContact CB-CD1 4.31Å; I704-I771 HydrophobicContact CD1-CG1 4.41Å; I704-I771 HydrophobicContact CG1-CD1 4Å; I704-I771 HydrophobicContact CG1-CG1 4.07Å; I704-I771 HydrophobicContact CG1-CG2 4.13Å; F746-I771 HydrophobicContact CD2-CG1 4.45Å; F746-I771 HydrophobicContact CE1-CG1 4.48Å; F746-I771 HydrophobicContact CE2-CB 4.41Å; F746-I771 HydrophobicContact CE2-CG1 3.51Å; F746-I771 HydrophobicContact CZ-CD1 4.27Å; F746-I771 HydrophobicContact CZ-CG1 3.49Å; F746-I771 VanDerWaalsContact CZ-CG1 3.49Å; I771-L774 WeakPolarHBondContact O-CB 3.25Å; I771-L774 PolarHBondContact O-N 2.87Å; I771-I775 HydrophobicContact CG2-CD1 3.63Å; I771-I775 HydrophobicContact CG2-CG1 4.1Å; I771-I775 WeakPolarHBondContact O-CG1 3.17Å; I771-I775 PolarHBondContact O-N 3.42Å
772	Y	80.1	Confident	87	Confident	95 Å²	95	48.2 Å²	48.2	37%	0.373	26%	0.261	S	S	.	.	H	α-helix	trans	-63.3	-47.9	178.5	-87.1	-65.9	0	0	0	115	H448 V770 L774 I775 D776	H448-Y772 AromaticContact CD2-CE2 3.46Å; H448-Y772 VanDerWaalsContact CD2-CE2 3.46Å; H448-Y772 WeakPolarHBondContact CD2-CE2 3.12Å; H448-Y772 AromaticContact CD2-CZ 3.75Å; H448-Y772 AromaticContact CE1-CE2 3.21Å; H448-Y772 WeakPolarHBondContact CE1-CE2 3.33Å; H448-Y772 AromaticContact CE1-CZ 3.18Å; H448-Y772 PolarHBondContact CE1-OH 3.3Å; H448-Y772 AromaticContact CG-CE2 3.59Å; H448-Y772 AromaticContact ND1-CE2 3.29Å; H448-Y772 VanDerWaalsContact ND1-CE2 3.29Å; H448-Y772 WeakPolarHBondContact ND1-CE2 3.17Å; H448-Y772 AromaticContact ND1-CZ 3.78Å; H448-Y772 AromaticContact NE2-CE2 3.27Å; H448-Y772 VanDerWaalsContact NE2-CE2 3.27Å; H448-Y772 WeakPolarHBondContact NE2-CE2 3.1Å; H448-Y772 AromaticContact NE2-CZ 3.07Å; H448-Y772 PolarHBondContact NE2-OH 3.27Å; V770-Y772 PolarHBondContact O-N 3.33Å; Y772-L774 PolarHBondContact O-N 2.8Å; Y772-L774 VanDerWaalsContact O-N 3.15Å; Y772-I775 CarbonylContact O-C 3.48Å; Y772-I775 PolarHBondContact O-N 2.95Å; Y772-D776 WeakPolarHBondContact O-CB 3.35Å; Y772-D776 VanDerWaalsContact O-CG 3.29Å; Y772-D776 PolarHBondContact O-N 3.27Å
773	N	86.2	Confident	86.5	Confident	97 Å²	97	44 Å²	44	52%	0.519	23%	0.232	S	C	.	.	H	α-helix	trans	-58.7	-34.6	179.5	-62.5	-2.7	0	0	0	110.3	Y768 V770 E777	Y768-N773 HydrophobicContact CD1-CB 4.17Å; V770-N773 PolarHBondContact O-N 2.92Å; N773-E777 WeakPolarHBondContact O-CB 3.07Å; N773-E777 PolarHBondContact O-N 3.27Å
774	L	88.1	Confident	86	Confident	0 Å²	0	45.7 Å²	45.7	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-66.2	-51.9	172.7	-176.3	168.2	0	0	0	111.4	I704 L708 V744 F746 Y768 I771 Y772 D776 E777 V778	I704-L774 HydrophobicContact CD1-CD1 4.04Å; I704-L774 HydrophobicContact CG1-CD1 4.48Å; I704-L774 HydrophobicContact CG2-CD1 3.98Å; I704-L774 HydrophobicContact CG2-CD2 3.97Å; L708-L774 HydrophobicContact CD1-CD2 4.33Å; L708-L774 HydrophobicContact CD2-CD2 3.96Å; L708-L774 HydrophobicContact CG-CD2 4.37Å; V744-L774 HydrophobicContact CG1-CD1 3.43Å; V744-L774 VanDerWaalsContact CG1-CD1 3.43Å; V744-L774 HydrophobicContact CG1-CG 3.94Å; F746-L774 HydrophobicContact CD2-CD1 4.42Å; Y768-L774 HydrophobicContact CD1-CB 3.92Å; Y768-L774 HydrophobicContact CD2-CB 3.81Å; Y768-L774 HydrophobicContact CD2-CD1 3.85Å; Y768-L774 HydrophobicContact CD2-CG 3.77Å; Y768-L774 HydrophobicContact CE1-CB 4.23Å; Y768-L774 HydrophobicContact CE2-CB 4.12Å; Y768-L774 HydrophobicContact CE2-CD1 4.39Å; Y768-L774 HydrophobicContact CE2-CG 3.9Å; Y768-L774 HydrophobicContact CG-CB 3.68Å; Y768-L774 HydrophobicContact CG-CD1 4.3Å; Y768-L774 HydrophobicContact CG-CG 4.18Å; I771-L774 WeakPolarHBondContact O-CB 3.25Å; I771-L774 PolarHBondContact O-N 2.87Å; Y772-L774 PolarHBondContact O-N 2.8Å; Y772-L774 VanDerWaalsContact O-N 3.15Å; L774-D776 PolarHBondContact O-N 2.7Å; L774-E777 PolarHBondContact O-N 2.82Å; L774-V778 HydrophobicContact CD2-CG2 4.16Å; L774-V778 WeakPolarHBondContact O-CB 3.29Å; L774-V778 VanDerWaalsContact O-CG2 3.26Å; L774-V778 WeakPolarHBondContact O-CG2 3.48Å; L774-V778 PolarHBondContact O-N 2.84Å
775	I	86.6	Confident	85.4	Confident	21 Å²	21	46.4 Å²	46.4	11%	0.108	26%	0.258	C	S	.	.	H	α-helix	trans	-59.5	-47.4	-179.9	-70.8	175.1	0	0	0	110.8	L711 I771 Y772 V778 K779	L711-I775 HydrophobicContact CD1-CG2 3.78Å; I771-I775 HydrophobicContact CG2-CD1 3.63Å; I771-I775 HydrophobicContact CG2-CG1 4.1Å; I771-I775 WeakPolarHBondContact O-CG1 3.17Å; I771-I775 PolarHBondContact O-N 3.42Å; Y772-I775 CarbonylContact O-C 3.48Å; Y772-I775 PolarHBondContact O-N 2.95Å; I775-V778 PolarHBondContact O-N 2.76Å; I775-K779 WeakPolarHBondContact O-CB 3.41Å; I775-K779 PolarHBondContact O-N 2.84Å
776	D	86	Confident	84.7	Confident	85 Å²	85	45.6 Å²	45.6	46%	0.455	25%	0.254	S	S	.	.	H	α-helix	trans	-66.7	-39.6	-177.9	-68.2	-24.9	0	0	0	111.5	Y772 L774 K779 A780	Y772-D776 WeakPolarHBondContact O-CB 3.35Å; Y772-D776 VanDerWaalsContact O-CG 3.29Å; Y772-D776 PolarHBondContact O-N 3.27Å; L774-D776 PolarHBondContact O-N 2.7Å; D776-K779 PolarHBondContact O-N 3.26Å; D776-A780 WeakPolarHBondContact O-CB 3.4Å; D776-A780 PolarHBondContact O-N 3.06Å
777	E	84.7	Confident	83.8	Confident	78 Å²	78	46.3 Å²	46.3	36%	0.364	27%	0.268	S	S	.	.	H	α-helix	trans	-71.7	-38.5	177.5	-168.7	174	156.2	0	0	111.9	R766 Y768 N773 L774 K779 A780 A781	R766-E777 VanDerWaalsContact CD-OE1 3.28Å; R766-E777 WeakPolarHBondContact CD-OE1 3.36Å; R766-E777 IonicContact CZ-OE1 2.99Å; R766-E777 IonicContact NE-OE1 4Å; R766-E777 IonicContact NH1-OE1 3.03Å; R766-E777 PolarHBondContact NH1-OE1 2.96Å; Y768-E777 HydrophobicContact CE1-CB 4.24Å; Y768-E777 WeakPolarHBondContact CE1-OE2 3.47Å; Y768-E777 PolarHBondContact OH-OE1 2.83Å; Y768-E777 PolarHBondContact OH-OE2 2.93Å; Y768-E777 VanDerWaalsContact OH-OE2 3.07Å; N773-E777 WeakPolarHBondContact O-CB 3.07Å; N773-E777 PolarHBondContact O-N 3.27Å; L774-E777 PolarHBondContact O-N 2.82Å; E777-K779 VanDerWaalsContact C-N 3.33Å; E777-A780 PolarHBondContact O-N 3.39Å; E777-A781 WeakPolarHBondContact O-CB 3.34Å; E777-A781 PolarHBondContact O-N 2.86Å
778	V	86.3	Confident	83	Confident	8 Å²	8	44.6 Å²	44.6	5%	0.048	27%	0.267	C	S	.	.	H	α-helix	trans	-65.5	-40	171.4	174.5	0	0	0	0	110.4	I691 L708 L774 I775 A780 A781 M782	I691-V778 HydrophobicContact CD1-CG1 4.15Å; I691-V778 HydrophobicContact CD1-CG2 4.23Å; L708-V778 HydrophobicContact CD2-CB 4.12Å; L708-V778 HydrophobicContact CD2-CG1 3.87Å; L708-V778 HydrophobicContact CD2-CG2 4.14Å; L774-V778 HydrophobicContact CD2-CG2 4.16Å; L774-V778 WeakPolarHBondContact O-CB 3.29Å; L774-V778 VanDerWaalsContact O-CG2 3.26Å; L774-V778 WeakPolarHBondContact O-CG2 3.48Å; L774-V778 PolarHBondContact O-N 2.84Å; I775-V778 PolarHBondContact O-N 2.76Å; V778-A780 VanDerWaalsContact C-N 3.34Å; V778-A780 PolarHBondContact O-N 3.42Å; V778-A781 WeakPolarHBondContact O-CB 3.39Å; V778-A781 PolarHBondContact O-N 2.99Å; V778-M782 HydrophobicContact CG1-CG 4.41Å; V778-M782 VanDerWaalsContact O-CG 3.31Å; V778-M782 WeakPolarHBondContact O-CG 3.31Å; V778-M782 PolarHBondContact O-N 3.32Å
779	K	83.4	Confident	82.3	Confident	44 Å²	44	48.7 Å²	48.7	19%	0.191	29%	0.287	C	S	.	.	H	α-helix	trans	-63.2	-38.4	175.1	-176.2	174.3	173.4	172.1	0	112.1	I775 D776 E777 S783 I889 A890	I775-K779 WeakPolarHBondContact O-CB 3.41Å; I775-K779 PolarHBondContact O-N 2.84Å; D776-K779 PolarHBondContact O-N 3.26Å; E777-K779 VanDerWaalsContact C-N 3.33Å; K779-S783 WeakPolarHBondContact O-CB 3.2Å; K779-S783 PolarHBondContact O-N 3.02Å; K779-S783 PolarHBondContact O-OG 3.45Å; K779-I889 WeakPolarHBondContact CE-O 3.15Å; K779-I889 HydrophobicContact CG-CB 4.08Å; K779-I889 HydrophobicContact CG-CG2 4.39Å; K779-I889 PolarHBondContact NZ-O 2.9Å; K779-A890 WeakPolarHBondContact CE-O 3.37Å; K779-A890 PolarHBondContact NZ-O 2.93Å; K779-A890 PolarHBondContact NZ-OXT 3.38Å
780	A	83.4	Confident	82.1	Confident	61 Å²	61	51.1 Å²	51.1	50%	0.504	30%	0.295	S	S	.	.	H	α-helix	trans	-66.9	-42.6	172.5	0	0	0	0	0	111.6	D776 E777 V778 M782 S783 G784	D776-A780 WeakPolarHBondContact O-CB 3.4Å; D776-A780 PolarHBondContact O-N 3.06Å; E777-A780 PolarHBondContact O-N 3.39Å; V778-A780 VanDerWaalsContact C-N 3.34Å; V778-A780 PolarHBondContact O-N 3.42Å; A780-M782 PolarHBondContact O-N 3.43Å; A780-S783 PolarHBondContact O-N 3.17Å; A780-G784 PolarHBondContact O-N 3.15Å
