A0A5K4EN81_SCHMA Loading...

Dynamin-associated protein, putative

AlphaFold DB , UniProt , Accession A0A5K4EN81, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,150 aa.

						>A0A5K4EN81_SCHMA|A0A5K4EN81
MSEWDRWVITTDDRVKHDAQFQFLKPVGGYITGDQARVFFMKSGLSVMVLGQIWALADMDMDGKMDKKEFSIAMFLIKKTLEGLPLPSTLPPGLKNDPQPAFITSGVTLSLSLVSDSGNNGLSSVSSIGQDSNSASTAYQDWIITSTNRPRYRLLFNQHDRNKRGFLTGVEARSILSQYGLPNPILAHIWNLADLNKNGNLNCDEFCIAIFLIEKAISGSQLPNTLPSGLLPSNQPRTFGHTSPSVTAKEDNESKENKSSLSFEDKRRENFRQGQAELDRRKQELAEKMRLDEEIRLENERLEREKQQKLRMEKERQQAAEAEKQAELSRQLEAQREQRRRQAVEQRMKAARDLEKQRQIESERIRTDALLKERNHMQTLLEQAVAHRASLLESASSQQQRLLELDSRLNVAQTEVDSHKTSINEMRSKRDAYERDIRDMTEQVEAAKAELTHWQREKEQLSLRMAAGVDMNPVMEQYKTLQSMREARIKTIEQLRNKLNELDQNMTQQGHELATRRNKIDDSQDRVTRTMLDLVDLRHSVEQKMQAYKLKRKSTDLSTSTSTTIESTQKELYEAMFDFTARHPDELSFTTGTLIDVFVNAPINVGPGWLYGQINDKVGLFPETYVRKKVDGKIDPFDPFGVHKITNTCVSSIMMTTTTIPTTINTPNTFSAINTNNSLTEPANDNLVASETTPTTKLNDITFPNNDFYGEVQQNWNVSMSTITLPENILTDQFLTLTVDDHVKITKENDNNKEWYFGEITDKSGIVNKGWFPACCLKPSTKSNTSNINQNGLNISSSSNSSSKQPDILFSCIALYPYESNVPGDLNLSVGDLIRVCVIKDDWWEGICERTKLKGLFPANYVRKLSSEETRSMEEKLDISGSTNNQMDHNDTINPPSLSKITPISSPKLMEANLNNCMASLLSSSNTSSTSSSGVIVCTQPEFARVIAPYKATSAGQLTLQPGQVVQLRKRSPKGWWEGELQQRGHIRQIGWFPADFVRLITPLTVNGSSNSSDQKLLSKLISPTNNQIENTPTSLKALASKAITTSNSFNDNSVQSQQTQSNRVEMMQTIFSYKAVHADELTFEEGAIITVLGRDEPEWWRGRLQNSGAEGLFPVNYVRPYNPPSQTEKSSNSVNQHPIVSAQIINTDQ
					

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	36.6	Very low	65	Low	230 Å²	230	100.2 Å²	100.2	100%	1.133	49%	0.493	S	S	*	.				0	143.3	0	-76.5	160.9	170.1	0	0	107.3
2	S	44.7	Very low	66.1	Low	80 Å²	80	101.1 Å²	101.1	56%	0.559	50%	0.501	S	S	*	.			trans	-87.5	159	-144.3	-58.7	0	0	0	0	112.3	W4 D5	S2-W4 PolarHBondContact O-N 3.1Å; S2-D5 PolarHBondContact N-OD2 3.41Å; S2-D5 VanDerWaalsContact N-OD2 3.15Å; S2-D5 PolarHBondContact O-N 2.95Å; S2-D5 VanDerWaalsContact O-N 3.12Å
3	E	51.4	Low	67.7	Low	144 Å²	144	94.5 Å²	94.5	67%	0.673	47%	0.469	S	S	*	.	G	3₁₀ helix	trans	-55.7	-20.6	176	-66.3	177.1	102.3	0	0	113.5	R6	E3-R6 PolarHBondContact O-N 3.25Å
4	W	54.1	Low	69.2	Low	168 Å²	168	89.9 Å²	89.9	64%	0.636	44%	0.443	S	S	*	.	G	3₁₀ helix	trans	-71.3	-28	-176.5	-62	46	0	0	0	112	S2 R6 W7 P92	S2-W4 PolarHBondContact O-N 3.1Å; W4-R6 PolarHBondContact O-N 2.82Å; W4-R6 VanDerWaalsContact O-N 3.14Å; W4-W7 PolarHBondContact O-N 2.85Å; W4-W7 VanDerWaalsContact O-N 3.13Å; W4-P92 HydrophobicContact CH2-CG 4.48Å; W4-P92 HydrophobicContact CZ3-CG 3.81Å
5	D	55.8	Low	70.4	Confident	115 Å²	115	90.2 Å²	90.2	62%	0.615	45%	0.452	S	S	*	.	G	3₁₀ helix	trans	-64.6	-17.1	176.7	-64.3	-39.8	0	0	0	112.6	S2	S2-D5 PolarHBondContact N-OD2 3.41Å; S2-D5 VanDerWaalsContact N-OD2 3.15Å; S2-D5 PolarHBondContact O-N 2.95Å; S2-D5 VanDerWaalsContact O-N 3.12Å
6	R	65.7	Low	71.6	Confident	145 Å²	145	91.8 Å²	91.8	55%	0.547	46%	0.455	S	S	.	.	G	3₁₀ helix	trans	-83.4	-10.2	177.4	-111.7	175.3	-68.5	-169.3	1.2	114.2	E3 W4 F75	E3-R6 PolarHBondContact O-N 3.25Å; W4-R6 PolarHBondContact O-N 2.82Å; W4-R6 VanDerWaalsContact O-N 3.14Å; R6-F75 WeakPolarHBondContact O-CZ 3.47Å
7	W	76.1	Confident	72.9	Confident	35 Å²	35	86.9 Å²	86.9	13%	0.133	43%	0.431	C	S	.	.	S	Bend	trans	-112.8	52.7	-173.5	-62.9	107.2	0	0	0	112.1	W4 F75 L76 K79 P87 P91 G93 L94	W4-W7 PolarHBondContact O-N 2.85Å; W4-W7 VanDerWaalsContact O-N 3.13Å; W7-F75 HydrophobicContact CE3-CD1 4.31Å; W7-F75 AromaticContact CE3-CE1 3.92Å; W7-F75 HydrophobicContact CE3-CE1 3.92Å; W7-F75 HydrophobicContact CZ3-CE1 4.49Å; W7-L76 HydrophobicContact CZ3-CD2 3.98Å; W7-K79 HydrophobicContact CE3-CG 4.27Å; W7-K79 HydrophobicContact CH2-CB 3.98Å; W7-K79 HydrophobicContact CH2-CG 4.36Å; W7-K79 HydrophobicContact CZ3-CB 3.74Å; W7-K79 HydrophobicContact CZ3-CG 3.77Å; W7-P87 HydrophobicContact CH2-CG 4.18Å; W7-P87 HydrophobicContact CZ2-CG 4.37Å; W7-P87 HydrophobicContact CZ3-CG 4.39Å; W7-P91 HydrophobicContact CB-CB 3.79Å; W7-P91 HydrophobicContact CB-CG 4.03Å; W7-P91 HydrophobicContact CD2-CG 4.01Å; W7-P91 HydrophobicContact CG-CB 4.04Å; W7-P91 HydrophobicContact CG-CG 3.78Å; W7-G93 CarbonylContact O-C 3.55Å; W7-G93 WeakPolarHBondContact O-CA 3.27Å; W7-L94 HydrophobicContact CB-CD1 4.33Å; W7-L94 HydrophobicContact CE3-CD1 3.81Å; W7-L94 PolarHBondContact O-N 2.86Å
8	V	80.6	Confident	73.9	Confident	77 Å²	77	84 Å²	84	47%	0.467	42%	0.417	S	S	.	.			trans	-131.1	126.9	178.7	-177.5	0	0	0	0	109.5	F75	V8-F75 WeakPolarHBondContact O-CE2 3.41Å; V8-F75 VanDerWaalsContact O-CZ 3.29Å; V8-F75 WeakPolarHBondContact O-CZ 3.45Å
9	I	83.1	Confident	74.7	Confident	7 Å²	7	82.9 Å²	82.9	4%	0.036	42%	0.423	C	S	.	.			trans	-74.9	131.1	175	-44.9	-173.3	0	0	0	108.7	D13 R14 S71 I72 F75 L94 P98	I9-D13 HydrophobicContact CG2-CB 3.93Å; I9-R14 HydrophobicContact CG2-CB 4.29Å; I9-S71 WeakPolarHBondContact CD1-O 3.3Å; I9-S71 WeakPolarHBondContact CD1-OG 3.4Å; I9-I72 HydrophobicContact CD1-CG1 4.29Å; I9-F75 HydrophobicContact CB-CD2 4.23Å; I9-F75 HydrophobicContact CD1-CB 4.22Å; I9-F75 HydrophobicContact CG1-CB 4.09Å; I9-F75 HydrophobicContact CG1-CD2 3.92Å; I9-F75 HydrophobicContact CG1-CG 4.03Å; I9-F75 HydrophobicContact CG2-CD2 4.3Å; I9-L94 HydrophobicContact CD1-CD2 3.74Å; I9-L94 HydrophobicContact CG1-CD2 3.52Å; I9-P98 WeakPolarHBondContact O-CB 3.47Å
10	T	85.7	Confident	75.6	Confident	63 Å²	63	82.1 Å²	82.1	39%	0.387	42%	0.417	S	S	.	.			trans	-78.1	156.1	173.1	65.4	0	0	0	0	110.9	D12 D13 R14	T10-D12 PolarHBondContact O-N 3.31Å; T10-D13 PolarHBondContact O-N 3.41Å; T10-D13 VanDerWaalsContact OG1-CB 3.28Å; T10-D13 WeakPolarHBondContact OG1-CB 3.48Å; T10-D13 PolarHBondContact OG1-N 2.89Å; T10-D13 PolarHBondContact OG1-OD2 3.32Å; T10-R14 PolarHBondContact O-N 3.49Å
11	T	80.7	Confident	76.4	Confident	38 Å²	38	78.4 Å²	78.4	23%	0.233	40%	0.399	C	S	.	.	H	α-helix	trans	-59.2	-37.5	174.7	-39.3	0	0	0	0	111.4	R14 V15 Q99 A101	T11-R14 PolarHBondContact O-N 2.87Å; T11-V15 WeakPolarHBondContact O-CG2 3.24Å; T11-V15 PolarHBondContact O-N 3.38Å; T11-Q99 PolarHBondContact OG1-O 3.43Å; T11-A101 WeakPolarHBondContact OG1-CB 3.5Å; T11-A101 PolarHBondContact OG1-N 2.93Å
12	D	78.7	Confident	79	Confident	111 Å²	111	73.7 Å²	73.7	59%	0.594	37%	0.374	S	S	*	.	H	α-helix	trans	-67.5	-39.1	175.8	-64.9	-63	0	0	0	113.2	T10 K16	T10-D12 PolarHBondContact O-N 3.31Å; D12-K16 VanDerWaalsContact O-CD 3.3Å; D12-K16 WeakPolarHBondContact O-CD 3.45Å; D12-K16 VanDerWaalsContact O-CE 3.22Å; D12-K16 WeakPolarHBondContact O-CE 3.39Å; D12-K16 VanDerWaalsContact O-CG 3.25Å; D12-K16 WeakPolarHBondContact O-CG 3.43Å; D12-K16 PolarHBondContact O-N 3.36Å
13	D	86.6	Confident	81.2	Confident	16 Å²	16	77.4 Å²	77.4	9%	0.086	38%	0.38	C	S	.	.	H	α-helix	trans	-64.7	-41.9	171.4	-71.5	-39.7	0	0	0	110.5	I9 T10 V15 K16 H17 K78	I9-D13 HydrophobicContact CG2-CB 3.93Å; T10-D13 PolarHBondContact O-N 3.41Å; T10-D13 VanDerWaalsContact OG1-CB 3.28Å; T10-D13 WeakPolarHBondContact OG1-CB 3.48Å; T10-D13 PolarHBondContact OG1-N 2.89Å; T10-D13 PolarHBondContact OG1-OD2 3.32Å; D13-V15 PolarHBondContact O-N 3.08Å; D13-K16 WeakPolarHBondContact O-CB 3.36Å; D13-K16 PolarHBondContact O-N 3.18Å; D13-K16 VanDerWaalsContact O-N 3.16Å; D13-K16 IonicContact OD1-NZ 2.66Å; D13-H17 PolarHBondContact O-CD2 3.38Å; D13-H17 PolarHBondContact O-N 3.38Å; D13-K78 IonicContact OD1-NZ 3.83Å; D13-K78 PolarHBondContact OD1-NZ 2.89Å; D13-K78 IonicContact OD2-NZ 3.75Å; D13-K78 PolarHBondContact OD2-NZ 3.27Å
14	R	88.7	Confident	83	Confident	29 Å²	29	72 Å²	72	11%	0.109	36%	0.355	C	S	.	.	H	α-helix	trans	-61.6	-45.5	177.7	-171.8	62.2	175.7	-100.2	-11.8	112.3	I9 T10 T11 K16 H17 D18 S71 D97 P98	I9-R14 HydrophobicContact CG2-CB 4.29Å; T10-R14 PolarHBondContact O-N 3.49Å; T11-R14 PolarHBondContact O-N 2.87Å; R14-K16 PolarHBondContact O-N 3.08Å; R14-H17 PolarHBondContact O-N 3.44Å; R14-D18 VanDerWaalsContact CD-OD1 3.26Å; R14-D18 WeakPolarHBondContact CD-OD1 3.27Å; R14-D18 IonicContact NE-OD1 2.68Å; R14-D18 PolarHBondContact NE-OD1 3.14Å; R14-D18 WeakPolarHBondContact O-CB 3.49Å; R14-D18 PolarHBondContact O-N 2.85Å; R14-S71 VanDerWaalsContact CD-CB 3.5Å; R14-S71 WeakPolarHBondContact CD-OG 3.27Å; R14-D97 IonicContact CZ-OD1 3.27Å; R14-D97 VanDerWaalsContact CZ-OD1 3.25Å; R14-D97 IonicContact NH1-OD1 2.83Å; R14-D97 PolarHBondContact NH1-OD1 3.3Å; R14-D97 IonicContact NH2-OD1 2.82Å; R14-D97 PolarHBondContact NH2-OD1 3.4Å; R14-P98 HydrophobicContact CB-CG 3.54Å; R14-P98 HydrophobicContact CG-CG 3.55Å
15	V	87.2	Confident	84.6	Confident	95 Å²	95	69 Å²	69	58%	0.576	35%	0.347	S	S	*	.	H	α-helix	trans	-59.5	-34.5	176.6	170.8	0	0	0	0	111.8	T11 D13 A19	T11-V15 WeakPolarHBondContact O-CG2 3.24Å; T11-V15 PolarHBondContact O-N 3.38Å; D13-V15 PolarHBondContact O-N 3.08Å; V15-A19 WeakPolarHBondContact O-CB 3.43Å; V15-A19 PolarHBondContact O-N 2.96Å; V15-A19 VanDerWaalsContact O-N 3.16Å
16	K	89.9	Confident	86.2	Confident	116 Å²	116	64.9 Å²	64.9	50%	0.504	33%	0.327	S	S	.	.	H	α-helix	trans	-71.2	-46	174.2	-62.6	160	-159	161.1	0	111.9	D12 D13 R14 D18 A19 Q20	D12-K16 VanDerWaalsContact O-CD 3.3Å; D12-K16 WeakPolarHBondContact O-CD 3.45Å; D12-K16 VanDerWaalsContact O-CE 3.22Å; D12-K16 WeakPolarHBondContact O-CE 3.39Å; D12-K16 VanDerWaalsContact O-CG 3.25Å; D12-K16 WeakPolarHBondContact O-CG 3.43Å; D12-K16 PolarHBondContact O-N 3.36Å; D13-K16 WeakPolarHBondContact O-CB 3.36Å; D13-K16 PolarHBondContact O-N 3.18Å; D13-K16 VanDerWaalsContact O-N 3.16Å; D13-K16 IonicContact OD1-NZ 2.66Å; R14-K16 PolarHBondContact O-N 3.08Å; K16-D18 VanDerWaalsContact C-N 3.34Å; K16-A19 PolarHBondContact O-N 3.35Å; K16-Q20 WeakPolarHBondContact O-CG 3.27Å; K16-Q20 PolarHBondContact O-N 3.35Å
17	H	93.4	Very high	87	Confident	9 Å²	9	59.6 Å²	59.6	4%	0.042	31%	0.31	C	S	.	.	H	α-helix	trans	-63.4	-41	177.7	-58.1	171	0	0	0	111	D13 R14 A19 Q20 F21 F70 S71 M74	D13-H17 PolarHBondContact O-CD2 3.38Å; D13-H17 PolarHBondContact O-N 3.38Å; R14-H17 PolarHBondContact O-N 3.44Å; H17-A19 VanDerWaalsContact C-N 3.34Å; H17-A19 PolarHBondContact O-N 2.88Å; H17-Q20 PolarHBondContact O-N 2.85Å; H17-F21 WeakPolarHBondContact O-CB 3.42Å; H17-F21 PolarHBondContact O-N 3.44Å; H17-F70 WeakPolarHBondContact O-CE1 3.26Å; H17-S71 PolarHBondContact ND1-O 2.85Å; H17-S71 PolarHBondContact ND1-OG 2.88Å; H17-M74 HydrophobicContact CB-CB 4.44Å
18	D	91	Very high	87.5	Confident	34 Å²	34	61.6 Å²	61.6	18%	0.182	34%	0.341	C	S	.	.	H	α-helix	trans	-59.6	-42.3	175.3	-74.7	4.9	0	0	0	111.6	R14 K16 F21 Q22 K67	R14-D18 VanDerWaalsContact CD-OD1 3.26Å; R14-D18 WeakPolarHBondContact CD-OD1 3.27Å; R14-D18 IonicContact NE-OD1 2.68Å; R14-D18 PolarHBondContact NE-OD1 3.14Å; R14-D18 WeakPolarHBondContact O-CB 3.49Å; R14-D18 PolarHBondContact O-N 2.85Å; K16-D18 VanDerWaalsContact C-N 3.34Å; D18-F21 PolarHBondContact O-N 3.12Å; D18-Q22 WeakPolarHBondContact O-CB 3.29Å; D18-Q22 PolarHBondContact O-N 2.8Å; D18-K67 VanDerWaalsContact CG-NZ 3.31Å; D18-K67 WeakPolarHBondContact OD1-CE 3.48Å; D18-K67 IonicContact OD1-NZ 2.71Å; D18-K67 WeakPolarHBondContact OD2-CE 3.4Å; D18-K67 IonicContact OD2-NZ 2.87Å; D18-K67 PolarHBondContact OD2-NZ 3.33Å
19	A	89.1	Confident	87.8	Confident	64 Å²	64	59.8 Å²	59.8	53%	0.529	34%	0.339	S	S	.	.	H	α-helix	trans	-68.9	-40.3	176.2	0	0	0	0	0	112.3	V15 K16 H17 Q22 F23	V15-A19 WeakPolarHBondContact O-CB 3.43Å; V15-A19 PolarHBondContact O-N 2.96Å; V15-A19 VanDerWaalsContact O-N 3.16Å; K16-A19 PolarHBondContact O-N 3.35Å; H17-A19 VanDerWaalsContact C-N 3.34Å; H17-A19 PolarHBondContact O-N 2.88Å; A19-Q22 PolarHBondContact O-N 2.89Å; A19-F23 WeakPolarHBondContact O-CB 3.18Å; A19-F23 PolarHBondContact O-N 2.89Å
20	Q	92.2	Very high	88.2	Confident	66 Å²	66	63.4 Å²	63.4	31%	0.308	35%	0.352	S	S	.	.	H	α-helix	trans	-64.4	-40.3	173.7	-73.9	172	-23.8	0	0	111.9	K16 H17 F23 L24 F39 F70	K16-Q20 WeakPolarHBondContact O-CG 3.27Å; K16-Q20 PolarHBondContact O-N 3.35Å; H17-Q20 PolarHBondContact O-N 2.85Å; Q20-F23 WeakPolarHBondContact O-CB 3.31Å; Q20-F23 PolarHBondContact O-N 3.47Å; Q20-L24 PolarHBondContact O-N 3.4Å; Q20-F39 HydrophobicContact CB-CE1 4.45Å; Q20-F39 HydrophobicContact CB-CZ 4.11Å; Q20-F39 HydrophobicContact CG-CZ 4.09Å; Q20-F70 HydrophobicContact CB-CE1 3.78Å; Q20-F70 HydrophobicContact CB-CZ 4.08Å
21	F	93.4	Very high	88.5	Confident	5 Å²	5	60.4 Å²	60.4	2%	0.022	33%	0.334	C	S	.	.	H	α-helix	trans	-59.2	-49.9	173.8	-173.4	-106.5	0	0	0	111	H17 D18 F23 L24 P26 G29 I31 M65 D66 K67 F70	H17-F21 WeakPolarHBondContact O-CB 3.42Å; H17-F21 PolarHBondContact O-N 3.44Å; D18-F21 PolarHBondContact O-N 3.12Å; F21-F23 VanDerWaalsContact C-N 3.28Å; F21-F23 PolarHBondContact O-N 3.3Å; F21-L24 PolarHBondContact O-N 3.37Å; F21-L24 VanDerWaalsContact O-N 3.11Å; F21-P26 HydrophobicContact CD1-CB 4.26Å; F21-P26 HydrophobicContact CD1-CG 4.01Å; F21-P26 HydrophobicContact CE1-CB 3.58Å; F21-P26 HydrophobicContact CE1-CG 3.7Å; F21-P26 HydrophobicContact CZ-CB 3.74Å; F21-P26 HydrophobicContact CZ-CG 4.36Å; F21-P26 WeakPolarHBondContact O-CD 3.36Å; F21-G29 VanDerWaalsContact CZ-O 3.26Å; F21-G29 WeakPolarHBondContact CZ-O 3.5Å; F21-I31 HydrophobicContact CD2-CD1 4.36Å; F21-I31 HydrophobicContact CD2-CG2 4.13Å; F21-I31 HydrophobicContact CE2-CB 4.39Å; F21-I31 HydrophobicContact CE2-CD1 4.33Å; F21-I31 HydrophobicContact CE2-CG1 4.03Å; F21-I31 HydrophobicContact CE2-CG2 3.78Å; F21-I31 HydrophobicContact CZ-CG2 4.31Å; F21-M65 WeakPolarHBondContact CE2-O 3.36Å; F21-D66 WeakPolarHBondContact CE2-O 3.39Å; F21-K67 HydrophobicContact CD1-CB 3.89Å; F21-K67 HydrophobicContact CD1-CG 3.87Å; F21-K67 HydrophobicContact CE1-CB 3.69Å; F21-K67 HydrophobicContact CE1-CG 4.18Å; F21-K67 HydrophobicContact CG-CB 4.49Å; F21-K67 HydrophobicContact CG-CG 4.39Å; F21-K67 HydrophobicContact CZ-CB 4.13Å; F21-F70 HydrophobicContact CB-CD1 3.66Å; F21-F70 HydrophobicContact CB-CE1 4Å; F21-F70 HydrophobicContact CB-CG 4.29Å; F21-F70 HydrophobicContact CD2-CB 3.47Å; F21-F70 VanDerWaalsContact CD2-CB 3.47Å; F21-F70 AromaticContact CD2-CD1 3.85Å; F21-F70 HydrophobicContact CD2-CD1 3.85Å; F21-F70 HydrophobicContact CD2-CD2 4.21Å; F21-F70 AromaticContact CD2-CG 3.58Å; F21-F70 HydrophobicContact CD2-CG 3.58Å; F21-F70 HydrophobicContact CE2-CB 3.91Å; F21-F70 HydrophobicContact CE2-CG 4.4Å; F21-F70 HydrophobicContact CG-CB 4.43Å; F21-F70 HydrophobicContact CG-CD1 4.24Å; F21-F70 HydrophobicContact CG-CG 4.4Å
22	Q	91.8	Very high	89	Confident	130 Å²	130	61.3 Å²	61.3	61%	0.607	34%	0.34	S	S	*	.	H	α-helix	trans	-62	-35.9	178.5	-163.7	64.5	41.3	0	0	112.3	D18 A19 L24 K25	D18-Q22 WeakPolarHBondContact O-CB 3.29Å; D18-Q22 PolarHBondContact O-N 2.8Å; A19-Q22 PolarHBondContact O-N 2.89Å; Q22-L24 VanDerWaalsContact C-N 3.3Å; Q22-L24 PolarHBondContact O-N 2.79Å; Q22-K25 PolarHBondContact O-N 3.45Å
23	F	89.7	Confident	89.5	Confident	158 Å²	158	57.5 Å²	57.5	69%	0.693	33%	0.326	S	S	*	.	H	α-helix	trans	-63.4	-31.8	175.5	-178.9	-93.6	0	0	0	113	A19 Q20 F21 K25	A19-F23 WeakPolarHBondContact O-CB 3.18Å; A19-F23 PolarHBondContact O-N 2.89Å; Q20-F23 WeakPolarHBondContact O-CB 3.31Å; Q20-F23 PolarHBondContact O-N 3.47Å; F21-F23 VanDerWaalsContact C-N 3.28Å; F21-F23 PolarHBondContact O-N 3.3Å; F23-K25 PolarHBondContact O-N 2.81Å
24	L	89.3	Confident	89.5	Confident	30 Å²	30	61.9 Å²	61.9	16%	0.157	35%	0.35	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.1	-1.7	176.3	-67.8	176.1	0	0	0	114.5	Q20 F21 Q22 I31 Q35 F39 F70	Q20-L24 PolarHBondContact O-N 3.4Å; F21-L24 PolarHBondContact O-N 3.37Å; F21-L24 VanDerWaalsContact O-N 3.11Å; Q22-L24 VanDerWaalsContact C-N 3.3Å; Q22-L24 PolarHBondContact O-N 2.79Å; L24-I31 HydrophobicContact CB-CG2 4.03Å; L24-I31 HydrophobicContact CD1-CD1 3.77Å; L24-Q35 PolarHBondContact O-NE2 3.4Å; L24-F39 HydrophobicContact CD1-CB 3.92Å; L24-F39 HydrophobicContact CD1-CD1 4.06Å; L24-F39 HydrophobicContact CD1-CD2 4.34Å; L24-F39 HydrophobicContact CD1-CG 3.85Å; L24-F39 HydrophobicContact CD2-CB 3.85Å; L24-F39 HydrophobicContact CD2-CD2 3.73Å; L24-F39 HydrophobicContact CD2-CG 3.91Å; L24-F39 HydrophobicContact CG-CD2 4.36Å; L24-F39 HydrophobicContact CG-CG 4.34Å; L24-F70 HydrophobicContact CD1-CD2 4.47Å; L24-F70 HydrophobicContact CD1-CE2 3.56Å; L24-F70 HydrophobicContact CD1-CZ 3.79Å
25	K	86.8	Confident	89.5	Confident	106 Å²	106	62.3 Å²	62.3	46%	0.461	35%	0.353	S	S	.	.			trans	56.7	72.3	-178.4	-59.6	-179.3	180	178.9	0	112.1	Q22 F23 Q35	Q22-K25 PolarHBondContact O-N 3.45Å; F23-K25 PolarHBondContact O-N 2.81Å; K25-Q35 PolarHBondContact O-NE2 3.1Å
26	P	89.6	Confident	89.7	Confident	29 Å²	29	57.8 Å²	57.8	19%	0.188	33%	0.326	C	S	.	.			trans	-64.4	136.6	-178.6	26.9	-33.7	0	0	0	111.6	F21 Y30 I31	F21-P26 HydrophobicContact CD1-CB 4.26Å; F21-P26 HydrophobicContact CD1-CG 4.01Å; F21-P26 HydrophobicContact CE1-CB 3.58Å; F21-P26 HydrophobicContact CE1-CG 3.7Å; F21-P26 HydrophobicContact CZ-CB 3.74Å; F21-P26 HydrophobicContact CZ-CG 4.36Å; F21-P26 WeakPolarHBondContact O-CD 3.36Å; P26-Y30 CarbonylContact C-O 3.46Å; P26-Y30 VanDerWaalsContact CA-O 3.23Å; P26-Y30 WeakPolarHBondContact CA-O 3.36Å; P26-Y30 WeakPolarHBondContact CB-O 3.48Å; P26-I31 HydrophobicContact CB-CG2 3.99Å
27	V	84.3	Confident	89.7	Confident	34 Å²	34	58.1 Å²	58.1	21%	0.206	32%	0.324	C	S	.	.	B	Isolated β-bridge	trans	-91.2	112.4	179.2	-176.7	0	0	0	0	108.8	G29 Y30 R969 I990	V27-G29 PolarHBondContact O-N 2.77Å; V27-G29 VanDerWaalsContact O-N 3.09Å; V27-Y30 PolarHBondContact N-O 3.45Å; V27-Y30 PolarHBondContact O-N 3.49Å; V27-Y30 VanDerWaalsContact O-N 3.11Å; V27-R969 VanDerWaalsContact CG1-NH2 3.28Å; V27-I990 HydrophobicContact CG1-CD1 3.8Å
28	G	84.8	Confident	89.4	Confident	76 Å²	76	62.5 Å²	62.5	78%	0.784	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.8	16.5	179.5	0	0	0	0	0	114.9
29	G	88.6	Confident	89.5	Confident	40 Å²	40	62.5 Å²	62.5	41%	0.412	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	104	-1	-176	0	0	0	0	0	115.5	F21 V27	F21-G29 VanDerWaalsContact CZ-O 3.26Å; F21-G29 WeakPolarHBondContact CZ-O 3.5Å; V27-G29 PolarHBondContact O-N 2.77Å; V27-G29 VanDerWaalsContact O-N 3.09Å
30	Y	91.6	Very high	89.7	Confident	82 Å²	82	59.8 Å²	59.8	32%	0.322	33%	0.326	S	S	.	.	B	Isolated β-bridge	trans	-128.2	156.4	-177	-53.1	-99.4	0	0	0	111.7	P26 V27 K64 M65 D66	P26-Y30 CarbonylContact C-O 3.46Å; P26-Y30 VanDerWaalsContact CA-O 3.23Å; P26-Y30 WeakPolarHBondContact CA-O 3.36Å; P26-Y30 WeakPolarHBondContact CB-O 3.48Å; V27-Y30 PolarHBondContact N-O 3.45Å; V27-Y30 PolarHBondContact O-N 3.49Å; V27-Y30 VanDerWaalsContact O-N 3.11Å; Y30-K64 HydrophobicContact CD1-CD 3.97Å; Y30-K64 HydrophobicContact CD1-CG 3.92Å; Y30-K64 HydrophobicContact CD2-CD 4.16Å; Y30-K64 HydrophobicContact CG-CD 3.72Å; Y30-K64 HydrophobicContact CG-CG 4.06Å; Y30-K64 VanDerWaalsContact CZ-NZ 3.26Å; Y30-M65 CarbonylContact C-O 3.58Å; Y30-M65 VanDerWaalsContact CA-O 3.26Å; Y30-M65 WeakPolarHBondContact CA-O 3.4Å; Y30-D66 HydrophobicContact CD1-CB 3.77Å; Y30-D66 HydrophobicContact CE1-CB 3.8Å
31	I	92	Very high	89.7	Confident	0 Å²	0	61.3 Å²	61.3	0%	0	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	148.3	164.8	64.4	177	0	0	0	110.5	F21 L24 P26 Q35 A36 K64 M65 F70	F21-I31 HydrophobicContact CD2-CD1 4.36Å; F21-I31 HydrophobicContact CD2-CG2 4.13Å; F21-I31 HydrophobicContact CE2-CB 4.39Å; F21-I31 HydrophobicContact CE2-CD1 4.33Å; F21-I31 HydrophobicContact CE2-CG1 4.03Å; F21-I31 HydrophobicContact CE2-CG2 3.78Å; F21-I31 HydrophobicContact CZ-CG2 4.31Å; L24-I31 HydrophobicContact CB-CG2 4.03Å; L24-I31 HydrophobicContact CD1-CD1 3.77Å; P26-I31 HydrophobicContact CB-CG2 3.99Å; I31-Q35 HydrophobicContact CB-CB 3.97Å; I31-A36 HydrophobicContact CD1-CB 3.49Å; I31-A36 VanDerWaalsContact CD1-CB 3.49Å; I31-A36 HydrophobicContact CG1-CB 4.22Å; I31-K64 CarbonylContact O-C 3.53Å; I31-K64 VanDerWaalsContact O-CA 3.3Å; I31-K64 WeakPolarHBondContact O-CA 3.24Å; I31-K64 WeakPolarHBondContact O-CB 3.49Å; I31-M65 HydrophobicContact CG1-CB 3.9Å; I31-M65 PolarHBondContact N-O 3.35Å; I31-M65 PolarHBondContact O-N 3.36Å; I31-F70 HydrophobicContact CD1-CD2 3.44Å; I31-F70 VanDerWaalsContact CD1-CD2 3.44Å; I31-F70 HydrophobicContact CD1-CE2 3.8Å; I31-F70 HydrophobicContact CD1-CG 4.32Å
32	T	90.6	Very high	89.5	Confident	58 Å²	58	68.9 Å²	68.9	36%	0.356	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	165	177.6	68.3	0	0	0	0	112.9	D34 Q35 A36	T32-D34 PolarHBondContact O-N 3.42Å; T32-Q35 PolarHBondContact O-N 3.15Å; T32-Q35 PolarHBondContact OG1-N 3.23Å; T32-A36 PolarHBondContact O-N 2.86Å
33	G	88	Confident	89.4	Confident	30 Å²	30	64 Å²	64	31%	0.309	35%	0.347	S	S	.	.	H	α-helix	trans	-42.9	-47.1	169.1	0	0	0	0	0	113.9	R37 W54	G33-R37 WeakPolarHBondContact O-CB 3.32Å; G33-R37 PolarHBondContact O-N 3.23Å; G33-W54 VanDerWaalsContact CA-CH2 3.47Å
34	D	87.7	Confident	89.4	Confident	108 Å²	108	60 Å²	60	58%	0.578	35%	0.35	S	S	*	.	H	α-helix	trans	-68.5	-40.1	178.7	-63.6	-44.1	0	0	0	113.3	T32 R37 V38	T32-D34 PolarHBondContact O-N 3.42Å; D34-R37 PolarHBondContact O-N 3.5Å; D34-V38 WeakPolarHBondContact O-CG2 3.41Å; D34-V38 PolarHBondContact O-N 3.23Å
35	Q	89	Confident	89.5	Confident	39 Å²	39	60 Å²	60	18%	0.182	35%	0.35	C	S	.	.	H	α-helix	trans	-62.4	-46.6	179	-74.6	178	-80.3	0	0	111.1	L24 K25 I31 T32 F39	L24-Q35 PolarHBondContact O-NE2 3.4Å; K25-Q35 PolarHBondContact O-NE2 3.1Å; I31-Q35 HydrophobicContact CB-CB 3.97Å; T32-Q35 PolarHBondContact O-N 3.15Å; T32-Q35 PolarHBondContact OG1-N 3.23Å; Q35-F39 PolarHBondContact O-N 3.28Å
36	A	91.2	Very high	89.7	Confident	0 Å²	0	58 Å²	58	0%	0	35%	0.35	C	S	.	.	H	α-helix	trans	-76.6	-34	177.6	0	0	0	0	0	112.4	I31 T32 V38 F39 F40 W54	I31-A36 HydrophobicContact CD1-CB 3.49Å; I31-A36 VanDerWaalsContact CD1-CB 3.49Å; I31-A36 HydrophobicContact CG1-CB 4.22Å; T32-A36 PolarHBondContact O-N 2.86Å; A36-V38 PolarHBondContact O-N 3.39Å; A36-F39 CarbonylContact O-C 3.59Å; A36-F39 PolarHBondContact O-N 2.79Å; A36-F39 VanDerWaalsContact O-N 3.09Å; A36-F40 HydrophobicContact CB-CD2 3.91Å; A36-F40 HydrophobicContact CB-CE1 4.38Å; A36-F40 HydrophobicContact CB-CE2 3.5Å; A36-F40 HydrophobicContact CB-CG 4.5Å; A36-F40 HydrophobicContact CB-CZ 3.76Å; A36-F40 WeakPolarHBondContact O-CB 3.42Å; A36-F40 WeakPolarHBondContact O-CD2 3.4Å; A36-F40 WeakPolarHBondContact O-CG 3.3Å; A36-F40 PolarHBondContact O-N 3.29Å; A36-W54 HydrophobicContact CB-CE3 4.28Å; A36-W54 HydrophobicContact CB-CZ3 3.58Å
37	R	89.5	Confident	89.6	Confident	123 Å²	123	60.2 Å²	60.2	46%	0.464	36%	0.362	S	S	.	.	H	α-helix	trans	-54	-50.9	173.1	169.9	-179.2	-84.7	-88.5	4	111.6	G33 D34 F39 F40 M41	G33-R37 WeakPolarHBondContact O-CB 3.32Å; G33-R37 PolarHBondContact O-N 3.23Å; D34-R37 PolarHBondContact O-N 3.5Å; R37-F39 PolarHBondContact O-N 3.06Å; R37-F40 PolarHBondContact O-N 2.86Å; R37-M41 HydrophobicContact CG-CG 4.47Å; R37-M41 HydrophobicContact CG-SD 3.87Å; R37-M41 WeakPolarHBondContact O-CB 3.28Å; R37-M41 VanDerWaalsContact O-CG 3.27Å; R37-M41 WeakPolarHBondContact O-CG 3.41Å; R37-M41 PolarHBondContact O-N 3.24Å
38	V	87.9	Confident	89.9	Confident	101 Å²	101	66.4 Å²	66.4	61%	0.612	39%	0.391	S	S	*	.	H	α-helix	trans	-65.8	-24.7	-179.9	173.1	0	0	0	0	112.2	D34 A36	D34-V38 WeakPolarHBondContact O-CG2 3.41Å; D34-V38 PolarHBondContact O-N 3.23Å; A36-V38 PolarHBondContact O-N 3.39Å
39	F	92.4	Very high	90.2	Very high	34 Å²	34	64.6 Å²	64.6	15%	0.149	37%	0.365	C	S	.	.	H	α-helix	trans	-81.9	-53.3	173.7	-168.9	-110.7	0	0	0	112.5	Q20 L24 Q35 A36 R37 M41 K42 F70 M74	Q20-F39 HydrophobicContact CB-CE1 4.45Å; Q20-F39 HydrophobicContact CB-CZ 4.11Å; Q20-F39 HydrophobicContact CG-CZ 4.09Å; L24-F39 HydrophobicContact CD1-CB 3.92Å; L24-F39 HydrophobicContact CD1-CD1 4.06Å; L24-F39 HydrophobicContact CD1-CD2 4.34Å; L24-F39 HydrophobicContact CD1-CG 3.85Å; L24-F39 HydrophobicContact CD2-CB 3.85Å; L24-F39 HydrophobicContact CD2-CD2 3.73Å; L24-F39 HydrophobicContact CD2-CG 3.91Å; L24-F39 HydrophobicContact CG-CD2 4.36Å; L24-F39 HydrophobicContact CG-CG 4.34Å; Q35-F39 PolarHBondContact O-N 3.28Å; A36-F39 CarbonylContact O-C 3.59Å; A36-F39 PolarHBondContact O-N 2.79Å; A36-F39 VanDerWaalsContact O-N 3.09Å; R37-F39 PolarHBondContact O-N 3.06Å; F39-M41 VanDerWaalsContact C-N 3.32Å; F39-M41 PolarHBondContact O-N 2.75Å; F39-K42 VanDerWaalsContact O-CB 3.24Å; F39-K42 WeakPolarHBondContact O-CB 3.23Å; F39-K42 WeakPolarHBondContact O-CG 3.37Å; F39-K42 PolarHBondContact O-N 2.93Å; F39-F70 AromaticContact CD1-CE2 3.94Å; F39-F70 HydrophobicContact CD1-CE2 3.94Å; F39-F70 AromaticContact CD1-CZ 3.79Å; F39-F70 HydrophobicContact CD1-CZ 3.79Å; F39-F70 HydrophobicContact CE1-CE2 4.24Å; F39-F70 AromaticContact CE1-CZ 3.63Å; F39-F70 HydrophobicContact CE1-CZ 3.63Å; F39-M74 HydrophobicContact CD1-SD 4.27Å; F39-M74 HydrophobicContact CE1-CE 4.43Å; F39-M74 HydrophobicContact CE1-SD 3.7Å
40	F	93.9	Very high	90.4	Very high	6 Å²	6	63.4 Å²	63.4	3%	0.026	35%	0.349	C	S	.	.	H	α-helix	trans	-65.8	-30.1	-175.9	-62.5	-22.8	0	0	0	113	A36 R37 K42 S43 L50 W54 M65 F70 A73 M74 I77	A36-F40 HydrophobicContact CB-CD2 3.91Å; A36-F40 HydrophobicContact CB-CE1 4.38Å; A36-F40 HydrophobicContact CB-CE2 3.5Å; A36-F40 HydrophobicContact CB-CG 4.5Å; A36-F40 HydrophobicContact CB-CZ 3.76Å; A36-F40 WeakPolarHBondContact O-CB 3.42Å; A36-F40 WeakPolarHBondContact O-CD2 3.4Å; A36-F40 WeakPolarHBondContact O-CG 3.3Å; A36-F40 PolarHBondContact O-N 3.29Å; R37-F40 PolarHBondContact O-N 2.86Å; F40-K42 PolarHBondContact O-N 3.25Å; F40-K42 VanDerWaalsContact O-N 3.11Å; F40-S43 VanDerWaalsContact O-CB 3.26Å; F40-S43 WeakPolarHBondContact O-CB 3.35Å; F40-S43 PolarHBondContact O-N 2.88Å; F40-S43 PolarHBondContact O-OG 2.89Å; F40-L50 HydrophobicContact CB-CD1 3.94Å; F40-L50 HydrophobicContact CB-CD2 3.85Å; F40-L50 HydrophobicContact CB-CG 4.41Å; F40-W54 HydrophobicContact CE2-CE3 4.46Å; F40-M65 HydrophobicContact CE2-CE 4.28Å; F40-M65 HydrophobicContact CE2-SD 4.21Å; F40-M65 HydrophobicContact CZ-SD 3.92Å; F40-F70 AromaticContact CE1-CD2 3.94Å; F40-F70 HydrophobicContact CE1-CD2 3.94Å; F40-F70 AromaticContact CE1-CE2 3.53Å; F40-F70 HydrophobicContact CE1-CE2 3.53Å; F40-F70 HydrophobicContact CE1-CZ 4.38Å; F40-F70 AromaticContact CZ-CD2 3.88Å; F40-F70 HydrophobicContact CZ-CD2 3.88Å; F40-F70 AromaticContact CZ-CE2 3.93Å; F40-F70 HydrophobicContact CZ-CE2 3.93Å; F40-A73 HydrophobicContact CE1-CB 4.25Å; F40-A73 HydrophobicContact CE2-CB 3.99Å; F40-A73 HydrophobicContact CZ-CB 3.48Å; F40-A73 VanDerWaalsContact CZ-CB 3.48Å; F40-M74 HydrophobicContact CD1-SD 4.26Å; F40-M74 HydrophobicContact CE1-SD 3.92Å; F40-I77 HydrophobicContact CB-CD1 4Å; F40-I77 HydrophobicContact CD1-CD1 3.29Å; F40-I77 HydrophobicContact CD2-CD1 4.29Å; F40-I77 HydrophobicContact CE1-CD1 3.75Å; F40-I77 HydrophobicContact CG-CD1 3.62Å; F40-I77 HydrophobicContact CZ-CD1 4.42Å
41	M	92.3	Very high	90.4	Very high	99 Å²	99	61.4 Å²	61.4	49%	0.488	35%	0.353	S	S	.	.	G	3₁₀ helix	trans	-58.9	-21.6	172.7	-78.5	178	63	0	0	113.1	R37 F39 S43 G44 L50	R37-M41 HydrophobicContact CG-CG 4.47Å; R37-M41 HydrophobicContact CG-SD 3.87Å; R37-M41 WeakPolarHBondContact O-CB 3.28Å; R37-M41 VanDerWaalsContact O-CG 3.27Å; R37-M41 WeakPolarHBondContact O-CG 3.41Å; R37-M41 PolarHBondContact O-N 3.24Å; F39-M41 VanDerWaalsContact C-N 3.32Å; F39-M41 PolarHBondContact O-N 2.75Å; M41-S43 PolarHBondContact O-N 3.36Å; M41-G44 PolarHBondContact O-N 3.45Å; M41-L50 HydrophobicContact CG-CD1 4.06Å
42	K	89.3	Confident	90.3	Very high	164 Å²	164	65.7 Å²	65.7	71%	0.713	37%	0.373	S	S	*	.	G	3₁₀ helix	trans	-70.7	-9.6	174	-55.6	-177.7	179.6	-171.6	0	113.9	F39 F40 G44	F39-K42 VanDerWaalsContact O-CB 3.24Å; F39-K42 WeakPolarHBondContact O-CB 3.23Å; F39-K42 WeakPolarHBondContact O-CG 3.37Å; F39-K42 PolarHBondContact O-N 2.93Å; F40-K42 PolarHBondContact O-N 3.25Å; F40-K42 VanDerWaalsContact O-N 3.11Å; K42-G44 VanDerWaalsContact C-N 3.3Å
43	S	89.5	Confident	90.4	Very high	28 Å²	28	62.9 Å²	62.9	20%	0.196	36%	0.356	C	S	.	.	G	3₁₀ helix	trans	-76.6	-13.8	173.9	67.2	0	0	0	0	113.9	F40 M41 L45	F40-S43 VanDerWaalsContact O-CB 3.26Å; F40-S43 WeakPolarHBondContact O-CB 3.35Å; F40-S43 PolarHBondContact O-N 2.88Å; F40-S43 PolarHBondContact O-OG 2.89Å; M41-S43 PolarHBondContact O-N 3.36Å; S43-L45 PolarHBondContact O-N 2.8Å; S43-L45 WeakPolarHBondContact OG-CB 3.26Å; S43-L45 WeakPolarHBondContact OG-CG 3.5Å; S43-L45 PolarHBondContact OG-N 3.49Å
44	G	89.9	Confident	90.6	Very high	72 Å²	72	63.6 Å²	63.6	74%	0.742	35%	0.349	S	S	*	.			trans	74.3	-3.9	-172.1	0	0	0	0	0	114.8	M41 K42	M41-G44 PolarHBondContact O-N 3.45Å; K42-G44 VanDerWaalsContact C-N 3.3Å
45	L	89.9	Confident	90.7	Very high	30 Å²	30	62.1 Å²	62.1	16%	0.157	35%	0.352	C	S	.	.			trans	-67.1	144.9	173	-61.7	178.4	0	0	0	110.9	S43 V49 L50 I53 I77 T80 L81	S43-L45 PolarHBondContact O-N 2.8Å; S43-L45 WeakPolarHBondContact OG-CB 3.26Å; S43-L45 WeakPolarHBondContact OG-CG 3.5Å; S43-L45 PolarHBondContact OG-N 3.49Å; L45-V49 HydrophobicContact CB-CB 4.5Å; L45-V49 HydrophobicContact CB-CG1 4.1Å; L45-V49 HydrophobicContact CD1-CG1 4.15Å; L45-V49 HydrophobicContact CD2-CG1 4.4Å; L45-V49 HydrophobicContact CG-CG1 4.46Å; L45-L50 HydrophobicContact CB-CD2 3.77Å; L45-L50 HydrophobicContact CB-CG 4.02Å; L45-L50 HydrophobicContact CD1-CD2 4.07Å; L45-I53 HydrophobicContact CD1-CD1 3.89Å; L45-I77 HydrophobicContact CD1-CB 4.32Å; L45-I77 HydrophobicContact CD1-CG1 4.2Å; L45-I77 HydrophobicContact CD1-CG2 4.02Å; L45-T80 HydrophobicContact CD1-CG2 4.13Å; L45-T80 HydrophobicContact CD2-CG2 3.77Å; L45-L81 HydrophobicContact CD2-CD2 3.78Å; L45-L81 HydrophobicContact CD2-CG 4.32Å; L45-L81 HydrophobicContact CG-CD2 4.1Å; L45-L81 HydrophobicContact CG-CG 4.44Å
46	S	91	Very high	90.8	Very high	66 Å²	66	61.2 Å²	61.2	46%	0.462	35%	0.348	S	S	.	.			trans	-65.9	152.4	-177.6	81.1	0	0	0	0	112.1	M48 V49 L50	S46-M48 PolarHBondContact O-N 2.82Å; S46-M48 VanDerWaalsContact O-N 3.09Å; S46-V49 PolarHBondContact O-N 2.88Å; S46-V49 WeakPolarHBondContact OG-CG2 3.49Å; S46-V49 PolarHBondContact OG-N 3.42Å; S46-L50 WeakPolarHBondContact O-CG 3.29Å; S46-L50 PolarHBondContact O-N 3.42Å
47	V	88.6	Confident	90.8	Very high	75 Å²	75	61.2 Å²	61.2	46%	0.455	35%	0.348	S	S	.	.	H	α-helix	trans	-57.1	-29.9	-179.2	-179.6	0	0	0	0	112.3	G51	V47-G51 PolarHBondContact O-N 2.88Å
48	M	90.4	Very high	90.8	Very high	163 Å²	163	56.2 Å²	56.2	80%	0.803	33%	0.331	S	S	*	.	H	α-helix	trans	-70.1	-45.6	174.1	-65.1	-177.7	71.2	0	0	112.3	S46 L50 G51 Q52	S46-M48 PolarHBondContact O-N 2.82Å; S46-M48 VanDerWaalsContact O-N 3.09Å; M48-L50 VanDerWaalsContact C-N 3.32Å; M48-L50 PolarHBondContact O-N 3.14Å; M48-G51 PolarHBondContact O-N 2.81Å; M48-Q52 PolarHBondContact O-N 3.32Å
49	V	91.3	Very high	90.7	Very high	39 Å²	39	55.1 Å²	55.1	24%	0.236	32%	0.32	C	S	.	.	H	α-helix	trans	-62.7	-41.2	176.6	170.2	0	0	0	0	110.4	L45 S46 Q52 I53 T80 L86	L45-V49 HydrophobicContact CB-CB 4.5Å; L45-V49 HydrophobicContact CB-CG1 4.1Å; L45-V49 HydrophobicContact CD1-CG1 4.15Å; L45-V49 HydrophobicContact CD2-CG1 4.4Å; L45-V49 HydrophobicContact CG-CG1 4.46Å; S46-V49 PolarHBondContact O-N 2.88Å; S46-V49 WeakPolarHBondContact OG-CG2 3.49Å; S46-V49 PolarHBondContact OG-N 3.42Å; V49-Q52 PolarHBondContact O-N 2.93Å; V49-I53 HydrophobicContact CG1-CD1 4.11Å; V49-I53 WeakPolarHBondContact O-CG1 3.43Å; V49-I53 PolarHBondContact O-N 2.83Å; V49-T80 HydrophobicContact CG1-CG2 4.02Å; V49-L86 HydrophobicContact CG1-CD1 3.95Å
50	L	92.5	Very high	90.4	Very high	14 Å²	14	58 Å²	58	7%	0.073	34%	0.337	C	S	.	.	H	α-helix	trans	-66.3	-35.4	175	-65.6	-178.3	0	0	0	112.9	F40 M41 L45 S46 M48 I53 W54 I77	F40-L50 HydrophobicContact CB-CD1 3.94Å; F40-L50 HydrophobicContact CB-CD2 3.85Å; F40-L50 HydrophobicContact CB-CG 4.41Å; M41-L50 HydrophobicContact CG-CD1 4.06Å; L45-L50 HydrophobicContact CB-CD2 3.77Å; L45-L50 HydrophobicContact CB-CG 4.02Å; L45-L50 HydrophobicContact CD1-CD2 4.07Å; S46-L50 WeakPolarHBondContact O-CG 3.29Å; S46-L50 PolarHBondContact O-N 3.42Å; M48-L50 VanDerWaalsContact C-N 3.32Å; M48-L50 PolarHBondContact O-N 3.14Å; L50-I53 HydrophobicContact CD2-CD1 4.36Å; L50-I53 PolarHBondContact O-N 2.69Å; L50-W54 PolarHBondContact O-N 2.81Å; L50-I77 HydrophobicContact CD2-CD1 4.35Å; L50-I77 HydrophobicContact CD2-CG1 4.32Å
51	G	91.1	Very high	90	Very high	40 Å²	40	65.7 Å²	65.7	41%	0.412	38%	0.375	S	S	.	.	H	α-helix	trans	-65.3	-39.2	171.9	0	0	0	0	0	113	V47 M48 W54 A55	V47-G51 PolarHBondContact O-N 2.88Å; M48-G51 PolarHBondContact O-N 2.81Å; G51-W54 PolarHBondContact O-N 3.28Å; G51-A55 PolarHBondContact O-N 2.83Å
52	Q	90.8	Very high	89.8	Confident	90 Å²	90	64.1 Å²	64.1	42%	0.421	37%	0.369	S	S	.	.	H	α-helix	trans	-67.2	-39.2	173.4	-173.1	179.8	-3.8	0	0	111.8	M48 V49 A55 L56 L86	M48-Q52 PolarHBondContact O-N 3.32Å; V49-Q52 PolarHBondContact O-N 2.93Å; Q52-A55 PolarHBondContact O-N 2.86Å; Q52-L56 HydrophobicContact CG-CD1 4.14Å; Q52-L56 VanDerWaalsContact O-CG 3.3Å; Q52-L56 WeakPolarHBondContact O-CG 3.35Å; Q52-L56 PolarHBondContact O-N 3.44Å; Q52-L56 VanDerWaalsContact O-N 3.11Å; Q52-L86 HydrophobicContact CB-CD1 4.17Å; Q52-L86 HydrophobicContact CG-CD1 4.07Å
53	I	92.2	Very high	89.7	Confident	0 Å²	0	58.5 Å²	58.5	0%	0	36%	0.357	C	S	.	.	H	α-helix	trans	-62.9	-42.8	174.1	-72.4	170.8	0	0	0	111.1	L45 V49 L50 L56 A57 A73 L76 I77 L86	L45-I53 HydrophobicContact CD1-CD1 3.89Å; V49-I53 HydrophobicContact CG1-CD1 4.11Å; V49-I53 WeakPolarHBondContact O-CG1 3.43Å; V49-I53 PolarHBondContact O-N 2.83Å; L50-I53 HydrophobicContact CD2-CD1 4.36Å; L50-I53 PolarHBondContact O-N 2.69Å; I53-L56 PolarHBondContact O-N 2.88Å; I53-A57 VanDerWaalsContact O-CB 3.27Å; I53-A57 WeakPolarHBondContact O-CB 3.48Å; I53-A57 PolarHBondContact O-N 3.44Å; I53-A57 VanDerWaalsContact O-N 3.08Å; I53-A73 HydrophobicContact CG2-CB 4.02Å; I53-L76 HydrophobicContact CD1-CB 4.48Å; I53-L76 HydrophobicContact CG1-CB 4.13Å; I53-L76 HydrophobicContact CG2-CB 3.96Å; I53-L76 HydrophobicContact CG2-CD1 4.19Å; I53-I77 HydrophobicContact CD1-CG1 3.74Å; I53-I77 HydrophobicContact CG2-CG1 4.17Å; I53-L86 HydrophobicContact CD1-CD1 4.29Å; I53-L86 HydrophobicContact CD1-CD2 4.11Å; I53-L86 HydrophobicContact CG1-CD1 3.75Å; I53-L86 HydrophobicContact CG1-CD2 3.59Å; I53-L86 HydrophobicContact CG1-CG 4.33Å
54	W	91.6	Very high	89.8	Confident	44 Å²	44	60.1 Å²	60.1	17%	0.167	36%	0.361	C	S	.	.	H	α-helix	trans	-56.1	-55.3	173.7	-176	-70.1	0	0	0	110.6	G33 A36 F40 L50 G51 L56 A57 D58 K64 M65	G33-W54 VanDerWaalsContact CA-CH2 3.47Å; A36-W54 HydrophobicContact CB-CE3 4.28Å; A36-W54 HydrophobicContact CB-CZ3 3.58Å; F40-W54 HydrophobicContact CE2-CE3 4.46Å; L50-W54 PolarHBondContact O-N 2.81Å; G51-W54 PolarHBondContact O-N 3.28Å; W54-L56 PolarHBondContact O-N 2.92Å; W54-A57 PolarHBondContact O-N 2.92Å; W54-D58 PolarHBondContact NE1-OD2 3.28Å; W54-D58 VanDerWaalsContact O-CB 3.3Å; W54-D58 WeakPolarHBondContact O-CB 3.45Å; W54-D58 PolarHBondContact O-N 3.32Å; W54-K64 WeakPolarHBondContact CZ2-O 3.37Å; W54-M65 HydrophobicContact CD2-CE 3.72Å; W54-M65 HydrophobicContact CE3-CE 3.59Å; W54-M65 HydrophobicContact CG-CE 4.29Å; W54-M65 HydrophobicContact CH2-CB 3.85Å; W54-M65 HydrophobicContact CH2-CE 4.04Å; W54-M65 HydrophobicContact CZ2-CB 4.22Å; W54-M65 HydrophobicContact CZ2-CE 4.18Å; W54-M65 HydrophobicContact CZ3-CB 4.46Å; W54-M65 HydrophobicContact CZ3-CE 3.78Å; W54-M65 HydrophobicContact CZ3-SD 4.48Å
55	A	90.6	Very high	89.8	Confident	77 Å²	77	56.7 Å²	56.7	64%	0.636	33%	0.325	S	S	*	.	H	α-helix	trans	-67.1	-7.6	-177.9	0	0	0	0	0	115.1	G51 Q52	G51-A55 PolarHBondContact O-N 2.83Å; Q52-A55 PolarHBondContact O-N 2.86Å
56	L	90.8	Very high	90	Very high	20 Å²	20	57.6 Å²	57.6	11%	0.105	33%	0.33	C	S	.	.	H	α-helix	trans	-98.7	-19.7	170.3	-73.2	167.4	0	0	0	112.9	Q52 I53 W54 L76 L86 P87 L90	Q52-L56 HydrophobicContact CG-CD1 4.14Å; Q52-L56 VanDerWaalsContact O-CG 3.3Å; Q52-L56 WeakPolarHBondContact O-CG 3.35Å; Q52-L56 PolarHBondContact O-N 3.44Å; Q52-L56 VanDerWaalsContact O-N 3.11Å; I53-L56 PolarHBondContact O-N 2.88Å; W54-L56 PolarHBondContact O-N 2.92Å; L56-L76 HydrophobicContact CB-CD1 3.74Å; L56-L76 HydrophobicContact CD1-CD1 4.46Å; L56-L86 HydrophobicContact CD1-CB 4.44Å; L56-L86 HydrophobicContact CD1-CD2 4.41Å; L56-P87 VanDerWaalsContact CD1-O 3.25Å; L56-P87 WeakPolarHBondContact CD1-O 3.15Å; L56-P87 WeakPolarHBondContact CD2-O 3.2Å; L56-L90 WeakPolarHBondContact O-CD1 3.35Å; L56-L90 WeakPolarHBondContact O-CD2 3.37Å
57	A	91.6	Very high	90	Very high	0 Å²	0	58.6 Å²	58.6	0%	0	33%	0.326	C	S	.	.	H	α-helix	trans	-102.5	-38	-174	0	0	0	0	0	113.1	I53 W54 M59 M65 E69 I72 A73 L76	I53-A57 VanDerWaalsContact O-CB 3.27Å; I53-A57 WeakPolarHBondContact O-CB 3.48Å; I53-A57 PolarHBondContact O-N 3.44Å; I53-A57 VanDerWaalsContact O-N 3.08Å; W54-A57 PolarHBondContact O-N 2.92Å; A57-M59 WeakPolarHBondContact O-CG 3.34Å; A57-M59 PolarHBondContact O-N 3.24Å; A57-M59 VanDerWaalsContact O-N 3.17Å; A57-M65 HydrophobicContact CB-CE 4.11Å; A57-E69 VanDerWaalsContact O-CB 3.23Å; A57-E69 WeakPolarHBondContact O-CB 3.47Å; A57-E69 WeakPolarHBondContact O-CG 3.5Å; A57-I72 HydrophobicContact CB-CB 4.3Å; A57-I72 HydrophobicContact CB-CG2 3.9Å; A57-A73 HydrophobicContact CB-CB 3.68Å; A57-L76 HydrophobicContact CB-CD1 4.45Å
58	D	90	Very high	90.1	Very high	18 Å²	18	57 Å²	57	10%	0.096	31%	0.313	C	S	.	.			trans	-66.1	98.6	167.5	-178.2	-11.9	0	0	0	108	W54 M61 D62 G63	W54-D58 PolarHBondContact NE1-OD2 3.28Å; W54-D58 VanDerWaalsContact O-CB 3.3Å; W54-D58 WeakPolarHBondContact O-CB 3.45Å; W54-D58 PolarHBondContact O-N 3.32Å; D58-M61 WeakPolarHBondContact OD1-CA 3.38Å; D58-M61 PolarHBondContact OD1-N 3.07Å; D58-D62 PolarHBondContact OD1-N 2.78Å; D58-G63 PolarHBondContact OD2-N 3.39Å
59	M	85.8	Confident	90.2	Very high	78 Å²	78	49.5 Å²	49.5	38%	0.384	28%	0.276	S	S	.	.	S	Bend	trans	-93	-27.5	-167.6	-68.5	-159.6	-55.3	0	0	113.3	A57 K68 E69 I72 L90 K95	A57-M59 WeakPolarHBondContact O-CG 3.34Å; A57-M59 PolarHBondContact O-N 3.24Å; A57-M59 VanDerWaalsContact O-N 3.17Å; M59-K68 HydrophobicContact CE-CD 4.24Å; M59-E69 HydrophobicContact CG-CG 4.41Å; M59-E69 PolarHBondContact N-OE1 3.32Å; M59-I72 HydrophobicContact CE-CD1 4.39Å; M59-I72 HydrophobicContact CG-CD1 4.44Å; M59-I72 HydrophobicContact SD-CD1 3.92Å; M59-L90 HydrophobicContact CG-CD2 3.91Å; M59-L90 HydrophobicContact SD-CD2 3.67Å; M59-K95 HydrophobicContact SD-CG 4.13Å
60	D	85.7	Confident	90.3	Very high	96 Å²	96	47.6 Å²	47.6	51%	0.513	27%	0.265	S	S	.	.	S	Bend	trans	-98.4	-2.6	174.6	65.5	20.1	0	0	0	113.5	D62	D60-D62 VanDerWaalsContact C-N 3.3Å; D60-D62 PolarHBondContact O-N 3.23Å; D60-D62 VanDerWaalsContact OD1-CB 3.29Å; D60-D62 WeakPolarHBondContact OD1-CB 3.33Å; D60-D62 PolarHBondContact OD1-N 2.89Å
61	M	86.1	Confident	90.3	Very high	167 Å²	167	47 Å²	47	82%	0.823	26%	0.261	S	S	*	.			trans	65.2	27.7	176.3	-56	-172.5	68.9	0	0	113.6	D58	D58-M61 WeakPolarHBondContact OD1-CA 3.38Å; D58-M61 PolarHBondContact OD1-N 3.07Å
62	D	88.1	Confident	90.4	Very high	66 Å²	66	45 Å²	45	35%	0.353	24%	0.242	S	C	.	.			trans	-88.6	-0.6	-174.2	85.9	10.6	0	0	0	115.2	D58 D60 K64	D58-D62 PolarHBondContact OD1-N 2.78Å; D60-D62 VanDerWaalsContact C-N 3.3Å; D60-D62 PolarHBondContact O-N 3.23Å; D60-D62 VanDerWaalsContact OD1-CB 3.29Å; D60-D62 WeakPolarHBondContact OD1-CB 3.33Å; D60-D62 PolarHBondContact OD1-N 2.89Å; D62-K64 PolarHBondContact O-N 3.45Å; D62-K64 WeakPolarHBondContact OD1-CG 3.33Å; D62-K64 PolarHBondContact OD1-N 2.86Å; D62-K64 IonicContact OD1-NZ 3.07Å; D62-K64 WeakPolarHBondContact OD2-CE 3.35Å; D62-K64 IonicContact OD2-NZ 2.75Å; D62-K64 PolarHBondContact OD2-NZ 2.71Å
63	G	87	Confident	90.5	Very high	45 Å²	45	40.8 Å²	40.8	46%	0.464	22%	0.222	S	C	.	.	S	Bend	trans	77	4.9	169.3	0	0	0	0	0	115	D58	D58-G63 PolarHBondContact OD2-N 3.39Å
64	K	90	Very high	90.6	Very high	63 Å²	63	42 Å²	42	27%	0.274	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	-170.7	159.9	51.4	-171.6	169.7	73.8	0	106.9	Y30 I31 W54 D62	Y30-K64 HydrophobicContact CD1-CD 3.97Å; Y30-K64 HydrophobicContact CD1-CG 3.92Å; Y30-K64 HydrophobicContact CD2-CD 4.16Å; Y30-K64 HydrophobicContact CG-CD 3.72Å; Y30-K64 HydrophobicContact CG-CG 4.06Å; Y30-K64 VanDerWaalsContact CZ-NZ 3.26Å; I31-K64 CarbonylContact O-C 3.53Å; I31-K64 VanDerWaalsContact O-CA 3.3Å; I31-K64 WeakPolarHBondContact O-CA 3.24Å; I31-K64 WeakPolarHBondContact O-CB 3.49Å; W54-K64 WeakPolarHBondContact CZ2-O 3.37Å; D62-K64 PolarHBondContact O-N 3.45Å; D62-K64 WeakPolarHBondContact OD1-CG 3.33Å; D62-K64 PolarHBondContact OD1-N 2.86Å; D62-K64 IonicContact OD1-NZ 3.07Å; D62-K64 WeakPolarHBondContact OD2-CE 3.35Å; D62-K64 IonicContact OD2-NZ 2.75Å; D62-K64 PolarHBondContact OD2-NZ 2.71Å
65	M	91.2	Very high	90.6	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.4	121	-173.7	-174.1	174.5	-74.8	0	0	109.5	F21 Y30 I31 F40 W54 A57 E69 F70 A73	F21-M65 WeakPolarHBondContact CE2-O 3.36Å; Y30-M65 CarbonylContact C-O 3.58Å; Y30-M65 VanDerWaalsContact CA-O 3.26Å; Y30-M65 WeakPolarHBondContact CA-O 3.4Å; I31-M65 HydrophobicContact CG1-CB 3.9Å; I31-M65 PolarHBondContact N-O 3.35Å; I31-M65 PolarHBondContact O-N 3.36Å; F40-M65 HydrophobicContact CE2-CE 4.28Å; F40-M65 HydrophobicContact CE2-SD 4.21Å; F40-M65 HydrophobicContact CZ-SD 3.92Å; W54-M65 HydrophobicContact CD2-CE 3.72Å; W54-M65 HydrophobicContact CE3-CE 3.59Å; W54-M65 HydrophobicContact CG-CE 4.29Å; W54-M65 HydrophobicContact CH2-CB 3.85Å; W54-M65 HydrophobicContact CH2-CE 4.04Å; W54-M65 HydrophobicContact CZ2-CB 4.22Å; W54-M65 HydrophobicContact CZ2-CE 4.18Å; W54-M65 HydrophobicContact CZ3-CB 4.46Å; W54-M65 HydrophobicContact CZ3-CE 3.78Å; W54-M65 HydrophobicContact CZ3-SD 4.48Å; A57-M65 HydrophobicContact CB-CE 4.11Å; M65-E69 WeakPolarHBondContact CA-OE2 3.14Å; M65-E69 HydrophobicContact CG-CB 3.61Å; M65-F70 HydrophobicContact CG-CB 4.13Å; M65-F70 HydrophobicContact SD-CB 4.09Å; M65-F70 HydrophobicContact SD-CD2 4.15Å; M65-A73 HydrophobicContact CE-CB 4.19Å; M65-A73 HydrophobicContact SD-CB 3.97Å
66	D	92.8	Very high	90.7	Very high	49 Å²	49	36.5 Å²	36.5	26%	0.262	19%	0.191	S	C	.	.			trans	-77.8	179	178.6	111.7	-40.6	0	0	0	112.1	F21 Y30 K68 E69 F70	F21-D66 WeakPolarHBondContact CE2-O 3.39Å; Y30-D66 HydrophobicContact CD1-CB 3.77Å; Y30-D66 HydrophobicContact CE1-CB 3.8Å; D66-K68 VanDerWaalsContact C-N 3.3Å; D66-K68 PolarHBondContact O-N 3.36Å; D66-K68 VanDerWaalsContact OD1-CA 3.3Å; D66-K68 WeakPolarHBondContact OD1-CA 3.34Å; D66-K68 VanDerWaalsContact OD1-CB 3.23Å; D66-K68 WeakPolarHBondContact OD1-CB 3.43Å; D66-K68 PolarHBondContact OD1-N 3.2Å; D66-E69 PolarHBondContact N-OE2 2.8Å; D66-E69 WeakPolarHBondContact OD1-CG 3.32Å; D66-E69 PolarHBondContact OD1-N 2.94Å; D66-F70 VanDerWaalsContact O-CB 3.3Å; D66-F70 WeakPolarHBondContact O-CB 3.33Å; D66-F70 PolarHBondContact O-N 3.25Å
67	K	91.6	Very high	90.8	Very high	86 Å²	86	35.9 Å²	35.9	37%	0.374	19%	0.188	S	C	.	.	H	α-helix	trans	-62.7	-32.1	-178.8	-172.4	-176.5	174.3	-157.6	0	113.7	D18 F21 S71	D18-K67 VanDerWaalsContact CG-NZ 3.31Å; D18-K67 WeakPolarHBondContact OD1-CE 3.48Å; D18-K67 IonicContact OD1-NZ 2.71Å; D18-K67 WeakPolarHBondContact OD2-CE 3.4Å; D18-K67 IonicContact OD2-NZ 2.87Å; D18-K67 PolarHBondContact OD2-NZ 3.33Å; F21-K67 HydrophobicContact CD1-CB 3.89Å; F21-K67 HydrophobicContact CD1-CG 3.87Å; F21-K67 HydrophobicContact CE1-CB 3.69Å; F21-K67 HydrophobicContact CE1-CG 4.18Å; F21-K67 HydrophobicContact CG-CB 4.49Å; F21-K67 HydrophobicContact CG-CG 4.39Å; F21-K67 HydrophobicContact CZ-CB 4.13Å; K67-S71 PolarHBondContact O-N 3.03Å
68	K	90.4	Very high	90.7	Very high	41 Å²	41	39.3 Å²	39.3	18%	0.178	20%	0.202	C	C	.	.	H	α-helix	trans	-82	-45.2	179.6	173.5	-177.4	-174.5	161.9	0	111	M59 D66 F70 S71 I72 K95 D97	M59-K68 HydrophobicContact CE-CD 4.24Å; D66-K68 VanDerWaalsContact C-N 3.3Å; D66-K68 PolarHBondContact O-N 3.36Å; D66-K68 VanDerWaalsContact OD1-CA 3.3Å; D66-K68 WeakPolarHBondContact OD1-CA 3.34Å; D66-K68 VanDerWaalsContact OD1-CB 3.23Å; D66-K68 WeakPolarHBondContact OD1-CB 3.43Å; D66-K68 PolarHBondContact OD1-N 3.2Å; K68-F70 VanDerWaalsContact C-N 3.34Å; K68-F70 PolarHBondContact O-N 2.88Å; K68-S71 CarbonylContact O-C 3.07Å; K68-S71 WeakPolarHBondContact O-CA 3.35Å; K68-S71 VanDerWaalsContact O-CB 3.24Å; K68-S71 WeakPolarHBondContact O-CB 3.48Å; K68-S71 PolarHBondContact O-N 3.26Å; K68-I72 HydrophobicContact CG-CD1 4.26Å; K68-I72 WeakPolarHBondContact O-CG1 3.32Å; K68-I72 PolarHBondContact O-N 2.78Å; K68-K95 WeakPolarHBondContact CE-O 3.24Å; K68-K95 PolarHBondContact NZ-O 3Å; K68-D97 WeakPolarHBondContact CD-OD1 3.37Å; K68-D97 WeakPolarHBondContact CD-OD2 3.25Å; K68-D97 WeakPolarHBondContact CE-OD2 3.49Å; K68-D97 WeakPolarHBondContact CG-OD1 3.36Å; K68-D97 IonicContact NZ-OD2 2.65Å; K68-D97 PolarHBondContact NZ-OD2 3Å
69	E	93	Very high	90.6	Very high	6 Å²	6	39.5 Å²	39.5	3%	0.028	20%	0.202	C	C	.	.	H	α-helix	trans	-61.8	-41.7	176.2	-63.1	177.4	136.7	0	0	111.3	A57 M59 M65 D66 S71 I72 A73	A57-E69 VanDerWaalsContact O-CB 3.23Å; A57-E69 WeakPolarHBondContact O-CB 3.47Å; A57-E69 WeakPolarHBondContact O-CG 3.5Å; M59-E69 HydrophobicContact CG-CG 4.41Å; M59-E69 PolarHBondContact N-OE1 3.32Å; M65-E69 WeakPolarHBondContact CA-OE2 3.14Å; M65-E69 HydrophobicContact CG-CB 3.61Å; D66-E69 PolarHBondContact N-OE2 2.8Å; D66-E69 WeakPolarHBondContact OD1-CG 3.32Å; D66-E69 PolarHBondContact OD1-N 2.94Å; E69-S71 VanDerWaalsContact C-N 3.27Å; E69-S71 PolarHBondContact O-N 3.43Å; E69-I72 CarbonylContact O-C 3.49Å; E69-I72 WeakPolarHBondContact O-CA 3.32Å; E69-I72 WeakPolarHBondContact O-CB 3.38Å; E69-I72 PolarHBondContact O-N 2.8Å; E69-I72 VanDerWaalsContact O-N 3.1Å; E69-A73 PolarHBondContact O-N 2.82Å
70	F	93.9	Very high	90.8	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-61.3	-36.7	171.4	-177.9	-99.3	0	0	0	112.6	H17 Q20 F21 L24 I31 F39 F40 M65 D66 K68 I72 A73 M74	H17-F70 WeakPolarHBondContact O-CE1 3.26Å; Q20-F70 HydrophobicContact CB-CE1 3.78Å; Q20-F70 HydrophobicContact CB-CZ 4.08Å; F21-F70 HydrophobicContact CB-CD1 3.66Å; F21-F70 HydrophobicContact CB-CE1 4Å; F21-F70 HydrophobicContact CB-CG 4.29Å; F21-F70 HydrophobicContact CD2-CB 3.47Å; F21-F70 VanDerWaalsContact CD2-CB 3.47Å; F21-F70 AromaticContact CD2-CD1 3.85Å; F21-F70 HydrophobicContact CD2-CD1 3.85Å; F21-F70 HydrophobicContact CD2-CD2 4.21Å; F21-F70 AromaticContact CD2-CG 3.58Å; F21-F70 HydrophobicContact CD2-CG 3.58Å; F21-F70 HydrophobicContact CE2-CB 3.91Å; F21-F70 HydrophobicContact CE2-CG 4.4Å; F21-F70 HydrophobicContact CG-CB 4.43Å; F21-F70 HydrophobicContact CG-CD1 4.24Å; F21-F70 HydrophobicContact CG-CG 4.4Å; L24-F70 HydrophobicContact CD1-CD2 4.47Å; L24-F70 HydrophobicContact CD1-CE2 3.56Å; L24-F70 HydrophobicContact CD1-CZ 3.79Å; I31-F70 HydrophobicContact CD1-CD2 3.44Å; I31-F70 VanDerWaalsContact CD1-CD2 3.44Å; I31-F70 HydrophobicContact CD1-CE2 3.8Å; I31-F70 HydrophobicContact CD1-CG 4.32Å; F39-F70 AromaticContact CD1-CE2 3.94Å; F39-F70 HydrophobicContact CD1-CE2 3.94Å; F39-F70 AromaticContact CD1-CZ 3.79Å; F39-F70 HydrophobicContact CD1-CZ 3.79Å; F39-F70 HydrophobicContact CE1-CE2 4.24Å; F39-F70 AromaticContact CE1-CZ 3.63Å; F39-F70 HydrophobicContact CE1-CZ 3.63Å; F40-F70 AromaticContact CE1-CD2 3.94Å; F40-F70 HydrophobicContact CE1-CD2 3.94Å; F40-F70 AromaticContact CE1-CE2 3.53Å; F40-F70 HydrophobicContact CE1-CE2 3.53Å; F40-F70 HydrophobicContact CE1-CZ 4.38Å; F40-F70 AromaticContact CZ-CD2 3.88Å; F40-F70 HydrophobicContact CZ-CD2 3.88Å; F40-F70 AromaticContact CZ-CE2 3.93Å; F40-F70 HydrophobicContact CZ-CE2 3.93Å; M65-F70 HydrophobicContact CG-CB 4.13Å; M65-F70 HydrophobicContact SD-CB 4.09Å; M65-F70 HydrophobicContact SD-CD2 4.15Å; D66-F70 VanDerWaalsContact O-CB 3.3Å; D66-F70 WeakPolarHBondContact O-CB 3.33Å; D66-F70 PolarHBondContact O-N 3.25Å; K68-F70 VanDerWaalsContact C-N 3.34Å; K68-F70 PolarHBondContact O-N 2.88Å; F70-I72 VanDerWaalsContact C-N 3.34Å; F70-A73 PolarHBondContact O-N 3.37Å; F70-M74 HydrophobicContact CD1-CG 4.06Å; F70-M74 HydrophobicContact CE1-CG 3.64Å; F70-M74 HydrophobicContact CE2-CG 4.3Å; F70-M74 HydrophobicContact CZ-CG 3.79Å; F70-M74 HydrophobicContact CZ-SD 4.12Å; F70-M74 WeakPolarHBondContact O-CB 3.44Å; F70-M74 WeakPolarHBondContact O-CG 3.48Å; F70-M74 PolarHBondContact O-N 3.4Å
71	S	93	Very high	91	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-66.9	-36.5	174.4	-163.1	0	0	0	0	112.4	I9 R14 H17 K67 K68 E69 F75	I9-S71 WeakPolarHBondContact CD1-O 3.3Å; I9-S71 WeakPolarHBondContact CD1-OG 3.4Å; R14-S71 VanDerWaalsContact CD-CB 3.5Å; R14-S71 WeakPolarHBondContact CD-OG 3.27Å; H17-S71 PolarHBondContact ND1-O 2.85Å; H17-S71 PolarHBondContact ND1-OG 2.88Å; K67-S71 PolarHBondContact O-N 3.03Å; K68-S71 CarbonylContact O-C 3.07Å; K68-S71 WeakPolarHBondContact O-CA 3.35Å; K68-S71 VanDerWaalsContact O-CB 3.24Å; K68-S71 WeakPolarHBondContact O-CB 3.48Å; K68-S71 PolarHBondContact O-N 3.26Å; E69-S71 VanDerWaalsContact C-N 3.27Å; E69-S71 PolarHBondContact O-N 3.43Å; S71-F75 WeakPolarHBondContact O-CB 3.37Å; S71-F75 PolarHBondContact O-N 3.19Å
72	I	91.9	Very high	91	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-64.1	-50	172.1	-69	160.4	0	0	0	110.1	I9 A57 M59 K68 E69 F70 M74 F75 L76 L90 L94	I9-I72 HydrophobicContact CD1-CG1 4.29Å; A57-I72 HydrophobicContact CB-CB 4.3Å; A57-I72 HydrophobicContact CB-CG2 3.9Å; M59-I72 HydrophobicContact CE-CD1 4.39Å; M59-I72 HydrophobicContact CG-CD1 4.44Å; M59-I72 HydrophobicContact SD-CD1 3.92Å; K68-I72 HydrophobicContact CG-CD1 4.26Å; K68-I72 WeakPolarHBondContact O-CG1 3.32Å; K68-I72 PolarHBondContact O-N 2.78Å; E69-I72 CarbonylContact O-C 3.49Å; E69-I72 WeakPolarHBondContact O-CA 3.32Å; E69-I72 WeakPolarHBondContact O-CB 3.38Å; E69-I72 PolarHBondContact O-N 2.8Å; E69-I72 VanDerWaalsContact O-N 3.1Å; F70-I72 VanDerWaalsContact C-N 3.34Å; I72-M74 VanDerWaalsContact C-N 3.35Å; I72-M74 PolarHBondContact O-N 2.96Å; I72-F75 PolarHBondContact O-N 3.35Å; I72-F75 VanDerWaalsContact O-N 3.14Å; I72-L76 HydrophobicContact CG2-CD1 3.96Å; I72-L76 HydrophobicContact CG2-CG 4.38Å; I72-L76 WeakPolarHBondContact O-CG 3.42Å; I72-L76 PolarHBondContact O-N 2.65Å; I72-L90 HydrophobicContact CD1-CD2 4.1Å; I72-L90 HydrophobicContact CG2-CD1 3.51Å; I72-L90 HydrophobicContact CG2-CD2 4.18Å; I72-L94 HydrophobicContact CB-CD2 4.47Å; I72-L94 WeakPolarHBondContact CD1-O 3.47Å; I72-L94 HydrophobicContact CG1-CB 4.45Å; I72-L94 HydrophobicContact CG1-CD2 4.17Å; I72-L94 WeakPolarHBondContact CG1-O 3.44Å; I72-L94 HydrophobicContact CG2-CD2 4.35Å
73	A	93.8	Very high	90.8	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-57.7	-45.4	177.3	0	0	0	0	0	112	F40 I53 A57 M65 E69 F70 F75 L76 I77	F40-A73 HydrophobicContact CE1-CB 4.25Å; F40-A73 HydrophobicContact CE2-CB 3.99Å; F40-A73 HydrophobicContact CZ-CB 3.48Å; F40-A73 VanDerWaalsContact CZ-CB 3.48Å; I53-A73 HydrophobicContact CG2-CB 4.02Å; A57-A73 HydrophobicContact CB-CB 3.68Å; M65-A73 HydrophobicContact CE-CB 4.19Å; M65-A73 HydrophobicContact SD-CB 3.97Å; E69-A73 PolarHBondContact O-N 2.82Å; F70-A73 PolarHBondContact O-N 3.37Å; A73-F75 PolarHBondContact O-N 3.08Å; A73-L76 PolarHBondContact O-N 3.33Å; A73-I77 VanDerWaalsContact O-CG1 3.3Å; A73-I77 WeakPolarHBondContact O-CG1 3.39Å; A73-I77 PolarHBondContact O-N 3.41Å
74	M	93.7	Very high	90.5	Very high	27 Å²	27	34.3 Å²	34.3	13%	0.133	18%	0.181	C	C	.	.	H	α-helix	trans	-64.1	-37.2	176	-76.2	-54.5	-52.9	0	0	113	H17 F39 F40 F70 I72 I77 K78	H17-M74 HydrophobicContact CB-CB 4.44Å; F39-M74 HydrophobicContact CD1-SD 4.27Å; F39-M74 HydrophobicContact CE1-CE 4.43Å; F39-M74 HydrophobicContact CE1-SD 3.7Å; F40-M74 HydrophobicContact CD1-SD 4.26Å; F40-M74 HydrophobicContact CE1-SD 3.92Å; F70-M74 HydrophobicContact CD1-CG 4.06Å; F70-M74 HydrophobicContact CE1-CG 3.64Å; F70-M74 HydrophobicContact CE2-CG 4.3Å; F70-M74 HydrophobicContact CZ-CG 3.79Å; F70-M74 HydrophobicContact CZ-SD 4.12Å; F70-M74 WeakPolarHBondContact O-CB 3.44Å; F70-M74 WeakPolarHBondContact O-CG 3.48Å; F70-M74 PolarHBondContact O-N 3.4Å; I72-M74 VanDerWaalsContact C-N 3.35Å; I72-M74 PolarHBondContact O-N 2.96Å; M74-I77 HydrophobicContact SD-CD1 4.21Å; M74-K78 VanDerWaalsContact O-CB 3.3Å; M74-K78 WeakPolarHBondContact O-CB 3.33Å; M74-K78 PolarHBondContact O-N 2.95Å
75	F	91.7	Very high	90.2	Very high	5 Å²	5	36.3 Å²	36.3	2%	0.022	20%	0.201	C	C	.	.	H	α-helix	trans	-68.6	-39.3	173.9	-168.2	-86.5	0	0	0	112.1	R6 W7 V8 I9 S71 I72 A73 K78 K79 L94	R6-F75 WeakPolarHBondContact O-CZ 3.47Å; W7-F75 HydrophobicContact CE3-CD1 4.31Å; W7-F75 AromaticContact CE3-CE1 3.92Å; W7-F75 HydrophobicContact CE3-CE1 3.92Å; W7-F75 HydrophobicContact CZ3-CE1 4.49Å; V8-F75 WeakPolarHBondContact O-CE2 3.41Å; V8-F75 VanDerWaalsContact O-CZ 3.29Å; V8-F75 WeakPolarHBondContact O-CZ 3.45Å; I9-F75 HydrophobicContact CB-CD2 4.23Å; I9-F75 HydrophobicContact CD1-CB 4.22Å; I9-F75 HydrophobicContact CG1-CB 4.09Å; I9-F75 HydrophobicContact CG1-CD2 3.92Å; I9-F75 HydrophobicContact CG1-CG 4.03Å; I9-F75 HydrophobicContact CG2-CD2 4.3Å; S71-F75 WeakPolarHBondContact O-CB 3.37Å; S71-F75 PolarHBondContact O-N 3.19Å; I72-F75 PolarHBondContact O-N 3.35Å; I72-F75 VanDerWaalsContact O-N 3.14Å; A73-F75 PolarHBondContact O-N 3.08Å; F75-K78 WeakPolarHBondContact O-CB 3.44Å; F75-K78 PolarHBondContact O-N 2.97Å; F75-K79 HydrophobicContact CD1-CG 3.82Å; F75-K79 HydrophobicContact CE1-CD 4.05Å; F75-K79 HydrophobicContact CE1-CG 3.52Å; F75-K79 HydrophobicContact CZ-CD 4.3Å; F75-K79 HydrophobicContact CZ-CG 4.18Å; F75-K79 VanDerWaalsContact O-CG 3.3Å; F75-K79 WeakPolarHBondContact O-CG 3.29Å; F75-K79 PolarHBondContact O-N 2.91Å; F75-L94 HydrophobicContact CB-CD2 3.98Å; F75-L94 HydrophobicContact CD1-CD1 4.2Å; F75-L94 HydrophobicContact CD1-CD2 3.72Å; F75-L94 HydrophobicContact CD1-CG 4.35Å; F75-L94 HydrophobicContact CE1-CD2 4.42Å; F75-L94 HydrophobicContact CG-CD2 3.96Å
76	L	91.7	Very high	89.7	Confident	0 Å²	0	37.8 Å²	37.8	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-62.1	-48.7	173.8	-70.1	170.7	0	0	0	110.9	W7 I53 L56 A57 I72 A73 K78 K79 T80 L86 P87 L94	W7-L76 HydrophobicContact CZ3-CD2 3.98Å; I53-L76 HydrophobicContact CD1-CB 4.48Å; I53-L76 HydrophobicContact CG1-CB 4.13Å; I53-L76 HydrophobicContact CG2-CB 3.96Å; I53-L76 HydrophobicContact CG2-CD1 4.19Å; L56-L76 HydrophobicContact CB-CD1 3.74Å; L56-L76 HydrophobicContact CD1-CD1 4.46Å; A57-L76 HydrophobicContact CB-CD1 4.45Å; I72-L76 HydrophobicContact CG2-CD1 3.96Å; I72-L76 HydrophobicContact CG2-CG 4.38Å; I72-L76 WeakPolarHBondContact O-CG 3.42Å; I72-L76 PolarHBondContact O-N 2.65Å; A73-L76 PolarHBondContact O-N 3.33Å; L76-K78 VanDerWaalsContact C-N 3.33Å; L76-K78 PolarHBondContact O-N 3.09Å; L76-K79 PolarHBondContact O-N 3.4Å; L76-K79 VanDerWaalsContact O-N 3.12Å; L76-T80 PolarHBondContact O-N 2.9Å; L76-T80 PolarHBondContact O-OG1 3.47Å; L76-T80 VanDerWaalsContact O-OG1 3.07Å; L76-L86 HydrophobicContact CB-CD2 4.23Å; L76-L86 HydrophobicContact CD2-CD2 4.18Å; L76-P87 HydrophobicContact CD2-CG 4.07Å; L76-L94 HydrophobicContact CD2-CD1 4.26Å
77	I	93	Very high	89.1	Confident	7 Å²	7	36.5 Å²	36.5	4%	0.036	20%	0.203	C	C	.	.	H	α-helix	trans	-54.9	-48.9	174.5	-69.8	167.5	0	0	0	110.6	F40 L45 L50 I53 A73 M74 K79 T80 L81	F40-I77 HydrophobicContact CB-CD1 4Å; F40-I77 HydrophobicContact CD1-CD1 3.29Å; F40-I77 HydrophobicContact CD2-CD1 4.29Å; F40-I77 HydrophobicContact CE1-CD1 3.75Å; F40-I77 HydrophobicContact CG-CD1 3.62Å; F40-I77 HydrophobicContact CZ-CD1 4.42Å; L45-I77 HydrophobicContact CD1-CB 4.32Å; L45-I77 HydrophobicContact CD1-CG1 4.2Å; L45-I77 HydrophobicContact CD1-CG2 4.02Å; L50-I77 HydrophobicContact CD2-CD1 4.35Å; L50-I77 HydrophobicContact CD2-CG1 4.32Å; I53-I77 HydrophobicContact CD1-CG1 3.74Å; I53-I77 HydrophobicContact CG2-CG1 4.17Å; A73-I77 VanDerWaalsContact O-CG1 3.3Å; A73-I77 WeakPolarHBondContact O-CG1 3.39Å; A73-I77 PolarHBondContact O-N 3.41Å; M74-I77 HydrophobicContact SD-CD1 4.21Å; I77-K79 VanDerWaalsContact C-N 3.33Å; I77-K79 PolarHBondContact O-N 3.39Å; I77-T80 PolarHBondContact O-N 3.36Å; I77-L81 HydrophobicContact CG2-CD1 3.9Å; I77-L81 HydrophobicContact CG2-CG 4.45Å; I77-L81 WeakPolarHBondContact O-CB 3.36Å; I77-L81 WeakPolarHBondContact O-CG 3.48Å; I77-L81 PolarHBondContact O-N 3.44Å
78	K	90.7	Very high	88.3	Confident	71 Å²	71	37.7 Å²	37.7	31%	0.309	22%	0.222	S	C	.	.	H	α-helix	trans	-55.4	-46.6	176.5	-179.7	-178.9	177.8	-178	0	111.4	D13 M74 F75 L76 L81 E82	D13-K78 IonicContact OD1-NZ 3.83Å; D13-K78 PolarHBondContact OD1-NZ 2.89Å; D13-K78 IonicContact OD2-NZ 3.75Å; D13-K78 PolarHBondContact OD2-NZ 3.27Å; M74-K78 VanDerWaalsContact O-CB 3.3Å; M74-K78 WeakPolarHBondContact O-CB 3.33Å; M74-K78 PolarHBondContact O-N 2.95Å; F75-K78 WeakPolarHBondContact O-CB 3.44Å; F75-K78 PolarHBondContact O-N 2.97Å; L76-K78 VanDerWaalsContact C-N 3.33Å; L76-K78 PolarHBondContact O-N 3.09Å; K78-L81 PolarHBondContact O-N 3.35Å; K78-E82 WeakPolarHBondContact O-CG 3.41Å; K78-E82 PolarHBondContact O-N 3.05Å
79	K	88.1	Confident	87.9	Confident	22 Å²	22	40.8 Å²	40.8	10%	0.096	24%	0.244	C	C	.	.	H	α-helix	trans	-70.1	-35.4	179.7	-68	-72.2	163.2	-130.9	0	113.5	W7 F75 L76 I77 E82 G83 L84	W7-K79 HydrophobicContact CE3-CG 4.27Å; W7-K79 HydrophobicContact CH2-CB 3.98Å; W7-K79 HydrophobicContact CH2-CG 4.36Å; W7-K79 HydrophobicContact CZ3-CB 3.74Å; W7-K79 HydrophobicContact CZ3-CG 3.77Å; F75-K79 HydrophobicContact CD1-CG 3.82Å; F75-K79 HydrophobicContact CE1-CD 4.05Å; F75-K79 HydrophobicContact CE1-CG 3.52Å; F75-K79 HydrophobicContact CZ-CD 4.3Å; F75-K79 HydrophobicContact CZ-CG 4.18Å; F75-K79 VanDerWaalsContact O-CG 3.3Å; F75-K79 WeakPolarHBondContact O-CG 3.29Å; F75-K79 PolarHBondContact O-N 2.91Å; L76-K79 PolarHBondContact O-N 3.4Å; L76-K79 VanDerWaalsContact O-N 3.12Å; I77-K79 VanDerWaalsContact C-N 3.33Å; I77-K79 PolarHBondContact O-N 3.39Å; K79-E82 IonicContact NZ-OE1 2.79Å; K79-E82 PolarHBondContact NZ-OE1 3.06Å; K79-E82 IonicContact NZ-OE2 2.79Å; K79-E82 PolarHBondContact NZ-OE2 2.67Å; K79-E82 PolarHBondContact O-N 3.28Å; K79-G83 PolarHBondContact O-N 3.32Å; K79-L84 HydrophobicContact CB-CD1 4.39Å; K79-L84 HydrophobicContact CD-CD1 3.61Å; K79-L84 WeakPolarHBondContact O-CB 3.33Å; K79-L84 PolarHBondContact O-N 3Å
80	T	89.9	Confident	87.2	Confident	29 Å²	29	41.4 Å²	41.4	18%	0.178	25%	0.248	C	C	.	.	H	α-helix	trans	-68.1	-37.5	173.7	-53.7	0	0	0	0	112	L45 V49 L76 I77 G83 L86	L45-T80 HydrophobicContact CD1-CG2 4.13Å; L45-T80 HydrophobicContact CD2-CG2 3.77Å; V49-T80 HydrophobicContact CG1-CG2 4.02Å; L76-T80 PolarHBondContact O-N 2.9Å; L76-T80 PolarHBondContact O-OG1 3.47Å; L76-T80 VanDerWaalsContact O-OG1 3.07Å; I77-T80 PolarHBondContact O-N 3.36Å; T80-G83 WeakPolarHBondContact O-CA 3.24Å; T80-G83 PolarHBondContact O-N 2.92Å; T80-L86 VanDerWaalsContact OG1-CD2 3.27Å; T80-L86 WeakPolarHBondContact OG1-CD2 3.32Å
81	L	88.7	Confident	86.4	Confident	103 Å²	103	42.2 Å²	42.2	54%	0.539	25%	0.253	S	S	.	.	H	α-helix	trans	-70.8	-30	172.8	-68.5	173.6	0	0	0	113	L45 I77 K78 G83	L45-L81 HydrophobicContact CD2-CD2 3.78Å; L45-L81 HydrophobicContact CD2-CG 4.32Å; L45-L81 HydrophobicContact CG-CD2 4.1Å; L45-L81 HydrophobicContact CG-CG 4.44Å; I77-L81 HydrophobicContact CG2-CD1 3.9Å; I77-L81 HydrophobicContact CG2-CG 4.45Å; I77-L81 WeakPolarHBondContact O-CB 3.36Å; I77-L81 WeakPolarHBondContact O-CG 3.48Å; I77-L81 PolarHBondContact O-N 3.44Å; K78-L81 PolarHBondContact O-N 3.35Å; L81-G83 PolarHBondContact O-N 2.77Å
82	E	86.7	Confident	85.5	Confident	100 Å²	100	45.5 Å²	45.5	47%	0.467	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.2	0.1	166.1	-71.6	172.9	-148.3	0	0	113.2	K78 K79	K78-E82 WeakPolarHBondContact O-CG 3.41Å; K78-E82 PolarHBondContact O-N 3.05Å; K79-E82 IonicContact NZ-OE1 2.79Å; K79-E82 PolarHBondContact NZ-OE1 3.06Å; K79-E82 IonicContact NZ-OE2 2.79Å; K79-E82 PolarHBondContact NZ-OE2 2.67Å; K79-E82 PolarHBondContact O-N 3.28Å
83	G	83.6	Confident	84.4	Confident	65 Å²	65	46.7 Å²	46.7	67%	0.67	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	83.1	11.8	176.8	0	0	0	0	0	115.3	K79 T80 L81	K79-G83 PolarHBondContact O-N 3.32Å; T80-G83 WeakPolarHBondContact O-CA 3.24Å; T80-G83 PolarHBondContact O-N 2.92Å; L81-G83 PolarHBondContact O-N 2.77Å
84	L	81.2	Confident	83.4	Confident	46 Å²	46	46.7 Å²	46.7	24%	0.241	29%	0.287	C	S	.	.	P	Polyproline II helix	trans	-84.5	138	175.4	-65.7	166.2	0	0	0	110.9	K79	K79-L84 HydrophobicContact CB-CD1 4.39Å; K79-L84 HydrophobicContact CD-CD1 3.61Å; K79-L84 WeakPolarHBondContact O-CB 3.33Å; K79-L84 PolarHBondContact O-N 3Å
85	P	82.7	Confident	82.3	Confident	106 Å²	106	50.4 Å²	50.4	69%	0.688	30%	0.302	S	S	*	.	P	Polyproline II helix	trans	-64.5	146	176	28.4	-34.8	0	0	0	110.9
86	L	82.4	Confident	81.1	Confident	30 Å²	30	55.6 Å²	55.6	16%	0.157	33%	0.33	C	S	.	.	P	Polyproline II helix	trans	-65.1	134.2	174.7	-77.1	170.5	0	0	0	110.6	V49 Q52 I53 L56 L76 T80	V49-L86 HydrophobicContact CG1-CD1 3.95Å; Q52-L86 HydrophobicContact CB-CD1 4.17Å; Q52-L86 HydrophobicContact CG-CD1 4.07Å; I53-L86 HydrophobicContact CD1-CD1 4.29Å; I53-L86 HydrophobicContact CD1-CD2 4.11Å; I53-L86 HydrophobicContact CG1-CD1 3.75Å; I53-L86 HydrophobicContact CG1-CD2 3.59Å; I53-L86 HydrophobicContact CG1-CG 4.33Å; L56-L86 HydrophobicContact CD1-CB 4.44Å; L56-L86 HydrophobicContact CD1-CD2 4.41Å; L76-L86 HydrophobicContact CB-CD2 4.23Å; L76-L86 HydrophobicContact CD2-CD2 4.18Å; T80-L86 VanDerWaalsContact OG1-CD2 3.27Å; T80-L86 WeakPolarHBondContact OG1-CD2 3.32Å