781	A	82.6	Confident	82	Confident	28 Å²	28	55.8 Å²	55.8	23%	0.231	31%	0.313	C	S	.	.	H	α-helix	trans	-62.1	-41.8	175.5	0	0	0	0	0	112	E777 V778 G784 M785	E777-A781 WeakPolarHBondContact O-CB 3.34Å; E777-A781 PolarHBondContact O-N 2.86Å; V778-A781 WeakPolarHBondContact O-CB 3.39Å; V778-A781 PolarHBondContact O-N 2.99Å; A781-G784 PolarHBondContact O-N 3.12Å; A781-M785 PolarHBondContact O-N 3.15Å
782	M	81.7	Confident	82.2	Confident	0 Å²	0	59.8 Å²	59.8	0%	0	33%	0.332	C	S	.	.	H	α-helix	trans	-67	-40.3	174	-69.9	-164	-63.2	0	0	112.2	V689 L711 V716 V718 V778 A780 G784 M785 L786 I889	V689-M782 HydrophobicContact CG2-CG 4.22Å; L711-M782 HydrophobicContact CB-CE 3.74Å; L711-M782 HydrophobicContact CD1-CE 4.18Å; L711-M782 HydrophobicContact CG-CE 4.4Å; V716-M782 HydrophobicContact CG1-CB 4.04Å; V716-M782 HydrophobicContact CG1-CG 3.76Å; V716-M782 HydrophobicContact CG1-SD 3.88Å; V718-M782 HydrophobicContact CG2-CE 4.32Å; V718-M782 HydrophobicContact CG2-CG 4.34Å; V718-M782 HydrophobicContact CG2-SD 3.3Å; V718-M782 WeakPolarHBondContact CG2-SD 3.27Å; V778-M782 HydrophobicContact CG1-CG 4.41Å; V778-M782 VanDerWaalsContact O-CG 3.31Å; V778-M782 WeakPolarHBondContact O-CG 3.31Å; V778-M782 PolarHBondContact O-N 3.32Å; A780-M782 PolarHBondContact O-N 3.43Å; M782-G784 PolarHBondContact O-N 3.17Å; M782-M785 PolarHBondContact O-N 3.38Å; M782-L786 PolarHBondContact O-N 2.94Å; M782-I889 HydrophobicContact CB-CD1 3.42Å; M782-I889 VanDerWaalsContact CB-CD1 3.42Å; M782-I889 HydrophobicContact CE-CD1 3.66Å; M782-I889 HydrophobicContact CG-CD1 4.44Å; M782-I889 HydrophobicContact SD-CD1 4.24Å
783	S	80.4	Confident	82.6	Confident	20 Å²	20	60.7 Å²	60.7	14%	0.14	34%	0.339	C	S	.	.	H	α-helix	trans	-61.2	-34.7	175.5	-60.2	0	0	0	0	111.5	K779 A780 M785 L786 I889	K779-S783 WeakPolarHBondContact O-CB 3.2Å; K779-S783 PolarHBondContact O-N 3.02Å; K779-S783 PolarHBondContact O-OG 3.45Å; A780-S783 PolarHBondContact O-N 3.17Å; S783-M785 VanDerWaalsContact C-N 3.28Å; S783-M785 PolarHBondContact O-N 3.45Å; S783-L786 PolarHBondContact O-N 3.37Å; S783-I889 PolarHBondContact OG-N 2.92Å
784	G	78.1	Confident	82.8	Confident	63 Å²	63	60.3 Å²	60.3	65%	0.649	34%	0.336	S	S	*	.	H	α-helix	trans	-69.6	-19.1	172.5	0	0	0	0	0	115	A780 A781 M782	A780-G784 PolarHBondContact O-N 3.15Å; A781-G784 PolarHBondContact O-N 3.12Å; M782-G784 PolarHBondContact O-N 3.17Å
785	M	77.9	Confident	82.8	Confident	82 Å²	82	62 Å²	62	40%	0.404	35%	0.345	S	S	.	.	H	α-helix	trans	-90.9	-15.9	175.3	-67.1	-173.5	-177.9	0	0	113.3	V689 V716 A781 M782 S783	V689-M785 HydrophobicContact CG2-CE 3.94Å; V689-M785 HydrophobicContact CG2-SD 3.47Å; V689-M785 WeakPolarHBondContact CG2-SD 3.46Å; V716-M785 HydrophobicContact CG2-CB 4.46Å; A781-M785 PolarHBondContact O-N 3.15Å; M782-M785 PolarHBondContact O-N 3.38Å; S783-M785 VanDerWaalsContact C-N 3.28Å; S783-M785 PolarHBondContact O-N 3.45Å
786	L	77.9	Confident	83.1	Confident	23 Å²	23	61.2 Å²	61.2	12%	0.12	34%	0.341	C	S	.	.	S	Bend	trans	-68.3	139.8	175	-70.1	171.2	0	0	0	110.3	E715 V716 M782 S783 R887 I889	E715-L786 HydrophobicContact CB-CD2 4.02Å; E715-L786 VanDerWaalsContact OE2-CD2 3.26Å; E715-L786 WeakPolarHBondContact OE2-CD2 3.41Å; V716-L786 HydrophobicContact CG2-CD2 3.67Å; V716-L786 HydrophobicContact CG2-CG 4.16Å; M782-L786 PolarHBondContact O-N 2.94Å; S783-L786 PolarHBondContact O-N 3.37Å; L786-R887 HydrophobicContact CB-CB 4.3Å; L786-R887 HydrophobicContact CD1-CB 4.07Å; L786-I889 HydrophobicContact CD1-CD1 4.2Å; L786-I889 HydrophobicContact CD1-CG1 3.61Å
787	S	75.2	Confident	83.4	Confident	72 Å²	72	59.1 Å²	59.1	50%	0.503	33%	0.33	S	S	.	.	P	Polyproline II helix	trans	-60.9	134.9	171.3	61.4	0	0	0	0	110.3
788	P	77.6	Confident	83.7	Confident	52 Å²	52	55.4 Å²	55.4	34%	0.338	31%	0.313	S	S	.	.	P	Polyproline II helix	trans	-65.3	143.8	178.4	26.1	-32.9	0	0	0	110.6	L790 E884 I885	P788-L790 PolarHBondContact O-N 3.41Å; P788-E884 HydrophobicContact CB-CB 4.01Å; P788-E884 HydrophobicContact CB-CG 4.44Å; P788-E884 HydrophobicContact CG-CB 4.32Å; P788-E884 HydrophobicContact CG-CG 4.27Å; P788-I885 CarbonylContact C-O 3.51Å; P788-I885 WeakPolarHBondContact CA-O 3.42Å
789	E	77.8	Confident	84	Confident	101 Å²	101	58.8 Å²	58.8	47%	0.472	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	122.4	173.9	-168.2	177	164.7	0	0	109.5	K791 I885 R887	E789-K791 PolarHBondContact O-N 2.95Å; E789-K791 VanDerWaalsContact O-N 3.17Å; E789-I885 PolarHBondContact N-O 3.06Å; E789-I885 PolarHBondContact O-N 3.25Å; E789-R887 HydrophobicContact CB-CG 4.18Å; E789-R887 IonicContact OE2-NE 3.17Å
790	L	81.8	Confident	84.5	Confident	110 Å²	110	56.7 Å²	56.7	58%	0.576	32%	0.319	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.8	96	176.2	-60.7	179.4	0	0	0	109.2	P788 I882 E884	P788-L790 PolarHBondContact O-N 3.41Å; L790-I882 HydrophobicContact CB-CG2 3.91Å; L790-I882 HydrophobicContact CD2-CG2 3.82Å; L790-I882 HydrophobicContact CG-CG2 4.3Å; L790-E884 HydrophobicContact CD2-CG 3.69Å
791	K	83	Confident	84.9	Confident	127 Å²	127	60.5 Å²	60.5	55%	0.552	32%	0.32	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94.2	128.9	174	-168.5	174.4	-177.1	176	0	110	E789 I883 I885	E789-K791 PolarHBondContact O-N 2.95Å; E789-K791 VanDerWaalsContact O-N 3.17Å; K791-I883 PolarHBondContact N-O 3.03Å; K791-I883 PolarHBondContact O-N 2.79Å; K791-I885 HydrophobicContact CB-CD1 3.68Å; K791-I885 HydrophobicContact CB-CG1 4.31Å; K791-I885 HydrophobicContact CD-CD1 3.62Å; K791-I885 HydrophobicContact CG-CD1 4.29Å
792	Q	86.9	Confident	85.2	Confident	89 Å²	89	63 Å²	63	42%	0.416	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	116.9	173.6	-64.2	174.4	-1.1	0	0	108.9	F880 E881	Q792-F880 HydrophobicContact CB-CD2 3.98Å; Q792-F880 HydrophobicContact CG-CD2 3.86Å; Q792-F880 HydrophobicContact CG-CE2 4.03Å; Q792-E881 WeakPolarHBondContact CA-O 3.33Å
793	Q	88.7	Confident	85.6	Confident	114 Å²	114	65 Å²	65	53%	0.533	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	126.1	172.6	-175.6	172.1	14.6	0	0	109.8	I795 F880 E881 I883	Q793-I795 PolarHBondContact O-N 3.38Å; Q793-F880 CarbonylContact O-C 3.53Å; Q793-F880 VanDerWaalsContact O-CA 3.23Å; Q793-F880 WeakPolarHBondContact O-CA 3.26Å; Q793-F880 WeakPolarHBondContact O-CB 3.29Å; Q793-E881 PolarHBondContact N-O 2.83Å; Q793-E881 PolarHBondContact O-N 2.86Å; Q793-I883 HydrophobicContact CB-CD1 3.86Å
794	I	89.9	Confident	85.9	Confident	88 Å²	88	69.5 Å²	69.5	45%	0.451	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	118.3	174.8	-51.5	-178.7	0	0	0	108.5	L797 E878	I794-L797 HydrophobicContact CG2-CD2 4.09Å; I794-L797 HydrophobicContact CG2-CG 4.4Å; I794-E878 HydrophobicContact CD1-CG 4.21Å; I794-E878 VanDerWaalsContact CD1-OE1 3.29Å; I794-E878 WeakPolarHBondContact CD1-OE1 3.36Å; I794-E878 HydrophobicContact CG1-CG 4.21Å; I794-E878 VanDerWaalsContact CG1-OE1 3.25Å; I794-E878 WeakPolarHBondContact CG1-OE1 3.27Å; I794-E878 HydrophobicContact CG2-CG 3.7Å
795	I	89.8	Confident	86.1	Confident	37 Å²	37	75.9 Å²	75.9	19%	0.19	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	-32.8	178.2	-52.8	162.7	0	0	0	110.7	Q793 G820 V821 N826 V879 E881	Q793-I795 PolarHBondContact O-N 3.38Å; I795-G820 CarbonylContact O-C 3.43Å; I795-G820 WeakPolarHBondContact O-CA 3.32Å; I795-V821 HydrophobicContact CG2-CB 4.29Å; I795-V821 WeakPolarHBondContact CG2-O 3.43Å; I795-V821 PolarHBondContact O-N 3.3Å; I795-N826 HydrophobicContact CD1-CB 4.4Å; I795-N826 WeakPolarHBondContact CD1-ND2 3.48Å; I795-V879 HydrophobicContact CD1-CG1 4.41Å; I795-V879 PolarHBondContact N-O 3.49Å; I795-E881 HydrophobicContact CD1-CB 3.53Å; I795-E881 HydrophobicContact CG1-CB 3.88Å
796	G	91.3	Very high	86.2	Confident	3 Å²	3	73.4 Å²	73.4	3%	0.031	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-169	159.5	-179	0	0	0	0	0	114.4	E819 V879	G796-E819 CarbonylContact C-O 3.5Å; G796-E819 WeakPolarHBondContact CA-O 3.29Å; G796-V879 PolarHBondContact N-O 2.95Å; G796-V879 PolarHBondContact O-N 3.48Å