87	P	79.1	Confident	79.7	Confident	23 Å²	23	59.1 Å²	59.1	15%	0.149	35%	0.349	C	S	.	.	P	Polyproline II helix	trans	-70.8	141.5	177.4	31.7	-34.5	0	0	0	109.7	W7 L56 L76 T89 P91	W7-P87 HydrophobicContact CH2-CG 4.18Å; W7-P87 HydrophobicContact CZ2-CG 4.37Å; W7-P87 HydrophobicContact CZ3-CG 4.39Å; L56-P87 VanDerWaalsContact CD1-O 3.25Å; L56-P87 WeakPolarHBondContact CD1-O 3.15Å; L56-P87 WeakPolarHBondContact CD2-O 3.2Å; L76-P87 HydrophobicContact CD2-CG 4.07Å; P87-T89 PolarHBondContact O-N 2.77Å; P87-P91 HydrophobicContact CB-CG 4.03Å; P87-P91 HydrophobicContact CG-CG 4.03Å
88	S	75.3	Confident	77.9	Confident	111 Å²	111	60.2 Å²	60.2	78%	0.776	36%	0.356	S	S	*	.	S	Bend	trans	-70.6	-16.9	-179.1	53.3	0	0	0	0	114
89	T	80.8	Confident	75.5	Confident	105 Å²	105	62 Å²	62	64%	0.644	37%	0.366	S	S	*	.	S	Bend	trans	-143.6	147.6	173.1	52.5	0	0	0	0	108.9	P87 P91	P87-T89 PolarHBondContact O-N 2.77Å; T89-P91 WeakPolarHBondContact O-CD 3.49Å
90	L	79.6	Confident	73.1	Confident	19 Å²	19	64.2 Å²	64.2	10%	0.099	38%	0.382	C	S	.	.			trans	-64.7	116.2	-175.4	-177.4	65.2	0	0	0	111.7	L56 M59 I72 L94 K95	L56-L90 WeakPolarHBondContact O-CD1 3.35Å; L56-L90 WeakPolarHBondContact O-CD2 3.37Å; M59-L90 HydrophobicContact CG-CD2 3.91Å; M59-L90 HydrophobicContact SD-CD2 3.67Å; I72-L90 HydrophobicContact CD1-CD2 4.1Å; I72-L90 HydrophobicContact CG2-CD1 3.51Å; I72-L90 HydrophobicContact CG2-CD2 4.18Å; L90-L94 HydrophobicContact CD1-CB 3.75Å; L90-L94 HydrophobicContact CD1-CD1 3.81Å; L90-L94 HydrophobicContact CD1-CG 4.36Å; L90-L94 HydrophobicContact CG-CB 4.23Å; L90-K95 HydrophobicContact CD2-CD 4.43Å; L90-K95 HydrophobicContact CD2-CG 3.75Å; L90-K95 HydrophobicContact CG-CG 4.14Å; L90-K95 WeakPolarHBondContact O-CE 3.36Å
91	P	77.3	Confident	70.5	Confident	18 Å²	18	65.3 Å²	65.3	12%	0.117	39%	0.394	C	S	.	.			trans	-60	141.9	-177.4	-26.5	36.1	0	0	0	113	W7 P87 T89 G93 L94	W7-P91 HydrophobicContact CB-CB 3.79Å; W7-P91 HydrophobicContact CB-CG 4.03Å; W7-P91 HydrophobicContact CD2-CG 4.01Å; W7-P91 HydrophobicContact CG-CB 4.04Å; W7-P91 HydrophobicContact CG-CG 3.78Å; P87-P91 HydrophobicContact CB-CG 4.03Å; P87-P91 HydrophobicContact CG-CG 4.03Å; T89-P91 WeakPolarHBondContact O-CD 3.49Å; P91-G93 PolarHBondContact O-N 2.83Å; P91-G93 VanDerWaalsContact O-N 3.1Å; P91-L94 HydrophobicContact CG-CD1 4.43Å; P91-L94 WeakPolarHBondContact O-CB 3.19Å; P91-L94 PolarHBondContact O-N 3.34Å
92	P	72.9	Confident	68	Low	69 Å²	69	62.5 Å²	62.5	45%	0.448	38%	0.378	S	S	.	.	H	α-helix	trans	-57.8	-28.8	-177.4	-30.3	38.8	0	0	0	115.3	W4 L94 K95	W4-P92 HydrophobicContact CH2-CG 4.48Å; W4-P92 HydrophobicContact CZ3-CG 3.81Å; P92-L94 PolarHBondContact O-N 3.06Å; P92-K95 PolarHBondContact O-N 3.45Å
93	G	68.7	Low	65.3	Low	24 Å²	24	58.1 Å²	58.1	25%	0.247	36%	0.358	C	S	.	.	H	α-helix	trans	-63.1	-23.7	175	0	0	0	0	0	114.7	W7 P91	W7-G93 CarbonylContact O-C 3.55Å; W7-G93 WeakPolarHBondContact O-CA 3.27Å; P91-G93 PolarHBondContact O-N 2.83Å; P91-G93 VanDerWaalsContact O-N 3.1Å
94	L	72.7	Confident	62.9	Low	1 Å²	1	58 Å²	58	1%	0.005	34%	0.344	C	S	.	.	H	α-helix	trans	-85	-22.2	175.9	-88.5	160.1	0	0	0	113.2	W7 I9 I72 F75 L76 L90 P91 P92 N96	W7-L94 HydrophobicContact CB-CD1 4.33Å; W7-L94 HydrophobicContact CE3-CD1 3.81Å; W7-L94 PolarHBondContact O-N 2.86Å; I9-L94 HydrophobicContact CD1-CD2 3.74Å; I9-L94 HydrophobicContact CG1-CD2 3.52Å; I72-L94 HydrophobicContact CB-CD2 4.47Å; I72-L94 WeakPolarHBondContact CD1-O 3.47Å; I72-L94 HydrophobicContact CG1-CB 4.45Å; I72-L94 HydrophobicContact CG1-CD2 4.17Å; I72-L94 WeakPolarHBondContact CG1-O 3.44Å; I72-L94 HydrophobicContact CG2-CD2 4.35Å; F75-L94 HydrophobicContact CB-CD2 3.98Å; F75-L94 HydrophobicContact CD1-CD1 4.2Å; F75-L94 HydrophobicContact CD1-CD2 3.72Å; F75-L94 HydrophobicContact CD1-CG 4.35Å; F75-L94 HydrophobicContact CE1-CD2 4.42Å; F75-L94 HydrophobicContact CG-CD2 3.96Å; L76-L94 HydrophobicContact CD2-CD1 4.26Å; L90-L94 HydrophobicContact CD1-CB 3.75Å; L90-L94 HydrophobicContact CD1-CD1 3.81Å; L90-L94 HydrophobicContact CD1-CG 4.36Å; L90-L94 HydrophobicContact CG-CB 4.23Å; P91-L94 HydrophobicContact CG-CD1 4.43Å; P91-L94 WeakPolarHBondContact O-CB 3.19Å; P91-L94 PolarHBondContact O-N 3.34Å; P92-L94 PolarHBondContact O-N 3.06Å; L94-N96 VanDerWaalsContact C-N 3.34Å
95	K	71.7	Confident	60.2	Low	105 Å²	105	60 Å²	60	46%	0.457	36%	0.362	S	S	.	.	H	α-helix	trans	-79	-18.5	-178.3	-61.7	-168.6	177.6	-167.1	0	113.4	M59 K68 L90 P92	M59-K95 HydrophobicContact SD-CG 4.13Å; K68-K95 WeakPolarHBondContact CE-O 3.24Å; K68-K95 PolarHBondContact NZ-O 3Å; L90-K95 HydrophobicContact CD2-CD 4.43Å; L90-K95 HydrophobicContact CD2-CG 3.75Å; L90-K95 HydrophobicContact CG-CG 4.14Å; L90-K95 WeakPolarHBondContact O-CE 3.36Å; P92-K95 PolarHBondContact O-N 3.45Å
96	N	66.9	Low	57.8	Low	114 Å²	114	55.1 Å²	55.1	61%	0.61	33%	0.331	S	S	*	.	S	Bend	trans	-85.3	133.1	176.3	-65	-32.9	0	0	0	109.7	L94	L94-N96 VanDerWaalsContact C-N 3.34Å
97	D	61.9	Low	55.5	Low	74 Å²	74	58.4 Å²	58.4	40%	0.396	35%	0.352	S	S	.	.			trans	-65.8	140	170.4	-73.8	-74.4	0	0	0	109.9	R14 K68 Q99	R14-D97 IonicContact CZ-OD1 3.27Å; R14-D97 VanDerWaalsContact CZ-OD1 3.25Å; R14-D97 IonicContact NH1-OD1 2.83Å; R14-D97 PolarHBondContact NH1-OD1 3.3Å; R14-D97 IonicContact NH2-OD1 2.82Å; R14-D97 PolarHBondContact NH2-OD1 3.4Å; K68-D97 WeakPolarHBondContact CD-OD1 3.37Å; K68-D97 WeakPolarHBondContact CD-OD2 3.25Å; K68-D97 WeakPolarHBondContact CE-OD2 3.49Å; K68-D97 WeakPolarHBondContact CG-OD1 3.36Å; K68-D97 IonicContact NZ-OD2 2.65Å; K68-D97 PolarHBondContact NZ-OD2 3Å; D97-Q99 PolarHBondContact O-N 3.26Å
98	P	54.8	Low	53	Low	29 Å²	29	62 Å²	62	19%	0.188	37%	0.373	C	S	.	.			trans	-70.7	100.6	-172.7	26.7	-31	0	0	0	109.2	I9 R14	I9-P98 WeakPolarHBondContact O-CB 3.47Å; R14-P98 HydrophobicContact CB-CG 3.54Å; R14-P98 HydrophobicContact CG-CG 3.55Å
99	Q	41.1	Very low	51	Low	110 Å²	110	63.1 Å²	63.1	51%	0.514	37%	0.37	S	S	.	.			trans	-40.5	137.1	162.7	-65.2	-77.1	-68	0	0	108.7	T11 D97 A101	T11-Q99 PolarHBondContact OG1-O 3.43Å; D97-Q99 PolarHBondContact O-N 3.26Å; Q99-A101 PolarHBondContact O-N 3.22Å; Q99-A101 VanDerWaalsContact O-N 3.14Å
100	P	36.3	Very low	48.4	Very low	67 Å²	67	64 Å²	64	44%	0.435	38%	0.38	S	S	.	.			trans	-50.7	125.5	173.5	-27.1	35.4	0	0	0	109.9	F102	P100-F102 HydrophobicContact CB-CD2 3.72Å; P100-F102 HydrophobicContact CB-CE2 4.29Å; P100-F102 PolarHBondContact O-N 2.89Å
101	A	36.8	Very low	46	Very low	52 Å²	52	69.3 Å²	69.3	43%	0.43	41%	0.408	S	S	.	.	S	Bend	trans	-70.9	24.7	-173.9	0	0	0	0	0	114.2	T11 Q99 I103 R151	T11-A101 WeakPolarHBondContact OG1-CB 3.5Å; T11-A101 PolarHBondContact OG1-N 2.93Å; Q99-A101 PolarHBondContact O-N 3.22Å; Q99-A101 VanDerWaalsContact O-N 3.14Å; A101-I103 PolarHBondContact O-N 3.25Å; A101-R151 PolarHBondContact O-NH2 2.86Å
102	F	35.3	Very low	43.7	Very low	44 Å²	44	73.8 Å²	73.8	19%	0.193	44%	0.44	C	S	.	.	S	Bend	trans	-68.4	54.5	160.1	-63.1	-50.1	0	0	0	111.6	P100 L155 Q178 Y179	P100-F102 HydrophobicContact CB-CD2 3.72Å; P100-F102 HydrophobicContact CB-CE2 4.29Å; P100-F102 PolarHBondContact O-N 2.89Å; F102-L155 HydrophobicContact CD1-CD1 3.97Å; F102-L155 HydrophobicContact CD1-CD2 4.27Å; F102-L155 HydrophobicContact CE1-CD1 3.71Å; F102-Q178 HydrophobicContact CD2-CB 4.29Å; F102-Q178 HydrophobicContact CE2-CB 3.85Å; F102-Q178 VanDerWaalsContact CE2-OE1 3.26Å; F102-Y179 HydrophobicContact CB-CD1 4.11Å; F102-Y179 HydrophobicContact CB-CE1 3.59Å; F102-Y179 HydrophobicContact CB-CE2 4.2Å; F102-Y179 HydrophobicContact CG-CE2 4.35Å; F102-Y179 WeakPolarHBondContact O-CE1 3.45Å
103	I	30.7	Very low	41.6	Very low	9 Å²	9	77.9 Å²	77.9	5%	0.046	46%	0.457	C	S	.	.			trans	48.8	98.1	172	-35.4	100.2	0	0	0	115.3	A101 R151 Y152 I210 E214	A101-I103 PolarHBondContact O-N 3.25Å; I103-R151 HydrophobicContact CG1-CG 4.09Å; I103-Y152 HydrophobicContact CD1-CD1 3.94Å; I103-Y152 HydrophobicContact CD1-CE1 3.82Å; I103-Y152 HydrophobicContact CG1-CD1 4.45Å; I103-Y152 HydrophobicContact CG1-CE1 4.05Å; I103-I210 HydrophobicContact CD1-CG2 3.68Å; I103-E214 HydrophobicContact CB-CG 4.16Å; I103-E214 VanDerWaalsContact CB-OE1 3.27Å; I103-E214 WeakPolarHBondContact CB-OE1 3.46Å; I103-E214 HydrophobicContact CG2-CG 4.18Å; I103-E214 VanDerWaalsContact CG2-OE1 3.24Å; I103-E214 WeakPolarHBondContact CG2-OE1 3.44Å; I103-E214 WeakPolarHBondContact CG2-OE2 3.47Å; I103-E214 WeakPolarHBondContact O-CG 3.15Å
104	T	33	Very low	39.8	Very low	63 Å²	63	83 Å²	83	39%	0.387	48%	0.483	S	S	.	.			trans	-126	142.5	165.9	62.1	0	0	0	0	109.5	G106	T104-G106 WeakPolarHBondContact CG2-O 3.31Å
105	S	24.4	Very low	37.8	Very low	87 Å²	87	88 Å²	88	61%	0.608	52%	0.519	S	S	*	.	S	Bend	cis	35.9	76	-16.9	-58.3	0	0	0	0	118.1	S218	S105-S218 PolarHBondContact O-OG 3.49Å
106	G	32.1	Very low	35.8	Very low	4 Å²	4	90 Å²	90	4%	0.041	53%	0.534	C	S	.	.			trans	130.4	59.8	-178.6	0	0	0	0	0	112.4	T104 I217	T104-G106 WeakPolarHBondContact CG2-O 3.31Å; G106-I217 VanDerWaalsContact O-CG2 3.3Å; G106-I217 WeakPolarHBondContact O-CG2 3.26Å
107	V	34	Very low	34.2	Very low	98 Å²	98	89.6 Å²	89.6	59%	0.594	54%	0.541	S	S	*	.				21.8	104.8	87.3	-70.7	0	0	0	0	114.5
108	T	27.5	Very low	32.8	Very low	98 Å²	98	90 Å²	90	60%	0.601	56%	0.562	S	S	*	*			trans	47.7	132.6	138.3	63.6	0	0	0	0	119
109	L	31.8	Very low	31.6	Very low	135 Å²	135	95.2 Å²	95.2	71%	0.707	59%	0.588	S	S	*	*				-157.5	136.4	59.3	-82.7	162.2	0	0	0	112.5	L111	L109-L111 HydrophobicContact CB-CD1 4.35Å; L109-L111 HydrophobicContact CB-CG 4.41Å; L109-L111 HydrophobicContact CD1-CD1 3.91Å; L109-L111 PolarHBondContact O-N 3.45Å
110	S	26.6	Very low	31.1	Very low	123 Å²	123	97.1 Å²	97.1	86%	0.86	60%	0.602	S	S	*	*			trans	-77.4	110	153.1	52.2	0	0	0	0	109.2
111	L	29.8	Very low	30.8	Very low	131 Å²	131	97 Å²	97	69%	0.686	61%	0.613	S	S	*	*			trans	-130.7	106.5	172.2	-92.3	169.8	0	0	0	110.3	L109	L109-L111 HydrophobicContact CB-CD1 4.35Å; L109-L111 HydrophobicContact CB-CG 4.41Å; L109-L111 HydrophobicContact CD1-CD1 3.91Å; L109-L111 PolarHBondContact O-N 3.45Å
112	S	28.7	Very low	30.6	Very low	113 Å²	113	102.6 Å²	102.6	79%	0.79	64%	0.635	S	S	*	*			trans	-72.4	123.2	159.4	50.5	0	0	0	0	108.9	V114	S112-V114 PolarHBondContact O-N 3.46Å
113	L	28.3	Very low	30.7	Very low	154 Å²	154	105.3 Å²	105.3	81%	0.806	66%	0.66	S	S	*	*			trans	-54.2	137.3	161.5	-77.6	62.8	0	0	0	108.6
114	V	32.2	Very low	30.8	Very low	131 Å²	131	110 Å²	110	79%	0.794	69%	0.693	S	S	*	*				-171.4	155.6	95.5	-84.6	0	0	0	0	111.8	S112	S112-V114 PolarHBondContact O-N 3.46Å
115	S	30.4	Very low	30.8	Very low	108 Å²	108	112.8 Å²	112.8	76%	0.755	71%	0.71	S	S	*	*			trans	69.2	113.6	151.2	-59.6	0	0	0	0	121.9
116	D	29.3	Very low	31.3	Very low	145 Å²	145	113.7 Å²	113.7	78%	0.775	72%	0.716	S	S	*	*				99.3	127.1	124.1	-114.7	-36.9	0	0	0	123.7
117	S	32.2	Very low	31.5	Very low	107 Å²	107	118 Å²	118	75%	0.748	75%	0.745	S	S	*	*			trans	42	108.5	145.1	-68.3	0	0	0	0	123.8
118	G	32.6	Very low	31.6	Very low	81 Å²	81	121.6 Å²	121.6	84%	0.835	76%	0.76	S	S	*	*			trans	85.8	170.9	141.6	0	0	0	0	0	117.7
119	N	31.5	Very low	32	Very low	139 Å²	139	120 Å²	120	74%	0.743	76%	0.762	S	S	*	*			cis	-162.1	145.5	-17.9	-168.6	20.2	0	0	0	110.1
120	N	29.8	Very low	32.3	Very low	150 Å²	150	121.8 Å²	121.8	80%	0.802	77%	0.767	S	S	*	*			trans	33.5	131.8	160.5	-68.5	-20.1	0	0	0	123.5
121	G	30.6	Very low	32.4	Very low	66 Å²	66	122 Å²	122	68%	0.68	76%	0.759	S	S	*	*			trans	152.9	100.7	158.9	0	0	0	0	0	112.2
122	L	31.3	Very low	32.8	Very low	169 Å²	169	121.1 Å²	121.1	89%	0.885	76%	0.763	S	S	*	*				61.9	127.3	72.8	-57.1	170.3	0	0	0	111.7
123	S	36.7	Very low	32.9	Very low	101 Å²	101	123.1 Å²	123.1	71%	0.706	77%	0.765	S	S	*	*			cis	-155.3	145.4	22.9	-32.6	0	0	0	0	110.2
124	S	33.2	Very low	33.1	Very low	106 Å²	106	121.8 Å²	121.8	74%	0.741	77%	0.769	S	S	*	*				73.2	139.2	81	98.2	0	0	0	0	115
125	V	33.2	Very low	33.1	Very low	123 Å²	123	118.9 Å²	118.9	75%	0.745	76%	0.759	S	S	*	*			cis	-157.5	164.4	0.9	-159	0	0	0	0	109.2
126	S	36	Very low	33.2	Very low	106 Å²	106	118.7 Å²	118.7	74%	0.741	76%	0.757	S	S	*	*			trans	65.7	154	144.9	52.4	0	0	0	0	121.9
127	S	36.8	Very low	33.5	Very low	94 Å²	94	117.1 Å²	117.1	66%	0.657	75%	0.753	S	S	*	*			cis	-176.1	146.6	-24.1	56	0	0	0	0	112.8
128	I	35.3	Very low	33.7	Very low	174 Å²	174	116.3 Å²	116.3	89%	0.892	75%	0.753	S	S	*	*			trans	69.2	142.3	150	-68.3	163.1	0	0	0	118.9
129	G	35.3	Very low	34.1	Very low	64 Å²	64	122.5 Å²	122.5	66%	0.66	75%	0.752	S	S	*	*			trans	105.5	71	167.9	0	0	0	0	0	114.5
130	Q	37.7	Very low	34.9	Very low	173 Å²	173	121.7 Å²	121.7	81%	0.808	74%	0.744	S	S	*	*				83.7	140.2	88.7	-97.6	-165.1	-101.8	0	0	117.1
131	D	30.5	Very low	36.1	Very low	128 Å²	128	118.3 Å²	118.3	68%	0.684	73%	0.726	S	S	*	*			trans	79.1	116	154.9	-57.1	-5.5	0	0	0	122.6
132	S	36.4	Very low	37.9	Very low	111 Å²	111	118.4 Å²	118.4	78%	0.776	71%	0.706	S	S	*	*			trans	86.5	124.9	147.5	76.3	0	0	0	0	121.9
133	N	31.4	Very low	39.6	Very low	156 Å²	156	113.9 Å²	113.9	83%	0.834	68%	0.682	S	S	*	*			trans	49.3	95.5	150	-65.8	-17.2	0	0	0	121
134	S	33.7	Very low	41.1	Very low	126 Å²	126	109.7 Å²	109.7	88%	0.881	65%	0.652	S	S	*	*			trans	-157.7	95.6	137.5	-86.9	0	0	0	0	114.8
135	A	30.4	Very low	43	Very low	70 Å²	70	107.8 Å²	107.8	58%	0.579	64%	0.635	S	S	*	*			trans	42.3	99.3	136.9	0	0	0	0	0	121.4	T137	A135-T137 VanDerWaalsContact C-N 3.29Å; A135-T137 PolarHBondContact O-N 2.9Å; A135-T137 PolarHBondContact O-OG1 3.01Å
136	S	34.5	Very low	44.5	Very low	104 Å²	104	107.3 Å²	107.3	73%	0.727	64%	0.637	S	S	*	*				52.3	3	122.9	62.4	0	0	0	0	122.9	A138 Q140	S136-A138 PolarHBondContact O-N 3.42Å; S136-Q140 PolarHBondContact O-OE1 2.9Å
137	T	35	Very low	46.3	Very low	112 Å²	112	107.8 Å²	107.8	69%	0.687	64%	0.636	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.6	-11.2	-158.4	-58.3	0	0	0	0	115.7	A135 Y139	A135-T137 VanDerWaalsContact C-N 3.29Å; A135-T137 PolarHBondContact O-N 2.9Å; A135-T137 PolarHBondContact O-OG1 3.01Å; T137-Y139 PolarHBondContact O-N 2.97Å
138	A	37	Very low	48.4	Very low	90 Å²	90	105.3 Å²	105.3	74%	0.744	62%	0.616	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.7	-15.8	-172.1	0	0	0	0	0	116.5	S136	S136-A138 PolarHBondContact O-N 3.42Å
139	Y	40.9	Very low	50.7	Low	210 Å²	210	100.4 Å²	100.4	82%	0.824	59%	0.586	S	S	*	*	S	Bend	trans	-103.5	-11.1	-178	-88.9	-84.7	0	0	0	114.6	T137 D141	T137-Y139 PolarHBondContact O-N 2.97Å; Y139-D141 PolarHBondContact O-N 3.12Å
140	Q	46.8	Very low	53	Low	122 Å²	122	101.2 Å²	101.2	57%	0.57	58%	0.58	S	S	*	*	G	3₁₀ helix	trans	-67.2	-19.4	173.8	-100.2	67.1	12.6	0	0	113	S136 W142 I143	S136-Q140 PolarHBondContact O-OE1 2.9Å; Q140-W142 VanDerWaalsContact C-N 3.26Å; Q140-W142 PolarHBondContact O-N 3.27Å; Q140-W142 VanDerWaalsContact O-N 3.16Å; Q140-I143 PolarHBondContact O-N 3.37Å
141	D	56	Low	55.3	Low	80 Å²	80	98.4 Å²	98.4	43%	0.428	56%	0.562	S	S	.	*	G	3₁₀ helix	trans	-74.2	-12.4	-159.5	-152.3	44.6	0	0	0	114.8	Y139 K215	Y139-D141 PolarHBondContact O-N 3.12Å; D141-K215 WeakPolarHBondContact O-CE 3.48Å; D141-K215 PolarHBondContact O-NZ 2.9Å; D141-K215 IonicContact OD1-NZ 3.61Å; D141-K215 PolarHBondContact OD1-NZ 2.95Å; D141-K215 IonicContact OD2-NZ 2.7Å; D141-K215 PolarHBondContact OD2-NZ 2.72Å
142	W	67.4	Low	58.2	Low	67 Å²	67	92.3 Å²	92.3	25%	0.254	53%	0.529	S	S	.	.	G	3₁₀ helix	trans	-119.3	38.6	175.5	-62.1	98.2	0	0	0	112.7	Q140 F211 L212 K215 P223 P227 L230	Q140-W142 VanDerWaalsContact C-N 3.26Å; Q140-W142 PolarHBondContact O-N 3.27Å; Q140-W142 VanDerWaalsContact O-N 3.16Å; W142-F211 HydrophobicContact CE3-CE1 4.18Å; W142-L212 HydrophobicContact CZ3-CD2 4.18Å; W142-K215 HydrophobicContact CH2-CB 4.33Å; W142-K215 HydrophobicContact CH2-CD 4.41Å; W142-K215 HydrophobicContact CH2-CG 4.34Å; W142-K215 HydrophobicContact CZ3-CB 4.17Å; W142-K215 HydrophobicContact CZ3-CD 4.46Å; W142-K215 HydrophobicContact CZ3-CG 4Å; W142-P223 HydrophobicContact CD2-CG 4.43Å; W142-P223 HydrophobicContact CE3-CG 3.97Å; W142-P223 HydrophobicContact CH2-CG 3.56Å; W142-P223 HydrophobicContact CZ2-CG 4.02Å; W142-P223 HydrophobicContact CZ3-CG 3.52Å; W142-P227 HydrophobicContact CB-CB 3.87Å; W142-P227 HydrophobicContact CB-CG 4.07Å; W142-P227 HydrophobicContact CD2-CG 3.95Å; W142-P227 HydrophobicContact CE3-CG 4.1Å; W142-P227 HydrophobicContact CG-CB 4.19Å; W142-P227 HydrophobicContact CG-CG 3.93Å; W142-L230 VanDerWaalsContact O-CD2 3.29Å; W142-L230 WeakPolarHBondContact O-CD2 3.47Å; W142-L230 WeakPolarHBondContact O-CG 3.47Å
143	I	66.7	Low	60.8	Low	75 Å²	75	91.4 Å²	91.4	39%	0.385	51%	0.508	S	S	.	.	S	Bend	trans	-125.2	126.3	178.3	-53.7	179.6	0	0	0	109.8	Q140 T145 F211	Q140-I143 PolarHBondContact O-N 3.37Å; I143-T145 PolarHBondContact O-N 3.05Å; I143-F211 WeakPolarHBondContact O-CE2 3.11Å
144	I	70	Confident	63.4	Low	13 Å²	13	89.7 Å²	89.7	7%	0.067	50%	0.499	C	S	.	.			trans	-67.1	106.4	169.5	-61.8	164.2	0	0	0	108.1	N148 R149 Y152 C207 I208 F211 L230	I144-N148 HydrophobicContact CG2-CB 4.4Å; I144-R149 HydrophobicContact CG2-CB 3.8Å; I144-R149 HydrophobicContact CG2-CG 4.06Å; I144-Y152 HydrophobicContact CG1-CE2 4.4Å; I144-Y152 HydrophobicContact CG2-CD2 4.08Å; I144-Y152 HydrophobicContact CG2-CE2 3.8Å; I144-C207 HydrophobicContact CD1-CB 4.1Å; I144-I208 HydrophobicContact CD1-CG1 4.21Å; I144-F211 HydrophobicContact CB-CD2 4.45Å; I144-F211 HydrophobicContact CD1-CB 4.2Å; I144-F211 HydrophobicContact CG1-CB 3.78Å; I144-F211 HydrophobicContact CG1-CD1 4.25Å; I144-F211 HydrophobicContact CG1-CD2 3.74Å; I144-F211 HydrophobicContact CG1-CE2 4.4Å; I144-F211 HydrophobicContact CG1-CG 3.65Å; I144-L230 HydrophobicContact CD1-CD2 4.14Å; I144-L230 HydrophobicContact CG1-CD2 3.8Å
145	T	72.6	Confident	66.1	Low	65 Å²	65	84.3 Å²	84.3	40%	0.399	46%	0.46	S	S	.	.			trans	-61.1	152.7	-180	67.8	0	0	0	0	111.6	I143 T147 N148 R149	I143-T145 PolarHBondContact O-N 3.05Å; T145-T147 PolarHBondContact O-N 3Å; T145-T147 VanDerWaalsContact O-N 3.09Å; T145-N148 PolarHBondContact O-N 3.41Å; T145-N148 WeakPolarHBondContact OG1-CB 3.44Å; T145-N148 PolarHBondContact OG1-N 2.98Å; T145-N148 PolarHBondContact OG1-OD1 2.91Å; T145-R149 PolarHBondContact O-N 3.47Å; T145-R149 VanDerWaalsContact O-N 3.09Å
146	S	64.4	Low	68.9	Low	113 Å²	113	81.1 Å²	81.1	79%	0.79	43%	0.433	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.2	-22.1	175.4	-50.6	0	0	0	0	113.2	P150	S146-P150 WeakPolarHBondContact O-CD 3.34Å; S146-P150 WeakPolarHBondContact O-CG 3.2Å
147	T	74	Confident	71.5	Confident	117 Å²	117	81.2 Å²	81.2	72%	0.718	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.3	-37.6	174.9	-42.4	0	0	0	0	112.3	T145	T145-T147 PolarHBondContact O-N 3Å; T145-T147 VanDerWaalsContact O-N 3.09Å
148	N	80.2	Confident	74	Confident	41 Å²	41	82 Å²	82	22%	0.219	42%	0.421	C	S	.	.	H	α-helix	trans	-82.8	-38.7	-175.7	-75.3	32.8	0	0	0	112.4	I144 T145 R151 Y152 E214	I144-N148 HydrophobicContact CG2-CB 4.4Å; T145-N148 PolarHBondContact O-N 3.41Å; T145-N148 WeakPolarHBondContact OG1-CB 3.44Å; T145-N148 PolarHBondContact OG1-N 2.98Å; T145-N148 PolarHBondContact OG1-OD1 2.91Å; N148-R151 WeakPolarHBondContact O-CB 3.44Å; N148-R151 PolarHBondContact O-N 3.3Å; N148-Y152 HydrophobicContact CB-CE1 4.21Å; N148-Y152 HydrophobicContact CB-CE2 3.94Å; N148-Y152 PolarHBondContact ND2-OH 3.03Å; N148-Y152 PolarHBondContact O-N 2.84Å; N148-E214 PolarHBondContact ND2-OE2 2.78Å
149	R	83.3	Confident	76.3	Confident	72 Å²	72	80.1 Å²	80.1	27%	0.272	40%	0.397	S	S	.	.	H	α-helix	trans	-53.6	-42.9	-176.5	-151.5	-176.4	-164.1	96.4	1.6	114.1	I144 T145 R151 Y152 R153 D204	I144-R149 HydrophobicContact CG2-CB 3.8Å; I144-R149 HydrophobicContact CG2-CG 4.06Å; T145-R149 PolarHBondContact O-N 3.47Å; T145-R149 VanDerWaalsContact O-N 3.09Å; R149-R151 VanDerWaalsContact C-N 3.34Å; R149-R151 PolarHBondContact O-N 3.37Å; R149-Y152 PolarHBondContact O-N 2.9Å; R149-R153 WeakPolarHBondContact O-CG 3.39Å; R149-R153 PolarHBondContact O-N 2.88Å; R149-R153 VanDerWaalsContact O-N 3.07Å; R149-D204 IonicContact CZ-OD1 3.75Å; R149-D204 IonicContact NE-OD1 3.58Å; R149-D204 PolarHBondContact NE-OD1 2.89Å; R149-D204 IonicContact NH2-OD1 2.69Å; R149-D204 PolarHBondContact NH2-OD1 3.49Å
150	P	84.2	Confident	78.6	Confident	81 Å²	81	70.6 Å²	70.6	53%	0.526	36%	0.36	S	S	.	.	H	α-helix	trans	-62.5	-37.1	176.3	-23.7	35.2	0	0	0	113.3	S146 R153 L154	S146-P150 WeakPolarHBondContact O-CD 3.34Å; S146-P150 WeakPolarHBondContact O-CG 3.2Å; P150-R153 PolarHBondContact O-N 2.79Å; P150-L154 WeakPolarHBondContact O-CB 3.41Å; P150-L154 PolarHBondContact O-N 3.15Å
151	R	86.5	Confident	80.3	Confident	114 Å²	114	75.1 Å²	75.1	43%	0.43	37%	0.372	S	S	.	.	H	α-helix	trans	-66.8	-41.2	179.3	-169.9	171.3	179.9	-174.8	-3.6	111.4	A101 I103 N148 R149 L154 L155	A101-R151 PolarHBondContact O-NH2 2.86Å; I103-R151 HydrophobicContact CG1-CG 4.09Å; N148-R151 WeakPolarHBondContact O-CB 3.44Å; N148-R151 PolarHBondContact O-N 3.3Å; R149-R151 VanDerWaalsContact C-N 3.34Å; R149-R151 PolarHBondContact O-N 3.37Å; R151-L154 PolarHBondContact O-N 2.89Å; R151-L155 PolarHBondContact O-N 2.99Å; R151-L155 VanDerWaalsContact O-N 3.07Å
152	Y	90.9	Very high	81.4	Confident	0 Å²	0	76.9 Å²	76.9	0%	0	38%	0.382	C	S	.	.	H	α-helix	trans	-67.5	-40.3	175.8	-53.7	-18.7	0	0	0	111.9	I103 I144 N148 R149 L154 L155 F156 C207 I210 F211 E214	I103-Y152 HydrophobicContact CD1-CD1 3.94Å; I103-Y152 HydrophobicContact CD1-CE1 3.82Å; I103-Y152 HydrophobicContact CG1-CD1 4.45Å; I103-Y152 HydrophobicContact CG1-CE1 4.05Å; I144-Y152 HydrophobicContact CG1-CE2 4.4Å; I144-Y152 HydrophobicContact CG2-CD2 4.08Å; I144-Y152 HydrophobicContact CG2-CE2 3.8Å; N148-Y152 HydrophobicContact CB-CE1 4.21Å; N148-Y152 HydrophobicContact CB-CE2 3.94Å; N148-Y152 PolarHBondContact ND2-OH 3.03Å; N148-Y152 PolarHBondContact O-N 2.84Å; R149-Y152 PolarHBondContact O-N 2.9Å; Y152-L154 VanDerWaalsContact C-N 3.34Å; Y152-L154 PolarHBondContact O-N 2.96Å; Y152-L155 PolarHBondContact O-N 3.23Å; Y152-F156 WeakPolarHBondContact O-CB 3.37Å; Y152-F156 PolarHBondContact O-N 3Å; Y152-C207 HydrophobicContact CD2-CB 4Å; Y152-C207 WeakPolarHBondContact CD2-O 3.41Å; Y152-I210 HydrophobicContact CD1-CB 4.19Å; Y152-I210 HydrophobicContact CD1-CG2 3.62Å; Y152-I210 HydrophobicContact CE1-CB 4.44Å; Y152-I210 HydrophobicContact CE1-CG2 3.64Å; Y152-I210 HydrophobicContact CG-CB 4.29Å; Y152-I210 HydrophobicContact CG-CG2 4.22Å; Y152-F211 HydrophobicContact CE2-CB 4.01Å; Y152-F211 HydrophobicContact CE2-CD2 4.46Å; Y152-E214 WeakPolarHBondContact CE1-OE1 3.28Å; Y152-E214 PolarHBondContact OH-OE1 3.5Å; Y152-E214 PolarHBondContact OH-OE2 3.23Å
153	R	90	Very high	82.1	Confident	91 Å²	91	82.8 Å²	82.8	34%	0.343	41%	0.409	S	S	.	.	H	α-helix	trans	-66.7	-33.6	175.8	-71.3	-174.2	158.2	-118.8	4	112.7	R149 P150 N157 D204	R149-R153 WeakPolarHBondContact O-CG 3.39Å; R149-R153 PolarHBondContact O-N 2.88Å; R149-R153 VanDerWaalsContact O-N 3.07Å; P150-R153 PolarHBondContact O-N 2.79Å; R153-N157 WeakPolarHBondContact O-CB 3.37Å; R153-N157 PolarHBondContact O-N 3.23Å; R153-N157 PolarHBondContact O-ND2 2.82Å; R153-D204 IonicContact CZ-OD1 3.98Å; R153-D204 IonicContact CZ-OD2 2.71Å; R153-D204 IonicContact NE-OD1 2.79Å; R153-D204 IonicContact NH2-OD1 2.68Å; R153-D204 PolarHBondContact NH2-OD1 2.93Å; R153-D204 IonicContact NH2-OD2 2.91Å; R153-D204 PolarHBondContact NH2-OD2 3.24Å
154	L	87.7	Confident	82.9	Confident	121 Å²	121	82.9 Å²	82.9	63%	0.634	41%	0.405	S	S	*	.	H	α-helix	trans	-65.6	-45.8	171.3	-178.3	60.7	0	0	0	111.6	P150 R151 Y152 F156 N157 Q158	P150-L154 WeakPolarHBondContact O-CB 3.41Å; P150-L154 PolarHBondContact O-N 3.15Å; R151-L154 PolarHBondContact O-N 2.89Å; Y152-L154 VanDerWaalsContact C-N 3.34Å; Y152-L154 PolarHBondContact O-N 2.96Å; L154-F156 VanDerWaalsContact C-N 3.31Å; L154-F156 PolarHBondContact O-N 3.33Å; L154-N157 PolarHBondContact O-N 2.83Å; L154-Q158 PolarHBondContact O-N 2.71Å
155	L	88.6	Confident	83.6	Confident	12 Å²	12	84.2 Å²	84.2	6%	0.063	42%	0.421	C	S	.	.	H	α-helix	trans	-62	-37.8	177	-179.7	64.4	0	0	0	112.4	F102 R151 Y152 Q158 H159 Y179 F206 I210	F102-L155 HydrophobicContact CD1-CD1 3.97Å; F102-L155 HydrophobicContact CD1-CD2 4.27Å; F102-L155 HydrophobicContact CE1-CD1 3.71Å; R151-L155 PolarHBondContact O-N 2.99Å; R151-L155 VanDerWaalsContact O-N 3.07Å; Y152-L155 PolarHBondContact O-N 3.23Å; L155-Q158 PolarHBondContact O-N 3.49Å; L155-H159 PolarHBondContact O-N 3.29Å; L155-H159 PolarHBondContact O-ND1 3.16Å; L155-Y179 WeakPolarHBondContact CD2-OH 3.27Å; L155-F206 HydrophobicContact CB-CE1 4.2Å; L155-F206 HydrophobicContact CD2-CE1 4.04Å; L155-F206 HydrophobicContact CD2-CZ 3.95Å; L155-F206 HydrophobicContact CG-CE1 3.99Å; L155-F206 HydrophobicContact CG-CZ 3.96Å; L155-I210 HydrophobicContact CD2-CD1 4.4Å; L155-I210 HydrophobicContact CD2-CG1 4.33Å
156	F	90.2	Very high	84.4	Confident	4 Å²	4	84.5 Å²	84.5	2%	0.018	42%	0.417	C	S	.	.	H	α-helix	trans	-59.9	-53.1	171.2	179.3	-91.9	0	0	0	111.4	Y152 L154 Q158 H159 D160 L167 C203 F206	Y152-F156 WeakPolarHBondContact O-CB 3.37Å; Y152-F156 PolarHBondContact O-N 3Å; L154-F156 VanDerWaalsContact C-N 3.31Å; L154-F156 PolarHBondContact O-N 3.33Å; F156-Q158 PolarHBondContact O-N 2.96Å; F156-H159 PolarHBondContact O-N 3.44Å; F156-D160 HydrophobicContact CE1-CB 4.23Å; F156-D160 HydrophobicContact CZ-CB 4.44Å; F156-D160 PolarHBondContact O-N 3.12Å; F156-L167 HydrophobicContact CD2-CD1 3.58Å; F156-L167 HydrophobicContact CD2-CG 4Å; F156-L167 HydrophobicContact CE2-CB 4.46Å; F156-L167 HydrophobicContact CE2-CD1 3.82Å; F156-L167 HydrophobicContact CE2-CG 3.72Å; F156-L167 HydrophobicContact CG-CD1 4.49Å; F156-L167 HydrophobicContact CZ-CG 4.46Å; F156-C203 HydrophobicContact CD1-CB 3.97Å; F156-C203 HydrophobicContact CE1-CB 3.79Å; F156-C203 HydrophobicContact CE2-CB 4.33Å; F156-C203 HydrophobicContact CG-CB 4.33Å; F156-C203 HydrophobicContact CZ-CB 3.99Å; F156-F206 HydrophobicContact CB-CD1 3.7Å; F156-F206 HydrophobicContact CB-CE1 4.01Å; F156-F206 HydrophobicContact CB-CG 4.37Å; F156-F206 HydrophobicContact CD2-CB 3.67Å; F156-F206 AromaticContact CD2-CD1 3.98Å; F156-F206 HydrophobicContact CD2-CD1 3.98Å; F156-F206 HydrophobicContact CD2-CD2 4.4Å; F156-F206 AromaticContact CD2-CG 3.77Å; F156-F206 HydrophobicContact CD2-CG 3.77Å; F156-F206 HydrophobicContact CE2-CB 4.27Å; F156-F206 HydrophobicContact CG-CD1 4.34Å
157	N	88.5	Confident	85.5	Confident	106 Å²	106	79.1 Å²	79.1	57%	0.567	38%	0.379	S	S	*	.	H	α-helix	trans	-61.6	-30.1	-179.8	-70	-17	0	0	0	113.2	R153 L154 H159	R153-N157 WeakPolarHBondContact O-CB 3.37Å; R153-N157 PolarHBondContact O-N 3.23Å; R153-N157 PolarHBondContact O-ND2 2.82Å; L154-N157 PolarHBondContact O-N 2.83Å; N157-H159 VanDerWaalsContact C-N 3.28Å; N157-H159 PolarHBondContact O-N 3.4Å
158	Q	88.2	Confident	86.3	Confident	129 Å²	129	75.4 Å²	75.4	60%	0.603	36%	0.356	S	S	*	.	H	α-helix	trans	-67.6	-28.4	175.5	-172.6	179.6	14.7	0	0	112.6	L154 L155 F156	L154-Q158 PolarHBondContact O-N 2.71Å; L155-Q158 PolarHBondContact O-N 3.49Å; F156-Q158 PolarHBondContact O-N 2.96Å
159	H	85.6	Confident	86.5	Confident	50 Å²	50	74.7 Å²	74.7	23%	0.231	36%	0.359	C	S	.	.	H	α-helix	trans	-103.3	-26.9	-176	-70	90.4	0	0	0	114	L155 F156 N157 R161 L167 I175	L155-H159 PolarHBondContact O-N 3.29Å; L155-H159 PolarHBondContact O-ND1 3.16Å; F156-H159 PolarHBondContact O-N 3.44Å; N157-H159 VanDerWaalsContact C-N 3.28Å; N157-H159 PolarHBondContact O-N 3.4Å; H159-R161 PolarHBondContact O-N 2.94Å; H159-L167 HydrophobicContact CB-CD1 4.44Å; H159-L167 HydrophobicContact CB-CD2 3.99Å; H159-I175 HydrophobicContact CB-CD1 3.43Å; H159-I175 VanDerWaalsContact CB-CD1 3.43Å; H159-I175 HydrophobicContact CB-CG1 4.26Å; H159-I175 VanDerWaalsContact CG-CD1 3.4Å
160	D	88.2	Confident	86.7	Confident	9 Å²	9	76.8 Å²	76.8	5%	0.048	38%	0.38	C	S	.	.			trans	-77.3	64.2	169.3	-172.4	22.9	0	0	0	111	F156 N162 K163 R164 G165 L167	F156-D160 HydrophobicContact CE1-CB 4.23Å; F156-D160 HydrophobicContact CZ-CB 4.44Å; F156-D160 PolarHBondContact O-N 3.12Å; D160-N162 PolarHBondContact O-N 3.32Å; D160-K163 PolarHBondContact O-N 3.19Å; D160-K163 PolarHBondContact OD1-N 3.41Å; D160-K163 VanDerWaalsContact OD2-CA 3.27Å; D160-K163 WeakPolarHBondContact OD2-CA 3.27Å; D160-R164 VanDerWaalsContact CG-N 3.31Å; D160-R164 IonicContact OD1-CZ 2.88Å; D160-R164 PolarHBondContact OD1-N 2.96Å; D160-R164 VanDerWaalsContact OD1-N 3.1Å; D160-R164 IonicContact OD1-NE 3.51Å; D160-R164 PolarHBondContact OD1-NE 3.26Å; D160-R164 VanDerWaalsContact OD1-NE 3.14Å; D160-R164 IonicContact OD1-NH2 3.89Å; D160-R164 PolarHBondContact OD1-NH2 3.42Å; D160-R164 PolarHBondContact OD2-N 3.41Å; D160-G165 PolarHBondContact OD2-N 2.94Å; D160-L167 HydrophobicContact CB-CD2 4.09Å
161	R	82.1	Confident	86.9	Confident	218 Å²	218	75.8 Å²	75.8	82%	0.823	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.8	-25.2	179.8	-66.3	-177.7	176.2	-170.5	-0.9	113.3	H159	H159-R161 PolarHBondContact O-N 2.94Å
162	N	80.4	Confident	87	Confident	117 Å²	117	70.4 Å²	70.4	63%	0.626	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101	0.4	-176.1	-62.5	3.8	0	0	0	113.2	D160 R164	D160-N162 PolarHBondContact O-N 3.32Å; N162-R164 VanDerWaalsContact C-N 3.3Å; N162-R164 HydrophobicContact CB-CG 4.1Å; N162-R164 PolarHBondContact O-N 3Å
163	K	80.9	Confident	86.8	Confident	190 Å²	190	76.7 Å²	76.7	83%	0.826	37%	0.371	S	S	*	.			trans	52.5	40.3	-178.7	-57.5	-177	179.7	179.8	0	114.1	D160 G165	D160-K163 PolarHBondContact O-N 3.19Å; D160-K163 PolarHBondContact OD1-N 3.41Å; D160-K163 VanDerWaalsContact OD2-CA 3.27Å; D160-K163 WeakPolarHBondContact OD2-CA 3.27Å; K163-G165 VanDerWaalsContact C-N 3.31Å
164	R	84.1	Confident	86.6	Confident	78 Å²	78	76.1 Å²	76.1	29%	0.294	38%	0.381	S	S	.	.			trans	-72.9	-19.7	177.8	-67.3	163.7	-66.1	-165.4	-2.4	113.6	D160 N162 F166 E171	D160-R164 VanDerWaalsContact CG-N 3.31Å; D160-R164 IonicContact OD1-CZ 2.88Å; D160-R164 PolarHBondContact OD1-N 2.96Å; D160-R164 VanDerWaalsContact OD1-N 3.1Å; D160-R164 IonicContact OD1-NE 3.51Å; D160-R164 PolarHBondContact OD1-NE 3.26Å; D160-R164 VanDerWaalsContact OD1-NE 3.14Å; D160-R164 IonicContact OD1-NH2 3.89Å; D160-R164 PolarHBondContact OD1-NH2 3.42Å; D160-R164 PolarHBondContact OD2-N 3.41Å; N162-R164 VanDerWaalsContact C-N 3.3Å; N162-R164 HydrophobicContact CB-CG 4.1Å; N162-R164 PolarHBondContact O-N 3Å; R164-F166 VanDerWaalsContact C-N 3.27Å; R164-F166 HydrophobicContact CB-CD1 3.98Å; R164-F166 HydrophobicContact CB-CE1 3.81Å; R164-F166 HydrophobicContact CB-CG 4.45Å; R164-F166 HydrophobicContact CB-CZ 4.14Å; R164-F166 WeakPolarHBondContact O-CD1 3.27Å; R164-E171 IonicContact CZ-OE1 2.76Å; R164-E171 IonicContact CZ-OE2 3.63Å; R164-E171 VanDerWaalsContact NH1-CD 3.31Å; R164-E171 IonicContact NH1-OE1 3.6Å; R164-E171 PolarHBondContact NH1-OE1 3.17Å; R164-E171 IonicContact NH1-OE2 4Å; R164-E171 PolarHBondContact NH1-OE2 3.42Å; R164-E171 VanDerWaalsContact NH2-CD 3.29Å; R164-E171 IonicContact NH2-OE1 3.63Å; R164-E171 PolarHBondContact NH2-OE1 3Å; R164-E171 IonicContact NH2-OE2 3.8Å; R164-E171 PolarHBondContact NH2-OE2 3.49Å
165	G	84.5	Confident	86.6	Confident	40 Å²	40	70.6 Å²	70.6	41%	0.412	35%	0.352	S	S	.	.	S	Bend	trans	81.4	2.6	-172.6	0	0	0	0	0	114.3	D160 K163	D160-G165 PolarHBondContact OD2-N 2.94Å; K163-G165 VanDerWaalsContact C-N 3.31Å
166	F	89.6	Confident	86.5	Confident	72 Å²	72	70.2 Å²	70.2	32%	0.316	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.7	157	172.7	63.8	-92.2	0	0	0	111.5	R164 T168 N200 L201	R164-F166 VanDerWaalsContact C-N 3.27Å; R164-F166 HydrophobicContact CB-CD1 3.98Å; R164-F166 HydrophobicContact CB-CE1 3.81Å; R164-F166 HydrophobicContact CB-CG 4.45Å; R164-F166 HydrophobicContact CB-CZ 4.14Å; R164-F166 WeakPolarHBondContact O-CD1 3.27Å; F166-T168 HydrophobicContact CD2-CG2 4.48Å; F166-T168 HydrophobicContact CE2-CG2 4.09Å; F166-N200 HydrophobicContact CB-CB 4.32Å; F166-N200 HydrophobicContact CD2-CB 3.69Å; F166-N200 HydrophobicContact CE2-CB 4.35Å; F166-N200 HydrophobicContact CG-CB 4.23Å; F166-L201 WeakPolarHBondContact CA-O 2.98Å
167	L	88.4	Confident	86.4	Confident	0 Å²	0	73 Å²	73	0%	0	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	131.5	170.7	-68.7	167.6	0	0	0	109.2	F156 H159 D160 E171 A172 I175 N200 L201 F206	F156-L167 HydrophobicContact CD2-CD1 3.58Å; F156-L167 HydrophobicContact CD2-CG 4Å; F156-L167 HydrophobicContact CE2-CB 4.46Å; F156-L167 HydrophobicContact CE2-CD1 3.82Å; F156-L167 HydrophobicContact CE2-CG 3.72Å; F156-L167 HydrophobicContact CG-CD1 4.49Å; F156-L167 HydrophobicContact CZ-CG 4.46Å; H159-L167 HydrophobicContact CB-CD1 4.44Å; H159-L167 HydrophobicContact CB-CD2 3.99Å; D160-L167 HydrophobicContact CB-CD2 4.09Å; L167-E171 HydrophobicContact CD2-CB 4.44Å; L167-A172 HydrophobicContact CB-CB 4.1Å; L167-I175 HydrophobicContact CD1-CD1 3.74Å; L167-I175 HydrophobicContact CD2-CD1 4.47Å; L167-N200 CarbonylContact O-C 3.59Å; L167-N200 VanDerWaalsContact O-CA 3.26Å; L167-N200 WeakPolarHBondContact O-CA 3.26Å; L167-L201 PolarHBondContact N-O 3.32Å; L167-L201 PolarHBondContact O-N 3.37Å; L167-F206 HydrophobicContact CD1-CD2 3.63Å; L167-F206 HydrophobicContact CD1-CE2 3.73Å; L167-F206 HydrophobicContact CD1-CG 4.25Å; L167-F206 HydrophobicContact CD1-CZ 4.42Å
168	T	89.3	Confident	86.2	Confident	38 Å²	38	72.4 Å²	72.4	23%	0.233	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71	159.6	178.9	63.4	0	0	0	0	112.3	F166 V170 E171 A172 N200	F166-T168 HydrophobicContact CD2-CG2 4.48Å; F166-T168 HydrophobicContact CE2-CG2 4.09Å; T168-V170 PolarHBondContact O-N 3.14Å; T168-E171 VanDerWaalsContact CB-OE2 3.31Å; T168-E171 WeakPolarHBondContact CB-OE2 3.07Å; T168-E171 WeakPolarHBondContact CG2-OE2 3.39Å; T168-E171 PolarHBondContact N-OE2 3.46Å; T168-E171 PolarHBondContact O-N 2.95Å; T168-E171 VanDerWaalsContact OG1-CD 3.24Å; T168-E171 WeakPolarHBondContact OG1-CG 3.41Å; T168-E171 PolarHBondContact OG1-N 2.97Å; T168-E171 PolarHBondContact OG1-OE2 2.86Å; T168-A172 WeakPolarHBondContact O-CB 3.26Å; T168-A172 PolarHBondContact O-N 3Å; T168-N200 VanDerWaalsContact CA-OD1 3.3Å; T168-N200 WeakPolarHBondContact CA-OD1 3.24Å
169	G	85.4	Confident	86.1	Confident	26 Å²	26	67.4 Å²	67.4	27%	0.268	34%	0.34	S	S	.	.	H	α-helix	trans	-49.3	-28.9	174.1	0	0	0	0	0	115.6	R173 G199	G169-R173 WeakPolarHBondContact O-CB 3.5Å; G169-R173 PolarHBondContact O-N 2.9Å; G169-G199 WeakPolarHBondContact CA-O 3.48Å; G169-G199 PolarHBondContact N-O 2.89Å
170	V	87.9	Confident	86	Confident	117 Å²	117	68.2 Å²	68.2	71%	0.709	36%	0.362	S	S	*	.	H	α-helix	trans	-79.3	-47.7	176	-178	0	0	0	0	111.4	T168 R173 S174	T168-V170 PolarHBondContact O-N 3.14Å; V170-R173 PolarHBondContact O-N 2.88Å; V170-S174 PolarHBondContact O-N 3.24Å
171	E	88.5	Confident	85.8	Confident	60 Å²	60	69 Å²	69	28%	0.28	37%	0.366	S	S	.	.	H	α-helix	trans	-67.4	-47.1	-178.1	-65.9	160.6	134.2	0	0	111	R164 L167 T168 S174 I175	R164-E171 IonicContact CZ-OE1 2.76Å; R164-E171 IonicContact CZ-OE2 3.63Å; R164-E171 VanDerWaalsContact NH1-CD 3.31Å; R164-E171 IonicContact NH1-OE1 3.6Å; R164-E171 PolarHBondContact NH1-OE1 3.17Å; R164-E171 IonicContact NH1-OE2 4Å; R164-E171 PolarHBondContact NH1-OE2 3.42Å; R164-E171 VanDerWaalsContact NH2-CD 3.29Å; R164-E171 IonicContact NH2-OE1 3.63Å; R164-E171 PolarHBondContact NH2-OE1 3Å; R164-E171 IonicContact NH2-OE2 3.8Å; R164-E171 PolarHBondContact NH2-OE2 3.49Å; L167-E171 HydrophobicContact CD2-CB 4.44Å; T168-E171 VanDerWaalsContact CB-OE2 3.31Å; T168-E171 WeakPolarHBondContact CB-OE2 3.07Å; T168-E171 WeakPolarHBondContact CG2-OE2 3.39Å; T168-E171 PolarHBondContact N-OE2 3.46Å; T168-E171 PolarHBondContact O-N 2.95Å; T168-E171 VanDerWaalsContact OG1-CD 3.24Å; T168-E171 WeakPolarHBondContact OG1-CG 3.41Å; T168-E171 PolarHBondContact OG1-N 2.97Å; T168-E171 PolarHBondContact OG1-OE2 2.86Å; E171-S174 WeakPolarHBondContact O-CB 3.34Å; E171-S174 PolarHBondContact O-N 3.46Å; E171-S174 VanDerWaalsContact O-N 3.14Å; E171-I175 WeakPolarHBondContact O-CG1 3.41Å; E171-I175 PolarHBondContact O-N 3.31Å
172	A	88.3	Confident	85.9	Confident	0 Å²	0	62.1 Å²	62.1	0%	0	35%	0.35	C	S	.	.	H	α-helix	trans	-63.3	-42.5	175.6	0	0	0	0	0	111.5	L167 T168 S174 I175 L176 W190 L201	L167-A172 HydrophobicContact CB-CB 4.1Å; T168-A172 WeakPolarHBondContact O-CB 3.26Å; T168-A172 PolarHBondContact O-N 3Å; A172-S174 PolarHBondContact O-N 2.85Å; A172-I175 PolarHBondContact O-N 2.89Å; A172-L176 WeakPolarHBondContact O-CB 3.36Å; A172-L176 VanDerWaalsContact O-CG 3.23Å; A172-L176 WeakPolarHBondContact O-CG 3.3Å; A172-L176 PolarHBondContact O-N 2.91Å; A172-W190 HydrophobicContact CB-CH2 3.73Å; A172-W190 HydrophobicContact CB-CZ3 3.53Å; A172-L201 HydrophobicContact CB-CD1 4.07Å
173	R	86.1	Confident	86.1	Confident	133 Å²	133	61.4 Å²	61.4	50%	0.502	35%	0.346	S	S	.	.	H	α-helix	trans	-55.9	-39.9	171.9	177.2	179.2	-68.5	-90.8	0.1	112.2	G169 V170 I175 S177 N183	G169-R173 WeakPolarHBondContact O-CB 3.5Å; G169-R173 PolarHBondContact O-N 2.9Å; V170-R173 PolarHBondContact O-N 2.88Å; R173-I175 PolarHBondContact O-N 2.98Å; R173-S177 WeakPolarHBondContact O-CB 3.33Å; R173-S177 PolarHBondContact O-N 2.86Å; R173-N183 PolarHBondContact NH1-OD1 3.2Å
174	S	85.5	Confident	86.3	Confident	79 Å²	79	57.1 Å²	57.1	55%	0.552	34%	0.337	S	S	*	.	H	α-helix	trans	-65.6	-22.5	176.7	-163.1	0	0	0	0	113.6	V170 E171 A172 Q178	V170-S174 PolarHBondContact O-N 3.24Å; E171-S174 WeakPolarHBondContact O-CB 3.34Å; E171-S174 PolarHBondContact O-N 3.46Å; E171-S174 VanDerWaalsContact O-N 3.14Å; A172-S174 PolarHBondContact O-N 2.85Å; S174-Q178 WeakPolarHBondContact O-CG 3.5Å; S174-Q178 PolarHBondContact O-NE2 3Å
175	I	88.1	Confident	86.4	Confident	4 Å²	4	56.4 Å²	56.4	2%	0.021	34%	0.339	C	S	.	.	H	α-helix	trans	-88.3	-54.2	174.7	-56.6	159.3	0	0	0	110.2	H159 L167 E171 A172 R173 S177 Q178 Y179 F206	H159-I175 HydrophobicContact CB-CD1 3.43Å; H159-I175 VanDerWaalsContact CB-CD1 3.43Å; H159-I175 HydrophobicContact CB-CG1 4.26Å; H159-I175 VanDerWaalsContact CG-CD1 3.4Å; L167-I175 HydrophobicContact CD1-CD1 3.74Å; L167-I175 HydrophobicContact CD2-CD1 4.47Å; E171-I175 WeakPolarHBondContact O-CG1 3.41Å; E171-I175 PolarHBondContact O-N 3.31Å; A172-I175 PolarHBondContact O-N 2.89Å; R173-I175 PolarHBondContact O-N 2.98Å; I175-S177 PolarHBondContact O-N 3.39Å; I175-Q178 WeakPolarHBondContact O-CB 3.41Å; I175-Q178 PolarHBondContact O-N 3.37Å; I175-Y179 HydrophobicContact CG2-CE2 4.38Å; I175-Y179 WeakPolarHBondContact O-CD2 3.28Å; I175-F206 HydrophobicContact CD1-CE2 4.02Å; I175-F206 HydrophobicContact CD1-CZ 4.39Å; I175-F206 HydrophobicContact CG2-CE2 4.18Å; I175-F206 HydrophobicContact CG2-CZ 4.03Å
176	L	87.5	Confident	86.6	Confident	4 Å²	4	55 Å²	55	2%	0.021	32%	0.322	C	S	.	.	H	α-helix	trans	-59.4	-30.6	-177.6	-58.7	172.4	0	0	0	111.6	A172 Q178 Y179 L186 W190 L201 A209 I210 I213	A172-L176 WeakPolarHBondContact O-CB 3.36Å; A172-L176 VanDerWaalsContact O-CG 3.23Å; A172-L176 WeakPolarHBondContact O-CG 3.3Å; A172-L176 PolarHBondContact O-N 2.91Å; L176-Q178 VanDerWaalsContact C-N 3.31Å; L176-Q178 PolarHBondContact O-N 2.83Å; L176-Y179 WeakPolarHBondContact O-CB 3.45Å; L176-Y179 PolarHBondContact O-N 3.23Å; L176-L186 HydrophobicContact CB-CD2 4.13Å; L176-W190 HydrophobicContact CD1-CE3 3.94Å; L176-W190 HydrophobicContact CD1-CZ3 4.02Å; L176-L201 HydrophobicContact CD1-CD1 4.31Å; L176-A209 HydrophobicContact CD2-CB 4.07Å; L176-I210 HydrophobicContact CD2-CD1 3.61Å; L176-I213 HydrophobicContact CB-CD1 3.9Å; L176-I213 HydrophobicContact CD2-CD1 3.43Å; L176-I213 VanDerWaalsContact CD2-CD1 3.43Å; L176-I213 HydrophobicContact CG-CD1 4.21Å
177	S	86.6	Confident	86.5	Confident	64 Å²	64	53.5 Å²	53.5	45%	0.448	32%	0.322	S	S	.	.	G	3₁₀ helix	trans	-71.4	-16.3	174.8	-170	0	0	0	0	114.9	R173 I175 Y179 G180	R173-S177 WeakPolarHBondContact O-CB 3.33Å; R173-S177 PolarHBondContact O-N 2.86Å; I175-S177 PolarHBondContact O-N 3.39Å; S177-Y179 PolarHBondContact O-N 3.24Å; S177-G180 PolarHBondContact O-N 3.22Å
178	Q	86.1	Confident	86.3	Confident	92 Å²	92	56.3 Å²	56.3	43%	0.43	34%	0.335	S	S	.	.	G	3₁₀ helix	trans	-74.3	-14.2	176.9	-65.5	173.7	56.1	0	0	112.4	F102 S174 I175 L176 G180	F102-Q178 HydrophobicContact CD2-CB 4.29Å; F102-Q178 HydrophobicContact CE2-CB 3.85Å; F102-Q178 VanDerWaalsContact CE2-OE1 3.26Å; S174-Q178 WeakPolarHBondContact O-CG 3.5Å; S174-Q178 PolarHBondContact O-NE2 3Å; I175-Q178 WeakPolarHBondContact O-CB 3.41Å; I175-Q178 PolarHBondContact O-N 3.37Å; L176-Q178 VanDerWaalsContact C-N 3.31Å; L176-Q178 PolarHBondContact O-N 2.83Å; Q178-G180 VanDerWaalsContact C-N 3.28Å; Q178-G180 PolarHBondContact O-N 2.95Å
179	Y	85.4	Confident	86.2	Confident	24 Å²	24	54.5 Å²	54.5	9%	0.094	32%	0.324	C	S	.	.	G	3₁₀ helix	trans	-83.1	3.3	177.1	-69	-102.3	0	0	0	113.7	F102 L155 I175 L176 S177 L181 I210 I213 I217	F102-Y179 HydrophobicContact CB-CD1 4.11Å; F102-Y179 HydrophobicContact CB-CE1 3.59Å; F102-Y179 HydrophobicContact CB-CE2 4.2Å; F102-Y179 HydrophobicContact CG-CE2 4.35Å; F102-Y179 WeakPolarHBondContact O-CE1 3.45Å; L155-Y179 WeakPolarHBondContact CD2-OH 3.27Å; I175-Y179 HydrophobicContact CG2-CE2 4.38Å; I175-Y179 WeakPolarHBondContact O-CD2 3.28Å; L176-Y179 WeakPolarHBondContact O-CB 3.45Å; L176-Y179 PolarHBondContact O-N 3.23Å; S177-Y179 PolarHBondContact O-N 3.24Å; Y179-L181 PolarHBondContact O-N 3.14Å; Y179-L181 VanDerWaalsContact O-N 3.09Å; Y179-I210 HydrophobicContact CE2-CD1 3.94Å; Y179-I210 WeakPolarHBondContact OH-CD1 3.42Å; Y179-I213 HydrophobicContact CD1-CG2 3.26Å; Y179-I213 HydrophobicContact CD2-CD1 4.18Å; Y179-I213 HydrophobicContact CD2-CG2 4.42Å; Y179-I213 HydrophobicContact CE1-CG2 3.79Å; Y179-I213 HydrophobicContact CG-CD1 4.23Å; Y179-I213 HydrophobicContact CG-CG2 3.59Å; Y179-I217 HydrophobicContact CD1-CD1 3.95Å
180	G	82.6	Confident	86.3	Confident	67 Å²	67	55.1 Å²	55.1	69%	0.691	32%	0.318	S	S	*	.			trans	72.5	-1.9	172.6	0	0	0	0	0	116.8	S177 Q178	S177-G180 PolarHBondContact O-N 3.22Å; Q178-G180 VanDerWaalsContact C-N 3.28Å; Q178-G180 PolarHBondContact O-N 2.95Å
181	L	84.4	Confident	86.3	Confident	26 Å²	26	55.2 Å²	55.2	14%	0.136	32%	0.315	C	S	.	.			trans	-69	140.6	179.9	-69.1	175.7	0	0	0	112.4	Y179 I185 L186 I189 I213 A216 I217	Y179-L181 PolarHBondContact O-N 3.14Å; Y179-L181 VanDerWaalsContact O-N 3.09Å; L181-I185 HydrophobicContact CB-CG2 4.43Å; L181-I185 HydrophobicContact CD1-CG2 4.22Å; L181-I185 HydrophobicContact CD2-CG2 4.46Å; L181-L186 HydrophobicContact CB-CD2 3.78Å; L181-L186 HydrophobicContact CB-CG 4Å; L181-L186 HydrophobicContact CD1-CD2 4.16Å; L181-L186 WeakPolarHBondContact O-CD1 3.38Å; L181-I189 HydrophobicContact CD1-CD1 3.9Å; L181-I213 HydrophobicContact CD1-CB 4.21Å; L181-I213 HydrophobicContact CD1-CG1 3.93Å; L181-I213 HydrophobicContact CD1-CG2 3.9Å; L181-A216 HydrophobicContact CD1-CB 3.94Å; L181-A216 HydrophobicContact CD2-CB 4.38Å; L181-I217 HydrophobicContact CD1-CG1 4.21Å; L181-I217 HydrophobicContact CD2-CG1 3.94Å; L181-I217 HydrophobicContact CG-CG1 4.08Å
182	P	83.6	Confident	86.2	Confident	74 Å²	74	53.1 Å²	53.1	48%	0.481	31%	0.306	S	S	.	.			trans	-53.9	143.1	174.6	-29	34.6	0	0	0	114.5	P184 I185 L186	P182-P184 VanDerWaalsContact C-CD 3.42Å; P182-P184 VanDerWaalsContact C-N 3.33Å; P182-P184 VanDerWaalsContact O-N 3.13Å; P182-I185 HydrophobicContact CB-CD1 4.5Å; P182-I185 HydrophobicContact CB-CG1 4.45Å; P182-I185 HydrophobicContact CG-CD1 4.25Å; P182-I185 WeakPolarHBondContact O-CA 3.49Å; P182-I185 WeakPolarHBondContact O-CB 3.45Å; P182-I185 PolarHBondContact O-N 3.21Å; P182-L186 PolarHBondContact O-N 3.06Å
183	N	84.5	Confident	86.1	Confident	102 Å²	102	53.1 Å²	53.1	55%	0.545	31%	0.306	S	S	.	.	H	α-helix	trans	-47.2	-40.5	178.7	-86.9	-47.8	0	0	0	115.5	R173 A187	R173-N183 PolarHBondContact NH1-OD1 3.2Å; N183-A187 WeakPolarHBondContact O-CB 3.43Å; N183-A187 PolarHBondContact O-N 3.09Å
184	P	86.9	Confident	86.3	Confident	99 Å²	99	47.4 Å²	47.4	64%	0.643	29%	0.285	S	S	*	.	H	α-helix	trans	-65.6	-36.7	176	-22.8	34.9	0	0	0	113.4	P182 A187 H188	P182-P184 VanDerWaalsContact C-CD 3.42Å; P182-P184 VanDerWaalsContact C-N 3.33Å; P182-P184 VanDerWaalsContact O-N 3.13Å; P184-A187 PolarHBondContact O-N 2.97Å; P184-H188 PolarHBondContact O-N 3.34Å
185	I	85.7	Confident	86.2	Confident	64 Å²	64	47 Å²	47	33%	0.328	28%	0.276	S	S	.	.	H	α-helix	trans	-69.9	-43.4	178.7	-63.2	-175.4	0	0	0	109.6	L181 P182 A187 H188 I189 A216 L222	L181-I185 HydrophobicContact CB-CG2 4.43Å; L181-I185 HydrophobicContact CD1-CG2 4.22Å; L181-I185 HydrophobicContact CD2-CG2 4.46Å; P182-I185 HydrophobicContact CB-CD1 4.5Å; P182-I185 HydrophobicContact CB-CG1 4.45Å; P182-I185 HydrophobicContact CG-CD1 4.25Å; P182-I185 WeakPolarHBondContact O-CA 3.49Å; P182-I185 WeakPolarHBondContact O-CB 3.45Å; P182-I185 PolarHBondContact O-N 3.21Å; I185-A187 VanDerWaalsContact C-N 3.29Å; I185-A187 PolarHBondContact O-N 3.39Å; I185-H188 PolarHBondContact O-N 3.49Å; I185-I189 HydrophobicContact CG2-CD1 4.14Å; I185-I189 WeakPolarHBondContact O-CG1 3.44Å; I185-I189 PolarHBondContact O-N 2.81Å; I185-A216 HydrophobicContact CG2-CB 4.4Å; I185-L222 HydrophobicContact CG2-CD1 3.67Å
186	L	88.3	Confident	86	Confident	11 Å²	11	50.5 Å²	50.5	6%	0.058	30%	0.295	C	S	.	.	H	α-helix	trans	-61.1	-35.7	173	-66.7	-179.2	0	0	0	112.8	L176 L181 P182 W190 I213	L176-L186 HydrophobicContact CB-CD2 4.13Å; L181-L186 HydrophobicContact CB-CD2 3.78Å; L181-L186 HydrophobicContact CB-CG 4Å; L181-L186 HydrophobicContact CD1-CD2 4.16Å; L181-L186 WeakPolarHBondContact O-CD1 3.38Å; P182-L186 PolarHBondContact O-N 3.06Å; L186-W190 WeakPolarHBondContact O-CB 3.2Å; L186-W190 PolarHBondContact O-N 2.93Å; L186-I213 HydrophobicContact CD2-CD1 3.91Å; L186-I213 HydrophobicContact CD2-CG1 4.43Å
187	A	86.6	Confident	85.8	Confident	39 Å²	39	59 Å²	59	32%	0.322	33%	0.331	S	S	.	.	H	α-helix	trans	-69.6	-36.8	174.5	0	0	0	0	0	112.7	N183 P184 I185 W190 N191	N183-A187 WeakPolarHBondContact O-CB 3.43Å; N183-A187 PolarHBondContact O-N 3.09Å; P184-A187 PolarHBondContact O-N 2.97Å; I185-A187 VanDerWaalsContact C-N 3.29Å; I185-A187 PolarHBondContact O-N 3.39Å; A187-W190 WeakPolarHBondContact O-CB 3.34Å; A187-W190 PolarHBondContact O-N 3.43Å; A187-N191 VanDerWaalsContact O-CG 3.23Å; A187-N191 PolarHBondContact O-N 3.43Å; A187-N191 VanDerWaalsContact O-N 3.11Å; A187-N191 PolarHBondContact O-ND2 2.89Å
188	H	86.2	Confident	85.8	Confident	60 Å²	60	59.9 Å²	59.9	28%	0.278	33%	0.332	S	S	.	.	H	α-helix	trans	-66.4	-44.5	173.5	-169.3	76.4	0	0	0	111.7	P184 I185 W190 N191 L192 P223	P184-H188 PolarHBondContact O-N 3.34Å; I185-H188 PolarHBondContact O-N 3.49Å; H188-W190 VanDerWaalsContact C-N 3.3Å; H188-W190 PolarHBondContact O-N 3.33Å; H188-N191 PolarHBondContact O-N 2.84Å; H188-L192 WeakPolarHBondContact O-CG 3.3Å; H188-L192 PolarHBondContact O-N 3.35Å; H188-P223 PolarHBondContact NE2-O 3.42Å
189	I	87.2	Confident	85.8	Confident	0 Å²	0	56.9 Å²	56.9	0%	0	33%	0.325	C	S	.	.	H	α-helix	trans	-59.5	-41.3	174.2	-67.5	173.5	0	0	0	111	L181 I185 N191 L192 A193 A209 L212 I213 A216 L222	L181-I189 HydrophobicContact CD1-CD1 3.9Å; I185-I189 HydrophobicContact CG2-CD1 4.14Å; I185-I189 WeakPolarHBondContact O-CG1 3.44Å; I185-I189 PolarHBondContact O-N 2.81Å; I189-N191 PolarHBondContact O-N 3.22Å; I189-L192 PolarHBondContact O-N 2.87Å; I189-A193 WeakPolarHBondContact O-CB 3.34Å; I189-A193 PolarHBondContact O-N 3.3Å; I189-A209 HydrophobicContact CG2-CB 4.4Å; I189-L212 HydrophobicContact CG1-CB 4.23Å; I189-L212 HydrophobicContact CG2-CB 3.86Å; I189-L212 HydrophobicContact CG2-CD1 4.35Å; I189-I213 HydrophobicContact CD1-CB 4.42Å; I189-I213 HydrophobicContact CD1-CG1 3.59Å; I189-I213 HydrophobicContact CG2-CG1 4.22Å; I189-A216 HydrophobicContact CD1-CB 4.12Å; I189-L222 HydrophobicContact CD1-CD1 3.98Å; I189-L222 HydrophobicContact CD1-CD2 4.21Å; I189-L222 HydrophobicContact CG1-CD1 3.61Å; I189-L222 HydrophobicContact CG1-CD2 3.79Å; I189-L222 HydrophobicContact CG1-CG 4.38Å
190	W	87.4	Confident	86	Confident	39 Å²	39	58 Å²	58	15%	0.148	33%	0.333	C	S	.	.	H	α-helix	trans	-55.5	-51.5	173.9	-169	-76.4	0	0	0	111.7	A172 L176 L186 A187 H188 L192 A193 D194 L201	A172-W190 HydrophobicContact CB-CH2 3.73Å; A172-W190 HydrophobicContact CB-CZ3 3.53Å; L176-W190 HydrophobicContact CD1-CE3 3.94Å; L176-W190 HydrophobicContact CD1-CZ3 4.02Å; L186-W190 WeakPolarHBondContact O-CB 3.2Å; L186-W190 PolarHBondContact O-N 2.93Å; A187-W190 WeakPolarHBondContact O-CB 3.34Å; A187-W190 PolarHBondContact O-N 3.43Å; H188-W190 VanDerWaalsContact C-N 3.3Å; H188-W190 PolarHBondContact O-N 3.33Å; W190-L192 PolarHBondContact O-N 3.3Å; W190-A193 PolarHBondContact O-N 3.46Å; W190-A193 VanDerWaalsContact O-N 3.09Å; W190-D194 PolarHBondContact NE1-OD2 3.49Å; W190-D194 WeakPolarHBondContact O-CB 3.45Å; W190-D194 PolarHBondContact O-N 2.84Å; W190-L201 HydrophobicContact CE3-CD1 4.11Å; W190-L201 HydrophobicContact CH2-CD1 3.73Å; W190-L201 HydrophobicContact CH2-CG 3.62Å; W190-L201 HydrophobicContact CZ2-CD1 4.34Å; W190-L201 HydrophobicContact CZ2-CD2 4.42Å; W190-L201 HydrophobicContact CZ2-CG 3.86Å; W190-L201 HydrophobicContact CZ3-CD1 3.62Å; W190-L201 HydrophobicContact CZ3-CG 4.06Å
191	N	86.5	Confident	86.3	Confident	119 Å²	119	54.8 Å²	54.8	64%	0.636	30%	0.3	S	S	*	.	H	α-helix	trans	-64.4	-20.4	-177.4	-67	-23.7	0	0	0	114	A187 H188 I189	A187-N191 VanDerWaalsContact O-CG 3.23Å; A187-N191 PolarHBondContact O-N 3.43Å; A187-N191 VanDerWaalsContact O-N 3.11Å; A187-N191 PolarHBondContact O-ND2 2.89Å; H188-N191 PolarHBondContact O-N 2.84Å; I189-N191 PolarHBondContact O-N 3.22Å
192	L	86.6	Confident	86.6	Confident	16 Å²	16	56.1 Å²	56.1	8%	0.084	31%	0.307	C	S	.	.	H	α-helix	trans	-87.3	-32.8	173.1	-66.9	170.3	0	0	0	112.9	H188 I189 W190 L212 P223 L226	H188-L192 WeakPolarHBondContact O-CG 3.3Å; H188-L192 PolarHBondContact O-N 3.35Å; I189-L192 PolarHBondContact O-N 2.87Å; W190-L192 PolarHBondContact O-N 3.3Å; L192-L212 HydrophobicContact CB-CD1 3.56Å; L192-L212 HydrophobicContact CD1-CD1 3.94Å; L192-L212 HydrophobicContact CD1-CD2 4.38Å; L192-L212 HydrophobicContact CG-CD1 4.44Å; L192-P223 WeakPolarHBondContact CD1-O 3.45Å; L192-L226 HydrophobicContact CB-CD1 4.46Å
193	A	87.1	Confident	86.9	Confident	0 Å²	0	53.6 Å²	53.6	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-90	-29.9	-174.4	0	0	0	0	0	113.9	I189 W190 L195 L201 E205 I208 A209	I189-A193 WeakPolarHBondContact O-CB 3.34Å; I189-A193 PolarHBondContact O-N 3.3Å; W190-A193 PolarHBondContact O-N 3.46Å; W190-A193 VanDerWaalsContact O-N 3.09Å; A193-L195 PolarHBondContact O-N 2.9Å; A193-L201 HydrophobicContact CB-CD2 3.91Å; A193-E205 VanDerWaalsContact O-CB 3.3Å; A193-E205 WeakPolarHBondContact O-CB 3.3Å; A193-E205 WeakPolarHBondContact O-CG 3.23Å; A193-I208 HydrophobicContact CB-CB 4.43Å; A193-I208 HydrophobicContact CB-CG2 4.11Å; A193-A209 HydrophobicContact CB-CB 3.7Å
194	D	88.7	Confident	87	Confident	12 Å²	12	50.2 Å²	50.2	6%	0.064	27%	0.273	C	S	.	.			trans	-77.6	69.6	176.7	-168.9	-9.6	0	0	0	110.4	W190 N196 K197 N198 G199 L201	W190-D194 PolarHBondContact NE1-OD2 3.49Å; W190-D194 WeakPolarHBondContact O-CB 3.45Å; W190-D194 PolarHBondContact O-N 2.84Å; D194-N196 PolarHBondContact O-N 2.61Å; D194-K197 PolarHBondContact O-N 3.25Å; D194-K197 VanDerWaalsContact O-N 3.16Å; D194-K197 WeakPolarHBondContact OD1-CA 3.26Å; D194-K197 PolarHBondContact OD1-N 3.29Å; D194-N198 PolarHBondContact OD1-N 2.94Å; D194-N198 VanDerWaalsContact OD1-N 3.15Å; D194-G199 WeakPolarHBondContact OD2-CA 3.44Å; D194-G199 PolarHBondContact OD2-N 3.08Å; D194-L201 HydrophobicContact CB-CD2 4.2Å
195	L	83.9	Confident	87.2	Confident	70 Å²	70	45.8 Å²	45.8	37%	0.366	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.1	-34.2	-172.3	-55.8	-179.4	0	0	0	112.7	A193 E205 I208 L226	A193-L195 PolarHBondContact O-N 2.9Å; L195-E205 HydrophobicContact CB-CG 4.48Å; L195-E205 HydrophobicContact CD1-CG 4.21Å; L195-E205 HydrophobicContact CG-CG 4.06Å; L195-I208 HydrophobicContact CD1-CD1 3.9Å; L195-I208 HydrophobicContact CD2-CD1 4.29Å; L195-I208 HydrophobicContact CG-CD1 4.35Å; L195-L226 HydrophobicContact CD2-CD2 3.47Å; L195-L226 VanDerWaalsContact CD2-CD2 3.47Å
196	N	83.6	Confident	87.5	Confident	79 Å²	79	42.8 Å²	42.8	42%	0.422	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97.3	-9.4	-175.5	76.1	65.7	0	0	0	113.5	D194 N198 E205	D194-N196 PolarHBondContact O-N 2.61Å; N196-N198 WeakPolarHBondContact OD1-CB 3.39Å; N196-N198 PolarHBondContact OD1-N 3.16Å; N196-N198 PolarHBondContact OD1-ND2 3.05Å; N196-N198 VanDerWaalsContact OD1-ND2 3.07Å; N196-N198 PolarHBondContact OD1-OD1 2.8Å; N196-E205 VanDerWaalsContact ND2-CD 3.26Å; N196-E205 PolarHBondContact ND2-OE1 3.09Å; N196-E205 PolarHBondContact ND2-OE2 2.97Å; N196-E205 VanDerWaalsContact ND2-OE2 3.09Å
197	K	84.6	Confident	87.6	Confident	181 Å²	181	42.2 Å²	42.2	79%	0.787	23%	0.225	S	C	*	.			trans	61.2	33.4	179.1	-56.6	-174.6	179	-177.2	0	115.1	D194	D194-K197 PolarHBondContact O-N 3.25Å; D194-K197 VanDerWaalsContact O-N 3.16Å; D194-K197 WeakPolarHBondContact OD1-CA 3.26Å; D194-K197 PolarHBondContact OD1-N 3.29Å
198	N	86.4	Confident	87.8	Confident	84 Å²	84	40.4 Å²	40.4	45%	0.449	21%	0.21	S	C	.	.	S	Bend	trans	-90.3	-5.7	177.4	71.1	5.1	0	0	0	114.3	D194 N196 N200	D194-N198 PolarHBondContact OD1-N 2.94Å; D194-N198 VanDerWaalsContact OD1-N 3.15Å; N196-N198 WeakPolarHBondContact OD1-CB 3.39Å; N196-N198 PolarHBondContact OD1-N 3.16Å; N196-N198 PolarHBondContact OD1-ND2 3.05Å; N196-N198 VanDerWaalsContact OD1-ND2 3.07Å; N196-N198 PolarHBondContact OD1-OD1 2.8Å; N198-N200 VanDerWaalsContact C-N 3.3Å; N198-N200 PolarHBondContact O-N 3.25Å; N198-N200 WeakPolarHBondContact OD1-CA 3.44Å; N198-N200 WeakPolarHBondContact OD1-CB 3.45Å; N198-N200 PolarHBondContact OD1-N 3.3Å; N198-N200 PolarHBondContact OD1-O 3.16Å
199	G	85.2	Confident	88	Confident	29 Å²	29	37.5 Å²	37.5	30%	0.299	20%	0.197	S	C	.	.	S	Bend	trans	75.4	12.9	-176.7	0	0	0	0	0	115.2	G169 D194	G169-G199 WeakPolarHBondContact CA-O 3.48Å; G169-G199 PolarHBondContact N-O 2.89Å; D194-G199 WeakPolarHBondContact OD2-CA 3.44Å; D194-G199 PolarHBondContact OD2-N 3.08Å
200	N	89.9	Confident	88.1	Confident	46 Å²	46	37.5 Å²	37.5	25%	0.246	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	97.6	-176.2	-65.5	-37.6	0	0	0	110.7	F166 L167 T168 N198 N202	F166-N200 HydrophobicContact CB-CB 4.32Å; F166-N200 HydrophobicContact CD2-CB 3.69Å; F166-N200 HydrophobicContact CE2-CB 4.35Å; F166-N200 HydrophobicContact CG-CB 4.23Å; L167-N200 CarbonylContact O-C 3.59Å; L167-N200 VanDerWaalsContact O-CA 3.26Å; L167-N200 WeakPolarHBondContact O-CA 3.26Å; T168-N200 VanDerWaalsContact CA-OD1 3.3Å; T168-N200 WeakPolarHBondContact CA-OD1 3.24Å; N198-N200 VanDerWaalsContact C-N 3.3Å; N198-N200 PolarHBondContact O-N 3.25Å; N198-N200 WeakPolarHBondContact OD1-CA 3.44Å; N198-N200 WeakPolarHBondContact OD1-CB 3.45Å; N198-N200 PolarHBondContact OD1-N 3.3Å; N198-N200 PolarHBondContact OD1-O 3.16Å; N200-N202 PolarHBondContact O-N 3.3Å; N200-N202 VanDerWaalsContact O-N 3.16Å
201	L	88.4	Confident	88.2	Confident	0 Å²	0	36.4 Å²	36.4	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.7	117.7	-179.5	-64.8	171.1	0	0	0	111	F166 L167 A172 L176 W190 A193 D194 E205 F206 A209	F166-L201 WeakPolarHBondContact CA-O 2.98Å; L167-L201 PolarHBondContact N-O 3.32Å; L167-L201 PolarHBondContact O-N 3.37Å; A172-L201 HydrophobicContact CB-CD1 4.07Å; L176-L201 HydrophobicContact CD1-CD1 4.31Å; W190-L201 HydrophobicContact CE3-CD1 4.11Å; W190-L201 HydrophobicContact CH2-CD1 3.73Å; W190-L201 HydrophobicContact CH2-CG 3.62Å; W190-L201 HydrophobicContact CZ2-CD1 4.34Å; W190-L201 HydrophobicContact CZ2-CD2 4.42Å; W190-L201 HydrophobicContact CZ2-CG 3.86Å; W190-L201 HydrophobicContact CZ3-CD1 3.62Å; W190-L201 HydrophobicContact CZ3-CG 4.06Å; A193-L201 HydrophobicContact CB-CD2 3.91Å; D194-L201 HydrophobicContact CB-CD2 4.2Å; L201-E205 HydrophobicContact CB-CB 4.26Å; L201-E205 HydrophobicContact CD2-CB 3.83Å; L201-F206 HydrophobicContact CB-CB 4.4Å; L201-A209 HydrophobicContact CD1-CB 4Å
202	N	90.9	Very high	88.3	Confident	54 Å²	54	30.7 Å²	30.7	29%	0.289	16%	0.163	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	175.6	168.7	81.7	52.4	0	0	0	111.8	N200 D204 E205 F206	N200-N202 PolarHBondContact O-N 3.3Å; N200-N202 VanDerWaalsContact O-N 3.16Å; N202-D204 VanDerWaalsContact C-N 3.33Å; N202-D204 PolarHBondContact O-N 2.93Å; N202-D204 PolarHBondContact OD1-N 2.88Å; N202-E205 WeakPolarHBondContact CB-OE2 3.37Å; N202-E205 PolarHBondContact N-OE2 2.68Å; N202-E205 WeakPolarHBondContact ND2-CG 3.47Å; N202-E205 PolarHBondContact ND2-OE1 3.03Å; N202-E205 PolarHBondContact ND2-OE2 2.89Å; N202-E205 PolarHBondContact O-N 2.93Å; N202-E205 PolarHBondContact OD1-N 3.32Å; N202-F206 WeakPolarHBondContact O-CB 3.45Å; N202-F206 PolarHBondContact O-N 2.93Å
203	C	89.4	Confident	88.4	Confident	21 Å²	21	30 Å²	30	14%	0.142	16%	0.159	C	C	.	.	H	α-helix	trans	-56.1	-38.7	-175.8	-167.5	0	0	0	0	114.6	F156 C207	F156-C203 HydrophobicContact CD1-CB 3.97Å; F156-C203 HydrophobicContact CE1-CB 3.79Å; F156-C203 HydrophobicContact CE2-CB 4.33Å; F156-C203 HydrophobicContact CG-CB 4.33Å; F156-C203 HydrophobicContact CZ-CB 3.99Å; C203-C207 PolarHBondContact O-N 3.33Å; C203-C207 PolarHBondContact O-SG 2.89Å
204	D	88.3	Confident	88.3	Confident	32 Å²	32	30.5 Å²	30.5	17%	0.171	16%	0.161	C	C	.	.	H	α-helix	trans	-84	-32.7	178.1	-73.9	-60	0	0	0	112.7	R149 R153 N202 F206 C207 I208 P232	R149-D204 IonicContact CZ-OD1 3.75Å; R149-D204 IonicContact NE-OD1 3.58Å; R149-D204 PolarHBondContact NE-OD1 2.89Å; R149-D204 IonicContact NH2-OD1 2.69Å; R149-D204 PolarHBondContact NH2-OD1 3.49Å; R153-D204 IonicContact CZ-OD1 3.98Å; R153-D204 IonicContact CZ-OD2 2.71Å; R153-D204 IonicContact NE-OD1 2.79Å; R153-D204 IonicContact NH2-OD1 2.68Å; R153-D204 PolarHBondContact NH2-OD1 2.93Å; R153-D204 IonicContact NH2-OD2 2.91Å; R153-D204 PolarHBondContact NH2-OD2 3.24Å; N202-D204 VanDerWaalsContact C-N 3.33Å; N202-D204 PolarHBondContact O-N 2.93Å; N202-D204 PolarHBondContact OD1-N 2.88Å; D204-F206 VanDerWaalsContact C-N 3.33Å; D204-C207 VanDerWaalsContact O-CB 3.32Å; D204-C207 WeakPolarHBondContact O-CB 3.39Å; D204-C207 PolarHBondContact O-N 2.77Å; D204-C207 VanDerWaalsContact O-N 3.15Å; D204-I208 WeakPolarHBondContact O-CG1 3.13Å; D204-I208 PolarHBondContact O-N 3.32Å; D204-P232 HydrophobicContact CB-CG 3.92Å
205	E	91.3	Very high	88	Confident	6 Å²	6	31.3 Å²	31.3	3%	0.028	16%	0.164	C	C	.	.	H	α-helix	trans	-64.6	-38.6	172.5	-69	172.8	157.9	0	0	111.3	A193 L195 N196 L201 N202 I208 A209	A193-E205 VanDerWaalsContact O-CB 3.3Å; A193-E205 WeakPolarHBondContact O-CB 3.3Å; A193-E205 WeakPolarHBondContact O-CG 3.23Å; L195-E205 HydrophobicContact CB-CG 4.48Å; L195-E205 HydrophobicContact CD1-CG 4.21Å; L195-E205 HydrophobicContact CG-CG 4.06Å; N196-E205 VanDerWaalsContact ND2-CD 3.26Å; N196-E205 PolarHBondContact ND2-OE1 3.09Å; N196-E205 PolarHBondContact ND2-OE2 2.97Å; N196-E205 VanDerWaalsContact ND2-OE2 3.09Å; L201-E205 HydrophobicContact CB-CB 4.26Å; L201-E205 HydrophobicContact CD2-CB 3.83Å; N202-E205 WeakPolarHBondContact CB-OE2 3.37Å; N202-E205 PolarHBondContact N-OE2 2.68Å; N202-E205 WeakPolarHBondContact ND2-CG 3.47Å; N202-E205 PolarHBondContact ND2-OE1 3.03Å; N202-E205 PolarHBondContact ND2-OE2 2.89Å; N202-E205 PolarHBondContact O-N 2.93Å; N202-E205 PolarHBondContact OD1-N 3.32Å; E205-I208 WeakPolarHBondContact O-CB 3.24Å; E205-I208 PolarHBondContact O-N 3.48Å; E205-A209 PolarHBondContact O-N 3.38Å
206	F	91.8	Very high	88	Confident	0 Å²	0	29 Å²	29	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-64.6	-38.3	170.2	-175.4	-94	0	0	0	112.1	L155 F156 L167 I175 L201 N202 D204 I208 A209 I210	L155-F206 HydrophobicContact CB-CE1 4.2Å; L155-F206 HydrophobicContact CD2-CE1 4.04Å; L155-F206 HydrophobicContact CD2-CZ 3.95Å; L155-F206 HydrophobicContact CG-CE1 3.99Å; L155-F206 HydrophobicContact CG-CZ 3.96Å; F156-F206 HydrophobicContact CB-CD1 3.7Å; F156-F206 HydrophobicContact CB-CE1 4.01Å; F156-F206 HydrophobicContact CB-CG 4.37Å; F156-F206 HydrophobicContact CD2-CB 3.67Å; F156-F206 AromaticContact CD2-CD1 3.98Å; F156-F206 HydrophobicContact CD2-CD1 3.98Å; F156-F206 HydrophobicContact CD2-CD2 4.4Å; F156-F206 AromaticContact CD2-CG 3.77Å; F156-F206 HydrophobicContact CD2-CG 3.77Å; F156-F206 HydrophobicContact CE2-CB 4.27Å; F156-F206 HydrophobicContact CG-CD1 4.34Å; L167-F206 HydrophobicContact CD1-CD2 3.63Å; L167-F206 HydrophobicContact CD1-CE2 3.73Å; L167-F206 HydrophobicContact CD1-CG 4.25Å; L167-F206 HydrophobicContact CD1-CZ 4.42Å; I175-F206 HydrophobicContact CD1-CE2 4.02Å; I175-F206 HydrophobicContact CD1-CZ 4.39Å; I175-F206 HydrophobicContact CG2-CE2 4.18Å; I175-F206 HydrophobicContact CG2-CZ 4.03Å; L201-F206 HydrophobicContact CB-CB 4.4Å; N202-F206 WeakPolarHBondContact O-CB 3.45Å; N202-F206 PolarHBondContact O-N 2.93Å; D204-F206 VanDerWaalsContact C-N 3.33Å; F206-I208 VanDerWaalsContact C-N 3.26Å; F206-I208 PolarHBondContact O-N 3.45Å; F206-A209 PolarHBondContact O-N 2.86Å; F206-I210 HydrophobicContact CD1-CG1 3.99Å; F206-I210 HydrophobicContact CE1-CD1 4.15Å; F206-I210 HydrophobicContact CE1-CG1 3.57Å; F206-I210 HydrophobicContact CE2-CD1 4.07Å; F206-I210 HydrophobicContact CE2-CG1 4.28Å; F206-I210 HydrophobicContact CZ-CD1 3.76Å; F206-I210 HydrophobicContact CZ-CG1 3.73Å; F206-I210 WeakPolarHBondContact O-CG1 3.43Å; F206-I210 PolarHBondContact O-N 2.92Å