797	L	93.1	Very high	86.3	Confident	41 Å²	41	78.9 Å²	78.9	22%	0.215	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	134.5	178.3	-62.6	175.3	0	0	0	108.4	I794 V817 T818 E819 V876 E878	I794-L797 HydrophobicContact CG2-CD2 4.09Å; I794-L797 HydrophobicContact CG2-CG 4.4Å; L797-V817 CarbonylContact O-C 3.56Å; L797-V817 WeakPolarHBondContact O-CA 3.45Å; L797-T818 WeakPolarHBondContact CB-OG1 3.3Å; L797-T818 PolarHBondContact O-N 2.95Å; L797-T818 PolarHBondContact O-OG1 3.25Å; L797-T818 VanDerWaalsContact O-OG1 3.13Å; L797-E819 HydrophobicContact CB-CB 4.42Å; L797-E819 PolarHBondContact N-O 2.88Å; L797-E819 PolarHBondContact O-N 2.78Å; L797-V876 HydrophobicContact CB-CG1 4.39Å; L797-V876 HydrophobicContact CD2-CG1 4.17Å; L797-E878 HydrophobicContact CD2-CB 3.8Å; L797-E878 HydrophobicContact CD2-CG 3.79Å
798	A	92.1	Very high	86.4	Confident	0 Å²	0	83.8 Å²	83.8	0%	0	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	120.6	176.1	0	0	0	0	0	109.9	C815 M816 V817 V822 I863 I877	A798-C815 HydrophobicContact CB-CB 3.91Å; A798-M816 WeakPolarHBondContact CA-O 3.26Å; A798-V817 HydrophobicContact CB-CG2 4.45Å; A798-V822 HydrophobicContact CB-CG2 3.99Å; A798-I863 HydrophobicContact CB-CD1 3.9Å; A798-I877 HydrophobicContact CB-CB 4.44Å; A798-I877 PolarHBondContact N-O 2.84Å; A798-I877 PolarHBondContact O-N 3.21Å
799	E	92.5	Very high	86.3	Confident	79 Å²	79	83.6 Å²	83.6	37%	0.369	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	128.6	179.4	-170.1	-173.8	173.7	0	0	110	R801 C815 M816 T818	E799-R801 PolarHBondContact O-N 2.8Å; E799-C815 CarbonylContact O-C 3.49Å; E799-C815 WeakPolarHBondContact O-CA 3.44Å; E799-M816 PolarHBondContact N-O 2.91Å; E799-M816 PolarHBondContact O-N 2.76Å; E799-T818 HydrophobicContact CB-CG2 3.81Å
800	V	92.6	Very high	86.5	Confident	1 Å²	1	80.2 Å²	80.2	1%	0.006	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79	113.3	180	-176.8	0	0	0	0	109.9	V803 A813 V871 R872 G874 D875 I877	V800-V803 HydrophobicContact CG1-CG2 3.87Å; V800-A813 HydrophobicContact CG1-CB 3.86Å; V800-A813 HydrophobicContact CG2-CB 3.95Å; V800-V871 HydrophobicContact CB-CG1 4.41Å; V800-V871 HydrophobicContact CG1-CG1 4.02Å; V800-V871 HydrophobicContact CG2-CG1 3.79Å; V800-R872 WeakPolarHBondContact CG1-O 3.49Å; V800-G874 PolarHBondContact O-N 3.34Å; V800-D875 HydrophobicContact CB-CB 4.4Å; V800-D875 WeakPolarHBondContact CB-O 3.45Å; V800-D875 HydrophobicContact CG2-CB 4.07Å; V800-D875 VanDerWaalsContact CG2-O 3.3Å; V800-D875 WeakPolarHBondContact CG2-O 3.39Å; V800-D875 PolarHBondContact N-O 3.07Å; V800-I877 HydrophobicContact CG2-CD1 3.95Å; V800-I877 HydrophobicContact CG2-CG1 3.96Å
801	R	91.5	Very high	86.7	Confident	140 Å²	140	75.3 Å²	75.3	53%	0.528	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	-35.8	178.1	-71.7	-171.8	171.9	179.5	-0.6	113.6	E799 G814 M816 T873	E799-R801 PolarHBondContact O-N 2.8Å; R801-G814 PolarHBondContact N-O 3.17Å; R801-M816 PolarHBondContact NH2-SD 2.82Å; R801-T873 WeakPolarHBondContact O-CG2 3.34Å
802	D	90.2	Very high	87	Confident	82 Å²	82	70.3 Å²	70.3	44%	0.439	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	158.3	-178.1	-157.1	-5.3	0	0	0	110.2	F804 G814	D802-F804 HydrophobicContact CB-CE2 4.04Å; D802-F804 HydrophobicContact CB-CZ 3.91Å; D802-F804 WeakPolarHBondContact OD2-CE1 3.18Å; D802-F804 VanDerWaalsContact OD2-CZ 3.26Å; D802-F804 WeakPolarHBondContact OD2-CZ 3.46Å; D802-G814 PolarHBondContact N-O 3.14Å; D802-G814 WeakPolarHBondContact O-CA 3.4Å; D802-G814 PolarHBondContact O-N 3.13Å
803	V	89.4	Confident	87.1	Confident	41 Å²	41	66.1 Å²	66.1	25%	0.248	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	111.3	-179	-176.7	0	0	0	0	109.6	V800 A811 I812 V871 T873	V800-V803 HydrophobicContact CG1-CG2 3.87Å; V803-A811 HydrophobicContact CG1-CB 4.05Å; V803-I812 WeakPolarHBondContact CA-O 3.46Å; V803-V871 WeakPolarHBondContact CG2-O 3.46Å; V803-T873 HydrophobicContact CG2-CG2 4.35Å
804	F	87.5	Confident	87.2	Confident	114 Å²	114	61.3 Å²	61.3	50%	0.5	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	136.1	-179.6	-54.7	-76.7	0	0	0	110.7	D802 I812	D802-F804 HydrophobicContact CB-CE2 4.04Å; D802-F804 HydrophobicContact CB-CZ 3.91Å; D802-F804 WeakPolarHBondContact OD2-CE1 3.18Å; D802-F804 VanDerWaalsContact OD2-CZ 3.26Å; D802-F804 WeakPolarHBondContact OD2-CZ 3.46Å; F804-I812 PolarHBondContact N-O 3.39Å; F804-I812 PolarHBondContact O-N 3.32Å
805	K	81.8	Confident	87.2	Confident	198 Å²	198	57.3 Å²	57.3	86%	0.861	29%	0.291	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.4	112.5	170.6	-68.7	-176.3	-178	-179.5	0	109.9
806	S	79.9	Confident	87.2	Confident	30 Å²	30	57.2 Å²	57.2	21%	0.21	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	135.5	173.7	174.7	0	0	0	0	110.7	K808 G810	S806-K808 PolarHBondContact O-N 2.91Å; S806-K808 PolarHBondContact OG-N 3.44Å; S806-G810 PolarHBondContact N-O 3.08Å; S806-G810 PolarHBondContact O-N 2.9Å; S806-G810 VanDerWaalsContact O-N 3.15Å
807	P	79.9	Confident	87.3	Confident	138 Å²	138	57.1 Å²	57.1	90%	0.896	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.7	-19.3	178	24	-31.8	0	0	0	113.7
808	K	78	Confident	87.1	Confident	175 Å²	175	57.7 Å²	57.7	76%	0.761	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.7	-31.4	-178.3	-73.6	-174.3	176.9	-177.5	0	114.8	S806	S806-K808 PolarHBondContact O-N 2.91Å; S806-K808 PolarHBondContact OG-N 3.44Å
809	F	74.9	Confident	87	Confident	48 Å²	48	63.5 Å²	63.5	21%	0.211	32%	0.321	C	S	.	.	T	Hydrogen-bonded Turn	trans	-129.2	14.4	-167.8	-58.4	-70.8	0	0	0	113.3	I812 E843	F809-I812 HydrophobicContact CB-CD1 4.33Å; F809-I812 HydrophobicContact CB-CG1 4.36Å; F809-E843 HydrophobicContact CD1-CG 4.13Å
810	G	82	Confident	86.9	Confident	29 Å²	29	61.3 Å²	61.3	30%	0.299	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	69.5	-135.1	179.5	0	0	0	0	0	113.3	S806	S806-G810 PolarHBondContact N-O 3.08Å; S806-G810 PolarHBondContact O-N 2.9Å; S806-G810 VanDerWaalsContact O-N 3.15Å
811	A	86.1	Confident	86.9	Confident	8 Å²	8	63 Å²	63	7%	0.066	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	115.4	177.8	0	0	0	0	0	110.8	V803 N869	V803-A811 HydrophobicContact CG1-CB 4.05Å; A811-N869 HydrophobicContact CB-CB 4.43Å; A811-N869 VanDerWaalsContact CB-O 3.22Å; A811-N869 WeakPolarHBondContact CB-O 3.49Å; A811-N869 PolarHBondContact N-OD1 3.21Å
812	I	89.2	Confident	86.9	Confident	22 Å²	22	56.4 Å²	56.4	11%	0.113	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	121.8	173.8	-58.1	-178.3	0	0	0	108.2	V803 F804 F809 G814	V803-I812 WeakPolarHBondContact CA-O 3.46Å; F804-I812 PolarHBondContact N-O 3.39Å; F804-I812 PolarHBondContact O-N 3.32Å; F809-I812 HydrophobicContact CB-CD1 4.33Å; F809-I812 HydrophobicContact CB-CG1 4.36Å; I812-G814 PolarHBondContact O-N 3.35Å
813	A	87.8	Confident	86.9	Confident	0 Å²	0	55.9 Å²	55.9	0%	0	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	115.3	174.6	0	0	0	0	0	110	V800 C815 G862 I863 V871 I877	V800-A813 HydrophobicContact CG1-CB 3.86Å; V800-A813 HydrophobicContact CG2-CB 3.95Å; A813-C815 WeakPolarHBondContact CB-SG 3.43Å; A813-C815 PolarHBondContact O-N 2.9Å; A813-C815 PolarHBondContact O-SG 2.93Å; A813-G862 WeakPolarHBondContact O-CA 3.4Å; A813-I863 PolarHBondContact N-O 3.18Å; A813-I863 PolarHBondContact O-N 2.96Å; A813-V871 HydrophobicContact CB-CG1 3.89Å; A813-I877 HydrophobicContact CB-CD1 4.15Å
814	G	90.7	Very high	86.7	Confident	14 Å²	14	57.7 Å²	57.7	14%	0.144	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	102.7	165.5	0	0	0	0	0	109.1	R801 D802 I812	R801-G814 PolarHBondContact N-O 3.17Å; D802-G814 PolarHBondContact N-O 3.14Å; D802-G814 WeakPolarHBondContact O-CA 3.4Å; D802-G814 PolarHBondContact O-N 3.13Å; I812-G814 PolarHBondContact O-N 3.35Å
815	C	90.5	Very high	86.7	Confident	3 Å²	3	60 Å²	60	2%	0.02	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	149.5	-173.1	-48.4	0	0	0	0	111.6	A798 E799 A813 E860 C861 I863	A798-C815 HydrophobicContact CB-CB 3.91Å; E799-C815 CarbonylContact O-C 3.49Å; E799-C815 WeakPolarHBondContact O-CA 3.44Å; A813-C815 WeakPolarHBondContact CB-SG 3.43Å; A813-C815 PolarHBondContact O-N 2.9Å; A813-C815 PolarHBondContact O-SG 2.93Å; C815-E860 WeakPolarHBondContact O-CA 3.38Å; C815-C861 PolarHBondContact N-O 3.43Å; C815-C861 PolarHBondContact O-N 3.45Å; C815-C861 VanDerWaalsContact O-O 3.11Å; C815-I863 HydrophobicContact CB-CD1 3.91Å; C815-I863 HydrophobicContact CB-CG1 4.26Å
816	M	91	Very high	87.1	Confident	36 Å²	36	51.5 Å²	51.5	18%	0.177	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	125.5	163.7	-178	169.5	-79.1	0	0	108.3	A798 E799 R801 T818 E860	A798-M816 WeakPolarHBondContact CA-O 3.26Å; E799-M816 PolarHBondContact N-O 2.91Å; E799-M816 PolarHBondContact O-N 2.76Å; R801-M816 PolarHBondContact NH2-SD 2.82Å; M816-T818 PolarHBondContact O-N 3.25Å; M816-T818 VanDerWaalsContact O-N 3.14Å; M816-E860 HydrophobicContact CE-CG 3.64Å; M816-E860 WeakPolarHBondContact CE-OE1 3.19Å
817	V	92.4	Very high	87.6	Confident	0 Å²	0	51.9 Å²	51.9	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.5	110.7	174.1	-174.7	0	0	0	0	107.8	L797 A798 V822 V855 N857 G858 M859	L797-V817 CarbonylContact O-C 3.56Å; L797-V817 WeakPolarHBondContact O-CA 3.45Å; A798-V817 HydrophobicContact CB-CG2 4.45Å; V817-V822 HydrophobicContact CG1-CG2 4.24Å; V817-V822 HydrophobicContact CG2-CB 4.42Å; V817-V822 HydrophobicContact CG2-CG2 3.69Å; V817-V855 HydrophobicContact CG2-CB 4.15Å; V817-V855 HydrophobicContact CG2-CG1 3.63Å; V817-N857 PolarHBondContact O-OD1 2.77Å; V817-G858 PolarHBondContact O-N 3Å; V817-M859 PolarHBondContact N-O 3.13Å; V817-M859 VanDerWaalsContact N-O 3.17Å
818	T	90.2	Very high	88.2	Confident	54 Å²	54	45.3 Å²	45.3	33%	0.331	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	-39	-177.9	49.4	0	0	0	0	111.1	L797 E799 M816 N857	L797-T818 WeakPolarHBondContact CB-OG1 3.3Å; L797-T818 PolarHBondContact O-N 2.95Å; L797-T818 PolarHBondContact O-OG1 3.25Å; L797-T818 VanDerWaalsContact O-OG1 3.13Å; E799-T818 HydrophobicContact CB-CG2 3.81Å; M816-T818 PolarHBondContact O-N 3.25Å; M816-T818 VanDerWaalsContact O-N 3.14Å; T818-N857 PolarHBondContact O-ND2 3.04Å; T818-N857 PolarHBondContact O-OD1 2.82Å
819	E	89.5	Confident	88.9	Confident	121 Å²	121	39 Å²	39	57%	0.565	21%	0.208	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-142.6	143.5	-179.5	-65	-171.1	168.6	0	0	110.3	G796 L797	G796-E819 CarbonylContact C-O 3.5Å; G796-E819 WeakPolarHBondContact CA-O 3.29Å; L797-E819 HydrophobicContact CB-CB 4.42Å; L797-E819 PolarHBondContact N-O 2.88Å; L797-E819 PolarHBondContact O-N 2.78Å
820	G	90.5	Very high	89.7	Confident	33 Å²	33	36.7 Å²	36.7	34%	0.34	20%	0.198	S	C	.	.	E	Extended strand (participates in β ladder)	trans	71.8	-145.9	171.8	0	0	0	0	0	116	I795 N857	I795-G820 CarbonylContact O-C 3.43Å; I795-G820 WeakPolarHBondContact O-CA 3.32Å; G820-N857 PolarHBondContact O-N 3.11Å
821	V	91.5	Very high	90.2	Very high	38 Å²	38	36.4 Å²	36.4	23%	0.23	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	133.1	-175.7	-177.3	0	0	0	0	110.8	I795 K823 E854 V855	I795-V821 HydrophobicContact CG2-CB 4.29Å; I795-V821 WeakPolarHBondContact CG2-O 3.43Å; I795-V821 PolarHBondContact O-N 3.3Å; V821-K823 HydrophobicContact CG1-CG 4.36Å; V821-E854 HydrophobicContact CG1-CB 3.92Å; V821-V855 VanDerWaalsContact CA-O 3.32Å; V821-V855 WeakPolarHBondContact CA-O 3.44Å; V821-V855 WeakPolarHBondContact CG1-O 3.46Å
822	V	91.3	Very high	90.4	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	116.1	172.3	176.2	0	0	0	0	108.8	A798 V817 L842 L845 E854 V855 I863 V879	A798-V822 HydrophobicContact CB-CG2 3.99Å; V817-V822 HydrophobicContact CG1-CG2 4.24Å; V817-V822 HydrophobicContact CG2-CB 4.42Å; V817-V822 HydrophobicContact CG2-CG2 3.69Å; V822-L842 HydrophobicContact CG1-CD1 3.99Å; V822-L845 HydrophobicContact CG1-CD1 3.69Å; V822-L845 HydrophobicContact CG1-CD2 4.02Å; V822-L845 WeakPolarHBondContact O-CD2 3.5Å; V822-E854 CarbonylContact O-C 3.44Å; V822-E854 VanDerWaalsContact O-CA 3.27Å; V822-E854 WeakPolarHBondContact O-CA 3.22Å; V822-V855 HydrophobicContact CB-CB 4.48Å; V822-V855 PolarHBondContact N-O 3.2Å; V822-V855 PolarHBondContact O-N 2.85Å; V822-I863 HydrophobicContact CG1-CD1 4.06Å; V822-I863 HydrophobicContact CG2-CD1 4.49Å; V822-V879 HydrophobicContact CB-CG2 4.18Å; V822-V879 HydrophobicContact CG1-CG2 3.86Å; V822-V879 HydrophobicContact CG2-CG2 3.98Å
823	K	90	Very high	90.3	Very high	71 Å²	71	44.2 Å²	44.2	31%	0.309	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	140.6	175.8	-70	-179.4	-178.2	171.6	0	110.7	V821 H825 N826 L842	V821-K823 HydrophobicContact CG1-CG 4.36Å; K823-H825 VanDerWaalsContact C-N 3.34Å; K823-H825 PolarHBondContact O-N 3.03Å; K823-N826 HydrophobicContact CB-CB 4.4Å; K823-N826 WeakPolarHBondContact CB-OD1 3.3Å; K823-L842 WeakPolarHBondContact O-CD1 3.16Å
824	R	85.8	Confident	90.3	Very high	80 Å²	80	51.4 Å²	51.4	30%	0.302	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-27.4	-175.4	-172.8	176.2	177.3	177.6	2.3	115.3	L845 N853	R824-L845 HydrophobicContact CB-CB 4.3Å; R824-L845 HydrophobicContact CB-CD2 4.35Å; R824-L845 HydrophobicContact CG-CB 4.33Å; R824-N853 PolarHBondContact N-O 3Å
825	H	87.1	Confident	90.2	Very high	161 Å²	161	55.2 Å²	55.2	75%	0.745	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.3	-2.8	-171.9	-61.2	-22.2	0	0	0	114.1	K823	K823-H825 VanDerWaalsContact C-N 3.34Å; K823-H825 PolarHBondContact O-N 3.03Å
826	N	90	Very high	90.2	Very high	21 Å²	21	58.1 Å²	58.1	11%	0.112	30%	0.303	C	S	.	.	S	Bend	trans	-88.1	147.7	-176.3	-73.8	61.2	0	0	0	110.6	I795 K823 V879	I795-N826 HydrophobicContact CD1-CB 4.4Å; I795-N826 WeakPolarHBondContact CD1-ND2 3.48Å; K823-N826 HydrophobicContact CB-CB 4.4Å; K823-N826 WeakPolarHBondContact CB-OD1 3.3Å; N826-V879 HydrophobicContact CB-CG1 3.58Å
827	P	91.9	Very high	90.1	Very high	38 Å²	38	59.8 Å²	59.8	25%	0.247	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65	151.8	173.3	29.2	-35.6	0	0	0	110.9	G840 F880	P827-G840 WeakPolarHBondContact CA-O 3.46Å; P827-F880 HydrophobicContact CB-CE1 3.95Å; P827-F880 HydrophobicContact CB-CE2 3.98Å; P827-F880 HydrophobicContact CB-CZ 3.62Å; P827-F880 VanDerWaalsContact CD-O 3.27Å; P827-F880 WeakPolarHBondContact CD-O 3.34Å; P827-F880 HydrophobicContact CG-CD2 3.89Å; P827-F880 HydrophobicContact CG-CE1 4.23Å; P827-F880 HydrophobicContact CG-CE2 3.57Å; P827-F880 HydrophobicContact CG-CG 4.38Å; P827-F880 HydrophobicContact CG-CZ 3.77Å; P827-F880 WeakPolarHBondContact CG-O 3.29Å; P827-F880 PolarHBondContact O-N 2.78Å; P827-F880 VanDerWaalsContact O-N 3.09Å
828	I	92.1	Very high	90	Very high	0 Å²	0	62.5 Å²	62.5	0%	0	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	154	-176.3	59.2	155.8	0	0	0	112.3	E839 G840 L842 V865 I877 E878 V879	I828-E839 WeakPolarHBondContact O-CA 3.5Å; I828-G840 WeakPolarHBondContact CG1-O 3.36Å; I828-G840 PolarHBondContact N-O 3.42Å; I828-G840 PolarHBondContact O-N 2.73Å; I828-L842 HydrophobicContact CD1-CD2 3.54Å; I828-L842 HydrophobicContact CD1-CG 4.18Å; I828-L842 HydrophobicContact CG1-CD2 4.3Å; I828-L842 HydrophobicContact CG1-CG 4.42Å; I828-L842 HydrophobicContact CG2-CD1 4.06Å; I828-L842 HydrophobicContact CG2-CD2 3.99Å; I828-L842 HydrophobicContact CG2-CG 3.7Å; I828-V865 HydrophobicContact CD1-CB 4.28Å; I828-V865 HydrophobicContact CD1-CG1 3.77Å; I828-V865 HydrophobicContact CD1-CG2 3.76Å; I828-I877 HydrophobicContact CB-CG2 4.21Å; I828-I877 HydrophobicContact CD1-CG2 4.1Å; I828-I877 HydrophobicContact CG2-CG2 4.36Å; I828-E878 CarbonylContact C-O 3.59Å; I828-E878 WeakPolarHBondContact CA-O 3.47Å; I828-E878 WeakPolarHBondContact CB-O 3.46Å; I828-V879 HydrophobicContact CG2-CB 4.29Å; I828-V879 HydrophobicContact CG2-CG1 4.34Å; I828-V879 HydrophobicContact CG2-CG2 3.78Å