207	C	90.7	Very high	88	Confident	0 Å²	0	26.5 Å²	26.5	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-60.5	-36.5	172.4	-67.3	0	0	0	0	112.2	I144 Y152 C203 D204 F211	I144-C207 HydrophobicContact CD1-CB 4.1Å; Y152-C207 HydrophobicContact CD2-CB 4Å; Y152-C207 WeakPolarHBondContact CD2-O 3.41Å; C203-C207 PolarHBondContact O-N 3.33Å; C203-C207 PolarHBondContact O-SG 2.89Å; D204-C207 VanDerWaalsContact O-CB 3.32Å; D204-C207 WeakPolarHBondContact O-CB 3.39Å; D204-C207 PolarHBondContact O-N 2.77Å; D204-C207 VanDerWaalsContact O-N 3.15Å; C207-F211 WeakPolarHBondContact O-CB 3.19Å; C207-F211 PolarHBondContact O-N 2.71Å
208	I	88.9	Confident	87.8	Confident	0 Å²	0	20.1 Å²	20.1	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-68.9	-45.3	174.2	-65.1	165.4	0	0	0	110.5	I144 A193 L195 D204 E205 F206 I210 F211 L212 L226 L230	I144-I208 HydrophobicContact CD1-CG1 4.21Å; A193-I208 HydrophobicContact CB-CB 4.43Å; A193-I208 HydrophobicContact CB-CG2 4.11Å; L195-I208 HydrophobicContact CD1-CD1 3.9Å; L195-I208 HydrophobicContact CD2-CD1 4.29Å; L195-I208 HydrophobicContact CG-CD1 4.35Å; D204-I208 WeakPolarHBondContact O-CG1 3.13Å; D204-I208 PolarHBondContact O-N 3.32Å; E205-I208 WeakPolarHBondContact O-CB 3.24Å; E205-I208 PolarHBondContact O-N 3.48Å; F206-I208 VanDerWaalsContact C-N 3.26Å; F206-I208 PolarHBondContact O-N 3.45Å; I208-I210 PolarHBondContact O-N 3.16Å; I208-F211 PolarHBondContact O-N 2.96Å; I208-L212 HydrophobicContact CG2-CD1 3.8Å; I208-L212 HydrophobicContact CG2-CG 4.31Å; I208-L212 WeakPolarHBondContact O-CB 3.41Å; I208-L212 VanDerWaalsContact O-CG 3.31Å; I208-L212 WeakPolarHBondContact O-CG 3.39Å; I208-L212 PolarHBondContact O-N 2.83Å; I208-L226 HydrophobicContact CG2-CD1 3.75Å; I208-L230 WeakPolarHBondContact CD1-O 3.5Å; I208-L230 HydrophobicContact CG1-CB 4.46Å
209	A	90.8	Very high	87.2	Confident	0 Å²	0	19.3 Å²	19.3	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-57.7	-46.9	178.3	0	0	0	0	0	112.4	L176 I189 A193 L201 E205 F206 L212 I213	L176-A209 HydrophobicContact CD2-CB 4.07Å; I189-A209 HydrophobicContact CG2-CB 4.4Å; A193-A209 HydrophobicContact CB-CB 3.7Å; L201-A209 HydrophobicContact CD1-CB 4Å; E205-A209 PolarHBondContact O-N 3.38Å; F206-A209 PolarHBondContact O-N 2.86Å; A209-L212 PolarHBondContact O-N 3.05Å; A209-I213 WeakPolarHBondContact O-CG1 3.26Å; A209-I213 PolarHBondContact O-N 2.82Å
210	I	90.6	Very high	86.5	Confident	0 Å²	0	19.7 Å²	19.7	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-67.7	-40.1	179.2	-59.7	-46	0	0	0	111.9	I103 Y152 L155 L176 Y179 F206 I208 L212 I213 E214	I103-I210 HydrophobicContact CD1-CG2 3.68Å; Y152-I210 HydrophobicContact CD1-CB 4.19Å; Y152-I210 HydrophobicContact CD1-CG2 3.62Å; Y152-I210 HydrophobicContact CE1-CB 4.44Å; Y152-I210 HydrophobicContact CE1-CG2 3.64Å; Y152-I210 HydrophobicContact CG-CB 4.29Å; Y152-I210 HydrophobicContact CG-CG2 4.22Å; L155-I210 HydrophobicContact CD2-CD1 4.4Å; L155-I210 HydrophobicContact CD2-CG1 4.33Å; L176-I210 HydrophobicContact CD2-CD1 3.61Å; Y179-I210 HydrophobicContact CE2-CD1 3.94Å; Y179-I210 WeakPolarHBondContact OH-CD1 3.42Å; F206-I210 HydrophobicContact CD1-CG1 3.99Å; F206-I210 HydrophobicContact CE1-CD1 4.15Å; F206-I210 HydrophobicContact CE1-CG1 3.57Å; F206-I210 HydrophobicContact CE2-CD1 4.07Å; F206-I210 HydrophobicContact CE2-CG1 4.28Å; F206-I210 HydrophobicContact CZ-CD1 3.76Å; F206-I210 HydrophobicContact CZ-CG1 3.73Å; F206-I210 WeakPolarHBondContact O-CG1 3.43Å; F206-I210 PolarHBondContact O-N 2.92Å; I208-I210 PolarHBondContact O-N 3.16Å; I210-L212 VanDerWaalsContact C-N 3.35Å; I210-L212 PolarHBondContact O-N 3.06Å; I210-I213 WeakPolarHBondContact O-CB 3.42Å; I210-I213 PolarHBondContact O-N 2.9Å; I210-E214 PolarHBondContact O-N 3.4Å
211	F	88.7	Confident	85.4	Confident	15 Å²	15	26.2 Å²	26.2	7%	0.066	16%	0.158	C	C	.	.	H	α-helix	trans	-61.9	-40.8	175.3	-177.2	-97.9	0	0	0	112.8	W142 I143 I144 Y152 C207 I208 I213 E214 K215 L230	W142-F211 HydrophobicContact CE3-CE1 4.18Å; I143-F211 WeakPolarHBondContact O-CE2 3.11Å; I144-F211 HydrophobicContact CB-CD2 4.45Å; I144-F211 HydrophobicContact CD1-CB 4.2Å; I144-F211 HydrophobicContact CG1-CB 3.78Å; I144-F211 HydrophobicContact CG1-CD1 4.25Å; I144-F211 HydrophobicContact CG1-CD2 3.74Å; I144-F211 HydrophobicContact CG1-CE2 4.4Å; I144-F211 HydrophobicContact CG1-CG 3.65Å; Y152-F211 HydrophobicContact CE2-CB 4.01Å; Y152-F211 HydrophobicContact CE2-CD2 4.46Å; C207-F211 WeakPolarHBondContact O-CB 3.19Å; C207-F211 PolarHBondContact O-N 2.71Å; I208-F211 PolarHBondContact O-N 2.96Å; F211-I213 VanDerWaalsContact C-N 3.34Å; F211-E214 PolarHBondContact O-N 3Å; F211-K215 HydrophobicContact CE1-CG 4.31Å; F211-K215 HydrophobicContact CZ-CG 4.48Å; F211-K215 PolarHBondContact O-N 3.3Å; F211-K215 VanDerWaalsContact O-N 3.09Å; F211-L230 HydrophobicContact CD1-CD1 4.04Å; F211-L230 HydrophobicContact CD1-CD2 3.73Å; F211-L230 HydrophobicContact CE1-CD1 4.21Å; F211-L230 HydrophobicContact CE1-CD2 3.77Å; F211-L230 HydrophobicContact CG-CD2 4.45Å
212	L	88.4	Confident	84.4	Confident	0 Å²	0	27.9 Å²	27.9	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-67.4	-33.9	174.8	-70.5	172.3	0	0	0	112.1	W142 I189 L192 I208 A209 I210 A216 L222 L226 L230	W142-L212 HydrophobicContact CZ3-CD2 4.18Å; I189-L212 HydrophobicContact CG1-CB 4.23Å; I189-L212 HydrophobicContact CG2-CB 3.86Å; I189-L212 HydrophobicContact CG2-CD1 4.35Å; L192-L212 HydrophobicContact CB-CD1 3.56Å; L192-L212 HydrophobicContact CD1-CD1 3.94Å; L192-L212 HydrophobicContact CD1-CD2 4.38Å; L192-L212 HydrophobicContact CG-CD1 4.44Å; I208-L212 HydrophobicContact CG2-CD1 3.8Å; I208-L212 HydrophobicContact CG2-CG 4.31Å; I208-L212 WeakPolarHBondContact O-CB 3.41Å; I208-L212 VanDerWaalsContact O-CG 3.31Å; I208-L212 WeakPolarHBondContact O-CG 3.39Å; I208-L212 PolarHBondContact O-N 2.83Å; A209-L212 PolarHBondContact O-N 3.05Å; I210-L212 VanDerWaalsContact C-N 3.35Å; I210-L212 PolarHBondContact O-N 3.06Å; L212-A216 WeakPolarHBondContact O-CB 3.43Å; L212-A216 PolarHBondContact O-N 2.91Å; L212-L222 HydrophobicContact CB-CD2 4.14Å; L212-L222 HydrophobicContact CD2-CD2 4.2Å; L212-L226 HydrophobicContact CD1-CD1 4.3Å; L212-L230 HydrophobicContact CD2-CD1 4.42Å
213	I	88.2	Confident	83.3	Confident	0 Å²	0	26.3 Å²	26.3	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-64.4	-49.7	171.1	-75.1	-174.1	0	0	0	111.2	L176 Y179 L181 L186 I189 A209 I210 F211 K215 A216 I217	L176-I213 HydrophobicContact CB-CD1 3.9Å; L176-I213 HydrophobicContact CD2-CD1 3.43Å; L176-I213 VanDerWaalsContact CD2-CD1 3.43Å; L176-I213 HydrophobicContact CG-CD1 4.21Å; Y179-I213 HydrophobicContact CD1-CG2 3.26Å; Y179-I213 HydrophobicContact CD2-CD1 4.18Å; Y179-I213 HydrophobicContact CD2-CG2 4.42Å; Y179-I213 HydrophobicContact CE1-CG2 3.79Å; Y179-I213 HydrophobicContact CG-CD1 4.23Å; Y179-I213 HydrophobicContact CG-CG2 3.59Å; L181-I213 HydrophobicContact CD1-CB 4.21Å; L181-I213 HydrophobicContact CD1-CG1 3.93Å; L181-I213 HydrophobicContact CD1-CG2 3.9Å; L186-I213 HydrophobicContact CD2-CD1 3.91Å; L186-I213 HydrophobicContact CD2-CG1 4.43Å; I189-I213 HydrophobicContact CD1-CB 4.42Å; I189-I213 HydrophobicContact CD1-CG1 3.59Å; I189-I213 HydrophobicContact CG2-CG1 4.22Å; A209-I213 WeakPolarHBondContact O-CG1 3.26Å; A209-I213 PolarHBondContact O-N 2.82Å; I210-I213 WeakPolarHBondContact O-CB 3.42Å; I210-I213 PolarHBondContact O-N 2.9Å; F211-I213 VanDerWaalsContact C-N 3.34Å; I213-K215 PolarHBondContact O-N 2.83Å; I213-A216 PolarHBondContact O-N 2.91Å; I213-A216 VanDerWaalsContact O-N 3.08Å; I213-I217 HydrophobicContact CG2-CD1 3.56Å; I213-I217 HydrophobicContact CG2-CG1 4.16Å; I213-I217 WeakPolarHBondContact O-CG1 3.45Å; I213-I217 PolarHBondContact O-N 2.78Å
214	E	85.9	Confident	82	Confident	12 Å²	12	32.2 Å²	32.2	6%	0.056	19%	0.19	C	C	.	.	H	α-helix	trans	-54.9	-41.4	176.8	-91.8	169.7	-116	0	0	112.2	I103 N148 Y152 I210 F211 S218	I103-E214 HydrophobicContact CB-CG 4.16Å; I103-E214 VanDerWaalsContact CB-OE1 3.27Å; I103-E214 WeakPolarHBondContact CB-OE1 3.46Å; I103-E214 HydrophobicContact CG2-CG 4.18Å; I103-E214 VanDerWaalsContact CG2-OE1 3.24Å; I103-E214 WeakPolarHBondContact CG2-OE1 3.44Å; I103-E214 WeakPolarHBondContact CG2-OE2 3.47Å; I103-E214 WeakPolarHBondContact O-CG 3.15Å; N148-E214 PolarHBondContact ND2-OE2 2.78Å; Y152-E214 WeakPolarHBondContact CE1-OE1 3.28Å; Y152-E214 PolarHBondContact OH-OE1 3.5Å; Y152-E214 PolarHBondContact OH-OE2 3.23Å; I210-E214 PolarHBondContact O-N 3.4Å; F211-E214 PolarHBondContact O-N 3Å; E214-S218 WeakPolarHBondContact O-CB 3.41Å; E214-S218 PolarHBondContact O-N 3.05Å; E214-S218 PolarHBondContact O-OG 3.38Å
215	K	82.2	Confident	80.9	Confident	29 Å²	29	36.1 Å²	36.1	13%	0.126	22%	0.215	C	C	.	.	H	α-helix	trans	-66.6	-42.5	175.1	-80.7	-73.5	175.1	-179.8	0	112.9	D141 W142 F211 I213 S218 S220	D141-K215 WeakPolarHBondContact O-CE 3.48Å; D141-K215 PolarHBondContact O-NZ 2.9Å; D141-K215 IonicContact OD1-NZ 3.61Å; D141-K215 PolarHBondContact OD1-NZ 2.95Å; D141-K215 IonicContact OD2-NZ 2.7Å; D141-K215 PolarHBondContact OD2-NZ 2.72Å; W142-K215 HydrophobicContact CH2-CB 4.33Å; W142-K215 HydrophobicContact CH2-CD 4.41Å; W142-K215 HydrophobicContact CH2-CG 4.34Å; W142-K215 HydrophobicContact CZ3-CB 4.17Å; W142-K215 HydrophobicContact CZ3-CD 4.46Å; W142-K215 HydrophobicContact CZ3-CG 4Å; F211-K215 HydrophobicContact CE1-CG 4.31Å; F211-K215 HydrophobicContact CZ-CG 4.48Å; F211-K215 PolarHBondContact O-N 3.3Å; F211-K215 VanDerWaalsContact O-N 3.09Å; I213-K215 PolarHBondContact O-N 2.83Å; K215-S218 CarbonylContact O-C 3.56Å; K215-S218 PolarHBondContact O-N 3.38Å; K215-S220 VanDerWaalsContact O-CB 3.26Å; K215-S220 WeakPolarHBondContact O-CB 3.46Å; K215-S220 PolarHBondContact O-N 2.79Å
216	A	83.9	Confident	79.6	Confident	21 Å²	21	37.7 Å²	37.7	17%	0.174	22%	0.224	C	C	.	.	H	α-helix	trans	-65.2	-39.2	177.1	0	0	0	0	0	112.9	L181 I185 I189 L212 I213 G219 L222	L181-A216 HydrophobicContact CD1-CB 3.94Å; L181-A216 HydrophobicContact CD2-CB 4.38Å; I185-A216 HydrophobicContact CG2-CB 4.4Å; I189-A216 HydrophobicContact CD1-CB 4.12Å; L212-A216 WeakPolarHBondContact O-CB 3.43Å; L212-A216 PolarHBondContact O-N 2.91Å; I213-A216 PolarHBondContact O-N 2.91Å; I213-A216 VanDerWaalsContact O-N 3.08Å; A216-G219 PolarHBondContact O-N 3.39Å; A216-L222 HydrophobicContact CB-CD1 4.11Å; A216-L222 HydrophobicContact CB-CD2 4.16Å; A216-L222 HydrophobicContact CB-CG 4.09Å
217	I	84.1	Confident	78.1	Confident	26 Å²	26	39.2 Å²	39.2	13%	0.133	23%	0.233	C	C	.	.	H	α-helix	trans	-70.7	-39.7	174.6	-55.8	165.5	0	0	0	110.1	G106 Y179 L181 I213 G219	G106-I217 VanDerWaalsContact O-CG2 3.3Å; G106-I217 WeakPolarHBondContact O-CG2 3.26Å; Y179-I217 HydrophobicContact CD1-CD1 3.95Å; L181-I217 HydrophobicContact CD1-CG1 4.21Å; L181-I217 HydrophobicContact CD2-CG1 3.94Å; L181-I217 HydrophobicContact CG-CG1 4.08Å; I213-I217 HydrophobicContact CG2-CD1 3.56Å; I213-I217 HydrophobicContact CG2-CG1 4.16Å; I213-I217 WeakPolarHBondContact O-CG1 3.45Å; I213-I217 PolarHBondContact O-N 2.78Å; I217-G219 PolarHBondContact O-N 3.45Å
218	S	80.2	Confident	76.4	Confident	48 Å²	48	44.3 Å²	44.3	34%	0.336	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.3	22.8	174.2	-57.2	0	0	0	0	114.2	S105 E214 K215 S220	S105-S218 PolarHBondContact O-OG 3.49Å; E214-S218 WeakPolarHBondContact O-CB 3.41Å; E214-S218 PolarHBondContact O-N 3.05Å; E214-S218 PolarHBondContact O-OG 3.38Å; K215-S218 CarbonylContact O-C 3.56Å; K215-S218 PolarHBondContact O-N 3.38Å; S218-S220 PolarHBondContact O-N 2.89Å
219	G	73.4	Confident	74.8	Confident	67 Å²	67	46.6 Å²	46.6	69%	0.691	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.4	6.9	175.2	0	0	0	0	0	115.9	A216 I217	A216-G219 PolarHBondContact O-N 3.39Å; I217-G219 PolarHBondContact O-N 3.45Å
220	S	70.3	Confident	73.3	Confident	37 Å²	37	46.8 Å²	46.8	26%	0.259	29%	0.293	S	S	.	.	P	Polyproline II helix	trans	-80.1	127.5	178.6	-54.9	0	0	0	0	109.7	K215 S218 L222	K215-S220 VanDerWaalsContact O-CB 3.26Å; K215-S220 WeakPolarHBondContact O-CB 3.46Å; K215-S220 PolarHBondContact O-N 2.79Å; S218-S220 PolarHBondContact O-N 2.89Å; S220-L222 PolarHBondContact O-N 3.28Å
221	Q	67.1	Low	71.6	Confident	183 Å²	183	51.7 Å²	51.7	86%	0.855	32%	0.319	S	S	*	.	P	Polyproline II helix	trans	-61.4	133.1	175.8	-65.5	-169.1	16.7	0	0	110.3
222	L	67.1	Low	69.6	Low	34 Å²	34	53.3 Å²	53.3	18%	0.178	33%	0.331	C	S	.	.	P	Polyproline II helix	trans	-67.3	138.3	-178.8	-78.2	163.8	0	0	0	111	I185 I189 L212 A216 S220	I185-L222 HydrophobicContact CG2-CD1 3.67Å; I189-L222 HydrophobicContact CD1-CD1 3.98Å; I189-L222 HydrophobicContact CD1-CD2 4.21Å; I189-L222 HydrophobicContact CG1-CD1 3.61Å; I189-L222 HydrophobicContact CG1-CD2 3.79Å; I189-L222 HydrophobicContact CG1-CG 4.38Å; L212-L222 HydrophobicContact CB-CD2 4.14Å; L212-L222 HydrophobicContact CD2-CD2 4.2Å; A216-L222 HydrophobicContact CB-CD1 4.11Å; A216-L222 HydrophobicContact CB-CD2 4.16Å; A216-L222 HydrophobicContact CB-CG 4.09Å; S220-L222 PolarHBondContact O-N 3.28Å
223	P	67.5	Low	67.4	Low	21 Å²	21	59 Å²	59	14%	0.136	37%	0.371	C	S	.	.	P	Polyproline II helix	trans	-61.6	145	175	-23.5	35.4	0	0	0	111.8	W142 H188 L192 T225 P227	W142-P223 HydrophobicContact CD2-CG 4.43Å; W142-P223 HydrophobicContact CE3-CG 3.97Å; W142-P223 HydrophobicContact CH2-CG 3.56Å; W142-P223 HydrophobicContact CZ2-CG 4.02Å; W142-P223 HydrophobicContact CZ3-CG 3.52Å; H188-P223 PolarHBondContact NE2-O 3.42Å; L192-P223 WeakPolarHBondContact CD1-O 3.45Å; P223-T225 VanDerWaalsContact C-N 3.28Å; P223-T225 WeakPolarHBondContact CB-O 3.33Å; P223-P227 HydrophobicContact CB-CG 4.23Å; P223-P227 HydrophobicContact CG-CG 3.88Å
224	N	63.7	Low	64.9	Low	146 Å²	146	66.5 Å²	66.5	78%	0.781	41%	0.411	S	S	*	.	S	Bend	trans	-78.3	-15.9	170.7	-72.5	-28.7	0	0	0	112.7
225	T	65.2	Low	62.3	Low	114 Å²	114	74.7 Å²	74.7	70%	0.699	45%	0.449	S	S	*	.	S	Bend	trans	-142.5	147.4	174.2	50	0	0	0	0	108.9	P223 P227	P223-T225 VanDerWaalsContact C-N 3.28Å; P223-T225 WeakPolarHBondContact CB-O 3.33Å; T225-P227 WeakPolarHBondContact O-CD 3.18Å
226	L	63.3	Low	59.8	Low	39 Å²	39	78.5 Å²	78.5	20%	0.204	48%	0.477	C	S	.	.			trans	-67.2	124.8	-175.1	-169.8	76.6	0	0	0	111.6	L192 L195 I208 L212 L230 L231	L192-L226 HydrophobicContact CB-CD1 4.46Å; L195-L226 HydrophobicContact CD2-CD2 3.47Å; L195-L226 VanDerWaalsContact CD2-CD2 3.47Å; I208-L226 HydrophobicContact CG2-CD1 3.75Å; L212-L226 HydrophobicContact CD1-CD1 4.3Å; L226-L230 HydrophobicContact CD1-CB 4.18Å; L226-L230 HydrophobicContact CD1-CD1 3.7Å; L226-L230 HydrophobicContact CD2-CB 4.24Å; L226-L230 HydrophobicContact CG-CB 4.16Å; L226-L230 HydrophobicContact CG-CD1 4.39Å; L226-L231 HydrophobicContact CD2-CD2 4.12Å
227	P	59.6	Low	57.2	Low	32 Å²	32	89.7 Å²	89.7	21%	0.208	52%	0.515	C	S	.	.			trans	-62.4	136.9	175.9	-24.6	35.2	0	0	0	112.6	W142 P223 T225 G229 L230	W142-P227 HydrophobicContact CB-CB 3.87Å; W142-P227 HydrophobicContact CB-CG 4.07Å; W142-P227 HydrophobicContact CD2-CG 3.95Å; W142-P227 HydrophobicContact CE3-CG 4.1Å; W142-P227 HydrophobicContact CG-CB 4.19Å; W142-P227 HydrophobicContact CG-CG 3.93Å; P223-P227 HydrophobicContact CB-CG 4.23Å; P223-P227 HydrophobicContact CG-CG 3.88Å; T225-P227 WeakPolarHBondContact O-CD 3.18Å; P227-G229 PolarHBondContact O-N 2.92Å; P227-L230 PolarHBondContact O-N 3.36Å
228	S	55.9	Low	54.7	Low	106 Å²	106	93.6 Å²	93.6	74%	0.741	54%	0.54	S	S	*	.	G	3₁₀ helix	trans	-60.1	-13.5	-172.3	-44.3	0	0	0	0	115.6	L230	S228-L230 VanDerWaalsContact C-N 3.35Å
229	G	55.2	Low	52.3	Low	48 Å²	48	101.3 Å²	101.3	50%	0.495	57%	0.568	S	S	.	*	G	3₁₀ helix	trans	-78.3	-10.5	174.6	0	0	0	0	0	115.2	P227	P227-G229 PolarHBondContact O-N 2.92Å
230	L	58.5	Low	50.2	Low	4 Å²	4	101 Å²	101	2%	0.021	56%	0.564	C	S	.	*	G	3₁₀ helix	trans	-94	-7.4	180	-65.2	179.7	0	0	0	114.1	W142 I144 I208 F211 L212 L226 P227 S228	W142-L230 VanDerWaalsContact O-CD2 3.29Å; W142-L230 WeakPolarHBondContact O-CD2 3.47Å; W142-L230 WeakPolarHBondContact O-CG 3.47Å; I144-L230 HydrophobicContact CD1-CD2 4.14Å; I144-L230 HydrophobicContact CG1-CD2 3.8Å; I208-L230 WeakPolarHBondContact CD1-O 3.5Å; I208-L230 HydrophobicContact CG1-CB 4.46Å; F211-L230 HydrophobicContact CD1-CD1 4.04Å; F211-L230 HydrophobicContact CD1-CD2 3.73Å; F211-L230 HydrophobicContact CE1-CD1 4.21Å; F211-L230 HydrophobicContact CE1-CD2 3.77Å; F211-L230 HydrophobicContact CG-CD2 4.45Å; L212-L230 HydrophobicContact CD2-CD1 4.42Å; L226-L230 HydrophobicContact CD1-CB 4.18Å; L226-L230 HydrophobicContact CD1-CD1 3.7Å; L226-L230 HydrophobicContact CD2-CB 4.24Å; L226-L230 HydrophobicContact CG-CB 4.16Å; L226-L230 HydrophobicContact CG-CD1 4.39Å; P227-L230 PolarHBondContact O-N 3.36Å; S228-L230 VanDerWaalsContact C-N 3.35Å
231	L	55.6	Low	48.4	Very low	104 Å²	104	107.6 Å²	107.6	55%	0.545	59%	0.591	S	S	.	*	S	Bend	trans	-70.8	129.9	-179.2	-66.1	171.3	0	0	0	111.6	L226 S233	L226-L231 HydrophobicContact CD2-CD2 4.12Å; L231-S233 PolarHBondContact O-N 3.39Å
232	P	47.1	Very low	46.5	Very low	49 Å²	49	104.8 Å²	104.8	32%	0.318	59%	0.586	S	S	.	*			trans	-61.6	124.1	175.2	-24.6	35.4	0	0	0	112.3	D204 N234	D204-P232 HydrophobicContact CB-CG 3.92Å; P232-N234 PolarHBondContact O-N 3.43Å
233	S	41.3	Very low	44.7	Very low	120 Å²	120	109.1 Å²	109.1	84%	0.839	62%	0.619	S	S	*	*			trans	-80.3	111.6	-179.4	-171.8	0	0	0	0	111.3	L231 Q235	L231-S233 PolarHBondContact O-N 3.39Å; S233-Q235 PolarHBondContact O-N 3.44Å
234	N	35.4	Very low	43.2	Very low	156 Å²	156	114.2 Å²	114.2	83%	0.834	65%	0.653	S	S	*	*			trans	-70.8	125.1	177.7	-78.8	-28.7	0	0	0	111.9	P232	P232-N234 PolarHBondContact O-N 3.43Å
235	Q	32.4	Very low	41.5	Very low	185 Å²	185	112.4 Å²	112.4	86%	0.864	65%	0.651	S	S	*	*			trans	-70.8	162.2	162.9	-64.2	177.9	-21.3	0	0	110.9	S233	S233-Q235 PolarHBondContact O-N 3.44Å
236	P	30	Very low	39.9	Very low	108 Å²	108	113 Å²	113	70%	0.701	66%	0.655	S	S	*	*			cis	-121.3	152.9	-21.1	35.4	-21.6	0	0	0	112.4	T238	P236-T238 PolarHBondContact O-N 3.43Å
237	R	28.1	Very low	38.2	Very low	257 Å²	257	117.6 Å²	117.6	97%	0.97	69%	0.685	S	S	*	*			trans	-82.5	100.4	171	-86.5	-71.9	-151.3	174.2	6.7	111.1
238	T	32.1	Very low	37	Very low	108 Å²	108	120.3 Å²	120.3	66%	0.663	71%	0.709	S	S	*	*			trans	-134.2	127.2	163.9	47.4	0	0	0	0	111	P236	P236-T238 PolarHBondContact O-N 3.43Å
239	F	29.7	Very low	36	Very low	210 Å²	210	123 Å²	123	92%	0.921	71%	0.708	S	S	*	*			trans	55	119.5	169.9	-66.9	-79.2	0	0	0	121
240	G	28.8	Very low	35	Very low	60 Å²	60	127.2 Å²	127.2	62%	0.619	71%	0.714	S	S	*	*				106.3	97.1	110.4	0	0	0	0	0	119.7
241	H	32.2	Very low	33.9	Very low	175 Å²	175	133.5 Å²	133.5	81%	0.81	75%	0.748	S	S	*	*			trans	38.8	96	136.4	-55.8	-67.2	0	0	0	119.4
242	T	27.7	Very low	32.9	Very low	124 Å²	124	134.7 Å²	134.7	76%	0.761	76%	0.755	S	S	*	*				68.3	109	85.6	60.3	0	0	0	0	117.1
243	S	30.1	Very low	32.3	Very low	125 Å²	125	138.5 Å²	138.5	87%	0.874	77%	0.769	S	S	*	*			trans	-163.6	157	139.7	-84.1	0	0	0	0	111.7
244	P	35	Very low	32.2	Very low	129 Å²	129	137.5 Å²	137.5	84%	0.838	76%	0.762	S	S	*	*			trans	-123.4	-179.3	-156.6	42	-28.6	0	0	0	115.9
245	S	27.9	Very low	32.4	Very low	108 Å²	108	138.1 Å²	138.1	76%	0.755	76%	0.757	S	S	*	*			trans	-148.6	97.4	174.5	176.9	0	0	0	0	116
246	V	31.9	Very low	32.7	Very low	127 Å²	127	136.3 Å²	136.3	77%	0.77	75%	0.748	S	S	*	*			trans	63.3	148.7	137.7	-158.3	0	0	0	0	122.1
247	T	28.8	Very low	33	Very low	135 Å²	135	137 Å²	137	83%	0.828	75%	0.747	S	S	*	*			trans	90	143.8	167.8	71.1	0	0	0	0	118.4
248	A	33	Very low	33.8	Very low	88 Å²	88	131.8 Å²	131.8	73%	0.727	73%	0.731	S	S	*	*			cis	-172.8	156.5	-27.6	0	0	0	0	0	109.8
249	K	34.7	Very low	34.4	Very low	164 Å²	164	131.7 Å²	131.7	71%	0.713	73%	0.734	S	S	*	*			trans	171.1	128.8	145.1	-97	175.3	157.5	-67.8	0	115.6
250	E	34	Very low	35	Very low	135 Å²	135	127.6 Å²	127.6	63%	0.631	73%	0.732	S	S	*	*			trans	47.3	146.8	149.2	-68	117.7	-149.9	0	0	122
251	D	36.1	Very low	35.9	Very low	136 Å²	136	133.1 Å²	133.1	73%	0.727	75%	0.746	S	S	*	*			cis	-161.2	-158.8	-14.6	-81.9	-17.7	0	0	0	108.4
252	N	35.3	Very low	36.4	Very low	130 Å²	130	129.8 Å²	129.8	70%	0.695	74%	0.742	S	S	*	*			cis	-164.6	169.4	-1.5	-141.6	-61	0	0	0	112.7
253	E	34.6	Very low	36.8	Very low	129 Å²	129	133.2 Å²	133.2	60%	0.603	75%	0.747	S	S	*	*			trans	58.8	170.6	164.5	-79.9	-75.5	50.8	0	0	120	K255	E253-K255 WeakPolarHBondContact OE1-CE 3.14Å; E253-K255 IonicContact OE1-NZ 2.78Å; E253-K255 PolarHBondContact OE1-NZ 3.21Å; E253-K255 IonicContact OE2-NZ 2.8Å; E253-K255 PolarHBondContact OE2-NZ 3.49Å
254	S	37.5	Very low	37.8	Very low	99 Å²	99	133.2 Å²	133.2	69%	0.692	73%	0.734	S	S	*	*			cis	-167.4	177.8	-16	52.9	0	0	0	0	109.6
255	K	40.4	Very low	38.6	Very low	168 Å²	168	131.6 Å²	131.6	73%	0.73	72%	0.718	S	S	*	*			cis	-162.7	-174.1	-37.5	-93.8	161.1	-177.9	160.9	0	110.5	E253	E253-K255 WeakPolarHBondContact OE1-CE 3.14Å; E253-K255 IonicContact OE1-NZ 2.78Å; E253-K255 PolarHBondContact OE1-NZ 3.21Å; E253-K255 IonicContact OE2-NZ 2.8Å; E253-K255 PolarHBondContact OE2-NZ 3.49Å
256	E	37.9	Very low	39.7	Very low	147 Å²	147	134.5 Å²	134.5	69%	0.687	72%	0.717	S	S	*	*			trans	-130.3	-170	-165.8	-72.5	-136.6	112	0	0	115.7	K258	E256-K258 IonicContact OE1-NZ 2.81Å; E256-K258 PolarHBondContact OE1-NZ 3.47Å; E256-K258 IonicContact OE2-NZ 3.17Å; E256-K258 PolarHBondContact OE2-NZ 2.97Å
257	N	38	Very low	40.8	Very low	124 Å²	124	139.9 Å²	139.9	66%	0.663	72%	0.723	S	S	*	*			cis	-158.9	-140.8	27	-135.2	-46.4	0	0	0	119.7
258	K	43.4	Very low	42.3	Very low	146 Å²	146	142.1 Å²	142.1	64%	0.635	72%	0.717	S	S	*	*			trans	-146	174.6	-152.3	-62.1	165.2	-163.5	73.5	0	113.7	E256	E256-K258 IonicContact OE1-NZ 2.81Å; E256-K258 PolarHBondContact OE1-NZ 3.47Å; E256-K258 IonicContact OE2-NZ 3.17Å; E256-K258 PolarHBondContact OE2-NZ 2.97Å
259	S	46.4	Very low	43.4	Very low	106 Å²	106	141.9 Å²	141.9	74%	0.741	70%	0.7	S	S	*	*			cis	-176.9	-176.2	-28.6	66.3	0	0	0	0	112.6
260	S	42.3	Very low	44.4	Very low	124 Å²	124	140.3 Å²	140.3	87%	0.867	70%	0.7	S	S	*	*			trans	101.2	169.5	159.6	79.7	0	0	0	0	123.3
261	L	47.7	Very low	45.6	Very low	177 Å²	177	141.8 Å²	141.8	93%	0.927	70%	0.704	S	S	*	*			trans	-159.7	165.4	-148.2	-111.8	175.1	0	0	0	118.7
262	S	42.2	Very low	46.6	Very low	104 Å²	104	141.3 Å²	141.3	73%	0.727	69%	0.693	S	S	*	*			trans	142.9	144.4	134.4	-167.3	0	0	0	0	118.2
263	F	36.4	Very low	47.6	Very low	196 Å²	196	140.4 Å²	140.4	86%	0.86	68%	0.684	S	S	*	*				178.3	-91.6	118.4	-164.1	-117.2	0	0	0	119
264	E	50.3	Low	49	Very low	126 Å²	126	137 Å²	137	59%	0.589	68%	0.684	S	S	*	*			trans	-94.7	150.8	-152.4	152.8	66.6	178.9	0	0	117.9	K266	E264-K266 PolarHBondContact OE1-N 3.48Å; E264-K266 WeakPolarHBondContact OE2-CB 3.29Å; E264-K266 PolarHBondContact OE2-N 2.82Å
265	D	51.1	Low	50	Low	94 Å²	94	137.5 Å²	137.5	50%	0.503	68%	0.675	S	S	.	*			trans	-146.3	-16.5	-176.4	-116.3	-48.8	0	0	0	116.7	R267 R272	D265-R267 PolarHBondContact O-N 2.98Å; D265-R272 IonicContact OD1-NH1 3.71Å
266	K	52.5	Low	51	Low	170 Å²	170	131.4 Å²	131.4	74%	0.739	66%	0.657	S	S	*	*	G	3₁₀ helix	trans	-83.4	-13	-136.7	-149.3	152.1	-169.1	163.9	0	118.7	E264	E264-K266 PolarHBondContact OE1-N 3.48Å; E264-K266 WeakPolarHBondContact OE2-CB 3.29Å; E264-K266 PolarHBondContact OE2-N 2.82Å
267	R	55	Low	52.6	Low	240 Å²	240	128.4 Å²	128.4	91%	0.906	64%	0.642	S	S	*	*	G	3₁₀ helix	trans	-79.2	-23.8	177.7	-171.8	178.2	-69.9	-170.8	0.7	114	D265 E269	D265-R267 PolarHBondContact O-N 2.98Å; R267-E269 PolarHBondContact O-N 3.17Å
268	R	59	Low	53.6	Low	182 Å²	182	128.3 Å²	128.3	69%	0.687	64%	0.641	S	S	*	*	G	3₁₀ helix	trans	-65.1	-9.7	-177	-113.6	178.1	-67.2	-117.3	0.6	114	R272	R268-R272 WeakPolarHBondContact O-CB 3.2Å
269	E	57.3	Low	54.6	Low	82 Å²	82	124.8 Å²	124.8	38%	0.383	63%	0.63	S	S	.	*	H	α-helix	trans	-77.8	-36.6	-152.8	-160.9	62.1	-173.8	0	0	116.2	R267 R272 Q273	R267-E269 PolarHBondContact O-N 3.17Å; E269-R272 CarbonylContact O-C 3.52Å; E269-R272 WeakPolarHBondContact O-CA 3.42Å; E269-R272 WeakPolarHBondContact O-CB 3.36Å; E269-R272 PolarHBondContact O-N 3.46Å; E269-Q273 WeakPolarHBondContact O-CG 3.48Å; E269-Q273 PolarHBondContact O-N 3.04Å
270	N	54.5	Low	56.1	Low	132 Å²	132	125 Å²	125	71%	0.706	61%	0.614	S	S	*	*	H	α-helix	trans	-74.1	-40.5	-170.9	-90	-118.4	0	0	0	113.7	R272 Q273	N270-R272 VanDerWaalsContact C-N 3.29Å; N270-Q273 PolarHBondContact O-N 2.97Å
271	F	59	Low	57.4	Low	165 Å²	165	127.3 Å²	127.3	72%	0.724	60%	0.604	S	S	*	*	H	α-helix	trans	-70.1	-32.4	170.3	-172.7	-96.5	0	0	0	111	Q275	F271-Q275 VanDerWaalsContact CE1-OE1 3.28Å
272	R	58.2	Low	58.4	Low	127 Å²	127	125.3 Å²	125.3	48%	0.479	59%	0.587	S	S	.	*	H	α-helix	trans	-53.9	-52.3	168.5	-124.7	178.5	175.1	167.4	-2.2	110.6	D265 R268 E269 N270 G274 Q275 A276	D265-R272 IonicContact OD1-NH1 3.71Å; R268-R272 WeakPolarHBondContact O-CB 3.2Å; E269-R272 CarbonylContact O-C 3.52Å; E269-R272 WeakPolarHBondContact O-CA 3.42Å; E269-R272 WeakPolarHBondContact O-CB 3.36Å; E269-R272 PolarHBondContact O-N 3.46Å; N270-R272 VanDerWaalsContact C-N 3.29Å; R272-G274 VanDerWaalsContact C-N 3.3Å; R272-G274 PolarHBondContact O-N 3.32Å; R272-Q275 CarbonylContact O-C 3.55Å; R272-Q275 PolarHBondContact O-N 3.01Å; R272-A276 WeakPolarHBondContact O-CA 3.47Å; R272-A276 WeakPolarHBondContact O-CB 3.5Å; R272-A276 PolarHBondContact O-N 3.46Å
273	Q	56.7	Low	59.8	Low	110 Å²	110	126 Å²	126	51%	0.514	58%	0.579	S	S	.	*	H	α-helix	trans	-52.8	-40.7	-175.7	-81.5	176.1	-43.6	0	0	114	E269 N270 A276 E277	E269-Q273 WeakPolarHBondContact O-CG 3.48Å; E269-Q273 PolarHBondContact O-N 3.04Å; N270-Q273 PolarHBondContact O-N 2.97Å; Q273-A276 PolarHBondContact O-N 3.09Å; Q273-E277 PolarHBondContact O-N 2.95Å
274	G	63.9	Low	61.7	Low	59 Å²	59	120.7 Å²	120.7	61%	0.608	56%	0.557	S	S	*	*	H	α-helix	trans	-67.1	-39.7	177.2	0	0	0	0	0	113.9	R272	R272-G274 VanDerWaalsContact C-N 3.3Å; R272-G274 PolarHBondContact O-N 3.32Å
275	Q	58.3	Low	62.5	Low	108 Å²	108	120.7 Å²	120.7	51%	0.505	56%	0.56	S	S	.	*	H	α-helix	trans	-71.5	-38.1	170.9	-121.8	87.6	99.4	0	0	111.4	F271 R272 E277 L278 D279	F271-Q275 VanDerWaalsContact CE1-OE1 3.28Å; R272-Q275 CarbonylContact O-C 3.55Å; R272-Q275 PolarHBondContact O-N 3.01Å; Q275-E277 PolarHBondContact O-N 2.83Å; Q275-L278 WeakPolarHBondContact O-CB 3.46Å; Q275-L278 PolarHBondContact O-N 2.63Å; Q275-L278 VanDerWaalsContact O-N 3.12Å; Q275-D279 PolarHBondContact O-N 3.38Å
276	A	61.4	Low	63.5	Low	41 Å²	41	119 Å²	119	34%	0.339	56%	0.559	S	S	.	*	H	α-helix	trans	-75.7	-21.1	-170.2	0	0	0	0	0	113.2	R272 Q273 L278 R280	R272-A276 WeakPolarHBondContact O-CA 3.47Å; R272-A276 WeakPolarHBondContact O-CB 3.5Å; R272-A276 PolarHBondContact O-N 3.46Å; Q273-A276 PolarHBondContact O-N 3.09Å; A276-L278 VanDerWaalsContact C-N 3.31Å; A276-R280 VanDerWaalsContact O-CA 3.32Å; A276-R280 WeakPolarHBondContact O-CA 3.46Å; A276-R280 WeakPolarHBondContact O-CB 3.27Å; A276-R280 PolarHBondContact O-N 2.96Å
277	E	70.4	Confident	64.7	Low	83 Å²	83	117 Å²	117	39%	0.388	55%	0.553	S	S	.	*	H	α-helix	trans	-70.4	-32.1	167.7	-175.4	62.1	-168.5	0	0	111.4	Q273 Q275 R280 R281	Q273-E277 PolarHBondContact O-N 2.95Å; Q275-E277 PolarHBondContact O-N 2.83Å; E277-R280 IonicContact OE1-CZ 3.29Å; E277-R280 IonicContact OE1-NH1 3.19Å; E277-R280 PolarHBondContact OE1-NH1 3.4Å; E277-R280 IonicContact OE2-CZ 3.39Å; E277-R280 IonicContact OE2-NE 3.34Å; E277-R280 IonicContact OE2-NH1 3.11Å; E277-R280 PolarHBondContact OE2-NH1 2.84Å; E277-R281 PolarHBondContact O-N 2.87Å
278	L	60.1	Low	65.7	Low	122 Å²	122	111.6 Å²	111.6	64%	0.639	54%	0.536	S	S	*	.	H	α-helix	trans	-76.2	-43	176.3	-119.9	172.9	0	0	0	111.7	Q275 A276 R281	Q275-L278 WeakPolarHBondContact O-CB 3.46Å; Q275-L278 PolarHBondContact O-N 2.63Å; Q275-L278 VanDerWaalsContact O-N 3.12Å; A276-L278 VanDerWaalsContact C-N 3.31Å; L278-R281 PolarHBondContact O-N 2.85Å
279	D	64.2	Low	66.2	Low	73 Å²	73	109.8 Å²	109.8	39%	0.39	54%	0.537	S	S	.	.	H	α-helix	trans	-72.2	-29.5	172.1	-78.8	-24.4	0	0	0	112.2	Q275 R281 K282 Q283	Q275-D279 PolarHBondContact O-N 3.38Å; D279-R281 VanDerWaalsContact C-N 3.34Å; D279-R281 PolarHBondContact O-N 2.92Å; D279-K282 CarbonylContact O-C 3.54Å; D279-K282 WeakPolarHBondContact O-CA 3.35Å; D279-K282 WeakPolarHBondContact O-CB 3.45Å; D279-K282 PolarHBondContact O-N 2.66Å; D279-K282 VanDerWaalsContact O-N 3.07Å; D279-K282 IonicContact OD1-NZ 2.95Å; D279-K282 PolarHBondContact OD1-NZ 2.82Å; D279-Q283 WeakPolarHBondContact O-CB 3.4Å; D279-Q283 WeakPolarHBondContact O-CG 3.33Å; D279-Q283 PolarHBondContact O-N 3.05Å
280	R	76.7	Confident	67.3	Low	109 Å²	109	113.6 Å²	113.6	41%	0.411	55%	0.548	S	S	.	.	H	α-helix	trans	-58.5	-43.4	170.9	171	-180	154.7	-127	-17.4	110.9	A276 E277 K282 Q283 E284	A276-R280 VanDerWaalsContact O-CA 3.32Å; A276-R280 WeakPolarHBondContact O-CA 3.46Å; A276-R280 WeakPolarHBondContact O-CB 3.27Å; A276-R280 PolarHBondContact O-N 2.96Å; E277-R280 IonicContact OE1-CZ 3.29Å; E277-R280 IonicContact OE1-NH1 3.19Å; E277-R280 PolarHBondContact OE1-NH1 3.4Å; E277-R280 IonicContact OE2-CZ 3.39Å; E277-R280 IonicContact OE2-NE 3.34Å; E277-R280 IonicContact OE2-NH1 3.11Å; E277-R280 PolarHBondContact OE2-NH1 2.84Å; R280-K282 VanDerWaalsContact C-N 3.26Å; R280-K282 PolarHBondContact O-N 2.65Å; R280-Q283 CarbonylContact O-C 3.5Å; R280-Q283 PolarHBondContact O-N 3.4Å; R280-Q283 VanDerWaalsContact O-N 3.1Å; R280-E284 HydrophobicContact CG-CG 4.14Å; R280-E284 IonicContact CZ-OE1 3.01Å; R280-E284 IonicContact NE-OE1 3.3Å; R280-E284 PolarHBondContact NE-OE1 2.73Å; R280-E284 IonicContact NH2-OE1 2.69Å; R280-E284 PolarHBondContact NH2-OE1 2.95Å; R280-E284 WeakPolarHBondContact O-CB 3.38Å; R280-E284 WeakPolarHBondContact O-CG 3.19Å; R280-E284 PolarHBondContact O-N 2.98Å
281	R	71.2	Confident	68.2	Low	173 Å²	173	112.2 Å²	112.2	65%	0.653	54%	0.54	S	S	*	.	H	α-helix	trans	-66.5	-25.8	175.9	-77.5	-175.6	173.9	167.7	0.8	114	E277 L278 D279	E277-R281 PolarHBondContact O-N 2.87Å; L278-R281 PolarHBondContact O-N 2.85Å; D279-R281 VanDerWaalsContact C-N 3.34Å; D279-R281 PolarHBondContact O-N 2.92Å
282	K	68.3	Low	69	Low	135 Å²	135	108.9 Å²	108.9	59%	0.587	53%	0.53	S	S	*	.	H	α-helix	trans	-76.4	-39	168.1	-66.2	176.7	-172.8	158.4	0	111.6	D279 R280 L285 A286	D279-K282 CarbonylContact O-C 3.54Å; D279-K282 WeakPolarHBondContact O-CA 3.35Å; D279-K282 WeakPolarHBondContact O-CB 3.45Å; D279-K282 PolarHBondContact O-N 2.66Å; D279-K282 VanDerWaalsContact O-N 3.07Å; D279-K282 IonicContact OD1-NZ 2.95Å; D279-K282 PolarHBondContact OD1-NZ 2.82Å; R280-K282 VanDerWaalsContact C-N 3.26Å; R280-K282 PolarHBondContact O-N 2.65Å; K282-L285 PolarHBondContact O-N 3.02Å; K282-A286 WeakPolarHBondContact O-CB 3.33Å; K282-A286 PolarHBondContact O-N 3.01Å
283	Q	70.3	Confident	69.9	Low	120 Å²	120	106.3 Å²	106.3	56%	0.561	52%	0.523	S	S	*	.	H	α-helix	trans	-66.1	-44.4	177.3	-74.9	176.5	-26.5	0	0	111.3	D279 R280 L285 A286 E287	D279-Q283 WeakPolarHBondContact O-CB 3.4Å; D279-Q283 WeakPolarHBondContact O-CG 3.33Å; D279-Q283 PolarHBondContact O-N 3.05Å; R280-Q283 CarbonylContact O-C 3.5Å; R280-Q283 PolarHBondContact O-N 3.4Å; R280-Q283 VanDerWaalsContact O-N 3.1Å; Q283-L285 PolarHBondContact O-N 3.24Å; Q283-A286 CarbonylContact O-C 3.53Å; Q283-A286 PolarHBondContact O-N 2.91Å; Q283-E287 WeakPolarHBondContact O-CA 3.45Å; Q283-E287 VanDerWaalsContact O-CB 3.24Å; Q283-E287 WeakPolarHBondContact O-CB 3.23Å; Q283-E287 WeakPolarHBondContact O-CG 3.3Å; Q283-E287 PolarHBondContact O-N 3.32Å
284	E	76.4	Confident	71	Confident	84 Å²	84	105.9 Å²	105.9	39%	0.393	52%	0.521	S	S	.	.	H	α-helix	trans	-56.3	-36.9	175.3	-75.1	173.3	168.4	0	0	111.8	R280 K288	R280-E284 HydrophobicContact CG-CG 4.14Å; R280-E284 IonicContact CZ-OE1 3.01Å; R280-E284 IonicContact NE-OE1 3.3Å; R280-E284 PolarHBondContact NE-OE1 2.73Å; R280-E284 IonicContact NH2-OE1 2.69Å; R280-E284 PolarHBondContact NH2-OE1 2.95Å; R280-E284 WeakPolarHBondContact O-CB 3.38Å; R280-E284 WeakPolarHBondContact O-CG 3.19Å; R280-E284 PolarHBondContact O-N 2.98Å; E284-K288 WeakPolarHBondContact O-CB 3.46Å; E284-K288 PolarHBondContact O-N 3.42Å
285	L	67.8	Low	71.8	Confident	125 Å²	125	107.1 Å²	107.1	65%	0.654	51%	0.513	S	S	*	.	H	α-helix	trans	-73.1	-41.5	175.5	-159	76.7	0	0	0	112.3	K282 Q283 K288 M289	K282-L285 PolarHBondContact O-N 3.02Å; Q283-L285 PolarHBondContact O-N 3.24Å; L285-K288 PolarHBondContact O-N 3.28Å; L285-M289 PolarHBondContact O-N 3.41Å; L285-M289 VanDerWaalsContact O-N 3.15Å
286	A	72.4	Confident	72.9	Confident	58 Å²	58	109.6 Å²	109.6	48%	0.479	52%	0.518	S	S	.	.	H	α-helix	trans	-72.8	-35.4	178.1	0	0	0	0	0	113.1	K282 Q283 M289 R290	K282-A286 WeakPolarHBondContact O-CB 3.33Å; K282-A286 PolarHBondContact O-N 3.01Å; Q283-A286 CarbonylContact O-C 3.53Å; Q283-A286 PolarHBondContact O-N 2.91Å; A286-M289 PolarHBondContact O-N 3.5Å; A286-R290 PolarHBondContact O-N 2.93Å
287	E	77.3	Confident	73.9	Confident	128 Å²	128	112 Å²	112	60%	0.598	52%	0.524	S	S	*	.	H	α-helix	trans	-66.2	-41.8	171.3	-79.2	-163.7	132	0	0	110.1	Q283 M289 R290 L291	Q283-E287 WeakPolarHBondContact O-CA 3.45Å; Q283-E287 VanDerWaalsContact O-CB 3.24Å; Q283-E287 WeakPolarHBondContact O-CB 3.23Å; Q283-E287 WeakPolarHBondContact O-CG 3.3Å; Q283-E287 PolarHBondContact O-N 3.32Å; E287-M289 PolarHBondContact O-N 3.44Å; E287-R290 CarbonylContact O-C 3.57Å; E287-R290 PolarHBondContact O-N 2.77Å; E287-L291 VanDerWaalsContact O-CB 3.24Å; E287-L291 WeakPolarHBondContact O-CB 3.46Å; E287-L291 PolarHBondContact O-N 3.45Å
288	K	75.4	Confident	74.2	Confident	128 Å²	128	112.5 Å²	112.5	56%	0.557	53%	0.527	S	S	*	.	H	α-helix	trans	-59.5	-46.7	173.2	-172.5	178.4	178.2	-175.8	0	111.5	E284 L285 R290 L291 D292	E284-K288 WeakPolarHBondContact O-CB 3.46Å; E284-K288 PolarHBondContact O-N 3.42Å; L285-K288 PolarHBondContact O-N 3.28Å; K288-R290 VanDerWaalsContact C-N 3.31Å; K288-R290 PolarHBondContact O-N 3.43Å; K288-L291 PolarHBondContact O-N 3.11Å; K288-D292 PolarHBondContact O-N 3.07Å
289	M	70.6	Confident	75.1	Confident	143 Å²	143	111.6 Å²	111.6	70%	0.704	52%	0.522	S	S	*	.	H	α-helix	trans	-62.3	-36.9	175.2	-72.1	-167	70.7	0	0	112.8	L285 A286 E287 E293	L285-M289 PolarHBondContact O-N 3.41Å; L285-M289 VanDerWaalsContact O-N 3.15Å; A286-M289 PolarHBondContact O-N 3.5Å; E287-M289 PolarHBondContact O-N 3.44Å; M289-E293 PolarHBondContact O-N 2.65Å
290	R	79.5	Confident	75.9	Confident	162 Å²	162	112.8 Å²	112.8	61%	0.611	53%	0.526	S	S	*	.	H	α-helix	trans	-66	-42.4	172.1	-99.5	-161.2	65	-162.6	-3.7	112.4	A286 E287 K288 E293 E294	A286-R290 PolarHBondContact O-N 2.93Å; E287-R290 CarbonylContact O-C 3.57Å; E287-R290 PolarHBondContact O-N 2.77Å; K288-R290 VanDerWaalsContact C-N 3.31Å; K288-R290 PolarHBondContact O-N 3.43Å; R290-E293 PolarHBondContact O-N 3.28Å; R290-E294 IonicContact CZ-OE2 3.99Å; R290-E294 IonicContact NE-OE2 3.93Å; R290-E294 IonicContact NH2-OE2 2.7Å; R290-E294 PolarHBondContact NH2-OE2 3.42Å; R290-E294 VanDerWaalsContact O-CB 3.3Å; R290-E294 WeakPolarHBondContact O-CB 3.47Å; R290-E294 PolarHBondContact O-N 2.89Å
291	L	75.1	Confident	76.3	Confident	104 Å²	104	114.8 Å²	114.8	55%	0.545	53%	0.533	S	S	.	.	H	α-helix	trans	-67.7	-41	-176	-169.1	71.7	0	0	0	110.8	E287 K288 E293 E294 I295	E287-L291 VanDerWaalsContact O-CB 3.24Å; E287-L291 WeakPolarHBondContact O-CB 3.46Å; E287-L291 PolarHBondContact O-N 3.45Å; K288-L291 PolarHBondContact O-N 3.11Å; L291-E293 VanDerWaalsContact C-N 3.3Å; L291-E293 PolarHBondContact O-N 2.91Å; L291-E294 PolarHBondContact O-N 3.06Å; L291-I295 HydrophobicContact CG-CD1 4.02Å; L291-I295 VanDerWaalsContact O-CB 3.3Å; L291-I295 WeakPolarHBondContact O-CB 3.37Å; L291-I295 WeakPolarHBondContact O-CD1 3.27Å; L291-I295 WeakPolarHBondContact O-CG1 3.43Å; L291-I295 PolarHBondContact O-N 2.76Å
292	D	74.8	Confident	76.7	Confident	95 Å²	95	111.2 Å²	111.2	51%	0.508	53%	0.526	S	S	.	.	H	α-helix	trans	-62.3	-36.8	173.9	-70.5	-26	0	0	0	111.4	K288 R296	K288-D292 PolarHBondContact O-N 3.07Å; D292-R296 PolarHBondContact O-N 2.88Å; D292-R296 VanDerWaalsContact O-N 3.12Å
293	E	77.6	Confident	77.3	Confident	72 Å²	72	108.5 Å²	108.5	34%	0.336	52%	0.516	S	S	.	.	H	α-helix	trans	-74.8	-39.5	174.5	-174.8	61.1	-129.9	0	0	112.9	M289 R290 L291 R296 L297	M289-E293 PolarHBondContact O-N 2.65Å; R290-E293 PolarHBondContact O-N 3.28Å; L291-E293 VanDerWaalsContact C-N 3.3Å; L291-E293 PolarHBondContact O-N 2.91Å; E293-R296 WeakPolarHBondContact O-CB 3.22Å; E293-R296 PolarHBondContact O-N 3.03Å; E293-R296 VanDerWaalsContact O-N 3.12Å; E293-R296 IonicContact OE1-CZ 2.67Å; E293-R296 IonicContact OE1-NE 2.65Å; E293-R296 PolarHBondContact OE1-NE 3.48Å; E293-R296 IonicContact OE1-NH2 2.69Å; E293-R296 PolarHBondContact OE1-NH2 3.48Å; E293-R296 IonicContact OE2-CZ 3.36Å; E293-R296 VanDerWaalsContact OE2-CZ 3.29Å; E293-R296 IonicContact OE2-NE 3.32Å; E293-R296 PolarHBondContact OE2-NE 2.83Å; E293-R296 IonicContact OE2-NH2 3.25Å; E293-R296 PolarHBondContact OE2-NH2 2.85Å; E293-L297 HydrophobicContact CG-CD1 4.25Å; E293-L297 WeakPolarHBondContact O-CG 3.34Å; E293-L297 PolarHBondContact O-N 3.38Å
294	E	80.3	Confident	77.9	Confident	101 Å²	101	109 Å²	109	47%	0.472	51%	0.513	S	S	.	.	H	α-helix	trans	-65.3	-40.5	177.3	-160	114.1	-146.4	0	0	110.6	R290 L291 R296 L297 E298	R290-E294 IonicContact CZ-OE2 3.99Å; R290-E294 IonicContact NE-OE2 3.93Å; R290-E294 IonicContact NH2-OE2 2.7Å; R290-E294 PolarHBondContact NH2-OE2 3.42Å; R290-E294 VanDerWaalsContact O-CB 3.3Å; R290-E294 WeakPolarHBondContact O-CB 3.47Å; R290-E294 PolarHBondContact O-N 2.89Å; L291-E294 PolarHBondContact O-N 3.06Å; E294-R296 VanDerWaalsContact C-N 3.33Å; E294-L297 PolarHBondContact O-N 2.83Å; E294-E298 WeakPolarHBondContact O-CB 3.4Å; E294-E298 PolarHBondContact O-N 2.86Å
295	I	80.2	Confident	78.2	Confident	85 Å²	85	110.4 Å²	110.4	44%	0.436	52%	0.519	S	S	.	.	H	α-helix	trans	-62.9	-38.8	170.4	-71.2	167.5	0	0	0	110.9	L291 N299	L291-I295 HydrophobicContact CG-CD1 4.02Å; L291-I295 VanDerWaalsContact O-CB 3.3Å; L291-I295 WeakPolarHBondContact O-CB 3.37Å; L291-I295 WeakPolarHBondContact O-CD1 3.27Å; L291-I295 WeakPolarHBondContact O-CG1 3.43Å; L291-I295 PolarHBondContact O-N 2.76Å; I295-N299 WeakPolarHBondContact CG2-ND2 3.43Å; I295-N299 WeakPolarHBondContact O-CB 3.37Å; I295-N299 PolarHBondContact O-N 3.34Å; I295-N299 VanDerWaalsContact O-N 3.1Å; I295-N299 PolarHBondContact O-ND2 2.74Å
296	R	81.3	Confident	79	Confident	161 Å²	161	109.8 Å²	109.8	61%	0.608	51%	0.511	S	S	*	.	H	α-helix	trans	-63	-46.2	175.9	-170.6	176.5	76.2	148.6	1.6	111.5	D292 E293 E294 E300	D292-R296 PolarHBondContact O-N 2.88Å; D292-R296 VanDerWaalsContact O-N 3.12Å; E293-R296 WeakPolarHBondContact O-CB 3.22Å; E293-R296 PolarHBondContact O-N 3.03Å; E293-R296 VanDerWaalsContact O-N 3.12Å; E293-R296 IonicContact OE1-CZ 2.67Å; E293-R296 IonicContact OE1-NE 2.65Å; E293-R296 PolarHBondContact OE1-NE 3.48Å; E293-R296 IonicContact OE1-NH2 2.69Å; E293-R296 PolarHBondContact OE1-NH2 3.48Å; E293-R296 IonicContact OE2-CZ 3.36Å; E293-R296 VanDerWaalsContact OE2-CZ 3.29Å; E293-R296 IonicContact OE2-NE 3.32Å; E293-R296 PolarHBondContact OE2-NE 2.83Å; E293-R296 IonicContact OE2-NH2 3.25Å; E293-R296 PolarHBondContact OE2-NH2 2.85Å; E294-R296 VanDerWaalsContact C-N 3.33Å; R296-E300 WeakPolarHBondContact O-CB 3.47Å; R296-E300 PolarHBondContact O-N 2.65Å; R296-E300 VanDerWaalsContact O-N 3.08Å
297	L	82.1	Confident	79.4	Confident	90 Å²	90	112.9 Å²	112.9	47%	0.471	52%	0.516	S	S	.	.	H	α-helix	trans	-68.5	-41.7	-179.3	-70.2	168.3	0	0	0	112.7	E293 E294 E300 R301	E293-L297 HydrophobicContact CG-CD1 4.25Å; E293-L297 WeakPolarHBondContact O-CG 3.34Å; E293-L297 PolarHBondContact O-N 3.38Å; E294-L297 PolarHBondContact O-N 2.83Å; L297-E300 PolarHBondContact O-N 3.21Å; L297-R301 WeakPolarHBondContact O-CB 3.4Å; L297-R301 PolarHBondContact O-N 3.45Å
298	E	77.7	Confident	79.6	Confident	95 Å²	95	113.6 Å²	113.6	44%	0.444	52%	0.519	S	S	.	.	H	α-helix	trans	-70.2	-35.9	179	-169.2	62.8	-165.6	0	0	111.6	E294 R301 L302	E294-E298 WeakPolarHBondContact O-CB 3.4Å; E294-E298 PolarHBondContact O-N 2.86Å; E298-R301 WeakPolarHBondContact O-CB 3.43Å; E298-R301 PolarHBondContact O-N 2.8Å; E298-R301 IonicContact OE1-NH1 3.66Å; E298-R301 WeakPolarHBondContact OE2-CD 3.15Å; E298-R301 IonicContact OE2-NH1 2.62Å; E298-R301 PolarHBondContact OE2-NH1 3.25Å; E298-R301 VanDerWaalsContact OE2-NH1 3.1Å; E298-L302 WeakPolarHBondContact O-CB 3.32Å; E298-L302 PolarHBondContact O-N 3.17Å
299	N	78.9	Confident	80	Confident	102 Å²	102	114.4 Å²	114.4	55%	0.545	52%	0.522	S	S	.	.	H	α-helix	trans	-61.8	-42.6	169.5	-81.2	-61.2	0	0	0	112.1	I295 R301 L302 E303	I295-N299 WeakPolarHBondContact CG2-ND2 3.43Å; I295-N299 WeakPolarHBondContact O-CB 3.37Å; I295-N299 PolarHBondContact O-N 3.34Å; I295-N299 VanDerWaalsContact O-N 3.1Å; I295-N299 PolarHBondContact O-ND2 2.74Å; N299-R301 VanDerWaalsContact C-N 3.29Å; N299-R301 PolarHBondContact O-N 3.04Å; N299-L302 PolarHBondContact O-N 3.11Å; N299-E303 PolarHBondContact O-N 3.02Å
300	E	81	Confident	80.6	Confident	99 Å²	99	113.9 Å²	113.9	46%	0.463	52%	0.522	S	S	.	.	H	α-helix	trans	-67.2	-29.9	177	-157.4	-150.2	-172.3	0	0	112.2	R296 L297 R304	R296-E300 WeakPolarHBondContact O-CB 3.47Å; R296-E300 PolarHBondContact O-N 2.65Å; R296-E300 VanDerWaalsContact O-N 3.08Å; L297-E300 PolarHBondContact O-N 3.21Å; E300-R304 VanDerWaalsContact C-NH1 3.31Å; E300-R304 VanDerWaalsContact O-CG 3.32Å; E300-R304 WeakPolarHBondContact O-CG 3.3Å; E300-R304 PolarHBondContact O-N 2.95Å; E300-R304 PolarHBondContact O-NH1 2.63Å; E300-R304 IonicContact OE1-CZ 2.62Å; E300-R304 IonicContact OE1-NH1 2.99Å; E300-R304 IonicContact OE1-NH2 3.12Å; E300-R304 PolarHBondContact OE1-NH2 3.2Å; E300-R304 IonicContact OE2-CZ 2.65Å; E300-R304 IonicContact OE2-NH1 3.95Å; E300-R304 PolarHBondContact OE2-NH1 2.77Å; E300-R304 IonicContact OE2-NH2 2.66Å; E300-R304 PolarHBondContact OE2-NH2 2.85Å
301	R	84.4	Confident	81	Confident	150 Å²	150	115.2 Å²	115.2	57%	0.566	53%	0.527	S	S	*	.	H	α-helix	trans	-69.9	-47.4	172.5	-173.5	-170.6	-173.5	-176.9	1.3	111.5	L297 E298 N299 E303 R304 E305	L297-R301 WeakPolarHBondContact O-CB 3.4Å; L297-R301 PolarHBondContact O-N 3.45Å; E298-R301 WeakPolarHBondContact O-CB 3.43Å; E298-R301 PolarHBondContact O-N 2.8Å; E298-R301 IonicContact OE1-NH1 3.66Å; E298-R301 WeakPolarHBondContact OE2-CD 3.15Å; E298-R301 IonicContact OE2-NH1 2.62Å; E298-R301 PolarHBondContact OE2-NH1 3.25Å; E298-R301 VanDerWaalsContact OE2-NH1 3.1Å; N299-R301 VanDerWaalsContact C-N 3.29Å; N299-R301 PolarHBondContact O-N 3.04Å; R301-E303 VanDerWaalsContact C-N 3.34Å; R301-E303 PolarHBondContact O-N 3.08Å; R301-R304 WeakPolarHBondContact O-CB 3.3Å; R301-R304 PolarHBondContact O-N 3.33Å; R301-E305 PolarHBondContact O-N 2.73Å
302	L	80.4	Confident	81.2	Confident	98 Å²	98	116.7 Å²	116.7	51%	0.513	53%	0.533	S	S	.	.	H	α-helix	trans	-64.4	-38.8	-178.7	-156.7	161.1	0	0	0	111	E298 N299 E305 K306	E298-L302 WeakPolarHBondContact O-CB 3.32Å; E298-L302 PolarHBondContact O-N 3.17Å; N299-L302 PolarHBondContact O-N 3.11Å; L302-E305 PolarHBondContact O-N 3.41Å; L302-K306 VanDerWaalsContact O-CB 3.22Å; L302-K306 WeakPolarHBondContact O-CB 3.49Å; L302-K306 PolarHBondContact O-N 2.88Å
303	E	80.4	Confident	81.7	Confident	79 Å²	79	115.9 Å²	115.9	37%	0.369	53%	0.526	S	S	.	.	H	α-helix	trans	-69.2	-35.1	175.1	-163.8	59.2	-142.8	0	0	112.5	N299 R301 K306 Q307	N299-E303 PolarHBondContact O-N 3.02Å; R301-E303 VanDerWaalsContact C-N 3.34Å; R301-E303 PolarHBondContact O-N 3.08Å; E303-K306 PolarHBondContact O-N 3.01Å; E303-K306 IonicContact OE1-NZ 2.77Å; E303-K306 PolarHBondContact OE1-NZ 3.04Å; E303-K306 IonicContact OE2-NZ 3.39Å; E303-K306 PolarHBondContact OE2-NZ 2.93Å; E303-Q307 VanDerWaalsContact O-CG 3.32Å; E303-Q307 WeakPolarHBondContact O-CG 3.33Å; E303-Q307 PolarHBondContact O-N 3.39Å
304	R	81.9	Confident	82.2	Confident	130 Å²	130	118.8 Å²	118.8	49%	0.491	54%	0.538	S	S	.	.	H	α-helix	trans	-63.4	-45.2	170.5	-75.5	-179.9	-167.1	99.5	-14.3	112.2	E300 R301 K306 Q307 Q308	E300-R304 VanDerWaalsContact C-NH1 3.31Å; E300-R304 VanDerWaalsContact O-CG 3.32Å; E300-R304 WeakPolarHBondContact O-CG 3.3Å; E300-R304 PolarHBondContact O-N 2.95Å; E300-R304 PolarHBondContact O-NH1 2.63Å; E300-R304 IonicContact OE1-CZ 2.62Å; E300-R304 IonicContact OE1-NH1 2.99Å; E300-R304 IonicContact OE1-NH2 3.12Å; E300-R304 PolarHBondContact OE1-NH2 3.2Å; E300-R304 IonicContact OE2-CZ 2.65Å; E300-R304 IonicContact OE2-NH1 3.95Å; E300-R304 PolarHBondContact OE2-NH1 2.77Å; E300-R304 IonicContact OE2-NH2 2.66Å; E300-R304 PolarHBondContact OE2-NH2 2.85Å; R301-R304 WeakPolarHBondContact O-CB 3.3Å; R301-R304 PolarHBondContact O-N 3.33Å; R304-K306 VanDerWaalsContact C-N 3.33Å; R304-Q307 PolarHBondContact O-N 2.91Å; R304-Q308 PolarHBondContact O-N 3.41Å
305	E	83.2	Confident	82.5	Confident	114 Å²	114	119.7 Å²	119.7	53%	0.533	54%	0.542	S	S	.	.	H	α-helix	trans	-62.7	-43.1	178.1	-169.4	-175.1	150.2	0	0	110.8	R301 L302 Q307 Q308 K309	R301-E305 PolarHBondContact O-N 2.73Å; L302-E305 PolarHBondContact O-N 3.41Å; E305-Q307 VanDerWaalsContact C-N 3.35Å; E305-Q307 PolarHBondContact O-N 3.46Å; E305-Q308 PolarHBondContact O-N 3.34Å; E305-K309 WeakPolarHBondContact O-CB 3.49Å; E305-K309 PolarHBondContact O-N 3.39Å
306	K	84.8	Confident	83	Confident	112 Å²	112	123.4 Å²	123.4	49%	0.487	55%	0.55	S	S	.	*	H	α-helix	trans	-59.2	-40.8	173.6	175.7	162.7	158.6	-96.3	0	112.3	L302 E303 R304 K309 L310	L302-K306 VanDerWaalsContact O-CB 3.22Å; L302-K306 WeakPolarHBondContact O-CB 3.49Å; L302-K306 PolarHBondContact O-N 2.88Å; E303-K306 PolarHBondContact O-N 3.01Å; E303-K306 IonicContact OE1-NZ 2.77Å; E303-K306 PolarHBondContact OE1-NZ 3.04Å; E303-K306 IonicContact OE2-NZ 3.39Å; E303-K306 PolarHBondContact OE2-NZ 2.93Å; R304-K306 VanDerWaalsContact C-N 3.33Å; K306-K309 PolarHBondContact O-N 2.63Å; K306-L310 WeakPolarHBondContact O-CB 3.45Å; K306-L310 PolarHBondContact O-N 2.67Å
307	Q	80.7	Confident	83.3	Confident	123 Å²	123	121 Å²	121	58%	0.575	55%	0.546	S	S	*	.	H	α-helix	trans	-67.4	-42.1	173.2	-73.4	177.5	25.5	0	0	113	E303 R304 E305 K309 L310 R311	E303-Q307 VanDerWaalsContact O-CG 3.32Å; E303-Q307 WeakPolarHBondContact O-CG 3.33Å; E303-Q307 PolarHBondContact O-N 3.39Å; R304-Q307 PolarHBondContact O-N 2.91Å; E305-Q307 VanDerWaalsContact C-N 3.35Å; E305-Q307 PolarHBondContact O-N 3.46Å; Q307-K309 VanDerWaalsContact C-N 3.35Å; Q307-K309 PolarHBondContact O-N 2.97Å; Q307-L310 PolarHBondContact O-N 3.28Å; Q307-R311 WeakPolarHBondContact O-CB 3.46Å; Q307-R311 PolarHBondContact O-N 2.82Å
308	Q	81.1	Confident	83.6	Confident	142 Å²	142	122.5 Å²	122.5	66%	0.664	55%	0.55	S	S	*	*	H	α-helix	trans	-60	-44.6	173	-88.6	-173.7	-26.6	0	0	111.8	R304 E305 R311 M312	R304-Q308 PolarHBondContact O-N 3.41Å; E305-Q308 PolarHBondContact O-N 3.34Å; Q308-R311 PolarHBondContact O-N 2.93Å; Q308-M312 PolarHBondContact O-N 2.93Å
309	K	83.7	Confident	84.2	Confident	145 Å²	145	120.8 Å²	120.8	63%	0.63	55%	0.552	S	S	*	*	H	α-helix	trans	-65.7	-41.1	-179.9	-162	168	-170.8	167.3	0	112.1	E305 K306 Q307 R311 M312 E313	E305-K309 WeakPolarHBondContact O-CB 3.49Å; E305-K309 PolarHBondContact O-N 3.39Å; K306-K309 PolarHBondContact O-N 2.63Å; Q307-K309 VanDerWaalsContact C-N 3.35Å; Q307-K309 PolarHBondContact O-N 2.97Å; K309-R311 VanDerWaalsContact C-N 3.33Å; K309-M312 PolarHBondContact O-N 3.02Å; K309-E313 WeakPolarHBondContact O-CB 3.5Å; K309-E313 PolarHBondContact O-N 2.95Å
310	L	83.2	Confident	84.7	Confident	133 Å²	133	117.9 Å²	117.9	70%	0.696	54%	0.543	S	S	*	.	H	α-helix	trans	-63.1	-39	173.1	-164.3	80.9	0	0	0	111.8	K306 Q307 K314	K306-L310 WeakPolarHBondContact O-CB 3.45Å; K306-L310 PolarHBondContact O-N 2.67Å; Q307-L310 PolarHBondContact O-N 3.28Å; L310-K314 WeakPolarHBondContact O-CB 3.29Å; L310-K314 PolarHBondContact O-N 2.86Å; L310-K314 VanDerWaalsContact O-N 3.07Å
311	R	87.7	Confident	85.1	Confident	189 Å²	189	119.3 Å²	119.3	71%	0.713	55%	0.549	S	S	*	.	H	α-helix	trans	-65.8	-48.4	176.9	-172.6	175.5	179.4	169.4	0.8	111.7	Q307 Q308 K309 E313 K314 E315	Q307-R311 WeakPolarHBondContact O-CB 3.46Å; Q307-R311 PolarHBondContact O-N 2.82Å; Q308-R311 PolarHBondContact O-N 2.93Å; K309-R311 VanDerWaalsContact C-N 3.33Å; R311-E313 PolarHBondContact O-N 3.07Å; R311-K314 PolarHBondContact O-N 2.91Å; R311-E315 WeakPolarHBondContact O-CB 3.47Å; R311-E315 PolarHBondContact O-N 3.07Å
312	M	79.3	Confident	85.4	Confident	136 Å²	136	114.9 Å²	114.9	67%	0.67	55%	0.545	S	S	*	.	H	α-helix	trans	-61	-42.2	175.9	-82.8	-143.8	-60.6	0	0	112.7	Q308 K309 K314 E315 R316	Q308-M312 PolarHBondContact O-N 2.93Å; K309-M312 PolarHBondContact O-N 3.02Å; M312-K314 VanDerWaalsContact C-N 3.34Å; M312-K314 PolarHBondContact O-N 2.75Å; M312-E315 PolarHBondContact O-N 2.82Å; M312-R316 VanDerWaalsContact O-CB 3.24Å; M312-R316 WeakPolarHBondContact O-CB 3Å; M312-R316 PolarHBondContact O-N 3.47Å
313	E	85.5	Confident	85.8	Confident	77 Å²	77	117 Å²	117	36%	0.36	55%	0.552	S	S	.	*	H	α-helix	trans	-68.4	-34.5	180	-172.3	59	-153.9	0	0	111.7	K309 R311 R316 Q317	K309-E313 WeakPolarHBondContact O-CB 3.5Å; K309-E313 PolarHBondContact O-N 2.95Å; R311-E313 PolarHBondContact O-N 3.07Å; E313-R316 IonicContact OE1-NH1 2.72Å; E313-R316 PolarHBondContact OE1-NH1 3.32Å; E313-R316 WeakPolarHBondContact OE2-CD 3.37Å; E313-R316 IonicContact OE2-CZ 2.72Å; E313-R316 IonicContact OE2-NH1 3.23Å; E313-R316 PolarHBondContact OE2-NH1 2.89Å; E313-Q317 VanDerWaalsContact O-CG 3.29Å; E313-Q317 WeakPolarHBondContact O-CG 3.25Å; E313-Q317 PolarHBondContact O-N 2.9Å
314	K	88.8	Confident	86.4	Confident	134 Å²	134	120.8 Å²	120.8	58%	0.583	57%	0.567	S	S	*	*	H	α-helix	trans	-66.6	-42	172	-173.6	174.9	-178.2	177.6	0	112.5	L310 R311 M312 Q317 Q318	L310-K314 WeakPolarHBondContact O-CB 3.29Å; L310-K314 PolarHBondContact O-N 2.86Å; L310-K314 VanDerWaalsContact O-N 3.07Å; R311-K314 PolarHBondContact O-N 2.91Å; M312-K314 VanDerWaalsContact C-N 3.34Å; M312-K314 PolarHBondContact O-N 2.75Å; K314-Q317 PolarHBondContact O-N 2.92Å; K314-Q318 WeakPolarHBondContact O-CG 3.45Å; K314-Q318 PolarHBondContact O-N 2.96Å
315	E	86.3	Confident	86.6	Confident	120 Å²	120	121.6 Å²	121.6	56%	0.561	58%	0.577	S	S	*	*	H	α-helix	trans	-64.4	-41.2	176.6	-173	165.7	-174.6	0	0	111.3	R311 M312 Q318 A319	R311-E315 WeakPolarHBondContact O-CB 3.47Å; R311-E315 PolarHBondContact O-N 3.07Å; M312-E315 PolarHBondContact O-N 2.82Å; E315-Q318 PolarHBondContact O-N 3.31Å; E315-A319 WeakPolarHBondContact O-CB 3.27Å; E315-A319 PolarHBondContact O-N 3.17Å
316	R	90	Very high	87	Confident	163 Å²	163	118.7 Å²	118.7	62%	0.615	57%	0.572	S	S	*	*	H	α-helix	trans	-62.6	-39.5	172.8	-178	-177.1	175.8	-138.5	-0.2	113	M312 E313 A319 A320	M312-R316 VanDerWaalsContact O-CB 3.24Å; M312-R316 WeakPolarHBondContact O-CB 3Å; M312-R316 PolarHBondContact O-N 3.47Å; E313-R316 IonicContact OE1-NH1 2.72Å; E313-R316 PolarHBondContact OE1-NH1 3.32Å; E313-R316 WeakPolarHBondContact OE2-CD 3.37Å; E313-R316 IonicContact OE2-CZ 2.72Å; E313-R316 IonicContact OE2-NH1 3.23Å; E313-R316 PolarHBondContact OE2-NH1 2.89Å; R316-A319 PolarHBondContact O-N 2.83Å; R316-A320 WeakPolarHBondContact O-CB 3.43Å; R316-A320 PolarHBondContact O-N 3.17Å
317	Q	88.1	Confident	87.2	Confident	110 Å²	110	116.2 Å²	116.2	51%	0.514	56%	0.563	S	S	.	*	H	α-helix	trans	-65.8	-44.3	174.5	-75.2	171.6	16	0	0	111.5	E313 K314 A319 A320 E321	E313-Q317 VanDerWaalsContact O-CG 3.29Å; E313-Q317 WeakPolarHBondContact O-CG 3.25Å; E313-Q317 PolarHBondContact O-N 2.9Å; K314-Q317 PolarHBondContact O-N 2.92Å; Q317-A319 VanDerWaalsContact C-N 3.33Å; Q317-A319 PolarHBondContact O-N 2.92Å; Q317-A320 PolarHBondContact O-N 2.78Å; Q317-E321 PolarHBondContact O-N 2.76Å
318	Q	87.9	Confident	87.8	Confident	121 Å²	121	116.2 Å²	116.2	57%	0.565	57%	0.566	S	S	*	*	H	α-helix	trans	-62.6	-39	175.2	-71.3	-177.4	-30.4	0	0	112.2	K314 E315 E321 A322	K314-Q318 WeakPolarHBondContact O-CG 3.45Å; K314-Q318 PolarHBondContact O-N 2.96Å; E315-Q318 PolarHBondContact O-N 3.31Å; Q318-E321 PolarHBondContact O-N 2.9Å; Q318-A322 WeakPolarHBondContact O-CB 3.48Å; Q318-A322 PolarHBondContact O-N 3.35Å
319	A	90.2	Very high	88.1	Confident	59 Å²	59	113 Å²	113	49%	0.488	56%	0.559	S	S	.	*	H	α-helix	trans	-62.3	-45	172.9	0	0	0	0	0	112.3	E315 R316 Q317 E321 A322 E323	E315-A319 WeakPolarHBondContact O-CB 3.27Å; E315-A319 PolarHBondContact O-N 3.17Å; R316-A319 PolarHBondContact O-N 2.83Å; Q317-A319 VanDerWaalsContact C-N 3.33Å; Q317-A319 PolarHBondContact O-N 2.92Å; A319-E321 PolarHBondContact O-N 3.27Å; A319-A322 PolarHBondContact O-N 2.74Å; A319-E323 WeakPolarHBondContact O-CB 3.35Å; A319-E323 PolarHBondContact O-N 3.27Å
320	A	91.2	Very high	88.5	Confident	42 Å²	42	113.2 Å²	113.2	35%	0.347	56%	0.556	S	S	.	*	H	α-helix	trans	-68.6	-31	179.3	0	0	0	0	0	113.6	R316 Q317 K324	R316-A320 WeakPolarHBondContact O-CB 3.43Å; R316-A320 PolarHBondContact O-N 3.17Å; Q317-A320 PolarHBondContact O-N 2.78Å; A320-K324 WeakPolarHBondContact O-CG 3.35Å; A320-K324 PolarHBondContact O-N 3.02Å
321	E	88.7	Confident	88.8	Confident	128 Å²	128	112.1 Å²	112.1	60%	0.598	55%	0.547	S	S	*	.	H	α-helix	trans	-72.7	-42	172	-72.1	-173	159.2	0	0	111.9	Q317 Q318 A319 E323 K324 Q325	Q317-E321 PolarHBondContact O-N 2.76Å; Q318-E321 PolarHBondContact O-N 2.9Å; A319-E321 PolarHBondContact O-N 3.27Å; E321-E323 VanDerWaalsContact C-N 3.35Å; E321-K324 PolarHBondContact O-N 3.23Å; E321-Q325 WeakPolarHBondContact O-CG 3.23Å; E321-Q325 PolarHBondContact O-N 3.38Å; E321-Q325 VanDerWaalsContact O-N 3.07Å
322	A	90.3	Very high	88.8	Confident	57 Å²	57	107.4 Å²	107.4	47%	0.471	54%	0.536	S	S	.	.	H	α-helix	trans	-62.2	-41	173.6	0	0	0	0	0	111.9	Q318 A319 Q325 A326	Q318-A322 WeakPolarHBondContact O-CB 3.48Å; Q318-A322 PolarHBondContact O-N 3.35Å; A319-A322 PolarHBondContact O-N 2.74Å; A322-Q325 PolarHBondContact O-N 3.19Å; A322-A326 WeakPolarHBondContact O-CB 3.13Å; A322-A326 PolarHBondContact O-N 3.48Å
323	E	89	Confident	89.1	Confident	142 Å²	142	105.6 Å²	105.6	66%	0.664	53%	0.525	S	S	*	.	H	α-helix	trans	-61	-43.4	175.1	-175.1	174.9	-151.1	0	0	111.8	A319 E321 Q325 A326 E327	A319-E323 WeakPolarHBondContact O-CB 3.35Å; A319-E323 PolarHBondContact O-N 3.27Å; E321-E323 VanDerWaalsContact C-N 3.35Å; E323-Q325 PolarHBondContact O-N 3.39Å; E323-A326 PolarHBondContact O-N 3.43Å; E323-E327 WeakPolarHBondContact O-CB 3.42Å; E323-E327 PolarHBondContact O-N 3.21Å
324	K	92.1	Very high	89.4	Confident	159 Å²	159	104.6 Å²	104.6	69%	0.691	53%	0.53	S	S	*	.	H	α-helix	trans	-62.7	-39.2	174.6	-77.5	176.3	179.9	176.2	0	113.2	A320 E321 L328	A320-K324 WeakPolarHBondContact O-CG 3.35Å; A320-K324 PolarHBondContact O-N 3.02Å; E321-K324 PolarHBondContact O-N 3.23Å; K324-L328 PolarHBondContact O-N 3.02Å; K324-L328 VanDerWaalsContact O-N 3.07Å
325	Q	87.8	Confident	89.5	Confident	147 Å²	147	103.5 Å²	103.5	69%	0.687	53%	0.527	S	S	*	.	H	α-helix	trans	-68	-41.4	175.7	-68.2	-177.6	17.9	0	0	111.3	E321 A322 E323 L328 S329	E321-Q325 WeakPolarHBondContact O-CG 3.23Å; E321-Q325 PolarHBondContact O-N 3.38Å; E321-Q325 VanDerWaalsContact O-N 3.07Å; A322-Q325 PolarHBondContact O-N 3.19Å; E323-Q325 PolarHBondContact O-N 3.39Å; Q325-L328 PolarHBondContact O-N 3.11Å; Q325-S329 PolarHBondContact O-N 3.21Å; Q325-S329 VanDerWaalsContact O-N 3.08Å; Q325-S329 PolarHBondContact O-OG 3.44Å
326	A	90.9	Very high	89.5	Confident	53 Å²	53	104.4 Å²	104.4	44%	0.438	53%	0.526	S	S	.	.	H	α-helix	trans	-61.7	-45.9	174.3	0	0	0	0	0	111.6	A322 E323 L328 S329 R330	A322-A326 WeakPolarHBondContact O-CB 3.13Å; A322-A326 PolarHBondContact O-N 3.48Å; E323-A326 PolarHBondContact O-N 3.43Å; A326-L328 PolarHBondContact O-N 3.2Å; A326-S329 PolarHBondContact O-N 3.25Å; A326-S329 PolarHBondContact O-OG 2.64Å; A326-R330 WeakPolarHBondContact O-CB 3.1Å; A326-R330 PolarHBondContact O-N 2.93Å
327	E	89.8	Confident	89.3	Confident	61 Å²	61	98.9 Å²	98.9	29%	0.285	51%	0.507	S	S	.	.	H	α-helix	trans	-56.8	-50	175.7	-179.1	60.6	-134.9	0	0	111.9	E323 S329 R330 Q331	E323-E327 WeakPolarHBondContact O-CB 3.42Å; E323-E327 PolarHBondContact O-N 3.21Å; E327-S329 VanDerWaalsContact C-N 3.33Å; E327-S329 PolarHBondContact O-N 2.86Å; E327-R330 PolarHBondContact O-N 3.19Å; E327-R330 VanDerWaalsContact O-N 3.15Å; E327-R330 IonicContact OE1-CZ 3.17Å; E327-R330 IonicContact OE1-NH1 2.83Å; E327-R330 IonicContact OE1-NH2 3.7Å; E327-R330 PolarHBondContact OE1-NH2 3.5Å; E327-R330 IonicContact OE2-CZ 2.9Å; E327-R330 IonicContact OE2-NH1 3.26Å; E327-R330 PolarHBondContact OE2-NH1 2.95Å; E327-R330 IonicContact OE2-NH2 3.68Å; E327-R330 PolarHBondContact OE2-NH2 2.94Å; E327-Q331 WeakPolarHBondContact O-CG 3.33Å; E327-Q331 PolarHBondContact O-N 3.01Å; E327-Q331 WeakPolarHBondContact OE1-CG 3.41Å; E327-Q331 PolarHBondContact OE1-NE2 2.77Å
328	L	92.1	Very high	89.4	Confident	123 Å²	123	99.3 Å²	99.3	64%	0.644	51%	0.509	S	S	*	.	H	α-helix	trans	-60.5	-41.4	178.6	-178.3	62.2	0	0	0	112.1	K324 Q325 A326 Q331 L332	K324-L328 PolarHBondContact O-N 3.02Å; K324-L328 VanDerWaalsContact O-N 3.07Å; Q325-L328 PolarHBondContact O-N 3.11Å; A326-L328 PolarHBondContact O-N 3.2Å; L328-Q331 PolarHBondContact O-N 3.5Å; L328-L332 PolarHBondContact O-N 3.13Å
329	S	88.5	Confident	89.5	Confident	75 Å²	75	101.9 Å²	101.9	52%	0.524	51%	0.513	S	S	.	.	H	α-helix	trans	-65.4	-39.8	175.5	71.1	0	0	0	0	112.4	Q325 A326 E327 Q331 L332 E333	Q325-S329 PolarHBondContact O-N 3.21Å; Q325-S329 VanDerWaalsContact O-N 3.08Å; Q325-S329 PolarHBondContact O-OG 3.44Å; A326-S329 PolarHBondContact O-N 3.25Å; A326-S329 PolarHBondContact O-OG 2.64Å; E327-S329 VanDerWaalsContact C-N 3.33Å; E327-S329 PolarHBondContact O-N 2.86Å; S329-Q331 PolarHBondContact O-N 2.97Å; S329-L332 PolarHBondContact O-N 2.76Å; S329-E333 PolarHBondContact O-N 2.89Å
330	R	90.7	Very high	89.4	Confident	149 Å²	149	106.7 Å²	106.7	56%	0.562	52%	0.519	S	S	*	.	H	α-helix	trans	-65	-37.3	176.1	-159.9	-178.7	76.9	-109.3	-8.6	111.8	A326 E327 A334	A326-R330 WeakPolarHBondContact O-CB 3.1Å; A326-R330 PolarHBondContact O-N 2.93Å; E327-R330 PolarHBondContact O-N 3.19Å; E327-R330 VanDerWaalsContact O-N 3.15Å; E327-R330 IonicContact OE1-CZ 3.17Å; E327-R330 IonicContact OE1-NH1 2.83Å; E327-R330 IonicContact OE1-NH2 3.7Å; E327-R330 PolarHBondContact OE1-NH2 3.5Å; E327-R330 IonicContact OE2-CZ 2.9Å; E327-R330 IonicContact OE2-NH1 3.26Å; E327-R330 PolarHBondContact OE2-NH1 2.95Å; E327-R330 IonicContact OE2-NH2 3.68Å; E327-R330 PolarHBondContact OE2-NH2 2.94Å; R330-A334 WeakPolarHBondContact O-CB 3.45Å; R330-A334 PolarHBondContact O-N 2.81Å
331	Q	89.5	Confident	89.3	Confident	110 Å²	110	112.4 Å²	112.4	51%	0.514	53%	0.531	S	S	.	.	H	α-helix	trans	-69	-42.5	176	-71.2	-177.6	20.2	0	0	112.6	E327 L328 S329 E333 A334 Q335	E327-Q331 WeakPolarHBondContact O-CG 3.33Å; E327-Q331 PolarHBondContact O-N 3.01Å; E327-Q331 WeakPolarHBondContact OE1-CG 3.41Å; E327-Q331 PolarHBondContact OE1-NE2 2.77Å; L328-Q331 PolarHBondContact O-N 3.5Å; S329-Q331 PolarHBondContact O-N 2.97Å; Q331-E333 VanDerWaalsContact C-N 3.34Å; Q331-E333 PolarHBondContact O-N 3.33Å; Q331-A334 PolarHBondContact O-N 3.08Å; Q331-Q335 PolarHBondContact O-N 2.93Å
332	L	87.8	Confident	89.4	Confident	89 Å²	89	111.1 Å²	111.1	47%	0.466	53%	0.526	S	S	.	.	H	α-helix	trans	-61.9	-43.4	176.3	-172.2	71.3	0	0	0	111.3	L328 S329 Q335 R336	L328-L332 PolarHBondContact O-N 3.13Å; S329-L332 PolarHBondContact O-N 2.76Å; L332-Q335 PolarHBondContact O-N 2.83Å; L332-R336 WeakPolarHBondContact O-CG 3.26Å; L332-R336 PolarHBondContact O-N 3.22Å; L332-R336 VanDerWaalsContact O-N 3.09Å
333	E	85.8	Confident	89.5	Confident	98 Å²	98	110.4 Å²	110.4	46%	0.458	52%	0.52	S	S	.	.	H	α-helix	trans	-73.2	-35.3	179.6	-159.8	56.2	-149.7	0	0	112.2	S329 Q331 Q335 R336 E337	S329-E333 PolarHBondContact O-N 2.89Å; Q331-E333 VanDerWaalsContact C-N 3.34Å; Q331-E333 PolarHBondContact O-N 3.33Å; E333-Q335 VanDerWaalsContact C-N 3.35Å; E333-Q335 PolarHBondContact O-N 2.9Å; E333-R336 PolarHBondContact O-N 2.99Å; E333-R336 WeakPolarHBondContact OE2-CD 3.41Å; E333-R336 IonicContact OE2-CZ 3.65Å; E333-R336 IonicContact OE2-NE 3.43Å; E333-R336 IonicContact OE2-NH1 2.65Å; E333-R336 PolarHBondContact OE2-NH1 3.48Å; E333-E337 WeakPolarHBondContact O-CB 3.29Å; E333-E337 PolarHBondContact O-N 3.06Å
334	A	91.3	Very high	89.6	Confident	56 Å²	56	107.7 Å²	107.7	46%	0.463	51%	0.513	S	S	.	.	H	α-helix	trans	-61.1	-40.6	170.7	0	0	0	0	0	112.3	R330 Q331 E337 Q338	R330-A334 WeakPolarHBondContact O-CB 3.45Å; R330-A334 PolarHBondContact O-N 2.81Å; Q331-A334 PolarHBondContact O-N 3.08Å; A334-E337 PolarHBondContact O-N 2.94Å; A334-Q338 WeakPolarHBondContact O-CB 3.19Å; A334-Q338 PolarHBondContact O-N 3Å
335	Q	90.8	Very high	89.5	Confident	111 Å²	111	106.4 Å²	106.4	52%	0.519	51%	0.509	S	S	.	.	H	α-helix	trans	-66.3	-40.5	176	-170	-172.1	92.9	0	0	111.9	Q331 L332 E333 Q338 R339	Q331-Q335 PolarHBondContact O-N 2.93Å; L332-Q335 PolarHBondContact O-N 2.83Å; E333-Q335 VanDerWaalsContact C-N 3.35Å; E333-Q335 PolarHBondContact O-N 2.9Å; Q335-Q338 PolarHBondContact O-N 3.37Å; Q335-R339 PolarHBondContact O-N 3.09Å; Q335-R339 VanDerWaalsContact O-N 3.1Å
336	R	88.1	Confident	89.6	Confident	139 Å²	139	106.2 Å²	106.2	53%	0.525	51%	0.508	S	S	.	.	H	α-helix	trans	-61.4	-49.4	173.7	-74.2	166	169.9	179.2	-1.7	111.2	L332 E333 Q338 R339 R340	L332-R336 WeakPolarHBondContact O-CG 3.26Å; L332-R336 PolarHBondContact O-N 3.22Å; L332-R336 VanDerWaalsContact O-N 3.09Å; E333-R336 PolarHBondContact O-N 2.99Å; E333-R336 WeakPolarHBondContact OE2-CD 3.41Å; E333-R336 IonicContact OE2-CZ 3.65Å; E333-R336 IonicContact OE2-NE 3.43Å; E333-R336 IonicContact OE2-NH1 2.65Å; E333-R336 PolarHBondContact OE2-NH1 3.48Å; R336-Q338 VanDerWaalsContact C-N 3.33Å; R336-Q338 PolarHBondContact O-N 2.78Å; R336-R339 WeakPolarHBondContact O-CB 3.45Å; R336-R339 PolarHBondContact O-N 3.39Å; R336-R339 VanDerWaalsContact O-N 3.16Å; R336-R340 WeakPolarHBondContact O-CG 3.45Å; R336-R340 PolarHBondContact O-N 3.24Å
337	E	85.3	Confident	89.7	Confident	48 Å²	48	112.9 Å²	112.9	22%	0.224	52%	0.522	C	S	.	.	H	α-helix	trans	-61.5	-39.1	178.1	172.7	59.1	-177	0	0	112	E333 A334 R339 R340 R341	E333-E337 WeakPolarHBondContact O-CB 3.29Å; E333-E337 PolarHBondContact O-N 3.06Å; A334-E337 PolarHBondContact O-N 2.94Å; E337-R339 PolarHBondContact O-N 2.87Å; E337-R340 WeakPolarHBondContact O-CB 3.32Å; E337-R340 PolarHBondContact O-N 3.49Å; E337-R340 VanDerWaalsContact O-N 3.16Å; E337-R340 IonicContact OE1-NH2 3.48Å; E337-R340 IonicContact OE2-CZ 2.68Å; E337-R340 IonicContact OE2-NE 2.68Å; E337-R340 PolarHBondContact OE2-NE 2.92Å; E337-R340 IonicContact OE2-NH2 2.65Å; E337-R340 PolarHBondContact OE2-NH2 2.87Å; E337-R341 WeakPolarHBondContact O-CG 3.48Å; E337-R341 PolarHBondContact O-N 2.99Å; E337-R341 IonicContact OE1-CZ 3.66Å; E337-R341 VanDerWaalsContact OE1-CZ 3.3Å; E337-R341 IonicContact OE1-NE 3.14Å; E337-R341 PolarHBondContact OE1-NE 2.66Å; E337-R341 IonicContact OE1-NH2 3.1Å; E337-R341 PolarHBondContact OE1-NH2 3.14Å
338	Q	89.6	Confident	89.5	Confident	118 Å²	118	115.4 Å²	115.4	55%	0.551	54%	0.535	S	S	*	.	H	α-helix	trans	-62.6	-41.1	174.2	-171.3	173.4	4.4	0	0	112	A334 Q335 R336 R341 Q342	A334-Q338 WeakPolarHBondContact O-CB 3.19Å; A334-Q338 PolarHBondContact O-N 3Å; Q335-Q338 PolarHBondContact O-N 3.37Å; R336-Q338 VanDerWaalsContact C-N 3.33Å; R336-Q338 PolarHBondContact O-N 2.78Å; Q338-R341 PolarHBondContact O-N 3.2Å; Q338-Q342 WeakPolarHBondContact O-CG 3.46Å; Q338-Q342 PolarHBondContact O-N 2.96Å
339	R	90	Very high	89.5	Confident	175 Å²	175	115.7 Å²	115.7	66%	0.66	53%	0.531	S	S	*	.	H	α-helix	trans	-63.7	-39.4	171.5	-72.1	-170.8	-177.2	-166.1	3.6	112.2	Q335 R336 E337 A343	Q335-R339 PolarHBondContact O-N 3.09Å; Q335-R339 VanDerWaalsContact O-N 3.1Å; R336-R339 WeakPolarHBondContact O-CB 3.45Å; R336-R339 PolarHBondContact O-N 3.39Å; R336-R339 VanDerWaalsContact O-N 3.16Å; E337-R339 PolarHBondContact O-N 2.87Å; R339-A343 WeakPolarHBondContact O-CB 3.35Å; R339-A343 PolarHBondContact O-N 2.88Å
340	R	87.9	Confident	89.7	Confident	161 Å²	161	115.1 Å²	115.1	61%	0.608	53%	0.531	S	S	*	.	H	α-helix	trans	-60.7	-46.5	174.1	-60.6	-157.3	-47.9	156.2	6.3	111.2	R336 E337 A343 V344	R336-R340 WeakPolarHBondContact O-CG 3.45Å; R336-R340 PolarHBondContact O-N 3.24Å; E337-R340 WeakPolarHBondContact O-CB 3.32Å; E337-R340 PolarHBondContact O-N 3.49Å; E337-R340 VanDerWaalsContact O-N 3.16Å; E337-R340 IonicContact OE1-NH2 3.48Å; E337-R340 IonicContact OE2-CZ 2.68Å; E337-R340 IonicContact OE2-NE 2.68Å; E337-R340 PolarHBondContact OE2-NE 2.92Å; E337-R340 IonicContact OE2-NH2 2.65Å; E337-R340 PolarHBondContact OE2-NH2 2.87Å; R340-A343 PolarHBondContact O-N 3.29Å; R340-V344 WeakPolarHBondContact O-CB 3.1Å; R340-V344 WeakPolarHBondContact O-CG2 3.3Å; R340-V344 PolarHBondContact O-N 3.07Å
341	R	88.8	Confident	89.8	Confident	161 Å²	161	110.7 Å²	110.7	61%	0.608	53%	0.526	S	S	*	.	H	α-helix	trans	-59.3	-48.8	178.4	-72	175.7	-172.4	-167.9	3.6	111.9	E337 Q338 A343 V344 E345	E337-R341 WeakPolarHBondContact O-CG 3.48Å; E337-R341 PolarHBondContact O-N 2.99Å; E337-R341 IonicContact OE1-CZ 3.66Å; E337-R341 VanDerWaalsContact OE1-CZ 3.3Å; E337-R341 IonicContact OE1-NE 3.14Å; E337-R341 PolarHBondContact OE1-NE 2.66Å; E337-R341 IonicContact OE1-NH2 3.1Å; E337-R341 PolarHBondContact OE1-NH2 3.14Å; Q338-R341 PolarHBondContact O-N 3.2Å; R341-A343 PolarHBondContact O-N 3.08Å; R341-V344 PolarHBondContact O-N 3.48Å; R341-E345 WeakPolarHBondContact O-CB 3.44Å; R341-E345 PolarHBondContact O-N 2.87Å
342	Q	91.5	Very high	89.8	Confident	102 Å²	102	112.4 Å²	112.4	48%	0.477	53%	0.528	S	S	.	.	H	α-helix	trans	-60.8	-42.3	176.5	-72.8	176.8	-21.7	0	0	112.3	Q338 E345 Q346	Q338-Q342 WeakPolarHBondContact O-CG 3.46Å; Q338-Q342 PolarHBondContact O-N 2.96Å; Q342-E345 PolarHBondContact O-N 2.96Å; Q342-Q346 WeakPolarHBondContact O-CB 3.3Å; Q342-Q346 WeakPolarHBondContact O-CG 3.19Å; Q342-Q346 PolarHBondContact O-N 3.03Å
343	A	91.9	Very high	89.9	Confident	42 Å²	42	111.2 Å²	111.2	35%	0.347	52%	0.522	S	S	.	.	H	α-helix	trans	-66.5	-37.4	176.9	0	0	0	0	0	112.8	R339 R340 R341 R347	R339-A343 WeakPolarHBondContact O-CB 3.35Å; R339-A343 PolarHBondContact O-N 2.88Å; R340-A343 PolarHBondContact O-N 3.29Å; R341-A343 PolarHBondContact O-N 3.08Å; A343-R347 WeakPolarHBondContact O-CB 3.43Å; A343-R347 WeakPolarHBondContact O-CD 3.44Å; A343-R347 WeakPolarHBondContact O-CG 3.42Å; A343-R347 PolarHBondContact O-N 2.84Å; A343-R347 VanDerWaalsContact O-N 3.12Å
344	V	91.6	Very high	90.3	Very high	85 Å²	85	111.1 Å²	111.1	52%	0.515	52%	0.524	S	S	.	.	H	α-helix	trans	-67.6	-44.3	173.5	169.4	0	0	0	0	110.7	R340 R341 R347 M348	R340-V344 WeakPolarHBondContact O-CB 3.1Å; R340-V344 WeakPolarHBondContact O-CG2 3.3Å; R340-V344 PolarHBondContact O-N 3.07Å; R341-V344 PolarHBondContact O-N 3.48Å; V344-R347 PolarHBondContact O-N 3.41Å; V344-M348 HydrophobicContact CG1-CG 4.17Å; V344-M348 WeakPolarHBondContact O-CB 3.32Å; V344-M348 WeakPolarHBondContact O-CG 3.44Å; V344-M348 PolarHBondContact O-N 3.2Å
345	E	89.8	Confident	90.1	Very high	131 Å²	131	112.6 Å²	112.6	61%	0.612	52%	0.522	S	S	*	.	H	α-helix	trans	-62.9	-45.3	178.8	-173.6	179	-177	0	0	112.1	R341 Q342 R347 M348 K349	R341-E345 WeakPolarHBondContact O-CB 3.44Å; R341-E345 PolarHBondContact O-N 2.87Å; Q342-E345 PolarHBondContact O-N 2.96Å; E345-R347 PolarHBondContact O-N 3.07Å; E345-M348 CarbonylContact O-C 3.58Å; E345-M348 PolarHBondContact O-N 3.38Å; E345-K349 PolarHBondContact O-N 2.93Å
346	Q	91.1	Very high	90.2	Very high	143 Å²	143	112.8 Å²	112.8	67%	0.668	52%	0.521	S	S	*	.	H	α-helix	trans	-60.7	-43.8	174.9	-74.2	179.8	-2.1	0	0	111.8	Q342 K349 A350	Q342-Q346 WeakPolarHBondContact O-CB 3.3Å; Q342-Q346 WeakPolarHBondContact O-CG 3.19Å; Q342-Q346 PolarHBondContact O-N 3.03Å; Q346-K349 PolarHBondContact O-N 2.9Å; Q346-A350 WeakPolarHBondContact O-CB 3.22Å; Q346-A350 PolarHBondContact O-N 2.68Å
347	R	91.1	Very high	90.3	Very high	193 Å²	193	112.9 Å²	112.9	73%	0.728	53%	0.527	S	S	*	.	H	α-helix	trans	-62.2	-42.7	173.9	-74.2	171.3	179.6	-168.1	-0.7	111.9	A343 V344 E345 K349 A350 A351	A343-R347 WeakPolarHBondContact O-CB 3.43Å; A343-R347 WeakPolarHBondContact O-CD 3.44Å; A343-R347 WeakPolarHBondContact O-CG 3.42Å; A343-R347 PolarHBondContact O-N 2.84Å; A343-R347 VanDerWaalsContact O-N 3.12Å; V344-R347 PolarHBondContact O-N 3.41Å; E345-R347 PolarHBondContact O-N 3.07Å; R347-K349 VanDerWaalsContact C-N 3.32Å; R347-K349 PolarHBondContact O-N 2.76Å; R347-A350 PolarHBondContact O-N 2.94Å; R347-A351 VanDerWaalsContact O-CB 3.26Å; R347-A351 WeakPolarHBondContact O-CB 3.2Å; R347-A351 PolarHBondContact O-N 2.97Å
348	M	87.2	Confident	90.5	Very high	115 Å²	115	118.1 Å²	118.1	57%	0.567	55%	0.545	S	S	*	.	H	α-helix	trans	-69.4	-26.1	177.6	-72.4	-70	-78.1	0	0	113	V344 E345 R352	V344-M348 HydrophobicContact CG1-CG 4.17Å; V344-M348 WeakPolarHBondContact O-CB 3.32Å; V344-M348 WeakPolarHBondContact O-CG 3.44Å; V344-M348 PolarHBondContact O-N 3.2Å; E345-M348 CarbonylContact O-C 3.58Å; E345-M348 PolarHBondContact O-N 3.38Å; M348-R352 WeakPolarHBondContact O-CG 3.47Å; M348-R352 PolarHBondContact O-N 3.45Å; M348-R352 PolarHBondContact O-NE 3.21Å
349	K	91.5	Very high	90.5	Very high	128 Å²	128	117.4 Å²	117.4	56%	0.557	54%	0.541	S	S	*	.	H	α-helix	trans	-73.4	-53.8	168.7	-173.9	-179.9	177.3	-175.1	0	110.8	E345 Q346 R347 A351 R352 D353	E345-K349 PolarHBondContact O-N 2.93Å; Q346-K349 PolarHBondContact O-N 2.9Å; R347-K349 VanDerWaalsContact C-N 3.32Å; R347-K349 PolarHBondContact O-N 2.76Å; K349-A351 VanDerWaalsContact C-N 3.28Å; K349-A351 PolarHBondContact O-N 2.91Å; K349-R352 PolarHBondContact O-N 3.02Å; K349-D353 WeakPolarHBondContact CG-OD2 3.33Å; K349-D353 PolarHBondContact O-N 2.91Å
350	A	92.8	Very high	90.6	Very high	63 Å²	63	114.7 Å²	114.7	52%	0.521	54%	0.539	S	S	.	.	H	α-helix	trans	-57.1	-39.9	179.9	0	0	0	0	0	112.6	Q346 R347 D353 L354	Q346-A350 WeakPolarHBondContact O-CB 3.22Å; Q346-A350 PolarHBondContact O-N 2.68Å; R347-A350 PolarHBondContact O-N 2.94Å; A350-D353 PolarHBondContact O-N 3.07Å; A350-L354 VanDerWaalsContact O-CB 3.25Å; A350-L354 WeakPolarHBondContact O-CB 3.22Å; A350-L354 PolarHBondContact O-N 3.31Å
351	A	92	Very high	90.7	Very high	56 Å²	56	111 Å²	111	46%	0.463	53%	0.528	S	S	.	.	H	α-helix	trans	-62.7	-43.3	174.9	0	0	0	0	0	112.7	R347 K349 E355	R347-A351 VanDerWaalsContact O-CB 3.26Å; R347-A351 WeakPolarHBondContact O-CB 3.2Å; R347-A351 PolarHBondContact O-N 2.97Å; K349-A351 VanDerWaalsContact C-N 3.28Å; K349-A351 PolarHBondContact O-N 2.91Å; A351-E355 VanDerWaalsContact O-CB 3.24Å; A351-E355 WeakPolarHBondContact O-CB 3.43Å; A351-E355 PolarHBondContact O-N 3Å
352	R	90.8	Very high	90.6	Very high	147 Å²	147	106.5 Å²	106.5	56%	0.555	52%	0.522	S	S	*	.	H	α-helix	trans	-66.4	-39.9	177.3	-78.8	178.4	-68.8	159.6	-2.3	112.6	M348 K349 E355 K356	M348-R352 WeakPolarHBondContact O-CG 3.47Å; M348-R352 PolarHBondContact O-N 3.45Å; M348-R352 PolarHBondContact O-NE 3.21Å; K349-R352 PolarHBondContact O-N 3.02Å; R352-E355 PolarHBondContact O-N 3.16Å; R352-K356 WeakPolarHBondContact O-CG 3.35Å; R352-K356 PolarHBondContact O-N 2.79Å
353	D	90.3	Very high	90.5	Very high	63 Å²	63	106.8 Å²	106.8	34%	0.337	52%	0.523	S	S	.	.	H	α-helix	trans	-75	-36	-178.8	-65.7	-31.1	0	0	0	111.4	K349 A350 K356 Q357	K349-D353 WeakPolarHBondContact CG-OD2 3.33Å; K349-D353 PolarHBondContact O-N 2.91Å; A350-D353 PolarHBondContact O-N 3.07Å; D353-K356 IonicContact OD1-NZ 3.2Å; D353-K356 PolarHBondContact OD1-NZ 3.22Å; D353-Q357 PolarHBondContact O-N 3.14Å
354	L	92.1	Very high	90.6	Very high	96 Å²	96	112.3 Å²	112.3	50%	0.503	54%	0.535	S	S	.	.	H	α-helix	trans	-61.3	-41.5	168.1	-176.8	69.1	0	0	0	112.1	A350 Q357 R358	A350-L354 VanDerWaalsContact O-CB 3.25Å; A350-L354 WeakPolarHBondContact O-CB 3.22Å; A350-L354 PolarHBondContact O-N 3.31Å; L354-Q357 PolarHBondContact O-N 3.43Å; L354-R358 WeakPolarHBondContact O-CG 3.27Å; L354-R358 PolarHBondContact O-N 3.19Å
355	E	88.4	Confident	90.7	Very high	88 Å²	88	113 Å²	113	41%	0.411	54%	0.535	S	S	.	.	H	α-helix	trans	-67.8	-41.9	-179.5	-179.2	52.4	-149.7	0	0	112.4	A351 R352 Q357 R358 Q359	A351-E355 VanDerWaalsContact O-CB 3.24Å; A351-E355 WeakPolarHBondContact O-CB 3.43Å; A351-E355 PolarHBondContact O-N 3Å; R352-E355 PolarHBondContact O-N 3.16Å; E355-Q357 PolarHBondContact O-N 3.07Å; E355-R358 WeakPolarHBondContact O-CB 3.42Å; E355-R358 PolarHBondContact O-N 3.39Å; E355-Q359 WeakPolarHBondContact O-CG 3.43Å; E355-Q359 PolarHBondContact O-N 3.44Å; E355-Q359 PolarHBondContact OE1-NE2 3.22Å
356	K	92	Very high	90.8	Very high	114 Å²	114	112.9 Å²	112.9	50%	0.496	53%	0.529	S	S	.	.	H	α-helix	trans	-55.5	-41.6	169.4	-69.2	167.9	-167.2	163	0	111.8	R352 D353 Q359 I360	R352-K356 WeakPolarHBondContact O-CG 3.35Å; R352-K356 PolarHBondContact O-N 2.79Å; D353-K356 IonicContact OD1-NZ 3.2Å; D353-K356 PolarHBondContact OD1-NZ 3.22Å; K356-Q359 PolarHBondContact O-N 3.49Å; K356-I360 WeakPolarHBondContact O-CG1 3.26Å; K356-I360 PolarHBondContact O-N 3.16Å
357	Q	91.8	Very high	90.8	Very high	142 Å²	142	109.7 Å²	109.7	66%	0.664	52%	0.519	S	S	*	.	H	α-helix	trans	-72.1	-32.6	-178	-162.1	160.6	5.7	0	0	112.1	D353 L354 E355 E361	D353-Q357 PolarHBondContact O-N 3.14Å; L354-Q357 PolarHBondContact O-N 3.43Å; E355-Q357 PolarHBondContact O-N 3.07Å; Q357-E361 WeakPolarHBondContact O-CB 3.33Å; Q357-E361 PolarHBondContact O-N 2.91Å; Q357-E361 VanDerWaalsContact O-N 3.11Å
358	R	88.5	Confident	91	Very high	157 Å²	157	103.7 Å²	103.7	59%	0.592	50%	0.502	S	S	*	.	H	α-helix	trans	-61.5	-45.2	167	-71.6	175.4	179.7	-79.6	-0.8	111.8	L354 E355 E361 S362	L354-R358 WeakPolarHBondContact O-CG 3.27Å; L354-R358 PolarHBondContact O-N 3.19Å; E355-R358 WeakPolarHBondContact O-CB 3.42Å; E355-R358 PolarHBondContact O-N 3.39Å; R358-E361 PolarHBondContact O-N 3.21Å; R358-S362 WeakPolarHBondContact O-CB 3.16Å; R358-S362 PolarHBondContact O-N 3.08Å; R358-S362 PolarHBondContact O-OG 3.24Å
359	Q	90.6	Very high	91.3	Very high	103 Å²	103	100.8 Å²	100.8	48%	0.481	50%	0.496	S	S	.	.	H	α-helix	trans	-62.3	-50.2	179.4	-70.8	172.1	15.3	0	0	111.7	E355 K356 E361 S362 E363	E355-Q359 WeakPolarHBondContact O-CG 3.43Å; E355-Q359 PolarHBondContact O-N 3.44Å; E355-Q359 PolarHBondContact OE1-NE2 3.22Å; K356-Q359 PolarHBondContact O-N 3.49Å; Q359-E361 PolarHBondContact O-N 2.86Å; Q359-S362 PolarHBondContact O-N 2.97Å; Q359-S362 PolarHBondContact O-OG 3.37Å; Q359-E363 PolarHBondContact O-N 3.05Å
360	I	90.7	Very high	91.3	Very high	119 Å²	119	99.7 Å²	99.7	61%	0.61	50%	0.495	S	S	*	.	H	α-helix	trans	-57.2	-46.9	176.4	-67.4	165.8	0	0	0	111.7	K356 S362 E363 R364	K356-I360 WeakPolarHBondContact O-CG1 3.26Å; K356-I360 PolarHBondContact O-N 3.16Å; I360-S362 PolarHBondContact O-N 2.97Å; I360-E363 PolarHBondContact O-N 2.79Å; I360-R364 WeakPolarHBondContact O-CB 3.5Å; I360-R364 PolarHBondContact O-N 2.77Å
361	E	91	Very high	91.4	Very high	82 Å²	82	101.3 Å²	101.3	38%	0.383	50%	0.495	S	S	.	.	H	α-helix	trans	-69.2	-33.8	179.8	-168.7	59.8	-148.7	0	0	111.7	Q357 R358 Q359 R364 I365	Q357-E361 WeakPolarHBondContact O-CB 3.33Å; Q357-E361 PolarHBondContact O-N 2.91Å; Q357-E361 VanDerWaalsContact O-N 3.11Å; R358-E361 PolarHBondContact O-N 3.21Å; Q359-E361 PolarHBondContact O-N 2.86Å; E361-R364 WeakPolarHBondContact O-CB 3.27Å; E361-R364 PolarHBondContact O-N 3.18Å; E361-R364 IonicContact OE1-NH1 3.66Å; E361-R364 PolarHBondContact OE1-NH1 2.85Å; E361-R364 VanDerWaalsContact OE2-CD 3.31Å; E361-R364 WeakPolarHBondContact OE2-CD 3.3Å; E361-R364 IonicContact OE2-CZ 2.65Å; E361-R364 IonicContact OE2-NH1 2.65Å; E361-R364 PolarHBondContact OE2-NH1 3.45Å; E361-I365 HydrophobicContact CG-CD1 4.1Å; E361-I365 WeakPolarHBondContact O-CB 3.29Å; E361-I365 VanDerWaalsContact O-CG1 3.27Å; E361-I365 WeakPolarHBondContact O-CG1 3.4Å; E361-I365 PolarHBondContact O-N 3.25Å
362	S	86.3	Confident	91.5	Very high	67 Å²	67	104.6 Å²	104.6	47%	0.469	50%	0.499	S	S	.	.	H	α-helix	trans	-64.5	-37.8	172.8	76.4	0	0	0	0	113.2	R358 Q359 I360 R366	R358-S362 WeakPolarHBondContact O-CB 3.16Å; R358-S362 PolarHBondContact O-N 3.08Å; R358-S362 PolarHBondContact O-OG 3.24Å; Q359-S362 PolarHBondContact O-N 2.97Å; Q359-S362 PolarHBondContact O-OG 3.37Å; I360-S362 PolarHBondContact O-N 2.97Å; S362-R366 VanDerWaalsContact O-CB 3.29Å; S362-R366 WeakPolarHBondContact O-CB 3.44Å; S362-R366 PolarHBondContact O-N 3.23Å
363	E	89	Confident	91.5	Very high	109 Å²	109	102.4 Å²	102.4	51%	0.509	50%	0.495	S	S	.	.	H	α-helix	trans	-69.8	-39.3	174.6	-71.1	-137.3	98.8	0	0	111.3	Q359 I360 R366 T367	Q359-E363 PolarHBondContact O-N 3.05Å; I360-E363 PolarHBondContact O-N 2.79Å; E363-R366 PolarHBondContact O-N 3.29Å; E363-R366 IonicContact OE1-NH2 2.73Å; E363-R366 PolarHBondContact OE1-NH2 3.27Å; E363-R366 VanDerWaalsContact OE1-NH2 3.11Å; E363-T367 WeakPolarHBondContact O-CG2 3.26Å; E363-T367 PolarHBondContact O-N 3.11Å; E363-T367 PolarHBondContact O-OG1 3.35Å; E363-T367 VanDerWaalsContact O-OG1 3.08Å
364	R	94.7	Very high	91.6	Very high	157 Å²	157	106.2 Å²	106.2	59%	0.592	50%	0.504	S	S	*	.	H	α-helix	trans	-59.3	-51.2	174	-172.3	-172.1	179.7	-159.7	0.4	111.3	I360 E361 R366 T367 D368	I360-R364 WeakPolarHBondContact O-CB 3.5Å; I360-R364 PolarHBondContact O-N 2.77Å; E361-R364 WeakPolarHBondContact O-CB 3.27Å; E361-R364 PolarHBondContact O-N 3.18Å; E361-R364 IonicContact OE1-NH1 3.66Å; E361-R364 PolarHBondContact OE1-NH1 2.85Å; E361-R364 VanDerWaalsContact OE2-CD 3.31Å; E361-R364 WeakPolarHBondContact OE2-CD 3.3Å; E361-R364 IonicContact OE2-CZ 2.65Å; E361-R364 IonicContact OE2-NH1 2.65Å; E361-R364 PolarHBondContact OE2-NH1 3.45Å; R364-R366 VanDerWaalsContact C-N 3.32Å; R364-R366 PolarHBondContact O-N 3.38Å; R364-T367 PolarHBondContact O-N 3.43Å; R364-T367 PolarHBondContact O-OG1 3.36Å; R364-D368 WeakPolarHBondContact O-CB 3.38Å; R364-D368 PolarHBondContact O-N 3.44Å
365	I	92.1	Very high	91.7	Very high	101 Å²	101	105.2 Å²	105.2	52%	0.518	50%	0.499	S	S	.	.	H	α-helix	trans	-59	-42.9	175.6	-68.7	165.7	0	0	0	110.8	E361 T367 A369	E361-I365 HydrophobicContact CG-CD1 4.1Å; E361-I365 WeakPolarHBondContact O-CB 3.29Å; E361-I365 VanDerWaalsContact O-CG1 3.27Å; E361-I365 WeakPolarHBondContact O-CG1 3.4Å; E361-I365 PolarHBondContact O-N 3.25Å; I365-T367 PolarHBondContact O-N 2.75Å; I365-A369 VanDerWaalsContact O-CB 3.3Å; I365-A369 WeakPolarHBondContact O-CB 3.32Å; I365-A369 PolarHBondContact O-N 3.28Å
366	R	93	Very high	91.9	Very high	128 Å²	128	104.5 Å²	104.5	48%	0.483	50%	0.496	S	S	.	.	H	α-helix	trans	-61.4	-41.1	176.4	-174.4	-175.9	65.9	75.2	-4.1	112.6	S362 E363 R364 L370	S362-R366 VanDerWaalsContact O-CB 3.29Å; S362-R366 WeakPolarHBondContact O-CB 3.44Å; S362-R366 PolarHBondContact O-N 3.23Å; E363-R366 PolarHBondContact O-N 3.29Å; E363-R366 IonicContact OE1-NH2 2.73Å; E363-R366 PolarHBondContact OE1-NH2 3.27Å; E363-R366 VanDerWaalsContact OE1-NH2 3.11Å; R364-R366 VanDerWaalsContact C-N 3.32Å; R364-R366 PolarHBondContact O-N 3.38Å; R366-L370 HydrophobicContact CG-CD1 4.49Å; R366-L370 WeakPolarHBondContact O-CG 3.31Å; R366-L370 PolarHBondContact O-N 3.42Å
367	T	91.6	Very high	91.8	Very high	75 Å²	75	104.3 Å²	104.3	46%	0.46	50%	0.498	S	S	.	.	H	α-helix	trans	-75	-39.1	179.8	54.2	0	0	0	0	113.1	E363 R364 I365 L370 L371	E363-T367 WeakPolarHBondContact O-CG2 3.26Å; E363-T367 PolarHBondContact O-N 3.11Å; E363-T367 PolarHBondContact O-OG1 3.35Å; E363-T367 VanDerWaalsContact O-OG1 3.08Å; R364-T367 PolarHBondContact O-N 3.43Å; R364-T367 PolarHBondContact O-OG1 3.36Å; I365-T367 PolarHBondContact O-N 2.75Å; T367-L370 PolarHBondContact O-N 2.84Å; T367-L371 WeakPolarHBondContact O-CB 3.41Å; T367-L371 PolarHBondContact O-N 2.92Å
368	D	94.9	Very high	91.9	Very high	68 Å²	68	102.2 Å²	102.2	36%	0.364	49%	0.488	S	S	.	.	H	α-helix	trans	-64.1	-41.3	173.4	173.6	57.7	0	0	0	111.9	R364 L370 L371 K372	R364-D368 WeakPolarHBondContact O-CB 3.38Å; R364-D368 PolarHBondContact O-N 3.44Å; D368-L370 PolarHBondContact O-N 3.19Å; D368-L371 PolarHBondContact O-N 3.31Å; D368-K372 WeakPolarHBondContact O-CB 3.14Å; D368-K372 WeakPolarHBondContact O-CG 3.23Å; D368-K372 PolarHBondContact O-N 2.83Å; D368-K372 WeakPolarHBondContact OD1-CE 3.39Å; D368-K372 IonicContact OD1-NZ 3.7Å; D368-K372 PolarHBondContact OD1-NZ 2.65Å; D368-K372 VanDerWaalsContact OD2-CE 3.32Å; D368-K372 WeakPolarHBondContact OD2-CE 3.34Å; D368-K372 IonicContact OD2-NZ 2.77Å; D368-K372 PolarHBondContact OD2-NZ 2.7Å
369	A	92.6	Very high	92.1	Very high	54 Å²	54	98 Å²	98	45%	0.446	48%	0.48	S	S	.	.	H	α-helix	trans	-59.8	-45	173.3	0	0	0	0	0	112.4	I365 L371 K372 E373	I365-A369 VanDerWaalsContact O-CB 3.3Å; I365-A369 WeakPolarHBondContact O-CB 3.32Å; I365-A369 PolarHBondContact O-N 3.28Å; A369-L371 PolarHBondContact O-N 2.91Å; A369-K372 PolarHBondContact O-N 2.85Å; A369-E373 PolarHBondContact O-N 2.78Å
370	L	92.9	Very high	92.3	Very high	104 Å²	104	94.4 Å²	94.4	55%	0.545	46%	0.464	S	S	.	.	H	α-helix	trans	-67.1	-33.5	176.3	-72	170.1	0	0	0	112.8	R366 T367 D368 R374	R366-L370 HydrophobicContact CG-CD1 4.49Å; R366-L370 WeakPolarHBondContact O-CG 3.31Å; R366-L370 PolarHBondContact O-N 3.42Å; T367-L370 PolarHBondContact O-N 2.84Å; D368-L370 PolarHBondContact O-N 3.19Å; L370-R374 VanDerWaalsContact O-CB 3.3Å; L370-R374 WeakPolarHBondContact O-CB 3.21Å; L370-R374 PolarHBondContact O-N 3.2Å
371	L	94.4	Very high	92.4	Very high	98 Å²	98	93.7 Å²	93.7	51%	0.513	46%	0.461	S	S	.	.	H	α-helix	trans	-67.2	-43.7	174.4	-171.8	72.4	0	0	0	111.1	T367 D368 A369 R374 N375	T367-L371 WeakPolarHBondContact O-CB 3.41Å; T367-L371 PolarHBondContact O-N 2.92Å; D368-L371 PolarHBondContact O-N 3.31Å; A369-L371 PolarHBondContact O-N 2.91Å; L371-R374 PolarHBondContact O-N 3.19Å; L371-N375 WeakPolarHBondContact O-CB 3.31Å; L371-N375 PolarHBondContact O-N 3.46Å; L371-N375 PolarHBondContact O-ND2 3.03Å; L371-N375 PolarHBondContact O-OD1 2.9Å
372	K	93.9	Very high	92.5	Very high	125 Å²	125	95 Å²	95	54%	0.543	47%	0.467	S	S	.	.	H	α-helix	trans	-61.5	-45.9	175.9	-75.6	166.3	175.7	168	0	111.8	D368 A369 N375 H376	D368-K372 WeakPolarHBondContact O-CB 3.14Å; D368-K372 WeakPolarHBondContact O-CG 3.23Å; D368-K372 PolarHBondContact O-N 2.83Å; D368-K372 WeakPolarHBondContact OD1-CE 3.39Å; D368-K372 IonicContact OD1-NZ 3.7Å; D368-K372 PolarHBondContact OD1-NZ 2.65Å; D368-K372 VanDerWaalsContact OD2-CE 3.32Å; D368-K372 WeakPolarHBondContact OD2-CE 3.34Å; D368-K372 IonicContact OD2-NZ 2.77Å; D368-K372 PolarHBondContact OD2-NZ 2.7Å; A369-K372 PolarHBondContact O-N 2.85Å; K372-N375 PolarHBondContact O-N 2.9Å; K372-H376 WeakPolarHBondContact O-CB 3.17Å; K372-H376 PolarHBondContact O-N 3.2Å
373	E	90.3	Very high	92.9	Very high	100 Å²	100	94 Å²	94	47%	0.467	46%	0.455	S	S	.	.	H	α-helix	trans	-61.3	-47	175.7	-175.2	56.5	-148.4	0	0	111.9	A369 N375 H376 M377	A369-E373 PolarHBondContact O-N 2.78Å; E373-N375 VanDerWaalsContact C-N 3.29Å; E373-N375 PolarHBondContact O-N 2.61Å; E373-H376 PolarHBondContact O-N 2.87Å; E373-M377 HydrophobicContact CG-CE 4.46Å; E373-M377 PolarHBondContact O-N 2.79Å
374	R	92.9	Very high	93	Very high	144 Å²	144	89.8 Å²	89.8	54%	0.543	44%	0.439	S	S	.	.	H	α-helix	trans	-59.9	-39.2	175.5	176.1	-93.5	165.3	80.9	-3	112.1	L370 L371 Q378	L370-R374 VanDerWaalsContact O-CB 3.3Å; L370-R374 WeakPolarHBondContact O-CB 3.21Å; L370-R374 PolarHBondContact O-N 3.2Å; L371-R374 PolarHBondContact O-N 3.19Å; R374-Q378 VanDerWaalsContact O-CB 3.28Å; R374-Q378 WeakPolarHBondContact O-CB 3.39Å; R374-Q378 PolarHBondContact O-N 3.22Å
375	N	94.4	Very high	93.1	Very high	74 Å²	74	86.3 Å²	86.3	40%	0.396	44%	0.435	S	S	.	.	H	α-helix	trans	-71.3	-40	177.7	-70.9	-11.2	0	0	0	111.5	L371 K372 E373 Q378 T379	L371-N375 WeakPolarHBondContact O-CB 3.31Å; L371-N375 PolarHBondContact O-N 3.46Å; L371-N375 PolarHBondContact O-ND2 3.03Å; L371-N375 PolarHBondContact O-OD1 2.9Å; K372-N375 PolarHBondContact O-N 2.9Å; E373-N375 VanDerWaalsContact C-N 3.29Å; E373-N375 PolarHBondContact O-N 2.61Å; N375-Q378 PolarHBondContact O-N 2.97Å; N375-T379 PolarHBondContact O-N 2.81Å; N375-T379 PolarHBondContact O-OG1 2.84Å
376	H	92.9	Very high	93.2	Very high	74 Å²	74	81.6 Å²	81.6	34%	0.343	41%	0.411	S	S	.	.	H	α-helix	trans	-61.5	-48.2	174.8	-178.4	63.1	0	0	0	111.5	K372 E373 Q378 T379 L380	K372-H376 WeakPolarHBondContact O-CB 3.17Å; K372-H376 PolarHBondContact O-N 3.2Å; E373-H376 PolarHBondContact O-N 2.87Å; H376-Q378 VanDerWaalsContact C-N 3.33Å; H376-Q378 PolarHBondContact O-N 2.82Å; H376-T379 PolarHBondContact O-N 2.8Å; H376-L380 PolarHBondContact O-N 3.42Å
377	M	90.1	Very high	93.1	Very high	110 Å²	110	77.8 Å²	77.8	54%	0.542	40%	0.399	S	S	.	.	H	α-helix	trans	-62.3	-36.2	173.2	-75.4	-159.1	-70.4	0	0	113.1	E373 L380 L381	E373-M377 HydrophobicContact CG-CE 4.46Å; E373-M377 PolarHBondContact O-N 2.79Å; M377-L380 PolarHBondContact O-N 2.91Å; M377-L381 WeakPolarHBondContact O-CB 3.22Å; M377-L381 PolarHBondContact O-N 2.83Å
378	Q	93.4	Very high	93.3	Very high	97 Å²	97	81.9 Å²	81.9	45%	0.453	41%	0.405	S	S	.	.	H	α-helix	trans	-66.6	-40.6	176.3	-175.4	169	-33.8	0	0	111.4	R374 N375 H376 L381 E382	R374-Q378 VanDerWaalsContact O-CB 3.28Å; R374-Q378 WeakPolarHBondContact O-CB 3.39Å; R374-Q378 PolarHBondContact O-N 3.22Å; N375-Q378 PolarHBondContact O-N 2.97Å; H376-Q378 VanDerWaalsContact C-N 3.33Å; H376-Q378 PolarHBondContact O-N 2.82Å; Q378-L381 PolarHBondContact O-N 2.72Å; Q378-E382 WeakPolarHBondContact O-CB 3.35Å; Q378-E382 PolarHBondContact O-N 3.33Å
379	T	93.4	Very high	93.3	Very high	69 Å²	69	79.3 Å²	79.3	42%	0.423	39%	0.394	S	S	.	.	H	α-helix	trans	-61.9	-49.8	171.4	-62.3	0	0	0	0	111.2	N375 H376 L381 E382 Q383	N375-T379 PolarHBondContact O-N 2.81Å; N375-T379 PolarHBondContact O-OG1 2.84Å; H376-T379 PolarHBondContact O-N 2.8Å; T379-L381 VanDerWaalsContact C-N 3.32Å; T379-L381 PolarHBondContact O-N 2.8Å; T379-E382 PolarHBondContact O-N 3.33Å; T379-Q383 HydrophobicContact CG2-CG 4.27Å; T379-Q383 WeakPolarHBondContact O-CB 3.37Å; T379-Q383 WeakPolarHBondContact O-CG 3.49Å; T379-Q383 PolarHBondContact O-N 3.43Å
380	L	93.1	Very high	93.3	Very high	28 Å²	28	78.9 Å²	78.9	15%	0.147	39%	0.388	C	S	.	.	H	α-helix	trans	-59.2	-40	177.6	-74.7	173.7	0	0	0	112.6	H376 M377 Q383 A384	H376-L380 PolarHBondContact O-N 3.42Å; M377-L380 PolarHBondContact O-N 2.91Å; L380-Q383 PolarHBondContact O-N 3.27Å; L380-A384 PolarHBondContact O-N 2.9Å
381	L	93.5	Very high	93.3	Very high	103 Å²	103	78.7 Å²	78.7	54%	0.539	39%	0.387	S	S	.	.	H	α-helix	trans	-65.2	-45.7	174.9	177.5	61.2	0	0	0	111.5	M377 Q378 T379 Q383 A384 V385	M377-L381 WeakPolarHBondContact O-CB 3.22Å; M377-L381 PolarHBondContact O-N 2.83Å; Q378-L381 PolarHBondContact O-N 2.72Å; T379-L381 VanDerWaalsContact C-N 3.32Å; T379-L381 PolarHBondContact O-N 2.8Å; L381-Q383 PolarHBondContact O-N 3.1Å; L381-A384 PolarHBondContact O-N 3.44Å; L381-V385 HydrophobicContact CD1-CG2 4.2Å; L381-V385 HydrophobicContact CG-CG2 4.41Å; L381-V385 WeakPolarHBondContact O-CB 3.42Å; L381-V385 VanDerWaalsContact O-CG2 3.23Å; L381-V385 WeakPolarHBondContact O-CG2 3.44Å; L381-V385 PolarHBondContact O-N 3.15Å
382	E	93.4	Very high	93.3	Very high	109 Å²	109	79 Å²	79	51%	0.509	39%	0.388	S	S	.	.	H	α-helix	trans	-59.6	-38	175.7	178.5	170.3	-176	0	0	111.8	Q378 T379 V385 K1037	Q378-E382 WeakPolarHBondContact O-CB 3.35Å; Q378-E382 PolarHBondContact O-N 3.33Å; T379-E382 PolarHBondContact O-N 3.33Å; E382-V385 PolarHBondContact O-N 2.84Å; E382-K1037 PolarHBondContact O-NZ 3.27Å; E382-K1037 IonicContact OE1-NZ 2.7Å; E382-K1037 PolarHBondContact OE1-NZ 3.45Å
383	Q	94	Very high	93.3	Very high	47 Å²	47	76.1 Å²	76.1	22%	0.22	38%	0.377	C	S	.	.	H	α-helix	trans	-66.8	-45.9	177.6	-72.1	179	-4.7	0	0	111.5	T379 L380 L381 V385 H387 T1034 S1035 L1036	T379-Q383 HydrophobicContact CG2-CG 4.27Å; T379-Q383 WeakPolarHBondContact O-CB 3.37Å; T379-Q383 WeakPolarHBondContact O-CG 3.49Å; T379-Q383 PolarHBondContact O-N 3.43Å; L380-Q383 PolarHBondContact O-N 3.27Å; L381-Q383 PolarHBondContact O-N 3.1Å; Q383-V385 VanDerWaalsContact C-N 3.34Å; Q383-V385 PolarHBondContact O-N 3.45Å; Q383-H387 PolarHBondContact O-N 2.93Å; Q383-T1034 HydrophobicContact CB-CG2 3.88Å; Q383-S1035 WeakPolarHBondContact CB-OG 3.43Å; Q383-S1035 WeakPolarHBondContact CG-OG 3.36Å; Q383-S1035 PolarHBondContact NE2-OG 3.49Å; Q383-S1035 PolarHBondContact OE1-OG 2.96Å; Q383-S1035 VanDerWaalsContact OE1-OG 3.1Å; Q383-L1036 VanDerWaalsContact CA-CD2 3.49Å; Q383-L1036 HydrophobicContact CB-CD2 4.25Å; Q383-L1036 HydrophobicContact CG-CD1 4.5Å; Q383-L1036 HydrophobicContact CG-CD2 4.44Å; Q383-L1036 HydrophobicContact CG-CG 4.36Å; Q383-L1036 WeakPolarHBondContact O-CD2 3.41Å
384	A	92.3	Very high	93.3	Very high	21 Å²	21	74.2 Å²	74.2	17%	0.174	38%	0.375	C	S	.	.	H	α-helix	trans	-61.8	-39.1	173.6	0	0	0	0	0	112.8	L380 L381 A386 R388	L380-A384 PolarHBondContact O-N 2.9Å; L381-A384 PolarHBondContact O-N 3.44Å; A384-A386 VanDerWaalsContact C-N 3.29Å; A384-A386 PolarHBondContact O-N 2.9Å; A384-R388 PolarHBondContact O-N 3.18Å
385	V	95.4	Very high	93.3	Very high	84 Å²	84	69.7 Å²	69.7	51%	0.509	37%	0.368	S	S	.	.	H	α-helix	trans	-57.6	-33.1	-172.7	153.9	0	0	0	0	114.1	L381 E382 Q383	L381-V385 HydrophobicContact CD1-CG2 4.2Å; L381-V385 HydrophobicContact CG-CG2 4.41Å; L381-V385 WeakPolarHBondContact O-CB 3.42Å; L381-V385 VanDerWaalsContact O-CG2 3.23Å; L381-V385 WeakPolarHBondContact O-CG2 3.44Å; L381-V385 PolarHBondContact O-N 3.15Å; E382-V385 PolarHBondContact O-N 2.84Å; Q383-V385 VanDerWaalsContact C-N 3.34Å; Q383-V385 PolarHBondContact O-N 3.45Å
386	A	94.7	Very high	93.3	Very high	1 Å²	1	69.8 Å²	69.8	1%	0.008	37%	0.374	C	S	.	.	H	α-helix	trans	-130.8	11.3	176.5	0	0	0	0	0	117.3	A384 A389 S390 K1037 L1039	A384-A386 VanDerWaalsContact C-N 3.29Å; A384-A386 PolarHBondContact O-N 2.9Å; A386-A389 HydrophobicContact CB-CB 3.61Å; A386-A389 PolarHBondContact O-N 3.27Å; A386-S390 PolarHBondContact O-N 3.47Å; A386-K1037 HydrophobicContact CB-CB 3.59Å; A386-K1037 HydrophobicContact CB-CD 3.94Å; A386-K1037 HydrophobicContact CB-CG 3.5Å; A386-K1037 WeakPolarHBondContact O-CA 3.29Å; A386-K1037 PolarHBondContact O-N 3.21Å; A386-L1039 HydrophobicContact CB-CB 4.28Å; A386-L1039 HydrophobicContact CB-CD1 4.45Å; A386-L1039 HydrophobicContact CB-CD2 4.08Å
387	H	92.1	Very high	93.3	Very high	49 Å²	49	69.8 Å²	69.8	23%	0.227	38%	0.383	C	S	.	.	H	α-helix	trans	-57	-45.9	138.6	178.8	-122	0	0	0	109.7	Q383 A389 S390 L391 S924 S925	Q383-H387 PolarHBondContact O-N 2.93Å; H387-A389 PolarHBondContact O-N 3.25Å; H387-S390 VanDerWaalsContact O-CB 3.32Å; H387-S390 WeakPolarHBondContact O-CB 3.45Å; H387-S390 PolarHBondContact O-N 2.96Å; H387-L391 PolarHBondContact O-N 3.34Å; H387-S924 PolarHBondContact ND1-OG 3.35Å; H387-S925 PolarHBondContact CE1-OG 2.94Å; H387-S925 VanDerWaalsContact CE1-OG 3.31Å
388	R	94.2	Very high	93.5	Very high	160 Å²	160	70.4 Å²	70.4	60%	0.604	38%	0.384	S	S	*	.	H	α-helix	trans	-51.9	-40.4	172.3	168.8	179	173	151.2	3.3	113.4	A384 L391 L392	A384-R388 PolarHBondContact O-N 3.18Å; R388-L391 PolarHBondContact O-N 3.26Å; R388-L392 HydrophobicContact CG-CD1 4.39Å; R388-L392 PolarHBondContact O-N 2.85Å
389	A	95.3	Very high	93.5	Very high	15 Å²	15	71.1 Å²	71.1	12%	0.124	39%	0.388	C	S	.	.	H	α-helix	trans	-80.3	-30.3	-175.9	0	0	0	0	0	112.8	A386 H387 L391 L392 E393 L1039	A386-A389 HydrophobicContact CB-CB 3.61Å; A386-A389 PolarHBondContact O-N 3.27Å; H387-A389 PolarHBondContact O-N 3.25Å; A389-L391 PolarHBondContact O-N 3.07Å; A389-L392 PolarHBondContact O-N 3.35Å; A389-L392 VanDerWaalsContact O-N 3.16Å; A389-E393 WeakPolarHBondContact O-CB 3.42Å; A389-E393 PolarHBondContact O-N 3.31Å; A389-L1039 HydrophobicContact CB-CB 4.46Å; A389-L1039 HydrophobicContact CB-CD1 3.4Å; A389-L1039 VanDerWaalsContact CB-CD1 3.4Å; A389-L1039 HydrophobicContact CB-CG 4.48Å
390	S	93.2	Very high	93.6	Very high	45 Å²	45	74.4 Å²	74.4	32%	0.315	40%	0.398	S	S	.	.	H	α-helix	trans	-53.2	-44.9	165	-161.2	0	0	0	0	111.2	A386 H387 L392 E393 S394 A1038	A386-S390 PolarHBondContact O-N 3.47Å; H387-S390 VanDerWaalsContact O-CB 3.32Å; H387-S390 WeakPolarHBondContact O-CB 3.45Å; H387-S390 PolarHBondContact O-N 2.96Å; S390-L392 PolarHBondContact O-N 2.9Å; S390-E393 PolarHBondContact O-N 3.34Å; S390-S394 VanDerWaalsContact O-CB 3.3Å; S390-S394 WeakPolarHBondContact O-CB 3.27Å; S390-S394 PolarHBondContact O-N 3.11Å; S390-A1038 VanDerWaalsContact OG-CB 3.27Å; S390-A1038 WeakPolarHBondContact OG-CB 3.36Å
391	L	92.5	Very high	93.7	Very high	99 Å²	99	77.5 Å²	77.5	52%	0.518	41%	0.408	S	S	.	.	H	α-helix	trans	-67.3	-34.6	177.9	-61.9	172	0	0	0	112.9	H387 R388 A389 A395	H387-L391 PolarHBondContact O-N 3.34Å; R388-L391 PolarHBondContact O-N 3.26Å; A389-L391 PolarHBondContact O-N 3.07Å; L391-A395 WeakPolarHBondContact O-CB 3.47Å; L391-A395 PolarHBondContact O-N 3.41Å
392	L	94.4	Very high	93.7	Very high	105 Å²	105	77.7 Å²	77.7	55%	0.55	41%	0.409	S	S	.	.	H	α-helix	trans	-71.3	-36.9	175.3	-70.2	171.4	0	0	0	112.5	R388 A389 S390 S396	R388-L392 HydrophobicContact CG-CD1 4.39Å; R388-L392 PolarHBondContact O-N 2.85Å; A389-L392 PolarHBondContact O-N 3.35Å; A389-L392 VanDerWaalsContact O-N 3.16Å; S390-L392 PolarHBondContact O-N 2.9Å; L392-S396 WeakPolarHBondContact O-CB 3.44Å; L392-S396 PolarHBondContact O-N 2.98Å
393	E	93.3	Very high	93.8	Very high	64 Å²	64	77.9 Å²	77.9	30%	0.299	41%	0.413	S	S	.	.	H	α-helix	trans	-69.9	-45.4	177.1	-176.5	158.5	-144.5	0	0	111.2	A389 S390 S396 S397 L1039 A1040 S1041	A389-E393 WeakPolarHBondContact O-CB 3.42Å; A389-E393 PolarHBondContact O-N 3.31Å; S390-E393 PolarHBondContact O-N 3.34Å; E393-S396 PolarHBondContact O-N 2.83Å; E393-S397 PolarHBondContact O-N 3.48Å; E393-L1039 WeakPolarHBondContact OE2-CA 3.44Å; E393-L1039 PolarHBondContact OE2-N 2.93Å; E393-A1040 WeakPolarHBondContact OE1-CA 3.24Å; E393-A1040 PolarHBondContact OE1-N 2.79Å; E393-A1040 PolarHBondContact OE2-N 3.1Å; E393-A1040 VanDerWaalsContact OE2-N 3.14Å; E393-S1041 PolarHBondContact OE1-N 2.92Å
394	S	91.3	Very high	93.8	Very high	61 Å²	61	80 Å²	80	43%	0.427	42%	0.423	S	S	.	.	H	α-helix	trans	-59.2	-46	170.8	-177.6	0	0	0	0	112.2	S390 S396 S397 Q398	S390-S394 VanDerWaalsContact O-CB 3.3Å; S390-S394 WeakPolarHBondContact O-CB 3.27Å; S390-S394 PolarHBondContact O-N 3.11Å; S394-S396 VanDerWaalsContact C-N 3.32Å; S394-S396 PolarHBondContact O-N 2.81Å; S394-S397 WeakPolarHBondContact O-CB 3.41Å; S394-S397 PolarHBondContact O-N 2.81Å; S394-Q398 WeakPolarHBondContact O-CG 3.31Å; S394-Q398 PolarHBondContact O-N 2.8Å
395	A	92.6	Very high	93.9	Very high	48 Å²	48	83.5 Å²	83.5	40%	0.397	44%	0.438	S	S	.	.	H	α-helix	trans	-62.7	-36.2	175.9	0	0	0	0	0	113	L391 Q398 Q399	L391-A395 WeakPolarHBondContact O-CB 3.47Å; L391-A395 PolarHBondContact O-N 3.41Å; A395-Q398 PolarHBondContact O-N 3.43Å; A395-Q399 WeakPolarHBondContact O-CB 3.49Å; A395-Q399 PolarHBondContact O-N 3.07Å
396	S	94.8	Very high	93.9	Very high	76 Å²	76	83.9 Å²	83.9	53%	0.531	44%	0.437	S	S	.	.	H	α-helix	trans	-67.3	-39.8	174.5	-163.1	0	0	0	0	112	L392 E393 S394 Q399 Q400	L392-S396 WeakPolarHBondContact O-CB 3.44Å; L392-S396 PolarHBondContact O-N 2.98Å; E393-S396 PolarHBondContact O-N 2.83Å; S394-S396 VanDerWaalsContact C-N 3.32Å; S394-S396 PolarHBondContact O-N 2.81Å; S396-Q399 PolarHBondContact O-N 3.06Å; S396-Q400 PolarHBondContact O-N 2.79Å
397	S	93.1	Very high	93.9	Very high	75 Å²	75	87.2 Å²	87.2	52%	0.524	46%	0.461	S	S	.	.	H	α-helix	trans	-64.7	-43	174.4	-178.3	0	0	0	0	111.8	E393 S394 Q399 Q400 R401	E393-S397 PolarHBondContact O-N 3.48Å; S394-S397 WeakPolarHBondContact O-CB 3.41Å; S394-S397 PolarHBondContact O-N 2.81Å; S397-Q399 PolarHBondContact O-N 2.88Å; S397-Q400 PolarHBondContact O-N 2.82Å; S397-R401 PolarHBondContact O-N 3.22Å
398	Q	93	Very high	94.1	Very high	123 Å²	123	92.3 Å²	92.3	58%	0.575	48%	0.478	S	S	*	.	H	α-helix	trans	-61.6	-42.2	173.4	-73.4	-178.8	-28	0	0	112.1	S394 A395 Q400 R401 L402	S394-Q398 WeakPolarHBondContact O-CG 3.31Å; S394-Q398 PolarHBondContact O-N 2.8Å; A395-Q398 PolarHBondContact O-N 3.43Å; Q398-Q400 VanDerWaalsContact C-N 3.32Å; Q398-Q400 PolarHBondContact O-N 3Å; Q398-R401 PolarHBondContact O-N 2.89Å; Q398-L402 WeakPolarHBondContact O-CG 3.4Å; Q398-L402 PolarHBondContact O-N 3.39Å
399	Q	94	Very high	94.2	Very high	111 Å²	111	90.1 Å²	90.1	52%	0.519	48%	0.477	S	S	.	.	H	α-helix	trans	-62.8	-37.6	175.4	-174.3	62.3	37.5	0	0	112.2	A395 S396 S397 L402 L403	A395-Q399 WeakPolarHBondContact O-CB 3.49Å; A395-Q399 PolarHBondContact O-N 3.07Å; S396-Q399 PolarHBondContact O-N 3.06Å; S397-Q399 PolarHBondContact O-N 2.88Å; Q399-L402 PolarHBondContact O-N 3.17Å; Q399-L403 WeakPolarHBondContact O-CG 3.41Å; Q399-L403 PolarHBondContact O-N 3.09Å
400	Q	95.3	Very high	94.2	Very high	139 Å²	139	93.7 Å²	93.7	65%	0.65	49%	0.494	S	S	*	.	H	α-helix	trans	-67.3	-43.2	173.9	-175.9	175	-14.9	0	0	111.8	S396 S397 Q398 L402 L403 E404	S396-Q400 PolarHBondContact O-N 2.79Å; S397-Q400 PolarHBondContact O-N 2.82Å; Q398-Q400 VanDerWaalsContact C-N 3.32Å; Q398-Q400 PolarHBondContact O-N 3Å; Q400-L402 VanDerWaalsContact C-N 3.29Å; Q400-L402 PolarHBondContact O-N 2.79Å; Q400-L403 PolarHBondContact O-N 2.77Å; Q400-E404 PolarHBondContact O-N 2.82Å
401	R	95.2	Very high	94.3	Very high	93 Å²	93	95.1 Å²	95.1	35%	0.351	50%	0.501	S	S	.	.	H	α-helix	trans	-61.2	-36.6	175.6	-166.2	179.7	-175.5	107.4	-1.9	111.8	S397 Q398 E404 L405 E727 N728	S397-R401 PolarHBondContact O-N 3.22Å; Q398-R401 PolarHBondContact O-N 2.89Å; R401-E404 PolarHBondContact O-N 2.76Å; R401-L405 HydrophobicContact CG-CD1 4.29Å; R401-L405 WeakPolarHBondContact O-CB 3.39Å; R401-L405 VanDerWaalsContact O-CG 3.26Å; R401-L405 WeakPolarHBondContact O-CG 3.05Å; R401-L405 PolarHBondContact O-N 3.48Å; R401-E727 IonicContact CZ-OE2 3.67Å; R401-E727 IonicContact NE-OE2 3.31Å; R401-E727 VanDerWaalsContact NH2-CB 3.32Å; R401-E727 IonicContact NH2-OE2 2.61Å; R401-E727 PolarHBondContact NH2-OE2 2.85Å; R401-N728 PolarHBondContact NH1-OD1 3.39Å; R401-N728 PolarHBondContact NH2-OD1 3.4Å
402	L	94	Very high	94.3	Very high	107 Å²	107	92.4 Å²	92.4	56%	0.56	49%	0.493	S	S	*	.	H	α-helix	trans	-64.6	-43	173.9	-73.7	173.3	0	0	0	112.6	Q398 Q399 Q400 E404 L405 D406	Q398-L402 WeakPolarHBondContact O-CG 3.4Å; Q398-L402 PolarHBondContact O-N 3.39Å; Q399-L402 PolarHBondContact O-N 3.17Å; Q400-L402 VanDerWaalsContact C-N 3.29Å; Q400-L402 PolarHBondContact O-N 2.79Å; L402-E404 VanDerWaalsContact C-N 3.34Å; L402-L405 PolarHBondContact O-N 3.14Å; L402-D406 WeakPolarHBondContact O-CB 3.36Å; L402-D406 PolarHBondContact O-N 2.62Å
403	L	95.2	Very high	94.4	Very high	112 Å²	112	91.6 Å²	91.6	59%	0.586	49%	0.486	S	S	*	.	H	α-helix	trans	-66.5	-35.7	175.8	-69.2	171.3	0	0	0	112.3	Q399 Q400 S407	Q399-L403 WeakPolarHBondContact O-CG 3.41Å; Q399-L403 PolarHBondContact O-N 3.09Å; Q400-L403 PolarHBondContact O-N 2.77Å; L403-S407 WeakPolarHBondContact O-CB 3.18Å; L403-S407 PolarHBondContact O-N 3.22Å
404	E	94.3	Very high	94.5	Very high	93 Å²	93	93 Å²	93	44%	0.435	50%	0.499	S	S	.	.	H	α-helix	trans	-67.3	-42.8	174.2	-166.1	-172.5	159.6	0	0	111.9	Q400 R401 L402 S407 R408	Q400-E404 PolarHBondContact O-N 2.82Å; R401-E404 PolarHBondContact O-N 2.76Å; L402-E404 VanDerWaalsContact C-N 3.34Å; E404-S407 PolarHBondContact O-N 2.86Å; E404-R408 WeakPolarHBondContact O-CB 3.37Å; E404-R408 VanDerWaalsContact O-CG 3.3Å; E404-R408 WeakPolarHBondContact O-CG 3.35Å; E404-R408 PolarHBondContact O-N 3.37Å; E404-R408 IonicContact OE1-CZ 2.71Å; E404-R408 VanDerWaalsContact OE1-CZ 3.25Å; E404-R408 IonicContact OE1-NE 3.14Å; E404-R408 PolarHBondContact OE1-NE 2.98Å; E404-R408 IonicContact OE1-NH2 3.32Å; E404-R408 PolarHBondContact OE1-NH2 3.5Å
405	L	94.3	Very high	94.7	Very high	94 Å²	94	95.4 Å²	95.4	49%	0.492	50%	0.504	S	S	.	.	H	α-helix	trans	-65.3	-39.2	176.3	-73.8	170.1	0	0	0	112.2	R401 L402 R408 L409	R401-L405 HydrophobicContact CG-CD1 4.29Å; R401-L405 WeakPolarHBondContact O-CB 3.39Å; R401-L405 VanDerWaalsContact O-CG 3.26Å; R401-L405 WeakPolarHBondContact O-CG 3.05Å; R401-L405 PolarHBondContact O-N 3.48Å; L402-L405 PolarHBondContact O-N 3.14Å; L405-R408 PolarHBondContact O-N 2.9Å; L405-L409 VanDerWaalsContact O-CB 3.29Å; L405-L409 WeakPolarHBondContact O-CB 3.28Å; L405-L409 PolarHBondContact O-N 3.25Å
406	D	95.3	Very high	94.9	Very high	92 Å²	92	96.4 Å²	96.4	49%	0.492	51%	0.505	S	S	.	.	H	α-helix	trans	-63	-44.5	173.2	-174.2	85	0	0	0	111.4	L402 R408 L409 N410	L402-D406 WeakPolarHBondContact O-CB 3.36Å; L402-D406 PolarHBondContact O-N 2.62Å; D406-R408 PolarHBondContact O-N 3.41Å; D406-L409 PolarHBondContact O-N 2.92Å; D406-N410 PolarHBondContact O-N 2.65Å; D406-N410 PolarHBondContact O-ND2 2.88Å; D406-N410 PolarHBondContact OD2-ND2 3.25Å
407	S	95.5	Very high	94.9	Very high	71 Å²	71	95.9 Å²	95.9	50%	0.497	50%	0.496	S	S	.	.	H	α-helix	trans	-60.7	-44.5	174.7	-177.1	0	0	0	0	112.4	L403 E404 N410 V411	L403-S407 WeakPolarHBondContact O-CB 3.18Å; L403-S407 PolarHBondContact O-N 3.22Å; E404-S407 PolarHBondContact O-N 2.86Å; S407-N410 PolarHBondContact O-N 2.98Å; S407-V411 WeakPolarHBondContact O-CG2 3.35Å; S407-V411 PolarHBondContact O-N 3.29Å; S407-V411 VanDerWaalsContact O-N 3.11Å
408	R	96	Very high	95	Very high	156 Å²	156	96 Å²	96	59%	0.589	50%	0.497	S	S	*	.	H	α-helix	trans	-63.1	-41.1	175.3	-71.6	170.3	178.8	-131.5	9	112.1	E404 L405 D406 V411 A412	E404-R408 WeakPolarHBondContact O-CB 3.37Å; E404-R408 VanDerWaalsContact O-CG 3.3Å; E404-R408 WeakPolarHBondContact O-CG 3.35Å; E404-R408 PolarHBondContact O-N 3.37Å; E404-R408 IonicContact OE1-CZ 2.71Å; E404-R408 VanDerWaalsContact OE1-CZ 3.25Å; E404-R408 IonicContact OE1-NE 3.14Å; E404-R408 PolarHBondContact OE1-NE 2.98Å; E404-R408 IonicContact OE1-NH2 3.32Å; E404-R408 PolarHBondContact OE1-NH2 3.5Å; L405-R408 PolarHBondContact O-N 2.9Å; D406-R408 PolarHBondContact O-N 3.41Å; R408-V411 PolarHBondContact O-N 2.89Å; R408-A412 WeakPolarHBondContact O-CB 3.36Å; R408-A412 PolarHBondContact O-N 2.91Å
409	L	94.7	Very high	95.2	Very high	114 Å²	114	95.2 Å²	95.2	60%	0.597	49%	0.493	S	S	*	.	H	α-helix	trans	-64.3	-43	177.6	179.2	62.1	0	0	0	111.7	L405 D406 A412 Q413	L405-L409 VanDerWaalsContact O-CB 3.29Å; L405-L409 WeakPolarHBondContact O-CB 3.28Å; L405-L409 PolarHBondContact O-N 3.25Å; D406-L409 PolarHBondContact O-N 2.92Å; L409-A412 PolarHBondContact O-N 3.4Å; L409-Q413 WeakPolarHBondContact O-CB 3.35Å; L409-Q413 PolarHBondContact O-N 2.86Å
410	N	95.4	Very high	95.3	Very high	89 Å²	89	94.7 Å²	94.7	48%	0.476	49%	0.489	S	S	.	.	H	α-helix	trans	-61.9	-43.3	175.6	-77.6	-64.2	0	0	0	111.9	D406 S407 Q413 T414	D406-N410 PolarHBondContact O-N 2.65Å; D406-N410 PolarHBondContact O-ND2 2.88Å; D406-N410 PolarHBondContact OD2-ND2 3.25Å; S407-N410 PolarHBondContact O-N 2.98Å; N410-Q413 PolarHBondContact O-N 2.84Å; N410-T414 WeakPolarHBondContact O-CG2 3.44Å; N410-T414 PolarHBondContact O-N 3.25Å; N410-T414 VanDerWaalsContact O-N 3.07Å; N410-T414 PolarHBondContact O-OG1 2.84Å
411	V	95.6	Very high	95.4	Very high	75 Å²	75	92.1 Å²	92.1	46%	0.455	48%	0.483	S	S	.	.	H	α-helix	trans	-60.6	-53.4	174.5	172.8	0	0	0	0	110.7	S407 R408 Q413 T414 E415	S407-V411 WeakPolarHBondContact O-CG2 3.35Å; S407-V411 PolarHBondContact O-N 3.29Å; S407-V411 VanDerWaalsContact O-N 3.11Å; R408-V411 PolarHBondContact O-N 2.89Å; V411-Q413 VanDerWaalsContact C-N 3.26Å; V411-Q413 PolarHBondContact O-N 3.36Å; V411-T414 PolarHBondContact O-N 2.98Å; V411-T414 PolarHBondContact O-OG1 3.42Å; V411-E415 HydrophobicContact CG1-CG 4.45Å; V411-E415 PolarHBondContact O-N 2.99Å
412	A	93.7	Very high	95.4	Very high	42 Å²	42	90.4 Å²	90.4	35%	0.347	49%	0.485	S	S	.	.	H	α-helix	trans	-58.3	-36.4	179.7	0	0	0	0	0	112.7	R408 L409 E415 V416	R408-A412 WeakPolarHBondContact O-CB 3.36Å; R408-A412 PolarHBondContact O-N 2.91Å; L409-A412 PolarHBondContact O-N 3.4Å; A412-E415 PolarHBondContact O-N 2.99Å; A412-V416 WeakPolarHBondContact O-CB 3.35Å; A412-V416 VanDerWaalsContact O-CG2 3.27Å; A412-V416 WeakPolarHBondContact O-CG2 3.46Å; A412-V416 PolarHBondContact O-N 3.43Å
413	Q	95.1	Very high	95.5	Very high	88 Å²	88	88.9 Å²	88.9	41%	0.411	48%	0.477	S	S	.	.	H	α-helix	trans	-64	-44.5	174	-178.7	61.6	44.1	0	0	111.8	L409 N410 V411 E415 V416 D417	L409-Q413 WeakPolarHBondContact O-CB 3.35Å; L409-Q413 PolarHBondContact O-N 2.86Å; N410-Q413 PolarHBondContact O-N 2.84Å; V411-Q413 VanDerWaalsContact C-N 3.26Å; V411-Q413 PolarHBondContact O-N 3.36Å; Q413-E415 PolarHBondContact O-N 2.79Å; Q413-V416 PolarHBondContact O-N 3.47Å; Q413-D417 VanDerWaalsContact NE2-CG 3.31Å; Q413-D417 PolarHBondContact NE2-OD1 3.22Å; Q413-D417 PolarHBondContact NE2-OD2 3.26Å; Q413-D417 PolarHBondContact O-N 3.06Å
414	T	96	Very high	95.4	Very high	94 Å²	94	87.7 Å²	87.7	58%	0.577	47%	0.471	S	S	*	.	H	α-helix	trans	-65.7	-36.1	176.1	59.6	0	0	0	0	113	N410 V411 D417 S418	N410-T414 WeakPolarHBondContact O-CG2 3.44Å; N410-T414 PolarHBondContact O-N 3.25Å; N410-T414 VanDerWaalsContact O-N 3.07Å; N410-T414 PolarHBondContact O-OG1 2.84Å; V411-T414 PolarHBondContact O-N 2.98Å; V411-T414 PolarHBondContact O-OG1 3.42Å; T414-D417 PolarHBondContact O-N 3.46Å; T414-S418 WeakPolarHBondContact O-CB 3.42Å; T414-S418 PolarHBondContact O-N 2.62Å
415	E	96	Very high	95.5	Very high	112 Å²	112	88.1 Å²	88.1	52%	0.523	47%	0.473	S	S	.	.	H	α-helix	trans	-64.6	-46	173	-69.4	-179.5	157.3	0	0	111	V411 A412 Q413 D417 S418 H419	V411-E415 HydrophobicContact CG1-CG 4.45Å; V411-E415 PolarHBondContact O-N 2.99Å; A412-E415 PolarHBondContact O-N 2.99Å; Q413-E415 PolarHBondContact O-N 2.79Å; E415-D417 PolarHBondContact O-N 2.98Å; E415-S418 WeakPolarHBondContact O-CB 3.49Å; E415-S418 PolarHBondContact O-N 3.33Å; E415-H419 PolarHBondContact O-N 2.81Å; E415-H419 PolarHBondContact O-ND1 2.66Å
416	V	96.5	Very high	95.6	Very high	68 Å²	68	88.7 Å²	88.7	41%	0.412	47%	0.474	S	S	.	.	H	α-helix	trans	-60.4	-41	176.4	161.9	0	0	0	0	112	A412 Q413 H419 K420	A412-V416 WeakPolarHBondContact O-CB 3.35Å; A412-V416 VanDerWaalsContact O-CG2 3.27Å; A412-V416 WeakPolarHBondContact O-CG2 3.46Å; A412-V416 PolarHBondContact O-N 3.43Å; Q413-V416 PolarHBondContact O-N 3.47Å; V416-H419 PolarHBondContact O-N 2.86Å; V416-K420 HydrophobicContact CG1-CD 4.44Å; V416-K420 VanDerWaalsContact CG1-CE 3.47Å; V416-K420 WeakPolarHBondContact O-CG 3.46Å; V416-K420 PolarHBondContact O-N 3.3Å
417	D	95.8	Very high	95.5	Very high	65 Å²	65	90.8 Å²	90.8	35%	0.348	48%	0.475	S	S	.	.	H	α-helix	trans	-73.2	-32.1	178.1	-70.2	-29.2	0	0	0	112.8	Q413 T414 E415 K420 T421	Q413-D417 VanDerWaalsContact NE2-CG 3.31Å; Q413-D417 PolarHBondContact NE2-OD1 3.22Å; Q413-D417 PolarHBondContact NE2-OD2 3.26Å; Q413-D417 PolarHBondContact O-N 3.06Å; T414-D417 PolarHBondContact O-N 3.46Å; E415-D417 PolarHBondContact O-N 2.98Å; D417-K420 PolarHBondContact O-N 2.9Å; D417-K420 WeakPolarHBondContact OD1-CD 3.43Å; D417-K420 WeakPolarHBondContact OD1-CE 3.47Å; D417-K420 IonicContact OD1-NZ 3.76Å; D417-K420 PolarHBondContact OD1-NZ 3.1Å; D417-T421 PolarHBondContact O-N 2.85Å; D417-T421 PolarHBondContact O-OG1 3.15Å
418	S	95.4	Very high	95.5	Very high	77 Å²	77	91.2 Å²	91.2	54%	0.538	48%	0.479	S	S	.	.	H	α-helix	trans	-61.8	-46.2	167.6	-176	0	0	0	0	111.6	T414 E415 K420 T421 S422	T414-S418 WeakPolarHBondContact O-CB 3.42Å; T414-S418 PolarHBondContact O-N 2.62Å; E415-S418 WeakPolarHBondContact O-CB 3.49Å; E415-S418 PolarHBondContact O-N 3.33Å; S418-K420 PolarHBondContact O-N 2.88Å; S418-T421 WeakPolarHBondContact O-CB 3.06Å; S418-T421 PolarHBondContact O-N 3.02Å; S418-T421 VanDerWaalsContact O-N 3.17Å; S418-S422 PolarHBondContact O-N 3.24Å
419	H	96.5	Very high	95.6	Very high	108 Å²	108	88.9 Å²	88.9	50%	0.5	47%	0.473	S	S	.	.	H	α-helix	trans	-63.1	-41.5	175.8	-76.3	74.7	0	0	0	112.3	E415 V416 T421 S422 I423	E415-H419 PolarHBondContact O-N 2.81Å; E415-H419 PolarHBondContact O-ND1 2.66Å; V416-H419 PolarHBondContact O-N 2.86Å; H419-T421 VanDerWaalsContact C-N 3.28Å; H419-T421 PolarHBondContact O-N 2.92Å; H419-S422 PolarHBondContact O-N 2.87Å; H419-I423 WeakPolarHBondContact O-CB 3.48Å; H419-I423 WeakPolarHBondContact O-CD1 3.02Å; H419-I423 VanDerWaalsContact O-CG1 3.26Å; H419-I423 WeakPolarHBondContact O-CG1 3.31Å; H419-I423 PolarHBondContact O-N 3.48Å
420	K	96.6	Very high	95.7	Very high	100 Å²	100	89.5 Å²	89.5	44%	0.435	47%	0.467	S	S	.	.	H	α-helix	trans	-58.1	-41.3	172.9	-73	170.1	-164.1	157.2	0	111.8	V416 D417 S418 I423 N424	V416-K420 HydrophobicContact CG1-CD 4.44Å; V416-K420 VanDerWaalsContact CG1-CE 3.47Å; V416-K420 WeakPolarHBondContact O-CG 3.46Å; V416-K420 PolarHBondContact O-N 3.3Å; D417-K420 PolarHBondContact O-N 2.9Å; D417-K420 WeakPolarHBondContact OD1-CD 3.43Å; D417-K420 WeakPolarHBondContact OD1-CE 3.47Å; D417-K420 IonicContact OD1-NZ 3.76Å; D417-K420 PolarHBondContact OD1-NZ 3.1Å; S418-K420 PolarHBondContact O-N 2.88Å; K420-I423 PolarHBondContact O-N 2.8Å; K420-N424 VanDerWaalsContact O-CG 3.31Å; K420-N424 PolarHBondContact O-N 3.26Å; K420-N424 PolarHBondContact O-ND2 2.82Å
421	T	96.2	Very high	95.7	Very high	84 Å²	84	88.2 Å²	88.2	52%	0.515	46%	0.46	S	S	.	.	H	α-helix	trans	-64.3	-49.9	179	-55.6	0	0	0	0	110.6	D417 S418 H419 I423 N424 E425	D417-T421 PolarHBondContact O-N 2.85Å; D417-T421 PolarHBondContact O-OG1 3.15Å; S418-T421 WeakPolarHBondContact O-CB 3.06Å; S418-T421 PolarHBondContact O-N 3.02Å; S418-T421 VanDerWaalsContact O-N 3.17Å; H419-T421 VanDerWaalsContact C-N 3.28Å; H419-T421 PolarHBondContact O-N 2.92Å; T421-I423 VanDerWaalsContact C-N 3.35Å; T421-I423 PolarHBondContact O-N 3.36Å; T421-N424 PolarHBondContact O-N 3.04Å; T421-N424 VanDerWaalsContact O-N 3.09Å; T421-E425 PolarHBondContact O-N 2.85Å
422	S	96.3	Very high	95.7	Very high	57 Å²	57	86.1 Å²	86.1	40%	0.399	45%	0.451	S	S	.	.	H	α-helix	trans	-59	-41.4	175.3	-177.7	0	0	0	0	112.9	S418 H419 N424 E425 M426	S418-S422 PolarHBondContact O-N 3.24Å; H419-S422 PolarHBondContact O-N 2.87Å; S422-N424 VanDerWaalsContact C-N 3.32Å; S422-N424 PolarHBondContact O-N 3.33Å; S422-E425 PolarHBondContact O-N 3.22Å; S422-M426 WeakPolarHBondContact O-CG 3.44Å; S422-M426 PolarHBondContact O-N 2.88Å
423	I	94.9	Very high	95.8	Very high	75 Å²	75	91.3 Å²	91.3	39%	0.385	46%	0.463	S	S	.	.	H	α-helix	trans	-61.8	-39.2	174.8	-73.7	163.1	0	0	0	111.7	H419 K420 T421 M426 R427	H419-I423 WeakPolarHBondContact O-CB 3.48Å; H419-I423 WeakPolarHBondContact O-CD1 3.02Å; H419-I423 VanDerWaalsContact O-CG1 3.26Å; H419-I423 WeakPolarHBondContact O-CG1 3.31Å; H419-I423 PolarHBondContact O-N 3.48Å; K420-I423 PolarHBondContact O-N 2.8Å; T421-I423 VanDerWaalsContact C-N 3.35Å; T421-I423 PolarHBondContact O-N 3.36Å; I423-M426 HydrophobicContact CG1-CE 4.15Å; I423-M426 PolarHBondContact O-N 3.01Å; I423-R427 VanDerWaalsContact O-CG 3.26Å; I423-R427 WeakPolarHBondContact O-CG 3.33Å; I423-R427 PolarHBondContact O-N 3.12Å
424	N	94.5	Very high	95.8	Very high	88 Å²	88	91.5 Å²	91.5	47%	0.471	46%	0.463	S	S	.	.	H	α-helix	trans	-71.7	-34.9	177.1	-71	-24.4	0	0	0	112.4	K420 T421 S422 R427 S428	K420-N424 VanDerWaalsContact O-CG 3.31Å; K420-N424 PolarHBondContact O-N 3.26Å; K420-N424 PolarHBondContact O-ND2 2.82Å; T421-N424 PolarHBondContact O-N 3.04Å; T421-N424 VanDerWaalsContact O-N 3.09Å; S422-N424 VanDerWaalsContact C-N 3.32Å; S422-N424 PolarHBondContact O-N 3.33Å; N424-R427 PolarHBondContact O-N 2.83Å; N424-R427 PolarHBondContact OD1-NH1 2.79Å; N424-S428 PolarHBondContact O-N 3.36Å
425	E	96.1	Very high	95.9	Very high	102 Å²	102	92.5 Å²	92.5	48%	0.477	46%	0.456	S	S	.	.	H	α-helix	trans	-62.9	-44.4	169.2	-71.9	-174.8	-153	0	0	112.4	T421 S422 R427 S428 K429	T421-E425 PolarHBondContact O-N 2.85Å; S422-E425 PolarHBondContact O-N 3.22Å; E425-R427 VanDerWaalsContact C-N 3.33Å; E425-R427 PolarHBondContact O-N 3.45Å; E425-S428 PolarHBondContact O-N 3Å; E425-K429 WeakPolarHBondContact O-CG 3.37Å; E425-K429 PolarHBondContact O-N 3.38Å; E425-K429 IonicContact OE2-NZ 2.76Å; E425-K429 PolarHBondContact OE2-NZ 2.8Å
426	M	94.7	Very high	95.9	Very high	106 Å²	106	91.1 Å²	91.1	52%	0.522	45%	0.453	S	S	.	.	H	α-helix	trans	-63.8	-38.7	177.7	-73.3	-171.2	-73.2	0	0	111.8	S422 I423 K429 R430	S422-M426 WeakPolarHBondContact O-CG 3.44Å; S422-M426 PolarHBondContact O-N 2.88Å; I423-M426 HydrophobicContact CG1-CE 4.15Å; I423-M426 PolarHBondContact O-N 3.01Å; M426-K429 PolarHBondContact O-N 3.01Å; M426-R430 WeakPolarHBondContact O-CB 3.47Å; M426-R430 PolarHBondContact O-N 3.15Å
427	R	94.9	Very high	95.8	Very high	135 Å²	135	93 Å²	93	51%	0.509	46%	0.46	S	S	.	.	H	α-helix	trans	-60.2	-49.2	170.4	-73.6	164.4	175.5	173.4	-5	111.3	I423 N424 E425 K429 R430 D431	I423-R427 VanDerWaalsContact O-CG 3.26Å; I423-R427 WeakPolarHBondContact O-CG 3.33Å; I423-R427 PolarHBondContact O-N 3.12Å; N424-R427 PolarHBondContact O-N 2.83Å; N424-R427 PolarHBondContact OD1-NH1 2.79Å; E425-R427 VanDerWaalsContact C-N 3.33Å; E425-R427 PolarHBondContact O-N 3.45Å; R427-K429 VanDerWaalsContact C-N 3.31Å; R427-K429 PolarHBondContact O-N 2.89Å; R427-R430 WeakPolarHBondContact O-CB 3.48Å; R427-R430 PolarHBondContact O-N 3.36Å; R427-R430 VanDerWaalsContact O-N 3.16Å; R427-D431 WeakPolarHBondContact O-CB 3.27Å; R427-D431 PolarHBondContact O-N 3.11Å; R427-D431 VanDerWaalsContact O-OD1 3.08Å
428	S	95.6	Very high	95.8	Very high	81 Å²	81	96.8 Å²	96.8	57%	0.566	47%	0.469	S	S	*	.	H	α-helix	trans	-59.5	-39	178.3	-176	0	0	0	0	113	N424 E425 D431 A432	N424-S428 PolarHBondContact O-N 3.36Å; E425-S428 PolarHBondContact O-N 3Å; S428-D431 PolarHBondContact O-N 2.93Å; S428-A432 PolarHBondContact O-N 2.84Å; S428-A432 VanDerWaalsContact O-N 3.09Å
429	K	96.7	Very high	95.8	Very high	107 Å²	107	96.5 Å²	96.5	47%	0.465	46%	0.461	S	S	.	.	H	α-helix	trans	-65.7	-44.9	174.1	-71.4	162.2	-176.2	156.2	0	111.9	E425 M426 R427 A432 Y433	E425-K429 WeakPolarHBondContact O-CG 3.37Å; E425-K429 PolarHBondContact O-N 3.38Å; E425-K429 IonicContact OE2-NZ 2.76Å; E425-K429 PolarHBondContact OE2-NZ 2.8Å; M426-K429 PolarHBondContact O-N 3.01Å; R427-K429 VanDerWaalsContact C-N 3.31Å; R427-K429 PolarHBondContact O-N 2.89Å; K429-A432 WeakPolarHBondContact O-CB 3.28Å; K429-A432 PolarHBondContact O-N 2.58Å; K429-Y433 HydrophobicContact CB-CE2 4.46Å; K429-Y433 VanDerWaalsContact O-CD2 3.3Å; K429-Y433 WeakPolarHBondContact O-CD2 3.36Å; K429-Y433 PolarHBondContact O-N 3.32Å
430	R	96.4	Very high	95.7	Very high	126 Å²	126	96.7 Å²	96.7	48%	0.475	46%	0.464	S	S	.	.	H	α-helix	trans	-58.2	-48.5	172.9	179.2	-157.4	65.9	166.7	-0.2	111.3	M426 R427 A432 Y433 E434	M426-R430 WeakPolarHBondContact O-CB 3.47Å; M426-R430 PolarHBondContact O-N 3.15Å; R427-R430 WeakPolarHBondContact O-CB 3.48Å; R427-R430 PolarHBondContact O-N 3.36Å; R427-R430 VanDerWaalsContact O-N 3.16Å; R430-A432 PolarHBondContact O-N 2.87Å; R430-Y433 PolarHBondContact O-N 3.32Å; R430-Y433 VanDerWaalsContact O-N 3.08Å; R430-E434 WeakPolarHBondContact CD-OE1 3.43Å; R430-E434 HydrophobicContact CG-CG 4.21Å; R430-E434 VanDerWaalsContact CG-OE1 3.28Å; R430-E434 WeakPolarHBondContact CG-OE1 3.1Å; R430-E434 IonicContact CZ-OE1 3.38Å; R430-E434 IonicContact NE-OE1 2.95Å; R430-E434 PolarHBondContact NE-OE1 3.47Å; R430-E434 WeakPolarHBondContact O-CB 3.31Å; R430-E434 WeakPolarHBondContact O-CG 3.35Å; R430-E434 PolarHBondContact O-N 3.33Å
431	D	96.2	Very high	95.7	Very high	63 Å²	63	95.5 Å²	95.5	34%	0.337	47%	0.465	S	S	.	.	H	α-helix	trans	-67.3	-18.9	-177.7	-59.3	-4.4	0	0	0	112.3	R427 S428 R435	R427-D431 WeakPolarHBondContact O-CB 3.27Å; R427-D431 PolarHBondContact O-N 3.11Å; R427-D431 VanDerWaalsContact O-OD1 3.08Å; S428-D431 PolarHBondContact O-N 2.93Å; D431-R435 PolarHBondContact O-NH2 3.32Å
432	A	95.9	Very high	95.6	Very high	31 Å²	31	98.5 Å²	98.5	26%	0.256	47%	0.473	S	S	.	.	H	α-helix	trans	-75.8	-53.9	165.9	0	0	0	0	0	111.6	S428 K429 R430 E434 R435 D436	S428-A432 PolarHBondContact O-N 2.84Å; S428-A432 VanDerWaalsContact O-N 3.09Å; K429-A432 WeakPolarHBondContact O-CB 3.28Å; K429-A432 PolarHBondContact O-N 2.58Å; R430-A432 PolarHBondContact O-N 2.87Å; A432-E434 VanDerWaalsContact C-N 3.29Å; A432-E434 PolarHBondContact O-N 2.95Å; A432-R435 WeakPolarHBondContact O-CA 3.44Å; A432-R435 VanDerWaalsContact O-CB 3.26Å; A432-R435 WeakPolarHBondContact O-CB 3.42Å; A432-R435 PolarHBondContact O-N 2.8Å; A432-D436 VanDerWaalsContact O-CG 3.31Å; A432-D436 PolarHBondContact O-N 2.99Å
433	Y	96.1	Very high	95.5	Very high	151 Å²	151	101.4 Å²	101.4	59%	0.592	48%	0.48	S	S	*	.	H	α-helix	trans	-59.8	-37	177.9	-58.2	-39.6	0	0	0	113.1	K429 R430 R435 D436 I437	K429-Y433 HydrophobicContact CB-CE2 4.46Å; K429-Y433 VanDerWaalsContact O-CD2 3.3Å; K429-Y433 WeakPolarHBondContact O-CD2 3.36Å; K429-Y433 PolarHBondContact O-N 3.32Å; R430-Y433 PolarHBondContact O-N 3.32Å; R430-Y433 VanDerWaalsContact O-N 3.08Å; Y433-R435 PolarHBondContact O-N 2.65Å; Y433-D436 PolarHBondContact O-N 3.39Å; Y433-I437 WeakPolarHBondContact O-CB 3.3Å; Y433-I437 WeakPolarHBondContact O-CD1 3.06Å; Y433-I437 WeakPolarHBondContact O-CG1 3.28Å; Y433-I437 PolarHBondContact O-N 3.46Å
434	E	95.5	Very high	95.5	Very high	91 Å²	91	101 Å²	101	43%	0.425	48%	0.482	S	S	.	.	H	α-helix	trans	-65.9	-19.3	173.2	-75.2	-179.2	-164.5	0	0	113.2	R430 A432 R438	R430-E434 WeakPolarHBondContact CD-OE1 3.43Å; R430-E434 HydrophobicContact CG-CG 4.21Å; R430-E434 VanDerWaalsContact CG-OE1 3.28Å; R430-E434 WeakPolarHBondContact CG-OE1 3.1Å; R430-E434 IonicContact CZ-OE1 3.38Å; R430-E434 IonicContact NE-OE1 2.95Å; R430-E434 PolarHBondContact NE-OE1 3.47Å; R430-E434 WeakPolarHBondContact O-CB 3.31Å; R430-E434 WeakPolarHBondContact O-CG 3.35Å; R430-E434 PolarHBondContact O-N 3.33Å; A432-E434 VanDerWaalsContact C-N 3.29Å; A432-E434 PolarHBondContact O-N 2.95Å; E434-R438 WeakPolarHBondContact O-CG 3.48Å; E434-R438 VanDerWaalsContact O-CZ 3.32Å; E434-R438 PolarHBondContact O-NE 2.91Å; E434-R438 PolarHBondContact O-NH2 2.93Å
435	R	96.5	Very high	95.5	Very high	115 Å²	115	101.5 Å²	101.5	43%	0.434	48%	0.481	S	S	.	.	H	α-helix	trans	-81.9	-54	168.6	-167.8	-173.2	-53.2	93.8	9.1	110.2	D431 A432 Y433 I437 R438 D439	D431-R435 PolarHBondContact O-NH2 3.32Å; A432-R435 WeakPolarHBondContact O-CA 3.44Å; A432-R435 VanDerWaalsContact O-CB 3.26Å; A432-R435 WeakPolarHBondContact O-CB 3.42Å; A432-R435 PolarHBondContact O-N 2.8Å; Y433-R435 PolarHBondContact O-N 2.65Å; R435-I437 PolarHBondContact O-N 3.19Å; R435-I437 VanDerWaalsContact O-N 3.16Å; R435-R438 VanDerWaalsContact CA-NH2 3.32Å; R435-R438 WeakPolarHBondContact O-CA 3.31Å; R435-R438 WeakPolarHBondContact O-CB 3.41Å; R435-R438 PolarHBondContact O-N 2.86Å; R435-D439 PolarHBondContact O-N 3.08Å; R435-D439 VanDerWaalsContact O-OD1 3.11Å
436	D	96.5	Very high	95.4	Very high	84 Å²	84	99.3 Å²	99.3	45%	0.449	48%	0.48	S	S	.	.	H	α-helix	trans	-55.9	-38	-178.1	-54.4	-14.4	0	0	0	111.7	A432 Y433 M440	A432-D436 VanDerWaalsContact O-CG 3.31Å; A432-D436 PolarHBondContact O-N 2.99Å; Y433-D436 PolarHBondContact O-N 3.39Å; D436-M440 WeakPolarHBondContact O-CB 3.32Å; D436-M440 PolarHBondContact O-N 3.36Å
437	I	94.1	Very high	95.3	Very high	108 Å²	108	97.1 Å²	97.1	55%	0.554	48%	0.479	S	S	*	.	H	α-helix	trans	-65.9	-39.2	174.5	-70.9	165.8	0	0	0	112.3	Y433 R435 T441	Y433-I437 WeakPolarHBondContact O-CB 3.3Å; Y433-I437 WeakPolarHBondContact O-CD1 3.06Å; Y433-I437 WeakPolarHBondContact O-CG1 3.28Å; Y433-I437 PolarHBondContact O-N 3.46Å; R435-I437 PolarHBondContact O-N 3.19Å; R435-I437 VanDerWaalsContact O-N 3.16Å; I437-T441 WeakPolarHBondContact O-CB 3.34Å; I437-T441 PolarHBondContact O-N 3.41Å; I437-T441 PolarHBondContact O-OG1 3.11Å
438	R	95.8	Very high	95.2	Very high	143 Å²	143	95.6 Å²	95.6	54%	0.54	48%	0.476	S	S	.	.	H	α-helix	trans	-68.4	-48.6	176.7	-79.4	179.9	-73.6	111.8	-6.6	110.9	E434 R435 M440 T441 E442	E434-R438 WeakPolarHBondContact O-CG 3.48Å; E434-R438 VanDerWaalsContact O-CZ 3.32Å; E434-R438 PolarHBondContact O-NE 2.91Å; E434-R438 PolarHBondContact O-NH2 2.93Å; R435-R438 VanDerWaalsContact CA-NH2 3.32Å; R435-R438 WeakPolarHBondContact O-CA 3.31Å; R435-R438 WeakPolarHBondContact O-CB 3.41Å; R435-R438 PolarHBondContact O-N 2.86Å; R438-M440 PolarHBondContact O-N 2.96Å; R438-T441 WeakPolarHBondContact O-CB 3.34Å; R438-T441 PolarHBondContact O-N 3.28Å; R438-E442 PolarHBondContact O-N 3.22Å
439	D	95.6	Very high	95.1	Very high	72 Å²	72	94.5 Å²	94.5	39%	0.385	47%	0.472	S	S	.	.	H	α-helix	trans	-62.1	-34.4	179.8	-60.2	12.1	0	0	0	111	R435 Q443	R435-D439 PolarHBondContact O-N 3.08Å; R435-D439 VanDerWaalsContact O-OD1 3.11Å; D439-Q443 WeakPolarHBondContact O-CG 3.39Å; D439-Q443 PolarHBondContact O-N 2.74Å; D439-Q443 PolarHBondContact O-NE2 3.44Å
440	M	95.2	Very high	95	Very high	112 Å²	112	95.4 Å²	95.4	55%	0.552	48%	0.478	S	S	*	.	H	α-helix	trans	-72.6	-37.2	172.1	-164.5	65.3	59.1	0	0	112.7	D436 R438 Q443 V444	D436-M440 WeakPolarHBondContact O-CB 3.32Å; D436-M440 PolarHBondContact O-N 3.36Å; R438-M440 PolarHBondContact O-N 2.96Å; M440-Q443 PolarHBondContact O-N 2.82Å; M440-V444 WeakPolarHBondContact O-CG2 3.3Å; M440-V444 PolarHBondContact O-N 3.09Å