829	R	92.5	Very high	90	Very high	41 Å²	41	65 Å²	65	16%	0.155	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	138.6	166.5	-57.1	-172.8	157.7	127.7	1.3	109.9	L831 V836 Y838 E839 I877 E878 F880	R829-L831 HydrophobicContact CB-CD1 4.17Å; R829-V836 HydrophobicContact CB-CG1 4.23Å; R829-V836 HydrophobicContact CG-CG1 4.35Å; R829-Y838 CarbonylContact C-O 3.6Å; R829-Y838 VanDerWaalsContact CA-O 3.31Å; R829-Y838 WeakPolarHBondContact CA-O 3.49Å; R829-E839 HydrophobicContact CG-CG 4.16Å; R829-E839 IonicContact CZ-OE1 2.74Å; R829-E839 IonicContact NE-OE1 3.24Å; R829-E839 PolarHBondContact NE-OE1 3.48Å; R829-E839 IonicContact NH2-OE1 3.05Å; R829-E839 PolarHBondContact NH2-OE1 2.83Å; R829-I877 CarbonylContact O-C 3.57Å; R829-I877 WeakPolarHBondContact O-CA 3.42Å; R829-E878 HydrophobicContact CB-CB 4.27Å; R829-E878 PolarHBondContact N-O 3.25Å; R829-E878 PolarHBondContact O-N 2.85Å; R829-F880 HydrophobicContact CG-CD1 3.93Å; R829-F880 HydrophobicContact CG-CE1 3.51Å; R829-F880 HydrophobicContact CG-CZ 4.47Å
830	V	92.5	Very high	90	Very high	0 Å²	0	60.1 Å²	60.1	0%	0	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	117.6	168.3	-175.1	0	0	0	0	107.9	I837 Y838 V865 Y868 D875	V830-I837 PolarHBondContact O-N 3.25Å; V830-Y838 HydrophobicContact CG2-CD1 4.49Å; V830-Y838 PolarHBondContact N-O 2.93Å; V830-V865 HydrophobicContact CG2-CG2 4.32Å; V830-Y868 HydrophobicContact CG1-CE1 4.39Å; V830-D875 HydrophobicContact CG1-CB 4.21Å
831	L	91.8	Very high	90	Very high	23 Å²	23	63.6 Å²	63.6	12%	0.12	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	136.7	177.5	-57	97	0	0	0	110.6	R829 V835 V836 D875 V876 E878	R829-L831 HydrophobicContact CB-CD1 4.17Å; L831-V835 VanDerWaalsContact CA-O 3.29Å; L831-V835 WeakPolarHBondContact CA-O 3.5Å; L831-V836 HydrophobicContact CD2-CG2 4.26Å; L831-V836 HydrophobicContact CG-CG2 4.39Å; L831-D875 CarbonylContact O-C 3.6Å; L831-D875 WeakPolarHBondContact O-CA 3.36Å; L831-V876 HydrophobicContact CB-CB 4.43Å; L831-V876 WeakPolarHBondContact CD1-O 3.44Å; L831-V876 PolarHBondContact N-O 2.87Å; L831-V876 PolarHBondContact O-N 3.41Å; L831-E878 HydrophobicContact CD1-CB 3.47Å; L831-E878 VanDerWaalsContact CD1-CB 3.47Å
832	R	91.1	Very high	89.8	Confident	47 Å²	47	62.4 Å²	62.4	18%	0.177	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	128.1	168.1	-175.8	177.6	-63.1	155.8	5.3	107.7	N834 V835 I837 D870 D875	R832-N834 PolarHBondContact O-N 2.82Å; R832-V835 PolarHBondContact N-O 2.8Å; R832-V835 PolarHBondContact O-N 2.76Å; R832-I837 HydrophobicContact CB-CD1 3.2Å; R832-I837 HydrophobicContact CB-CG1 4.16Å; R832-I837 HydrophobicContact CG-CD1 4.13Å; R832-D870 PolarHBondContact NH2-O 3.26Å; R832-D875 WeakPolarHBondContact CB-OD1 3.45Å; R832-D875 WeakPolarHBondContact CG-OD1 3.26Å; R832-D875 IonicContact CZ-OD1 3.63Å; R832-D875 IonicContact CZ-OD2 3.25Å; R832-D875 IonicContact NE-OD1 3.59Å; R832-D875 PolarHBondContact NE-OD1 2.91Å; R832-D875 IonicContact NE-OD2 3.94Å; R832-D875 IonicContact NH2-OD1 2.79Å; R832-D875 IonicContact NH2-OD2 3.82Å; R832-D875 PolarHBondContact NH2-OD2 3.21Å
833	D	86.7	Confident	89.6	Confident	148 Å²	148	65.7 Å²	65.7	79%	0.791	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	51	38.8	-174.3	-53.8	-45.3	0	0	0	112.5	V835	D833-V835 PolarHBondContact O-N 3.35Å
834	N	87.2	Confident	89.6	Confident	150 Å²	150	62.4 Å²	62.4	80%	0.802	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.2	14.2	-175.1	-54.6	-43.7	0	0	0	116.1	R832	R832-N834 PolarHBondContact O-N 2.82Å
835	V	89.2	Confident	89.8	Confident	94 Å²	94	58.6 Å²	58.6	57%	0.57	30%	0.299	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-102.8	129	174.3	-177.7	0	0	0	0	110	L831 R832 D833 I837	L831-V835 VanDerWaalsContact CA-O 3.29Å; L831-V835 WeakPolarHBondContact CA-O 3.5Å; R832-V835 PolarHBondContact N-O 2.8Å; R832-V835 PolarHBondContact O-N 2.76Å; D833-V835 PolarHBondContact O-N 3.35Å; V835-I837 PolarHBondContact O-N 3.21Å
836	V	89.6	Confident	89.9	Confident	64 Å²	64	54.6 Å²	54.6	39%	0.388	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.3	110.8	175.3	-178.1	0	0	0	0	109.2	R829 L831 E839	R829-V836 HydrophobicContact CB-CG1 4.23Å; R829-V836 HydrophobicContact CG-CG1 4.35Å; L831-V836 HydrophobicContact CD2-CG2 4.26Å; L831-V836 HydrophobicContact CG-CG2 4.39Å; V836-E839 HydrophobicContact CG1-CG 3.77Å
837	I	89.4	Confident	89.7	Confident	72 Å²	72	57.2 Å²	57.2	37%	0.369	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	-37.6	177.5	-60.7	166.1	0	0	0	111	V830 R832 V835 Y868	V830-I837 PolarHBondContact O-N 3.25Å; R832-I837 HydrophobicContact CB-CD1 3.2Å; R832-I837 HydrophobicContact CB-CG1 4.16Å; R832-I837 HydrophobicContact CG-CD1 4.13Å; V835-I837 PolarHBondContact O-N 3.21Å; I837-Y868 HydrophobicContact CG2-CE2 4.36Å; I837-Y868 WeakPolarHBondContact CG2-OH 3.42Å
838	Y	89.9	Confident	89.3	Confident	57 Å²	57	63.7 Å²	63.7	22%	0.224	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	135.4	-173.1	-174.4	-105.4	0	0	0	110.8	R829 V830 V865 K866 Y868	R829-Y838 CarbonylContact C-O 3.6Å; R829-Y838 VanDerWaalsContact CA-O 3.31Å; R829-Y838 WeakPolarHBondContact CA-O 3.49Å; V830-Y838 HydrophobicContact CG2-CD1 4.49Å; V830-Y838 PolarHBondContact N-O 2.93Å; Y838-V865 HydrophobicContact CD1-CG1 3.78Å; Y838-V865 HydrophobicContact CE1-CG1 3.62Å; Y838-K866 PolarHBondContact OH-O 3.03Å; Y838-K866 VanDerWaalsContact OH-O 3.06Å; Y838-Y868 HydrophobicContact CD1-CD2 4.22Å; Y838-Y868 AromaticContact CD1-CG 3.93Å; Y838-Y868 HydrophobicContact CD1-CG 3.93Å; Y838-Y868 AromaticContact CD2-CD2 3.78Å; Y838-Y868 HydrophobicContact CD2-CD2 3.78Å; Y838-Y868 HydrophobicContact CD2-CE2 4.43Å; Y838-Y868 HydrophobicContact CD2-CG 4.29Å; Y838-Y868 HydrophobicContact CE1-CG 4.39Å; Y838-Y868 HydrophobicContact CE2-CD2 4.39Å; Y838-Y868 AromaticContact CG-CD2 3.69Å; Y838-Y868 HydrophobicContact CG-CD2 3.69Å; Y838-Y868 HydrophobicContact CG-CE2 4.25Å; Y838-Y868 AromaticContact CG-CG 3.88Å; Y838-Y868 HydrophobicContact CG-CG 3.88Å
839	E	90.2	Very high	88.7	Confident	106 Å²	106	72.7 Å²	72.7	50%	0.495	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	131.7	168.4	-55.1	-167.6	148.5	0	0	108.5	I828 R829 V836	I828-E839 WeakPolarHBondContact O-CA 3.5Å; R829-E839 HydrophobicContact CG-CG 4.16Å; R829-E839 IonicContact CZ-OE1 2.74Å; R829-E839 IonicContact NE-OE1 3.24Å; R829-E839 PolarHBondContact NE-OE1 3.48Å; R829-E839 IonicContact NH2-OE1 3.05Å; R829-E839 PolarHBondContact NH2-OE1 2.83Å; V836-E839 HydrophobicContact CG1-CG 3.77Å
840	G	89.7	Confident	88.5	Confident	19 Å²	19	76.3 Å²	76.3	20%	0.196	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-172.6	-157.8	-178.1	0	0	0	0	0	113.6	P827 I828	P827-G840 WeakPolarHBondContact CA-O 3.46Å; I828-G840 WeakPolarHBondContact CG1-O 3.36Å; I828-G840 PolarHBondContact N-O 3.42Å; I828-G840 PolarHBondContact O-N 2.73Å
841	E	90.2	Very high	88.3	Confident	105 Å²	105	80.4 Å²	80.4	49%	0.491	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	159.1	179.6	-65.2	174.7	164.7	0	0	110.8	K866	E841-K866 HydrophobicContact CB-CD 4.3Å; E841-K866 VanDerWaalsContact O-CB 3.25Å; E841-K866 WeakPolarHBondContact O-CB 3.45Å; E841-K866 PolarHBondContact O-N 3.18Å; E841-K866 IonicContact OE2-NZ 2.93Å; E841-K866 PolarHBondContact OE2-NZ 3.05Å
842	L	87.7	Confident	88.2	Confident	14 Å²	14	80.8 Å²	80.8	7%	0.073	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	127.6	171.3	-68.2	176.6	0	0	0	111.5	V822 K823 I828 I863	V822-L842 HydrophobicContact CG1-CD1 3.99Å; K823-L842 WeakPolarHBondContact O-CD1 3.16Å; I828-L842 HydrophobicContact CD1-CD2 3.54Å; I828-L842 HydrophobicContact CD1-CG 4.18Å; I828-L842 HydrophobicContact CG1-CD2 4.3Å; I828-L842 HydrophobicContact CG1-CG 4.42Å; I828-L842 HydrophobicContact CG2-CD1 4.06Å; I828-L842 HydrophobicContact CG2-CD2 3.99Å; I828-L842 HydrophobicContact CG2-CG 3.7Å; L842-I863 HydrophobicContact CD2-CG2 3.17Å
843	E	88	Confident	88.1	Confident	69 Å²	69	84.2 Å²	84.2	32%	0.322	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	-41.2	173	-170.8	171.7	176.6	0	0	111.2	F809 G864 K866	F809-E843 HydrophobicContact CD1-CG 4.13Å; E843-G864 PolarHBondContact N-O 3.47Å; E843-K866 HydrophobicContact CB-CB 4.06Å
844	S	88	Confident	88.3	Confident	1 Å²	1	81.7 Å²	81.7	1%	0.007	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.5	148.2	176.1	63.3	0	0	0	0	112.1	G864	S844-G864 PolarHBondContact N-O 3.29Å; S844-G864 PolarHBondContact O-N 3.49Å