441	T	95.4	Very high	94.8	Very high	74 Å²	74	94.3 Å²	94.3	45%	0.454	48%	0.481	S	S	.	.	H	α-helix	trans	-65.9	-41.8	176.7	-59.4	0	0	0	0	111	I437 R438 V444 E445	I437-T441 WeakPolarHBondContact O-CB 3.34Å; I437-T441 PolarHBondContact O-N 3.41Å; I437-T441 PolarHBondContact O-OG1 3.11Å; R438-T441 WeakPolarHBondContact O-CB 3.34Å; R438-T441 PolarHBondContact O-N 3.28Å; T441-V444 PolarHBondContact O-N 3.07Å; T441-E445 PolarHBondContact O-N 3.48Å
442	E	95.2	Very high	94.6	Very high	147 Å²	147	93.9 Å²	93.9	69%	0.687	48%	0.48	S	S	*	.	H	α-helix	trans	-61.7	-43.6	174.9	-174.1	170.8	-174.4	0	0	111.6	R438 V444 E445 A446	R438-E442 PolarHBondContact O-N 3.22Å; E442-V444 VanDerWaalsContact C-N 3.32Å; E442-V444 PolarHBondContact O-N 3.27Å; E442-E445 PolarHBondContact O-N 2.79Å; E442-A446 WeakPolarHBondContact O-CB 3.46Å; E442-A446 PolarHBondContact O-N 2.86Å
443	Q	94.8	Very high	94.4	Very high	118 Å²	118	97.3 Å²	97.3	55%	0.551	49%	0.491	S	S	*	.	H	α-helix	trans	-60.5	-38.7	173.1	-76.2	169.5	79.3	0	0	112.8	D439 M440 A447	D439-Q443 WeakPolarHBondContact O-CG 3.39Å; D439-Q443 PolarHBondContact O-N 2.74Å; D439-Q443 PolarHBondContact O-NE2 3.44Å; M440-Q443 PolarHBondContact O-N 2.82Å; Q443-A447 WeakPolarHBondContact O-CB 3.43Å; Q443-A447 PolarHBondContact O-N 3.34Å
444	V	94	Very high	94	Very high	68 Å²	68	96.3 Å²	96.3	41%	0.412	49%	0.486	S	S	.	.	H	α-helix	trans	-68.2	-42	176.7	166.3	0	0	0	0	111.8	M440 T441 E442 A447 K448	M440-V444 WeakPolarHBondContact O-CG2 3.3Å; M440-V444 PolarHBondContact O-N 3.09Å; T441-V444 PolarHBondContact O-N 3.07Å; E442-V444 VanDerWaalsContact C-N 3.32Å; E442-V444 PolarHBondContact O-N 3.27Å; V444-A447 PolarHBondContact O-N 3.36Å; V444-K448 HydrophobicContact CG1-CD 4.16Å; V444-K448 WeakPolarHBondContact O-CB 3.42Å; V444-K448 VanDerWaalsContact O-CG 3.27Å; V444-K448 WeakPolarHBondContact O-CG 3.36Å; V444-K448 PolarHBondContact O-N 2.67Å
445	E	94.1	Very high	93.7	Very high	98 Å²	98	96.7 Å²	96.7	46%	0.458	49%	0.488	S	S	.	.	H	α-helix	trans	-69.6	-35.8	175.6	-64.8	-47.7	132	0	0	112.5	T441 E442 K448 A449	T441-E445 PolarHBondContact O-N 3.48Å; E442-E445 PolarHBondContact O-N 2.79Å; E445-K448 PolarHBondContact O-N 2.69Å; E445-K448 IonicContact OE1-NZ 2.65Å; E445-K448 PolarHBondContact OE1-NZ 3.12Å; E445-K448 VanDerWaalsContact OE2-CD 3.28Å; E445-K448 WeakPolarHBondContact OE2-CD 3.43Å; E445-K448 IonicContact OE2-NZ 3.18Å; E445-A449 WeakPolarHBondContact O-CB 3.35Å; E445-A449 PolarHBondContact O-N 2.86Å
446	A	94.1	Very high	93.4	Very high	55 Å²	55	97.8 Å²	97.8	46%	0.455	49%	0.492	S	S	.	.	H	α-helix	trans	-61.6	-47.3	171.5	0	0	0	0	0	111.7	E442 K448 A449 E450	E442-A446 WeakPolarHBondContact O-CB 3.46Å; E442-A446 PolarHBondContact O-N 2.86Å; A446-K448 VanDerWaalsContact C-N 3.33Å; A446-K448 PolarHBondContact O-N 2.95Å; A446-A449 WeakPolarHBondContact O-CB 3.26Å; A446-A449 PolarHBondContact O-N 3.24Å; A446-A449 VanDerWaalsContact O-N 3.14Å; A446-E450 PolarHBondContact O-N 3Å
447	A	92.4	Very high	93	Very high	61 Å²	61	97 Å²	97	50%	0.504	49%	0.486	S	S	.	.	H	α-helix	trans	-63.8	-35.9	176.7	0	0	0	0	0	112.8	Q443 V444 L451	Q443-A447 WeakPolarHBondContact O-CB 3.43Å; Q443-A447 PolarHBondContact O-N 3.34Å; V444-A447 PolarHBondContact O-N 3.36Å; A447-L451 WeakPolarHBondContact O-CB 3.4Å; A447-L451 PolarHBondContact O-N 3.08Å
448	K	93.9	Very high	92.6	Very high	103 Å²	103	99.4 Å²	99.4	45%	0.448	49%	0.492	S	S	.	.	H	α-helix	trans	-64.6	-44.1	170.4	-74.8	165.7	178.8	175.9	0	111.6	V444 E445 A446 E450 L451 T452	V444-K448 HydrophobicContact CG1-CD 4.16Å; V444-K448 WeakPolarHBondContact O-CB 3.42Å; V444-K448 VanDerWaalsContact O-CG 3.27Å; V444-K448 WeakPolarHBondContact O-CG 3.36Å; V444-K448 PolarHBondContact O-N 2.67Å; E445-K448 PolarHBondContact O-N 2.69Å; E445-K448 IonicContact OE1-NZ 2.65Å; E445-K448 PolarHBondContact OE1-NZ 3.12Å; E445-K448 VanDerWaalsContact OE2-CD 3.28Å; E445-K448 WeakPolarHBondContact OE2-CD 3.43Å; E445-K448 IonicContact OE2-NZ 3.18Å; A446-K448 VanDerWaalsContact C-N 3.33Å; A446-K448 PolarHBondContact O-N 2.95Å; K448-E450 PolarHBondContact O-N 2.68Å; K448-L451 WeakPolarHBondContact O-CB 3.16Å; K448-L451 PolarHBondContact O-N 2.86Å; K448-L451 VanDerWaalsContact O-N 3.17Å; K448-T452 WeakPolarHBondContact O-CG2 3.38Å; K448-T452 PolarHBondContact O-N 3.5Å
449	A	93.8	Very high	92.1	Very high	57 Å²	57	98.6 Å²	98.6	47%	0.471	49%	0.494	S	S	.	.	H	α-helix	trans	-59.3	-47.6	178.3	0	0	0	0	0	111.1	E445 A446 L451 T452 H453	E445-A449 WeakPolarHBondContact O-CB 3.35Å; E445-A449 PolarHBondContact O-N 2.86Å; A446-A449 WeakPolarHBondContact O-CB 3.26Å; A446-A449 PolarHBondContact O-N 3.24Å; A446-A449 VanDerWaalsContact O-N 3.14Å; A449-L451 PolarHBondContact O-N 2.84Å; A449-T452 PolarHBondContact O-N 2.77Å; A449-T452 PolarHBondContact O-OG1 2.93Å; A449-H453 PolarHBondContact O-N 3Å
450	E	93.2	Very high	91.6	Very high	127 Å²	127	100.7 Å²	100.7	59%	0.593	50%	0.502	S	S	*	.	H	α-helix	trans	-57.6	-45	172	-72.9	-166.6	-175.1	0	0	112.5	A446 K448 T452 H453 W454	A446-E450 PolarHBondContact O-N 3Å; K448-E450 PolarHBondContact O-N 2.68Å; E450-T452 VanDerWaalsContact C-N 3.31Å; E450-T452 PolarHBondContact O-N 2.87Å; E450-H453 WeakPolarHBondContact O-CB 3.31Å; E450-H453 PolarHBondContact O-N 3.09Å; E450-W454 PolarHBondContact O-N 3.28Å
451	L	92	Very high	90.8	Very high	103 Å²	103	99.3 Å²	99.3	54%	0.539	50%	0.496	S	S	.	.	H	α-helix	trans	-58.1	-43.9	177.3	-178.8	61.1	0	0	0	111.5	A447 K448 A449 H453 W454 Q455	A447-L451 WeakPolarHBondContact O-CB 3.4Å; A447-L451 PolarHBondContact O-N 3.08Å; K448-L451 WeakPolarHBondContact O-CB 3.16Å; K448-L451 PolarHBondContact O-N 2.86Å; K448-L451 VanDerWaalsContact O-N 3.17Å; A449-L451 PolarHBondContact O-N 2.84Å; L451-H453 VanDerWaalsContact C-N 3.32Å; L451-H453 PolarHBondContact O-N 3.05Å; L451-W454 PolarHBondContact O-N 2.83Å; L451-Q455 VanDerWaalsContact O-CG 3.31Å; L451-Q455 WeakPolarHBondContact O-CG 3.49Å; L451-Q455 PolarHBondContact O-N 3.39Å; L451-Q455 PolarHBondContact O-OE1 3.2Å
452	T	92.5	Very high	90	Very high	53 Å²	53	99 Å²	99	33%	0.325	50%	0.497	S	S	.	.	H	α-helix	trans	-67	-31.3	175.5	72.9	0	0	0	0	112.8	K448 A449 E450 R456	K448-T452 WeakPolarHBondContact O-CG2 3.38Å; K448-T452 PolarHBondContact O-N 3.5Å; A449-T452 PolarHBondContact O-N 2.77Å; A449-T452 PolarHBondContact O-OG1 2.93Å; E450-T452 VanDerWaalsContact C-N 3.31Å; E450-T452 PolarHBondContact O-N 2.87Å; T452-R456 VanDerWaalsContact CB-NH1 3.33Å; T452-R456 WeakPolarHBondContact O-CG 3.34Å; T452-R456 PolarHBondContact O-N 3.41Å; T452-R456 VanDerWaalsContact O-N 3.12Å; T452-R456 PolarHBondContact O-NH1 3.36Å; T452-R456 PolarHBondContact OG1-NH1 3.31Å
453	H	91.5	Very high	89.3	Confident	104 Å²	104	98 Å²	98	48%	0.481	50%	0.496	S	S	.	.	H	α-helix	trans	-61.6	-54.8	173.5	175.5	-79.9	0	0	0	110.2	A449 E450 L451 Q455 R456 E457	A449-H453 PolarHBondContact O-N 3Å; E450-H453 WeakPolarHBondContact O-CB 3.31Å; E450-H453 PolarHBondContact O-N 3.09Å; L451-H453 VanDerWaalsContact C-N 3.32Å; L451-H453 PolarHBondContact O-N 3.05Å; H453-Q455 VanDerWaalsContact C-N 3.27Å; H453-Q455 PolarHBondContact O-N 2.85Å; H453-R456 PolarHBondContact O-N 2.96Å; H453-R456 VanDerWaalsContact O-N 3.16Å; H453-E457 IonicContact CE1-OE2 2.7Å; H453-E457 PolarHBondContact CE1-OE2 3.49Å; H453-E457 IonicContact ND1-OE2 2.81Å; H453-E457 PolarHBondContact O-N 2.96Å
454	W	87.9	Confident	88.3	Confident	130 Å²	130	100.4 Å²	100.4	49%	0.492	50%	0.5	S	S	.	.	H	α-helix	trans	-63.5	-29.5	179.5	-67.1	113.1	0	0	0	113.3	E450 L451 E457 K458	E450-W454 PolarHBondContact O-N 3.28Å; L451-W454 PolarHBondContact O-N 2.83Å; W454-E457 VanDerWaalsContact CE3-OE2 3.26Å; W454-E457 WeakPolarHBondContact CZ3-OE2 3.16Å; W454-K458 VanDerWaalsContact O-CB 3.29Å; W454-K458 WeakPolarHBondContact O-CB 3.4Å; W454-K458 PolarHBondContact O-N 3.19Å
455	Q	90	Very high	87	Confident	99 Å²	99	104.2 Å²	104.2	46%	0.463	52%	0.515	S	S	.	.	H	α-helix	trans	-64.5	-50.2	171.1	-76	172.7	-51.2	0	0	112	L451 H453 E457 K458 E459	L451-Q455 VanDerWaalsContact O-CG 3.31Å; L451-Q455 WeakPolarHBondContact O-CG 3.49Å; L451-Q455 PolarHBondContact O-N 3.39Å; L451-Q455 PolarHBondContact O-OE1 3.2Å; H453-Q455 VanDerWaalsContact C-N 3.27Å; H453-Q455 PolarHBondContact O-N 2.85Å; Q455-E457 VanDerWaalsContact C-N 3.33Å; Q455-E457 PolarHBondContact O-N 3.07Å; Q455-K458 WeakPolarHBondContact O-CB 3.29Å; Q455-K458 PolarHBondContact O-N 2.89Å; Q455-E459 WeakPolarHBondContact O-CG 3.39Å; Q455-E459 PolarHBondContact O-N 2.88Å
456	R	90.5	Very high	86	Confident	138 Å²	138	103.7 Å²	103.7	52%	0.521	53%	0.528	S	S	.	.	H	α-helix	trans	-61.3	-40.4	177	-67.5	179.2	-161.7	91.2	-6.5	112.1	T452 H453 E459 Q460	T452-R456 VanDerWaalsContact CB-NH1 3.33Å; T452-R456 WeakPolarHBondContact O-CG 3.34Å; T452-R456 PolarHBondContact O-N 3.41Å; T452-R456 VanDerWaalsContact O-N 3.12Å; T452-R456 PolarHBondContact O-NH1 3.36Å; T452-R456 PolarHBondContact OG1-NH1 3.31Å; H453-R456 PolarHBondContact O-N 2.96Å; H453-R456 VanDerWaalsContact O-N 3.16Å; R456-E459 PolarHBondContact O-N 3.41Å; R456-Q460 WeakPolarHBondContact O-CG 3.45Å; R456-Q460 PolarHBondContact O-N 2.71Å
457	E	87.5	Confident	84.8	Confident	68 Å²	68	104.5 Å²	104.5	32%	0.318	53%	0.534	S	S	.	.	H	α-helix	trans	-65	-42.7	177.4	-170.2	179	168.4	0	0	111.5	H453 W454 Q455 E459 Q460 L461	H453-E457 IonicContact CE1-OE2 2.7Å; H453-E457 PolarHBondContact CE1-OE2 3.49Å; H453-E457 IonicContact ND1-OE2 2.81Å; H453-E457 PolarHBondContact O-N 2.96Å; W454-E457 VanDerWaalsContact CE3-OE2 3.26Å; W454-E457 WeakPolarHBondContact CZ3-OE2 3.16Å; Q455-E457 VanDerWaalsContact C-N 3.33Å; Q455-E457 PolarHBondContact O-N 3.07Å; E457-E459 VanDerWaalsContact C-N 3.31Å; E457-E459 PolarHBondContact O-N 3.46Å; E457-Q460 PolarHBondContact O-N 2.95Å; E457-L461 HydrophobicContact CG-CD1 4.24Å; E457-L461 WeakPolarHBondContact O-CB 3.45Å; E457-L461 WeakPolarHBondContact O-CG 3.33Å; E457-L461 PolarHBondContact O-N 2.98Å
458	K	84.8	Confident	83.2	Confident	158 Å²	158	104.8 Å²	104.8	69%	0.687	54%	0.543	S	S	*	.	H	α-helix	trans	-58.7	-41.1	173	-178.6	-170.5	172.9	-167.1	0	111.9	W454 Q455 L461 S462	W454-K458 VanDerWaalsContact O-CB 3.29Å; W454-K458 WeakPolarHBondContact O-CB 3.4Å; W454-K458 PolarHBondContact O-N 3.19Å; Q455-K458 WeakPolarHBondContact O-CB 3.29Å; Q455-K458 PolarHBondContact O-N 2.89Å; K458-L461 PolarHBondContact O-N 3.29Å; K458-S462 WeakPolarHBondContact O-CB 3.48Å; K458-S462 PolarHBondContact O-N 3.43Å
459	E	86.1	Confident	81.4	Confident	125 Å²	125	104.9 Å²	104.9	58%	0.584	55%	0.552	S	S	*	*	H	α-helix	trans	-65	-44.9	176.3	-72.7	167.8	-177.9	0	0	111.8	Q455 R456 E457 L461 S462 L463	Q455-E459 WeakPolarHBondContact O-CG 3.39Å; Q455-E459 PolarHBondContact O-N 2.88Å; R456-E459 PolarHBondContact O-N 3.41Å; E457-E459 VanDerWaalsContact C-N 3.31Å; E457-E459 PolarHBondContact O-N 3.46Å; E459-L461 PolarHBondContact O-N 3.34Å; E459-S462 WeakPolarHBondContact O-CB 3.41Å; E459-S462 PolarHBondContact O-N 3.21Å; E459-L463 WeakPolarHBondContact O-CG 3.4Å; E459-L463 PolarHBondContact O-N 3.11Å
460	Q	83.9	Confident	79.6	Confident	116 Å²	116	107.8 Å²	107.8	54%	0.542	56%	0.56	S	S	.	*	H	α-helix	trans	-61.3	-40.7	174.5	-70.6	-179.3	25.8	0	0	112.7	R456 E457 L463 R464	R456-Q460 WeakPolarHBondContact O-CG 3.45Å; R456-Q460 PolarHBondContact O-N 2.71Å; E457-Q460 PolarHBondContact O-N 2.95Å; Q460-L463 PolarHBondContact O-N 2.67Å; Q460-R464 PolarHBondContact O-N 3.22Å
461	L	78.6	Confident	78	Confident	84 Å²	84	108.4 Å²	108.4	44%	0.44	56%	0.564	S	S	.	*	H	α-helix	trans	-67.1	-39.3	175	-69.9	171.1	0	0	0	111.6	E457 K458 E459 L463 R464 M465	E457-L461 HydrophobicContact CG-CD1 4.24Å; E457-L461 WeakPolarHBondContact O-CB 3.45Å; E457-L461 WeakPolarHBondContact O-CG 3.33Å; E457-L461 PolarHBondContact O-N 2.98Å; K458-L461 PolarHBondContact O-N 3.29Å; E459-L461 PolarHBondContact O-N 3.34Å; L461-L463 VanDerWaalsContact C-N 3.35Å; L461-L463 PolarHBondContact O-N 3.2Å; L461-R464 PolarHBondContact O-N 3.11Å; L461-M465 WeakPolarHBondContact O-CG 3.32Å; L461-M465 PolarHBondContact O-N 2.86Å
462	S	79.1	Confident	76.4	Confident	68 Å²	68	109.7 Å²	109.7	48%	0.476	57%	0.572	S	S	.	*	H	α-helix	trans	-62.9	-40.1	174.3	-163.8	0	0	0	0	112.2	K458 E459 M465 A466	K458-S462 WeakPolarHBondContact O-CB 3.48Å; K458-S462 PolarHBondContact O-N 3.43Å; E459-S462 WeakPolarHBondContact O-CB 3.41Å; E459-S462 PolarHBondContact O-N 3.21Å; S462-M465 PolarHBondContact O-N 3.09Å; S462-A466 PolarHBondContact O-N 3.14Å
463	L	80.1	Confident	75	Confident	125 Å²	125	111 Å²	111	65%	0.654	58%	0.581	S	S	*	*	H	α-helix	trans	-64.5	-40	173.7	-75.4	162.7	0	0	0	112	E459 Q460 L461 A466 A467	E459-L463 WeakPolarHBondContact O-CG 3.4Å; E459-L463 PolarHBondContact O-N 3.11Å; Q460-L463 PolarHBondContact O-N 2.67Å; L461-L463 VanDerWaalsContact C-N 3.35Å; L461-L463 PolarHBondContact O-N 3.2Å; L463-A466 PolarHBondContact O-N 2.81Å; L463-A467 PolarHBondContact O-N 3.2Å; L463-A467 VanDerWaalsContact O-N 3.12Å
464	R	74.1	Confident	73.6	Confident	169 Å²	169	109 Å²	109	64%	0.638	58%	0.576	S	S	*	*	H	α-helix	trans	-65	-39.3	174.1	-77.8	-178	176	156.1	1.6	113	Q460 L461 A466 A467	Q460-R464 PolarHBondContact O-N 3.22Å; L461-R464 PolarHBondContact O-N 3.11Å; R464-A466 VanDerWaalsContact C-N 3.34Å; R464-A467 WeakPolarHBondContact O-CB 3.47Å; R464-A467 PolarHBondContact O-N 3.04Å
465	M	66.7	Low	72.4	Confident	147 Å²	147	108.9 Å²	108.9	72%	0.724	58%	0.583	S	S	*	*	H	α-helix	trans	-64.4	-39.3	174.3	-69.9	-169.3	-61.9	0	0	111.8	L461 S462 A467 G468	L461-M465 WeakPolarHBondContact O-CG 3.32Å; L461-M465 PolarHBondContact O-N 2.86Å; S462-M465 PolarHBondContact O-N 3.09Å; M465-A467 PolarHBondContact O-N 2.71Å; M465-G468 PolarHBondContact O-N 3.11Å
466	A	72.9	Confident	71.4	Confident	88 Å²	88	111.2 Å²	111.2	73%	0.727	59%	0.593	S	S	*	*	H	α-helix	trans	-66.2	-22.1	174.5	0	0	0	0	0	113.5	S462 L463 R464 G468	S462-A466 PolarHBondContact O-N 3.14Å; L463-A466 PolarHBondContact O-N 2.81Å; R464-A466 VanDerWaalsContact C-N 3.34Å; A466-G468 VanDerWaalsContact C-N 3.31Å; A466-G468 PolarHBondContact O-N 2.71Å
467	A	68.7	Low	70.4	Confident	71 Å²	71	110.5 Å²	110.5	59%	0.587	60%	0.596	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.7	1.5	179.6	0	0	0	0	0	114.9	L463 R464 M465 V469	L463-A467 PolarHBondContact O-N 3.2Å; L463-A467 VanDerWaalsContact O-N 3.12Å; R464-A467 WeakPolarHBondContact O-CB 3.47Å; R464-A467 PolarHBondContact O-N 3.04Å; M465-A467 PolarHBondContact O-N 2.71Å; A467-V469 HydrophobicContact CB-CG2 4.41Å; A467-V469 PolarHBondContact O-N 2.63Å
468	G	59.2	Low	69.7	Low	68 Å²	68	114.1 Å²	114.1	70%	0.701	61%	0.608	S	S	*	*	T	Hydrogen-bonded Turn	trans	67.1	29.8	167.2	0	0	0	0	0	116.2	M465 A466	M465-G468 PolarHBondContact O-N 3.11Å; A466-G468 VanDerWaalsContact C-N 3.31Å; A466-G468 PolarHBondContact O-N 2.71Å
469	V	57.1	Low	69.4	Low	104 Å²	104	113.4 Å²	113.4	63%	0.63	61%	0.605	S	S	*	*			trans	-75.3	150.5	-177.6	-175.9	0	0	0	0	111.8	A467 M471	A467-V469 HydrophobicContact CB-CG2 4.41Å; A467-V469 PolarHBondContact O-N 2.63Å; V469-M471 PolarHBondContact O-N 2.76Å
470	D	55.9	Low	69.1	Low	118 Å²	118	111.2 Å²	111.2	63%	0.631	60%	0.6	S	S	*	*			trans	-46.8	127.7	-175	-173.2	-5.8	0	0	0	114.1	N472	D470-N472 PolarHBondContact OD1-N 3.43Å; D470-N472 VanDerWaalsContact OD1-N 3.15Å
471	M	59.1	Low	68.9	Low	140 Å²	140	111 Å²	111	69%	0.69	60%	0.602	S	S	*	*	S	Bend	trans	-81.4	-11.7	-170.7	-72.2	-74.1	-172.7	0	0	114.5	V469 V474 M475	V469-M471 PolarHBondContact O-N 2.76Å; M471-V474 VanDerWaalsContact O-CB 3.31Å; M471-V474 WeakPolarHBondContact O-CB 3.49Å; M471-V474 PolarHBondContact O-N 2.81Å; M471-M475 PolarHBondContact O-N 2.75Å
472	N	59	Low	68.9	Low	131 Å²	131	110.5 Å²	110.5	70%	0.701	60%	0.597	S	S	*	*	H	α-helix	trans	-65.2	-52	-170.4	-148.5	6.4	0	0	0	114.2	D470 V474 M475	D470-N472 PolarHBondContact OD1-N 3.43Å; D470-N472 VanDerWaalsContact OD1-N 3.15Å; N472-V474 PolarHBondContact O-N 3.31Å; N472-M475 PolarHBondContact O-N 2.79Å
473	P	62.7	Low	69.1	Low	79 Å²	79	111 Å²	111	51%	0.513	60%	0.601	S	S	.	*	H	α-helix	trans	-67.6	-21.2	173.8	28.7	-35.7	0	0	0	112.9	M475 E476 Q477	P473-M475 VanDerWaalsContact C-N 3.25Å; P473-M475 PolarHBondContact O-N 3.49Å; P473-E476 PolarHBondContact O-N 3.41Å; P473-Q477 PolarHBondContact O-N 2.74Å
474	V	61.5	Low	69.3	Low	63 Å²	63	109.6 Å²	109.6	38%	0.382	59%	0.592	S	S	.	*	H	α-helix	trans	-64.2	-30.9	179.1	-173	0	0	0	0	111	M471 N472 E476 Y478	M471-V474 VanDerWaalsContact O-CB 3.31Å; M471-V474 WeakPolarHBondContact O-CB 3.49Å; M471-V474 PolarHBondContact O-N 2.81Å; N472-V474 PolarHBondContact O-N 3.31Å; V474-E476 PolarHBondContact O-N 2.77Å; V474-Y478 WeakPolarHBondContact O-CB 3.41Å; V474-Y478 PolarHBondContact O-N 2.94Å
475	M	63.6	Low	69.8	Low	128 Å²	128	108.9 Å²	108.9	63%	0.631	59%	0.59	S	S	*	*	H	α-helix	trans	-71.7	-30.2	-178.9	-169.4	158.8	-70.5	0	0	113.8	M471 N472 P473 K479	M471-M475 PolarHBondContact O-N 2.75Å; N472-M475 PolarHBondContact O-N 2.79Å; P473-M475 VanDerWaalsContact C-N 3.25Å; P473-M475 PolarHBondContact O-N 3.49Å; M475-K479 WeakPolarHBondContact O-CG 3.06Å; M475-K479 PolarHBondContact O-N 2.87Å; M475-K479 VanDerWaalsContact O-N 3.1Å
476	E	69	Low	70.8	Confident	147 Å²	147	106.2 Å²	106.2	69%	0.687	58%	0.575	S	S	*	*	H	α-helix	trans	-81.9	-35.9	176.2	-164.8	155.8	-115.3	0	0	111.7	P473 V474 Y478 K479 T480	P473-E476 PolarHBondContact O-N 3.41Å; V474-E476 PolarHBondContact O-N 2.77Å; E476-Y478 VanDerWaalsContact C-N 3.31Å; E476-Y478 PolarHBondContact O-N 3.38Å; E476-K479 PolarHBondContact O-N 2.93Å; E476-T480 PolarHBondContact O-N 2.8Å; E476-T480 PolarHBondContact O-OG1 3.46Å
477	Q	69.1	Low	71.6	Confident	123 Å²	123	104.5 Å²	104.5	58%	0.575	56%	0.561	S	S	*	*	H	α-helix	trans	-60.1	-40.6	164.8	-69.4	-176.2	-4.3	0	0	111.7	P473 T480 L481	P473-Q477 PolarHBondContact O-N 2.74Å; Q477-T480 WeakPolarHBondContact O-CB 3.24Å; Q477-T480 PolarHBondContact O-N 2.91Å; Q477-L481 WeakPolarHBondContact O-CB 3.43Å; Q477-L481 WeakPolarHBondContact O-CG 3.37Å; Q477-L481 PolarHBondContact O-N 2.81Å
478	Y	73.1	Confident	72.6	Confident	145 Å²	145	108.3 Å²	108.3	57%	0.569	56%	0.56	S	S	*	*	H	α-helix	trans	-63.2	-45.2	177.4	179.7	-94.9	0	0	0	112.2	V474 E476 T480 L481 Q482	V474-Y478 WeakPolarHBondContact O-CB 3.41Å; V474-Y478 PolarHBondContact O-N 2.94Å; E476-Y478 VanDerWaalsContact C-N 3.31Å; E476-Y478 PolarHBondContact O-N 3.38Å; Y478-T480 VanDerWaalsContact C-N 3.29Å; Y478-T480 PolarHBondContact O-N 3.21Å; Y478-L481 PolarHBondContact O-N 2.8Å; Y478-Q482 VanDerWaalsContact O-CB 3.29Å; Y478-Q482 WeakPolarHBondContact O-CB 3.36Å; Y478-Q482 PolarHBondContact O-N 3.36Å
479	K	77.9	Confident	74.1	Confident	142 Å²	142	107.8 Å²	107.8	62%	0.617	54%	0.541	S	S	*	.	H	α-helix	trans	-58.8	-41.2	172.5	-74.5	175.4	-178.6	174.1	0	112	M475 E476 Q482 S483	M475-K479 WeakPolarHBondContact O-CG 3.06Å; M475-K479 PolarHBondContact O-N 2.87Å; M475-K479 VanDerWaalsContact O-N 3.1Å; E476-K479 PolarHBondContact O-N 2.93Å; K479-Q482 PolarHBondContact O-N 2.81Å; K479-S483 WeakPolarHBondContact O-CB 3.04Å; K479-S483 PolarHBondContact O-N 2.89Å
480	T	80.2	Confident	75.7	Confident	80 Å²	80	109.1 Å²	109.1	49%	0.491	54%	0.538	S	S	.	.	H	α-helix	trans	-66.5	-47.7	178.2	-54.3	0	0	0	0	111.3	E476 Q477 Y478 Q482 S483 M484	E476-T480 PolarHBondContact O-N 2.8Å; E476-T480 PolarHBondContact O-OG1 3.46Å; Q477-T480 WeakPolarHBondContact O-CB 3.24Å; Q477-T480 PolarHBondContact O-N 2.91Å; Y478-T480 VanDerWaalsContact C-N 3.29Å; Y478-T480 PolarHBondContact O-N 3.21Å; T480-Q482 VanDerWaalsContact C-N 3.3Å; T480-Q482 PolarHBondContact O-N 3.46Å; T480-S483 PolarHBondContact O-N 3.39Å; T480-M484 HydrophobicContact CG2-SD 4.44Å; T480-M484 WeakPolarHBondContact O-CG 3.19Å; T480-M484 PolarHBondContact O-N 2.82Å
481	L	79.5	Confident	77.3	Confident	111 Å²	111	106.8 Å²	106.8	58%	0.581	53%	0.528	S	S	*	.	H	α-helix	trans	-61.1	-35.9	174.3	-82.1	163.6	0	0	0	112.4	Q477 Y478 M484 R485	Q477-L481 WeakPolarHBondContact O-CB 3.43Å; Q477-L481 WeakPolarHBondContact O-CG 3.37Å; Q477-L481 PolarHBondContact O-N 2.81Å; Y478-L481 PolarHBondContact O-N 2.8Å; L481-M484 PolarHBondContact O-N 2.7Å; L481-R485 VanDerWaalsContact O-CB 3.27Å; L481-R485 WeakPolarHBondContact O-CB 3.23Å; L481-R485 PolarHBondContact O-N 3.21Å
482	Q	78.7	Confident	78.7	Confident	73 Å²	73	104.1 Å²	104.1	34%	0.341	52%	0.516	S	S	.	.	H	α-helix	trans	-71.1	-42.7	176.5	-179.2	150.1	-18.6	0	0	111.7	Y478 K479 T480 M484 R485 E486	Y478-Q482 VanDerWaalsContact O-CB 3.29Å; Y478-Q482 WeakPolarHBondContact O-CB 3.36Å; Y478-Q482 PolarHBondContact O-N 3.36Å; K479-Q482 PolarHBondContact O-N 2.81Å; T480-Q482 VanDerWaalsContact C-N 3.3Å; T480-Q482 PolarHBondContact O-N 3.46Å; Q482-M484 VanDerWaalsContact C-N 3.33Å; Q482-M484 PolarHBondContact O-N 3.04Å; Q482-R485 WeakPolarHBondContact O-CB 3.24Å; Q482-R485 PolarHBondContact O-N 3.42Å; Q482-R485 VanDerWaalsContact O-N 3.12Å; Q482-E486 VanDerWaalsContact CG-OE1 3.27Å; Q482-E486 WeakPolarHBondContact CG-OE1 3.32Å; Q482-E486 PolarHBondContact NE2-OE1 2.94Å; Q482-E486 VanDerWaalsContact NE2-OE1 3.1Å; Q482-E486 WeakPolarHBondContact O-CG 3.49Å; Q482-E486 PolarHBondContact O-N 2.96Å
483	S	82.7	Confident	80.2	Confident	78 Å²	78	102.4 Å²	102.4	55%	0.545	50%	0.504	S	S	.	.	H	α-helix	trans	-57.8	-44.8	170.1	-178.3	0	0	0	0	111.7	K479 T480 R485 E486 A487	K479-S483 WeakPolarHBondContact O-CB 3.04Å; K479-S483 PolarHBondContact O-N 2.89Å; T480-S483 PolarHBondContact O-N 3.39Å; S483-R485 VanDerWaalsContact C-N 3.34Å; S483-R485 PolarHBondContact O-N 3.27Å; S483-E486 PolarHBondContact O-N 3.21Å; S483-A487 WeakPolarHBondContact O-CB 3.23Å; S483-A487 PolarHBondContact O-N 3.31Å
484	M	84.3	Confident	81.6	Confident	97 Å²	97	104.8 Å²	104.8	48%	0.478	51%	0.508	S	S	.	.	H	α-helix	trans	-63.7	-35.7	173.6	-71.1	177.1	69.5	0	0	113	T480 L481 Q482 R488	T480-M484 HydrophobicContact CG2-SD 4.44Å; T480-M484 WeakPolarHBondContact O-CG 3.19Å; T480-M484 PolarHBondContact O-N 2.82Å; L481-M484 PolarHBondContact O-N 2.7Å; Q482-M484 VanDerWaalsContact C-N 3.33Å; Q482-M484 PolarHBondContact O-N 3.04Å; M484-R488 WeakPolarHBondContact O-CB 3.31Å; M484-R488 WeakPolarHBondContact O-CG 3.29Å; M484-R488 PolarHBondContact O-N 3.23Å
485	R	85.8	Confident	83	Confident	154 Å²	154	107 Å²	107	58%	0.581	52%	0.517	S	S	*	.	H	α-helix	trans	-67.7	-43.5	175.6	-179.6	-179.5	177.5	-83.7	-1.5	111.1	L481 Q482 S483 R488 I489	L481-R485 VanDerWaalsContact O-CB 3.27Å; L481-R485 WeakPolarHBondContact O-CB 3.23Å; L481-R485 PolarHBondContact O-N 3.21Å; Q482-R485 WeakPolarHBondContact O-CB 3.24Å; Q482-R485 PolarHBondContact O-N 3.42Å; Q482-R485 VanDerWaalsContact O-N 3.12Å; S483-R485 VanDerWaalsContact C-N 3.34Å; S483-R485 PolarHBondContact O-N 3.27Å; R485-R488 PolarHBondContact O-N 3.47Å; R485-I489 HydrophobicContact CG-CD1 4.06Å; R485-I489 WeakPolarHBondContact O-CB 3.22Å; R485-I489 VanDerWaalsContact O-CG1 3.26Å; R485-I489 WeakPolarHBondContact O-CG1 3.31Å; R485-I489 PolarHBondContact O-N 2.86Å
486	E	87.7	Confident	84.3	Confident	91 Å²	91	108.7 Å²	108.7	43%	0.425	52%	0.516	S	S	.	.	H	α-helix	trans	-67.3	-37.6	176.7	-71.7	170.2	-157.4	0	0	111.6	Q482 S483 I489 K490	Q482-E486 VanDerWaalsContact CG-OE1 3.27Å; Q482-E486 WeakPolarHBondContact CG-OE1 3.32Å; Q482-E486 PolarHBondContact NE2-OE1 2.94Å; Q482-E486 VanDerWaalsContact NE2-OE1 3.1Å; Q482-E486 WeakPolarHBondContact O-CG 3.49Å; Q482-E486 PolarHBondContact O-N 2.96Å; S483-E486 PolarHBondContact O-N 3.21Å; E486-I489 PolarHBondContact O-N 2.76Å; E486-K490 WeakPolarHBondContact O-CG 3.32Å; E486-K490 PolarHBondContact O-N 3.5Å; E486-K490 VanDerWaalsContact O-N 3.08Å
487	A	89.1	Confident	85.4	Confident	51 Å²	51	107 Å²	107	42%	0.421	51%	0.512	S	S	.	.	H	α-helix	trans	-62.3	-49	169.6	0	0	0	0	0	111.9	S483 I489 K490 T491	S483-A487 WeakPolarHBondContact O-CB 3.23Å; S483-A487 PolarHBondContact O-N 3.31Å; A487-I489 VanDerWaalsContact C-N 3.31Å; A487-I489 PolarHBondContact O-N 2.77Å; A487-K490 PolarHBondContact O-N 3.27Å; A487-T491 PolarHBondContact O-N 2.98Å; A487-T491 PolarHBondContact O-OG1 3.46Å
488	R	89.3	Confident	86.4	Confident	151 Å²	151	107.2 Å²	107.2	57%	0.57	51%	0.511	S	S	*	.	H	α-helix	trans	-61.3	-35.9	176	-77.8	-177.1	177.3	-164.1	0.6	112.6	M484 R485 T491 I492	M484-R488 WeakPolarHBondContact O-CB 3.31Å; M484-R488 WeakPolarHBondContact O-CG 3.29Å; M484-R488 PolarHBondContact O-N 3.23Å; R485-R488 PolarHBondContact O-N 3.47Å; R488-T491 PolarHBondContact O-N 3.41Å; R488-I492 WeakPolarHBondContact O-CB 3.18Å; R488-I492 WeakPolarHBondContact O-CD1 3.02Å; R488-I492 VanDerWaalsContact O-CG1 3.26Å; R488-I492 WeakPolarHBondContact O-CG1 3.35Å; R488-I492 PolarHBondContact O-N 3.29Å
489	I	90.2	Very high	87.2	Confident	58 Å²	58	106 Å²	106	30%	0.297	51%	0.513	S	S	.	.	H	α-helix	trans	-62.5	-47.5	173.8	-74.2	164.6	0	0	0	110.4	R485 E486 A487 T491 I492 E493	R485-I489 HydrophobicContact CG-CD1 4.06Å; R485-I489 WeakPolarHBondContact O-CB 3.22Å; R485-I489 VanDerWaalsContact O-CG1 3.26Å; R485-I489 WeakPolarHBondContact O-CG1 3.31Å; R485-I489 PolarHBondContact O-N 2.86Å; E486-I489 PolarHBondContact O-N 2.76Å; A487-I489 VanDerWaalsContact C-N 3.31Å; A487-I489 PolarHBondContact O-N 2.77Å; I489-T491 VanDerWaalsContact C-N 3.3Å; I489-T491 PolarHBondContact O-N 3.07Å; I489-I492 CarbonylContact O-C 3.59Å; I489-I492 PolarHBondContact O-N 2.8Å; I489-I492 VanDerWaalsContact O-N 3.08Å; I489-E493 WeakPolarHBondContact O-CG 3.46Å; I489-E493 PolarHBondContact O-N 3.42Å
490	K	90.5	Very high	87.8	Confident	132 Å²	132	103.1 Å²	103.1	57%	0.574	51%	0.505	S	S	*	.	H	α-helix	trans	-59.7	-38.8	174.8	-70.9	171.8	-178.9	173.7	0	112.3	E486 A487 E493 Q494	E486-K490 WeakPolarHBondContact O-CG 3.32Å; E486-K490 PolarHBondContact O-N 3.5Å; E486-K490 VanDerWaalsContact O-N 3.08Å; A487-K490 PolarHBondContact O-N 3.27Å; K490-E493 PolarHBondContact O-N 3.09Å; K490-Q494 WeakPolarHBondContact O-CB 3.43Å; K490-Q494 VanDerWaalsContact O-CG 3.27Å; K490-Q494 WeakPolarHBondContact O-CG 3.3Å; K490-Q494 PolarHBondContact O-N 3.41Å
491	T	89.4	Confident	88.3	Confident	69 Å²	69	104.8 Å²	104.8	42%	0.423	51%	0.507	S	S	.	.	H	α-helix	trans	-65.9	-39.4	173.5	-51.5	0	0	0	0	112.2	A487 R488 I489 E493 Q494 L495	A487-T491 PolarHBondContact O-N 2.98Å; A487-T491 PolarHBondContact O-OG1 3.46Å; R488-T491 PolarHBondContact O-N 3.41Å; I489-T491 VanDerWaalsContact C-N 3.3Å; I489-T491 PolarHBondContact O-N 3.07Å; T491-E493 VanDerWaalsContact C-N 3.35Å; T491-Q494 PolarHBondContact O-N 3.46Å; T491-L495 HydrophobicContact CG2-CD1 4.23Å; T491-L495 WeakPolarHBondContact O-CB 3.39Å; T491-L495 VanDerWaalsContact O-CG 3.29Å; T491-L495 WeakPolarHBondContact O-CG 3.47Å; T491-L495 PolarHBondContact O-N 3.04Å
492	I	89.8	Confident	88.8	Confident	83 Å²	83	104.1 Å²	104.1	43%	0.426	50%	0.504	S	S	.	.	H	α-helix	trans	-65.9	-37.7	174.9	-70.9	162.7	0	0	0	111	R488 I489 L495 R496	R488-I492 WeakPolarHBondContact O-CB 3.18Å; R488-I492 WeakPolarHBondContact O-CD1 3.02Å; R488-I492 VanDerWaalsContact O-CG1 3.26Å; R488-I492 WeakPolarHBondContact O-CG1 3.35Å; R488-I492 PolarHBondContact O-N 3.29Å; I489-I492 CarbonylContact O-C 3.59Å; I489-I492 PolarHBondContact O-N 2.8Å; I489-I492 VanDerWaalsContact O-N 3.08Å; I492-L495 PolarHBondContact O-N 3.16Å; I492-R496 HydrophobicContact CG2-CG 4.49Å; I492-R496 WeakPolarHBondContact O-CB 3.34Å; I492-R496 VanDerWaalsContact O-CG 3.23Å; I492-R496 WeakPolarHBondContact O-CG 3.41Å; I492-R496 PolarHBondContact O-N 3.42Å
493	E	91	Very high	89.2	Confident	96 Å²	96	105.1 Å²	105.1	45%	0.449	51%	0.511	S	S	.	.	H	α-helix	trans	-67	-42.3	174	-71.7	168.9	170.7	0	0	111.8	I489 K490 T491 L495 R496 N497	I489-E493 WeakPolarHBondContact O-CG 3.46Å; I489-E493 PolarHBondContact O-N 3.42Å; K490-E493 PolarHBondContact O-N 3.09Å; T491-E493 VanDerWaalsContact C-N 3.35Å; E493-L495 PolarHBondContact O-N 3.07Å; E493-R496 PolarHBondContact O-N 3.07Å; E493-N497 WeakPolarHBondContact O-CB 3.39Å; E493-N497 VanDerWaalsContact O-CG 3.22Å; E493-N497 PolarHBondContact O-N 3.02Å
494	Q	90.4	Very high	89.6	Confident	129 Å²	129	106.2 Å²	106.2	60%	0.603	51%	0.508	S	S	*	.	H	α-helix	trans	-59.6	-44.7	171.6	-74.2	168.8	-19.5	0	0	112	K490 T491 N497 K498	K490-Q494 WeakPolarHBondContact O-CB 3.43Å; K490-Q494 VanDerWaalsContact O-CG 3.27Å; K490-Q494 WeakPolarHBondContact O-CG 3.3Å; K490-Q494 PolarHBondContact O-N 3.41Å; T491-Q494 PolarHBondContact O-N 3.46Å; Q494-N497 PolarHBondContact O-N 3.2Å; Q494-K498 WeakPolarHBondContact O-CB 3.45Å; Q494-K498 PolarHBondContact O-N 2.83Å
495	L	90.9	Very high	89.8	Confident	110 Å²	110	105.1 Å²	105.1	58%	0.576	50%	0.504	S	S	*	.	H	α-helix	trans	-67.1	-37.4	177	-72.3	170.3	0	0	0	112.3	T491 I492 E493 K498 L499	T491-L495 HydrophobicContact CG2-CD1 4.23Å; T491-L495 WeakPolarHBondContact O-CB 3.39Å; T491-L495 VanDerWaalsContact O-CG 3.29Å; T491-L495 WeakPolarHBondContact O-CG 3.47Å; T491-L495 PolarHBondContact O-N 3.04Å; I492-L495 PolarHBondContact O-N 3.16Å; E493-L495 PolarHBondContact O-N 3.07Å; L495-K498 PolarHBondContact O-N 2.57Å; L495-L499 VanDerWaalsContact O-CB 3.28Å; L495-L499 WeakPolarHBondContact O-CB 3.45Å; L495-L499 PolarHBondContact O-N 3.36Å
496	R	92.4	Very high	89.8	Confident	163 Å²	163	103.9 Å²	103.9	62%	0.615	51%	0.507	S	S	*	.	H	α-helix	trans	-64.6	-43.1	173	-78.1	168.8	173	-178.4	-3.8	112.2	I492 E493 L499 N500	I492-R496 HydrophobicContact CG2-CG 4.49Å; I492-R496 WeakPolarHBondContact O-CB 3.34Å; I492-R496 VanDerWaalsContact O-CG 3.23Å; I492-R496 WeakPolarHBondContact O-CG 3.41Å; I492-R496 PolarHBondContact O-N 3.42Å; E493-R496 PolarHBondContact O-N 3.07Å; R496-L499 PolarHBondContact O-N 2.9Å; R496-N500 WeakPolarHBondContact O-CB 3.35Å; R496-N500 PolarHBondContact O-N 2.94Å
497	N	91.3	Very high	89.8	Confident	111 Å²	111	102.8 Å²	102.8	59%	0.594	51%	0.506	S	S	*	.	H	α-helix	trans	-64.1	-42.6	176.1	-69.9	-10	0	0	0	110.9	E493 Q494 N500 E501	E493-N497 WeakPolarHBondContact O-CB 3.39Å; E493-N497 VanDerWaalsContact O-CG 3.22Å; E493-N497 PolarHBondContact O-N 3.02Å; Q494-N497 PolarHBondContact O-N 3.2Å; N497-N500 PolarHBondContact O-N 2.87Å; N497-E501 WeakPolarHBondContact O-CB 3.14Å; N497-E501 PolarHBondContact O-N 3.16Å
498	K	90.5	Very high	89.8	Confident	127 Å²	127	106 Å²	106	55%	0.552	51%	0.512	S	S	*	.	H	α-helix	trans	-68.7	-31	176	-166.3	170.3	-174.2	176.9	0	113.3	Q494 L495 L502	Q494-K498 WeakPolarHBondContact O-CB 3.45Å; Q494-K498 PolarHBondContact O-N 2.83Å; L495-K498 PolarHBondContact O-N 2.57Å; K498-L502 WeakPolarHBondContact O-CB 3.1Å; K498-L502 WeakPolarHBondContact O-CG 3.33Å; K498-L502 PolarHBondContact O-N 3.43Å
499	L	89.8	Confident	89.7	Confident	119 Å²	119	104.7 Å²	104.7	62%	0.623	51%	0.513	S	S	*	.	H	α-helix	trans	-68.7	-42.3	172	-177	64	0	0	0	111.2	L495 R496 L502 D503	L495-L499 VanDerWaalsContact O-CB 3.28Å; L495-L499 WeakPolarHBondContact O-CB 3.45Å; L495-L499 PolarHBondContact O-N 3.36Å; R496-L499 PolarHBondContact O-N 2.9Å; L499-L502 PolarHBondContact O-N 3.2Å; L499-D503 WeakPolarHBondContact O-CB 3.42Å; L499-D503 PolarHBondContact O-N 2.71Å
500	N	90.9	Very high	89.5	Confident	83 Å²	83	103.8 Å²	103.8	44%	0.444	52%	0.517	S	S	.	.	H	α-helix	trans	-64.5	-38.9	173.9	-171.7	7.5	0	0	0	111.6	R496 N497 D503 Q504	R496-N500 WeakPolarHBondContact O-CB 3.35Å; R496-N500 PolarHBondContact O-N 2.94Å; N497-N500 PolarHBondContact O-N 2.87Å; N500-D503 PolarHBondContact O-N 3.2Å; N500-Q504 WeakPolarHBondContact O-CB 3.28Å; N500-Q504 VanDerWaalsContact O-CG 3.24Å; N500-Q504 WeakPolarHBondContact O-CG 3.39Å; N500-Q504 PolarHBondContact O-N 2.71Å; N500-Q504 PolarHBondContact OD1-NE2 3.26Å
501	E	89.6	Confident	89.5	Confident	114 Å²	114	103.6 Å²	103.6	53%	0.533	52%	0.518	S	S	.	.	H	α-helix	trans	-63.5	-42.3	171.7	-176.4	-178.1	-164.9	0	0	111.9	N497 N505	N497-E501 WeakPolarHBondContact O-CB 3.14Å; N497-E501 PolarHBondContact O-N 3.16Å; E501-N505 WeakPolarHBondContact O-CB 3.34Å; E501-N505 VanDerWaalsContact O-CG 3.29Å; E501-N505 PolarHBondContact O-N 3.31Å; E501-N505 PolarHBondContact O-ND2 3.31Å
502	L	89.7	Confident	89.3	Confident	98 Å²	98	104.8 Å²	104.8	51%	0.513	52%	0.519	S	S	.	.	H	α-helix	trans	-65.3	-41.1	174	-83.6	162.6	0	0	0	112.5	K498 L499 N505 M506	K498-L502 WeakPolarHBondContact O-CB 3.1Å; K498-L502 WeakPolarHBondContact O-CG 3.33Å; K498-L502 PolarHBondContact O-N 3.43Å; L499-L502 PolarHBondContact O-N 3.2Å; L502-N505 PolarHBondContact O-N 3.04Å; L502-M506 VanDerWaalsContact O-CB 3.3Å; L502-M506 WeakPolarHBondContact O-CB 3.35Å; L502-M506 PolarHBondContact O-N 3.29Å
503	D	89	Confident	89.1	Confident	93 Å²	93	106 Å²	106	50%	0.497	53%	0.526	S	S	.	.	H	α-helix	trans	-66.5	-41.1	177.6	-170.2	60.7	0	0	0	111.7	L499 N500 M506 T507	L499-D503 WeakPolarHBondContact O-CB 3.42Å; L499-D503 PolarHBondContact O-N 2.71Å; N500-D503 PolarHBondContact O-N 3.2Å; D503-M506 PolarHBondContact O-N 2.81Å; D503-T507 VanDerWaalsContact O-CB 3.24Å; D503-T507 WeakPolarHBondContact O-CB 3.33Å; D503-T507 PolarHBondContact O-N 3.17Å; D503-T507 PolarHBondContact O-OG1 2.93Å
504	Q	89.9	Confident	88.8	Confident	102 Å²	102	103.8 Å²	103.8	48%	0.477	52%	0.524	S	S	.	.	H	α-helix	trans	-64.6	-40.6	171.3	-74.1	172.6	43.2	0	0	112.3	N500 T507 Q508	N500-Q504 WeakPolarHBondContact O-CB 3.28Å; N500-Q504 VanDerWaalsContact O-CG 3.24Å; N500-Q504 WeakPolarHBondContact O-CG 3.39Å; N500-Q504 PolarHBondContact O-N 2.71Å; N500-Q504 PolarHBondContact OD1-NE2 3.26Å; Q504-T507 PolarHBondContact O-N 3.12Å; Q504-Q508 WeakPolarHBondContact O-CB 3.41Å; Q504-Q508 VanDerWaalsContact O-CG 3.27Å; Q504-Q508 WeakPolarHBondContact O-CG 3.16Å; Q504-Q508 PolarHBondContact O-N 3.2Å; Q504-Q508 PolarHBondContact O-NE2 2.71Å
505	N	88.9	Confident	88.7	Confident	74 Å²	74	101 Å²	101	40%	0.396	52%	0.516	S	S	.	.	H	α-helix	trans	-68	-39.7	176	-79.1	-50.5	0	0	0	111.8	E501 L502 Q508 Q509	E501-N505 WeakPolarHBondContact O-CB 3.34Å; E501-N505 VanDerWaalsContact O-CG 3.29Å; E501-N505 PolarHBondContact O-N 3.31Å; E501-N505 PolarHBondContact O-ND2 3.31Å; L502-N505 PolarHBondContact O-N 3.04Å; N505-Q508 PolarHBondContact O-N 2.9Å; N505-Q509 WeakPolarHBondContact O-CG 3.26Å; N505-Q509 PolarHBondContact O-N 2.92Å
506	M	85.7	Confident	88.5	Confident	128 Å²	128	102 Å²	102	63%	0.631	51%	0.512	S	S	*	.	H	α-helix	trans	-66.1	-40.9	175.1	-164.7	-173.5	-46.9	0	0	111.1	L502 D503 Q509 G510	L502-M506 VanDerWaalsContact O-CB 3.3Å; L502-M506 WeakPolarHBondContact O-CB 3.35Å; L502-M506 PolarHBondContact O-N 3.29Å; D503-M506 PolarHBondContact O-N 2.81Å; M506-Q509 PolarHBondContact O-N 3.01Å; M506-G510 PolarHBondContact O-N 3.4Å
507	T	88.5	Confident	88.3	Confident	67 Å²	67	101 Å²	101	41%	0.411	51%	0.508	S	S	.	.	H	α-helix	trans	-62.5	-43.7	173.2	-63.7	0	0	0	0	111.3	D503 Q504 G510 H511	D503-T507 VanDerWaalsContact O-CB 3.24Å; D503-T507 WeakPolarHBondContact O-CB 3.33Å; D503-T507 PolarHBondContact O-N 3.17Å; D503-T507 PolarHBondContact O-OG1 2.93Å; Q504-T507 PolarHBondContact O-N 3.12Å; T507-G510 PolarHBondContact O-N 3.38Å; T507-H511 PolarHBondContact O-N 2.89Å; T507-H511 PolarHBondContact O-ND1 3.47Å
508	Q	88.1	Confident	88.1	Confident	118 Å²	118	100.4 Å²	100.4	55%	0.551	51%	0.505	S	S	*	.	H	α-helix	trans	-63.2	-44.2	174.9	-77.9	171.4	69.1	0	0	112.1	Q504 N505 G510 H511 E512	Q504-Q508 WeakPolarHBondContact O-CB 3.41Å; Q504-Q508 VanDerWaalsContact O-CG 3.27Å; Q504-Q508 WeakPolarHBondContact O-CG 3.16Å; Q504-Q508 PolarHBondContact O-N 3.2Å; Q504-Q508 PolarHBondContact O-NE2 2.71Å; N505-Q508 PolarHBondContact O-N 2.9Å; Q508-G510 VanDerWaalsContact C-N 3.31Å; Q508-G510 PolarHBondContact O-N 2.71Å; Q508-H511 PolarHBondContact O-N 2.87Å; Q508-E512 PolarHBondContact O-N 2.99Å
509	Q	87.1	Confident	88	Confident	125 Å²	125	100.6 Å²	100.6	58%	0.584	51%	0.506	S	S	*	.	H	α-helix	trans	-63	-36.9	173.4	-74.8	-175.9	-5.7	0	0	111.9	N505 M506 E512 L513	N505-Q509 WeakPolarHBondContact O-CG 3.26Å; N505-Q509 PolarHBondContact O-N 2.92Å; M506-Q509 PolarHBondContact O-N 3.01Å; Q509-E512 PolarHBondContact O-N 3.06Å; Q509-L513 VanDerWaalsContact O-CB 3.32Å; Q509-L513 WeakPolarHBondContact O-CB 3.26Å; Q509-L513 VanDerWaalsContact O-CG 3.24Å; Q509-L513 WeakPolarHBondContact O-CG 3.47Å; Q509-L513 PolarHBondContact O-N 3.46Å
510	G	87.4	Confident	87.9	Confident	38 Å²	38	99.5 Å²	99.5	39%	0.392	50%	0.5	S	S	.	.	H	α-helix	trans	-60.7	-44.8	171.9	0	0	0	0	0	112.7	M506 T507 Q508 L513 A514	M506-G510 PolarHBondContact O-N 3.4Å; T507-G510 PolarHBondContact O-N 3.38Å; Q508-G510 VanDerWaalsContact C-N 3.31Å; Q508-G510 PolarHBondContact O-N 2.71Å; G510-L513 PolarHBondContact O-N 2.83Å; G510-A514 WeakPolarHBondContact O-CB 3.34Å; G510-A514 PolarHBondContact O-N 2.84Å
511	H	88.6	Confident	87.7	Confident	128 Å²	128	98.3 Å²	98.3	59%	0.593	49%	0.493	S	S	*	.	H	α-helix	trans	-65.2	-37.8	173.9	-75	74.7	0	0	0	112.2	T507 Q508 T515	T507-H511 PolarHBondContact O-N 2.89Å; T507-H511 PolarHBondContact O-ND1 3.47Å; Q508-H511 PolarHBondContact O-N 2.87Å; H511-T515 WeakPolarHBondContact O-CB 3.24Å; H511-T515 PolarHBondContact O-N 2.94Å; H511-T515 PolarHBondContact O-OG1 3.32Å
512	E	86.6	Confident	87.6	Confident	95 Å²	95	97.3 Å²	97.3	44%	0.444	49%	0.492	S	S	.	.	H	α-helix	trans	-69.1	-41.1	176.5	-148.9	-147.8	149.5	0	0	111.6	Q508 Q509 T515 R516	Q508-E512 PolarHBondContact O-N 2.99Å; Q509-E512 PolarHBondContact O-N 3.06Å; E512-T515 WeakPolarHBondContact O-CB 3.3Å; E512-T515 PolarHBondContact O-N 2.86Å; E512-R516 WeakPolarHBondContact O-CB 3.48Å; E512-R516 VanDerWaalsContact O-CG 3.25Å; E512-R516 WeakPolarHBondContact O-CG 3.27Å; E512-R516 PolarHBondContact O-N 2.94Å; E512-R516 IonicContact OE1-CZ 3.82Å; E512-R516 IonicContact OE1-NE 3.18Å; E512-R516 PolarHBondContact OE1-NE 3.28Å; E512-R516 IonicContact OE1-NH2 2.69Å; E512-R516 PolarHBondContact OE1-NH2 2.96Å; E512-R516 IonicContact OE2-CZ 3.62Å; E512-R516 IonicContact OE2-NE 2.68Å; E512-R516 IonicContact OE2-NH2 3.14Å; E512-R516 PolarHBondContact OE2-NH2 3.27Å; E512-R516 VanDerWaalsContact OE2-NH2 3.14Å
513	L	84.4	Confident	87.3	Confident	109 Å²	109	94.8 Å²	94.8	57%	0.571	48%	0.482	S	S	*	.	H	α-helix	trans	-64.6	-41.1	174.6	-73.9	171.4	0	0	0	111.6	Q509 G510 R516 R517	Q509-L513 VanDerWaalsContact O-CB 3.32Å; Q509-L513 WeakPolarHBondContact O-CB 3.26Å; Q509-L513 VanDerWaalsContact O-CG 3.24Å; Q509-L513 WeakPolarHBondContact O-CG 3.47Å; Q509-L513 PolarHBondContact O-N 3.46Å; G510-L513 PolarHBondContact O-N 2.83Å; L513-R516 PolarHBondContact O-N 3.31Å; L513-R517 VanDerWaalsContact O-CB 3.32Å; L513-R517 WeakPolarHBondContact O-CB 3.4Å; L513-R517 PolarHBondContact O-N 3.33Å
514	A	85.6	Confident	87.3	Confident	49 Å²	49	96 Å²	96	41%	0.405	49%	0.485	S	S	.	.	H	α-helix	trans	-62.3	-42.4	171.4	0	0	0	0	0	111.7	G510 R516 R517 N518	G510-A514 WeakPolarHBondContact O-CB 3.34Å; G510-A514 PolarHBondContact O-N 2.84Å; A514-R516 VanDerWaalsContact C-N 3.35Å; A514-R516 PolarHBondContact O-N 3.48Å; A514-R517 WeakPolarHBondContact O-CB 3.17Å; A514-R517 PolarHBondContact O-N 2.95Å; A514-N518 VanDerWaalsContact O-CG 3.3Å; A514-N518 PolarHBondContact O-N 3.14Å; A514-N518 PolarHBondContact O-OD1 3.31Å
515	T	88.3	Confident	87.2	Confident	70 Å²	70	94.9 Å²	94.9	43%	0.429	48%	0.482	S	S	.	.	H	α-helix	trans	-64.3	-38.2	175.6	-57.4	0	0	0	0	112	H511 E512 K519	H511-T515 WeakPolarHBondContact O-CB 3.24Å; H511-T515 PolarHBondContact O-N 2.94Å; H511-T515 PolarHBondContact O-OG1 3.32Å; E512-T515 WeakPolarHBondContact O-CB 3.3Å; E512-T515 PolarHBondContact O-N 2.86Å; T515-K519 WeakPolarHBondContact O-CG 3.48Å; T515-K519 PolarHBondContact O-N 2.85Å
516	R	87	Confident	87.2	Confident	132 Å²	132	98.2 Å²	98.2	50%	0.498	49%	0.489	S	S	.	.	H	α-helix	trans	-69	-39	173.6	-71.3	172.2	-175.8	-163.4	9.8	111.5	E512 L513 A514 K519 I520	E512-R516 WeakPolarHBondContact O-CB 3.48Å; E512-R516 VanDerWaalsContact O-CG 3.25Å; E512-R516 WeakPolarHBondContact O-CG 3.27Å; E512-R516 PolarHBondContact O-N 2.94Å; E512-R516 IonicContact OE1-CZ 3.82Å; E512-R516 IonicContact OE1-NE 3.18Å; E512-R516 PolarHBondContact OE1-NE 3.28Å; E512-R516 IonicContact OE1-NH2 2.69Å; E512-R516 PolarHBondContact OE1-NH2 2.96Å; E512-R516 IonicContact OE2-CZ 3.62Å; E512-R516 IonicContact OE2-NE 2.68Å; E512-R516 IonicContact OE2-NH2 3.14Å; E512-R516 PolarHBondContact OE2-NH2 3.27Å; E512-R516 VanDerWaalsContact OE2-NH2 3.14Å; L513-R516 PolarHBondContact O-N 3.31Å; A514-R516 VanDerWaalsContact C-N 3.35Å; A514-R516 PolarHBondContact O-N 3.48Å; R516-K519 PolarHBondContact O-N 2.91Å; R516-I520 WeakPolarHBondContact O-CG1 3.49Å; R516-I520 PolarHBondContact O-N 3.02Å
517	R	87.1	Confident	87.3	Confident	140 Å²	140	96.2 Å²	96.2	53%	0.528	48%	0.484	S	S	.	.	H	α-helix	trans	-61.3	-52.1	175.6	-178.6	68.3	-146	-162	8	110.6	L513 A514 K519 I520 D521	L513-R517 VanDerWaalsContact O-CB 3.32Å; L513-R517 WeakPolarHBondContact O-CB 3.4Å; L513-R517 PolarHBondContact O-N 3.33Å; A514-R517 WeakPolarHBondContact O-CB 3.17Å; A514-R517 PolarHBondContact O-N 2.95Å; R517-K519 VanDerWaalsContact C-N 3.28Å; R517-K519 PolarHBondContact O-N 3.49Å; R517-I520 CarbonylContact O-C 3.59Å; R517-I520 WeakPolarHBondContact O-CA 3.28Å; R517-I520 WeakPolarHBondContact O-CB 3.16Å; R517-I520 PolarHBondContact O-N 3.45Å; R517-D521 WeakPolarHBondContact CG-OD2 3.48Å; R517-D521 IonicContact CZ-OD1 2.81Å; R517-D521 IonicContact CZ-OD2 3.21Å; R517-D521 IonicContact NE-OD1 2.63Å; R517-D521 PolarHBondContact NE-OD1 2.62Å; R517-D521 IonicContact NE-OD2 2.75Å; R517-D521 PolarHBondContact NE-OD2 3.48Å; R517-D521 IonicContact NH2-OD1 2.71Å; R517-D521 PolarHBondContact NH2-OD1 2.74Å; R517-D521 IonicContact NH2-OD2 2.77Å; R517-D521 PolarHBondContact O-N 3.11Å
518	N	87.5	Confident	87.4	Confident	99 Å²	99	96.1 Å²	96.1	53%	0.529	48%	0.483	S	S	.	.	H	α-helix	trans	-55.6	-42.5	176.3	-66.5	4.8	0	0	0	111.7	A514 I520 D521 D522	A514-N518 VanDerWaalsContact O-CG 3.3Å; A514-N518 PolarHBondContact O-N 3.14Å; A514-N518 PolarHBondContact O-OD1 3.31Å; N518-I520 VanDerWaalsContact C-N 3.32Å; N518-I520 PolarHBondContact O-N 2.79Å; N518-D521 PolarHBondContact O-N 3.1Å; N518-D522 WeakPolarHBondContact O-CB 3.27Å; N518-D522 PolarHBondContact O-N 2.97Å
519	K	88.9	Confident	87.5	Confident	132 Å²	132	96.9 Å²	96.9	57%	0.574	48%	0.481	S	S	*	.	H	α-helix	trans	-65.6	-29.2	175.3	-74.3	173	179.5	177.7	0	114.4	T515 R516 R517 S523	T515-K519 WeakPolarHBondContact O-CG 3.48Å; T515-K519 PolarHBondContact O-N 2.85Å; R516-K519 PolarHBondContact O-N 2.91Å; R517-K519 VanDerWaalsContact C-N 3.28Å; R517-K519 PolarHBondContact O-N 3.49Å; K519-S523 WeakPolarHBondContact O-CB 3.49Å; K519-S523 PolarHBondContact O-N 3Å; K519-S523 PolarHBondContact O-OG 3.2Å
520	I	87	Confident	87.6	Confident	96 Å²	96	94.5 Å²	94.5	49%	0.492	48%	0.475	S	S	.	.	H	α-helix	trans	-73.7	-46.7	173.4	-71.2	163.8	0	0	0	109.1	R516 R517 N518 S523 Q524	R516-I520 WeakPolarHBondContact O-CG1 3.49Å; R516-I520 PolarHBondContact O-N 3.02Å; R517-I520 CarbonylContact O-C 3.59Å; R517-I520 WeakPolarHBondContact O-CA 3.28Å; R517-I520 WeakPolarHBondContact O-CB 3.16Å; R517-I520 PolarHBondContact O-N 3.45Å; N518-I520 VanDerWaalsContact C-N 3.32Å; N518-I520 PolarHBondContact O-N 2.79Å; I520-S523 CarbonylContact O-C 3.58Å; I520-S523 WeakPolarHBondContact O-CA 3.47Å; I520-S523 WeakPolarHBondContact O-CB 3.29Å; I520-S523 PolarHBondContact O-N 3.3Å; I520-Q524 PolarHBondContact O-N 2.63Å
521	D	86.4	Confident	87.6	Confident	57 Å²	57	98.3 Å²	98.3	31%	0.305	48%	0.484	S	S	.	.	H	α-helix	trans	-61.8	-49.9	177.4	-67	-43.5	0	0	0	110.7	R517 N518 S523 Q524 D525	R517-D521 WeakPolarHBondContact CG-OD2 3.48Å; R517-D521 IonicContact CZ-OD1 2.81Å; R517-D521 IonicContact CZ-OD2 3.21Å; R517-D521 IonicContact NE-OD1 2.63Å; R517-D521 PolarHBondContact NE-OD1 2.62Å; R517-D521 IonicContact NE-OD2 2.75Å; R517-D521 PolarHBondContact NE-OD2 3.48Å; R517-D521 IonicContact NH2-OD1 2.71Å; R517-D521 PolarHBondContact NH2-OD1 2.74Å; R517-D521 IonicContact NH2-OD2 2.77Å; R517-D521 PolarHBondContact O-N 3.11Å; N518-D521 PolarHBondContact O-N 3.1Å; D521-S523 PolarHBondContact O-N 2.92Å; D521-Q524 CarbonylContact O-C 3.58Å; D521-Q524 PolarHBondContact O-N 3.07Å; D521-D525 VanDerWaalsContact O-CB 3.3Å; D521-D525 WeakPolarHBondContact O-CB 3.42Å; D521-D525 PolarHBondContact O-N 3.16Å
522	D	88	Confident	87.7	Confident	94 Å²	94	97.2 Å²	97.2	50%	0.503	48%	0.482	S	S	.	.	H	α-helix	trans	-49	-35.1	169.8	-75.8	-31.2	0	0	0	113.1	N518 R526	N518-D522 WeakPolarHBondContact O-CB 3.27Å; N518-D522 PolarHBondContact O-N 2.97Å; D522-R526 WeakPolarHBondContact O-CB 3.37Å; D522-R526 WeakPolarHBondContact O-CD 3.45Å; D522-R526 WeakPolarHBondContact O-CG 3.44Å; D522-R526 PolarHBondContact O-N 3.36Å
523	S	83.9	Confident	87.9	Confident	45 Å²	45	97.7 Å²	97.7	32%	0.315	49%	0.488	S	S	.	.	H	α-helix	trans	-80.5	-37.3	179.8	-62.8	0	0	0	0	112.5	K519 I520 D521 R526 V527	K519-S523 WeakPolarHBondContact O-CB 3.49Å; K519-S523 PolarHBondContact O-N 3Å; K519-S523 PolarHBondContact O-OG 3.2Å; I520-S523 CarbonylContact O-C 3.58Å; I520-S523 WeakPolarHBondContact O-CA 3.47Å; I520-S523 WeakPolarHBondContact O-CB 3.29Å; I520-S523 PolarHBondContact O-N 3.3Å; D521-S523 PolarHBondContact O-N 2.92Å; S523-R526 VanDerWaalsContact CA-NH1 3.35Å; S523-R526 PolarHBondContact O-N 3.27Å; S523-R526 PolarHBondContact OG-NH1 2.93Å; S523-V527 WeakPolarHBondContact O-CG2 3.5Å; S523-V527 PolarHBondContact O-N 2.87Å
524	Q	87.8	Confident	88.1	Confident	119 Å²	119	97.6 Å²	97.6	56%	0.556	49%	0.487	S	S	*	.	H	α-helix	trans	-69.9	-36.6	173.8	-172.2	164.1	-31.8	0	0	111	I520 D521 V527 T528	I520-Q524 PolarHBondContact O-N 2.63Å; D521-Q524 CarbonylContact O-C 3.58Å; D521-Q524 PolarHBondContact O-N 3.07Å; Q524-V527 PolarHBondContact O-N 3.18Å; Q524-T528 WeakPolarHBondContact O-CB 3.45Å; Q524-T528 PolarHBondContact O-N 2.86Å; Q524-T528 PolarHBondContact O-OG1 3.48Å
525	D	88.6	Confident	88.3	Confident	77 Å²	77	99.3 Å²	99.3	41%	0.412	49%	0.492	S	S	.	.	H	α-helix	trans	-61.1	-47	171.1	-124.5	36.1	0	0	0	111.2	D521 T528 R529	D521-D525 VanDerWaalsContact O-CB 3.3Å; D521-D525 WeakPolarHBondContact O-CB 3.42Å; D521-D525 PolarHBondContact O-N 3.16Å; D525-T528 PolarHBondContact O-N 3.32Å; D525-R529 WeakPolarHBondContact O-CG 3.23Å; D525-R529 PolarHBondContact O-N 2.97Å; D525-R529 IonicContact OD2-CZ 3.79Å; D525-R529 IonicContact OD2-NH1 3.14Å; D525-R529 PolarHBondContact OD2-NH1 3.05Å; D525-R529 IonicContact OD2-NH2 3.9Å; D525-R529 PolarHBondContact OD2-NH2 3.46Å
526	R	89.2	Confident	88.4	Confident	144 Å²	144	101.2 Å²	101.2	54%	0.543	50%	0.5	S	S	.	.	H	α-helix	trans	-60.9	-46.2	173	-86.9	164.9	37.8	-116.3	-15.3	112.2	D522 S523 T528 R529 T530	D522-R526 WeakPolarHBondContact O-CB 3.37Å; D522-R526 WeakPolarHBondContact O-CD 3.45Å; D522-R526 WeakPolarHBondContact O-CG 3.44Å; D522-R526 PolarHBondContact O-N 3.36Å; S523-R526 VanDerWaalsContact CA-NH1 3.35Å; S523-R526 PolarHBondContact O-N 3.27Å; S523-R526 PolarHBondContact OG-NH1 2.93Å; R526-T528 VanDerWaalsContact C-N 3.32Å; R526-T528 PolarHBondContact O-N 3.48Å; R526-R529 PolarHBondContact O-N 3.47Å; R526-T530 WeakPolarHBondContact O-CB 3.37Å; R526-T530 PolarHBondContact O-N 3.03Å; R526-T530 PolarHBondContact O-OG1 3.21Å
527	V	88.3	Confident	88.6	Confident	86 Å²	86	99.8 Å²	99.8	52%	0.521	50%	0.502	S	S	.	.	H	α-helix	trans	-61.7	-40.8	176.1	167.5	0	0	0	0	111.2	S523 Q524 T530 M531	S523-V527 WeakPolarHBondContact O-CG2 3.5Å; S523-V527 PolarHBondContact O-N 2.87Å; Q524-V527 PolarHBondContact O-N 3.18Å; V527-T530 PolarHBondContact O-N 3.02Å; V527-M531 WeakPolarHBondContact O-CB 3.43Å; V527-M531 PolarHBondContact O-N 2.97Å
528	T	89.6	Confident	88.6	Confident	66 Å²	66	100.6 Å²	100.6	41%	0.405	51%	0.505	S	S	.	.	H	α-helix	trans	-65.4	-45.2	177.9	-54.3	0	0	0	0	111.3	Q524 D525 R526 M531 L532	Q524-T528 WeakPolarHBondContact O-CB 3.45Å; Q524-T528 PolarHBondContact O-N 2.86Å; Q524-T528 PolarHBondContact O-OG1 3.48Å; D525-T528 PolarHBondContact O-N 3.32Å; R526-T528 VanDerWaalsContact C-N 3.32Å; R526-T528 PolarHBondContact O-N 3.48Å; T528-M531 WeakPolarHBondContact O-CB 3.32Å; T528-M531 PolarHBondContact O-N 3.33Å; T528-L532 HydrophobicContact CG2-CD1 4.48Å; T528-L532 WeakPolarHBondContact O-CG 3.36Å; T528-L532 PolarHBondContact O-N 2.86Å
529	R	91	Very high	88.7	Confident	133 Å²	133	100.9 Å²	100.9	50%	0.502	50%	0.503	S	S	.	.	H	α-helix	trans	-58.3	-50.3	172.5	-70.7	176.5	-171.9	101.6	10.9	111.3	D525 R526 M531 L532 D533	D525-R529 WeakPolarHBondContact O-CG 3.23Å; D525-R529 PolarHBondContact O-N 2.97Å; D525-R529 IonicContact OD2-CZ 3.79Å; D525-R529 IonicContact OD2-NH1 3.14Å; D525-R529 PolarHBondContact OD2-NH1 3.05Å; D525-R529 IonicContact OD2-NH2 3.9Å; D525-R529 PolarHBondContact OD2-NH2 3.46Å; R526-R529 PolarHBondContact O-N 3.47Å; R529-M531 VanDerWaalsContact C-N 3.26Å; R529-M531 PolarHBondContact O-N 3.02Å; R529-L532 WeakPolarHBondContact O-CB 3.43Å; R529-L532 PolarHBondContact O-N 2.84Å; R529-L532 VanDerWaalsContact O-N 3.09Å; R529-D533 VanDerWaalsContact O-CG 3.22Å; R529-D533 PolarHBondContact O-N 2.96Å
530	T	88.3	Confident	88.7	Confident	76 Å²	76	96.3 Å²	96.3	47%	0.466	49%	0.487	S	S	.	.	H	α-helix	trans	-61.5	-32.8	177.6	-54.8	0	0	0	0	112.7	R526 V527 L534	R526-T530 WeakPolarHBondContact O-CB 3.37Å; R526-T530 PolarHBondContact O-N 3.03Å; R526-T530 PolarHBondContact O-OG1 3.21Å; V527-T530 PolarHBondContact O-N 3.02Å; T530-L534 HydrophobicContact CG2-CD1 4.2Å; T530-L534 WeakPolarHBondContact O-CB 3.44Å; T530-L534 WeakPolarHBondContact O-CD1 3.22Å; T530-L534 WeakPolarHBondContact O-CG 3.43Å; T530-L534 PolarHBondContact O-N 2.76Å
531	M	88.2	Confident	88.8	Confident	117 Å²	117	95.7 Å²	95.7	58%	0.576	49%	0.488	S	S	*	.	H	α-helix	trans	-67.1	-43.4	174.2	-170.9	-172.3	-61.6	0	0	111.4	V527 T528 R529 L534 V535	V527-M531 WeakPolarHBondContact O-CB 3.43Å; V527-M531 PolarHBondContact O-N 2.97Å; T528-M531 WeakPolarHBondContact O-CB 3.32Å; T528-M531 PolarHBondContact O-N 3.33Å; R529-M531 VanDerWaalsContact C-N 3.26Å; R529-M531 PolarHBondContact O-N 3.02Å; M531-L534 PolarHBondContact O-N 3.48Å; M531-V535 WeakPolarHBondContact O-CG2 3.38Å; M531-V535 PolarHBondContact O-N 2.93Å
532	L	90.3	Very high	88.8	Confident	106 Å²	106	95.8 Å²	95.8	56%	0.555	49%	0.487	S	S	*	.	H	α-helix	trans	-63.4	-47.6	174.3	-67.1	167.8	0	0	0	111	T528 R529 L534 V535 D536	T528-L532 HydrophobicContact CG2-CD1 4.48Å; T528-L532 WeakPolarHBondContact O-CG 3.36Å; T528-L532 PolarHBondContact O-N 2.86Å; R529-L532 WeakPolarHBondContact O-CB 3.43Å; R529-L532 PolarHBondContact O-N 2.84Å; R529-L532 VanDerWaalsContact O-N 3.09Å; L532-L534 PolarHBondContact O-N 3.14Å; L532-V535 PolarHBondContact O-N 2.7Å; L532-D536 PolarHBondContact O-N 3.25Å
533	D	90.4	Very high	88.7	Confident	104 Å²	104	96.3 Å²	96.3	56%	0.556	49%	0.486	S	S	*	.	H	α-helix	trans	-54.8	-39.6	174.8	-63.8	-37.5	0	0	0	111.8	R529 L537	R529-D533 VanDerWaalsContact O-CG 3.22Å; R529-D533 PolarHBondContact O-N 2.96Å; D533-L537 WeakPolarHBondContact O-CB 3.23Å; D533-L537 PolarHBondContact O-N 3.42Å
534	L	88.7	Confident	88.9	Confident	108 Å²	108	100.7 Å²	100.7	57%	0.565	50%	0.5	S	S	*	.	H	α-helix	trans	-72.1	-35.3	176.7	-75.8	169.8	0	0	0	112.9	T530 M531 L532 R538	T530-L534 HydrophobicContact CG2-CD1 4.2Å; T530-L534 WeakPolarHBondContact O-CB 3.44Å; T530-L534 WeakPolarHBondContact O-CD1 3.22Å; T530-L534 WeakPolarHBondContact O-CG 3.43Å; T530-L534 PolarHBondContact O-N 2.76Å; M531-L534 PolarHBondContact O-N 3.48Å; L532-L534 PolarHBondContact O-N 3.14Å; L534-R538 WeakPolarHBondContact O-CB 3.25Å; L534-R538 PolarHBondContact O-N 3.4Å
535	V	90	Very high	88.6	Confident	84 Å²	84	98.7 Å²	98.7	51%	0.509	49%	0.491	S	S	.	.	H	α-helix	trans	-67.2	-45.6	173.7	168.4	0	0	0	0	110.6	M531 L532 R538 H539	M531-V535 WeakPolarHBondContact O-CG2 3.38Å; M531-V535 PolarHBondContact O-N 2.93Å; L532-V535 PolarHBondContact O-N 2.7Å; V535-R538 WeakPolarHBondContact O-CB 3.21Å; V535-R538 PolarHBondContact O-N 3.49Å; V535-H539 WeakPolarHBondContact O-CB 3.29Å; V535-H539 PolarHBondContact O-N 3.47Å
536	D	90.4	Very high	88.2	Confident	111 Å²	111	100.1 Å²	100.1	59%	0.594	50%	0.495	S	S	*	.	H	α-helix	trans	-66.3	-40.4	176.9	-79.2	-11.2	0	0	0	111.9	L532 H539 S540	L532-D536 PolarHBondContact O-N 3.25Å; D536-H539 PolarHBondContact O-N 2.97Å; D536-S540 WeakPolarHBondContact O-CB 3.25Å; D536-S540 PolarHBondContact O-N 2.93Å
537	L	90.7	Very high	87.9	Confident	102 Å²	102	96 Å²	96	53%	0.534	49%	0.493	S	S	.	.	H	α-helix	trans	-64	-43.1	173.3	-177.3	61.4	0	0	0	111.3	D533 H539 S540 V541	D533-L537 WeakPolarHBondContact O-CB 3.23Å; D533-L537 PolarHBondContact O-N 3.42Å; L537-H539 VanDerWaalsContact C-N 3.32Å; L537-H539 PolarHBondContact O-N 2.72Å; L537-S540 PolarHBondContact O-N 2.8Å; L537-V541 HydrophobicContact CD1-CG2 4.49Å; L537-V541 WeakPolarHBondContact O-CG2 3.41Å; L537-V541 PolarHBondContact O-N 3.29Å
538	R	88.2	Confident	87.3	Confident	156 Å²	156	98.6 Å²	98.6	59%	0.589	49%	0.494	S	S	*	.	H	α-helix	trans	-59.1	-44.7	173.9	-171.5	-158.8	172.7	-62.7	-13.2	110.6	L534 V535 V541 E542	L534-R538 WeakPolarHBondContact O-CB 3.25Å; L534-R538 PolarHBondContact O-N 3.4Å; V535-R538 WeakPolarHBondContact O-CB 3.21Å; V535-R538 PolarHBondContact O-N 3.49Å; R538-V541 PolarHBondContact O-N 3.24Å; R538-E542 IonicContact CZ-OE2 3.53Å; R538-E542 VanDerWaalsContact CZ-OE2 3.28Å; R538-E542 IonicContact NH1-OE2 2.71Å; R538-E542 PolarHBondContact NH1-OE2 3.02Å; R538-E542 IonicContact NH2-OE2 3.2Å; R538-E542 PolarHBondContact NH2-OE2 3.32Å; R538-E542 WeakPolarHBondContact O-CB 3.34Å; R538-E542 PolarHBondContact O-N 3Å
539	H	89.1	Confident	86.5	Confident	105 Å²	105	101.5 Å²	101.5	49%	0.486	50%	0.501	S	S	.	.	H	α-helix	trans	-66.3	-40.6	177.9	-165.4	86.1	0	0	0	111.9	V535 D536 L537 V541 E542 Q543	V535-H539 WeakPolarHBondContact O-CB 3.29Å; V535-H539 PolarHBondContact O-N 3.47Å; D536-H539 PolarHBondContact O-N 2.97Å; L537-H539 VanDerWaalsContact C-N 3.32Å; L537-H539 PolarHBondContact O-N 2.72Å; H539-V541 PolarHBondContact O-N 3.42Å; H539-E542 WeakPolarHBondContact O-CB 3.35Å; H539-E542 PolarHBondContact O-N 3.38Å; H539-Q543 PolarHBondContact CD2-NE2 3.14Å; H539-Q543 PolarHBondContact NE2-NE2 2.94Å; H539-Q543 WeakPolarHBondContact O-CB 3.23Å; H539-Q543 WeakPolarHBondContact O-CG 3.43Å; H539-Q543 PolarHBondContact O-N 3.38Å
540	S	89.3	Confident	85.7	Confident	36 Å²	36	100.9 Å²	100.9	25%	0.252	51%	0.507	S	S	.	.	H	α-helix	trans	-62.6	-39.1	174	-167	0	0	0	0	112.4	D536 L537 K544	D536-S540 WeakPolarHBondContact O-CB 3.25Å; D536-S540 PolarHBondContact O-N 2.93Å; L537-S540 PolarHBondContact O-N 2.8Å; S540-K544 VanDerWaalsContact O-CB 3.32Å; S540-K544 WeakPolarHBondContact O-CB 3.47Å; S540-K544 WeakPolarHBondContact O-CD 3.45Å; S540-K544 VanDerWaalsContact O-CG 3.24Å; S540-K544 WeakPolarHBondContact O-CG 3.36Å; S540-K544 PolarHBondContact O-N 2.82Å; S540-K544 PolarHBondContact OG-NZ 3.31Å; S540-K544 VanDerWaalsContact OG-NZ 3.08Å
541	V	87.9	Confident	84.8	Confident	84 Å²	84	105.7 Å²	105.7	51%	0.509	52%	0.521	S	S	.	.	H	α-helix	trans	-69.5	-41.7	174.8	170.7	0	0	0	0	111.2	L537 R538 H539 K544 M545	L537-V541 HydrophobicContact CD1-CG2 4.49Å; L537-V541 WeakPolarHBondContact O-CG2 3.41Å; L537-V541 PolarHBondContact O-N 3.29Å; R538-V541 PolarHBondContact O-N 3.24Å; H539-V541 PolarHBondContact O-N 3.42Å; V541-K544 PolarHBondContact O-N 3.39Å; V541-M545 WeakPolarHBondContact O-CB 3.38Å; V541-M545 PolarHBondContact O-N 3.12Å
542	E	86.8	Confident	83.5	Confident	58 Å²	58	109.3 Å²	109.3	27%	0.271	53%	0.528	S	S	.	.	H	α-helix	trans	-59	-49.2	174.3	-163.2	88.7	-103.4	0	0	110.7	R538 H539 M545 Q546	R538-E542 IonicContact CZ-OE2 3.53Å; R538-E542 VanDerWaalsContact CZ-OE2 3.28Å; R538-E542 IonicContact NH1-OE2 2.71Å; R538-E542 PolarHBondContact NH1-OE2 3.02Å; R538-E542 IonicContact NH2-OE2 3.2Å; R538-E542 PolarHBondContact NH2-OE2 3.32Å; R538-E542 WeakPolarHBondContact O-CB 3.34Å; R538-E542 PolarHBondContact O-N 3Å; H539-E542 WeakPolarHBondContact O-CB 3.35Å; H539-E542 PolarHBondContact O-N 3.38Å; E542-M545 PolarHBondContact O-N 3.48Å; E542-M545 WeakPolarHBondContact OE1-CE 3.37Å; E542-Q546 WeakPolarHBondContact O-CG 3.29Å; E542-Q546 PolarHBondContact O-N 2.83Å
543	Q	85.9	Confident	81.7	Confident	106 Å²	106	112.9 Å²	112.9	50%	0.495	54%	0.54	S	S	.	.	H	α-helix	trans	-60.4	-46.5	174.6	-73.7	-172.3	13.8	0	0	112.4	H539 M545 Q546 A547	H539-Q543 PolarHBondContact CD2-NE2 3.14Å; H539-Q543 PolarHBondContact NE2-NE2 2.94Å; H539-Q543 WeakPolarHBondContact O-CB 3.23Å; H539-Q543 WeakPolarHBondContact O-CG 3.43Å; H539-Q543 PolarHBondContact O-N 3.38Å; Q543-M545 VanDerWaalsContact C-N 3.33Å; Q543-M545 PolarHBondContact O-N 3.3Å; Q543-Q546 PolarHBondContact O-N 2.82Å; Q543-A547 WeakPolarHBondContact O-CB 3.37Å; Q543-A547 PolarHBondContact O-N 3.26Å
544	K	87.6	Confident	79.5	Confident	137 Å²	137	112.1 Å²	112.1	60%	0.596	54%	0.542	S	S	*	.	H	α-helix	trans	-63.8	-36.8	177.8	-77.3	165.3	-179	153	0	112.1	S540 V541 A547 Y548	S540-K544 VanDerWaalsContact O-CB 3.32Å; S540-K544 WeakPolarHBondContact O-CB 3.47Å; S540-K544 WeakPolarHBondContact O-CD 3.45Å; S540-K544 VanDerWaalsContact O-CG 3.24Å; S540-K544 WeakPolarHBondContact O-CG 3.36Å; S540-K544 PolarHBondContact O-N 2.82Å; S540-K544 PolarHBondContact OG-NZ 3.31Å; S540-K544 VanDerWaalsContact OG-NZ 3.08Å; V541-K544 PolarHBondContact O-N 3.39Å; K544-A547 PolarHBondContact O-N 3.29Å; K544-Y548 WeakPolarHBondContact O-CB 3.37Å; K544-Y548 PolarHBondContact O-N 3.26Å
545	M	81.8	Confident	77	Confident	77 Å²	77	113.2 Å²	113.2	38%	0.379	55%	0.554	S	S	.	*	H	α-helix	trans	-65.9	-42.3	173.3	176.1	177	49.8	0	0	111.5	V541 E542 Q543 Y548 K549	V541-M545 WeakPolarHBondContact O-CB 3.38Å; V541-M545 PolarHBondContact O-N 3.12Å; E542-M545 PolarHBondContact O-N 3.48Å; E542-M545 WeakPolarHBondContact OE1-CE 3.37Å; Q543-M545 VanDerWaalsContact C-N 3.33Å; Q543-M545 PolarHBondContact O-N 3.3Å; M545-Y548 PolarHBondContact O-N 3.49Å; M545-K549 HydrophobicContact CG-CD 4.22Å; M545-K549 VanDerWaalsContact O-CG 3.3Å; M545-K549 WeakPolarHBondContact O-CG 3.45Å; M545-K549 PolarHBondContact O-N 3.42Å; M545-K549 PolarHBondContact SD-NZ 3.23Å
546	Q	80.3	Confident	74.8	Confident	106 Å²	106	116.7 Å²	116.7	50%	0.495	57%	0.569	S	S	.	*	H	α-helix	trans	-63.1	-47.6	174	-69.9	175.7	24.8	0	0	111.1	E542 Q543 Y548 K549 L550	E542-Q546 WeakPolarHBondContact O-CG 3.29Å; E542-Q546 PolarHBondContact O-N 2.83Å; Q543-Q546 PolarHBondContact O-N 2.82Å; Q546-Y548 VanDerWaalsContact C-N 3.31Å; Q546-Y548 PolarHBondContact O-N 2.94Å; Q546-K549 WeakPolarHBondContact O-CA 3.47Å; Q546-K549 WeakPolarHBondContact O-CB 3.39Å; Q546-K549 PolarHBondContact O-N 2.76Å; Q546-K549 VanDerWaalsContact O-N 3.09Å; Q546-L550 WeakPolarHBondContact O-CD1 3.44Å; Q546-L550 PolarHBondContact O-N 2.99Å
547	A	82.8	Confident	72.2	Confident	59 Å²	59	119 Å²	119	49%	0.488	58%	0.581	S	S	.	*	H	α-helix	trans	-58.7	-39.3	175.8	0	0	0	0	0	112.4	Q543 K544 L550 K551	Q543-A547 WeakPolarHBondContact O-CB 3.37Å; Q543-A547 PolarHBondContact O-N 3.26Å; K544-A547 PolarHBondContact O-N 3.29Å; A547-L550 PolarHBondContact O-N 2.82Å; A547-K551 VanDerWaalsContact O-CB 3.26Å; A547-K551 WeakPolarHBondContact O-CB 3.26Å; A547-K551 PolarHBondContact O-N 3.07Å
548	Y	75.6	Confident	69.5	Low	140 Å²	140	118.5 Å²	118.5	55%	0.549	59%	0.586	S	S	.	*	H	α-helix	trans	-67.7	-38.3	174.4	-171	-96.1	0	0	0	112.5	K544 M545 Q546 K551 R552	K544-Y548 WeakPolarHBondContact O-CB 3.37Å; K544-Y548 PolarHBondContact O-N 3.26Å; M545-Y548 PolarHBondContact O-N 3.49Å; Q546-Y548 VanDerWaalsContact C-N 3.31Å; Q546-Y548 PolarHBondContact O-N 2.94Å; Y548-K551 PolarHBondContact O-N 3.16Å; Y548-R552 HydrophobicContact CE1-CG 4.16Å; Y548-R552 PolarHBondContact O-N 2.94Å; Y548-R552 PolarHBondContact OH-NE 3.03Å; Y548-R552 VanDerWaalsContact OH-NE 3.15Å; Y548-R552 PolarHBondContact OH-NH2 3.22Å
549	K	73.9	Confident	66.9	Low	127 Å²	127	117 Å²	117	55%	0.552	60%	0.595	S	S	*	*	H	α-helix	trans	-62.9	-39.3	172.5	-73.5	168	-179.6	173.1	0	112	M545 Q546	M545-K549 HydrophobicContact CG-CD 4.22Å; M545-K549 VanDerWaalsContact O-CG 3.3Å; M545-K549 WeakPolarHBondContact O-CG 3.45Å; M545-K549 PolarHBondContact O-N 3.42Å; M545-K549 PolarHBondContact SD-NZ 3.23Å; Q546-K549 WeakPolarHBondContact O-CA 3.47Å; Q546-K549 WeakPolarHBondContact O-CB 3.39Å; Q546-K549 PolarHBondContact O-N 2.76Å; Q546-K549 VanDerWaalsContact O-N 3.09Å
550	L	72.6	Confident	64.2	Low	119 Å²	119	117 Å²	117	62%	0.623	61%	0.606	S	S	*	*	H	α-helix	trans	-69.3	-44.7	172.6	-87.7	77.4	0	0	0	111.8	Q546 A547 R552 K553 S554	Q546-L550 WeakPolarHBondContact O-CD1 3.44Å; Q546-L550 PolarHBondContact O-N 2.99Å; A547-L550 PolarHBondContact O-N 2.82Å; L550-R552 VanDerWaalsContact C-N 3.28Å; L550-R552 PolarHBondContact O-N 2.91Å; L550-K553 WeakPolarHBondContact O-CA 3.36Å; L550-K553 WeakPolarHBondContact O-CB 3.36Å; L550-K553 PolarHBondContact O-N 3.09Å; L550-S554 PolarHBondContact O-N 2.91Å
551	K	69.8	Low	61.6	Low	177 Å²	177	122 Å²	122	77%	0.77	64%	0.635	S	S	*	*	H	α-helix	trans	-69.9	-21.7	-175.2	-158.1	167.2	-172.6	176.3	0	113.6	A547 Y548 K553	A547-K551 VanDerWaalsContact O-CB 3.26Å; A547-K551 WeakPolarHBondContact O-CB 3.26Å; A547-K551 PolarHBondContact O-N 3.07Å; Y548-K551 PolarHBondContact O-N 3.16Å; K551-K553 VanDerWaalsContact C-N 3.29Å