845	L	90.8	Very high	88.5	Confident	0 Å²	0	74.6 Å²	74.6	0%	0	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	116	174.1	-177.1	66	0	0	0	108.1	V822 R824 V852 V855 C861 I863	V822-L845 HydrophobicContact CG1-CD1 3.69Å; V822-L845 HydrophobicContact CG1-CD2 4.02Å; V822-L845 WeakPolarHBondContact O-CD2 3.5Å; R824-L845 HydrophobicContact CB-CB 4.3Å; R824-L845 HydrophobicContact CB-CD2 4.35Å; R824-L845 HydrophobicContact CG-CB 4.33Å; L845-V852 HydrophobicContact CD2-CG2 4.22Å; L845-V852 HydrophobicContact CG-CG2 3.9Å; L845-V852 PolarHBondContact O-N 2.9Å; L845-V855 HydrophobicContact CD1-CG2 3.97Å; L845-V855 HydrophobicContact CD2-CG2 3.96Å; L845-V855 HydrophobicContact CG-CG2 3.98Å; L845-C861 HydrophobicContact CD1-CB 4.21Å; L845-I863 HydrophobicContact CD1-CD1 4.39Å; L845-I863 HydrophobicContact CD1-CG1 3.83Å
846	R	89.4	Confident	88.6	Confident	77 Å²	77	77.3 Å²	77.3	29%	0.291	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	145.5	-173.9	-72.1	178.9	174.8	-157	-14.2	111.7	D850 D851 C861 G862	R846-D850 CarbonylContact C-O 3.51Å; R846-D850 VanDerWaalsContact CA-O 3.27Å; R846-D850 WeakPolarHBondContact CA-O 3.5Å; R846-D851 WeakPolarHBondContact CG-OD1 3.34Å; R846-D851 IonicContact CZ-OD1 3.59Å; R846-D851 IonicContact NE-OD1 3.51Å; R846-D851 PolarHBondContact NE-OD1 3.25Å; R846-D851 IonicContact NH2-OD1 2.82Å; R846-D851 PolarHBondContact NH2-OD1 3.35Å; R846-D851 VanDerWaalsContact NH2-OD1 3.17Å; R846-D851 IonicContact NH2-OD2 2.67Å; R846-D851 PolarHBondContact NH2-OD2 3.33Å; R846-C861 CarbonylContact O-C 3.52Å; R846-C861 VanDerWaalsContact O-CA 3.26Å; R846-C861 WeakPolarHBondContact O-CA 3.47Å; R846-C861 WeakPolarHBondContact O-CB 3.39Å; R846-G862 PolarHBondContact N-O 2.99Å; R846-G862 PolarHBondContact O-N 2.85Å
847	R	86.5	Confident	88.6	Confident	76 Å²	76	78.6 Å²	78.6	29%	0.287	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	119.4	162.5	-70	-169	76.7	-149.9	0.9	108.5	K849 D850 V852 V855 M859 E860 C861	R847-K849 PolarHBondContact O-N 3.29Å; R847-D850 PolarHBondContact N-O 2.86Å; R847-D850 PolarHBondContact O-N 2.93Å; R847-V852 HydrophobicContact CB-CG1 4.16Å; R847-V852 HydrophobicContact CG-CG1 4.17Å; R847-V852 HydrophobicContact CG-CG2 3.95Å; R847-V855 HydrophobicContact CG-CG2 3.97Å; R847-M859 PolarHBondContact NH1-SD 3.2Å; R847-E860 PolarHBondContact NE-O 3.26Å; R847-C861 HydrophobicContact CG-CB 4.22Å
848	F	81.8	Confident	88.6	Confident	174 Å²	174	77.7 Å²	77.7	76%	0.763	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.7	-96.2	-173.3	-55	-77.3	0	0	0	112.2
849	K	80.9	Confident	88.6	Confident	190 Å²	190	78.2 Å²	78.2	83%	0.826	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	-114.4	-6.3	179.9	-67.4	-177	179.4	178.9	0	114.3	R847	R847-K849 PolarHBondContact O-N 3.29Å
850	D	87.8	Confident	88.6	Confident	116 Å²	116	78.1 Å²	78.1	62%	0.62	38%	0.382	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-101.8	135.1	-173.1	-58.1	-33	0	0	0	110.9	R846 R847	R846-D850 CarbonylContact C-O 3.51Å; R846-D850 VanDerWaalsContact CA-O 3.27Å; R846-D850 WeakPolarHBondContact CA-O 3.5Å; R847-D850 PolarHBondContact N-O 2.86Å; R847-D850 PolarHBondContact O-N 2.93Å
851	D	88.4	Confident	88.6	Confident	86 Å²	86	77.5 Å²	77.5	46%	0.46	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72	123.8	169.4	-74	-47.2	0	0	0	108.7	R846	R846-D851 WeakPolarHBondContact CG-OD1 3.34Å; R846-D851 IonicContact CZ-OD1 3.59Å; R846-D851 IonicContact NE-OD1 3.51Å; R846-D851 PolarHBondContact NE-OD1 3.25Å; R846-D851 IonicContact NH2-OD1 2.82Å; R846-D851 PolarHBondContact NH2-OD1 3.35Å; R846-D851 VanDerWaalsContact NH2-OD1 3.17Å; R846-D851 IonicContact NH2-OD2 2.67Å; R846-D851 PolarHBondContact NH2-OD2 3.33Å
852	V	89.7	Confident	88.6	Confident	31 Å²	31	73.3 Å²	73.3	19%	0.188	36%	0.36	C	S	.	.			trans	-120	151.2	-178.3	-62.8	0	0	0	0	111	L845 R847 V855	L845-V852 HydrophobicContact CD2-CG2 4.22Å; L845-V852 HydrophobicContact CG-CG2 3.9Å; L845-V852 PolarHBondContact O-N 2.9Å; R847-V852 HydrophobicContact CB-CG1 4.16Å; R847-V852 HydrophobicContact CG-CG1 4.17Å; R847-V852 HydrophobicContact CG-CG2 3.95Å; V852-V855 HydrophobicContact CG2-CG2 3.6Å
853	N	89.6	Confident	88.7	Confident	119 Å²	119	72.6 Å²	72.6	64%	0.636	36%	0.356	S	S	*	.	S	Bend	trans	-86.3	-34	178.1	-69.3	-19.7	0	0	0	112.5	R824	R824-N853 PolarHBondContact N-O 3Å
854	E	90.4	Very high	88.7	Confident	95 Å²	95	69.3 Å²	69.3	44%	0.444	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	147.5	-180	61.2	173	-149	0	0	111.8	V821 V822 R856	V821-E854 HydrophobicContact CG1-CB 3.92Å; V822-E854 CarbonylContact O-C 3.44Å; V822-E854 VanDerWaalsContact O-CA 3.27Å; V822-E854 WeakPolarHBondContact O-CA 3.22Å; E854-R856 IonicContact OE1-NE 3.31Å; E854-R856 IonicContact OE1-NH2 3.76Å
855	V	91.5	Very high	88.8	Confident	1 Å²	1	69.4 Å²	69.4	1%	0.006	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	125.2	174.4	-177.3	0	0	0	0	109	V817 V821 V822 L845 R847 V852 M859 C861	V817-V855 HydrophobicContact CG2-CB 4.15Å; V817-V855 HydrophobicContact CG2-CG1 3.63Å; V821-V855 VanDerWaalsContact CA-O 3.32Å; V821-V855 WeakPolarHBondContact CA-O 3.44Å; V821-V855 WeakPolarHBondContact CG1-O 3.46Å; V822-V855 HydrophobicContact CB-CB 4.48Å; V822-V855 PolarHBondContact N-O 3.2Å; V822-V855 PolarHBondContact O-N 2.85Å; L845-V855 HydrophobicContact CD1-CG2 3.97Å; L845-V855 HydrophobicContact CD2-CG2 3.96Å; L845-V855 HydrophobicContact CG-CG2 3.98Å; R847-V855 HydrophobicContact CG-CG2 3.97Å; V852-V855 HydrophobicContact CG2-CG2 3.6Å; V855-M859 HydrophobicContact CG1-CB 3.79Å; V855-C861 HydrophobicContact CB-CB 4.28Å; V855-C861 HydrophobicContact CG1-CB 3.92Å; V855-C861 HydrophobicContact CG2-CB 3.7Å
856	R	91	Very high	88.6	Confident	151 Å²	151	73.6 Å²	73.6	57%	0.57	36%	0.36	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86.7	160.5	-178	-61.8	-176.4	-178.2	-173.1	-0.9	112	E854 M859	E854-R856 IonicContact OE1-NE 3.31Å; E854-R856 IonicContact OE1-NH2 3.76Å; R856-M859 HydrophobicContact CB-SD 4.4Å; R856-M859 WeakPolarHBondContact O-CB 3.32Å; R856-M859 PolarHBondContact O-N 3.03Å
857	N	90.3	Very high	88.5	Confident	92 Å²	92	76.6 Å²	76.6	49%	0.492	38%	0.381	S	S	.	.	T	Hydrogen-bonded Turn	trans	-46	137	173.5	-170.1	-6.1	0	0	0	113	V817 T818 G820 M859	V817-N857 PolarHBondContact O-OD1 2.77Å; T818-N857 PolarHBondContact O-ND2 3.04Å; T818-N857 PolarHBondContact O-OD1 2.82Å; G820-N857 PolarHBondContact O-N 3.11Å; N857-M859 VanDerWaalsContact C-N 3.27Å; N857-M859 PolarHBondContact O-N 3.33Å
858	G	88.1	Confident	88.4	Confident	52 Å²	52	74.3 Å²	74.3	54%	0.536	37%	0.373	S	S	.	.	T	Hydrogen-bonded Turn	trans	83	-1.6	177.5	0	0	0	0	0	114.1	V817	V817-G858 PolarHBondContact O-N 3Å
859	M	90.1	Very high	88.4	Confident	69 Å²	69	71 Å²	71	34%	0.34	36%	0.363	S	S	.	.			trans	-99.2	143.7	178.9	-61.1	-172.3	-178.5	0	0	111.7	V817 R847 V855 R856 N857	V817-M859 PolarHBondContact N-O 3.13Å; V817-M859 VanDerWaalsContact N-O 3.17Å; R847-M859 PolarHBondContact NH1-SD 3.2Å; V855-M859 HydrophobicContact CG1-CB 3.79Å; R856-M859 HydrophobicContact CB-SD 4.4Å; R856-M859 WeakPolarHBondContact O-CB 3.32Å; R856-M859 PolarHBondContact O-N 3.03Å; N857-M859 VanDerWaalsContact C-N 3.27Å; N857-M859 PolarHBondContact O-N 3.33Å
860	E	90.4	Very high	88.7	Confident	103 Å²	103	65.8 Å²	65.8	48%	0.481	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	140.5	171.6	-62.9	179	169	0	0	111	C815 M816 R847	C815-E860 WeakPolarHBondContact O-CA 3.38Å; M816-E860 HydrophobicContact CE-CG 3.64Å; M816-E860 WeakPolarHBondContact CE-OE1 3.19Å; R847-E860 PolarHBondContact NE-O 3.26Å
861	C	89.3	Confident	88.6	Confident	7 Å²	7	60.7 Å²	60.7	5%	0.047	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.6	151.5	176.3	57.3	0	0	0	0	112.3	C815 L845 R846 R847 V855	C815-C861 PolarHBondContact N-O 3.43Å; C815-C861 PolarHBondContact O-N 3.45Å; C815-C861 VanDerWaalsContact O-O 3.11Å; L845-C861 HydrophobicContact CD1-CB 4.21Å; R846-C861 CarbonylContact O-C 3.52Å; R846-C861 VanDerWaalsContact O-CA 3.26Å; R846-C861 WeakPolarHBondContact O-CA 3.47Å; R846-C861 WeakPolarHBondContact O-CB 3.39Å; R847-C861 HydrophobicContact CG-CB 4.22Å; V855-C861 HydrophobicContact CB-CB 4.28Å; V855-C861 HydrophobicContact CG1-CB 3.92Å; V855-C861 HydrophobicContact CG2-CB 3.7Å
862	G	90	Very high	88.6	Confident	16 Å²	16	62.8 Å²	62.8	17%	0.165	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	122.8	167.3	0	0	0	0	0	110.3	A813 R846	A813-G862 WeakPolarHBondContact O-CA 3.4Å; R846-G862 PolarHBondContact N-O 2.99Å; R846-G862 PolarHBondContact O-N 2.85Å
863	I	90.4	Very high	88.6	Confident	0 Å²	0	65.8 Å²	65.8	0%	0	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	119.2	-178.9	-58.3	-172.4	0	0	0	108.6	A798 A813 C815 V822 L842 L845 I877	A798-I863 HydrophobicContact CB-CD1 3.9Å; A813-I863 PolarHBondContact N-O 3.18Å; A813-I863 PolarHBondContact O-N 2.96Å; C815-I863 HydrophobicContact CB-CD1 3.91Å; C815-I863 HydrophobicContact CB-CG1 4.26Å; V822-I863 HydrophobicContact CG1-CD1 4.06Å; V822-I863 HydrophobicContact CG2-CD1 4.49Å; L842-I863 HydrophobicContact CD2-CG2 3.17Å; L845-I863 HydrophobicContact CD1-CD1 4.39Å; L845-I863 HydrophobicContact CD1-CG1 3.83Å; I863-I877 HydrophobicContact CB-CD1 4.22Å; I863-I877 HydrophobicContact CD1-CD1 4.32Å; I863-I877 HydrophobicContact CG2-CD1 3.9Å
864	G	88.8	Confident	88.6	Confident	0 Å²	0	62.3 Å²	62.3	0%	0	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	125.1	168.4	0	0	0	0	0	110	E843 S844	E843-G864 PolarHBondContact N-O 3.47Å; S844-G864 PolarHBondContact N-O 3.29Å; S844-G864 PolarHBondContact O-N 3.49Å
865	V	89.5	Confident	88.8	Confident	3 Å²	3	58 Å²	58	2%	0.018	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	125.6	178.2	-176.4	0	0	0	0	109.3	I828 V830 Y838 N867 Y868 V871 I877	I828-V865 HydrophobicContact CD1-CB 4.28Å; I828-V865 HydrophobicContact CD1-CG1 3.77Å; I828-V865 HydrophobicContact CD1-CG2 3.76Å; V830-V865 HydrophobicContact CG2-CG2 4.32Å; Y838-V865 HydrophobicContact CD1-CG1 3.78Å; Y838-V865 HydrophobicContact CE1-CG1 3.62Å; V865-N867 PolarHBondContact O-N 3.39Å; V865-Y868 HydrophobicContact CG1-CD1 4.45Å; V865-Y868 HydrophobicContact CG1-CG 4.47Å; V865-Y868 PolarHBondContact O-N 2.95Å; V865-V871 HydrophobicContact CG2-CG2 4.38Å; V865-I877 HydrophobicContact CG2-CD1 4.31Å
866	K	87.6	Confident	88.8	Confident	88 Å²	88	60 Å²	60	38%	0.383	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.5	132.6	-177.8	-168	-175.8	-173.2	-176.1	0	110	Y838 E841 E843 Y868	Y838-K866 PolarHBondContact OH-O 3.03Å; Y838-K866 VanDerWaalsContact OH-O 3.06Å; E841-K866 HydrophobicContact CB-CD 4.3Å; E841-K866 VanDerWaalsContact O-CB 3.25Å; E841-K866 WeakPolarHBondContact O-CB 3.45Å; E841-K866 PolarHBondContact O-N 3.18Å; E841-K866 IonicContact OE2-NZ 2.93Å; E841-K866 PolarHBondContact OE2-NZ 3.05Å; E843-K866 HydrophobicContact CB-CB 4.06Å; K866-Y868 PolarHBondContact O-N 2.67Å
867	N	85.7	Confident	88.9	Confident	139 Å²	139	52.8 Å²	52.8	74%	0.743	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.3	13	178.5	-59.8	-27.9	0	0	0	116	V865	V865-N867 PolarHBondContact O-N 3.39Å
868	Y	84.4	Confident	89	Confident	29 Å²	29	49.3 Å²	49.3	11%	0.114	28%	0.275	C	S	.	.			trans	-132.1	115.5	179.5	-171.8	-100.6	0	0	0	111.4	V830 I837 Y838 V865 K866 D870 V871	V830-Y868 HydrophobicContact CG1-CE1 4.39Å; I837-Y868 HydrophobicContact CG2-CE2 4.36Å; I837-Y868 WeakPolarHBondContact CG2-OH 3.42Å; Y838-Y868 HydrophobicContact CD1-CD2 4.22Å; Y838-Y868 AromaticContact CD1-CG 3.93Å; Y838-Y868 HydrophobicContact CD1-CG 3.93Å; Y838-Y868 AromaticContact CD2-CD2 3.78Å; Y838-Y868 HydrophobicContact CD2-CD2 3.78Å; Y838-Y868 HydrophobicContact CD2-CE2 4.43Å; Y838-Y868 HydrophobicContact CD2-CG 4.29Å; Y838-Y868 HydrophobicContact CE1-CG 4.39Å; Y838-Y868 HydrophobicContact CE2-CD2 4.39Å; Y838-Y868 AromaticContact CG-CD2 3.69Å; Y838-Y868 HydrophobicContact CG-CD2 3.69Å; Y838-Y868 HydrophobicContact CG-CE2 4.25Å; Y838-Y868 AromaticContact CG-CG 3.88Å; Y838-Y868 HydrophobicContact CG-CG 3.88Å; V865-Y868 HydrophobicContact CG1-CD1 4.45Å; V865-Y868 HydrophobicContact CG1-CG 4.47Å; V865-Y868 PolarHBondContact O-N 2.95Å; K866-Y868 PolarHBondContact O-N 2.67Å; Y868-D870 PolarHBondContact OH-O 2.82Å; Y868-V871 HydrophobicContact CD1-CG2 3.74Å; Y868-V871 HydrophobicContact CE1-CG2 3.85Å
869	N	83.1	Confident	89.2	Confident	104 Å²	104	46.8 Å²	46.8	56%	0.556	25%	0.25	S	C	*	.			trans	-111.6	-7.5	-174.7	-74.1	-50.4	0	0	0	114.7	A811 V871	A811-N869 HydrophobicContact CB-CB 4.43Å; A811-N869 VanDerWaalsContact CB-O 3.22Å; A811-N869 WeakPolarHBondContact CB-O 3.49Å; A811-N869 PolarHBondContact N-OD1 3.21Å; N869-V871 VanDerWaalsContact C-N 3.33Å; N869-V871 PolarHBondContact O-N 2.66Å
870	D	86.9	Confident	89.2	Confident	81 Å²	81	44 Å²	44	43%	0.433	24%	0.236	S	C	.	.			trans	-95	45.9	-177.8	-170.2	33.4	0	0	0	112.5	R832 Y868 R872	R832-D870 PolarHBondContact NH2-O 3.26Å; Y868-D870 PolarHBondContact OH-O 2.82Å; D870-R872 IonicContact OD1-NE 2.66Å; D870-R872 IonicContact OD1-NH2 3.51Å; D870-R872 IonicContact OD2-CZ 2.75Å; D870-R872 IonicContact OD2-NE 3.4Å; D870-R872 IonicContact OD2-NH2 3.8Å; D870-R872 PolarHBondContact OD2-NH2 3.24Å
871	V	86.1	Confident	89.2	Confident	9 Å²	9	42.7 Å²	42.7	6%	0.055	23%	0.229	C	C	.	.			trans	-76.7	132.9	171.9	-169.4	0	0	0	0	109	V800 V803 A813 V865 Y868 N869 D875	V800-V871 HydrophobicContact CB-CG1 4.41Å; V800-V871 HydrophobicContact CG1-CG1 4.02Å; V800-V871 HydrophobicContact CG2-CG1 3.79Å; V803-V871 WeakPolarHBondContact CG2-O 3.46Å; A813-V871 HydrophobicContact CB-CG1 3.89Å; V865-V871 HydrophobicContact CG2-CG2 4.38Å; Y868-V871 HydrophobicContact CD1-CG2 3.74Å; Y868-V871 HydrophobicContact CE1-CG2 3.85Å; N869-V871 VanDerWaalsContact C-N 3.33Å; N869-V871 PolarHBondContact O-N 2.66Å; V871-D875 HydrophobicContact CG1-CB 4.4Å
872	R	88.6	Confident	89.1	Confident	130 Å²	130	46.5 Å²	46.5	49%	0.491	25%	0.249	S	C	.	.			trans	-115.7	159.6	179.9	-64.5	-177.2	-168.9	177	5.7	111.4	V800 D870 G874 D875	V800-R872 WeakPolarHBondContact CG1-O 3.49Å; D870-R872 IonicContact OD1-NE 2.66Å; D870-R872 IonicContact OD1-NH2 3.51Å; D870-R872 IonicContact OD2-CZ 2.75Å; D870-R872 IonicContact OD2-NE 3.4Å; D870-R872 IonicContact OD2-NH2 3.8Å; D870-R872 PolarHBondContact OD2-NH2 3.24Å; R872-G874 PolarHBondContact O-N 3.17Å; R872-D875 PolarHBondContact N-OD2 2.86Å; R872-D875 WeakPolarHBondContact O-CB 3.46Å; R872-D875 PolarHBondContact O-N 3.26Å
873	T	89.8	Confident	88.8	Confident	94 Å²	94	48.6 Å²	48.6	58%	0.577	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.3	130.5	173.1	54.3	0	0	0	0	109.9	R801 V803	R801-T873 WeakPolarHBondContact O-CG2 3.34Å; V803-T873 HydrophobicContact CG2-CG2 4.35Å
874	G	89.7	Confident	88.4	Confident	46 Å²	46	55.3 Å²	55.3	47%	0.474	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	95	-5.2	-173.2	0	0	0	0	0	114.7	V800 R872	V800-G874 PolarHBondContact O-N 3.34Å; R872-G874 PolarHBondContact O-N 3.17Å
875	D	93.3	Very high	87.9	Confident	3 Å²	3	59 Å²	59	2%	0.016	31%	0.305	C	S	.	.			trans	-68.7	149.6	170.5	-68	-12.8	0	0	0	110.2	V800 V830 L831 R832 V871 R872	V800-D875 HydrophobicContact CB-CB 4.4Å; V800-D875 WeakPolarHBondContact CB-O 3.45Å; V800-D875 HydrophobicContact CG2-CB 4.07Å; V800-D875 VanDerWaalsContact CG2-O 3.3Å; V800-D875 WeakPolarHBondContact CG2-O 3.39Å; V800-D875 PolarHBondContact N-O 3.07Å; V830-D875 HydrophobicContact CG1-CB 4.21Å; L831-D875 CarbonylContact O-C 3.6Å; L831-D875 WeakPolarHBondContact O-CA 3.36Å; R832-D875 WeakPolarHBondContact CB-OD1 3.45Å; R832-D875 WeakPolarHBondContact CG-OD1 3.26Å; R832-D875 IonicContact CZ-OD1 3.63Å; R832-D875 IonicContact CZ-OD2 3.25Å; R832-D875 IonicContact NE-OD1 3.59Å; R832-D875 PolarHBondContact NE-OD1 2.91Å; R832-D875 IonicContact NE-OD2 3.94Å; R832-D875 IonicContact NH2-OD1 2.79Å; R832-D875 IonicContact NH2-OD2 3.82Å; R832-D875 PolarHBondContact NH2-OD2 3.21Å; V871-D875 HydrophobicContact CG1-CB 4.4Å; R872-D875 PolarHBondContact N-OD2 2.86Å; R872-D875 WeakPolarHBondContact O-CB 3.46Å; R872-D875 PolarHBondContact O-N 3.26Å