552	R	61.3	Low	59	Low	193 Å²	193	122.3 Å²	122.3	73%	0.728	64%	0.641	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.8	-11.7	164.8	-81.3	-162.2	-179.6	-165.5	4.2	114.6	Y548 L550	Y548-R552 HydrophobicContact CE1-CG 4.16Å; Y548-R552 PolarHBondContact O-N 2.94Å; Y548-R552 PolarHBondContact OH-NE 3.03Å; Y548-R552 VanDerWaalsContact OH-NE 3.15Å; Y548-R552 PolarHBondContact OH-NH2 3.22Å; L550-R552 VanDerWaalsContact C-N 3.28Å; L550-R552 PolarHBondContact O-N 2.91Å
553	K	52.1	Low	56.2	Low	182 Å²	182	125.3 Å²	125.3	79%	0.791	66%	0.664	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110.5	-6.9	-173.9	-156.6	174.7	-178.6	-177.4	0	113.6	L550 K551	L550-K553 WeakPolarHBondContact O-CA 3.36Å; L550-K553 WeakPolarHBondContact O-CB 3.36Å; L550-K553 PolarHBondContact O-N 3.09Å; K551-K553 VanDerWaalsContact C-N 3.29Å
554	S	44.5	Very low	53.7	Low	87 Å²	87	126 Å²	126	61%	0.608	68%	0.676	S	S	*	*			trans	-146.4	87.6	-176.9	-57.4	0	0	0	0	112.3	L550 D556	L550-S554 PolarHBondContact O-N 2.91Å; S554-D556 PolarHBondContact O-N 2.98Å
555	T	37.2	Very low	51.2	Low	132 Å²	132	126.1 Å²	126.1	81%	0.81	68%	0.681	S	S	*	*			trans	-75.5	96.4	146.2	46.2	0	0	0	0	107.9
556	D	42.4	Very low	48.8	Very low	156 Å²	156	131.3 Å²	131.3	83%	0.834	70%	0.704	S	S	*	*			trans	177.1	137	138.8	-89.1	-21.8	0	0	0	113.6	S554	S554-D556 PolarHBondContact O-N 2.98Å
557	L	37.7	Very low	46.8	Very low	159 Å²	159	131.6 Å²	131.6	83%	0.832	72%	0.718	S	S	*	*			trans	52.6	78.1	149.7	-139.1	65	0	0	0	122.5
558	S	32.8	Very low	45.4	Very low	93 Å²	93	134.5 Å²	134.5	65%	0.65	73%	0.73	S	S	*	*			trans	17.6	133.7	131.3	57.9	0	0	0	0	123.4
559	T	33.3	Very low	45.1	Very low	125 Å²	125	134.3 Å²	134.3	77%	0.767	73%	0.734	S	S	*	*				176.7	104.9	127.1	-71.7	0	0	0	0	108.9
560	S	33.5	Very low	45.5	Very low	104 Å²	104	132.1 Å²	132.1	73%	0.727	73%	0.725	S	S	*	*				51.2	121.6	100.8	-43.7	0	0	0	0	113.6
561	T	33.4	Very low	46.2	Very low	141 Å²	141	129.2 Å²	129.2	87%	0.865	71%	0.708	S	S	*	*			cis	-169	-174.4	41.2	43.3	0	0	0	0	109.4
562	S	33.8	Very low	47.2	Very low	91 Å²	91	123.9 Å²	123.9	64%	0.636	69%	0.687	S	S	*	*			cis	-179.7	128.2	-47.1	-173.1	0	0	0	0	110
563	T	28.5	Very low	48.8	Very low	121 Å²	121	115.4 Å²	115.4	74%	0.742	66%	0.656	S	S	*	*			trans	65.5	158.6	151.4	39.2	0	0	0	0	123.4
564	T	32.8	Very low	50.8	Low	121 Å²	121	108.9 Å²	108.9	74%	0.742	63%	0.628	S	S	*	*			trans	82.8	108.3	169	-34.3	0	0	0	0	114.8
565	I	35.6	Very low	53.1	Low	138 Å²	138	104.9 Å²	104.9	71%	0.708	60%	0.6	S	S	*	*			cis	88.2	121.4	45.8	-61.2	170.4	0	0	0	113.2
566	E	32.1	Very low	55.6	Low	186 Å²	186	101.3 Å²	101.3	87%	0.869	58%	0.575	S	S	*	*			trans	46.2	107.2	160.9	-68.7	165.1	-166.1	0	0	120.5
567	S	37.4	Very low	57.9	Low	113 Å²	113	99.3 Å²	99.3	79%	0.79	56%	0.559	S	S	*	*			trans	-148.9	131.6	142.6	62	0	0	0	0	110.2	Q569	S567-Q569 PolarHBondContact O-N 2.88Å
568	T	53.8	Low	60.6	Low	119 Å²	119	96.3 Å²	96.3	73%	0.73	54%	0.543	S	S	*	.			trans	-77.3	102.4	176.9	37	0	0	0	0	110	K570	T568-K570 PolarHBondContact O-N 2.91Å
569	Q	68.8	Low	63.4	Low	137 Å²	137	92.8 Å²	92.8	64%	0.64	52%	0.516	S	S	*	.			trans	-64.3	126.7	174.9	-77.7	-176.3	-72.9	0	0	111.1	S567 V599	S567-Q569 PolarHBondContact O-N 2.88Å; Q569-V599 HydrophobicContact CB-CB 4.36Å; Q569-V599 HydrophobicContact CB-CG2 4.03Å; Q569-V599 PolarHBondContact O-N 3.32Å; Q569-V599 VanDerWaalsContact O-N 3.16Å
570	K	82.2	Confident	66.3	Low	81 Å²	81	91.8 Å²	91.8	35%	0.352	51%	0.51	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	146.7	165.7	-74.2	174.8	150.9	-163.1	0	109	T568 D596 V597 F598	T568-K570 PolarHBondContact O-N 2.91Å; K570-D596 HydrophobicContact CD-CB 3.92Å; K570-D596 WeakPolarHBondContact CD-OD2 3.27Å; K570-D596 HydrophobicContact CG-CB 4.42Å; K570-D596 IonicContact NZ-OD2 3.21Å; K570-D596 PolarHBondContact NZ-OD2 3.41Å; K570-V597 CarbonylContact C-O 3.53Å; K570-V597 VanDerWaalsContact CA-O 3.24Å; K570-V597 WeakPolarHBondContact CA-O 3.26Å; K570-F598 HydrophobicContact CD-CE1 4.46Å; K570-F598 VanDerWaalsContact CE-CE1 3.49Å; K570-F598 HydrophobicContact CG-CD1 4.16Å; K570-F598 HydrophobicContact CG-CE1 4.25Å
571	E	87.6	Confident	69	Low	57 Å²	57	88.3 Å²	88.3	27%	0.266	49%	0.488	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	136.6	172.7	-67.4	-169.6	147.7	0	0	110.4	Y573 V597 V599 K628	E571-Y573 HydrophobicContact CB-CD2 4.22Å; E571-Y573 HydrophobicContact CB-CE2 3.86Å; E571-V597 PolarHBondContact N-O 3.29Å; E571-V597 PolarHBondContact O-N 2.82Å; E571-V599 HydrophobicContact CG-CG2 3.61Å; E571-K628 VanDerWaalsContact CD-CE 3.48Å; E571-K628 WeakPolarHBondContact OE1-CE 3.4Å; E571-K628 IonicContact OE1-NZ 3.67Å; E571-K628 PolarHBondContact OE1-NZ 2.87Å; E571-K628 WeakPolarHBondContact OE2-CE 3.41Å; E571-K628 IonicContact OE2-NZ 2.71Å; E571-K628 PolarHBondContact OE2-NZ 3.19Å
572	L	91.5	Very high	71.6	Confident	66 Å²	66	92 Å²	92	35%	0.346	49%	0.486	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	123.1	-177.3	-167.8	64.2	0	0	0	110.3	L594 K629	L572-L594 HydrophobicContact CD1-CB 4.11Å; L572-K629 HydrophobicContact CD2-CD 4.11Å; L572-K629 WeakPolarHBondContact O-CB 3.45Å; L572-K629 PolarHBondContact O-N 3.49Å
573	Y	93.7	Very high	74	Confident	15 Å²	15	93.1 Å²	93.1	6%	0.059	48%	0.481	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	159.4	176.9	-81.8	-119.2	0	0	0	110.5	E571 L594 I595 V597 L610 V626 R627 K628	E571-Y573 HydrophobicContact CB-CD2 4.22Å; E571-Y573 HydrophobicContact CB-CE2 3.86Å; Y573-L594 CarbonylContact O-C 3.52Å; Y573-L594 WeakPolarHBondContact O-CA 3.25Å; Y573-I595 PolarHBondContact N-O 3.2Å; Y573-I595 PolarHBondContact O-N 3.03Å; Y573-V597 HydrophobicContact CD1-CG2 4.22Å; Y573-V597 HydrophobicContact CD2-CB 3.82Å; Y573-V597 HydrophobicContact CD2-CG2 3.42Å; Y573-V597 VanDerWaalsContact CD2-CG2 3.42Å; Y573-V597 HydrophobicContact CE2-CB 3.96Å; Y573-V597 HydrophobicContact CE2-CG1 4.36Å; Y573-V597 HydrophobicContact CE2-CG2 3.88Å; Y573-V597 HydrophobicContact CG-CG2 3.63Å; Y573-L610 HydrophobicContact CD1-CD1 4.1Å; Y573-L610 HydrophobicContact CE1-CD1 3.68Å; Y573-V626 HydrophobicContact CD1-CB 3.99Å; Y573-V626 HydrophobicContact CD1-CG2 3.54Å; Y573-V626 HydrophobicContact CE1-CG2 4.15Å; Y573-V626 HydrophobicContact CG-CG2 4.47Å; Y573-R627 CarbonylContact C-O 3.6Å; Y573-R627 VanDerWaalsContact CA-O 3.23Å; Y573-R627 WeakPolarHBondContact CA-O 3.45Å; Y573-R627 WeakPolarHBondContact CB-O 3.44Å; Y573-R627 VanDerWaalsContact CD1-C 3.43Å; Y573-R627 WeakPolarHBondContact CD1-O 3.26Å; Y573-K628 HydrophobicContact CD1-CB 4.29Å; Y573-K628 HydrophobicContact CD2-CB 4.4Å; Y573-K628 HydrophobicContact CD2-CG 4.39Å; Y573-K628 HydrophobicContact CE1-CB 3.93Å; Y573-K628 HydrophobicContact CE2-CB 3.99Å; Y573-K628 HydrophobicContact CE2-CD 4.2Å; Y573-K628 HydrophobicContact CE2-CG 3.9Å
574	E	93.5	Very high	76.8	Confident	45 Å²	45	94 Å²	94	21%	0.21	49%	0.489	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	129.2	179.4	-177.2	-172.8	-178.6	0	0	109.5	M576 T593 L594 V626 R627	E574-M576 PolarHBondContact O-N 3.01Å; E574-T593 WeakPolarHBondContact CA-O 3.3Å; E574-L594 HydrophobicContact CB-CD2 4Å; E574-L594 HydrophobicContact CG-CD2 4.14Å; E574-V626 CarbonylContact O-C 3.56Å; E574-V626 VanDerWaalsContact O-CA 3.3Å; E574-V626 WeakPolarHBondContact O-CA 3.33Å; E574-R627 HydrophobicContact CB-CG 4.13Å; E574-R627 PolarHBondContact N-O 3.09Å; E574-R627 PolarHBondContact O-N 3.05Å; E574-R627 IonicContact OE1-CZ 3.58Å; E574-R627 IonicContact OE1-NH2 3.87Å; E574-R627 PolarHBondContact OE1-NH2 2.71Å; E574-R627 IonicContact OE2-CZ 3.61Å; E574-R627 IonicContact OE2-NE 3.69Å; E574-R627 PolarHBondContact OE2-NE 2.87Å; E574-R627 IonicContact OE2-NH2 2.77Å; E574-R627 PolarHBondContact OE2-NH2 3.25Å
575	A	93.1	Very high	79.4	Confident	2 Å²	2	92.3 Å²	92.3	2%	0.017	48%	0.475	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.9	120.7	177.9	0	0	0	0	0	111.8	F589 T590 G592 T593 I595	A575-F589 HydrophobicContact CB-CD2 3.39Å; A575-F589 HydrophobicContact CB-CE2 3.56Å; A575-F589 HydrophobicContact CB-CG 4.37Å; A575-T590 WeakPolarHBondContact CB-O 3.3Å; A575-G592 PolarHBondContact O-N 2.97Å; A575-T593 PolarHBondContact N-O 3.28Å; A575-I595 HydrophobicContact CB-CD1 4.48Å
576	M	90.6	Very high	82.1	Confident	58 Å²	58	87 Å²	87	29%	0.286	45%	0.448	S	S	.	.	S	Bend	trans	-84	-24.1	174.1	-67.8	-178.9	66.6	0	0	112.6	E574 T591 Y625 R627	E574-M576 PolarHBondContact O-N 3.01Å; M576-T591 WeakPolarHBondContact O-CG2 3.16Å; M576-Y625 PolarHBondContact N-O 3.17Å; M576-R627 HydrophobicContact CG-CB 4.09Å; M576-R627 HydrophobicContact CG-CG 3.99Å; M576-R627 HydrophobicContact SD-CB 3.78Å; M576-R627 HydrophobicContact SD-CG 4.27Å
577	F	91.4	Very high	84.9	Confident	113 Å²	113	78.5 Å²	78.5	50%	0.496	41%	0.408	S	S	.	.	S	Bend	trans	-143.6	157.6	-178.2	-54	-74.1	0	0	0	110.7	F579 F589 T591 Y625	F577-F579 PolarHBondContact O-N 3.14Å; F577-F589 WeakPolarHBondContact O-CE2 2.89Å; F577-T591 WeakPolarHBondContact CA-OG1 3.46Å; F577-Y625 HydrophobicContact CB-CD1 3.75Å; F577-Y625 HydrophobicContact CB-CE1 4.03Å; F577-Y625 HydrophobicContact CB-CG 4.45Å; F577-Y625 PolarHBondContact N-O 3.47Å
578	D	93.1	Very high	87.5	Confident	96 Å²	96	76.2 Å²	76.2	51%	0.513	39%	0.392	S	S	.	.			trans	-70	123.7	173.6	-71.1	17.4	0	0	0	110.5	T590 T591 Y625	D578-T590 WeakPolarHBondContact OD1-CA 3.24Å; D578-T591 PolarHBondContact N-OG1 2.99Å; D578-T591 WeakPolarHBondContact OD1-CB 3.39Å; D578-T591 PolarHBondContact OD1-N 2.76Å; D578-T591 PolarHBondContact OD1-OG1 3.4Å; D578-Y625 WeakPolarHBondContact O-CE1 3.1Å
579	F	92.8	Very high	89.5	Confident	19 Å²	19	71.3 Å²	71.3	8%	0.083	36%	0.36	C	S	.	.	B	Isolated β-bridge	trans	-114.1	134	174.9	-172.8	-111.5	0	0	0	111	F577 E586 L587 S588 F589 W609 F621 P622 Y625	F577-F579 PolarHBondContact O-N 3.14Å; F579-E586 HydrophobicContact CE1-CB 4.29Å; F579-E586 WeakPolarHBondContact CZ-OE2 3.41Å; F579-L587 WeakPolarHBondContact CD1-O 3.25Å; F579-S588 CarbonylContact O-C 3.51Å; F579-S588 VanDerWaalsContact O-CA 3.29Å; F579-S588 WeakPolarHBondContact O-CA 3.37Å; F579-F589 HydrophobicContact CB-CD1 4.38Å; F579-F589 HydrophobicContact CB-CD2 4.02Å; F579-F589 HydrophobicContact CB-CE1 3.98Å; F579-F589 HydrophobicContact CB-CE2 3.59Å; F579-F589 HydrophobicContact CB-CG 4.41Å; F579-F589 HydrophobicContact CB-CZ 3.57Å; F579-F589 HydrophobicContact CD1-CE1 4.19Å; F579-F589 HydrophobicContact CD1-CZ 4.45Å; F579-F589 HydrophobicContact CG-CE1 4.46Å; F579-F589 HydrophobicContact CG-CZ 4.28Å; F579-F589 PolarHBondContact N-O 3.19Å; F579-F589 PolarHBondContact O-N 3.02Å; F579-F589 VanDerWaalsContact O-O 3.05Å; F579-W609 HydrophobicContact CZ-CH2 4.45Å; F579-W609 HydrophobicContact CZ-CZ3 4.27Å; F579-F621 HydrophobicContact CD1-CB 3.99Å; F579-F621 HydrophobicContact CE1-CB 4.09Å; F579-P622 HydrophobicContact CD2-CG 4.22Å; F579-P622 HydrophobicContact CE2-CG 3.76Å; F579-P622 HydrophobicContact CZ-CG 4.19Å; F579-Y625 HydrophobicContact CB-CD1 3.73Å; F579-Y625 HydrophobicContact CB-CE1 4.27Å; F579-Y625 HydrophobicContact CB-CG 4.42Å; F579-Y625 AromaticContact CD2-CD1 3.92Å; F579-Y625 HydrophobicContact CD2-CD1 3.92Å; F579-Y625 AromaticContact CD2-CE1 3.93Å; F579-Y625 HydrophobicContact CD2-CE1 3.93Å; F579-Y625 HydrophobicContact CD2-CG 4.3Å; F579-Y625 HydrophobicContact CG-CD1 4.24Å
580	T	93.2	Very high	90.7	Very high	104 Å²	104	68.7 Å²	68.7	64%	0.638	35%	0.354	S	S	*	.			trans	-120.8	114.7	176.9	-60.7	0	0	0	0	109.5	R582	T580-R582 PolarHBondContact O-N 2.89Å
581	A	89.7	Confident	91.1	Very high	31 Å²	31	68.6 Å²	68.6	26%	0.256	36%	0.361	S	S	.	.			trans	-54.4	131.2	176.9	0	0	0	0	0	112.2	E586 S588	A581-E586 WeakPolarHBondContact CA-OE2 3.44Å; A581-E586 HydrophobicContact CB-CB 3.56Å; A581-E586 VanDerWaalsContact CB-O 3.3Å; A581-E586 WeakPolarHBondContact CB-O 3.27Å; A581-S588 VanDerWaalsContact CB-OG 3.24Å; A581-S588 WeakPolarHBondContact CB-OG 3.25Å; A581-S588 PolarHBondContact N-OG 3.48Å
582	R	88.3	Confident	91.1	Very high	219 Å²	219	67.9 Å²	67.9	83%	0.826	37%	0.368	S	S	*	.	S	Bend	trans	-101	-23	175.8	-57.9	-175.2	179.3	-154.1	-1	112.7	T580 E586	T580-R582 PolarHBondContact O-N 2.89Å; R582-E586 PolarHBondContact N-OE2 2.88Å
583	H	85.4	Confident	91.2	Very high	115 Å²	115	66.2 Å²	66.2	53%	0.532	36%	0.361	S	S	.	.	S	Bend	trans	-123.2	157.3	175.5	-62.7	92.1	0	0	0	110.8	D585 E586	H583-D585 WeakPolarHBondContact CB-OD1 3.32Å; H583-D585 PolarHBondContact O-N 3.21Å; H583-E586 HydrophobicContact CB-CG 4.24Å; H583-E586 IonicContact CE1-OE1 2.77Å; H583-E586 IonicContact CG-OE1 2.57Å; H583-E586 PolarHBondContact N-OE1 3.27Å; H583-E586 IonicContact ND1-OE1 3.07Å; H583-E586 PolarHBondContact ND1-OE1 3.39Å; H583-E586 WeakPolarHBondContact O-CB 3.26Å; H583-E586 PolarHBondContact O-N 2.99Å
584	P	85.7	Confident	91.1	Very high	140 Å²	140	69.1 Å²	69.1	91%	0.909	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.2	-9.2	-174.8	29.3	-36.8	0	0	0	114.8
585	D	87.8	Confident	91.1	Very high	85 Å²	85	67 Å²	67	46%	0.455	37%	0.367	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.4	-5.7	171.2	58.7	-36.8	0	0	0	113.3	H583 G619 L620	H583-D585 WeakPolarHBondContact CB-OD1 3.32Å; H583-D585 PolarHBondContact O-N 3.21Å; D585-G619 CarbonylContact O-C 3.57Å; D585-G619 WeakPolarHBondContact O-CA 3.46Å; D585-L620 PolarHBondContact O-N 2.76Å
586	E	92.7	Very high	91.1	Very high	27 Å²	27	69.5 Å²	69.5	13%	0.126	38%	0.38	C	S	.	.	B	Isolated β-bridge	trans	-88.3	152.4	172.8	-66.8	173.2	-142.4	0	0	111.9	F579 A581 R582 H583 W609 L620	F579-E586 HydrophobicContact CE1-CB 4.29Å; F579-E586 WeakPolarHBondContact CZ-OE2 3.41Å; A581-E586 WeakPolarHBondContact CA-OE2 3.44Å; A581-E586 HydrophobicContact CB-CB 3.56Å; A581-E586 VanDerWaalsContact CB-O 3.3Å; A581-E586 WeakPolarHBondContact CB-O 3.27Å; R582-E586 PolarHBondContact N-OE2 2.88Å; H583-E586 HydrophobicContact CB-CG 4.24Å; H583-E586 IonicContact CE1-OE1 2.77Å; H583-E586 IonicContact CG-OE1 2.57Å; H583-E586 PolarHBondContact N-OE1 3.27Å; H583-E586 IonicContact ND1-OE1 3.07Å; H583-E586 PolarHBondContact ND1-OE1 3.39Å; H583-E586 WeakPolarHBondContact O-CB 3.26Å; H583-E586 PolarHBondContact O-N 2.99Å; E586-W609 HydrophobicContact CG-CH2 4.41Å; E586-W609 HydrophobicContact CG-CZ3 4.13Å; E586-L620 CarbonylContact C-O 3.35Å; E586-L620 VanDerWaalsContact CA-O 3.23Å; E586-L620 WeakPolarHBondContact CA-O 3.33Å
587	L	90.6	Very high	91.1	Very high	6 Å²	6	67 Å²	67	3%	0.031	37%	0.368	C	S	.	.			trans	-115.3	102.2	-171.2	-167.7	67.8	0	0	0	113	F579 F589 G612 I614 K617 L620 F621	F579-L587 WeakPolarHBondContact CD1-O 3.25Å; L587-F589 WeakPolarHBondContact O-CD1 3.24Å; L587-F589 WeakPolarHBondContact O-CE1 3.27Å; L587-G612 WeakPolarHBondContact CD2-O 3.46Å; L587-I614 HydrophobicContact CD2-CB 4.23Å; L587-I614 HydrophobicContact CD2-CD1 3.7Å; L587-I614 HydrophobicContact CD2-CG1 3.71Å; L587-I614 HydrophobicContact CG-CD1 3.98Å; L587-I614 HydrophobicContact CG-CG1 4.35Å; L587-K617 HydrophobicContact CD1-CB 3.58Å; L587-L620 PolarHBondContact N-O 2.91Å; L587-F621 HydrophobicContact CB-CD1 4.07Å; L587-F621 HydrophobicContact CD2-CD1 4.01Å; L587-F621 HydrophobicContact CD2-CE1 3.95Å
588	S	93.1	Very high	90.9	Very high	66 Å²	66	63.5 Å²	63.5	46%	0.462	35%	0.353	S	S	.	.			trans	-68.6	139.1	177.5	-57.1	0	0	0	0	113.8	F579 A581	F579-S588 CarbonylContact O-C 3.51Å; F579-S588 VanDerWaalsContact O-CA 3.29Å; F579-S588 WeakPolarHBondContact O-CA 3.37Å; A581-S588 VanDerWaalsContact CB-OG 3.24Å; A581-S588 WeakPolarHBondContact CB-OG 3.25Å; A581-S588 PolarHBondContact N-OG 3.48Å
589	F	94.1	Very high	90.4	Very high	15 Å²	15	62.1 Å²	62.1	7%	0.066	35%	0.348	C	S	.	.	B	Isolated β-bridge	trans	-156.4	162.2	174.2	52.4	-103.5	0	0	0	112.8	A575 F577 F579 L587 T593 I595 I614 F621 V626	A575-F589 HydrophobicContact CB-CD2 3.39Å; A575-F589 HydrophobicContact CB-CE2 3.56Å; A575-F589 HydrophobicContact CB-CG 4.37Å; F577-F589 WeakPolarHBondContact O-CE2 2.89Å; F579-F589 HydrophobicContact CB-CD1 4.38Å; F579-F589 HydrophobicContact CB-CD2 4.02Å; F579-F589 HydrophobicContact CB-CE1 3.98Å; F579-F589 HydrophobicContact CB-CE2 3.59Å; F579-F589 HydrophobicContact CB-CG 4.41Å; F579-F589 HydrophobicContact CB-CZ 3.57Å; F579-F589 HydrophobicContact CD1-CE1 4.19Å; F579-F589 HydrophobicContact CD1-CZ 4.45Å; F579-F589 HydrophobicContact CG-CE1 4.46Å; F579-F589 HydrophobicContact CG-CZ 4.28Å; F579-F589 PolarHBondContact N-O 3.19Å; F579-F589 PolarHBondContact O-N 3.02Å; F579-F589 VanDerWaalsContact O-O 3.05Å; L587-F589 WeakPolarHBondContact O-CD1 3.24Å; L587-F589 WeakPolarHBondContact O-CE1 3.27Å; F589-T593 HydrophobicContact CB-CG2 4.09Å; F589-I595 HydrophobicContact CD1-CD1 3.63Å; F589-I595 HydrophobicContact CD2-CD1 4.25Å; F589-I595 HydrophobicContact CE1-CD1 3.62Å; F589-I595 HydrophobicContact CE2-CD1 4.24Å; F589-I595 HydrophobicContact CG-CD1 3.96Å; F589-I595 HydrophobicContact CZ-CD1 3.93Å; F589-I614 HydrophobicContact CB-CD1 3.65Å; F589-I614 HydrophobicContact CD1-CD1 3.67Å; F589-I614 HydrophobicContact CG-CD1 4.03Å; F589-F621 HydrophobicContact CE1-CB 3.6Å; F589-F621 HydrophobicContact CE1-CD1 4.12Å; F589-F621 AromaticContact CE1-CD2 4Å; F589-F621 HydrophobicContact CE1-CD2 4Å; F589-F621 AromaticContact CE1-CG 3.64Å; F589-F621 HydrophobicContact CE1-CG 3.64Å; F589-F621 HydrophobicContact CZ-CB 4.08Å; F589-F621 HydrophobicContact CZ-CD2 4.18Å; F589-F621 HydrophobicContact CZ-CG 4.21Å; F589-V626 HydrophobicContact CE2-CG1 4.28Å; F589-V626 HydrophobicContact CZ-CG1 3.85Å
590	T	93.9	Very high	89.6	Confident	83 Å²	83	67.7 Å²	67.7	51%	0.509	38%	0.379	S	S	.	.			trans	-102.9	159.3	172	53.6	0	0	0	0	111.5	A575 D578 G592 T593	A575-T590 WeakPolarHBondContact CB-O 3.3Å; D578-T590 WeakPolarHBondContact OD1-CA 3.24Å; T590-G592 PolarHBondContact O-N 3.15Å; T590-T593 PolarHBondContact N-OG1 3.14Å; T590-T593 WeakPolarHBondContact O-CB 3.22Å; T590-T593 PolarHBondContact O-N 2.91Å; T590-T593 PolarHBondContact O-OG1 2.91Å; T590-T593 PolarHBondContact OG1-OG1 2.92Å
591	T	90.8	Very high	88.7	Confident	79 Å²	79	64.4 Å²	64.4	49%	0.485	36%	0.362	S	S	.	.	T	Hydrogen-bonded Turn	trans	-48.5	135	173.4	-53.6	0	0	0	0	111.1	M576 F577 D578 T593	M576-T591 WeakPolarHBondContact O-CG2 3.16Å; F577-T591 WeakPolarHBondContact CA-OG1 3.46Å; D578-T591 PolarHBondContact N-OG1 2.99Å; D578-T591 WeakPolarHBondContact OD1-CB 3.39Å; D578-T591 PolarHBondContact OD1-N 2.76Å; D578-T591 PolarHBondContact OD1-OG1 3.4Å; T591-T593 VanDerWaalsContact C-N 3.31Å; T591-T593 PolarHBondContact O-N 2.85Å
592	G	88.9	Confident	88.1	Confident	41 Å²	41	67.8 Å²	67.8	42%	0.423	38%	0.381	S	S	.	.	T	Hydrogen-bonded Turn	trans	80.8	-3.4	-174.9	0	0	0	0	0	115.7	A575 T590	A575-G592 PolarHBondContact O-N 2.97Å; T590-G592 PolarHBondContact O-N 3.15Å
593	T	92.6	Very high	87.7	Confident	32 Å²	32	60.9 Å²	60.9	20%	0.196	36%	0.36	C	S	.	.			trans	-65.4	138.3	172.2	-55.5	0	0	0	0	110.4	E574 A575 F589 T590 T591 I614	E574-T593 WeakPolarHBondContact CA-O 3.3Å; A575-T593 PolarHBondContact N-O 3.28Å; F589-T593 HydrophobicContact CB-CG2 4.09Å; T590-T593 PolarHBondContact N-OG1 3.14Å; T590-T593 WeakPolarHBondContact O-CB 3.22Å; T590-T593 PolarHBondContact O-N 2.91Å; T590-T593 PolarHBondContact O-OG1 2.91Å; T590-T593 PolarHBondContact OG1-OG1 2.92Å; T591-T593 VanDerWaalsContact C-N 3.31Å; T591-T593 PolarHBondContact O-N 2.85Å; T593-I614 HydrophobicContact CG2-CD1 4.01Å; T593-I614 HydrophobicContact CG2-CG1 4.47Å; T593-I614 HydrophobicContact CG2-CG2 3.91Å
594	L	92.5	Very high	87.2	Confident	76 Å²	76	63.5 Å²	63.5	40%	0.398	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	140	174.6	-61.5	178.4	0	0	0	110.9	L572 Y573 E574 K629	L572-L594 HydrophobicContact CD1-CB 4.11Å; Y573-L594 CarbonylContact O-C 3.52Å; Y573-L594 WeakPolarHBondContact O-CA 3.25Å; E574-L594 HydrophobicContact CB-CD2 4Å; E574-L594 HydrophobicContact CG-CD2 4.14Å; L594-K629 HydrophobicContact CD2-CD 3.7Å
595	I	92.5	Very high	87	Confident	0 Å²	0	58.7 Å²	58.7	0%	0	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	126.9	-166.9	-46.4	-178.1	0	0	0	109.9	Y573 A575 F589 V597 I614 F621 V626	Y573-I595 PolarHBondContact N-O 3.2Å; Y573-I595 PolarHBondContact O-N 3.03Å; A575-I595 HydrophobicContact CB-CD1 4.48Å; F589-I595 HydrophobicContact CD1-CD1 3.63Å; F589-I595 HydrophobicContact CD2-CD1 4.25Å; F589-I595 HydrophobicContact CE1-CD1 3.62Å; F589-I595 HydrophobicContact CE2-CD1 4.24Å; F589-I595 HydrophobicContact CG-CD1 3.96Å; F589-I595 HydrophobicContact CZ-CD1 3.93Å; I595-V597 PolarHBondContact O-N 3.1Å; I595-I614 HydrophobicContact CB-CD1 4.36Å; I595-I614 HydrophobicContact CB-CG1 4.1Å; I595-I614 HydrophobicContact CD1-CD1 3.77Å; I595-I614 HydrophobicContact CD1-CG1 4.46Å; I595-I614 HydrophobicContact CG1-CD1 3.6Å; I595-I614 HydrophobicContact CG1-CG1 3.81Å; I595-I614 HydrophobicContact CG2-CD1 4.14Å; I595-I614 HydrophobicContact CG2-CG1 3.78Å; I595-F621 HydrophobicContact CB-CZ 4.48Å; I595-F621 HydrophobicContact CD1-CE2 4.42Å; I595-F621 HydrophobicContact CD1-CZ 4.39Å; I595-F621 HydrophobicContact CG2-CE1 3.72Å; I595-F621 HydrophobicContact CG2-CE2 4.41Å; I595-F621 HydrophobicContact CG2-CZ 3.48Å; I595-F621 VanDerWaalsContact CG2-CZ 3.48Å; I595-V626 HydrophobicContact CD1-CG1 3.71Å
596	D	92.7	Very high	86.6	Confident	55 Å²	55	56.4 Å²	56.4	29%	0.294	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84	100	173.1	-81.2	-10.3	0	0	0	109.8	K570 G612 Q613	K570-D596 HydrophobicContact CD-CB 3.92Å; K570-D596 WeakPolarHBondContact CD-OD2 3.27Å; K570-D596 HydrophobicContact CG-CB 4.42Å; K570-D596 IonicContact NZ-OD2 3.21Å; K570-D596 PolarHBondContact NZ-OD2 3.41Å; D596-G612 CarbonylContact O-C 3.54Å; D596-G612 WeakPolarHBondContact O-CA 3.26Å; D596-Q613 HydrophobicContact CB-CB 4.2Å; D596-Q613 PolarHBondContact N-O 2.79Å; D596-Q613 PolarHBondContact O-N 3.46Å
597	V	90.9	Very high	86.1	Confident	6 Å²	6	61.7 Å²	61.7	4%	0.036	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	132.4	173.2	174.4	0	0	0	0	109.9	K570 E571 Y573 I595 L610 F621	K570-V597 CarbonylContact C-O 3.53Å; K570-V597 VanDerWaalsContact CA-O 3.24Å; K570-V597 WeakPolarHBondContact CA-O 3.26Å; E571-V597 PolarHBondContact N-O 3.29Å; E571-V597 PolarHBondContact O-N 2.82Å; Y573-V597 HydrophobicContact CD1-CG2 4.22Å; Y573-V597 HydrophobicContact CD2-CB 3.82Å; Y573-V597 HydrophobicContact CD2-CG2 3.42Å; Y573-V597 VanDerWaalsContact CD2-CG2 3.42Å; Y573-V597 HydrophobicContact CE2-CB 3.96Å; Y573-V597 HydrophobicContact CE2-CG1 4.36Å; Y573-V597 HydrophobicContact CE2-CG2 3.88Å; Y573-V597 HydrophobicContact CG-CG2 3.63Å; I595-V597 PolarHBondContact O-N 3.1Å; V597-L610 HydrophobicContact CG1-CB 4.37Å; V597-L610 HydrophobicContact CG1-CD1 4.4Å; V597-L610 HydrophobicContact CG1-CD2 4.26Å; V597-L610 HydrophobicContact CG2-CB 4.46Å; V597-L610 HydrophobicContact CG2-CD1 4.06Å; V597-F621 HydrophobicContact CG2-CE2 4.34Å; V597-F621 HydrophobicContact CG2-CZ 3.89Å
598	F	88.3	Confident	85.9	Confident	38 Å²	38	63.1 Å²	63.1	17%	0.167	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	117.2	173	-65.2	-89.2	0	0	0	109.9	K570 N600 Y611 Q613 V618	K570-F598 HydrophobicContact CD-CE1 4.46Å; K570-F598 VanDerWaalsContact CE-CE1 3.49Å; K570-F598 HydrophobicContact CG-CD1 4.16Å; K570-F598 HydrophobicContact CG-CE1 4.25Å; F598-N600 VanDerWaalsContact C-N 3.29Å; F598-N600 PolarHBondContact O-N 2.93Å; F598-Y611 HydrophobicContact CB-CD1 4.44Å; F598-Y611 AromaticContact CD2-CD1 3.65Å; F598-Y611 HydrophobicContact CD2-CD1 3.65Å; F598-Y611 AromaticContact CD2-CE1 3.92Å; F598-Y611 HydrophobicContact CD2-CE1 3.92Å; F598-Y611 HydrophobicContact CE2-CD1 4.28Å; F598-Y611 HydrophobicContact CE2-CE1 4.13Å; F598-Y611 HydrophobicContact CG-CD1 4.34Å; F598-Y611 PolarHBondContact N-O 3.34Å; F598-Q613 HydrophobicContact CE2-CB 4.05Å; F598-Q613 HydrophobicContact CZ-CB 4.32Å; F598-V618 HydrophobicContact CE2-CG1 4.05Å; F598-V618 HydrophobicContact CZ-CG1 4.36Å
599	V	81.1	Confident	85.8	Confident	68 Å²	68	64.6 Å²	64.6	41%	0.412	39%	0.39	S	S	.	.	S	Bend	trans	-61.6	-41.3	179.3	-179.8	0	0	0	0	111	Q569 E571	Q569-V599 HydrophobicContact CB-CB 4.36Å; Q569-V599 HydrophobicContact CB-CG2 4.03Å; Q569-V599 PolarHBondContact O-N 3.32Å; Q569-V599 VanDerWaalsContact O-N 3.16Å; E571-V599 HydrophobicContact CG-CG2 3.61Å
600	N	76.3	Confident	85.7	Confident	136 Å²	136	65.2 Å²	65.2	73%	0.727	39%	0.394	S	S	*	.	S	Bend	trans	-108.9	88.6	170.7	-66.1	-26.1	0	0	0	108.3	F598	F598-N600 VanDerWaalsContact C-N 3.29Å; F598-N600 PolarHBondContact O-N 2.93Å
601	A	75.6	Confident	85.7	Confident	34 Å²	34	62.8 Å²	62.8	28%	0.281	38%	0.376	S	S	.	.			trans	-65.5	138.9	178.1	0	0	0	0	0	111.4	I603 V605 Y611	A601-I603 PolarHBondContact O-N 3.07Å; A601-V605 HydrophobicContact CB-CG2 3.63Å; A601-Y611 HydrophobicContact CB-CD1 4.07Å; A601-Y611 HydrophobicContact CB-CG 4.28Å
602	P	76.8	Confident	85.7	Confident	103 Å²	103	59 Å²	59	67%	0.669	35%	0.353	S	S	*	.	S	Bend	trans	-75.9	0.7	177.6	32.6	-36.9	0	0	0	113.8	Y611	P602-Y611 HydrophobicContact CG-CD1 4.45Å; P602-Y611 HydrophobicContact CG-CE1 3.78Å
603	I	78.5	Confident	85.9	Confident	74 Å²	74	59.1 Å²	59.1	38%	0.379	34%	0.343	S	S	.	.	S	Bend	trans	-126	154.7	174.3	62.8	171	0	0	0	109.4	A601 V605 Y611 L620	A601-I603 PolarHBondContact O-N 3.07Å; I603-V605 HydrophobicContact CG1-CG2 4.22Å; I603-V605 PolarHBondContact O-N 2.88Å; I603-Y611 HydrophobicContact CD1-CD2 3.51Å; I603-Y611 HydrophobicContact CD1-CE2 3.58Å; I603-Y611 HydrophobicContact CD1-CG 4.25Å; I603-Y611 HydrophobicContact CG1-CD2 3.96Å; I603-Y611 HydrophobicContact CG1-CE2 4.12Å; I603-Y611 HydrophobicContact CG1-CG 4.21Å; I603-L620 HydrophobicContact CD1-CD1 4.22Å; I603-L620 HydrophobicContact CD1-CD2 4.06Å; I603-L620 HydrophobicContact CD1-CG 4.11Å
604	N	76.1	Confident	85.8	Confident	170 Å²	170	58.4 Å²	58.4	91%	0.909	34%	0.337	S	S	*	.			trans	-77	106.2	179.1	-164.9	-10.1	0	0	0	110
605	V	81.4	Confident	85.4	Confident	38 Å²	38	62.1 Å²	62.1	23%	0.23	36%	0.357	C	S	.	.	P	Polyproline II helix	trans	-90.6	127.6	-174	-174.2	0	0	0	0	110.3	A601 I603 W609 L620	A601-V605 HydrophobicContact CB-CG2 3.63Å; I603-V605 HydrophobicContact CG1-CG2 4.22Å; I603-V605 PolarHBondContact O-N 2.88Å; V605-W609 HydrophobicContact CG1-CB 3.71Å; V605-W609 WeakPolarHBondContact CG1-O 3.4Å; V605-L620 HydrophobicContact CG1-CD2 3.89Å; V605-L620 HydrophobicContact CG2-CD2 4.11Å
606	G	78.7	Confident	84.9	Confident	37 Å²	37	68.7 Å²	68.7	38%	0.381	39%	0.392	S	S	.	.	P	Polyproline II helix	trans	-68.3	150.5	177.2	0	0	0	0	0	112.9	G608 W609	G606-G608 PolarHBondContact O-N 3.05Å; G606-W609 WeakPolarHBondContact O-CB 3.31Å; G606-W609 PolarHBondContact O-N 3.4Å
607	P	82.9	Confident	84.6	Confident	138 Å²	138	73.4 Å²	73.4	90%	0.896	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.2	134	-178.7	24.8	-34.4	0	0	0	111.8	W609	P607-W609 VanDerWaalsContact C-N 3.34Å
608	G	87	Confident	84.6	Confident	36 Å²	36	76.4 Å²	76.4	37%	0.371	43%	0.428	S	S	.	.	T	Hydrogen-bonded Turn	trans	82.8	5.3	-174.6	0	0	0	0	0	114.9	G606 P622 E623	G606-G608 PolarHBondContact O-N 3.05Å; G608-P622 CarbonylContact O-C 3.6Å; G608-P622 WeakPolarHBondContact O-CA 3.39Å; G608-E623 PolarHBondContact O-N 3.36Å
609	W	91.2	Very high	84.7	Confident	97 Å²	97	74.6 Å²	74.6	37%	0.367	42%	0.421	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	155	165.9	-66.4	77.7	0	0	0	110.4	F579 E586 V605 G606 P607 L620 F621 P622	F579-W609 HydrophobicContact CZ-CH2 4.45Å; F579-W609 HydrophobicContact CZ-CZ3 4.27Å; E586-W609 HydrophobicContact CG-CH2 4.41Å; E586-W609 HydrophobicContact CG-CZ3 4.13Å; V605-W609 HydrophobicContact CG1-CB 3.71Å; V605-W609 WeakPolarHBondContact CG1-O 3.4Å; G606-W609 WeakPolarHBondContact O-CB 3.31Å; G606-W609 PolarHBondContact O-N 3.4Å; P607-W609 VanDerWaalsContact C-N 3.34Å; W609-L620 HydrophobicContact CE3-CB 3.91Å; W609-L620 HydrophobicContact CZ3-CB 4.26Å; W609-F621 CarbonylContact C-O 3.57Å; W609-F621 WeakPolarHBondContact CA-O 3.33Å; W609-P622 HydrophobicContact CE3-CG 4.45Å; W609-P622 HydrophobicContact CH2-CG 4.37Å; W609-P622 HydrophobicContact CZ3-CG 4.25Å
610	L	91.3	Very high	85.3	Confident	28 Å²	28	72.7 Å²	72.7	15%	0.147	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	154.4	169.9	-65.3	176.9	0	0	0	109.4	Y573 V597 L620 F621 E623 V626	Y573-L610 HydrophobicContact CD1-CD1 4.1Å; Y573-L610 HydrophobicContact CE1-CD1 3.68Å; V597-L610 HydrophobicContact CG1-CB 4.37Å; V597-L610 HydrophobicContact CG1-CD1 4.4Å; V597-L610 HydrophobicContact CG1-CD2 4.26Å; V597-L610 HydrophobicContact CG2-CB 4.46Å; V597-L610 HydrophobicContact CG2-CD1 4.06Å; L610-L620 WeakPolarHBondContact O-CA 3.2Å; L610-F621 HydrophobicContact CB-CD2 4.24Å; L610-F621 HydrophobicContact CB-CE2 3.72Å; L610-F621 HydrophobicContact CB-CZ 4.02Å; L610-F621 HydrophobicContact CD1-CE2 4.19Å; L610-F621 PolarHBondContact N-O 3.41Å; L610-F621 PolarHBondContact O-N 2.87Å; L610-E623 HydrophobicContact CD1-CB 4.25Å; L610-E623 HydrophobicContact CD1-CG 4.07Å; L610-E623 HydrophobicContact CG-CB 4.04Å; L610-E623 HydrophobicContact CG-CG 4.24Å; L610-V626 HydrophobicContact CD1-CG2 3.82Å
611	Y	93.3	Very high	86.1	Confident	33 Å²	33	66.2 Å²	66.2	13%	0.129	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	125.8	173	-176.2	-103.6	0	0	0	109.4	F598 A601 P602 I603 V618 L620	F598-Y611 HydrophobicContact CB-CD1 4.44Å; F598-Y611 AromaticContact CD2-CD1 3.65Å; F598-Y611 HydrophobicContact CD2-CD1 3.65Å; F598-Y611 AromaticContact CD2-CE1 3.92Å; F598-Y611 HydrophobicContact CD2-CE1 3.92Å; F598-Y611 HydrophobicContact CE2-CD1 4.28Å; F598-Y611 HydrophobicContact CE2-CE1 4.13Å; F598-Y611 HydrophobicContact CG-CD1 4.34Å; F598-Y611 PolarHBondContact N-O 3.34Å; A601-Y611 HydrophobicContact CB-CD1 4.07Å; A601-Y611 HydrophobicContact CB-CG 4.28Å; P602-Y611 HydrophobicContact CG-CD1 4.45Å; P602-Y611 HydrophobicContact CG-CE1 3.78Å; I603-Y611 HydrophobicContact CD1-CD2 3.51Å; I603-Y611 HydrophobicContact CD1-CE2 3.58Å; I603-Y611 HydrophobicContact CD1-CG 4.25Å; I603-Y611 HydrophobicContact CG1-CD2 3.96Å; I603-Y611 HydrophobicContact CG1-CE2 4.12Å; I603-Y611 HydrophobicContact CG1-CG 4.21Å; Y611-V618 HydrophobicContact CE1-CB 4.4Å; Y611-V618 HydrophobicContact CE2-CB 4.41Å; Y611-V618 VanDerWaalsContact OH-CG2 3.27Å; Y611-V618 WeakPolarHBondContact OH-CG2 3.35Å; Y611-L620 HydrophobicContact CD2-CD2 4.17Å; Y611-L620 HydrophobicContact CD2-CG 4.27Å
612	G	91.5	Very high	86.9	Confident	0 Å²	0	65.4 Å²	65.4	0%	0	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153	177.7	-174.5	0	0	0	0	0	114.4	L587 D596 V618 G619	L587-G612 WeakPolarHBondContact CD2-O 3.46Å; D596-G612 CarbonylContact O-C 3.54Å; D596-G612 WeakPolarHBondContact O-CA 3.26Å; G612-V618 CarbonylContact O-C 3.43Å; G612-V618 VanDerWaalsContact O-CA 3.26Å; G612-V618 WeakPolarHBondContact O-CA 3.34Å; G612-G619 PolarHBondContact N-O 3.17Å; G612-G619 PolarHBondContact O-N 3.43Å
613	Q	92.5	Very high	87.6	Confident	43 Å²	43	62.4 Å²	62.4	20%	0.201	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	135.5	-177.8	-172.9	178.7	-9.5	0	0	111.5	D596 F598 D616 K617 V618	D596-Q613 HydrophobicContact CB-CB 4.2Å; D596-Q613 PolarHBondContact N-O 2.79Å; D596-Q613 PolarHBondContact O-N 3.46Å; F598-Q613 HydrophobicContact CE2-CB 4.05Å; F598-Q613 HydrophobicContact CZ-CB 4.32Å; Q613-D616 PolarHBondContact NE2-OD1 3.17Å; Q613-K617 CarbonylContact C-O 3.58Å; Q613-K617 VanDerWaalsContact CA-O 3.27Å; Q613-K617 WeakPolarHBondContact CA-O 3.37Å; Q613-V618 HydrophobicContact CB-CG1 3.93Å; Q613-V618 HydrophobicContact CG-CG1 3.98Å
614	I	90.2	Very high	88.2	Confident	16 Å²	16	63.5 Å²	63.5	8%	0.082	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	123.2	168.8	-57.2	170.4	0	0	0	107.4	L587 F589 T593 I595 D616 K617	L587-I614 HydrophobicContact CD2-CB 4.23Å; L587-I614 HydrophobicContact CD2-CD1 3.7Å; L587-I614 HydrophobicContact CD2-CG1 3.71Å; L587-I614 HydrophobicContact CG-CD1 3.98Å; L587-I614 HydrophobicContact CG-CG1 4.35Å; F589-I614 HydrophobicContact CB-CD1 3.65Å; F589-I614 HydrophobicContact CD1-CD1 3.67Å; F589-I614 HydrophobicContact CG-CD1 4.03Å; T593-I614 HydrophobicContact CG2-CD1 4.01Å; T593-I614 HydrophobicContact CG2-CG1 4.47Å; T593-I614 HydrophobicContact CG2-CG2 3.91Å; I595-I614 HydrophobicContact CB-CD1 4.36Å; I595-I614 HydrophobicContact CB-CG1 4.1Å; I595-I614 HydrophobicContact CD1-CD1 3.77Å; I595-I614 HydrophobicContact CD1-CG1 4.46Å; I595-I614 HydrophobicContact CG1-CD1 3.6Å; I595-I614 HydrophobicContact CG1-CG1 3.81Å; I595-I614 HydrophobicContact CG2-CD1 4.14Å; I595-I614 HydrophobicContact CG2-CG1 3.78Å; I614-D616 VanDerWaalsContact C-N 3.27Å; I614-D616 PolarHBondContact O-N 2.78Å; I614-K617 PolarHBondContact N-O 3.22Å; I614-K617 PolarHBondContact O-N 2.92Å
615	N	83.6	Confident	89	Confident	154 Å²	154	59.4 Å²	59.4	82%	0.824	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	47.1	50	175.3	-57.9	-30.4	0	0	0	112.8	K617	N615-K617 PolarHBondContact O-N 2.79Å
616	D	82	Confident	89.6	Confident	138 Å²	138	57.7 Å²	57.7	74%	0.738	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.3	4.9	-178	-57.3	-34.4	0	0	0	117.4	Q613 I614	Q613-D616 PolarHBondContact NE2-OD1 3.17Å; I614-D616 VanDerWaalsContact C-N 3.27Å; I614-D616 PolarHBondContact O-N 2.78Å
617	K	88.1	Confident	90.2	Very high	155 Å²	155	61.6 Å²	61.6	67%	0.674	32%	0.318	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84.2	133.8	158.6	-67	-172.3	176.1	-173.4	0	109.5	L587 Q613 I614 N615	L587-K617 HydrophobicContact CD1-CB 3.58Å; Q613-K617 CarbonylContact C-O 3.58Å; Q613-K617 VanDerWaalsContact CA-O 3.27Å; Q613-K617 WeakPolarHBondContact CA-O 3.37Å; I614-K617 PolarHBondContact N-O 3.22Å; I614-K617 PolarHBondContact O-N 2.92Å; N615-K617 PolarHBondContact O-N 2.79Å
618	V	90.7	Very high	90.5	Very high	68 Å²	68	59.1 Å²	59.1	41%	0.412	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	145.9	169.1	-68.2	0	0	0	0	109.6	F598 Y611 G612 Q613	F598-V618 HydrophobicContact CE2-CG1 4.05Å; F598-V618 HydrophobicContact CZ-CG1 4.36Å; Y611-V618 HydrophobicContact CE1-CB 4.4Å; Y611-V618 HydrophobicContact CE2-CB 4.41Å; Y611-V618 VanDerWaalsContact OH-CG2 3.27Å; Y611-V618 WeakPolarHBondContact OH-CG2 3.35Å; G612-V618 CarbonylContact O-C 3.43Å; G612-V618 VanDerWaalsContact O-CA 3.26Å; G612-V618 WeakPolarHBondContact O-CA 3.34Å; Q613-V618 HydrophobicContact CB-CG1 3.93Å; Q613-V618 HydrophobicContact CG-CG1 3.98Å
619	G	90.8	Very high	90.3	Very high	1 Å²	1	61.3 Å²	61.3	1%	0.01	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	178.1	176.4	177.4	0	0	0	0	0	114.5	D585 G612	D585-G619 CarbonylContact O-C 3.57Å; D585-G619 WeakPolarHBondContact O-CA 3.46Å; G612-G619 PolarHBondContact N-O 3.17Å; G612-G619 PolarHBondContact O-N 3.43Å
620	L	91.9	Very high	89.2	Confident	27 Å²	27	62.2 Å²	62.2	14%	0.141	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	143	179.8	-69.2	167.3	0	0	0	111.5	D585 E586 L587 I603 V605 W609 L610 Y611	D585-L620 PolarHBondContact O-N 2.76Å; E586-L620 CarbonylContact C-O 3.35Å; E586-L620 VanDerWaalsContact CA-O 3.23Å; E586-L620 WeakPolarHBondContact CA-O 3.33Å; L587-L620 PolarHBondContact N-O 2.91Å; I603-L620 HydrophobicContact CD1-CD1 4.22Å; I603-L620 HydrophobicContact CD1-CD2 4.06Å; I603-L620 HydrophobicContact CD1-CG 4.11Å; V605-L620 HydrophobicContact CG1-CD2 3.89Å; V605-L620 HydrophobicContact CG2-CD2 4.11Å; W609-L620 HydrophobicContact CE3-CB 3.91Å; W609-L620 HydrophobicContact CZ3-CB 4.26Å; L610-L620 WeakPolarHBondContact O-CA 3.2Å; Y611-L620 HydrophobicContact CD2-CD2 4.17Å; Y611-L620 HydrophobicContact CD2-CG 4.27Å
621	F	93.7	Very high	87.5	Confident	0 Å²	0	68.3 Å²	68.3	0%	0	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.4	157	169.1	49.1	-88.8	0	0	0	110.6	F579 L587 F589 I595 V597 W609 L610 V626	F579-F621 HydrophobicContact CD1-CB 3.99Å; F579-F621 HydrophobicContact CE1-CB 4.09Å; L587-F621 HydrophobicContact CB-CD1 4.07Å; L587-F621 HydrophobicContact CD2-CD1 4.01Å; L587-F621 HydrophobicContact CD2-CE1 3.95Å; F589-F621 HydrophobicContact CE1-CB 3.6Å; F589-F621 HydrophobicContact CE1-CD1 4.12Å; F589-F621 AromaticContact CE1-CD2 4Å; F589-F621 HydrophobicContact CE1-CD2 4Å; F589-F621 AromaticContact CE1-CG 3.64Å; F589-F621 HydrophobicContact CE1-CG 3.64Å; F589-F621 HydrophobicContact CZ-CB 4.08Å; F589-F621 HydrophobicContact CZ-CD2 4.18Å; F589-F621 HydrophobicContact CZ-CG 4.21Å; I595-F621 HydrophobicContact CB-CZ 4.48Å; I595-F621 HydrophobicContact CD1-CE2 4.42Å; I595-F621 HydrophobicContact CD1-CZ 4.39Å; I595-F621 HydrophobicContact CG2-CE1 3.72Å; I595-F621 HydrophobicContact CG2-CE2 4.41Å; I595-F621 HydrophobicContact CG2-CZ 3.48Å; I595-F621 VanDerWaalsContact CG2-CZ 3.48Å; V597-F621 HydrophobicContact CG2-CE2 4.34Å; V597-F621 HydrophobicContact CG2-CZ 3.89Å; W609-F621 CarbonylContact C-O 3.57Å; W609-F621 WeakPolarHBondContact CA-O 3.33Å; L610-F621 HydrophobicContact CB-CD2 4.24Å; L610-F621 HydrophobicContact CB-CE2 3.72Å; L610-F621 HydrophobicContact CB-CZ 4.02Å; L610-F621 HydrophobicContact CD1-CE2 4.19Å; L610-F621 PolarHBondContact N-O 3.41Å; L610-F621 PolarHBondContact O-N 2.87Å; F621-V626 HydrophobicContact CD2-CG1 3.93Å; F621-V626 HydrophobicContact CD2-CG2 4.35Å; F621-V626 HydrophobicContact CE2-CG1 3.79Å; F621-V626 HydrophobicContact CE2-CG2 3.96Å
622	P	92.6	Very high	85.3	Confident	18 Å²	18	69.1 Å²	69.1	12%	0.117	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.5	136.9	179.1	-18.4	31.6	0	0	0	111.5	F579 G608 W609 T624 Y625	F579-P622 HydrophobicContact CD2-CG 4.22Å; F579-P622 HydrophobicContact CE2-CG 3.76Å; F579-P622 HydrophobicContact CZ-CG 4.19Å; G608-P622 CarbonylContact O-C 3.6Å; G608-P622 WeakPolarHBondContact O-CA 3.39Å; W609-P622 HydrophobicContact CE3-CG 4.45Å; W609-P622 HydrophobicContact CH2-CG 4.37Å; W609-P622 HydrophobicContact CZ3-CG 4.25Å; P622-T624 PolarHBondContact O-N 3.34Å; P622-Y625 HydrophobicContact CB-CD2 3.84Å; P622-Y625 HydrophobicContact CB-CE2 4.47Å; P622-Y625 HydrophobicContact CG-CD2 3.98Å; P622-Y625 HydrophobicContact CG-CE2 4.34Å; P622-Y625 PolarHBondContact O-N 3Å; P622-Y625 VanDerWaalsContact O-N 3.11Å
623	E	91.3	Very high	83.3	Confident	40 Å²	40	79.3 Å²	79.3	19%	0.187	40%	0.404	C	S	.	.	G	3₁₀ helix	trans	-55.2	-35.9	174.3	-177.1	-179.8	-172.1	0	0	111.1	G608 L610 Y625 V626 H643	G608-E623 PolarHBondContact O-N 3.36Å; L610-E623 HydrophobicContact CD1-CB 4.25Å; L610-E623 HydrophobicContact CD1-CG 4.07Å; L610-E623 HydrophobicContact CG-CB 4.04Å; L610-E623 HydrophobicContact CG-CG 4.24Å; E623-Y625 PolarHBondContact O-N 3.25Å; E623-Y625 VanDerWaalsContact O-N 3.17Å; E623-V626 VanDerWaalsContact O-CG2 3.22Å; E623-V626 WeakPolarHBondContact O-CG2 3.3Å; E623-V626 PolarHBondContact O-N 3.11Å; E623-V626 VanDerWaalsContact O-O 3.11Å; E623-H643 IonicContact OE1-CE1 3.38Å; E623-H643 IonicContact OE1-CG 3.25Å; E623-H643 IonicContact OE1-ND1 3.83Å; E623-H643 PolarHBondContact OE1-ND1 3.38Å
624	T	91.3	Very high	80.8	Confident	97 Å²	97	84.9 Å²	84.9	60%	0.595	43%	0.434	S	S	*	.	G	3₁₀ helix	trans	-70.2	-6.7	-178.7	54.8	0	0	0	0	115.2	P622	P622-T624 PolarHBondContact O-N 3.34Å
625	Y	93.8	Very high	78.5	Confident	84 Å²	84	89.3 Å²	89.3	33%	0.329	46%	0.458	S	S	.	.	G	3₁₀ helix	trans	-94.2	-2.2	176.5	-84.1	-115.6	0	0	0	113	M576 F577 D578 F579 P622 E623	M576-Y625 PolarHBondContact N-O 3.17Å; F577-Y625 HydrophobicContact CB-CD1 3.75Å; F577-Y625 HydrophobicContact CB-CE1 4.03Å; F577-Y625 HydrophobicContact CB-CG 4.45Å; F577-Y625 PolarHBondContact N-O 3.47Å; D578-Y625 WeakPolarHBondContact O-CE1 3.1Å; F579-Y625 HydrophobicContact CB-CD1 3.73Å; F579-Y625 HydrophobicContact CB-CE1 4.27Å; F579-Y625 HydrophobicContact CB-CG 4.42Å; F579-Y625 AromaticContact CD2-CD1 3.92Å; F579-Y625 HydrophobicContact CD2-CD1 3.92Å; F579-Y625 AromaticContact CD2-CE1 3.93Å; F579-Y625 HydrophobicContact CD2-CE1 3.93Å; F579-Y625 HydrophobicContact CD2-CG 4.3Å; F579-Y625 HydrophobicContact CG-CD1 4.24Å; P622-Y625 HydrophobicContact CB-CD2 3.84Å; P622-Y625 HydrophobicContact CB-CE2 4.47Å; P622-Y625 HydrophobicContact CG-CD2 3.98Å; P622-Y625 HydrophobicContact CG-CE2 4.34Å; P622-Y625 PolarHBondContact O-N 3Å; P622-Y625 VanDerWaalsContact O-N 3.11Å; E623-Y625 PolarHBondContact O-N 3.25Å; E623-Y625 VanDerWaalsContact O-N 3.17Å
626	V	92.9	Very high	77	Confident	2 Å²	2	87.5 Å²	87.5	1%	0.012	45%	0.454	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	158.7	-173.7	-62.1	0	0	0	0	111.6	Y573 E574 F589 I595 L610 F621 E623	Y573-V626 HydrophobicContact CD1-CB 3.99Å; Y573-V626 HydrophobicContact CD1-CG2 3.54Å; Y573-V626 HydrophobicContact CE1-CG2 4.15Å; Y573-V626 HydrophobicContact CG-CG2 4.47Å; E574-V626 CarbonylContact O-C 3.56Å; E574-V626 VanDerWaalsContact O-CA 3.3Å; E574-V626 WeakPolarHBondContact O-CA 3.33Å; F589-V626 HydrophobicContact CE2-CG1 4.28Å; F589-V626 HydrophobicContact CZ-CG1 3.85Å; I595-V626 HydrophobicContact CD1-CG1 3.71Å; L610-V626 HydrophobicContact CD1-CG2 3.82Å; F621-V626 HydrophobicContact CD2-CG1 3.93Å; F621-V626 HydrophobicContact CD2-CG2 4.35Å; F621-V626 HydrophobicContact CE2-CG1 3.79Å; F621-V626 HydrophobicContact CE2-CG2 3.96Å; E623-V626 VanDerWaalsContact O-CG2 3.22Å; E623-V626 WeakPolarHBondContact O-CG2 3.3Å; E623-V626 PolarHBondContact O-N 3.11Å; E623-V626 VanDerWaalsContact O-O 3.11Å
627	R	90.7	Very high	75.3	Confident	119 Å²	119	89.9 Å²	89.9	45%	0.449	46%	0.458	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	147	165.2	61.2	-178.6	-177.3	-161.9	-2.8	110.5	Y573 E574 M576 K629	Y573-R627 CarbonylContact C-O 3.6Å; Y573-R627 VanDerWaalsContact CA-O 3.23Å; Y573-R627 WeakPolarHBondContact CA-O 3.45Å; Y573-R627 WeakPolarHBondContact CB-O 3.44Å; Y573-R627 VanDerWaalsContact CD1-C 3.43Å; Y573-R627 WeakPolarHBondContact CD1-O 3.26Å; E574-R627 HydrophobicContact CB-CG 4.13Å; E574-R627 PolarHBondContact N-O 3.09Å; E574-R627 PolarHBondContact O-N 3.05Å; E574-R627 IonicContact OE1-CZ 3.58Å; E574-R627 IonicContact OE1-NH2 3.87Å; E574-R627 PolarHBondContact OE1-NH2 2.71Å; E574-R627 IonicContact OE2-CZ 3.61Å; E574-R627 IonicContact OE2-NE 3.69Å; E574-R627 PolarHBondContact OE2-NE 2.87Å; E574-R627 IonicContact OE2-NH2 2.77Å; E574-R627 PolarHBondContact OE2-NH2 3.25Å; M576-R627 HydrophobicContact CG-CB 4.09Å; M576-R627 HydrophobicContact CG-CG 3.99Å; M576-R627 HydrophobicContact SD-CB 3.78Å; M576-R627 HydrophobicContact SD-CG 4.27Å; R627-K629 PolarHBondContact O-N 2.91Å
628	K	89.7	Confident	73.4	Confident	86 Å²	86	87.4 Å²	87.4	37%	0.374	45%	0.452	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66	125	169.9	-173.5	166	179	162.5	0	109.3	E571 Y573 V630	E571-K628 VanDerWaalsContact CD-CE 3.48Å; E571-K628 WeakPolarHBondContact OE1-CE 3.4Å; E571-K628 IonicContact OE1-NZ 3.67Å; E571-K628 PolarHBondContact OE1-NZ 2.87Å; E571-K628 WeakPolarHBondContact OE2-CE 3.41Å; E571-K628 IonicContact OE2-NZ 2.71Å; E571-K628 PolarHBondContact OE2-NZ 3.19Å; Y573-K628 HydrophobicContact CD1-CB 4.29Å; Y573-K628 HydrophobicContact CD2-CB 4.4Å; Y573-K628 HydrophobicContact CD2-CG 4.39Å; Y573-K628 HydrophobicContact CE1-CB 3.93Å; Y573-K628 HydrophobicContact CE2-CB 3.99Å; Y573-K628 HydrophobicContact CE2-CD 4.2Å; Y573-K628 HydrophobicContact CE2-CG 3.9Å; K628-V630 PolarHBondContact O-N 3.49Å
629	K	82.7	Confident	71.1	Confident	82 Å²	82	89 Å²	89	36%	0.357	47%	0.465	S	S	.	.			trans	-83.7	114.1	-177.7	-173.7	172.6	175.3	-178.9	0	109.9	L572 L594 R627	L572-K629 HydrophobicContact CD2-CD 4.11Å; L572-K629 WeakPolarHBondContact O-CB 3.45Å; L572-K629 PolarHBondContact O-N 3.49Å; L594-K629 HydrophobicContact CD2-CD 3.7Å; R627-K629 PolarHBondContact O-N 2.91Å
630	V	68.1	Low	68.8	Low	115 Å²	115	96.3 Å²	96.3	70%	0.697	50%	0.496	S	S	*	.			trans	-106.6	117.8	179.6	-175.8	0	0	0	0	109.3	K628 G632	K628-V630 PolarHBondContact O-N 3.49Å; V630-G632 PolarHBondContact O-N 2.99Å
631	D	56	Low	66.3	Low	156 Å²	156	97 Å²	97	83%	0.834	51%	0.509	S	S	*	.			trans	-76.7	75.9	174.8	-72.3	-34.9	0	0	0	110.6
632	G	47.1	Very low	64	Low	51 Å²	51	102.4 Å²	102.4	53%	0.526	54%	0.543	S	S	.	.	S	Bend	trans	-156.3	163.1	-178.5	0	0	0	0	0	112.5	V630 I634	V630-G632 PolarHBondContact O-N 2.99Å; G632-I634 PolarHBondContact O-N 3.01Å
633	K	50	Low	61.6	Low	214 Å²	214	104.6 Å²	104.6	93%	0.93	55%	0.551	S	S	*	*	P	Polyproline II helix	trans	-58.8	127.6	-178.8	-74.4	179.8	175.9	177.6	0	111.3	D635	K633-D635 PolarHBondContact O-N 3.36Å
634	I	39.3	Very low	59.1	Low	160 Å²	160	111.5 Å²	111.5	82%	0.821	58%	0.581	S	S	*	*	P	Polyproline II helix	trans	-63.6	129.3	171.9	-59.3	167.1	0	0	0	109.3	G632	G632-I634 PolarHBondContact O-N 3.01Å
635	D	41.8	Very low	56.4	Low	109 Å²	109	111.5 Å²	111.5	58%	0.583	58%	0.576	S	S	*	*	P	Polyproline II helix	trans	-83.2	127.7	167.3	-165.8	-44.3	0	0	0	109.3	K633 F637	K633-D635 PolarHBondContact O-N 3.36Å; D635-F637 PolarHBondContact O-N 3.26Å; D635-F637 VanDerWaalsContact O-N 3.07Å; D635-F637 PolarHBondContact OD1-N 2.87Å; D635-F637 VanDerWaalsContact OD1-N 3.08Å
636	P	52.8	Low	53.5	Low	116 Å²	116	111.3 Å²	111.3	75%	0.753	58%	0.583	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.6	-7	179	-24.7	35.6	0	0	0	116.7
637	F	45.9	Very low	50.6	Low	187 Å²	187	116 Å²	116	82%	0.82	61%	0.608	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.4	-5.2	-171	-78.1	-84.2	0	0	0	117.3	D635	D635-F637 PolarHBondContact O-N 3.26Å; D635-F637 VanDerWaalsContact O-N 3.07Å; D635-F637 PolarHBondContact OD1-N 2.87Å; D635-F637 VanDerWaalsContact OD1-N 3.08Å
638	D	49.1	Very low	47.8	Very low	103 Å²	103	116.7 Å²	116.7	55%	0.551	63%	0.626	S	S	*	*			trans	-117.6	99.3	170.1	-175.6	2.9	0	0	0	111.8	F640 G641	D638-F640 VanDerWaalsContact C-N 3.31Å; D638-F640 PolarHBondContact O-N 3.44Å; D638-F640 PolarHBondContact OD1-N 3.28Å; D638-G641 PolarHBondContact OD1-N 2.86Å; D638-G641 VanDerWaalsContact OD2-CA 3.29Å; D638-G641 WeakPolarHBondContact OD2-CA 3.32Å; D638-G641 PolarHBondContact OD2-N 3.31Å
639	P	42.6	Very low	44.8	Very low	103 Å²	103	117.7 Å²	117.7	67%	0.669	64%	0.643	S	S	*	*	S	Bend	trans	-79.4	-4.1	176.6	-13.1	29.8	0	0	0	114.9
640	F	42.5	Very low	42.3	Very low	153 Å²	153	120 Å²	120	67%	0.671	66%	0.663	S	S	*	*	S	Bend	trans	-130.9	-34.1	-163.5	-63.4	-68.6	0	0	0	115.8	D638 V642	D638-F640 VanDerWaalsContact C-N 3.31Å; D638-F640 PolarHBondContact O-N 3.44Å; D638-F640 PolarHBondContact OD1-N 3.28Å; F640-V642 HydrophobicContact CB-CG2 4.44Å; F640-V642 VanDerWaalsContact O-CG2 3.32Å; F640-V642 WeakPolarHBondContact O-CG2 2.99Å; F640-V642 PolarHBondContact O-N 2.94Å
641	G	39.3	Very low	40.5	Very low	41 Å²	41	119.2 Å²	119.2	42%	0.423	66%	0.663	S	S	.	*			trans	64	23.5	164.4	0	0	0	0	0	117.6	D638 H643	D638-G641 PolarHBondContact OD1-N 2.86Å; D638-G641 VanDerWaalsContact OD2-CA 3.29Å; D638-G641 WeakPolarHBondContact OD2-CA 3.32Å; D638-G641 PolarHBondContact OD2-N 3.31Å; G641-H643 PolarHBondContact O-N 3.35Å; G641-H643 VanDerWaalsContact O-N 3.17Å
642	V	44.2	Very low	39.3	Very low	115 Å²	115	117 Å²	117	70%	0.697	66%	0.66	S	S	*	*			trans	-86	93.5	-167.1	-168.6	0	0	0	0	114	F640	F640-V642 HydrophobicContact CB-CG2 4.44Å; F640-V642 VanDerWaalsContact O-CG2 3.32Å; F640-V642 WeakPolarHBondContact O-CG2 2.99Å; F640-V642 PolarHBondContact O-N 2.94Å
643	H	41.5	Very low	38.9	Very low	63 Å²	63	122 Å²	122	29%	0.292	67%	0.673	S	S	.	*			trans	32	126.4	130.2	-70.2	-110.3	0	0	0	120.6	E623 G641	E623-H643 IonicContact OE1-CE1 3.38Å; E623-H643 IonicContact OE1-CG 3.25Å; E623-H643 IonicContact OE1-ND1 3.83Å; E623-H643 PolarHBondContact OE1-ND1 3.38Å; G641-H643 PolarHBondContact O-N 3.35Å; G641-H643 VanDerWaalsContact O-N 3.17Å
644	K	38.9	Very low	37.9	Very low	186 Å²	186	120.7 Å²	120.7	81%	0.809	67%	0.672	S	S	*	*				-163.9	134.9	121.3	-114.1	172.6	-175.9	-179.7	0	113.6
645	I	35.4	Very low	37.5	Very low	96 Å²	96	120.8 Å²	120.8	49%	0.492	67%	0.671	S	S	.	*			trans	-112	133.5	166.3	-60.3	171.8	0	0	0	107.1	I766	I645-I766 HydrophobicContact CG2-CD1 3.72Å
646	T	32.4	Very low	37.1	Very low	80 Å²	80	121.8 Å²	121.8	49%	0.491	68%	0.681	S	S	.	*			trans	-138.6	104.2	179	52.6	0	0	0	0	110.8	N768	T646-N768 PolarHBondContact O-OD1 2.99Å
647	N	32.2	Very low	36.2	Very low	100 Å²	100	121.9 Å²	121.9	54%	0.535	68%	0.68	S	S	.	*			trans	-132.9	83.1	-170.8	-173.5	14.3	0	0	0	110.4	I766	N647-I766 HydrophobicContact CB-CD1 4.38Å; N647-I766 HydrophobicContact CB-CG2 3.91Å; N647-I766 VanDerWaalsContact CG-CG2 3.47Å; N647-I766 WeakPolarHBondContact ND2-CG2 3.26Å
648	T	31.3	Very low	35.6	Very low	135 Å²	135	118.6 Å²	118.6	83%	0.828	68%	0.676	S	S	*	*			trans	-134.5	127	-177	-49.9	0	0	0	0	111.3
649	C	27.4	Very low	34.9	Very low	106 Å²	106	120 Å²	120	72%	0.716	69%	0.688	S	S	*	*			trans	-114.3	161.1	165.3	-73.7	0	0	0	0	109.9
650	V	31.5	Very low	34.7	Very low	131 Å²	131	122.4 Å²	122.4	79%	0.794	69%	0.693	S	S	*	*			trans	55.5	97	164.9	-66.1	0	0	0	0	118.7
651	S	28.5	Very low	34.5	Very low	99 Å²	99	120.3 Å²	120.3	69%	0.692	70%	0.695	S	S	*	*				46	114.3	119.3	-49.9	0	0	0	0	119.8
652	S	31.5	Very low	34.4	Very low	109 Å²	109	124 Å²	124	76%	0.762	71%	0.71	S	S	*	*				169.7	151.9	122.5	-81.4	0	0	0	0	114.7
653	I	39.8	Very low	33.9	Very low	157 Å²	157	124.5 Å²	124.5	81%	0.805	71%	0.713	S	S	*	*			trans	57.6	111	148.4	-62.9	159.5	0	0	0	117.7
654	M	29	Very low	33.6	Very low	185 Å²	185	128.2 Å²	128.2	91%	0.911	73%	0.734	S	S	*	*			trans	-76	137.6	150.6	-66.6	-175.2	179.6	0	0	110
655	M	31.1	Very low	33.4	Very low	162 Å²	162	126 Å²	126	80%	0.798	73%	0.731	S	S	*	*			trans	171.2	94	139.8	-92.5	-62.4	173.6	0	0	109.1
656	T	32.1	Very low	33.5	Very low	130 Å²	130	127.3 Å²	127.3	80%	0.798	74%	0.743	S	S	*	*			trans	-93	149.9	158.8	50.1	0	0	0	0	107.8
657	T	34.8	Very low	33.9	Very low	119 Å²	119	128.1 Å²	128.1	73%	0.73	75%	0.75	S	S	*	*				-152	146.6	54	39.2	0	0	0	0	115.1
658	T	33.3	Very low	34	Very low	118 Å²	118	130.4 Å²	130.4	72%	0.724	76%	0.762	S	S	*	*				45.4	122.2	127.7	-37.3	0	0	0	0	118
659	T	33.3	Very low	34	Very low	132 Å²	132	129.6 Å²	129.6	81%	0.81	76%	0.757	S	S	*	*				-158	156.8	64.8	-45.6	0	0	0	0	113
660	I	39	Very low	34.2	Very low	153 Å²	153	133.4 Å²	133.4	79%	0.785	76%	0.762	S	S	*	*			trans	-109.4	-172.4	-176.1	10.3	173.4	0	0	0	110.3
661	P	37.4	Very low	34.3	Very low	109 Å²	109	132 Å²	132	71%	0.708	76%	0.758	S	S	*	*			cis	-134.6	-166	-6.1	30.1	-6.1	0	0	0	115.2
662	T	37	Very low	34.4	Very low	120 Å²	120	131.7 Å²	131.7	74%	0.736	76%	0.761	S	S	*	*			trans	99.5	154.7	160.1	-32.9	0	0	0	0	116.4
663	T	34.6	Very low	34.5	Very low	125 Å²	125	134.6 Å²	134.6	77%	0.767	77%	0.767	S	S	*	*				171.8	166.1	-64.9	-75	0	0	0	0	109.7
664	I	35.6	Very low	34.1	Very low	140 Å²	140	133.9 Å²	133.9	72%	0.718	76%	0.764	S	S	*	*			trans	120.2	118.5	162.2	-62.7	176.9	0	0	0	116.5
665	N	34	Very low	34.3	Very low	139 Å²	139	131.8 Å²	131.8	74%	0.743	76%	0.762	S	S	*	*			trans	65.7	98	154.7	-62	-2.4	0	0	0	124.5
666	T	38.5	Very low	34.3	Very low	124 Å²	124	131.4 Å²	131.4	76%	0.761	76%	0.764	S	S	*	*				3.9	167.6	113.5	54.4	0	0	0	0	121.6
667	P	39.3	Very low	34.4	Very low	98 Å²	98	132.7 Å²	132.7	64%	0.636	77%	0.766	S	S	*	*			cis	-142.2	178	-36.8	37.6	-19.6	0	0	0	115
668	N	34.1	Very low	34.3	Very low	147 Å²	147	131.8 Å²	131.8	79%	0.786	76%	0.764	S	S	*	*			trans	145.4	148.9	130.1	-79.1	-34.1	0	0	0	119.3
669	T	33	Very low	34.3	Very low	118 Å²	118	134 Å²	134	72%	0.724	77%	0.771	S	S	*	*			trans	91.9	95.2	143.4	-63.9	0	0	0	0	123.3
670	F	31.3	Very low	34.4	Very low	187 Å²	187	133.5 Å²	133.5	82%	0.82	77%	0.768	S	S	*	*				73.8	133.3	126.7	-87.2	-94.8	0	0	0	126.4
671	S	33.7	Very low	34.2	Very low	102 Å²	102	134.4 Å²	134.4	71%	0.713	77%	0.768	S	S	*	*			trans	53.6	125.7	146.6	54.8	0	0	0	0	120.9
672	A	30.3	Very low	34.2	Very low	91 Å²	91	134.6 Å²	134.6	75%	0.752	77%	0.77	S	S	*	*			cis	87.8	129	38	0	0	0	0	0	115.9
673	I	33	Very low	33.9	Very low	171 Å²	171	133.4 Å²	133.4	88%	0.877	77%	0.772	S	S	*	*			trans	-173.3	152.3	151.9	-101.5	155	0	0	0	111.1
674	N	30.8	Very low	33.9	Very low	141 Å²	141	135 Å²	135	75%	0.754	78%	0.776	S	S	*	*			trans	-86.1	168.5	-174	-54.1	-59.1	0	0	0	114.6
675	T	33.9	Very low	33.7	Very low	142 Å²	142	135.3 Å²	135.3	87%	0.871	78%	0.779	S	S	*	*				-172.2	156	112.8	20.2	0	0	0	0	113.6
676	N	30.4	Very low	33.8	Very low	154 Å²	154	135.4 Å²	135.4	82%	0.824	78%	0.78	S	S	*	*			trans	-121.1	150.9	-179.6	-71.1	-50.1	0	0	0	111.5
677	N	34.7	Very low	33.4	Very low	157 Å²	157	136.5 Å²	136.5	84%	0.84	78%	0.78	S	S	*	*			trans	-159.1	127.2	146	-91.1	-35.4	0	0	0	106.8
678	S	33.6	Very low	33.1	Very low	99 Å²	99	137.7 Å²	137.7	69%	0.692	79%	0.785	S	S	*	*			cis	80.3	107.4	42.1	-166.7	0	0	0	0	113.9
679	L	32.7	Very low	32.9	Very low	165 Å²	165	134.9 Å²	134.9	86%	0.864	78%	0.782	S	S	*	*				-162.4	154.5	124.8	-128.4	74.5	0	0	0	111.5
680	T	35.9	Very low	32.9	Very low	122 Å²	122	134.2 Å²	134.2	75%	0.748	78%	0.782	S	S	*	*			trans	-103.9	-168.5	174.7	47.3	0	0	0	0	109.3
681	E	34.8	Very low	32.8	Very low	171 Å²	171	133.7 Å²	133.7	80%	0.799	78%	0.783	S	S	*	*			cis	-163.8	-157.2	35.1	-143.3	-167.4	-147.8	0	0	111.8
682	P	37.3	Very low	32.7	Very low	114 Å²	114	135.7 Å²	135.7	74%	0.74	79%	0.791	S	S	*	*				-124.9	-153.1	-119.7	46.1	-27.8	0	0	0	116.1
683	A	31.3	Very low	32.6	Very low	95 Å²	95	137.7 Å²	137.7	79%	0.785	79%	0.794	S	S	*	*			trans	-98.2	-176.9	-168.3	0	0	0	0	0	114.7
684	N	34.1	Very low	32.5	Very low	158 Å²	158	134.8 Å²	134.8	85%	0.845	79%	0.786	S	S	*	*			trans	-148.6	149.2	166.7	-146.7	-9.8	0	0	0	110.6
685	D	30.7	Very low	32.5	Very low	146 Å²	146	134.7 Å²	134.7	78%	0.781	79%	0.791	S	S	*	*			trans	-95.4	178.6	-166.9	-73.2	-60	0	0	0	115.1
686	N	35.4	Very low	32.4	Very low	142 Å²	142	133.4 Å²	133.4	76%	0.759	78%	0.783	S	S	*	*			trans	119.6	147.2	163.1	-69.5	-66.6	0	0	0	115.4
687	L	31.3	Very low	32.3	Very low	146 Å²	146	135.2 Å²	135.2	76%	0.764	78%	0.783	S	S	*	*			cis	-171.3	149.5	-20.7	-174.2	63.7	0	0	0	109.9
688	V	33.7	Very low	31.8	Very low	123 Å²	123	135 Å²	135	75%	0.745	78%	0.782	S	S	*	*			trans	65.9	102.9	155.1	156	0	0	0	0	121.6
689	A	29.5	Very low	31.6	Very low	88 Å²	88	137 Å²	137	73%	0.727	79%	0.785	S	S	*	*				68.6	170.9	117.7	0	0	0	0	0	124.6
690	S	32.8	Very low	31.4	Very low	104 Å²	104	135 Å²	135	73%	0.727	77%	0.774	S	S	*	*			trans	77.4	97.9	173.1	-46.8	0	0	0	0	115.6
691	E	28.3	Very low	30.9	Very low	177 Å²	177	136.4 Å²	136.4	83%	0.827	78%	0.776	S	S	*	*				64.3	101.5	79.9	-68.6	-165.8	132.1	0	0	115.4
692	T	33.1	Very low	30.6	Very low	144 Å²	144	132.8 Å²	132.8	88%	0.883	77%	0.765	S	S	*	*				178	160.7	107.6	29.8	0	0	0	0	112.4
693	T	27	Very low	30.1	Very low	133 Å²	133	135.9 Å²	135.9	82%	0.816	77%	0.768	S	S	*	*			trans	-118.8	-168.2	-173.7	53.6	0	0	0	0	110.6
694	P	31.7	Very low	30.1	Very low	109 Å²	109	136 Å²	136	71%	0.708	76%	0.761	S	S	*	*				-130.2	164.7	-76.7	39.6	-24.9	0	0	0	113.6
695	T	30.7	Very low	29.9	Very low	140 Å²	140	136.2 Å²	136.2	86%	0.859	76%	0.761	S	S	*	*			trans	-142.5	98.5	158.7	-32.7	0	0	0	0	114.4
696	T	32.5	Very low	29.9	Very low	115 Å²	115	136.3 Å²	136.3	71%	0.706	76%	0.762	S	S	*	*			trans	-21.7	152.3	147.7	24.8	0	0	0	0	117.9
697	K	27	Very low	30.3	Very low	192 Å²	192	134.1 Å²	134.1	84%	0.835	75%	0.75	S	S	*	*			cis	-133	129.4	5.9	-62	-176.5	177.1	-178.4	0	110.6
698	L	25.2	Very low	31.3	Very low	153 Å²	153	132.9 Å²	132.9	80%	0.801	74%	0.739	S	S	*	*			trans	-156.5	87.8	170.8	-153.8	163.1	0	0	0	108.7
699	N	28.2	Very low	32.5	Very low	141 Å²	141	134 Å²	134	75%	0.754	73%	0.731	S	S	*	*			trans	-133.9	131.1	176.8	-61.7	59.5	0	0	0	105.2
700	D	27.9	Very low	34.1	Very low	122 Å²	122	130 Å²	130	65%	0.652	70%	0.698	S	S	*	*			cis	59.3	69.5	31.3	-66.6	-6.3	0	0	0	113.7	T702	D700-T702 WeakPolarHBondContact O-CB 3.13Å; D700-T702 PolarHBondContact O-OG1 3.22Å
701	I	27.5	Very low	35.7	Very low	152 Å²	152	129.2 Å²	129.2	78%	0.779	68%	0.683	S	S	*	*			trans	-82.1	93.3	149	-52.5	170.8	0	0	0	104.4
702	T	28.4	Very low	37.6	Very low	94 Å²	94	120.8 Å²	120.8	58%	0.577	64%	0.643	S	S	*	*			cis	38	87.9	46	-46.2	0	0	0	0	111.4	D700 P704	D700-T702 WeakPolarHBondContact O-CB 3.13Å; D700-T702 PolarHBondContact O-OG1 3.22Å; T702-P704 HydrophobicContact CG2-CB 4.35Å; T702-P704 HydrophobicContact CG2-CG 4.35Å; T702-P704 WeakPolarHBondContact O-CD 3.2Å
703	F	26.8	Very low	39.1	Very low	180 Å²	180	117.1 Å²	117.1	79%	0.789	62%	0.616	S	S	*	*			trans	-71	110	155.9	-82.1	-90.3	0	0	0	108.1
704	P	29.9	Very low	40.7	Very low	98 Å²	98	116.8 Å²	116.8	64%	0.636	61%	0.605	S	S	*	*			trans	-101.3	109.5	-178.1	15	7.2	0	0	0	109.2	T702 N706	T702-P704 HydrophobicContact CG2-CB 4.35Å; T702-P704 HydrophobicContact CG2-CG 4.35Å; T702-P704 WeakPolarHBondContact O-CD 3.2Å; P704-N706 PolarHBondContact O-N 3.05Å
705	N	30	Very low	42.1	Very low	161 Å²	161	117 Å²	117	86%	0.861	60%	0.601	S	S	*	*	S	Bend	trans	36.5	63.8	163.9	-64.2	5.7	0	0	0	116.3
706	N	31.2	Very low	43.6	Very low	148 Å²	148	113 Å²	113	79%	0.791	57%	0.57	S	S	*	*			trans	-128	103.5	151	-102.7	-23	0	0	0	106.1	P704 F708	P704-N706 PolarHBondContact O-N 3.05Å; N706-F708 PolarHBondContact O-N 3.5Å
707	D	43.2	Very low	44.8	Very low	96 Å²	96	113.7 Å²	113.7	51%	0.513	57%	0.569	S	S	.	*			trans	-64.5	98.6	173.4	-68.7	-75.6	0	0	0	108.6	Y709 K744	D707-Y709 HydrophobicContact CB-CD2 4.16Å; D707-Y709 HydrophobicContact CB-CE2 3.58Å; D707-Y709 WeakPolarHBondContact O-CD2 3.08Å; D707-Y709 PolarHBondContact O-N 2.81Å; D707-K744 WeakPolarHBondContact OD1-CE 3.47Å; D707-K744 IonicContact OD1-NZ 3.41Å
708	F	52.6	Low	46	Very low	120 Å²	120	106.3 Å²	106.3	53%	0.526	54%	0.54	S	S	.	.			trans	-82.8	87.4	-174.5	-147.3	-81.4	0	0	0	109.8	N706 G710 I745	N706-F708 PolarHBondContact O-N 3.5Å; F708-G710 PolarHBondContact O-N 2.92Å; F708-I745 HydrophobicContact CD1-CD1 4.01Å; F708-I745 PolarHBondContact O-N 3.41Å; F708-I745 VanDerWaalsContact O-N 3.08Å
709	Y	59.2	Low	47.2	Very low	147 Å²	147	102.6 Å²	102.6	58%	0.576	53%	0.527	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-71	112.5	171.2	-66.3	-82.7	0	0	0	110	D707 V743 K744	D707-Y709 HydrophobicContact CB-CD2 4.16Å; D707-Y709 HydrophobicContact CB-CE2 3.58Å; D707-Y709 WeakPolarHBondContact O-CD2 3.08Å; D707-Y709 PolarHBondContact O-N 2.81Å; Y709-V743 CarbonylContact C-O 3.51Å; Y709-V743 WeakPolarHBondContact CA-O 3.3Å; Y709-K744 HydrophobicContact CD1-CB 4.19Å; Y709-K744 HydrophobicContact CE1-CB 4.08Å; Y709-K744 HydrophobicContact CE1-CG 4.27Å
710	G	64	Low	47.4	Very low	3 Å²	3	103.3 Å²	103.3	3%	0.031	53%	0.528	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	136.8	166.7	0	0	0	0	0	111.1	F708 V743	F708-G710 PolarHBondContact O-N 2.92Å; G710-V743 PolarHBondContact N-O 2.83Å; G710-V743 PolarHBondContact O-N 3.11Å; G710-V743 VanDerWaalsContact O-N 3.13Å
711	E	66.2	Low	48	Very low	88 Å²	88	101.9 Å²	101.9	41%	0.411	53%	0.528	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	116.4	168.5	-168	-172.2	118.2	0	0	107.9	Q713 K778	E711-Q713 PolarHBondContact OE1-NE2 2.81Å; E711-K778 PolarHBondContact O-N 3.41Å
712	V	66.8	Low	49.1	Very low	1 Å²	1	100.2 Å²	100.2	1%	0.006	53%	0.525	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.5	135.2	-179.8	178.1	0	0	0	0	109.6	Q714 L737 T738 D741 V743 C776 L777	V712-Q714 VanDerWaalsContact CG1-O 3.26Å; V712-Q714 WeakPolarHBondContact CG1-O 3.36Å; V712-L737 HydrophobicContact CG1-CB 3.84Å; V712-L737 HydrophobicContact CG1-CD1 4.28Å; V712-L737 HydrophobicContact CG2-CB 4.09Å; V712-L737 HydrophobicContact CG2-CD1 4.12Å; V712-L737 HydrophobicContact CG2-CD2 4.49Å; V712-L737 HydrophobicContact CG2-CG 4.49Å; V712-T738 VanDerWaalsContact CB-O 3.27Å; V712-T738 WeakPolarHBondContact CB-O 3.41Å; V712-T738 VanDerWaalsContact CG1-O 3.22Å; V712-T738 WeakPolarHBondContact CG1-O 3.4Å; V712-D741 HydrophobicContact CG2-CB 4.31Å; V712-D741 WeakPolarHBondContact CG2-O 3.26Å; V712-V743 HydrophobicContact CG2-CG2 3.52Å; V712-C776 WeakPolarHBondContact CA-O 3.14Å; V712-L777 HydrophobicContact CG2-CD2 3.83Å
713	Q	64.3	Low	50.3	Low	66 Å²	66	98.3 Å²	98.3	31%	0.308	51%	0.51	S	S	.	.			trans	-128.2	-0.7	-172.8	-74.6	-93	-31.3	0	0	113	E711 C776 K778	E711-Q713 PolarHBondContact OE1-NE2 2.81Å; Q713-C776 PolarHBondContact N-O 3.3Å; Q713-K778 HydrophobicContact CB-CD 4.47Å; Q713-K778 HydrophobicContact CB-CG 4.15Å; Q713-K778 HydrophobicContact CG-CB 3.94Å; Q713-K778 HydrophobicContact CG-CD 3.83Å; Q713-K778 HydrophobicContact CG-CG 3.74Å
714	Q	61.4	Low	51.8	Low	127 Å²	127	96.4 Å²	96.4	59%	0.593	51%	0.514	S	S	*	.	S	Bend	trans	-144.8	135.8	167.4	-64.7	-173	-5.1	0	0	109.3	V712 W716	V712-Q714 VanDerWaalsContact CG1-O 3.26Å; V712-Q714 WeakPolarHBondContact CG1-O 3.36Å; Q714-W716 PolarHBondContact O-N 3.41Å
715	N	61.9	Low	52.9	Low	114 Å²	114	94.6 Å²	94.6	61%	0.61	50%	0.498	S	S	*	.			trans	-61.6	131.5	173.1	-78.2	3.2	0	0	0	109.8	L737 T738 V739	N715-L737 CarbonylContact C-O 3.37Å; N715-L737 WeakPolarHBondContact CA-O 3.29Å; N715-T738 WeakPolarHBondContact OD1-CA 3.35Å; N715-V739 WeakPolarHBondContact OD1-CG2 3.21Å; N715-V739 PolarHBondContact OD1-N 2.87Å