876	V	92.3	Very high	87.2	Confident	43 Å²	43	66.8 Å²	66.8	26%	0.261	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	124.4	175.4	-178.7	0	0	0	0	108.7	L797 L831	L797-V876 HydrophobicContact CB-CG1 4.39Å; L797-V876 HydrophobicContact CD2-CG1 4.17Å; L831-V876 HydrophobicContact CB-CB 4.43Å; L831-V876 WeakPolarHBondContact CD1-O 3.44Å; L831-V876 PolarHBondContact N-O 2.87Å; L831-V876 PolarHBondContact O-N 3.41Å
877	I	92.2	Very high	86.5	Confident	0 Å²	0	67.1 Å²	67.1	0%	0	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	112	174	-56.6	-179.7	0	0	0	107.9	A798 V800 A813 I828 R829 I863 V865	A798-I877 HydrophobicContact CB-CB 4.44Å; A798-I877 PolarHBondContact N-O 2.84Å; A798-I877 PolarHBondContact O-N 3.21Å; V800-I877 HydrophobicContact CG2-CD1 3.95Å; V800-I877 HydrophobicContact CG2-CG1 3.96Å; A813-I877 HydrophobicContact CB-CD1 4.15Å; I828-I877 HydrophobicContact CB-CG2 4.21Å; I828-I877 HydrophobicContact CD1-CG2 4.1Å; I828-I877 HydrophobicContact CG2-CG2 4.36Å; R829-I877 CarbonylContact O-C 3.57Å; R829-I877 WeakPolarHBondContact O-CA 3.42Å; I863-I877 HydrophobicContact CB-CD1 4.22Å; I863-I877 HydrophobicContact CD1-CD1 4.32Å; I863-I877 HydrophobicContact CG2-CD1 3.9Å; V865-I877 HydrophobicContact CG2-CD1 4.31Å
878	E	92.5	Very high	85.7	Confident	19 Å²	19	66.4 Å²	66.4	9%	0.089	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	128.4	174.7	-178.8	-170.5	143.8	0	0	109.4	I794 L797 I828 R829 L831	I794-E878 HydrophobicContact CD1-CG 4.21Å; I794-E878 VanDerWaalsContact CD1-OE1 3.29Å; I794-E878 WeakPolarHBondContact CD1-OE1 3.36Å; I794-E878 HydrophobicContact CG1-CG 4.21Å; I794-E878 VanDerWaalsContact CG1-OE1 3.25Å; I794-E878 WeakPolarHBondContact CG1-OE1 3.27Å; I794-E878 HydrophobicContact CG2-CG 3.7Å; L797-E878 HydrophobicContact CD2-CB 3.8Å; L797-E878 HydrophobicContact CD2-CG 3.79Å; I828-E878 CarbonylContact C-O 3.59Å; I828-E878 WeakPolarHBondContact CA-O 3.47Å; I828-E878 WeakPolarHBondContact CB-O 3.46Å; R829-E878 HydrophobicContact CB-CB 4.27Å; R829-E878 PolarHBondContact N-O 3.25Å; R829-E878 PolarHBondContact O-N 2.85Å; L831-E878 HydrophobicContact CD1-CB 3.47Å; L831-E878 VanDerWaalsContact CD1-CB 3.47Å
879	V	92.1	Very high	84.9	Confident	0 Å²	0	66.2 Å²	66.2	0%	0	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	123.1	173.4	-176	0	0	0	0	107.6	I795 G796 V822 N826 I828	I795-V879 HydrophobicContact CD1-CG1 4.41Å; I795-V879 PolarHBondContact N-O 3.49Å; G796-V879 PolarHBondContact N-O 2.95Å; G796-V879 PolarHBondContact O-N 3.48Å; V822-V879 HydrophobicContact CB-CG2 4.18Å; V822-V879 HydrophobicContact CG1-CG2 3.86Å; V822-V879 HydrophobicContact CG2-CG2 3.98Å; N826-V879 HydrophobicContact CB-CG1 3.58Å; I828-V879 HydrophobicContact CG2-CB 4.29Å; I828-V879 HydrophobicContact CG2-CG1 4.34Å; I828-V879 HydrophobicContact CG2-CG2 3.78Å
880	F	91.3	Very high	83.6	Confident	10 Å²	10	67.9 Å²	67.9	4%	0.044	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	153	179.6	65.3	-83.1	0	0	0	111.3	Q792 Q793 P827 R829 I882	Q792-F880 HydrophobicContact CB-CD2 3.98Å; Q792-F880 HydrophobicContact CG-CD2 3.86Å; Q792-F880 HydrophobicContact CG-CE2 4.03Å; Q793-F880 CarbonylContact O-C 3.53Å; Q793-F880 VanDerWaalsContact O-CA 3.23Å; Q793-F880 WeakPolarHBondContact O-CA 3.26Å; Q793-F880 WeakPolarHBondContact O-CB 3.29Å; P827-F880 HydrophobicContact CB-CE1 3.95Å; P827-F880 HydrophobicContact CB-CE2 3.98Å; P827-F880 HydrophobicContact CB-CZ 3.62Å; P827-F880 VanDerWaalsContact CD-O 3.27Å; P827-F880 WeakPolarHBondContact CD-O 3.34Å; P827-F880 HydrophobicContact CG-CD2 3.89Å; P827-F880 HydrophobicContact CG-CE1 4.23Å; P827-F880 HydrophobicContact CG-CE2 3.57Å; P827-F880 HydrophobicContact CG-CG 4.38Å; P827-F880 HydrophobicContact CG-CZ 3.77Å; P827-F880 WeakPolarHBondContact CG-O 3.29Å; P827-F880 PolarHBondContact O-N 2.78Å; P827-F880 VanDerWaalsContact O-N 3.09Å; R829-F880 HydrophobicContact CG-CD1 3.93Å; R829-F880 HydrophobicContact CG-CE1 3.51Å; R829-F880 HydrophobicContact CG-CZ 4.47Å; F880-I882 HydrophobicContact CD2-CG1 4.46Å; F880-I882 HydrophobicContact CE2-CG1 4.27Å
881	E	89.6	Confident	83.4	Confident	75 Å²	75	67.2 Å²	67.2	35%	0.35	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	141.5	169.9	-172.7	159.5	-172	0	0	108.5	Q792 Q793 I795 I883	Q792-E881 WeakPolarHBondContact CA-O 3.33Å; Q793-E881 PolarHBondContact N-O 2.83Å; Q793-E881 PolarHBondContact O-N 2.86Å; I795-E881 HydrophobicContact CD1-CB 3.53Å; I795-E881 HydrophobicContact CG1-CB 3.88Å; E881-I883 HydrophobicContact CG-CG1 4.25Å
882	I	86.4	Confident	83.3	Confident	88 Å²	88	70.3 Å²	70.3	45%	0.451	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	109.9	172	-56	172.5	0	0	0	105.7	L790 F880	L790-I882 HydrophobicContact CB-CG2 3.91Å; L790-I882 HydrophobicContact CD2-CG2 3.82Å; L790-I882 HydrophobicContact CG-CG2 4.3Å; F880-I882 HydrophobicContact CD2-CG1 4.46Å; F880-I882 HydrophobicContact CE2-CG1 4.27Å
883	I	85.3	Confident	83	Confident	59 Å²	59	66.9 Å²	66.9	30%	0.303	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	128.2	174.7	-62.3	175.5	0	0	0	107.8	K791 Q793 E881 I885	K791-I883 PolarHBondContact N-O 3.03Å; K791-I883 PolarHBondContact O-N 2.79Å; Q793-I883 HydrophobicContact CB-CD1 3.86Å; E881-I883 HydrophobicContact CG-CG1 4.25Å; I883-I885 HydrophobicContact CG2-CG1 4.24Å; I883-I885 PolarHBondContact O-N 3.26Å
884	E	80.6	Confident	82.6	Confident	142 Å²	142	65.4 Å²	65.4	66%	0.664	37%	0.366	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77.7	111.7	169.7	-70.5	175.8	-172.2	0	0	109	P788 L790	P788-E884 HydrophobicContact CB-CB 4.01Å; P788-E884 HydrophobicContact CB-CG 4.44Å; P788-E884 HydrophobicContact CG-CB 4.32Å; P788-E884 HydrophobicContact CG-CG 4.27Å; L790-E884 HydrophobicContact CD2-CG 3.69Å
885	I	80	Confident	82.1	Confident	77 Å²	77	66.6 Å²	66.6	40%	0.395	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	122.5	172	-58.2	178.4	0	0	0	107.8	P788 E789 K791 I883 R887	P788-I885 CarbonylContact C-O 3.51Å; P788-I885 WeakPolarHBondContact CA-O 3.42Å; E789-I885 PolarHBondContact N-O 3.06Å; E789-I885 PolarHBondContact O-N 3.25Å; K791-I885 HydrophobicContact CB-CD1 3.68Å; K791-I885 HydrophobicContact CB-CG1 4.31Å; K791-I885 HydrophobicContact CD-CD1 3.62Å; K791-I885 HydrophobicContact CG-CD1 4.29Å; I883-I885 HydrophobicContact CG2-CG1 4.24Å; I883-I885 PolarHBondContact O-N 3.26Å; I885-R887 PolarHBondContact O-N 3.48Å
886	Q	73.6	Confident	81.4	Confident	166 Å²	166	70.8 Å²	70.8	78%	0.776	38%	0.382	S	S	*	.	P	Polyproline II helix	trans	-64.5	127.3	173.3	-69.9	-179.1	-9.8	0	0	109.9
887	R	72.4	Confident	80.6	Confident	95 Å²	95	72.8 Å²	72.8	36%	0.358	39%	0.391	S	S	.	.	P	Polyproline II helix	trans	-74.1	139.5	173.3	-73.2	-178.2	171.5	175.4	1.7	109.8	E715 L786 E789 I885	E715-R887 IonicContact OE1-NH1 3.54Å; E715-R887 IonicContact OE2-NH1 3.96Å; L786-R887 HydrophobicContact CB-CB 4.3Å; L786-R887 HydrophobicContact CD1-CB 4.07Å; E789-R887 HydrophobicContact CB-CG 4.18Å; E789-R887 IonicContact OE2-NE 3.17Å; I885-R887 PolarHBondContact O-N 3.48Å
888	T	68.7	Low	79.7	Confident	124 Å²	124	78.4 Å²	78.4	76%	0.761	42%	0.421	S	S	*	.			trans	-109.3	132.8	168.8	50.8	0	0	0	0	109.3
889	I	67.6	Low	78.7	Confident	25 Å²	25	83.3 Å²	83.3	13%	0.128	45%	0.448	C	S	.	.			trans	-65	136	170.3	-61.5	171.9	0	0	0	108.2	K779 M782 S783 L786	K779-I889 WeakPolarHBondContact CE-O 3.15Å; K779-I889 HydrophobicContact CG-CB 4.08Å; K779-I889 HydrophobicContact CG-CG2 4.39Å; K779-I889 PolarHBondContact NZ-O 2.9Å; M782-I889 HydrophobicContact CB-CD1 3.42Å; M782-I889 VanDerWaalsContact CB-CD1 3.42Å; M782-I889 HydrophobicContact CE-CD1 3.66Å; M782-I889 HydrophobicContact CG-CD1 4.44Å; M782-I889 HydrophobicContact SD-CD1 4.24Å; S783-I889 PolarHBondContact OG-N 2.92Å; L786-I889 HydrophobicContact CD1-CD1 4.2Å; L786-I889 HydrophobicContact CD1-CG1 3.61Å
890	A	56.4	Low	77.4	Confident	139 Å²	139	90.9 Å²	90.9	100%	1.149	49%	0.489	S	S	*	.			trans	-65.5	0	-179.6	0	0	0	0	0	112.6	K779	K779-A890 WeakPolarHBondContact CE-O 3.37Å; K779-A890 PolarHBondContact NZ-O 2.93Å; K779-A890 PolarHBondContact NZ-OXT 3.38Å

Retrieved 890 of 890 residues in 3741.3 ms (Link to these results)

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