716	W	61.1	Low	54.3	Low	54 Å²	54	88.4 Å²	88.4	21%	0.205	47%	0.467	C	S	.	.	B	Isolated β-bridge	trans	-122.5	115	176.9	-179.6	-105.5	0	0	0	110.1	Q714 V718 I723 T736 L737 P773	Q714-W716 PolarHBondContact O-N 3.41Å; W716-V718 HydrophobicContact CZ2-CG2 4.07Å; W716-V718 VanDerWaalsContact NE1-CG2 3.29Å; W716-I723 HydrophobicContact CH2-CD1 3.5Å; W716-I723 HydrophobicContact CH2-CG1 3.92Å; W716-I723 HydrophobicContact CZ2-CD1 3.5Å; W716-I723 VanDerWaalsContact CZ2-CD1 3.5Å; W716-I723 HydrophobicContact CZ2-CG1 4.3Å; W716-T736 WeakPolarHBondContact O-CA 3.3Å; W716-T736 WeakPolarHBondContact O-CG2 3.33Å; W716-L737 HydrophobicContact CB-CB 3.97Å; W716-L737 HydrophobicContact CB-CD1 4Å; W716-L737 HydrophobicContact CB-CG 3.96Å; W716-L737 PolarHBondContact N-O 3.19Å; W716-L737 PolarHBondContact O-N 3.09Å; W716-P773 HydrophobicContact CD2-CG 3.81Å; W716-P773 VanDerWaalsContact CE2-CG 3.48Å; W716-P773 HydrophobicContact CE3-CG 4Å; W716-P773 HydrophobicContact CH2-CG 3.59Å; W716-P773 HydrophobicContact CZ2-CG 3.37Å; W716-P773 HydrophobicContact CZ3-CG 3.9Å
717	N	58.8	Low	55.6	Low	130 Å²	130	89.2 Å²	89.2	70%	0.695	47%	0.466	S	S	*	.			trans	-135.2	118.1	-179.9	-172.6	-1.7	0	0	0	108.7	S719 T736	N717-S719 PolarHBondContact O-N 2.93Å; N717-T736 HydrophobicContact CB-CG2 4.5Å
718	V	52	Low	56.5	Low	37 Å²	37	88.9 Å²	88.9	22%	0.224	46%	0.464	C	S	.	.			trans	-83.6	99.4	-170.6	-179.9	0	0	0	0	110.5	W716 I723 F734	W716-V718 HydrophobicContact CZ2-CG2 4.07Å; W716-V718 VanDerWaalsContact NE1-CG2 3.29Å; V718-I723 HydrophobicContact CG1-CD1 4.07Å; V718-I723 HydrophobicContact CG2-CD1 4.45Å; V718-F734 HydrophobicContact CG1-CD2 4.06Å; V718-F734 HydrophobicContact CG1-CE2 4.41Å; V718-F734 HydrophobicContact CG1-CG 4.45Å; V718-F734 HydrophobicContact CG2-CB 4.03Å; V718-F734 HydrophobicContact CG2-CD2 4.49Å; V718-F734 HydrophobicContact CG2-CG 4.09Å
719	S	48.9	Very low	57	Low	75 Å²	75	83.9 Å²	83.9	52%	0.524	44%	0.443	S	S	.	.			trans	-78.5	126.1	153.1	-173.6	0	0	0	0	108.5	N717 S721	N717-S719 PolarHBondContact O-N 2.93Å; S719-S721 PolarHBondContact O-N 3.29Å; S719-S721 PolarHBondContact OG-OG 2.86Å
720	M	33.3	Very low	57.2	Low	156 Å²	156	82.3 Å²	82.3	77%	0.768	44%	0.443	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.3	0.6	-171.2	-148.4	-168.2	-61.8	0	0	114.5
721	S	41.3	Very low	57	Low	93 Å²	93	85.5 Å²	85.5	65%	0.65	46%	0.462	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.6	-6.7	-167	53.1	0	0	0	0	116.2	S719	S719-S721 PolarHBondContact O-N 3.29Å; S719-S721 PolarHBondContact OG-OG 2.86Å
722	T	49.4	Very low	56.9	Low	117 Å²	117	87.5 Å²	87.5	72%	0.718	48%	0.476	S	S	*	.	S	Bend	trans	-143	0.8	-156.6	-47.2	0	0	0	0	114.9
723	I	55	Low	57.1	Low	53 Å²	53	91 Å²	91	27%	0.272	49%	0.493	S	S	.	.			trans	-122.4	120.6	-173.7	-62.3	150.4	0	0	0	110	W716 V718 L725 W755	W716-I723 HydrophobicContact CH2-CD1 3.5Å; W716-I723 HydrophobicContact CH2-CG1 3.92Å; W716-I723 HydrophobicContact CZ2-CD1 3.5Å; W716-I723 VanDerWaalsContact CZ2-CD1 3.5Å; W716-I723 HydrophobicContact CZ2-CG1 4.3Å; V718-I723 HydrophobicContact CG1-CD1 4.07Å; V718-I723 HydrophobicContact CG2-CD1 4.45Å; I723-L725 HydrophobicContact CG2-CD2 4.01Å; I723-L725 PolarHBondContact O-N 3.4Å; I723-L725 VanDerWaalsContact O-N 3.16Å; I723-W755 HydrophobicContact CG2-CH2 4.16Å; I723-W755 HydrophobicContact CG2-CZ2 3.99Å
724	T	57	Low	57.8	Low	141 Å²	141	90 Å²	90	87%	0.865	49%	0.487	S	S	*	.			trans	-72.8	103.8	172.7	-49.1	0	0	0	0	109.5
725	L	54.2	Low	58.6	Low	59 Å²	59	84.1 Å²	84.1	31%	0.309	46%	0.46	S	S	.	.			trans	-77	137.1	-176.5	-65.3	175.9	0	0	0	112.1	I723 E727 T731 F734 W755	I723-L725 HydrophobicContact CG2-CD2 4.01Å; I723-L725 PolarHBondContact O-N 3.4Å; I723-L725 VanDerWaalsContact O-N 3.16Å; L725-E727 PolarHBondContact O-N 3.12Å; L725-T731 HydrophobicContact CD1-CG2 4.32Å; L725-F734 HydrophobicContact CD1-CE2 4.26Å; L725-F734 HydrophobicContact CD1-CZ 3.69Å; L725-F734 HydrophobicContact CD2-CE1 3.64Å; L725-F734 HydrophobicContact CD2-CE2 4.36Å; L725-F734 HydrophobicContact CD2-CZ 3.33Å; L725-F734 HydrophobicContact CG-CZ 4.15Å; L725-W755 HydrophobicContact CD2-CH2 4Å; L725-W755 HydrophobicContact CD2-CZ2 4.28Å
726	P	58.2	Low	59.2	Low	31 Å²	31	81.9 Å²	81.9	20%	0.201	45%	0.45	C	S	.	.			trans	-59.5	134.6	166.4	-21	32.4	0	0	0	110.7	N728 I729	P726-N728 PolarHBondContact O-N 2.94Å; P726-I729 HydrophobicContact CB-CD1 4.42Å; P726-I729 HydrophobicContact CG-CD1 4.07Å; P726-I729 PolarHBondContact O-N 2.96Å
727	E	59.3	Low	59.9	Low	166 Å²	166	79.3 Å²	79.3	78%	0.776	44%	0.441	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.3	-10.2	-175.3	-63	-169.7	153.6	0	0	115.9	R401 L725	R401-E727 IonicContact CZ-OE2 3.67Å; R401-E727 IonicContact NE-OE2 3.31Å; R401-E727 VanDerWaalsContact NH2-CB 3.32Å; R401-E727 IonicContact NH2-OE2 2.61Å; R401-E727 PolarHBondContact NH2-OE2 2.85Å; L725-E727 PolarHBondContact O-N 3.12Å
728	N	61.3	Low	60.6	Low	88 Å²	88	76 Å²	76	47%	0.471	43%	0.425	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.2	0.7	-177.8	-66.6	16.9	0	0	0	113.5	R401 P726 N751	R401-N728 PolarHBondContact NH1-OD1 3.39Å; R401-N728 PolarHBondContact NH2-OD1 3.4Å; P726-N728 PolarHBondContact O-N 2.94Å; N728-N751 PolarHBondContact ND2-ND2 3.18Å
729	I	63.5	Low	61.5	Low	16 Å²	16	77.5 Å²	77.5	8%	0.082	43%	0.434	C	S	.	.	S	Bend	trans	-106.4	122.6	177.9	-62.1	179.1	0	0	0	109.7	P726 F734 W755 W771	P726-I729 HydrophobicContact CB-CD1 4.42Å; P726-I729 HydrophobicContact CG-CD1 4.07Å; P726-I729 PolarHBondContact O-N 2.96Å; I729-F734 HydrophobicContact CG2-CE1 3.72Å; I729-F734 HydrophobicContact CG2-CZ 4.09Å; I729-W755 HydrophobicContact CD1-CB 4.43Å; I729-W755 HydrophobicContact CD1-CD2 3.98Å; I729-W755 HydrophobicContact CD1-CE3 4.05Å; I729-W755 HydrophobicContact CD1-CG 4.17Å; I729-W771 HydrophobicContact CD1-CB 4.23Å; I729-W771 HydrophobicContact CD1-CD2 3.94Å; I729-W771 HydrophobicContact CD1-CE3 4.3Å; I729-W771 HydrophobicContact CD1-CG 3.92Å; I729-W771 HydrophobicContact CG1-CD2 4.27Å; I729-W771 HydrophobicContact CG1-CG 4.24Å; I729-W771 HydrophobicContact CG2-CB 4.3Å; I729-W771 HydrophobicContact CG2-CG 4.03Å
730	L	62.9	Low	62.5	Low	113 Å²	113	79.5 Å²	79.5	59%	0.592	44%	0.439	S	S	*	.			trans	-74.2	144.4	173.2	-77.2	163.1	0	0	0	110.8	D732 Q733	L730-D732 PolarHBondContact O-N 3.07Å; L730-Q733 HydrophobicContact CB-CG 4.2Å; L730-Q733 PolarHBondContact O-N 3.37Å
731	T	59.5	Low	64.4	Low	70 Å²	70	73.4 Å²	73.4	43%	0.429	41%	0.41	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.3	-21.8	-178.8	42.7	0	0	0	0	114.7	L725 F734	L725-T731 HydrophobicContact CD1-CG2 4.32Å; T731-F734 WeakPolarHBondContact O-CD2 3.23Å; T731-F734 WeakPolarHBondContact O-CE2 3.49Å
732	D	65.4	Low	66	Low	130 Å²	130	75 Å²	75	70%	0.695	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.8	11.5	-168.3	-47.8	-4.1	0	0	0	111.5	L730	L730-D732 PolarHBondContact O-N 3.07Å
733	Q	70.9	Confident	67.4	Low	76 Å²	76	69.4 Å²	69.4	36%	0.355	37%	0.372	S	S	.	.			trans	-121	31.6	-172.7	-61.2	-172.3	11.3	0	0	113.5	L730 G770 W771	L730-Q733 HydrophobicContact CB-CG 4.2Å; L730-Q733 PolarHBondContact O-N 3.37Å; Q733-G770 CarbonylContact O-C 3.58Å; Q733-G770 VanDerWaalsContact O-CA 3.23Å; Q733-G770 WeakPolarHBondContact O-CA 3.38Å; Q733-W771 PolarHBondContact O-N 2.8Å
734	F	77.7	Confident	68.6	Low	43 Å²	43	69.5 Å²	69.5	19%	0.189	37%	0.37	C	S	.	.	B	Isolated β-bridge	trans	-90.8	145.9	177.4	-60	-59.5	0	0	0	113.2	V718 L725 I729 T731 W755 W771	V718-F734 HydrophobicContact CG1-CD2 4.06Å; V718-F734 HydrophobicContact CG1-CE2 4.41Å; V718-F734 HydrophobicContact CG1-CG 4.45Å; V718-F734 HydrophobicContact CG2-CB 4.03Å; V718-F734 HydrophobicContact CG2-CD2 4.49Å; V718-F734 HydrophobicContact CG2-CG 4.09Å; L725-F734 HydrophobicContact CD1-CE2 4.26Å; L725-F734 HydrophobicContact CD1-CZ 3.69Å; L725-F734 HydrophobicContact CD2-CE1 3.64Å; L725-F734 HydrophobicContact CD2-CE2 4.36Å; L725-F734 HydrophobicContact CD2-CZ 3.33Å; L725-F734 HydrophobicContact CG-CZ 4.15Å; I729-F734 HydrophobicContact CG2-CE1 3.72Å; I729-F734 HydrophobicContact CG2-CZ 4.09Å; T731-F734 WeakPolarHBondContact O-CD2 3.23Å; T731-F734 WeakPolarHBondContact O-CE2 3.49Å; F734-W755 HydrophobicContact CD1-CH2 4.42Å; F734-W755 AromaticContact CD1-CZ3 3.99Å; F734-W755 HydrophobicContact CD1-CZ3 3.99Å; F734-W755 HydrophobicContact CE1-CH2 4.02Å; F734-W755 AromaticContact CE1-CZ3 3.9Å; F734-W755 HydrophobicContact CE1-CZ3 3.9Å; F734-W771 WeakPolarHBondContact CA-O 3.33Å; F734-W771 HydrophobicContact CD1-CB 4.4Å
735	L	78.5	Confident	69.8	Low	5 Å²	5	64.5 Å²	64.5	3%	0.026	34%	0.338	C	S	.	.			trans	-106.2	111.6	172.5	-167.5	60.6	0	0	0	109.4	L737 V743 I760 N768 W771 F772	L735-L737 HydrophobicContact CB-CD2 4.35Å; L735-L737 HydrophobicContact CD2-CD2 4.04Å; L735-L737 HydrophobicContact CG-CD2 3.89Å; L735-V743 HydrophobicContact CD2-CG1 4.2Å; L735-I760 HydrophobicContact CD1-CD1 4.09Å; L735-I760 HydrophobicContact CD1-CG1 4.46Å; L735-I760 HydrophobicContact CD2-CD1 4Å; L735-I760 HydrophobicContact CD2-CG1 4.03Å; L735-I760 HydrophobicContact CG-CD1 3.87Å; L735-I760 HydrophobicContact CG-CG1 4.39Å; L735-N768 HydrophobicContact CD1-CB 3.85Å; L735-N768 WeakPolarHBondContact CD1-O 3.49Å; L735-W771 PolarHBondContact N-O 2.85Å; L735-F772 HydrophobicContact CB-CB 4.41Å; L735-F772 HydrophobicContact CB-CD1 4.24Å; L735-F772 HydrophobicContact CD2-CD1 3.87Å; L735-F772 HydrophobicContact CD2-CE1 4.22Å
736	T	75.5	Confident	71	Confident	66 Å²	66	64.9 Å²	64.9	41%	0.405	34%	0.343	S	S	.	.			trans	-64.9	134.6	167.6	-54.1	0	0	0	0	108.7	W716 N717 I760	W716-T736 WeakPolarHBondContact O-CA 3.3Å; W716-T736 WeakPolarHBondContact O-CG2 3.33Å; N717-T736 HydrophobicContact CB-CG2 4.5Å; T736-I760 WeakPolarHBondContact O-CD1 2.96Å
737	L	74.4	Confident	72	Confident	1 Å²	1	69.7 Å²	69.7	1%	0.005	36%	0.361	C	S	.	.	B	Isolated β-bridge	trans	-122.2	137.5	179	-43.3	176.6	0	0	0	110.7	V712 N715 W716 L735 V743 I760 F772 C776	V712-L737 HydrophobicContact CG1-CB 3.84Å; V712-L737 HydrophobicContact CG1-CD1 4.28Å; V712-L737 HydrophobicContact CG2-CB 4.09Å; V712-L737 HydrophobicContact CG2-CD1 4.12Å; V712-L737 HydrophobicContact CG2-CD2 4.49Å; V712-L737 HydrophobicContact CG2-CG 4.49Å; N715-L737 CarbonylContact C-O 3.37Å; N715-L737 WeakPolarHBondContact CA-O 3.29Å; W716-L737 HydrophobicContact CB-CB 3.97Å; W716-L737 HydrophobicContact CB-CD1 4Å; W716-L737 HydrophobicContact CB-CG 3.96Å; W716-L737 PolarHBondContact N-O 3.19Å; W716-L737 PolarHBondContact O-N 3.09Å; L735-L737 HydrophobicContact CB-CD2 4.35Å; L735-L737 HydrophobicContact CD2-CD2 4.04Å; L735-L737 HydrophobicContact CG-CD2 3.89Å; L737-V743 HydrophobicContact CD2-CG2 3.75Å; L737-I760 HydrophobicContact CD2-CD1 3.73Å; L737-F772 HydrophobicContact CD1-CB 3.82Å; L737-F772 HydrophobicContact CD1-CD2 3.61Å; L737-F772 HydrophobicContact CD1-CE2 4.4Å; L737-F772 HydrophobicContact CD1-CG 3.86Å; L737-F772 HydrophobicContact CD2-CB 4.04Å; L737-F772 HydrophobicContact CD2-CD1 4.26Å; L737-F772 HydrophobicContact CD2-CD2 4.37Å; L737-F772 HydrophobicContact CD2-CG 3.96Å; L737-F772 HydrophobicContact CG-CB 4.05Å; L737-F772 HydrophobicContact CG-CG 4.31Å; L737-C776 HydrophobicContact CD1-CB 3.4Å
738	T	73.9	Confident	73	Confident	60 Å²	60	64.2 Å²	64.2	37%	0.368	34%	0.335	S	S	.	.			trans	-112	156.5	164.6	72.1	0	0	0	0	110.3	V712 N715 D740 D741	V712-T738 VanDerWaalsContact CB-O 3.27Å; V712-T738 WeakPolarHBondContact CB-O 3.41Å; V712-T738 VanDerWaalsContact CG1-O 3.22Å; V712-T738 WeakPolarHBondContact CG1-O 3.4Å; N715-T738 WeakPolarHBondContact OD1-CA 3.35Å; T738-D740 PolarHBondContact O-N 3.37Å; T738-D741 WeakPolarHBondContact CA-OD2 3.46Å; T738-D741 WeakPolarHBondContact CB-OD2 3.45Å; T738-D741 PolarHBondContact N-OD2 3.26Å; T738-D741 WeakPolarHBondContact O-CB 3.35Å; T738-D741 PolarHBondContact O-N 3.28Å; T738-D741 VanDerWaalsContact OG1-CG 3.25Å; T738-D741 PolarHBondContact OG1-OD2 3.25Å
739	V	72.1	Confident	73.5	Confident	68 Å²	68	60.6 Å²	60.6	41%	0.412	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.6	-16.3	-178	163.7	0	0	0	0	114.3	N715	N715-V739 WeakPolarHBondContact OD1-CG2 3.21Å; N715-V739 PolarHBondContact OD1-N 2.87Å
740	D	69.9	Low	73.7	Confident	117 Å²	117	67.3 Å²	67.3	63%	0.626	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.9	-4.6	176.1	-64.5	-21.9	0	0	0	113.8	T738	T738-D740 PolarHBondContact O-N 3.37Å
741	D	73.2	Confident	73.6	Confident	29 Å²	29	67.6 Å²	67.6	16%	0.155	35%	0.354	C	S	.	.			trans	-79.4	127.2	-173.1	-72.3	-50.7	0	0	0	112.8	V712 T738 V743 I760	V712-D741 HydrophobicContact CG2-CB 4.31Å; V712-D741 WeakPolarHBondContact CG2-O 3.26Å; T738-D741 WeakPolarHBondContact CA-OD2 3.46Å; T738-D741 WeakPolarHBondContact CB-OD2 3.45Å; T738-D741 PolarHBondContact N-OD2 3.26Å; T738-D741 WeakPolarHBondContact O-CB 3.35Å; T738-D741 PolarHBondContact O-N 3.28Å; T738-D741 VanDerWaalsContact OG1-CG 3.25Å; T738-D741 PolarHBondContact OG1-OD2 3.25Å; D741-V743 PolarHBondContact O-N 3.15Å; D741-I760 HydrophobicContact CB-CD1 3.79Å; D741-I760 HydrophobicContact CB-CG1 4.14Å; D741-I760 HydrophobicContact CB-CG2 4.26Å
742	H	73.5	Confident	73.8	Confident	126 Å²	126	66.8 Å²	66.8	58%	0.583	35%	0.347	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86.9	97.4	168.4	-73	-38.2	0	0	0	110.3
743	V	78.8	Confident	73.9	Confident	0 Å²	0	67.4 Å²	67.4	0%	0	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84	122.4	177.8	-173.2	0	0	0	0	109.8	Y709 G710 V712 L735 L737 D741 I760 F772	Y709-V743 CarbonylContact C-O 3.51Å; Y709-V743 WeakPolarHBondContact CA-O 3.3Å; G710-V743 PolarHBondContact N-O 2.83Å; G710-V743 PolarHBondContact O-N 3.11Å; G710-V743 VanDerWaalsContact O-N 3.13Å; V712-V743 HydrophobicContact CG2-CG2 3.52Å; L735-V743 HydrophobicContact CD2-CG1 4.2Å; L737-V743 HydrophobicContact CD2-CG2 3.75Å; D741-V743 PolarHBondContact O-N 3.15Å; V743-I760 HydrophobicContact CB-CG1 4.32Å; V743-I760 HydrophobicContact CG1-CG1 4.49Å; V743-I760 HydrophobicContact CG2-CD1 3.96Å; V743-I760 HydrophobicContact CG2-CG1 3.67Å; V743-F772 HydrophobicContact CB-CZ 4.37Å; V743-F772 HydrophobicContact CG1-CD1 4.43Å; V743-F772 HydrophobicContact CG1-CE1 3.51Å; V743-F772 HydrophobicContact CG1-CZ 3.54Å
744	K	81.8	Confident	74.2	Confident	54 Å²	54	69.7 Å²	69.7	24%	0.235	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	109.7	169.2	-176.5	-154.6	179.3	-174.5	0	109.2	D707 Y709 T746 G758 E759	D707-K744 WeakPolarHBondContact OD1-CE 3.47Å; D707-K744 IonicContact OD1-NZ 3.41Å; Y709-K744 HydrophobicContact CD1-CB 4.19Å; Y709-K744 HydrophobicContact CE1-CB 4.08Å; Y709-K744 HydrophobicContact CE1-CG 4.27Å; K744-T746 PolarHBondContact O-N 3.29Å; K744-T746 PolarHBondContact O-OG1 2.82Å; K744-G758 VanDerWaalsContact O-CA 3.25Å; K744-G758 WeakPolarHBondContact O-CA 3.33Å; K744-E759 HydrophobicContact CB-CG 3.99Å; K744-E759 HydrophobicContact CD-CG 3.8Å; K744-E759 WeakPolarHBondContact CD-OE1 3.44Å; K744-E759 WeakPolarHBondContact CE-OE1 3.34Å; K744-E759 HydrophobicContact CG-CG 4.47Å; K744-E759 PolarHBondContact N-O 3.08Å; K744-E759 IonicContact NZ-OE1 2.87Å; K744-E759 PolarHBondContact NZ-OE1 3.28Å; K744-E759 PolarHBondContact O-N 3.14Å
745	I	81.7	Confident	74.3	Confident	36 Å²	36	68.3 Å²	68.3	19%	0.185	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.4	127.5	-179.3	-54	175.6	0	0	0	109.2	F708 Y756 L777	F708-I745 HydrophobicContact CD1-CD1 4.01Å; F708-I745 PolarHBondContact O-N 3.41Å; F708-I745 VanDerWaalsContact O-N 3.08Å; I745-Y756 HydrophobicContact CD1-CD2 4.12Å; I745-Y756 HydrophobicContact CD1-CE2 4.27Å; I745-Y756 HydrophobicContact CD1-CG 4.29Å; I745-Y756 HydrophobicContact CG2-CD1 4.15Å; I745-Y756 HydrophobicContact CG2-CG 4.27Å; I745-L777 HydrophobicContact CD1-CD1 3.72Å; I745-L777 HydrophobicContact CG1-CD1 4.18Å
746	T	79.5	Confident	74.5	Confident	68 Å²	68	70.6 Å²	70.6	42%	0.417	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	-27.4	-175.8	-58.1	0	0	0	0	112.1	K744 F757	K744-T746 PolarHBondContact O-N 3.29Å; K744-T746 PolarHBondContact O-OG1 2.82Å; T746-F757 WeakPolarHBondContact CA-O 3.46Å; T746-F757 PolarHBondContact N-O 3.07Å
747	K	78.3	Confident	75	Confident	132 Å²	132	69.2 Å²	69.2	57%	0.574	35%	0.345	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-147.5	158.8	166.5	-49.3	179.9	179.3	177.8	0	111.1	F757	K747-F757 HydrophobicContact CB-CB 4Å; K747-F757 HydrophobicContact CG-CB 4.48Å; K747-F757 PolarHBondContact N-O 2.85Å; K747-F757 PolarHBondContact O-N 2.88Å
748	E	80	Confident	75.4	Confident	50 Å²	50	69.2 Å²	69.2	23%	0.234	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	153.3	162.5	-175.5	172.6	164.1	0	0	108.7	D750 K753 Y756	E748-D750 PolarHBondContact O-N 3.16Å; E748-K753 VanDerWaalsContact OE1-CG 3.26Å; E748-K753 WeakPolarHBondContact OE1-CG 3.48Å; E748-K753 IonicContact OE1-NZ 3.2Å; E748-K753 PolarHBondContact OE1-NZ 2.91Å; E748-K753 IonicContact OE2-NZ 3.44Å; E748-Y756 HydrophobicContact CB-CD1 4.05Å; E748-Y756 HydrophobicContact CB-CE1 4.21Å; E748-Y756 HydrophobicContact CG-CD1 3.93Å; E748-Y756 HydrophobicContact CG-CE1 3.75Å
749	N	72.4	Confident	76	Confident	13 Å²	13	67.8 Å²	67.8	7%	0.07	33%	0.334	C	S	.	.			trans	-84	101.4	171.5	179	2	0	0	0	109.3	N751 N752 W755 W771	N749-N751 PolarHBondContact O-N 3.28Å; N749-N751 PolarHBondContact OD1-N 2.69Å; N749-N752 WeakPolarHBondContact CB-O 3.43Å; N749-N752 CarbonylContact O-C 3.53Å; N749-N752 PolarHBondContact O-N 2.97Å; N749-W755 HydrophobicContact CB-CB 3.8Å; N749-W755 VanDerWaalsContact CB-O 3.29Å; N749-W755 WeakPolarHBondContact CB-O 3.3Å; N749-W755 PolarHBondContact N-O 3.43Å; N749-W771 HydrophobicContact CB-CE3 4.38Å; N749-W771 HydrophobicContact CB-CH2 4.07Å; N749-W771 HydrophobicContact CB-CZ3 3.61Å
750	D	68.4	Low	76.6	Confident	157 Å²	157	64.8 Å²	64.8	84%	0.84	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.7	-27.9	-177.8	-58.1	-55.9	0	0	0	114	E748	E748-D750 PolarHBondContact O-N 3.16Å
751	N	60.7	Low	77	Confident	118 Å²	118	63.4 Å²	63.4	63%	0.631	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.7	-23.6	-179.1	-65.9	-29.8	0	0	0	113.7	N728 N749	N728-N751 PolarHBondContact ND2-ND2 3.18Å; N749-N751 PolarHBondContact O-N 3.28Å; N749-N751 PolarHBondContact OD1-N 2.69Å
752	N	63.5	Low	76.9	Confident	53 Å²	53	63.4 Å²	63.4	28%	0.283	31%	0.311	S	S	.	.			trans	-156.2	106.9	176.5	-174.3	1.8	0	0	0	110.5	N749 E754 W755	N749-N752 WeakPolarHBondContact CB-O 3.43Å; N749-N752 CarbonylContact O-C 3.53Å; N749-N752 PolarHBondContact O-N 2.97Å; N752-E754 PolarHBondContact ND2-OE2 2.98Å; N752-E754 PolarHBondContact O-N 2.93Å; N752-E754 VanDerWaalsContact OD1-CB 3.31Å; N752-E754 WeakPolarHBondContact OD1-CB 3.28Å; N752-E754 WeakPolarHBondContact OD1-CG 3.39Å; N752-E754 PolarHBondContact OD1-N 3.37Å; N752-E754 VanDerWaalsContact OD1-N 3.11Å; N752-E754 PolarHBondContact OD1-OE2 3.2Å; N752-W755 PolarHBondContact O-N 3.23Å; N752-W755 VanDerWaalsContact O-N 3.07Å
753	K	68.2	Low	76.8	Confident	143 Å²	143	66.6 Å²	66.6	62%	0.622	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.8	-8.9	179.8	-58.2	-171.4	159.4	-84.4	0	114.3	E748 W755 A774	E748-K753 VanDerWaalsContact OE1-CG 3.26Å; E748-K753 WeakPolarHBondContact OE1-CG 3.48Å; E748-K753 IonicContact OE1-NZ 3.2Å; E748-K753 PolarHBondContact OE1-NZ 2.91Å; E748-K753 IonicContact OE2-NZ 3.44Å; K753-W755 PolarHBondContact O-N 2.88Å; K753-A774 WeakPolarHBondContact O-CB 3.5Å
754	E	76.7	Confident	76.3	Confident	125 Å²	125	69.8 Å²	69.8	58%	0.584	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.6	-4.4	169.4	-64.1	172.8	162.4	0	0	113.7	N752 P773 A774	N752-E754 PolarHBondContact ND2-OE2 2.98Å; N752-E754 PolarHBondContact O-N 2.93Å; N752-E754 VanDerWaalsContact OD1-CB 3.31Å; N752-E754 WeakPolarHBondContact OD1-CB 3.28Å; N752-E754 WeakPolarHBondContact OD1-CG 3.39Å; N752-E754 PolarHBondContact OD1-N 3.37Å; N752-E754 VanDerWaalsContact OD1-N 3.11Å; N752-E754 PolarHBondContact OD1-OE2 3.2Å; E754-P773 CarbonylContact O-C 3.44Å; E754-P773 WeakPolarHBondContact O-CA 3.47Å; E754-A774 PolarHBondContact O-N 3.48Å
755	W	78.9	Confident	75.9	Confident	14 Å²	14	69.6 Å²	69.6	5%	0.053	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	132.3	179	-67.3	80.6	0	0	0	113.3	I723 L725 I729 F734 N749 N752 K753 W771 F772 P773	I723-W755 HydrophobicContact CG2-CH2 4.16Å; I723-W755 HydrophobicContact CG2-CZ2 3.99Å; L725-W755 HydrophobicContact CD2-CH2 4Å; L725-W755 HydrophobicContact CD2-CZ2 4.28Å; I729-W755 HydrophobicContact CD1-CB 4.43Å; I729-W755 HydrophobicContact CD1-CD2 3.98Å; I729-W755 HydrophobicContact CD1-CE3 4.05Å; I729-W755 HydrophobicContact CD1-CG 4.17Å; F734-W755 HydrophobicContact CD1-CH2 4.42Å; F734-W755 AromaticContact CD1-CZ3 3.99Å; F734-W755 HydrophobicContact CD1-CZ3 3.99Å; F734-W755 HydrophobicContact CE1-CH2 4.02Å; F734-W755 AromaticContact CE1-CZ3 3.9Å; F734-W755 HydrophobicContact CE1-CZ3 3.9Å; N749-W755 HydrophobicContact CB-CB 3.8Å; N749-W755 VanDerWaalsContact CB-O 3.29Å; N749-W755 WeakPolarHBondContact CB-O 3.3Å; N749-W755 PolarHBondContact N-O 3.43Å; N752-W755 PolarHBondContact O-N 3.23Å; N752-W755 VanDerWaalsContact O-N 3.07Å; K753-W755 PolarHBondContact O-N 2.88Å; W755-W771 HydrophobicContact CB-CE3 4.22Å; W755-W771 HydrophobicContact CE3-CB 3.97Å; W755-W771 HydrophobicContact CZ3-CB 4.26Å; W755-F772 WeakPolarHBondContact CA-O 3.3Å; W755-P773 HydrophobicContact CZ3-CG 4.49Å
756	Y	83.6	Confident	75.5	Confident	53 Å²	53	69.8 Å²	69.8	21%	0.208	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	148.2	170.7	-65.3	-51.1	0	0	0	110.3	I745 E748 W771 F772 A774 L777	I745-Y756 HydrophobicContact CD1-CD2 4.12Å; I745-Y756 HydrophobicContact CD1-CE2 4.27Å; I745-Y756 HydrophobicContact CD1-CG 4.29Å; I745-Y756 HydrophobicContact CG2-CD1 4.15Å; I745-Y756 HydrophobicContact CG2-CG 4.27Å; E748-Y756 HydrophobicContact CB-CD1 4.05Å; E748-Y756 HydrophobicContact CB-CE1 4.21Å; E748-Y756 HydrophobicContact CG-CD1 3.93Å; E748-Y756 HydrophobicContact CG-CE1 3.75Å; Y756-W771 VanDerWaalsContact C-CE3 3.47Å; Y756-W771 CarbonylContact O-C 3.57Å; Y756-W771 VanDerWaalsContact O-CA 3.3Å; Y756-W771 WeakPolarHBondContact O-CA 3.27Å; Y756-F772 VanDerWaalsContact CB-CZ 3.43Å; Y756-F772 AromaticContact CD2-CE2 3.92Å; Y756-F772 HydrophobicContact CD2-CE2 3.92Å; Y756-F772 HydrophobicContact CD2-CZ 4.16Å; Y756-F772 HydrophobicContact CG-CE2 4.38Å; Y756-F772 HydrophobicContact CG-CZ 4.27Å; Y756-F772 PolarHBondContact N-O 3.19Å; Y756-F772 VanDerWaalsContact O-CD1 3.3Å; Y756-F772 WeakPolarHBondContact O-CD1 3.43Å; Y756-F772 PolarHBondContact O-N 3.19Å; Y756-A774 HydrophobicContact CD2-CB 3.64Å; Y756-A774 HydrophobicContact CE2-CB 3.26Å; Y756-A774 HydrophobicContact CG-CB 4.4Å; Y756-L777 HydrophobicContact CD2-CD1 3.92Å; Y756-L777 HydrophobicContact CE2-CD1 4.13Å
757	F	85.2	Confident	75.5	Confident	37 Å²	37	69.6 Å²	69.6	16%	0.162	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	124.8	166.3	-170.2	-87.4	0	0	0	108.4	T746 K747 K769 G770 W771	T746-F757 WeakPolarHBondContact CA-O 3.46Å; T746-F757 PolarHBondContact N-O 3.07Å; K747-F757 HydrophobicContact CB-CB 4Å; K747-F757 HydrophobicContact CG-CB 4.48Å; K747-F757 PolarHBondContact N-O 2.85Å; K747-F757 PolarHBondContact O-N 2.88Å; F757-K769 HydrophobicContact CE1-CB 4.02Å; F757-K769 HydrophobicContact CZ-CB 3.96Å; F757-G770 WeakPolarHBondContact CA-O 3.49Å; F757-G770 VanDerWaalsContact CD2-C 3.45Å; F757-G770 VanDerWaalsContact CE2-CA 3.48Å; F757-W771 HydrophobicContact CB-CD2 3.95Å; F757-W771 HydrophobicContact CB-CE3 3.74Å; F757-W771 HydrophobicContact CB-CH2 3.95Å; F757-W771 HydrophobicContact CB-CZ2 4.16Å; F757-W771 HydrophobicContact CB-CZ3 3.72Å; F757-W771 AromaticContact CD2-CD1 3.75Å; F757-W771 AromaticContact CD2-CD2 3.8Å; F757-W771 HydrophobicContact CD2-CD2 3.8Å; F757-W771 AromaticContact CD2-CE2 3.66Å; F757-W771 HydrophobicContact CD2-CE3 4.46Å; F757-W771 AromaticContact CD2-CG 3.87Å; F757-W771 HydrophobicContact CD2-CG 3.87Å; F757-W771 HydrophobicContact CD2-CZ2 4.23Å; F757-W771 AromaticContact CD2-NE1 3.62Å; F757-W771 HydrophobicContact CG-CD2 4.39Å
758	G	83.7	Confident	75.6	Confident	0 Å²	0	64.6 Å²	64.6	0%	0	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	174.1	-176.5	0	0	0	0	0	113.2	K744 K769 G770	K744-G758 VanDerWaalsContact O-CA 3.25Å; K744-G758 WeakPolarHBondContact O-CA 3.33Å; G758-K769 VanDerWaalsContact O-CA 3.27Å; G758-K769 WeakPolarHBondContact O-CA 3.41Å; G758-G770 PolarHBondContact N-O 2.74Å; G758-G770 PolarHBondContact O-N 2.88Å; G758-G770 VanDerWaalsContact O-N 3.17Å
759	E	86.5	Confident	75.9	Confident	31 Å²	31	67.6 Å²	67.6	15%	0.145	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	125.4	166.9	59.4	-169.5	-165.4	0	0	110	K744 V767 N768 K769	K744-E759 HydrophobicContact CB-CG 3.99Å; K744-E759 HydrophobicContact CD-CG 3.8Å; K744-E759 WeakPolarHBondContact CD-OE1 3.44Å; K744-E759 WeakPolarHBondContact CE-OE1 3.34Å; K744-E759 HydrophobicContact CG-CG 4.47Å; K744-E759 PolarHBondContact N-O 3.08Å; K744-E759 IonicContact NZ-OE1 2.87Å; K744-E759 PolarHBondContact NZ-OE1 3.28Å; K744-E759 PolarHBondContact O-N 3.14Å; E759-V767 HydrophobicContact CB-CG1 3.76Å; E759-V767 HydrophobicContact CG-CG1 4.38Å; E759-N768 WeakPolarHBondContact CA-O 3.5Å; E759-K769 HydrophobicContact CB-CD 4.06Å; E759-K769 HydrophobicContact CB-CG 3.88Å; E759-K769 VanDerWaalsContact OE2-CE 3.3Å; E759-K769 WeakPolarHBondContact OE2-CE 3.48Å; E759-K769 IonicContact OE2-NZ 2.67Å; E759-K769 PolarHBondContact OE2-NZ 3.41Å
760	I	83.7	Confident	76.5	Confident	5 Å²	5	67 Å²	67	3%	0.026	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	133.8	163.9	-67.6	164.4	0	0	0	106.5	L735 T736 L737 D741 V743 V767 N768	L735-I760 HydrophobicContact CD1-CD1 4.09Å; L735-I760 HydrophobicContact CD1-CG1 4.46Å; L735-I760 HydrophobicContact CD2-CD1 4Å; L735-I760 HydrophobicContact CD2-CG1 4.03Å; L735-I760 HydrophobicContact CG-CD1 3.87Å; L735-I760 HydrophobicContact CG-CG1 4.39Å; T736-I760 WeakPolarHBondContact O-CD1 2.96Å; L737-I760 HydrophobicContact CD2-CD1 3.73Å; D741-I760 HydrophobicContact CB-CD1 3.79Å; D741-I760 HydrophobicContact CB-CG1 4.14Å; D741-I760 HydrophobicContact CB-CG2 4.26Å; V743-I760 HydrophobicContact CB-CG1 4.32Å; V743-I760 HydrophobicContact CG1-CG1 4.49Å; V743-I760 HydrophobicContact CG2-CD1 3.96Å; V743-I760 HydrophobicContact CG2-CG1 3.67Å; I760-V767 CarbonylContact O-C 3.42Å; I760-V767 VanDerWaalsContact O-CA 3.32Å; I760-V767 WeakPolarHBondContact O-CA 2.97Å; I760-N768 PolarHBondContact N-O 3.11Å; I760-N768 PolarHBondContact O-N 3.41Å
761	T	79.9	Confident	77.2	Confident	87 Å²	87	60.9 Å²	60.9	53%	0.534	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	113.8	161.2	-53.6	0	0	0	0	107.6	I766 V767	T761-I766 WeakPolarHBondContact CA-O 3.12Å; T761-V767 HydrophobicContact CG2-CG2 4.34Å
762	D	69.8	Low	78.3	Confident	29 Å²	29	55.3 Å²	55.3	16%	0.155	28%	0.283	C	S	.	.			trans	-73.3	174.4	-179.1	79.8	10	0	0	0	112.4	S764 G765 I766	D762-S764 PolarHBondContact O-N 3.09Å; D762-S764 VanDerWaalsContact OD1-CA 3.27Å; D762-S764 WeakPolarHBondContact OD1-CA 3.23Å; D762-S764 WeakPolarHBondContact OD1-CB 3.49Å; D762-S764 PolarHBondContact OD1-N 3.01Å; D762-S764 PolarHBondContact OD1-OG 3.17Å; D762-S764 PolarHBondContact OD2-OG 3.18Å; D762-G765 PolarHBondContact O-N 3.26Å; D762-G765 PolarHBondContact OD1-N 2.95Å; D762-G765 VanDerWaalsContact OD1-N 3.08Å; D762-I766 PolarHBondContact N-O 2.89Å; D762-I766 PolarHBondContact OD1-N 3.4Å
763	K	70.6	Confident	79.1	Confident	194 Å²	194	53.2 Å²	53.2	84%	0.843	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.8	-4.3	-178.9	-64.2	173	-176.2	169	0	113.7
764	S	70.2	Confident	79.5	Confident	66 Å²	66	47.2 Å²	47.2	46%	0.462	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-103.6	-2.8	171.4	76.3	0	0	0	0	113.7	D762 I766	D762-S764 PolarHBondContact O-N 3.09Å; D762-S764 VanDerWaalsContact OD1-CA 3.27Å; D762-S764 WeakPolarHBondContact OD1-CA 3.23Å; D762-S764 WeakPolarHBondContact OD1-CB 3.49Å; D762-S764 PolarHBondContact OD1-N 3.01Å; D762-S764 PolarHBondContact OD1-OG 3.17Å; D762-S764 PolarHBondContact OD2-OG 3.18Å; S764-I766 WeakPolarHBondContact OG-CD1 3.37Å; S764-I766 WeakPolarHBondContact OG-CG1 3.42Å
765	G	72.2	Confident	79.4	Confident	50 Å²	50	45.9 Å²	45.9	52%	0.515	25%	0.253	S	S	.	.	S	Bend	trans	87.8	5.3	-178	0	0	0	0	0	114.4	D762	D762-G765 PolarHBondContact O-N 3.26Å; D762-G765 PolarHBondContact OD1-N 2.95Å; D762-G765 VanDerWaalsContact OD1-N 3.08Å
766	I	73	Confident	79.1	Confident	41 Å²	41	45.4 Å²	45.4	21%	0.21	25%	0.251	C	S	.	.			trans	-77.4	129.6	176.6	-64.9	171.1	0	0	0	108.9	I645 N647 T761 D762 S764 N768	I645-I766 HydrophobicContact CG2-CD1 3.72Å; N647-I766 HydrophobicContact CB-CD1 4.38Å; N647-I766 HydrophobicContact CB-CG2 3.91Å; N647-I766 VanDerWaalsContact CG-CG2 3.47Å; N647-I766 WeakPolarHBondContact ND2-CG2 3.26Å; T761-I766 WeakPolarHBondContact CA-O 3.12Å; D762-I766 PolarHBondContact N-O 2.89Å; D762-I766 PolarHBondContact OD1-N 3.4Å; S764-I766 WeakPolarHBondContact OG-CD1 3.37Å; S764-I766 WeakPolarHBondContact OG-CG1 3.42Å; I766-N768 WeakPolarHBondContact CG2-OD1 3.24Å; I766-N768 PolarHBondContact O-N 3.47Å
767	V	80.2	Confident	78.6	Confident	63 Å²	63	44 Å²	44	38%	0.382	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-96	87.5	-178.1	-170.6	0	0	0	0	110.3	E759 I760 T761 K769	E759-V767 HydrophobicContact CB-CG1 3.76Å; E759-V767 HydrophobicContact CG-CG1 4.38Å; I760-V767 CarbonylContact O-C 3.42Å; I760-V767 VanDerWaalsContact O-CA 3.32Å; I760-V767 WeakPolarHBondContact O-CA 2.97Å; T761-V767 HydrophobicContact CG2-CG2 4.34Å; V767-K769 HydrophobicContact CG1-CG 4.31Å
768	N	80.6	Confident	77.5	Confident	28 Å²	28	48.3 Å²	48.3	15%	0.15	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	132.7	177	-64.3	-34.9	0	0	0	109.9	T646 L735 E759 I760 I766	T646-N768 PolarHBondContact O-OD1 2.99Å; L735-N768 HydrophobicContact CD1-CB 3.85Å; L735-N768 WeakPolarHBondContact CD1-O 3.49Å; E759-N768 WeakPolarHBondContact CA-O 3.5Å; I760-N768 PolarHBondContact N-O 3.11Å; I760-N768 PolarHBondContact O-N 3.41Å; I766-N768 WeakPolarHBondContact CG2-OD1 3.24Å; I766-N768 PolarHBondContact O-N 3.47Å
769	K	86.8	Confident	75.8	Confident	113 Å²	113	53.5 Å²	53.5	49%	0.491	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	139.3	-176.8	-43.9	-163.3	-170.5	-156.6	0	111.9	F757 G758 E759 V767	F757-K769 HydrophobicContact CE1-CB 4.02Å; F757-K769 HydrophobicContact CZ-CB 3.96Å; G758-K769 VanDerWaalsContact O-CA 3.27Å; G758-K769 WeakPolarHBondContact O-CA 3.41Å; E759-K769 HydrophobicContact CB-CD 4.06Å; E759-K769 HydrophobicContact CB-CG 3.88Å; E759-K769 VanDerWaalsContact OE2-CE 3.3Å; E759-K769 WeakPolarHBondContact OE2-CE 3.48Å; E759-K769 IonicContact OE2-NZ 2.67Å; E759-K769 PolarHBondContact OE2-NZ 3.41Å; V767-K769 HydrophobicContact CG1-CG 4.31Å
770	G	84.2	Confident	73.6	Confident	0 Å²	0	55.6 Å²	55.6	0%	0	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	174.5	177.8	179.9	0	0	0	0	0	114	Q733 F757 G758	Q733-G770 CarbonylContact O-C 3.58Å; Q733-G770 VanDerWaalsContact O-CA 3.23Å; Q733-G770 WeakPolarHBondContact O-CA 3.38Å; F757-G770 WeakPolarHBondContact CA-O 3.49Å; F757-G770 VanDerWaalsContact CD2-C 3.45Å; F757-G770 VanDerWaalsContact CE2-CA 3.48Å; G758-G770 PolarHBondContact N-O 2.74Å; G758-G770 PolarHBondContact O-N 2.88Å; G758-G770 VanDerWaalsContact O-N 3.17Å
771	W	83.8	Confident	71.1	Confident	29 Å²	29	61.6 Å²	61.6	11%	0.11	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81	137.3	173.9	-66.3	103.4	0	0	0	111.7	I729 Q733 F734 L735 N749 W755 Y756 F757	I729-W771 HydrophobicContact CD1-CB 4.23Å; I729-W771 HydrophobicContact CD1-CD2 3.94Å; I729-W771 HydrophobicContact CD1-CE3 4.3Å; I729-W771 HydrophobicContact CD1-CG 3.92Å; I729-W771 HydrophobicContact CG1-CD2 4.27Å; I729-W771 HydrophobicContact CG1-CG 4.24Å; I729-W771 HydrophobicContact CG2-CB 4.3Å; I729-W771 HydrophobicContact CG2-CG 4.03Å; Q733-W771 PolarHBondContact O-N 2.8Å; F734-W771 WeakPolarHBondContact CA-O 3.33Å; F734-W771 HydrophobicContact CD1-CB 4.4Å; L735-W771 PolarHBondContact N-O 2.85Å; N749-W771 HydrophobicContact CB-CE3 4.38Å; N749-W771 HydrophobicContact CB-CH2 4.07Å; N749-W771 HydrophobicContact CB-CZ3 3.61Å; W755-W771 HydrophobicContact CB-CE3 4.22Å; W755-W771 HydrophobicContact CE3-CB 3.97Å; W755-W771 HydrophobicContact CZ3-CB 4.26Å; Y756-W771 VanDerWaalsContact C-CE3 3.47Å; Y756-W771 CarbonylContact O-C 3.57Å; Y756-W771 VanDerWaalsContact O-CA 3.3Å; Y756-W771 WeakPolarHBondContact O-CA 3.27Å; F757-W771 HydrophobicContact CB-CD2 3.95Å; F757-W771 HydrophobicContact CB-CE3 3.74Å; F757-W771 HydrophobicContact CB-CH2 3.95Å; F757-W771 HydrophobicContact CB-CZ2 4.16Å; F757-W771 HydrophobicContact CB-CZ3 3.72Å; F757-W771 AromaticContact CD2-CD1 3.75Å; F757-W771 AromaticContact CD2-CD2 3.8Å; F757-W771 HydrophobicContact CD2-CD2 3.8Å; F757-W771 AromaticContact CD2-CE2 3.66Å; F757-W771 HydrophobicContact CD2-CE3 4.46Å; F757-W771 AromaticContact CD2-CG 3.87Å; F757-W771 HydrophobicContact CD2-CG 3.87Å; F757-W771 HydrophobicContact CD2-CZ2 4.23Å; F757-W771 AromaticContact CD2-NE1 3.62Å; F757-W771 HydrophobicContact CG-CD2 4.39Å
772	F	82.8	Confident	68.9	Low	0 Å²	0	67.2 Å²	67.2	0%	0	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.7	159	173.8	62.9	-85.8	0	0	0	110.4	L735 L737 V743 W755 Y756 L777	L735-F772 HydrophobicContact CB-CB 4.41Å; L735-F772 HydrophobicContact CB-CD1 4.24Å; L735-F772 HydrophobicContact CD2-CD1 3.87Å; L735-F772 HydrophobicContact CD2-CE1 4.22Å; L737-F772 HydrophobicContact CD1-CB 3.82Å; L737-F772 HydrophobicContact CD1-CD2 3.61Å; L737-F772 HydrophobicContact CD1-CE2 4.4Å; L737-F772 HydrophobicContact CD1-CG 3.86Å; L737-F772 HydrophobicContact CD2-CB 4.04Å; L737-F772 HydrophobicContact CD2-CD1 4.26Å; L737-F772 HydrophobicContact CD2-CD2 4.37Å; L737-F772 HydrophobicContact CD2-CG 3.96Å; L737-F772 HydrophobicContact CG-CB 4.05Å; L737-F772 HydrophobicContact CG-CG 4.31Å; V743-F772 HydrophobicContact CB-CZ 4.37Å; V743-F772 HydrophobicContact CG1-CD1 4.43Å; V743-F772 HydrophobicContact CG1-CE1 3.51Å; V743-F772 HydrophobicContact CG1-CZ 3.54Å; W755-F772 WeakPolarHBondContact CA-O 3.3Å; Y756-F772 VanDerWaalsContact CB-CZ 3.43Å; Y756-F772 AromaticContact CD2-CE2 3.92Å; Y756-F772 HydrophobicContact CD2-CE2 3.92Å; Y756-F772 HydrophobicContact CD2-CZ 4.16Å; Y756-F772 HydrophobicContact CG-CE2 4.38Å; Y756-F772 HydrophobicContact CG-CZ 4.27Å; Y756-F772 PolarHBondContact N-O 3.19Å; Y756-F772 VanDerWaalsContact O-CD1 3.3Å; Y756-F772 WeakPolarHBondContact O-CD1 3.43Å; Y756-F772 PolarHBondContact O-N 3.19Å; F772-L777 HydrophobicContact CE2-CD1 3.77Å; F772-L777 HydrophobicContact CE2-CD2 4.3Å; F772-L777 HydrophobicContact CE2-CG 3.9Å; F772-L777 HydrophobicContact CZ-CD1 4.09Å
773	P	80.2	Confident	66.8	Low	10 Å²	10	70.5 Å²	70.5	7%	0.065	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.3	137.4	178.8	-22.5	34.2	0	0	0	113.9	W716 E754 W755 C775 C776	W716-P773 HydrophobicContact CD2-CG 3.81Å; W716-P773 VanDerWaalsContact CE2-CG 3.48Å; W716-P773 HydrophobicContact CE3-CG 4Å; W716-P773 HydrophobicContact CH2-CG 3.59Å; W716-P773 HydrophobicContact CZ2-CG 3.37Å; W716-P773 HydrophobicContact CZ3-CG 3.9Å; E754-P773 CarbonylContact O-C 3.44Å; E754-P773 WeakPolarHBondContact O-CA 3.47Å; W755-P773 HydrophobicContact CZ3-CG 4.49Å; P773-C775 VanDerWaalsContact CB-SG 3.5Å; P773-C775 PolarHBondContact O-N 2.93Å; P773-C776 WeakPolarHBondContact O-CB 3.42Å; P773-C776 PolarHBondContact O-N 3.19Å; P773-C776 VanDerWaalsContact O-N 3.07Å; P773-C776 PolarHBondContact O-SG 3Å
774	A	77.4	Confident	64.8	Low	17 Å²	17	68.6 Å²	68.6	14%	0.14	40%	0.396	C	S	.	.	G	3₁₀ helix	trans	-60.4	-27.3	176.1	0	0	0	0	0	113.4	K753 E754 Y756 C776 L777	K753-A774 WeakPolarHBondContact O-CB 3.5Å; E754-A774 PolarHBondContact O-N 3.48Å; Y756-A774 HydrophobicContact CD2-CB 3.64Å; Y756-A774 HydrophobicContact CE2-CB 3.26Å; Y756-A774 HydrophobicContact CG-CB 4.4Å; A774-C776 PolarHBondContact O-N 3.09Å; A774-L777 PolarHBondContact O-N 3.46Å
775	C	74.9	Confident	62.7	Low	97 Å²	97	70.5 Å²	70.5	66%	0.655	41%	0.405	S	S	*	.	G	3₁₀ helix	trans	-66.9	-13	176.2	60.3	0	0	0	0	114.1	P773 L777	P773-C775 VanDerWaalsContact CB-SG 3.5Å; P773-C775 PolarHBondContact O-N 2.93Å; C775-L777 VanDerWaalsContact C-N 3.27Å; C775-L777 PolarHBondContact O-N 3.1Å
776	C	72	Confident	60.8	Low	3 Å²	3	73.2 Å²	73.2	2%	0.02	42%	0.416	C	S	.	.	G	3₁₀ helix	trans	-75.2	-13.1	175.4	-58.3	0	0	0	0	113.6	V712 Q713 L737 P773 A774	V712-C776 WeakPolarHBondContact CA-O 3.14Å; Q713-C776 PolarHBondContact N-O 3.3Å; L737-C776 HydrophobicContact CD1-CB 3.4Å; P773-C776 WeakPolarHBondContact O-CB 3.42Å; P773-C776 PolarHBondContact O-N 3.19Å; P773-C776 VanDerWaalsContact O-N 3.07Å; P773-C776 PolarHBondContact O-SG 3Å; A774-C776 PolarHBondContact O-N 3.09Å
777	L	72.2	Confident	58.7	Low	24 Å²	24	78.6 Å²	78.6	13%	0.126	45%	0.445	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	144.4	-179.1	-58.5	-178.7	0	0	0	112.1	V712 I745 Y756 F772 A774 C775	V712-L777 HydrophobicContact CG2-CD2 3.83Å; I745-L777 HydrophobicContact CD1-CD1 3.72Å; I745-L777 HydrophobicContact CG1-CD1 4.18Å; Y756-L777 HydrophobicContact CD2-CD1 3.92Å; Y756-L777 HydrophobicContact CE2-CD1 4.13Å; F772-L777 HydrophobicContact CE2-CD1 3.77Å; F772-L777 HydrophobicContact CE2-CD2 4.3Å; F772-L777 HydrophobicContact CE2-CG 3.9Å; F772-L777 HydrophobicContact CZ-CD1 4.09Å; A774-L777 PolarHBondContact O-N 3.46Å; C775-L777 VanDerWaalsContact C-N 3.27Å; C775-L777 PolarHBondContact O-N 3.1Å
778	K	62.1	Low	56.4	Low	127 Å²	127	82.3 Å²	82.3	55%	0.552	46%	0.461	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.9	142.8	162.1	-86.2	-177.4	-173.8	155.8	0	111.9	E711 Q713 S780	E711-K778 PolarHBondContact O-N 3.41Å; Q713-K778 HydrophobicContact CB-CD 4.47Å; Q713-K778 HydrophobicContact CB-CG 4.15Å; Q713-K778 HydrophobicContact CG-CB 3.94Å; Q713-K778 HydrophobicContact CG-CD 3.83Å; Q713-K778 HydrophobicContact CG-CG 3.74Å; K778-S780 PolarHBondContact O-N 3.46Å
779	P	48.5	Very low	54.1	Low	110 Å²	110	87.3 Å²	87.3	71%	0.714	49%	0.488	S	S	*	.			trans	-69.9	109.6	167	28.7	-32.8	0	0	0	110.4
780	S	39.7	Very low	51.7	Low	74 Å²	74	88.7 Å²	88.7	52%	0.517	50%	0.496	S	S	.	.			trans	-93	152.1	171.4	-168	0	0	0	0	110.8	K778	K778-S780 PolarHBondContact O-N 3.46Å
781	T	32.1	Very low	49.2	Very low	131 Å²	131	95.9 Å²	95.9	80%	0.804	54%	0.535	S	S	*	.			trans	-122.4	128.6	-176.1	53.1	0	0	0	0	111.7
782	K	33.4	Very low	46.7	Very low	206 Å²	206	97.8 Å²	97.8	90%	0.896	56%	0.564	S	S	*	*			trans	-139.8	145	171.5	-70.5	-174.1	-179.3	171.4	0	111
783	S	26.1	Very low	44.3	Very low	97 Å²	97	105.9 Å²	105.9	68%	0.678	61%	0.606	S	S	*	*			trans	-108.9	144.5	-172.5	55	0	0	0	0	112.6
784	N	28.1	Very low	41.8	Very low	155 Å²	155	111.8 Å²	111.8	83%	0.829	64%	0.637	S	S	*	*			trans	-153.4	117.4	143.3	-83.7	-38.8	0	0	0	105.5
785	T	27	Very low	39.7	Very low	105 Å²	105	117.9 Å²	117.9	64%	0.644	67%	0.666	S	S	*	*			cis	71.6	131.4	48.5	72	0	0	0	0	115.2
786	S	30.9	Very low	37.8	Very low	107 Å²	107	117.8 Å²	117.8	75%	0.748	67%	0.666	S	S	*	*			trans	71.4	143.4	175.4	81.6	0	0	0	0	116.7
787	N	29.6	Very low	35.9	Very low	154 Å²	154	122.8 Å²	122.8	82%	0.824	70%	0.701	S	S	*	*			cis	-164	177.1	-18.7	-110.2	-18.3	0	0	0	111.2
788	I	32.3	Very low	34.1	Very low	141 Å²	141	126.7 Å²	126.7	72%	0.723	73%	0.731	S	S	*	*			trans	95.8	95.3	159.8	-50.4	-168.2	0	0	0	117.7
789	N	32.5	Very low	32.6	Very low	133 Å²	133	125.2 Å²	125.2	71%	0.711	74%	0.736	S	S	*	*			trans	60.3	141.9	134.2	-59.2	-7.9	0	0	0	120.9
790	Q	36.3	Very low	31.9	Very low	143 Å²	143	127 Å²	127	67%	0.668	74%	0.74	S	S	*	*			cis	-160	153.6	4.2	-126.6	171.5	46.4	0	0	112.3
791	N	32	Very low	31.4	Very low	150 Å²	150	128.3 Å²	128.3	80%	0.802	75%	0.749	S	S	*	*			trans	64.8	125.5	159.6	-51.1	-29	0	0	0	118.5
792	G	31.6	Very low	31.3	Very low	70 Å²	70	127.5 Å²	127.5	72%	0.722	75%	0.749	S	S	*	*			trans	-169.6	-49.1	177.4	0	0	0	0	0	119.1
793	L	31.8	Very low	31.4	Very low	170 Å²	170	122.7 Å²	122.7	89%	0.89	74%	0.741	S	S	*	*			trans	67.8	154.1	-171.5	-54.4	160.9	0	0	0	115.4
794	N	27.8	Very low	32	Very low	133 Å²	133	127.3 Å²	127.3	71%	0.711	75%	0.749	S	S	*	*			cis	-163.8	170.1	-40.2	-158.8	2.2	0	0	0	109.1
795	I	33.7	Very low	32.6	Very low	145 Å²	145	126.5 Å²	126.5	74%	0.744	74%	0.74	S	S	*	*			trans	75.1	96.4	168.4	-52.3	163.9	0	0	0	114
796	S	33.5	Very low	33.7	Very low	95 Å²	95	125 Å²	125	66%	0.664	73%	0.733	S	S	*	*				86.2	104.4	72	-70	0	0	0	0	113.4
797	S	31.8	Very low	35	Very low	109 Å²	109	126.5 Å²	126.5	76%	0.762	73%	0.732	S	S	*	*				81.4	151.9	83.6	73.8	0	0	0	0	113.5
798	S	34.4	Very low	37.4	Very low	106 Å²	106	122 Å²	122	74%	0.741	71%	0.707	S	S	*	*			cis	178.9	160.3	-2.1	36.3	0	0	0	0	107.8
799	S	32.3	Very low	39.8	Very low	96 Å²	96	119.5 Å²	119.5	67%	0.671	70%	0.695	S	S	*	*			cis	-174.5	-162.7	-12	54.4	0	0	0	0	108.9
800	N	32.5	Very low	42.6	Very low	146 Å²	146	114.5 Å²	114.5	78%	0.781	67%	0.667	S	S	*	*			trans	79	161.6	163.6	-57.9	6.5	0	0	0	118.8
801	S	29.7	Very low	45.2	Very low	103 Å²	103	108.1 Å²	108.1	72%	0.72	64%	0.638	S	S	*	*				178.2	123.1	-54.1	53.3	0	0	0	0	112.9
802	S	30.1	Very low	48.2	Very low	114 Å²	114	101 Å²	101	80%	0.797	60%	0.6	S	S	*	*			trans	-176.4	157.6	155.7	49.7	0	0	0	0	114.8
803	S	35.6	Very low	51.2	Low	105 Å²	105	98.7 Å²	98.7	73%	0.734	57%	0.571	S	S	*	*			trans	35	115.4	156.7	56.1	0	0	0	0	121	Q805	S803-Q805 PolarHBondContact O-N 2.97Å
804	K	38.6	Very low	54.2	Low	194 Å²	194	90.7 Å²	90.7	84%	0.843	53%	0.529	S	S	*	.			trans	-78.5	112.7	160.5	-72.7	-165.5	172.7	-162.5	0	111.2
805	Q	39.5	Very low	57.3	Low	137 Å²	137	88 Å²	88	64%	0.64	52%	0.515	S	S	*	.			trans	-71.2	168.9	158.3	-77.9	-175.3	-23.8	0	0	110.3	S803	S803-Q805 PolarHBondContact O-N 2.97Å
806	P	50.3	Low	60	Low	75 Å²	75	87.8 Å²	87.8	49%	0.487	51%	0.505	S	S	.	.			trans	-54.6	143.1	159.2	26.1	-35.8	0	0	0	110	I808 I847	P806-I808 PolarHBondContact O-N 2.93Å; P806-I847 HydrophobicContact CG-CD1 4.06Å
807	D	59.3	Low	62.8	Low	137 Å²	137	87.1 Å²	87.1	73%	0.733	50%	0.499	S	S	*	.			trans	-68.5	104.1	-179.6	-70	-51.4	0	0	0	110.3	L809	D807-L809 PolarHBondContact O-N 3.16Å
808	I	78.7	Confident	65.7	Low	59 Å²	59	83.1 Å²	83.1	30%	0.303	47%	0.467	S	S	.	.			trans	-77.9	113.4	-179.6	-62.8	149.3	0	0	0	108.5	P806 R835 V836	P806-I808 PolarHBondContact O-N 2.93Å; I808-R835 HydrophobicContact CG1-CB 4.2Å; I808-R835 HydrophobicContact CG2-CB 3.89Å; I808-R835 HydrophobicContact CG2-CG 4.39Å; I808-V836 CarbonylContact C-O 3.57Å
809	L	84.4	Confident	68.3	Low	89 Å²	89	86 Å²	86	47%	0.466	47%	0.469	S	S	.	.			trans	-68.8	-41.2	-179.2	-59.1	177.5	0	0	0	111.8	D807 V836 I839	D807-L809 PolarHBondContact O-N 3.16Å; L809-V836 PolarHBondContact N-O 2.76Å; L809-I839 HydrophobicContact CD1-CD1 3.99Å; L809-I839 HydrophobicContact CD1-CG1 3.97Å
810	F	90.4	Very high	71	Confident	29 Å²	29	82.5 Å²	82.5	13%	0.127	44%	0.444	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-175	168.5	171.4	51.6	-95.1	0	0	0	110.9	C812 V836 I839 W844 K864	F810-C812 HydrophobicContact CD2-CB 4.41Å; F810-C812 HydrophobicContact CE2-CB 4.26Å; F810-V836 HydrophobicContact CD2-CB 4.23Å; F810-V836 HydrophobicContact CD2-CG2 3.84Å; F810-V836 HydrophobicContact CE2-CB 4.07Å; F810-V836 HydrophobicContact CE2-CG2 3.54Å; F810-V836 HydrophobicContact CZ-CB 4.32Å; F810-V836 HydrophobicContact CZ-CG1 4.33Å; F810-V836 HydrophobicContact CZ-CG2 4.16Å; F810-V836 PolarHBondContact O-N 3.16Å; F810-I839 HydrophobicContact CE1-CD1 3.88Å; F810-I839 HydrophobicContact CZ-CD1 4.38Å; F810-W844 AromaticContact CE2-CE3 4Å; F810-W844 HydrophobicContact CE2-CE3 4Å; F810-W844 HydrophobicContact CE2-CH2 4.21Å; F810-W844 AromaticContact CE2-CZ3 3.58Å; F810-W844 HydrophobicContact CE2-CZ3 3.58Å; F810-W844 HydrophobicContact CZ-CD2 4.47Å; F810-W844 AromaticContact CZ-CE3 3.92Å; F810-W844 HydrophobicContact CZ-CE3 3.92Å; F810-W844 AromaticContact CZ-CH2 3.91Å; F810-W844 HydrophobicContact CZ-CH2 3.91Å; F810-W844 HydrophobicContact CZ-CZ2 4.43Å; F810-W844 AromaticContact CZ-CZ3 3.62Å; F810-W844 HydrophobicContact CZ-CZ3 3.62Å; F810-K864 HydrophobicContact CB-CD 4.35Å; F810-K864 HydrophobicContact CB-CG 4.44Å; F810-K864 HydrophobicContact CD1-CD 3.97Å; F810-K864 HydrophobicContact CD2-CB 4.22Å; F810-K864 HydrophobicContact CD2-CD 3.69Å; F810-K864 HydrophobicContact CD2-CG 3.63Å; F810-K864 HydrophobicContact CE1-CD 4.08Å; F810-K864 HydrophobicContact CE2-CB 4.14Å; F810-K864 HydrophobicContact CE2-CD 3.84Å; F810-K864 HydrophobicContact CE2-CG 3.97Å; F810-K864 HydrophobicContact CG-CD 3.75Å; F810-K864 VanDerWaalsContact CG-CE 3.42Å; F810-K864 HydrophobicContact CG-CG 4.05Å; F810-K864 HydrophobicContact CZ-CD 4.04Å
811	S	91.8	Very high	73.6	Confident	9 Å²	9	83.6 Å²	83.6	6%	0.063	45%	0.45	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	141.7	167.1	-58.4	0	0	0	0	111.4	I834 L865	S811-I834 CarbonylContact C-O 3.53Å; S811-I834 WeakPolarHBondContact CA-O 3.4Å; S811-L865 PolarHBondContact O-N 3.47Å
812	C	94.1	Very high	76.3	Confident	0 Å²	0	82.9 Å²	82.9	0%	0	44%	0.442	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	161.1	169.7	64.3	0	0	0	0	111.3	F810 L833 I834 V836 V862 R863 L865	F810-C812 HydrophobicContact CD2-CB 4.41Å; F810-C812 HydrophobicContact CE2-CB 4.26Å; C812-L833 CarbonylContact O-C 3.48Å; C812-L833 WeakPolarHBondContact O-CA 3.5Å; C812-I834 PolarHBondContact N-O 2.86Å; C812-I834 PolarHBondContact O-N 3.02Å; C812-V836 HydrophobicContact CB-CG2 4.42Å; C812-V836 VanDerWaalsContact SG-CG2 3.53Å; C812-V862 HydrophobicContact CB-CB 4.04Å; C812-V862 HydrophobicContact CB-CG2 4.11Å; C812-R863 CarbonylContact C-O 3.58Å; C812-R863 WeakPolarHBondContact CA-O 3.42Å; C812-R863 WeakPolarHBondContact CB-O 3.46Å; C812-L865 VanDerWaalsContact CA-CD1 3.43Å
813	I	95	Very high	78.9	Confident	22 Å²	22	83.8 Å²	83.8	11%	0.113	44%	0.444	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	133.3	177.1	-173.4	166.9	0	0	0	110.5	L815 D832 V862 R863 L865 M873	I813-L815 PolarHBondContact O-N 3.45Å; I813-D832 CarbonylContact C-O 3.5Å; I813-D832 VanDerWaalsContact CA-O 3.25Å; I813-D832 WeakPolarHBondContact CA-O 3.03Å; I813-V862 CarbonylContact O-C 3.57Å; I813-V862 VanDerWaalsContact O-CA 3.29Å; I813-V862 WeakPolarHBondContact O-CA 3.3Å; I813-R863 HydrophobicContact CG2-CB 4.1Å; I813-R863 PolarHBondContact N-O 2.89Å; I813-R863 PolarHBondContact O-N 2.9Å; I813-L865 HydrophobicContact CB-CD1 3.81Å; I813-L865 HydrophobicContact CG2-CD1 3.87Å; I813-L865 VanDerWaalsContact N-CD1 3.34Å; I813-M873 HydrophobicContact CD1-CE 3.9Å; I813-M873 HydrophobicContact CD1-SD 4.08Å
814	A	94.9	Very high	81.1	Confident	2 Å²	2	81 Å²	81	2%	0.017	43%	0.432	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.3	122.4	176.2	0	0	0	0	0	111.6	L828 S829 G831 D832 I834	A814-L828 HydrophobicContact CB-CB 4.01Å; A814-L828 HydrophobicContact CB-CD1 4.18Å; A814-S829 VanDerWaalsContact CB-O 3.29Å; A814-S829 WeakPolarHBondContact CB-O 3.21Å; A814-G831 PolarHBondContact O-N 3.45Å; A814-D832 HydrophobicContact CB-CB 4.16Å; A814-D832 PolarHBondContact N-O 2.61Å; A814-I834 HydrophobicContact CB-CD1 4.27Å
815	L	92	Very high	83.7	Confident	77 Å²	77	73.3 Å²	73.3	40%	0.403	40%	0.4	S	S	.	.	S	Bend	trans	-86.1	-30.3	173.6	-64.1	-176.6	0	0	0	112.1	I813 Y861 R863	I813-L815 PolarHBondContact O-N 3.45Å; L815-Y861 PolarHBondContact N-O 2.73Å; L815-R863 HydrophobicContact CD1-CB 4.03Å; L815-R863 HydrophobicContact CD2-CB 3.85Å; L815-R863 HydrophobicContact CG-CB 3.91Å
816	Y	91.4	Very high	86.2	Confident	139 Å²	139	66.9 Å²	66.9	55%	0.545	37%	0.37	S	S	.	.	S	Bend	trans	-131.7	149	-175.4	-60	-71.6	0	0	0	109.5	Y861	Y816-Y861 PolarHBondContact N-O 2.69Å
817	P	92.6	Very high	88.2	Confident	81 Å²	81	66.8 Å²	66.8	53%	0.526	37%	0.366	S	S	.	.			trans	-71.1	141.9	174.4	32.2	-32.5	0	0	0	109.4	L828 V830 Y861	P817-L828 CarbonylContact C-O 3.17Å; P817-L828 WeakPolarHBondContact CA-O 3.37Å; P817-V830 HydrophobicContact CB-CG2 4.37Å; P817-V830 HydrophobicContact CG-CG2 4.35Å; P817-Y861 WeakPolarHBondContact O-CD1 3.35Å; P817-Y861 VanDerWaalsContact O-CE1 3.23Å; P817-Y861 WeakPolarHBondContact O-CE1 3.35Å
818	Y	91.1	Very high	89.8	Confident	26 Å²	26	60.4 Å²	60.4	10%	0.102	33%	0.331	C	S	.	.	B	Isolated β-bridge	trans	-134.2	126.7	178	178.5	-107.8	0	0	0	109.6	S820 D825 L826 N827 L828 W843 F857 P858 Y861	Y818-S820 WeakPolarHBondContact OH-CB 3.34Å; Y818-D825 PolarHBondContact OH-OD2 2.96Å; Y818-L826 WeakPolarHBondContact CD1-O 3.01Å; Y818-N827 CarbonylContact O-C 3.39Å; Y818-N827 VanDerWaalsContact O-CA 3.25Å; Y818-N827 WeakPolarHBondContact O-CA 3.47Å; Y818-L828 PolarHBondContact N-O 3.07Å; Y818-L828 PolarHBondContact O-N 3.43Å; Y818-W843 VanDerWaalsContact OH-CH2 3.22Å; Y818-W843 WeakPolarHBondContact OH-CH2 3.21Å; Y818-W843 VanDerWaalsContact OH-CZ3 3.23Å; Y818-W843 WeakPolarHBondContact OH-CZ3 3.37Å; Y818-F857 HydrophobicContact CD1-CB 4.27Å; Y818-F857 HydrophobicContact CE1-CB 4.45Å; Y818-P858 HydrophobicContact CD2-CG 3.97Å; Y818-P858 HydrophobicContact CE1-CG 4.43Å; Y818-P858 HydrophobicContact CE2-CG 3.58Å; Y818-P858 VanDerWaalsContact CZ-CD 3.49Å; Y818-Y861 HydrophobicContact CD2-CD1 4.25Å; Y818-Y861 HydrophobicContact CD2-CE1 4.15Å; Y818-Y861 HydrophobicContact CG-CD1 4.41Å
819	E	91	Very high	90.5	Very high	166 Å²	166	60 Å²	60	78%	0.776	33%	0.334	S	S	*	.			trans	-131.4	129.7	178	-65.4	-177.3	170.8	0	0	108.7
820	S	87.5	Confident	90.8	Very high	22 Å²	22	60.4 Å²	60.4	15%	0.154	34%	0.34	C	S	.	.			trans	-130.2	149.5	177	-174.6	0	0	0	0	111	Y818 V822 D825 N827	Y818-S820 WeakPolarHBondContact OH-CB 3.34Å; S820-V822 PolarHBondContact OG-N 3.43Å; S820-V822 VanDerWaalsContact OG-N 3.15Å; S820-D825 VanDerWaalsContact CB-OD2 3.24Å; S820-D825 WeakPolarHBondContact CB-OD2 3.23Å; S820-D825 PolarHBondContact OG-OD2 2.75Å; S820-N827 PolarHBondContact N-OD1 2.77Å; S820-N827 PolarHBondContact O-OD1 2.76Å
821	N	87.5	Confident	90.8	Very high	169 Å²	169	61 Å²	61	90%	0.904	35%	0.354	S	S	*	.			trans	-100.5	2.7	173.7	-64.8	-23.5	0	0	0	112
822	V	86.5	Confident	91	Very high	89 Å²	89	61 Å²	61	54%	0.539	35%	0.354	S	S	.	.	S	Bend	trans	-84.9	123.7	-178.7	-176.5	0	0	0	0	110	S820 G824 D825	S820-V822 PolarHBondContact OG-N 3.43Å; S820-V822 VanDerWaalsContact OG-N 3.15Å; V822-G824 PolarHBondContact O-N 2.87Å; V822-G824 VanDerWaalsContact O-N 3.11Å; V822-D825 PolarHBondContact O-N 2.82Å; V822-D825 VanDerWaalsContact O-N 3.12Å
823	P	84.2	Confident	91	Very high	132 Å²	132	61.7 Å²	61.7	86%	0.857	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.9	114.2	176.7	-22.8	34.4	0	0	0	111.6
824	G	83	Confident	90.9	Very high	46 Å²	46	60.6 Å²	60.6	47%	0.474	35%	0.352	S	S	.	.	T	Hydrogen-bonded Turn	trans	119.6	-13.9	-175.6	0	0	0	0	0	113.8	V822 G855 L856	V822-G824 PolarHBondContact O-N 2.87Å; V822-G824 VanDerWaalsContact O-N 3.11Å; G824-G855 CarbonylContact O-C 3.56Å; G824-G855 WeakPolarHBondContact O-CA 3.12Å; G824-L856 PolarHBondContact O-N 2.71Å
825	D	92.5	Very high	90.9	Very high	33 Å²	33	63.2 Å²	63.2	18%	0.176	36%	0.361	C	S	.	.	B	Isolated β-bridge	trans	-82.1	158.9	172.5	-70.4	-1.9	0	0	0	112	Y818 S820 V822 L856	Y818-D825 PolarHBondContact OH-OD2 2.96Å; S820-D825 VanDerWaalsContact CB-OD2 3.24Å; S820-D825 WeakPolarHBondContact CB-OD2 3.23Å; S820-D825 PolarHBondContact OG-OD2 2.75Å; V822-D825 PolarHBondContact O-N 2.82Å; V822-D825 VanDerWaalsContact O-N 3.12Å; D825-L856 CarbonylContact C-O 3.49Å; D825-L856 VanDerWaalsContact CA-O 3.23Å; D825-L856 WeakPolarHBondContact CA-O 3.21Å
826	L	91.7	Very high	91	Very high	2 Å²	2	59.6 Å²	59.6	1%	0.01	34%	0.342	C	S	.	.			trans	-117.4	106.3	-174	-176.3	65.4	0	0	0	111.4	Y818 L828 I834 G846 C848 L853 L856 F857	Y818-L826 WeakPolarHBondContact CD1-O 3.01Å; L826-L828 HydrophobicContact CD2-CD2 4.07Å; L826-L828 HydrophobicContact CG-CD2 3.97Å; L826-L828 WeakPolarHBondContact O-CG 3.39Å; L826-L828 PolarHBondContact O-N 3.37Å; L826-I834 HydrophobicContact CD2-CG2 3.91Å; L826-G846 WeakPolarHBondContact CD2-O 3.49Å; L826-C848 HydrophobicContact CD1-CB 3.96Å; L826-C848 HydrophobicContact CD2-CB 3.94Å; L826-C848 HydrophobicContact CG-CB 4.2Å; L826-L853 HydrophobicContact CD1-CB 3.81Å; L826-L853 VanDerWaalsContact CD1-O 3.3Å; L826-L853 WeakPolarHBondContact CD1-O 3.49Å; L826-L856 PolarHBondContact N-O 3.37Å; L826-F857 HydrophobicContact CB-CB 4.49Å; L826-F857 HydrophobicContact CB-CD1 4.32Å; L826-F857 HydrophobicContact CD2-CD1 3.83Å; L826-F857 HydrophobicContact CD2-CE1 4.25Å
827	N	93.1	Very high	91	Very high	73 Å²	73	53.8 Å²	53.8	39%	0.39	32%	0.322	S	S	.	.			trans	-68.1	124.8	178.7	-66	-9.3	0	0	0	111.6	Y818 S820	Y818-N827 CarbonylContact O-C 3.39Å; Y818-N827 VanDerWaalsContact O-CA 3.25Å; Y818-N827 WeakPolarHBondContact O-CA 3.47Å; S820-N827 PolarHBondContact N-OD1 2.77Å; S820-N827 PolarHBondContact O-OD1 2.76Å
828	L	92.6	Very high	90.8	Very high	3 Å²	3	52.4 Å²	52.4	2%	0.016	31%	0.312	C	S	.	.	B	Isolated β-bridge	trans	-110.3	138.1	-176.8	-50.5	-176.1	0	0	0	111.3	A814 P817 Y818 L826 I834 F857 V862	A814-L828 HydrophobicContact CB-CB 4.01Å; A814-L828 HydrophobicContact CB-CD1 4.18Å; P817-L828 CarbonylContact C-O 3.17Å; P817-L828 WeakPolarHBondContact CA-O 3.37Å; Y818-L828 PolarHBondContact N-O 3.07Å; Y818-L828 PolarHBondContact O-N 3.43Å; L826-L828 HydrophobicContact CD2-CD2 4.07Å; L826-L828 HydrophobicContact CG-CD2 3.97Å; L826-L828 WeakPolarHBondContact O-CG 3.39Å; L826-L828 PolarHBondContact O-N 3.37Å; L828-I834 HydrophobicContact CD1-CD1 4.3Å; L828-I834 HydrophobicContact CD2-CD1 3.89Å; L828-I834 HydrophobicContact CD2-CG1 3.77Å; L828-F857 HydrophobicContact CD1-CB 3.95Å; L828-F857 HydrophobicContact CD1-CD2 3.94Å; L828-F857 HydrophobicContact CD1-CG 4Å; L828-F857 HydrophobicContact CG-CB 4.29Å; L828-V862 HydrophobicContact CD1-CG1 3.76Å
829	S	92.9	Very high	90.7	Very high	51 Å²	51	55.3 Å²	55.3	36%	0.357	33%	0.328	S	S	.	.			trans	-105.1	148.3	164.8	-61.4	0	0	0	0	109.9	A814 G831 D832 R850	A814-S829 VanDerWaalsContact CB-O 3.29Å; A814-S829 WeakPolarHBondContact CB-O 3.21Å; S829-G831 PolarHBondContact O-N 3Å; S829-D832 PolarHBondContact N-OD2 2.99Å; S829-D832 VanDerWaalsContact O-CB 3.26Å; S829-D832 WeakPolarHBondContact O-CB 3.44Å; S829-D832 VanDerWaalsContact O-CG 3.3Å; S829-D832 PolarHBondContact O-N 3.4Å; S829-R850 PolarHBondContact OG-NH2 2.9Å
830	V	92.1	Very high	90.4	Very high	97 Å²	97	52 Å²	52	59%	0.588	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.6	125.2	178.7	-177.9	0	0	0	0	110	P817	P817-V830 HydrophobicContact CB-CG2 4.37Å; P817-V830 HydrophobicContact CG-CG2 4.35Å
831	G	90.6	Very high	90	Very high	42 Å²	42	58 Å²	58	43%	0.433	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	94.1	-5.6	-175	0	0	0	0	0	115.5	A814 S829 L833	A814-G831 PolarHBondContact O-N 3.45Å; S829-G831 PolarHBondContact O-N 3Å; G831-L833 PolarHBondContact O-N 3.31Å
832	D	94.1	Very high	90	Very high	10 Å²	10	55.7 Å²	55.7	5%	0.053	33%	0.329	C	S	.	.			trans	-60.1	129.4	173.7	-82.7	-10.7	0	0	0	111.3	I813 A814 S829 I834 R850	I813-D832 CarbonylContact C-O 3.5Å; I813-D832 VanDerWaalsContact CA-O 3.25Å; I813-D832 WeakPolarHBondContact CA-O 3.03Å; A814-D832 HydrophobicContact CB-CB 4.16Å; A814-D832 PolarHBondContact N-O 2.61Å; S829-D832 PolarHBondContact N-OD2 2.99Å; S829-D832 VanDerWaalsContact O-CB 3.26Å; S829-D832 WeakPolarHBondContact O-CB 3.44Å; S829-D832 VanDerWaalsContact O-CG 3.3Å; S829-D832 PolarHBondContact O-N 3.4Å; D832-I834 HydrophobicContact CB-CD1 4.25Å; D832-I834 VanDerWaalsContact O-CD1 3.23Å; D832-I834 WeakPolarHBondContact O-CD1 3.38Å; D832-R850 VanDerWaalsContact CG-NE 3.34Å; D832-R850 WeakPolarHBondContact OD1-CD 3.27Å; D832-R850 IonicContact OD1-CZ 2.71Å; D832-R850 IonicContact OD1-NE 3.77Å; D832-R850 PolarHBondContact OD1-NE 2.92Å; D832-R850 IonicContact OD1-NH2 3.31Å; D832-R850 IonicContact OD2-CZ 2.61Å; D832-R850 IonicContact OD2-NE 2.82Å; D832-R850 PolarHBondContact OD2-NE 2.76Å; D832-R850 IonicContact OD2-NH2 3.42Å; D832-R850 PolarHBondContact OD2-NH2 2.71Å
833	L	94.6	Very high	90.2	Very high	13 Å²	13	56.6 Å²	56.6	7%	0.068	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84	129.4	168.3	-172.6	71.8	0	0	0	109	C812 G831 E849 L865 L877	C812-L833 CarbonylContact O-C 3.48Å; C812-L833 WeakPolarHBondContact O-CA 3.5Å; G831-L833 PolarHBondContact O-N 3.31Å; L833-E849 HydrophobicContact CB-CB 4.04Å; L833-E849 HydrophobicContact CD2-CB 4.38Å; L833-E849 HydrophobicContact CD2-CG 4.35Å; L833-E849 HydrophobicContact CG-CB 4.49Å; L833-E849 VanDerWaalsContact O-CB 3.32Å; L833-E849 WeakPolarHBondContact O-CB 3.3Å; L833-E849 PolarHBondContact O-N 3.18Å; L833-L865 HydrophobicContact CD1-CD1 3.95Å; L833-L865 HydrophobicContact CD1-CD2 3.82Å; L833-L877 HydrophobicContact CD2-CD1 4.45Å
834	I	94	Very high	90.7	Very high	0 Å²	0	52.5 Å²	52.5	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	126.6	178.5	-49.9	96.9	0	0	0	109.6	S811 C812 A814 L826 L828 D832 V836 I847 C848 F857 V862	S811-I834 CarbonylContact C-O 3.53Å; S811-I834 WeakPolarHBondContact CA-O 3.4Å; C812-I834 PolarHBondContact N-O 2.86Å; C812-I834 PolarHBondContact O-N 3.02Å; A814-I834 HydrophobicContact CB-CD1 4.27Å; L826-I834 HydrophobicContact CD2-CG2 3.91Å; L828-I834 HydrophobicContact CD1-CD1 4.3Å; L828-I834 HydrophobicContact CD2-CD1 3.89Å; L828-I834 HydrophobicContact CD2-CG1 3.77Å; D832-I834 HydrophobicContact CB-CD1 4.25Å; D832-I834 VanDerWaalsContact O-CD1 3.23Å; D832-I834 WeakPolarHBondContact O-CD1 3.38Å; I834-V836 PolarHBondContact O-N 3.17Å; I834-I847 CarbonylContact C-O 3.43Å; I834-I847 WeakPolarHBondContact CA-O 3.5Å; I834-C848 HydrophobicContact CG1-CB 4.22Å; I834-F857 HydrophobicContact CG2-CD1 4.46Å; I834-F857 HydrophobicContact CG2-CE1 3.66Å; I834-F857 HydrophobicContact CG2-CZ 4Å; I834-V862 HydrophobicContact CD1-CG1 4.05Å
835	R	94.2	Very high	91.2	Very high	57 Å²	57	51.9 Å²	51.9	22%	0.215	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	105.4	172.1	-62.6	-170.6	-169.7	-94.1	-10.9	108.7	I808 G846 I847 E849 E874	I808-R835 HydrophobicContact CG1-CB 4.2Å; I808-R835 HydrophobicContact CG2-CB 3.89Å; I808-R835 HydrophobicContact CG2-CG 4.39Å; R835-G846 CarbonylContact O-C 3.45Å; R835-G846 WeakPolarHBondContact O-CA 3.49Å; R835-I847 PolarHBondContact N-O 2.95Å; R835-I847 PolarHBondContact O-N 3.31Å; R835-E849 IonicContact CZ-OE2 3.3Å; R835-E849 IonicContact NE-OE2 2.75Å; R835-E849 PolarHBondContact NE-OE2 3.45Å; R835-E849 IonicContact NH2-OE2 2.96Å; R835-E849 PolarHBondContact NH2-OE2 3.41Å; R835-E874 IonicContact CZ-OE1 3.95Å; R835-E874 IonicContact NH1-OE1 2.77Å; R835-E874 PolarHBondContact NH1-OE1 2.91Å; R835-E874 IonicContact NH2-OE1 3.98Å; R835-E874 PolarHBondContact NH2-OE1 2.73Å
836	V	93.7	Very high	91.2	Very high	0 Å²	0	50.3 Å²	50.3	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	131.5	-176.9	-171	0	0	0	0	109.8	I808 L809 F810 C812 I834 I839 W844 F857	I808-V836 CarbonylContact C-O 3.57Å; L809-V836 PolarHBondContact N-O 2.76Å; F810-V836 HydrophobicContact CD2-CB 4.23Å; F810-V836 HydrophobicContact CD2-CG2 3.84Å; F810-V836 HydrophobicContact CE2-CB 4.07Å; F810-V836 HydrophobicContact CE2-CG2 3.54Å; F810-V836 HydrophobicContact CZ-CB 4.32Å; F810-V836 HydrophobicContact CZ-CG1 4.33Å; F810-V836 HydrophobicContact CZ-CG2 4.16Å; F810-V836 PolarHBondContact O-N 3.16Å; C812-V836 HydrophobicContact CB-CG2 4.42Å; C812-V836 VanDerWaalsContact SG-CG2 3.53Å; I834-V836 PolarHBondContact O-N 3.17Å; V836-I839 HydrophobicContact CG1-CG1 4.31Å; V836-W844 HydrophobicContact CG1-CB 4.11Å; V836-W844 HydrophobicContact CG2-CE3 4.25Å; V836-F857 HydrophobicContact CG2-CZ 4.13Å
837	C	91	Very high	91.4	Very high	18 Å²	18	52.4 Å²	52.4	12%	0.122	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	-25.7	-177.8	-61	0	0	0	0	112.9	E845	C837-E845 PolarHBondContact N-O 3.13Å
838	V	89.6	Confident	91.4	Very high	52 Å²	52	48.9 Å²	48.9	32%	0.315	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	150.4	176.1	-158.6	0	0	0	0	109.6	K840 E845	V838-K840 HydrophobicContact CG1-CG 4.18Å; V838-E845 HydrophobicContact CB-CB 3.75Å; V838-E845 HydrophobicContact CG2-CB 3.98Å; V838-E845 PolarHBondContact N-O 3.29Å; V838-E845 PolarHBondContact O-N 3.19Å
839	I	88.8	Confident	91.2	Very high	86 Å²	86	51 Å²	51	44%	0.441	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	127.2	174.4	-65.6	164.9	0	0	0	107.2	L809 F810 V836 W844	L809-I839 HydrophobicContact CD1-CD1 3.99Å; L809-I839 HydrophobicContact CD1-CG1 3.97Å; F810-I839 HydrophobicContact CE1-CD1 3.88Å; F810-I839 HydrophobicContact CZ-CD1 4.38Å; V836-I839 HydrophobicContact CG1-CG1 4.31Å; I839-W844 HydrophobicContact CG1-CG 4.4Å
840	K	83.6	Confident	91.1	Very high	96 Å²	96	55 Å²	55	42%	0.417	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	80.8	-179.9	-54.6	179.1	-165.1	170.1	0	108.3	V838 D842 W843 E845 L856	V838-K840 HydrophobicContact CG1-CG 4.18Å; K840-D842 PolarHBondContact O-N 3.03Å; K840-W843 CarbonylContact C-O 3.59Å; K840-W843 WeakPolarHBondContact CA-O 3.45Å; K840-W843 WeakPolarHBondContact CB-O 3.37Å; K840-W843 PolarHBondContact N-O 3.31Å; K840-W843 PolarHBondContact O-N 3.32Å; K840-E845 VanDerWaalsContact CE-OE2 3.28Å; K840-E845 WeakPolarHBondContact CE-OE2 3.35Å; K840-E845 IonicContact NZ-OE2 3.82Å; K840-E845 PolarHBondContact NZ-OE2 2.97Å; K840-L856 HydrophobicContact CD-CD2 4.13Å
841	D	79.8	Confident	90.9	Very high	148 Å²	148	52.6 Å²	52.6	79%	0.791	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	52	-122.6	-172.1	-54.4	-50.3	0	0	0	111.8	W843 W844	D841-W843 PolarHBondContact O-N 2.99Å; D841-W844 PolarHBondContact O-NE1 3.28Å
842	D	88.2	Confident	91	Very high	121 Å²	121	56.9 Å²	56.9	65%	0.647	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.4	0.2	179.2	-71	-46.8	0	0	0	114.3	K840 A859	K840-D842 PolarHBondContact O-N 3.03Å; D842-A859 VanDerWaalsContact O-CB 3.32Å; D842-A859 WeakPolarHBondContact O-CB 3.46Å; D842-A859 PolarHBondContact O-N 2.61Å
843	W	90.6	Very high	90.8	Very high	108 Å²	108	61.8 Å²	61.8	41%	0.409	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	123.8	177.9	-69.7	73.8	0	0	0	111.1	Y818 K840 D841 L856 F857 P858	Y818-W843 VanDerWaalsContact OH-CH2 3.22Å; Y818-W843 WeakPolarHBondContact OH-CH2 3.21Å; Y818-W843 VanDerWaalsContact OH-CZ3 3.23Å; Y818-W843 WeakPolarHBondContact OH-CZ3 3.37Å; K840-W843 CarbonylContact C-O 3.59Å; K840-W843 WeakPolarHBondContact CA-O 3.45Å; K840-W843 WeakPolarHBondContact CB-O 3.37Å; K840-W843 PolarHBondContact N-O 3.31Å; K840-W843 PolarHBondContact O-N 3.32Å; D841-W843 PolarHBondContact O-N 2.99Å; W843-L856 HydrophobicContact CE3-CB 4.19Å; W843-F857 WeakPolarHBondContact CA-O 3.35Å; W843-P858 HydrophobicContact CE3-CG 4.32Å; W843-P858 HydrophobicContact CH2-CG 4.17Å; W843-P858 HydrophobicContact CZ2-CG 4.3Å; W843-P858 HydrophobicContact CZ3-CG 4.16Å
844	W	94.1	Very high	90.6	Very high	46 Å²	46	66.5 Å²	66.5	17%	0.174	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	140.9	-177.1	-63.2	-4.6	0	0	0	110.2	F810 V836 I839 D841 L856 F857 A859 V862	F810-W844 AromaticContact CE2-CE3 4Å; F810-W844 HydrophobicContact CE2-CE3 4Å; F810-W844 HydrophobicContact CE2-CH2 4.21Å; F810-W844 AromaticContact CE2-CZ3 3.58Å; F810-W844 HydrophobicContact CE2-CZ3 3.58Å; F810-W844 HydrophobicContact CZ-CD2 4.47Å; F810-W844 AromaticContact CZ-CE3 3.92Å; F810-W844 HydrophobicContact CZ-CE3 3.92Å; F810-W844 AromaticContact CZ-CH2 3.91Å; F810-W844 HydrophobicContact CZ-CH2 3.91Å; F810-W844 HydrophobicContact CZ-CZ2 4.43Å; F810-W844 AromaticContact CZ-CZ3 3.62Å; F810-W844 HydrophobicContact CZ-CZ3 3.62Å; V836-W844 HydrophobicContact CG1-CB 4.11Å; V836-W844 HydrophobicContact CG2-CE3 4.25Å; I839-W844 HydrophobicContact CG1-CG 4.4Å; D841-W844 PolarHBondContact O-NE1 3.28Å; W844-L856 CarbonylContact O-C 3.57Å; W844-L856 VanDerWaalsContact O-CA 3.31Å; W844-L856 WeakPolarHBondContact O-CA 3.43Å; W844-F857 HydrophobicContact CB-CE1 4.16Å; W844-F857 HydrophobicContact CB-CE2 3.85Å; W844-F857 HydrophobicContact CB-CZ 3.63Å; W844-F857 HydrophobicContact CE3-CE2 4.09Å; W844-F857 HydrophobicContact CE3-CZ 4.32Å; W844-F857 PolarHBondContact N-O 3.05Å; W844-F857 WeakPolarHBondContact O-CD1 3.33Å; W844-F857 VanDerWaalsContact O-CE1 3.29Å; W844-F857 WeakPolarHBondContact O-CE1 3.48Å; W844-F857 PolarHBondContact O-N 2.78Å; W844-A859 HydrophobicContact CD2-CB 3.87Å; W844-A859 VanDerWaalsContact CE2-CB 3.41Å; W844-A859 HydrophobicContact CE3-CB 4.49Å; W844-A859 HydrophobicContact CG-CB 4.2Å; W844-A859 HydrophobicContact CH2-CB 4.34Å; W844-A859 HydrophobicContact CZ2-CB 3.7Å; W844-V862 HydrophobicContact CE3-CG2 3.82Å; W844-V862 HydrophobicContact CH2-CG2 4.47Å; W844-V862 HydrophobicContact CZ3-CG2 3.56Å
845	E	93.8	Very high	90.5	Very high	33 Å²	33	66.7 Å²	66.7	15%	0.154	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	122.8	176.1	-155.5	-175.2	132.5	0	0	108.9	C837 V838 K840 K854 G855 L856	C837-E845 PolarHBondContact N-O 3.13Å; V838-E845 HydrophobicContact CB-CB 3.75Å; V838-E845 HydrophobicContact CG2-CB 3.98Å; V838-E845 PolarHBondContact N-O 3.29Å; V838-E845 PolarHBondContact O-N 3.19Å; K840-E845 VanDerWaalsContact CE-OE2 3.28Å; K840-E845 WeakPolarHBondContact CE-OE2 3.35Å; K840-E845 IonicContact NZ-OE2 3.82Å; K840-E845 PolarHBondContact NZ-OE2 2.97Å; E845-K854 WeakPolarHBondContact OE1-CE 3.32Å; E845-K854 IonicContact OE1-NZ 2.66Å; E845-K854 PolarHBondContact OE1-NZ 3.46Å; E845-G855 WeakPolarHBondContact CA-O 3.5Å; E845-L856 HydrophobicContact CB-CD2 3.8Å; E845-L856 HydrophobicContact CG-CD2 4.04Å; E845-L856 HydrophobicContact CG-CG 4.37Å
846	G	92.9	Very high	90.5	Very high	0 Å²	0	66 Å²	66	0%	0	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.7	176.7	-176.7	0	0	0	0	0	113	L826 R835 K854 G855	L826-G846 WeakPolarHBondContact CD2-O 3.49Å; R835-G846 CarbonylContact O-C 3.45Å; R835-G846 WeakPolarHBondContact O-CA 3.49Å; G846-K854 CarbonylContact O-C 3.47Å; G846-K854 VanDerWaalsContact O-CA 3.24Å; G846-K854 WeakPolarHBondContact O-CA 3.29Å; G846-G855 PolarHBondContact N-O 2.97Å; G846-G855 PolarHBondContact O-N 3.34Å
847	I	94.8	Very high	90.6	Very high	46 Å²	46	66 Å²	66	24%	0.236	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	116.8	178.2	-56.5	171	0	0	0	108.2	P806 I834 R835 L853 K854	P806-I847 HydrophobicContact CG-CD1 4.06Å; I834-I847 CarbonylContact C-O 3.43Å; I834-I847 WeakPolarHBondContact CA-O 3.5Å; R835-I847 PolarHBondContact N-O 2.95Å; R835-I847 PolarHBondContact O-N 3.31Å; I847-L853 WeakPolarHBondContact CA-O 3.49Å; I847-K854 HydrophobicContact CG1-CB 4.05Å; I847-K854 HydrophobicContact CG1-CG 3.87Å
848	C	92.8	Very high	90.7	Very high	0 Å²	0	65.7 Å²	65.7	0%	0	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	126.8	176.4	172.6	0	0	0	0	110.1	L826 I834 R850 T851 K852 L853	L826-C848 HydrophobicContact CD1-CB 3.96Å; L826-C848 HydrophobicContact CD2-CB 3.94Å; L826-C848 HydrophobicContact CG-CB 4.2Å; I834-C848 HydrophobicContact CG1-CB 4.22Å; C848-R850 PolarHBondContact O-N 3.09Å; C848-R850 PolarHBondContact SG-N 3.27Å; C848-T851 WeakPolarHBondContact CB-OG1 3.42Å; C848-T851 PolarHBondContact O-N 2.87Å; C848-K852 VanDerWaalsContact O-CA 3.22Å; C848-K852 WeakPolarHBondContact O-CA 3.5Å; C848-K852 PolarHBondContact O-N 3.08Å; C848-L853 PolarHBondContact N-O 2.87Å
849	E	89.4	Confident	90.8	Very high	46 Å²	46	64 Å²	64	22%	0.215	31%	0.305	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.4	-26.5	-177	-161.3	69.1	-98.7	0	0	112.2	L833 R835 K852	L833-E849 HydrophobicContact CB-CB 4.04Å; L833-E849 HydrophobicContact CD2-CB 4.38Å; L833-E849 HydrophobicContact CD2-CG 4.35Å; L833-E849 HydrophobicContact CG-CB 4.49Å; L833-E849 VanDerWaalsContact O-CB 3.32Å; L833-E849 WeakPolarHBondContact O-CB 3.3Å; L833-E849 PolarHBondContact O-N 3.18Å; R835-E849 IonicContact CZ-OE2 3.3Å; R835-E849 IonicContact NE-OE2 2.75Å; R835-E849 PolarHBondContact NE-OE2 3.45Å; R835-E849 IonicContact NH2-OE2 2.96Å; R835-E849 PolarHBondContact NH2-OE2 3.41Å; E849-K852 WeakPolarHBondContact O-CD 3.38Å; E849-K852 WeakPolarHBondContact O-CE 3.34Å; E849-K852 PolarHBondContact O-NZ 3.17Å; E849-K852 IonicContact OE1-NZ 3.04Å; E849-K852 PolarHBondContact OE1-NZ 3.1Å
850	R	90.2	Very high	90.9	Very high	136 Å²	136	65.3 Å²	65.3	51%	0.513	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.7	-46.8	176.1	179.5	-178.6	57	85	7.4	112.6	S829 D832 C848	S829-R850 PolarHBondContact OG-NH2 2.9Å; D832-R850 VanDerWaalsContact CG-NE 3.34Å; D832-R850 WeakPolarHBondContact OD1-CD 3.27Å; D832-R850 IonicContact OD1-CZ 2.71Å; D832-R850 IonicContact OD1-NE 3.77Å; D832-R850 PolarHBondContact OD1-NE 2.92Å; D832-R850 IonicContact OD1-NH2 3.31Å; D832-R850 IonicContact OD2-CZ 2.61Å; D832-R850 IonicContact OD2-NE 2.82Å; D832-R850 PolarHBondContact OD2-NE 2.76Å; D832-R850 IonicContact OD2-NH2 3.42Å; D832-R850 PolarHBondContact OD2-NH2 2.71Å; C848-R850 PolarHBondContact O-N 3.09Å; C848-R850 PolarHBondContact SG-N 3.27Å
851	T	89.1	Confident	91.4	Very high	46 Å²	46	64.6 Å²	64.6	28%	0.282	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.2	-17.4	-174.2	63.7	0	0	0	0	113.5	C848 L853	C848-T851 WeakPolarHBondContact CB-OG1 3.42Å; C848-T851 PolarHBondContact O-N 2.87Å; T851-L853 PolarHBondContact O-N 2.9Å; T851-L853 VanDerWaalsContact O-N 3.08Å; T851-L853 PolarHBondContact OG1-N 2.96Å
852	K	90.8	Very high	92	Very high	133 Å²	133	58.2 Å²	58.2	58%	0.578	27%	0.274	S	S	*	.			trans	55.4	9.9	-166.7	-50.5	-53.5	-169.1	-156.9	0	114.6	C848 E849	C848-K852 VanDerWaalsContact O-CA 3.22Å; C848-K852 WeakPolarHBondContact O-CA 3.5Å; C848-K852 PolarHBondContact O-N 3.08Å; E849-K852 WeakPolarHBondContact O-CD 3.38Å; E849-K852 WeakPolarHBondContact O-CE 3.34Å; E849-K852 PolarHBondContact O-NZ 3.17Å; E849-K852 IonicContact OE1-NZ 3.04Å; E849-K852 PolarHBondContact OE1-NZ 3.1Å
853	L	90.4	Very high	92.3	Very high	112 Å²	112	57.4 Å²	57.4	59%	0.586	26%	0.262	S	S	*	.			trans	-79.6	146	175.5	-62.4	177.1	0	0	0	110.3	L826 I847 C848 T851	L826-L853 HydrophobicContact CD1-CB 3.81Å; L826-L853 VanDerWaalsContact CD1-O 3.3Å; L826-L853 WeakPolarHBondContact CD1-O 3.49Å; I847-L853 WeakPolarHBondContact CA-O 3.49Å; C848-L853 PolarHBondContact N-O 2.87Å; T851-L853 PolarHBondContact O-N 2.9Å; T851-L853 VanDerWaalsContact O-N 3.08Å; T851-L853 PolarHBondContact OG1-N 2.96Å
854	K	91.4	Very high	92.3	Very high	112 Å²	112	57.8 Å²	57.8	49%	0.487	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	136.8	168.8	-164.8	-165.7	-168.3	-152.6	0	109.3	E845 G846 I847	E845-K854 WeakPolarHBondContact OE1-CE 3.32Å; E845-K854 IonicContact OE1-NZ 2.66Å; E845-K854 PolarHBondContact OE1-NZ 3.46Å; G846-K854 CarbonylContact O-C 3.47Å; G846-K854 VanDerWaalsContact O-CA 3.24Å; G846-K854 WeakPolarHBondContact O-CA 3.29Å; I847-K854 HydrophobicContact CG1-CB 4.05Å; I847-K854 HydrophobicContact CG1-CG 3.87Å
855	G	92.4	Very high	91.9	Very high	4 Å²	4	56.1 Å²	56.1	4%	0.041	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-177.9	-179.6	172.9	0	0	0	0	0	113.8	G824 E845 G846	G824-G855 CarbonylContact O-C 3.56Å; G824-G855 WeakPolarHBondContact O-CA 3.12Å; E845-G855 WeakPolarHBondContact CA-O 3.5Å; G846-G855 PolarHBondContact N-O 2.97Å; G846-G855 PolarHBondContact O-N 3.34Å
856	L	93.6	Very high	91.1	Very high	44 Å²	44	57 Å²	57	23%	0.23	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	140.5	179.2	-68.1	166.7	0	0	0	111.9	G824 D825 L826 K840 W843 W844 E845	G824-L856 PolarHBondContact O-N 2.71Å; D825-L856 CarbonylContact C-O 3.49Å; D825-L856 VanDerWaalsContact CA-O 3.23Å; D825-L856 WeakPolarHBondContact CA-O 3.21Å; L826-L856 PolarHBondContact N-O 3.37Å; K840-L856 HydrophobicContact CD-CD2 4.13Å; W843-L856 HydrophobicContact CE3-CB 4.19Å; W844-L856 CarbonylContact O-C 3.57Å; W844-L856 VanDerWaalsContact O-CA 3.31Å; W844-L856 WeakPolarHBondContact O-CA 3.43Å; E845-L856 HydrophobicContact CB-CD2 3.8Å; E845-L856 HydrophobicContact CG-CD2 4.04Å; E845-L856 HydrophobicContact CG-CG 4.37Å
857	F	94.5	Very high	89.9	Confident	0 Å²	0	61.8 Å²	61.8	0%	0	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.6	153	173.7	59.7	-87.3	0	0	0	110.9	Y818 L826 L828 I834 V836 W843 W844 A859 V862	Y818-F857 HydrophobicContact CD1-CB 4.27Å; Y818-F857 HydrophobicContact CE1-CB 4.45Å; L826-F857 HydrophobicContact CB-CB 4.49Å; L826-F857 HydrophobicContact CB-CD1 4.32Å; L826-F857 HydrophobicContact CD2-CD1 3.83Å; L826-F857 HydrophobicContact CD2-CE1 4.25Å; L828-F857 HydrophobicContact CD1-CB 3.95Å; L828-F857 HydrophobicContact CD1-CD2 3.94Å; L828-F857 HydrophobicContact CD1-CG 4Å; L828-F857 HydrophobicContact CG-CB 4.29Å; I834-F857 HydrophobicContact CG2-CD1 4.46Å; I834-F857 HydrophobicContact CG2-CE1 3.66Å; I834-F857 HydrophobicContact CG2-CZ 4Å; V836-F857 HydrophobicContact CG2-CZ 4.13Å; W843-F857 WeakPolarHBondContact CA-O 3.35Å; W844-F857 HydrophobicContact CB-CE1 4.16Å; W844-F857 HydrophobicContact CB-CE2 3.85Å; W844-F857 HydrophobicContact CB-CZ 3.63Å; W844-F857 HydrophobicContact CE3-CE2 4.09Å; W844-F857 HydrophobicContact CE3-CZ 4.32Å; W844-F857 PolarHBondContact N-O 3.05Å; W844-F857 WeakPolarHBondContact O-CD1 3.33Å; W844-F857 VanDerWaalsContact O-CE1 3.29Å; W844-F857 WeakPolarHBondContact O-CE1 3.48Å; W844-F857 PolarHBondContact O-N 2.78Å; F857-A859 PolarHBondContact O-N 3.41Å; F857-V862 HydrophobicContact CD2-CG1 3.81Å; F857-V862 HydrophobicContact CD2-CG2 4.45Å; F857-V862 HydrophobicContact CE2-CB 4.33Å; F857-V862 HydrophobicContact CE2-CG1 3.6Å; F857-V862 HydrophobicContact CE2-CG2 3.77Å
858	P	93.5	Very high	88.7	Confident	11 Å²	11	67 Å²	67	7%	0.071	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.7	131.2	179.6	-21.7	33.9	0	0	0	112.9	Y818 W843 N860 Y861	Y818-P858 HydrophobicContact CD2-CG 3.97Å; Y818-P858 HydrophobicContact CE1-CG 4.43Å; Y818-P858 HydrophobicContact CE2-CG 3.58Å; Y818-P858 VanDerWaalsContact CZ-CD 3.49Å; W843-P858 HydrophobicContact CE3-CG 4.32Å; W843-P858 HydrophobicContact CH2-CG 4.17Å; W843-P858 HydrophobicContact CZ2-CG 4.3Å; W843-P858 HydrophobicContact CZ3-CG 4.16Å; P858-N860 WeakPolarHBondContact CB-OD1 3.3Å; P858-N860 PolarHBondContact O-N 3.41Å; P858-Y861 HydrophobicContact CB-CD2 3.81Å; P858-Y861 HydrophobicContact CB-CE2 4.35Å; P858-Y861 HydrophobicContact CG-CD2 4.25Å; P858-Y861 PolarHBondContact O-N 3.48Å
859	A	91.4	Very high	87.7	Confident	15 Å²	15	69.9 Å²	69.9	12%	0.124	34%	0.341	C	S	.	.	G	3₁₀ helix	trans	-58.7	-31.7	-177.9	0	0	0	0	0	113.4	D842 W844 F857 Y861 V862	D842-A859 VanDerWaalsContact O-CB 3.32Å; D842-A859 WeakPolarHBondContact O-CB 3.46Å; D842-A859 PolarHBondContact O-N 2.61Å; W844-A859 HydrophobicContact CD2-CB 3.87Å; W844-A859 VanDerWaalsContact CE2-CB 3.41Å; W844-A859 HydrophobicContact CE3-CB 4.49Å; W844-A859 HydrophobicContact CG-CB 4.2Å; W844-A859 HydrophobicContact CH2-CB 4.34Å; W844-A859 HydrophobicContact CZ2-CB 3.7Å; F857-A859 PolarHBondContact O-N 3.41Å; A859-Y861 VanDerWaalsContact C-N 3.28Å; A859-Y861 PolarHBondContact O-N 3.04Å; A859-V862 VanDerWaalsContact O-CG2 3.28Å; A859-V862 WeakPolarHBondContact O-CG2 3.41Å; A859-V862 PolarHBondContact O-N 2.88Å
860	N	92.3	Very high	86.6	Confident	115 Å²	115	68.6 Å²	68.6	62%	0.615	34%	0.337	S	S	*	.	G	3₁₀ helix	trans	-75.5	-9.6	179.2	62.3	-33.6	0	0	0	114.3	P858	P858-N860 WeakPolarHBondContact CB-OD1 3.3Å; P858-N860 PolarHBondContact O-N 3.41Å
861	Y	92.8	Very high	85.4	Confident	81 Å²	81	71.1 Å²	71.1	32%	0.318	35%	0.346	S	S	.	.	G	3₁₀ helix	trans	-87.7	-6.3	175.5	-80.4	-116.8	0	0	0	112.8	L815 Y816 P817 Y818 P858 A859	L815-Y861 PolarHBondContact N-O 2.73Å; Y816-Y861 PolarHBondContact N-O 2.69Å; P817-Y861 WeakPolarHBondContact O-CD1 3.35Å; P817-Y861 VanDerWaalsContact O-CE1 3.23Å; P817-Y861 WeakPolarHBondContact O-CE1 3.35Å; Y818-Y861 HydrophobicContact CD2-CD1 4.25Å; Y818-Y861 HydrophobicContact CD2-CE1 4.15Å; Y818-Y861 HydrophobicContact CG-CD1 4.41Å; P858-Y861 HydrophobicContact CB-CD2 3.81Å; P858-Y861 HydrophobicContact CB-CE2 4.35Å; P858-Y861 HydrophobicContact CG-CD2 4.25Å; P858-Y861 PolarHBondContact O-N 3.48Å; A859-Y861 VanDerWaalsContact C-N 3.28Å; A859-Y861 PolarHBondContact O-N 3.04Å
862	V	93.7	Very high	84.3	Confident	13 Å²	13	72.7 Å²	72.7	8%	0.079	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	161.9	-176	-60.2	0	0	0	0	113.6	C812 I813 L828 I834 W844 F857 A859	C812-V862 HydrophobicContact CB-CB 4.04Å; C812-V862 HydrophobicContact CB-CG2 4.11Å; I813-V862 CarbonylContact O-C 3.57Å; I813-V862 VanDerWaalsContact O-CA 3.29Å; I813-V862 WeakPolarHBondContact O-CA 3.3Å; L828-V862 HydrophobicContact CD1-CG1 3.76Å; I834-V862 HydrophobicContact CD1-CG1 4.05Å; W844-V862 HydrophobicContact CE3-CG2 3.82Å; W844-V862 HydrophobicContact CH2-CG2 4.47Å; W844-V862 HydrophobicContact CZ3-CG2 3.56Å; F857-V862 HydrophobicContact CD2-CG1 3.81Å; F857-V862 HydrophobicContact CD2-CG2 4.45Å; F857-V862 HydrophobicContact CE2-CB 4.33Å; F857-V862 HydrophobicContact CE2-CG1 3.6Å; F857-V862 HydrophobicContact CE2-CG2 3.77Å; A859-V862 VanDerWaalsContact O-CG2 3.28Å; A859-V862 WeakPolarHBondContact O-CG2 3.41Å; A859-V862 PolarHBondContact O-N 2.88Å
863	R	93	Very high	82.9	Confident	105 Å²	105	69.7 Å²	69.7	40%	0.396	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	122.9	169.1	-176.7	175	71.6	93.7	2.5	109.4	C812 I813 L815 L865 E869	C812-R863 CarbonylContact C-O 3.58Å; C812-R863 WeakPolarHBondContact CA-O 3.42Å; C812-R863 WeakPolarHBondContact CB-O 3.46Å; I813-R863 HydrophobicContact CG2-CB 4.1Å; I813-R863 PolarHBondContact N-O 2.89Å; I813-R863 PolarHBondContact O-N 2.9Å; L815-R863 HydrophobicContact CD1-CB 4.03Å; L815-R863 HydrophobicContact CD2-CB 3.85Å; L815-R863 HydrophobicContact CG-CB 3.91Å; R863-L865 PolarHBondContact O-N 3.47Å; R863-E869 IonicContact CZ-OE1 2.73Å; R863-E869 VanDerWaalsContact CZ-OE1 3.25Å; R863-E869 IonicContact NH1-OE1 3.11Å; R863-E869 PolarHBondContact NH1-OE1 3.37Å; R863-E869 IonicContact NH1-OE2 3.91Å; R863-E869 IonicContact NH2-OE1 2.69Å; R863-E869 PolarHBondContact NH2-OE1 3.14Å
864	K	91.1	Very high	81.2	Confident	116 Å²	116	67.4 Å²	67.4	50%	0.504	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.9	131.9	172	178.6	165.8	-179.7	163.8	0	110.2	F810	F810-K864 HydrophobicContact CB-CD 4.35Å; F810-K864 HydrophobicContact CB-CG 4.44Å; F810-K864 HydrophobicContact CD1-CD 3.97Å; F810-K864 HydrophobicContact CD2-CB 4.22Å; F810-K864 HydrophobicContact CD2-CD 3.69Å; F810-K864 HydrophobicContact CD2-CG 3.63Å; F810-K864 HydrophobicContact CE1-CD 4.08Å; F810-K864 HydrophobicContact CE2-CB 4.14Å; F810-K864 HydrophobicContact CE2-CD 3.84Å; F810-K864 HydrophobicContact CE2-CG 3.97Å; F810-K864 HydrophobicContact CG-CD 3.75Å; F810-K864 VanDerWaalsContact CG-CE 3.42Å; F810-K864 HydrophobicContact CG-CG 4.05Å; F810-K864 HydrophobicContact CZ-CD 4.04Å
865	L	86.7	Confident	79.4	Confident	10 Å²	10	69.2 Å²	69.2	5%	0.052	34%	0.344	C	S	.	.	P	Polyproline II helix	trans	-80.7	150	172.9	-76.1	75.2	0	0	0	110	S811 C812 I813 L833 R863 E869 T870 M873	S811-L865 PolarHBondContact O-N 3.47Å; C812-L865 VanDerWaalsContact CA-CD1 3.43Å; I813-L865 HydrophobicContact CB-CD1 3.81Å; I813-L865 HydrophobicContact CG2-CD1 3.87Å; I813-L865 VanDerWaalsContact N-CD1 3.34Å; L833-L865 HydrophobicContact CD1-CD1 3.95Å; L833-L865 HydrophobicContact CD1-CD2 3.82Å; R863-L865 PolarHBondContact O-N 3.47Å; L865-E869 HydrophobicContact CB-CB 4.12Å; L865-E869 HydrophobicContact CD2-CB 4.05Å; L865-E869 HydrophobicContact CG-CB 4.14Å; L865-T870 WeakPolarHBondContact CB-OG1 3.49Å; L865-M873 HydrophobicContact CD2-SD 3.9Å
866	S	77	Confident	77.7	Confident	51 Å²	51	77.2 Å²	77.2	36%	0.357	38%	0.378	S	S	.	.	P	Polyproline II helix	trans	-70.5	161.6	158	59.9	0	0	0	0	111.6	E868 E869 T870	S866-E868 PolarHBondContact O-N 3.3Å; S866-E869 WeakPolarHBondContact CB-OE2 3.47Å; S866-E869 PolarHBondContact N-OE2 3.38Å; S866-E869 PolarHBondContact O-N 3.09Å; S866-E869 WeakPolarHBondContact OG-CB 3.21Å; S866-E869 VanDerWaalsContact OG-CG 3.27Å; S866-E869 WeakPolarHBondContact OG-CG 3.11Å; S866-E869 PolarHBondContact OG-N 3.16Å; S866-E869 PolarHBondContact OG-OE2 3.01Å; S866-T870 WeakPolarHBondContact O-CB 3.47Å; S866-T870 PolarHBondContact O-N 3Å; S866-T870 PolarHBondContact O-OG1 3.38Å
867	S	67.8	Low	75.5	Confident	101 Å²	101	80 Å²	80	71%	0.706	39%	0.393	S	S	*	.	H	α-helix	trans	-60.8	-25.3	174.6	-47.9	0	0	0	0	113.1	R871	S867-R871 PolarHBondContact O-N 3.09Å
868	E	68.6	Low	72.7	Confident	157 Å²	157	87 Å²	87	73%	0.734	43%	0.43	S	S	*	.	H	α-helix	trans	-79.3	-50.1	178.2	-62	-179.9	166.4	0	0	110.9	S866 T870 R871 S872	S866-E868 PolarHBondContact O-N 3.3Å; E868-T870 PolarHBondContact O-N 3.06Å; E868-R871 PolarHBondContact O-N 3.28Å; E868-S872 PolarHBondContact O-N 3.49Å; E868-S872 PolarHBondContact O-OG 3.04Å; E868-S872 VanDerWaalsContact O-OG 3.12Å
869	E	72	Confident	70.2	Confident	60 Å²	60	93.4 Å²	93.4	28%	0.28	46%	0.462	S	S	.	.	H	α-helix	trans	-57.1	-37.7	171.9	-73.7	167.4	109.7	0	0	112.1	R863 L865 S866 S872 M873	R863-E869 IonicContact CZ-OE1 2.73Å; R863-E869 VanDerWaalsContact CZ-OE1 3.25Å; R863-E869 IonicContact NH1-OE1 3.11Å; R863-E869 PolarHBondContact NH1-OE1 3.37Å; R863-E869 IonicContact NH1-OE2 3.91Å; R863-E869 IonicContact NH2-OE1 2.69Å; R863-E869 PolarHBondContact NH2-OE1 3.14Å; L865-E869 HydrophobicContact CB-CB 4.12Å; L865-E869 HydrophobicContact CD2-CB 4.05Å; L865-E869 HydrophobicContact CG-CB 4.14Å; S866-E869 WeakPolarHBondContact CB-OE2 3.47Å; S866-E869 PolarHBondContact N-OE2 3.38Å; S866-E869 PolarHBondContact O-N 3.09Å; S866-E869 WeakPolarHBondContact OG-CB 3.21Å; S866-E869 VanDerWaalsContact OG-CG 3.27Å; S866-E869 WeakPolarHBondContact OG-CG 3.11Å; S866-E869 PolarHBondContact OG-N 3.16Å; S866-E869 PolarHBondContact OG-OE2 3.01Å; E869-S872 PolarHBondContact O-N 3.48Å; E869-M873 PolarHBondContact O-N 3.24Å
870	T	66	Low	67.3	Low	19 Å²	19	98.2 Å²	98.2	12%	0.117	50%	0.495	C	S	.	.	H	α-helix	trans	-61.2	-51	-179.7	-56.3	0	0	0	0	110.5	L865 S866 E868 S872 M873 E874	L865-T870 WeakPolarHBondContact CB-OG1 3.49Å; S866-T870 WeakPolarHBondContact O-CB 3.47Å; S866-T870 PolarHBondContact O-N 3Å; S866-T870 PolarHBondContact O-OG1 3.38Å; E868-T870 PolarHBondContact O-N 3.06Å; T870-S872 PolarHBondContact O-N 3.07Å; T870-M873 PolarHBondContact O-N 3.08Å; T870-M873 VanDerWaalsContact O-N 3.16Å; T870-E874 HydrophobicContact CG2-CG 4.39Å; T870-E874 WeakPolarHBondContact O-CG 3.3Å; T870-E874 PolarHBondContact O-N 2.87Å
871	R	66.1	Low	64.3	Low	189 Å²	189	96.1 Å²	96.1	71%	0.713	50%	0.501	S	S	*	.	H	α-helix	trans	-59.6	-44.3	174.9	-73.2	-179	174.5	-174	-1.5	112.1	S867 E868 M873 E874 E875	S867-R871 PolarHBondContact O-N 3.09Å; E868-R871 PolarHBondContact O-N 3.28Å; R871-M873 PolarHBondContact O-N 3.39Å; R871-E874 PolarHBondContact O-N 2.82Å; R871-E875 VanDerWaalsContact O-CB 3.25Å; R871-E875 WeakPolarHBondContact O-CB 3.46Å; R871-E875 PolarHBondContact O-N 3.46Å
872	S	65.2	Low	61.3	Low	78 Å²	78	97.6 Å²	97.6	55%	0.545	52%	0.522	S	S	.	.	H	α-helix	trans	-66.4	-14.7	179.1	-58.1	0	0	0	0	114.8	E868 E869 T870	E868-S872 PolarHBondContact O-N 3.49Å; E868-S872 PolarHBondContact O-OG 3.04Å; E868-S872 VanDerWaalsContact O-OG 3.12Å; E869-S872 PolarHBondContact O-N 3.48Å; T870-S872 PolarHBondContact O-N 3.07Å
873	M	60.6	Low	58.4	Low	71 Å²	71	102.6 Å²	102.6	35%	0.35	55%	0.553	S	S	.	*	H	α-helix	trans	-100.7	-35.2	172.9	-73.7	-168.9	165.9	0	0	112.8	I813 L865 E869 T870 R871 K876 L877	I813-M873 HydrophobicContact CD1-CE 3.9Å; I813-M873 HydrophobicContact CD1-SD 4.08Å; L865-M873 HydrophobicContact CD2-SD 3.9Å; E869-M873 PolarHBondContact O-N 3.24Å; T870-M873 PolarHBondContact O-N 3.08Å; T870-M873 VanDerWaalsContact O-N 3.16Å; R871-M873 PolarHBondContact O-N 3.39Å; M873-K876 PolarHBondContact O-N 3.31Å; M873-K876 VanDerWaalsContact O-N 3.14Å; M873-L877 PolarHBondContact O-N 3.15Å
874	E	56	Low	55.4	Low	63 Å²	63	104.2 Å²	104.2	29%	0.294	57%	0.57	S	S	.	*	H	α-helix	trans	-62.2	-47	171.9	-70.9	177.8	139.3	0	0	110.8	R835 T870 R871 K876 L877	R835-E874 IonicContact CZ-OE1 3.95Å; R835-E874 IonicContact NH1-OE1 2.77Å; R835-E874 PolarHBondContact NH1-OE1 2.91Å; R835-E874 IonicContact NH2-OE1 3.98Å; R835-E874 PolarHBondContact NH2-OE1 2.73Å; T870-E874 HydrophobicContact CG2-CG 4.39Å; T870-E874 WeakPolarHBondContact O-CG 3.3Å; T870-E874 PolarHBondContact O-N 2.87Å; R871-E874 PolarHBondContact O-N 2.82Å; E874-K876 PolarHBondContact O-N 3.3Å; E874-L877 PolarHBondContact O-N 3.15Å
875	E	53.8	Low	52.5	Low	151 Å²	151	105.4 Å²	105.4	71%	0.706	58%	0.582	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.7	-11.4	174.6	-168.6	168.4	-137.9	0	0	113.4	R871	R871-E875 VanDerWaalsContact O-CB 3.25Å; R871-E875 WeakPolarHBondContact O-CB 3.46Å; R871-E875 PolarHBondContact O-N 3.46Å
876	K	55.7	Low	49.8	Very low	171 Å²	171	112.2 Å²	112.2	74%	0.743	61%	0.613	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.7	-2.2	177.5	-149.8	-178.1	-179.8	-174.4	0	114	M873 E874	M873-K876 PolarHBondContact O-N 3.31Å; M873-K876 VanDerWaalsContact O-N 3.14Å; E874-K876 PolarHBondContact O-N 3.3Å
877	L	47.5	Very low	47.7	Very low	103 Å²	103	116.8 Å²	116.8	54%	0.539	63%	0.631	S	S	.	*	T	Hydrogen-bonded Turn	trans	-107	-25.2	179.7	-73.2	168.8	0	0	0	113.4	L833 M873 E874 I879	L833-L877 HydrophobicContact CD2-CD1 4.45Å; M873-L877 PolarHBondContact O-N 3.15Å; E874-L877 PolarHBondContact O-N 3.15Å; L877-I879 VanDerWaalsContact C-N 3.27Å; L877-I879 PolarHBondContact O-N 3.12Å
878	D	36.4	Very low	46.1	Very low	147 Å²	147	118.3 Å²	118.3	79%	0.786	63%	0.631	S	S	*	*	S	Bend	trans	-80.7	3.7	178.7	-74.8	-32.7	0	0	0	114.8
879	I	39.9	Very low	44.6	Very low	146 Å²	146	118.1 Å²	118.1	75%	0.749	63%	0.63	S	S	*	*	S	Bend	trans	-110.2	61.3	-178.9	-43.4	-178.1	0	0	0	111.8	L877	L877-I879 VanDerWaalsContact C-N 3.27Å; L877-I879 PolarHBondContact O-N 3.12Å
880	S	31.6	Very low	42.7	Very low	116 Å²	116	121 Å²	121	81%	0.811	65%	0.647	S	S	*	*			trans	-153.9	29.7	162.8	53.2	0	0	0	0	113.7
881	G	28.5	Very low	41	Very low	71 Å²	71	125.7 Å²	125.7	73%	0.732	67%	0.672	S	S	*	*			trans	-105.2	20.3	-168.1	0	0	0	0	0	117.9
882	S	30.5	Very low	39.2	Very low	111 Å²	111	122.4 Å²	122.4	78%	0.776	67%	0.672	S	S	*	*	S	Bend	trans	-164.1	149.5	171.6	-89.2	0	0	0	0	115.8
883	T	31.5	Very low	37.6	Very low	119 Å²	119	125.6 Å²	125.6	73%	0.73	68%	0.682	S	S	*	*			trans	63.8	96	162.7	52.7	0	0	0	0	120.7
884	N	29.9	Very low	36	Very low	138 Å²	138	129.4 Å²	129.4	74%	0.738	70%	0.704	S	S	*	*				67.4	123.9	116.9	-60	-1.9	0	0	0	122.6
885	N	30.6	Very low	35.6	Very low	141 Å²	141	131.6 Å²	131.6	75%	0.754	72%	0.723	S	S	*	*				74.2	114.5	128.7	-69.4	8.3	0	0	0	121.8
886	Q	30.8	Very low	34.7	Very low	153 Å²	153	129.5 Å²	129.5	72%	0.715	72%	0.723	S	S	*	*				109	98.5	113.3	-169.7	163.6	8.2	0	0	119.8
887	M	32.2	Very low	33.5	Very low	148 Å²	148	126 Å²	126	73%	0.729	72%	0.72	S	S	*	*			trans	80	147.3	135.7	-79.2	167.3	170.1	0	0	122.3
888	D	35.5	Very low	32.5	Very low	132 Å²	132	128.7 Å²	128.7	71%	0.706	73%	0.734	S	S	*	*			trans	66	142.6	155.1	-58.9	-5.2	0	0	0	121.2
889	H	36.7	Very low	32	Very low	153 Å²	153	127 Å²	127	71%	0.708	73%	0.734	S	S	*	*			cis	-171.2	140.5	-38.3	-129.1	-57.9	0	0	0	108
890	N	31.4	Very low	31.5	Very low	121 Å²	121	129.4 Å²	129.4	65%	0.647	74%	0.739	S	S	*	*			trans	60.7	166.2	154.7	-77.7	29.4	0	0	0	118.4
891	D	30.7	Very low	31.2	Very low	118 Å²	118	131 Å²	131	63%	0.631	74%	0.737	S	S	*	*			cis	-146.3	124.7	-9	-113.9	-39.5	0	0	0	106.5
892	T	28.6	Very low	31.4	Very low	119 Å²	119	133.5 Å²	133.5	73%	0.73	74%	0.738	S	S	*	*				88.3	157	92.5	-66.3	0	0	0	0	114.8
893	I	30.6	Very low	31.4	Very low	145 Å²	145	133 Å²	133	74%	0.744	73%	0.732	S	S	*	*			trans	92.5	87.3	173.1	-44.8	-173.9	0	0	0	119.2
894	N	27.8	Very low	31	Very low	151 Å²	151	134 Å²	134	81%	0.807	73%	0.732	S	S	*	*			trans	65.6	151.9	130.9	-72.9	-23.7	0	0	0	126.1
895	P	46.7	Very low	31.1	Very low	109 Å²	109	133.3 Å²	133.3	71%	0.708	74%	0.738	S	S	*	*			trans	-87.9	-170.2	172.8	43.1	-41.2	0	0	0	111.7
896	P	36	Very low	30.9	Very low	107 Å²	107	131.4 Å²	131.4	70%	0.695	74%	0.736	S	S	*	*			cis	-146.6	-179	15.1	43.3	-21.7	0	0	0	119.2
897	S	29.3	Very low	31	Very low	98 Å²	98	129.4 Å²	129.4	69%	0.685	74%	0.736	S	S	*	*			trans	43.8	145.9	143.8	68.9	0	0	0	0	124.6
898	L	26.4	Very low	30.8	Very low	159 Å²	159	131.2 Å²	131.2	83%	0.832	74%	0.74	S	S	*	*			trans	85.9	148.9	154.6	-74.1	157.2	0	0	0	120.5
899	S	26.2	Very low	30.3	Very low	113 Å²	113	131.6 Å²	131.6	79%	0.79	74%	0.741	S	S	*	*			trans	61.2	125.9	-176.9	27.7	0	0	0	0	116.3
900	K	29.3	Very low	30	Very low	195 Å²	195	131.3 Å²	131.3	85%	0.848	74%	0.741	S	S	*	*			cis	84.1	137.8	37.2	-166.1	-179.2	-176.1	179.4	0	112.4
901	I	25.6	Very low	29.7	Very low	150 Å²	150	133 Å²	133	77%	0.769	75%	0.746	S	S	*	*			trans	85.4	104.8	-171.9	-53.4	169.9	0	0	0	110.8
902	T	32.4	Very low	29.9	Very low	124 Å²	124	132.1 Å²	132.1	76%	0.761	75%	0.754	S	S	*	*				52.3	152.6	93.1	16.7	0	0	0	0	115.8
903	P	30.9	Very low	30	Very low	100 Å²	100	133 Å²	133	65%	0.649	75%	0.754	S	S	*	*			cis	-139.1	-157.6	-1.1	37.8	-14.7	0	0	0	114.4
904	I	24.4	Very low	30	Very low	140 Å²	140	133.6 Å²	133.6	72%	0.718	76%	0.759	S	S	*	*			trans	71.4	129.4	158.1	-65.2	163.5	0	0	0	118.1
905	S	30.6	Very low	30.1	Very low	124 Å²	124	133.2 Å²	133.2	87%	0.867	76%	0.757	S	S	*	*			trans	-120.5	140	151.8	-71.9	0	0	0	0	109.5
906	S	26.8	Very low	29.4	Very low	101 Å²	101	135.8 Å²	135.8	71%	0.706	76%	0.764	S	S	*	*			trans	-99.1	-163.4	-178.4	-51	0	0	0	0	110.6
907	P	32.8	Very low	29	Very low	111 Å²	111	136 Å²	136	72%	0.721	77%	0.767	S	S	*	*				-125.7	-176.5	-117.7	36.6	-15.7	0	0	0	115.3
908	K	27.7	Very low	28.9	Very low	186 Å²	186	140.1 Å²	140.1	81%	0.809	78%	0.778	S	S	*	*			trans	36.1	129.9	143.2	-82	-171	171.5	-175.4	0	118.6
909	L	25.9	Very low	28.9	Very low	139 Å²	139	137 Å²	137	73%	0.728	77%	0.774	S	S	*	*			cis	-165.1	-170.3	31.9	-104	158.7	0	0	0	107.5
910	M	29.5	Very low	29	Very low	147 Å²	147	135.3 Å²	135.3	72%	0.724	76%	0.763	S	S	*	*			cis	-136.4	-113.6	9.3	-167	144.4	176.1	0	0	113.3
911	E	25.6	Very low	29	Very low	158 Å²	158	127.4 Å²	127.4	74%	0.738	73%	0.73	S	S	*	*			trans	-150.3	140.8	-163.9	-64.4	169.4	99	0	0	111.4
912	A	34.2	Very low	29.1	Very low	98 Å²	98	125.1 Å²	125.1	81%	0.81	72%	0.718	S	S	*	*			trans	167.8	92	145.4	0	0	0	0	0	108
913	N	31.9	Very low	28.9	Very low	137 Å²	137	119.7 Å²	119.7	73%	0.733	69%	0.686	S	S	*	*				58.1	96	62.3	-168.9	14.4	0	0	0	114.3
914	L	29.9	Very low	28.9	Very low	159 Å²	159	117 Å²	117	83%	0.832	67%	0.669	S	S	*	*			trans	-166.7	165.2	130.3	-126.5	69.8	0	0	0	112.1
915	N	30	Very low	29.3	Very low	143 Å²	143	113.7 Å²	113.7	77%	0.765	66%	0.658	S	S	*	*			trans	-98.1	141	-175.2	-42.8	-91.5	0	0	0	112.2
916	N	31.9	Very low	29.4	Very low	163 Å²	163	115.2 Å²	115.2	87%	0.872	66%	0.657	S	S	*	*			trans	-166.2	173.5	141.6	-126.6	-24.3	0	0	0	115.5
917	C	27.1	Very low	29.5	Very low	111 Å²	111	116.1 Å²	116.1	75%	0.75	66%	0.659	S	S	*	*			trans	62.3	81	168.1	-71.9	0	0	0	0	118.5
918	M	26.9	Very low	29.4	Very low	185 Å²	185	115.5 Å²	115.5	91%	0.911	66%	0.657	S	S	*	*			trans	-77.3	157.9	139.6	-104.9	-157.4	-70.1	0	0	110.6
919	A	27.4	Very low	29.4	Very low	92 Å²	92	112 Å²	112	76%	0.76	66%	0.655	S	S	*	*			trans	60.6	105.9	162.4	0	0	0	0	0	118.6
920	S	27.4	Very low	29.7	Very low	79 Å²	79	112.5 Å²	112.5	55%	0.552	66%	0.664	S	S	*	*			trans	-170.6	159.6	134.9	-82.1	0	0	0	0	112.3
921	L	30	Very low	29.7	Very low	29 Å²	29	111.2 Å²	111.2	15%	0.152	67%	0.67	C	S	.	*			trans	73.8	101.1	166.4	-47.9	177.9	0	0	0	119.2	T1025 N1031 T1032	L921-T1025 WeakPolarHBondContact O-CB 3.09Å; L921-T1025 PolarHBondContact O-OG1 2.88Å; L921-N1031 HydrophobicContact CD1-CB 4.01Å; L921-N1031 WeakPolarHBondContact CD1-OD1 3.41Å; L921-T1032 HydrophobicContact CB-CG2 4.09Å; L921-T1032 HydrophobicContact CD1-CG2 4.05Å; L921-T1032 WeakPolarHBondContact CD1-OG1 3.35Å; L921-T1032 HydrophobicContact CD2-CG2 4.06Å; L921-T1032 HydrophobicContact CG-CG2 4.28Å
922	L	27	Very low	30	Very low	101 Å²	101	109.2 Å²	109.2	53%	0.529	67%	0.674	S	S	.	*			trans	-93.4	126.2	145.9	-61	137	0	0	0	107.9	S1023	L922-S1023 VanDerWaalsContact CD2-O 3.26Å; L922-S1023 WeakPolarHBondContact CD2-O 3.1Å
923	S	28.8	Very low	29.9	Very low	10 Å²	10	110.7 Å²	110.7	7%	0.07	68%	0.678	C	S	.	*			trans	155	125.1	137.4	-71.7	0	0	0	0	117.8	T1034	S923-T1034 PolarHBondContact O-OG1 3.38Å
924	S	31	Very low	29.9	Very low	43 Å²	43	106.5 Å²	106.5	30%	0.301	67%	0.667	S	S	.	*			trans	81.3	96.6	143	-65.2	0	0	0	0	124	H387	H387-S924 PolarHBondContact ND1-OG 3.35Å
925	S	33.6	Very low	30.3	Very low	71 Å²	71	102.4 Å²	102.4	50%	0.497	65%	0.649	S	S	.	*				66.1	128	120.2	57.6	0	0	0	0	125.7	H387	H387-S925 PolarHBondContact CE1-OG 2.94Å; H387-S925 VanDerWaalsContact CE1-OG 3.31Å
926	N	32	Very low	30.7	Very low	156 Å²	156	100.6 Å²	100.6	83%	0.834	64%	0.638	S	S	*	*			trans	72.9	149.6	150.3	-58.8	1.1	0	0	0	117.9
927	T	29.6	Very low	31.2	Very low	121 Å²	121	96.4 Å²	96.4	74%	0.742	62%	0.618	S	S	*	*			cis	-135.7	176.4	15	53.1	0	0	0	0	115.1
928	S	29.7	Very low	31.8	Very low	98 Å²	98	92.6 Å²	92.6	69%	0.685	59%	0.592	S	S	*	*			trans	68.4	109.8	144.2	50.9	0	0	0	0	123.2
929	S	28.5	Very low	32.4	Very low	111 Å²	111	89.7 Å²	89.7	78%	0.776	59%	0.585	S	S	*	*			trans	56	112.9	136	59.5	0	0	0	0	122.9
930	T	32.4	Very low	33.5	Very low	150 Å²	150	92.8 Å²	92.8	92%	0.92	58%	0.584	S	S	*	*			trans	-161.1	152.5	131.8	2.3	0	0	0	0	110.5
931	S	28.8	Very low	35.3	Very low	121 Å²	121	93 Å²	93	85%	0.846	58%	0.583	S	S	*	*			trans	-89.3	126.9	-170.1	46.5	0	0	0	0	113.8
932	S	32.3	Very low	37.7	Very low	116 Å²	116	94 Å²	94	81%	0.811	59%	0.587	S	S	*	*			trans	-161.3	160	161.1	59.6	0	0	0	0	111.3	G934	S932-G934 PolarHBondContact O-N 2.92Å
933	S	32.1	Very low	40.6	Very low	128 Å²	128	92.7 Å²	92.7	90%	0.895	58%	0.577	S	S	*	*			trans	-66.6	82.3	-168.1	-56.2	0	0	0	0	114.8	V935	S933-V935 PolarHBondContact O-N 3.29Å
934	G	32	Very low	43.5	Very low	49 Å²	49	92.2 Å²	92.2	51%	0.505	57%	0.574	S	S	.	*			trans	-78.4	99.2	-179	0	0	0	0	0	114.4	S932 I936	S932-G934 PolarHBondContact O-N 2.92Å; G934-I936 PolarHBondContact O-N 3.44Å
935	V	37.1	Very low	46.4	Very low	74 Å²	74	96.2 Å²	96.2	45%	0.448	58%	0.582	S	S	.	*			trans	-73.2	119.1	163.6	175.5	0	0	0	0	109.2	S933 V937 K970	S933-V935 PolarHBondContact O-N 3.29Å; V935-V937 HydrophobicContact CG1-CG2 4.42Å; V935-V937 PolarHBondContact O-N 3.16Å; V935-K970 HydrophobicContact CG1-CB 3.65Å; V935-K970 HydrophobicContact CG1-CD 3.94Å; V935-K970 HydrophobicContact CG1-CG 3.84Å
936	I	38.8	Very low	49.2	Very low	104 Å²	104	93 Å²	93	53%	0.533	56%	0.56	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-78.2	99.3	179.4	-57.1	177.7	0	0	0	108.7	G934 C938 K970 R971	G934-I936 PolarHBondContact O-N 3.44Å; I936-C938 PolarHBondContact O-N 2.68Å; I936-K970 CarbonylContact O-C 3.45Å; I936-K970 WeakPolarHBondContact O-CA 3.33Å; I936-R971 HydrophobicContact CB-CB 4.32Å; I936-R971 PolarHBondContact N-O 2.71Å; I936-R971 PolarHBondContact O-N 2.85Å
937	V	43.5	Very low	52	Low	76 Å²	76	89.9 Å²	89.9	46%	0.461	54%	0.542	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	106.2	171.6	-179.4	0	0	0	0	108.7	V935 T939 K970	V935-V937 HydrophobicContact CG1-CG2 4.42Å; V935-V937 PolarHBondContact O-N 3.16Å; V937-T939 PolarHBondContact O-N 3.27Å; V937-K970 HydrophobicContact CG2-CG 4.41Å
938	C	38.1	Very low	54.9	Low	30 Å²	30	85.6 Å²	85.6	20%	0.203	52%	0.519	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.3	130.4	178.5	-71	0	0	0	0	110.7	I936 E942 R969	I936-C938 PolarHBondContact O-N 2.68Å; C938-E942 PolarHBondContact SG-OE2 3.07Å; C938-R969 PolarHBondContact N-O 3.31Å
939	T	40.9	Very low	57.8	Low	125 Å²	125	84.8 Å²	84.8	77%	0.767	51%	0.511	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87.7	-13.5	179	49	0	0	0	0	113.3	V937	V937-T939 PolarHBondContact O-N 3.27Å
940	Q	50.9	Low	60.8	Low	157 Å²	157	80.8 Å²	80.8	73%	0.734	48%	0.48	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-108.5	151.3	168.7	-66.4	-170.2	-2.4	0	0	110.5	E942	Q940-E942 PolarHBondContact O-N 3.47Å; Q940-E942 VanDerWaalsContact O-N 3.07Å
941	P	65.3	Low	63.6	Low	83 Å²	83	81.9 Å²	81.9	54%	0.539	47%	0.471	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.9	99.4	175.5	30.7	-33.9	0	0	0	110.1	F943	P941-F943 HydrophobicContact CB-CE2 4.1Å; P941-F943 HydrophobicContact CB-CZ 4.28Å; P941-F943 WeakPolarHBondContact O-CD2 3.36Å; P941-F943 WeakPolarHBondContact O-CE2 3.08Å
942	E	79.5	Confident	66.4	Low	51 Å²	51	77.5 Å²	77.5	24%	0.238	44%	0.443	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	134.9	-179	-158.3	-178.5	179.2	0	0	109.3	C938 Q940 Q967 L968 R971 L1000	C938-E942 PolarHBondContact SG-OE2 3.07Å; Q940-E942 PolarHBondContact O-N 3.47Å; Q940-E942 VanDerWaalsContact O-N 3.07Å; E942-Q967 CarbonylContact O-C 3.5Å; E942-L968 HydrophobicContact CB-CB 4.38Å; E942-L968 HydrophobicContact CG-CD1 4.43Å; E942-L968 PolarHBondContact O-N 3.32Å; E942-R971 IonicContact OE1-CZ 2.95Å; E942-R971 IonicContact OE1-NH1 3.44Å; E942-R971 PolarHBondContact OE1-NH1 3.38Å; E942-R971 IonicContact OE1-NH2 3.76Å; E942-R971 PolarHBondContact OE1-NH2 3.48Å; E942-R971 IonicContact OE2-CZ 3.28Å; E942-R971 VanDerWaalsContact OE2-CZ 3.23Å; E942-R971 IonicContact OE2-NH1 2.72Å; E942-R971 PolarHBondContact OE2-NH1 2.74Å; E942-R971 IonicContact OE2-NH2 2.96Å; E942-R971 PolarHBondContact OE2-NH2 3.48Å; E942-L1000 HydrophobicContact CG-CD1 4Å; E942-L1000 WeakPolarHBondContact OE1-CD2 3.42Å
943	F	88.4	Confident	69	Low	73 Å²	73	78 Å²	78	32%	0.32	44%	0.441	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	144.6	-174.3	-62.7	-89.9	0	0	0	111.5	P941 V965 V966 Q967 Q982 I1001	P941-F943 HydrophobicContact CB-CE2 4.1Å; P941-F943 HydrophobicContact CB-CZ 4.28Å; P941-F943 WeakPolarHBondContact O-CD2 3.36Å; P941-F943 WeakPolarHBondContact O-CE2 3.08Å; F943-V965 HydrophobicContact CB-CG1 4.29Å; F943-V965 HydrophobicContact CD1-CG1 3.96Å; F943-V966 WeakPolarHBondContact CA-O 3.47Å; F943-Q967 HydrophobicContact CD1-CB 3.94Å; F943-Q967 HydrophobicContact CD1-CG 4.31Å; F943-Q967 HydrophobicContact CE1-CB 3.81Å; F943-Q967 HydrophobicContact CE1-CG 3.95Å; F943-Q967 HydrophobicContact CZ-CG 4.36Å; F943-Q982 HydrophobicContact CE1-CG 4.3Å; F943-I1001 HydrophobicContact CB-CB 4.21Å; F943-I1001 HydrophobicContact CB-CD1 4.02Å; F943-I1001 HydrophobicContact CB-CG1 4.37Å; F943-I1001 WeakPolarHBondContact O-CB 3.36Å; F943-I1001 PolarHBondContact O-N 3.44Å
944	A	89.2	Confident	71.4	Confident	0 Å²	0	75 Å²	75	0%	0	42%	0.42	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	144.8	172	0	0	0	0	0	110.5	V965 V966 L968 W977 V998 R999 L1000	A944-V965 WeakPolarHBondContact O-CA 3.43Å; A944-V966 PolarHBondContact N-O 3.33Å; A944-V966 PolarHBondContact O-N 2.99Å; A944-L968 HydrophobicContact CB-CD1 4.38Å; A944-L968 HydrophobicContact CB-CD2 3.94Å; A944-L968 HydrophobicContact CB-CG 4.28Å; A944-W977 HydrophobicContact CB-CZ3 4.42Å; A944-V998 HydrophobicContact CB-CB 3.8Å; A944-V998 HydrophobicContact CB-CG2 3.68Å; A944-R999 CarbonylContact C-O 3.51Å; A944-R999 WeakPolarHBondContact CA-O 3.49Å; A944-L1000 HydrophobicContact CB-CD1 4.41Å
945	R	92.4	Very high	73.7	Confident	126 Å²	126	78.1 Å²	78.1	48%	0.475	44%	0.441	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	127.9	175.6	-176.9	171.2	66	-148.4	3.8	109.1	I947 Q964 V998 R999 I1001	R945-I947 PolarHBondContact O-N 3.18Å; R945-Q964 CarbonylContact C-O 3.52Å; R945-Q964 WeakPolarHBondContact CA-O 3.49Å; R945-V998 CarbonylContact O-C 3.59Å; R945-V998 WeakPolarHBondContact O-CA 3.43Å; R945-R999 PolarHBondContact N-O 2.9Å; R945-R999 PolarHBondContact O-N 3.36Å; R945-I1001 HydrophobicContact CB-CD1 3.98Å; R945-I1001 HydrophobicContact CB-CG1 3.96Å
946	V	91.7	Very high	75.9	Confident	3 Å²	3	76.5 Å²	76.5	2%	0.018	44%	0.439	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.9	130.3	177.2	-177.1	0	0	0	0	110.1	A948 L960 Q961 G963 Q964 V966 F997 V998	V946-A948 WeakPolarHBondContact CG1-O 3.45Å; V946-L960 HydrophobicContact CB-CB 4.49Å; V946-L960 HydrophobicContact CG1-CB 3.7Å; V946-L960 HydrophobicContact CG1-CD1 4.36Å; V946-L960 HydrophobicContact CG2-CB 3.91Å; V946-L960 HydrophobicContact CG2-CD1 4.2Å; V946-L960 HydrophobicContact CG2-CD2 3.97Å; V946-L960 HydrophobicContact CG2-CG 4.27Å; V946-Q961 VanDerWaalsContact CB-O 3.31Å; V946-Q961 WeakPolarHBondContact CB-O 3.42Å; V946-Q961 WeakPolarHBondContact CG1-O 3.37Å; V946-G963 PolarHBondContact O-N 2.95Å; V946-Q964 HydrophobicContact CB-CB 4.31Å; V946-Q964 HydrophobicContact CG2-CB 3.77Å; V946-Q964 PolarHBondContact N-O 3.49Å; V946-V966 HydrophobicContact CG2-CG2 3.97Å; V946-F997 WeakPolarHBondContact CA-O 3.1Å; V946-V998 HydrophobicContact CG2-CG1 4.18Å
947	I	91.4	Very high	78.4	Confident	92 Å²	92	73.5 Å²	73.5	47%	0.472	42%	0.423	S	S	.	.			trans	-110.3	-21.8	178.1	55.9	169.7	0	0	0	113.4	R945 F997 R999	R945-I947 PolarHBondContact O-N 3.18Å; I947-F997 WeakPolarHBondContact CG1-O 3.45Å; I947-F997 PolarHBondContact N-O 2.98Å; I947-R999 HydrophobicContact CD1-CB 4.42Å; I947-R999 HydrophobicContact CG2-CB 3.63Å
948	A	89.1	Confident	80.5	Confident	30 Å²	30	70 Å²	70	25%	0.248	40%	0.402	C	S	.	.	S	Bend	trans	-137.5	148.9	177.7	0	0	0	0	0	111	V946 F997	V946-A948 WeakPolarHBondContact CG1-O 3.45Å; A948-F997 HydrophobicContact CB-CD1 3.65Å; A948-F997 HydrophobicContact CB-CE1 4.24Å; A948-F997 HydrophobicContact CB-CG 4.43Å; A948-F997 PolarHBondContact N-O 3.46Å
949	P	92.1	Very high	83.1	Confident	81 Å²	81	71.2 Å²	71.2	53%	0.526	41%	0.408	S	S	.	.			trans	-69.8	133.5	176.4	29.5	-33.1	0	0	0	110.5	L960 P962 F997	P949-L960 WeakPolarHBondContact CA-O 3.3Å; P949-P962 HydrophobicContact CB-CG 4.42Å; P949-F997 WeakPolarHBondContact O-CD1 3.48Å; P949-F997 VanDerWaalsContact O-CE1 3.31Å; P949-F997 WeakPolarHBondContact O-CE1 3.29Å
950	Y	91.2	Very high	85.4	Confident	28 Å²	28	65.2 Å²	65.2	11%	0.11	37%	0.372	C	S	.	.	B	Isolated β-bridge	trans	-128.8	127	175.8	176.9	-112.3	0	0	0	109.3	Q957 L958 T959 L960 W976 F993 P994 F997	Y950-Q957 HydrophobicContact CE1-CB 4.36Å; Y950-Q957 PolarHBondContact OH-OE1 2.86Å; Y950-L958 VanDerWaalsContact CD1-O 3.24Å; Y950-L958 WeakPolarHBondContact CD1-O 3.49Å; Y950-T959 CarbonylContact O-C 3.37Å; Y950-T959 WeakPolarHBondContact O-CA 3.37Å; Y950-L960 HydrophobicContact CD1-CG 4.34Å; Y950-L960 PolarHBondContact N-O 3.35Å; Y950-L960 PolarHBondContact O-N 3.33Å; Y950-W976 VanDerWaalsContact OH-CH2 3.32Å; Y950-W976 WeakPolarHBondContact OH-CH2 2.94Å; Y950-W976 WeakPolarHBondContact OH-CZ3 3.24Å; Y950-F993 HydrophobicContact CD1-CB 3.86Å; Y950-F993 HydrophobicContact CE1-CB 4.01Å; Y950-P994 HydrophobicContact CD2-CG 4.28Å; Y950-P994 HydrophobicContact CE2-CG 3.93Å; Y950-F997 HydrophobicContact CD2-CD1 4.39Å; Y950-F997 HydrophobicContact CD2-CD2 4.36Å; Y950-F997 HydrophobicContact CD2-CE1 4.19Å; Y950-F997 HydrophobicContact CD2-CE2 4.17Å; Y950-F997 HydrophobicContact CD2-CG 4.47Å; Y950-F997 HydrophobicContact CD2-CZ 4.08Å; Y950-F997 HydrophobicContact CG-CD1 4.39Å; Y950-F997 HydrophobicContact CG-CG 4.4Å
951	K	91.2	Very high	87.2	Confident	172 Å²	172	62.8 Å²	62.8	75%	0.748	36%	0.36	S	S	*	.			trans	-100.5	126.5	179	-172.1	179.6	178.9	-175.4	0	109.1	T953	K951-T953 PolarHBondContact O-N 2.89Å
952	A	88	Confident	88.3	Confident	30 Å²	30	62.3 Å²	62.3	25%	0.248	36%	0.357	C	S	.	.			trans	-61.5	128.5	175.1	0	0	0	0	0	110.9	Q957 T959	A952-Q957 HydrophobicContact CB-CB 3.8Å; A952-Q957 VanDerWaalsContact CB-O 3.27Å; A952-Q957 WeakPolarHBondContact CB-O 3.32Å; A952-T959 VanDerWaalsContact CB-OG1 3.26Å; A952-T959 WeakPolarHBondContact CB-OG1 3.41Å; A952-T959 PolarHBondContact N-OG1 3.3Å; A952-T959 VanDerWaalsContact N-OG1 3.09Å
953	T	85.6	Confident	88.5	Confident	127 Å²	127	62.3 Å²	62.3	78%	0.779	37%	0.371	S	S	*	.	S	Bend	trans	-96.5	-19.5	175.4	-51.5	0	0	0	0	111.4	K951 Q957	K951-T953 PolarHBondContact O-N 2.89Å; T953-Q957 VanDerWaalsContact CB-OE1 3.29Å
954	S	82.5	Confident	88.6	Confident	64 Å²	64	60.1 Å²	60.1	45%	0.448	36%	0.361	S	S	.	.	S	Bend	trans	-137.3	162.3	173.9	74.2	0	0	0	0	112.1	G956 Q957	S954-G956 PolarHBondContact O-N 3.44Å; S954-G956 VanDerWaalsContact O-N 3.14Å; S954-Q957 VanDerWaalsContact N-OE1 3.09Å; S954-Q957 WeakPolarHBondContact O-CB 3.47Å; S954-Q957 PolarHBondContact O-N 3.27Å
955	A	80.6	Confident	88.6	Confident	114 Å²	114	62.3 Å²	62.3	94%	0.942	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.9	-17.4	-178.8	0	0	0	0	0	114.3	Q957	A955-Q957 VanDerWaalsContact C-N 3.34Å
956	G	83.9	Confident	88.5	Confident	40 Å²	40	56.3 Å²	56.3	41%	0.412	35%	0.352	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.4	1.2	173.4	0	0	0	0	0	114.3	S954 G991 W992	S954-G956 PolarHBondContact O-N 3.44Å; S954-G956 VanDerWaalsContact O-N 3.14Å; G956-G991 CarbonylContact O-C 3.59Å; G956-G991 WeakPolarHBondContact O-CA 3.43Å; G956-W992 PolarHBondContact O-N 2.85Å
957	Q	90.2	Very high	88.4	Confident	41 Å²	41	58.3 Å²	58.3	19%	0.192	36%	0.362	C	S	.	.	B	Isolated β-bridge	trans	-105.9	143.8	-178	-71.3	168.7	-10.7	0	0	112.1	Y950 A952 T953 S954 A955 W976 W992	Y950-Q957 HydrophobicContact CE1-CB 4.36Å; Y950-Q957 PolarHBondContact OH-OE1 2.86Å; A952-Q957 HydrophobicContact CB-CB 3.8Å; A952-Q957 VanDerWaalsContact CB-O 3.27Å; A952-Q957 WeakPolarHBondContact CB-O 3.32Å; T953-Q957 VanDerWaalsContact CB-OE1 3.29Å; S954-Q957 VanDerWaalsContact N-OE1 3.09Å; S954-Q957 WeakPolarHBondContact O-CB 3.47Å; S954-Q957 PolarHBondContact O-N 3.27Å; A955-Q957 VanDerWaalsContact C-N 3.34Å; Q957-W976 HydrophobicContact CG-CZ3 4.11Å; Q957-W976 VanDerWaalsContact NE2-CH2 3.31Å; Q957-W992 CarbonylContact C-O 3.59Å; Q957-W992 WeakPolarHBondContact CA-O 3.46Å; Q957-W992 WeakPolarHBondContact CB-O 3.4Å
958	L	88.7	Confident	88.4	Confident	3 Å²	3	54.2 Å²	54.2	2%	0.016	34%	0.34	C	S	.	.			trans	-92.3	124.2	-179.3	-172.2	61.3	0	0	0	110.1	Y950 L960 V966 L981 Q989 W992 F993	Y950-L958 VanDerWaalsContact CD1-O 3.24Å; Y950-L958 WeakPolarHBondContact CD1-O 3.49Å; L958-L960 HydrophobicContact CB-CD2 4.37Å; L958-L960 HydrophobicContact CD2-CD2 3.79Å; L958-L960 HydrophobicContact CG-CD2 3.85Å; L958-L960 PolarHBondContact O-N 2.96Å; L958-V966 HydrophobicContact CD2-CG1 3.89Å; L958-V966 HydrophobicContact CD2-CG2 4.3Å; L958-L981 HydrophobicContact CD1-CB 4.13Å; L958-L981 HydrophobicContact CD2-CB 4.23Å; L958-Q989 HydrophobicContact CD1-CB 3.46Å; L958-Q989 VanDerWaalsContact CD1-CB 3.46Å; L958-W992 PolarHBondContact N-O 2.92Å; L958-F993 HydrophobicContact CB-CD1 4.06Å; L958-F993 HydrophobicContact CD2-CD1 4.05Å; L958-F993 HydrophobicContact CD2-CE1 4.13Å
959	T	91.5	Very high	88.2	Confident	55 Å²	55	55.5 Å²	55.5	34%	0.337	34%	0.339	S	S	.	.			trans	-76.3	124.4	172.2	-68.2	0	0	0	0	109.7	Y950 A952	Y950-T959 CarbonylContact O-C 3.37Å; Y950-T959 WeakPolarHBondContact O-CA 3.37Å; A952-T959 VanDerWaalsContact CB-OG1 3.26Å; A952-T959 WeakPolarHBondContact CB-OG1 3.41Å; A952-T959 PolarHBondContact N-OG1 3.3Å; A952-T959 VanDerWaalsContact N-OG1 3.09Å
960	L	89.8	Confident	88	Confident	0 Å²	0	54 Å²	54	0%	0	32%	0.324	C	S	.	.	B	Isolated β-bridge	trans	-110.3	141.4	-177.2	-52.4	-179.5	0	0	0	111.7	V946 P949 Y950 L958 V966 F993 F997 V998	V946-L960 HydrophobicContact CB-CB 4.49Å; V946-L960 HydrophobicContact CG1-CB 3.7Å; V946-L960 HydrophobicContact CG1-CD1 4.36Å; V946-L960 HydrophobicContact CG2-CB 3.91Å; V946-L960 HydrophobicContact CG2-CD1 4.2Å; V946-L960 HydrophobicContact CG2-CD2 3.97Å; V946-L960 HydrophobicContact CG2-CG 4.27Å; P949-L960 WeakPolarHBondContact CA-O 3.3Å; Y950-L960 HydrophobicContact CD1-CG 4.34Å; Y950-L960 PolarHBondContact N-O 3.35Å; Y950-L960 PolarHBondContact O-N 3.33Å; L958-L960 HydrophobicContact CB-CD2 4.37Å; L958-L960 HydrophobicContact CD2-CD2 3.79Å; L958-L960 HydrophobicContact CG-CD2 3.85Å; L958-L960 PolarHBondContact O-N 2.96Å; L960-V966 HydrophobicContact CD2-CG2 3.86Å; L960-F993 HydrophobicContact CD1-CB 3.74Å; L960-F993 HydrophobicContact CD1-CD1 4.49Å; L960-F993 HydrophobicContact CD1-CD2 3.84Å; L960-F993 HydrophobicContact CD1-CG 3.76Å; L960-F993 HydrophobicContact CD2-CD1 4.34Å; L960-F993 HydrophobicContact CD2-CG 4.39Å; L960-F993 HydrophobicContact CG-CB 4.24Å; L960-F993 HydrophobicContact CG-CG 4.4Å; L960-F997 HydrophobicContact CD1-CB 3.95Å; L960-V998 HydrophobicContact CD1-CG1 3.84Å
961	Q	88.8	Confident	87.7	Confident	106 Å²	106	55.2 Å²	55.2	50%	0.495	33%	0.329	S	S	.	.			trans	-123.6	137.4	170.5	-67.2	-65.9	-16.6	0	0	110	V946 G963 Q964	V946-Q961 VanDerWaalsContact CB-O 3.31Å; V946-Q961 WeakPolarHBondContact CB-O 3.42Å; V946-Q961 WeakPolarHBondContact CG1-O 3.37Å; Q961-G963 PolarHBondContact O-N 3.46Å; Q961-Q964 HydrophobicContact CB-CG 4.23Å; Q961-Q964 VanDerWaalsContact O-CB 3.3Å; Q961-Q964 WeakPolarHBondContact O-CB 3.4Å; Q961-Q964 WeakPolarHBondContact O-CG 3.32Å; Q961-Q964 PolarHBondContact O-N 3.22Å; Q961-Q964 VanDerWaalsContact O-N 3.14Å; Q961-Q964 PolarHBondContact O-OE1 3.44Å
962	P	88.8	Confident	87.2	Confident	72 Å²	72	48.5 Å²	48.5	47%	0.468	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	-49.7	137.4	-178.7	-29.7	36.3	0	0	0	113.6	P949 Q964	P949-P962 HydrophobicContact CB-CG 4.42Å; P962-Q964 VanDerWaalsContact C-N 3.3Å; P962-Q964 PolarHBondContact O-N 2.97Å
963	G	83.8	Confident	86.3	Confident	52 Å²	52	52.4 Å²	52.4	54%	0.536	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	84.4	-12.7	-178.7	0	0	0	0	0	115.6	V946 Q961	V946-G963 PolarHBondContact O-N 2.95Å; Q961-G963 PolarHBondContact O-N 3.46Å
964	Q	89.9	Confident	85.8	Confident	26 Å²	26	53 Å²	53	12%	0.121	32%	0.318	C	S	.	.			trans	-59.9	154	167.8	-74.2	176.9	-28	0	0	111.4	R945 V946 Q961 P962 L981	R945-Q964 CarbonylContact C-O 3.52Å; R945-Q964 WeakPolarHBondContact CA-O 3.49Å; V946-Q964 HydrophobicContact CB-CB 4.31Å; V946-Q964 HydrophobicContact CG2-CB 3.77Å; V946-Q964 PolarHBondContact N-O 3.49Å; Q961-Q964 HydrophobicContact CB-CG 4.23Å; Q961-Q964 VanDerWaalsContact O-CB 3.3Å; Q961-Q964 WeakPolarHBondContact O-CB 3.4Å; Q961-Q964 WeakPolarHBondContact O-CG 3.32Å; Q961-Q964 PolarHBondContact O-N 3.22Å; Q961-Q964 VanDerWaalsContact O-N 3.14Å; Q961-Q964 PolarHBondContact O-OE1 3.44Å; P962-Q964 VanDerWaalsContact C-N 3.3Å; P962-Q964 PolarHBondContact O-N 2.97Å; Q964-L981 HydrophobicContact CB-CD1 3.84Å; Q964-L981 VanDerWaalsContact CD-CD1 3.49Å; Q964-L981 HydrophobicContact CG-CD1 3.96Å
965	V	89.7	Confident	85.9	Confident	47 Å²	47	51.4 Å²	51.4	29%	0.285	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	137.9	170.9	177.8	0	0	0	0	109	F943 A944 Q982 I1001	F943-V965 HydrophobicContact CB-CG1 4.29Å; F943-V965 HydrophobicContact CD1-CG1 3.96Å; A944-V965 WeakPolarHBondContact O-CA 3.43Å; V965-Q982 HydrophobicContact CB-CB 4.25Å; V965-Q982 HydrophobicContact CG1-CB 4.3Å; V965-Q982 WeakPolarHBondContact O-CB 3.37Å; V965-Q982 PolarHBondContact O-N 2.89Å; V965-I1001 HydrophobicContact CG1-CD1 3.91Å; V965-I1001 HydrophobicContact CG2-CD1 4.07Å
966	V	90.5	Very high	86.3	Confident	0 Å²	0	50.2 Å²	50.2	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	129	178	-172.9	0	0	0	0	108.6	F943 A944 V946 L958 L960 E980 L981 F993	F943-V966 WeakPolarHBondContact CA-O 3.47Å; A944-V966 PolarHBondContact N-O 3.33Å; A944-V966 PolarHBondContact O-N 2.99Å; V946-V966 HydrophobicContact CG2-CG2 3.97Å; L958-V966 HydrophobicContact CD2-CG1 3.89Å; L958-V966 HydrophobicContact CD2-CG2 4.3Å; L960-V966 HydrophobicContact CD2-CG2 3.86Å; V966-E980 WeakPolarHBondContact CA-O 3.46Å; V966-L981 HydrophobicContact CG2-CD1 4.32Å; V966-F993 HydrophobicContact CB-CZ 4.43Å; V966-F993 HydrophobicContact CG1-CE1 3.68Å; V966-F993 HydrophobicContact CG1-CZ 3.84Å
967	Q	90	Very high	86.7	Confident	45 Å²	45	50.3 Å²	50.3	21%	0.21	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	116.3	172.3	-178.6	-179.1	-13.8	0	0	108.9	E942 F943 G979 E980 Q982	E942-Q967 CarbonylContact O-C 3.5Å; F943-Q967 HydrophobicContact CD1-CB 3.94Å; F943-Q967 HydrophobicContact CD1-CG 4.31Å; F943-Q967 HydrophobicContact CE1-CB 3.81Å; F943-Q967 HydrophobicContact CE1-CG 3.95Å; F943-Q967 HydrophobicContact CZ-CG 4.36Å; Q967-G979 CarbonylContact O-C 3.45Å; Q967-G979 WeakPolarHBondContact O-CA 3.34Å; Q967-E980 HydrophobicContact CB-CB 4.46Å; Q967-E980 PolarHBondContact N-O 3.02Å; Q967-E980 PolarHBondContact O-N 3.24Å; Q967-Q982 HydrophobicContact CB-CG 4.21Å
968	L	90.1	Very high	86.8	Confident	5 Å²	5	49.2 Å²	49.2	3%	0.026	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	139.4	179.7	-52.5	-174.5	0	0	0	110.7	E942 A944 W977 F993 L1000	E942-L968 HydrophobicContact CB-CB 4.38Å; E942-L968 HydrophobicContact CG-CD1 4.43Å; E942-L968 PolarHBondContact O-N 3.32Å; A944-L968 HydrophobicContact CB-CD1 4.38Å; A944-L968 HydrophobicContact CB-CD2 3.94Å; A944-L968 HydrophobicContact CB-CG 4.28Å; L968-W977 HydrophobicContact CD1-CD2 4.36Å; L968-W977 HydrophobicContact CD1-CE3 3.61Å; L968-W977 HydrophobicContact CD1-CZ3 3.73Å; L968-W977 HydrophobicContact CD2-CE3 3.69Å; L968-W977 HydrophobicContact CD2-CZ3 4.37Å; L968-W977 HydrophobicContact CG-CE3 4.33Å; L968-F993 HydrophobicContact CD2-CE2 4.39Å; L968-F993 HydrophobicContact CD2-CZ 3.76Å; L968-L1000 HydrophobicContact CD1-CD1 3.65Å
969	R	85.6	Confident	86.8	Confident	57 Å²	57	49.1 Å²	49.1	22%	0.215	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	-45.6	-178	-71.9	169.7	147.8	-99.2	-3.8	111.5	V27 C938 E978 E980	V27-R969 VanDerWaalsContact CG1-NH2 3.28Å; C938-R969 PolarHBondContact N-O 3.31Å; R969-E978 HydrophobicContact CB-CB 4.47Å; R969-E978 HydrophobicContact CB-CG 4.38Å; R969-E978 WeakPolarHBondContact CB-OE2 3.47Å; R969-E978 PolarHBondContact N-O 2.96Å; R969-E980 IonicContact CZ-OE2 3.19Å; R969-E980 VanDerWaalsContact CZ-OE2 3.25Å; R969-E980 IonicContact NE-OE2 2.82Å; R969-E980 PolarHBondContact NE-OE2 2.95Å; R969-E980 IonicContact NH2-OE2 2.71Å; R969-E980 PolarHBondContact NH2-OE2 3.49Å
970	K	86.6	Confident	86.8	Confident	51 Å²	51	46.7 Å²	46.7	22%	0.222	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	144.4	179.3	-55.8	169.5	-172.1	160.3	0	109.9	V935 I936 V937 W977 E978 W992	V935-K970 HydrophobicContact CG1-CB 3.65Å; V935-K970 HydrophobicContact CG1-CD 3.94Å; V935-K970 HydrophobicContact CG1-CG 3.84Å; I936-K970 CarbonylContact O-C 3.45Å; I936-K970 WeakPolarHBondContact O-CA 3.33Å; V937-K970 HydrophobicContact CG2-CG 4.41Å; K970-W977 CarbonylContact O-C 3.48Å; K970-W977 WeakPolarHBondContact O-CA 3.42Å; K970-E978 HydrophobicContact CB-CB 3.75Å; K970-E978 HydrophobicContact CD-CB 4.08Å; K970-E978 VanDerWaalsContact CD-CD 3.47Å; K970-E978 HydrophobicContact CD-CG 4.42Å; K970-E978 WeakPolarHBondContact CD-OE1 3.25Å; K970-E978 WeakPolarHBondContact CD-OE2 3.42Å; K970-E978 VanDerWaalsContact CE-CD 3.49Å; K970-E978 VanDerWaalsContact CE-OE1 3.28Å; K970-E978 WeakPolarHBondContact CE-OE1 3.31Å; K970-E978 WeakPolarHBondContact CE-OE2 3.18Å; K970-E978 HydrophobicContact CG-CB 4.1Å; K970-E978 PolarHBondContact N-O 2.94Å; K970-E978 IonicContact NZ-OE1 2.81Å; K970-E978 PolarHBondContact NZ-OE1 2.83Å; K970-E978 IonicContact NZ-OE2 2.81Å; K970-E978 PolarHBondContact NZ-OE2 2.65Å; K970-E978 PolarHBondContact O-N 2.82Å; K970-W992 HydrophobicContact CB-CH2 3.84Å; K970-W992 HydrophobicContact CB-CZ2 4.44Å; K970-W992 HydrophobicContact CB-CZ3 4.32Å; K970-W992 HydrophobicContact CD-CH2 3.95Å; K970-W992 HydrophobicContact CD-CZ2 3.75Å
971	R	86.5	Confident	86.7	Confident	53 Å²	53	47.1 Å²	47.1	20%	0.2	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	124.8	163.5	-67.6	179.1	160.8	141.6	-1.8	109.4	I936 E942 W977	I936-R971 HydrophobicContact CB-CB 4.32Å; I936-R971 PolarHBondContact N-O 2.71Å; I936-R971 PolarHBondContact O-N 2.85Å; E942-R971 IonicContact OE1-CZ 2.95Å; E942-R971 IonicContact OE1-NH1 3.44Å; E942-R971 PolarHBondContact OE1-NH1 3.38Å; E942-R971 IonicContact OE1-NH2 3.76Å; E942-R971 PolarHBondContact OE1-NH2 3.48Å; E942-R971 IonicContact OE2-CZ 3.28Å; E942-R971 VanDerWaalsContact OE2-CZ 3.23Å; E942-R971 IonicContact OE2-NH1 2.72Å; E942-R971 PolarHBondContact OE2-NH1 2.74Å; E942-R971 IonicContact OE2-NH2 2.96Å; E942-R971 PolarHBondContact OE2-NH2 3.48Å; R971-W977 HydrophobicContact CG-CD2 4.31Å; R971-W977 HydrophobicContact CG-CG 4.07Å
972	S	80.8	Confident	86.2	Confident	30 Å²	30	45.8 Å²	45.8	21%	0.21	25%	0.245	C	C	.	.			trans	-85.4	140.8	164.3	-177.3	0	0	0	0	109.3	K974 G975 W976	S972-K974 PolarHBondContact O-N 2.76Å; S972-K974 PolarHBondContact OG-N 3.48Å; S972-G975 PolarHBondContact O-N 3.33Å; S972-W976 WeakPolarHBondContact CA-O 3.42Å; S972-W976 WeakPolarHBondContact CB-O 3.38Å; S972-W976 PolarHBondContact N-O 3.48Å
973	P	68.2	Low	85.2	Confident	112 Å²	112	46.1 Å²	46.1	73%	0.727	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.1	-27.6	167.6	-25.5	35.3	0	0	0	113.3	G975	P973-G975 PolarHBondContact O-N 3.07Å
974	K	76.4	Confident	84	Confident	140 Å²	140	55.9 Å²	55.9	61%	0.609	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75	26.4	178.9	-63.2	-170.7	174.6	-107.5	0	114.3	S972 W976 D1096	S972-K974 PolarHBondContact O-N 2.76Å; S972-K974 PolarHBondContact OG-N 3.48Å; K974-W976 VanDerWaalsContact O-CD1 3.26Å; K974-W976 PolarHBondContact O-N 3.01Å; K974-W976 VanDerWaalsContact O-N 3.1Å; K974-D1096 IonicContact NZ-OD1 2.76Å; K974-D1096 PolarHBondContact NZ-OD1 2.7Å
975	G	83.2	Confident	82.4	Confident	30 Å²	30	58.4 Å²	58.4	31%	0.309	29%	0.294	S	S	.	.	S	Bend	trans	69	4.8	178.9	0	0	0	0	0	116.3	S972 P973 A995	S972-G975 PolarHBondContact O-N 3.33Å; P973-G975 PolarHBondContact O-N 3.07Å; G975-A995 VanDerWaalsContact O-CB 3.27Å; G975-A995 WeakPolarHBondContact O-CB 3.13Å; G975-A995 PolarHBondContact O-N 3.23Å
976	W	88.8	Confident	81.1	Confident	90 Å²	90	62.6 Å²	62.6	34%	0.341	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	130	175.7	-74.3	85.4	0	0	0	111.4	Y950 Q957 S972 K974 W992 F993 P994	Y950-W976 VanDerWaalsContact OH-CH2 3.32Å; Y950-W976 WeakPolarHBondContact OH-CH2 2.94Å; Y950-W976 WeakPolarHBondContact OH-CZ3 3.24Å; Q957-W976 HydrophobicContact CG-CZ3 4.11Å; Q957-W976 VanDerWaalsContact NE2-CH2 3.31Å; S972-W976 WeakPolarHBondContact CA-O 3.42Å; S972-W976 WeakPolarHBondContact CB-O 3.38Å; S972-W976 PolarHBondContact N-O 3.48Å; K974-W976 VanDerWaalsContact O-CD1 3.26Å; K974-W976 PolarHBondContact O-N 3.01Å; K974-W976 VanDerWaalsContact O-N 3.1Å; W976-W992 HydrophobicContact CB-CE3 3.96Å; W976-W992 HydrophobicContact CB-CZ3 4.41Å; W976-W992 HydrophobicContact CE3-CB 4Å; W976-W992 HydrophobicContact CZ3-CB 4.47Å; W976-W992 WeakPolarHBondContact O-CZ3 3.39Å; W976-F993 VanDerWaalsContact CE3-C 3.49Å; W976-P994 HydrophobicContact CE3-CG 4.36Å; W976-P994 HydrophobicContact CH2-CG 4.05Å; W976-P994 HydrophobicContact CZ2-CG 4.3Å; W976-P994 HydrophobicContact CZ3-CG 4.07Å
977	W	92.6	Very high	79.5	Confident	42 Å²	42	70 Å²	70	16%	0.159	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	136.2	177	-63.2	-2.5	0	0	0	109.9	A944 L968 K970 R971 W992 F993 A995 V998 L1000	A944-W977 HydrophobicContact CB-CZ3 4.42Å; L968-W977 HydrophobicContact CD1-CD2 4.36Å; L968-W977 HydrophobicContact CD1-CE3 3.61Å; L968-W977 HydrophobicContact CD1-CZ3 3.73Å; L968-W977 HydrophobicContact CD2-CE3 3.69Å; L968-W977 HydrophobicContact CD2-CZ3 4.37Å; L968-W977 HydrophobicContact CG-CE3 4.33Å; K970-W977 CarbonylContact O-C 3.48Å; K970-W977 WeakPolarHBondContact O-CA 3.42Å; R971-W977 HydrophobicContact CG-CD2 4.31Å; R971-W977 HydrophobicContact CG-CG 4.07Å; W977-W992 VanDerWaalsContact C-CE3 3.5Å; W977-W992 CarbonylContact O-C 3.6Å; W977-W992 WeakPolarHBondContact O-CA 3.27Å; W977-F993 HydrophobicContact CB-CD2 4.46Å; W977-F993 HydrophobicContact CB-CE2 3.83Å; W977-F993 HydrophobicContact CB-CZ 3.97Å; W977-F993 HydrophobicContact CE3-CE2 4.3Å; W977-F993 PolarHBondContact N-O 3.49Å; W977-F993 WeakPolarHBondContact O-CD1 3.36Å; W977-F993 WeakPolarHBondContact O-CE1 3.21Å; W977-F993 PolarHBondContact O-N 3.32Å; W977-A995 HydrophobicContact CD2-CB 3.85Å; W977-A995 VanDerWaalsContact CE2-CB 3.48Å; W977-A995 HydrophobicContact CE3-CB 4.42Å; W977-A995 HydrophobicContact CG-CB 4.21Å; W977-A995 HydrophobicContact CH2-CB 4.37Å; W977-A995 HydrophobicContact CZ2-CB 3.78Å; W977-V998 HydrophobicContact CE3-CG2 3.58Å; W977-V998 HydrophobicContact CZ3-CG2 3.48Å; W977-V998 VanDerWaalsContact CZ3-CG2 3.48Å; W977-L1000 HydrophobicContact CZ3-CD1 4.39Å
978	E	91.7	Very high	78.6	Confident	18 Å²	18	76 Å²	76	8%	0.084	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	136.5	167.3	-171.6	-171	-92.2	0	0	108.4	R969 K970 I990 G991 W992	R969-E978 HydrophobicContact CB-CB 4.47Å; R969-E978 HydrophobicContact CB-CG 4.38Å; R969-E978 WeakPolarHBondContact CB-OE2 3.47Å; R969-E978 PolarHBondContact N-O 2.96Å; K970-E978 HydrophobicContact CB-CB 3.75Å; K970-E978 HydrophobicContact CD-CB 4.08Å; K970-E978 VanDerWaalsContact CD-CD 3.47Å; K970-E978 HydrophobicContact CD-CG 4.42Å; K970-E978 WeakPolarHBondContact CD-OE1 3.25Å; K970-E978 WeakPolarHBondContact CD-OE2 3.42Å; K970-E978 VanDerWaalsContact CE-CD 3.49Å; K970-E978 VanDerWaalsContact CE-OE1 3.28Å; K970-E978 WeakPolarHBondContact CE-OE1 3.31Å; K970-E978 WeakPolarHBondContact CE-OE2 3.18Å; K970-E978 HydrophobicContact CG-CB 4.1Å; K970-E978 PolarHBondContact N-O 2.94Å; K970-E978 IonicContact NZ-OE1 2.81Å; K970-E978 PolarHBondContact NZ-OE1 2.83Å; K970-E978 IonicContact NZ-OE2 2.81Å; K970-E978 PolarHBondContact NZ-OE2 2.65Å; K970-E978 PolarHBondContact O-N 2.82Å; E978-I990 HydrophobicContact CG-CG2 4.16Å; E978-G991 WeakPolarHBondContact CA-O 3.43Å; E978-W992 HydrophobicContact CB-CD2 3.85Å; E978-W992 HydrophobicContact CB-CE3 3.95Å; E978-W992 HydrophobicContact CB-CG 4.43Å; E978-W992 HydrophobicContact CB-CH2 4.21Å; E978-W992 HydrophobicContact CB-CZ2 4.09Å; E978-W992 HydrophobicContact CB-CZ3 4.12Å; E978-W992 HydrophobicContact CG-CD2 4.5Å
979	G	89.7	Confident	78.2	Confident	0 Å²	0	80.4 Å²	80.4	0%	0	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.6	172.4	174.7	0	0	0	0	0	114	Q967 I990 G991	Q967-G979 CarbonylContact O-C 3.45Å; Q967-G979 WeakPolarHBondContact O-CA 3.34Å; G979-I990 WeakPolarHBondContact O-CA 3.44Å; G979-G991 PolarHBondContact N-O 2.94Å; G979-G991 PolarHBondContact O-N 3.44Å; G979-G991 VanDerWaalsContact O-N 3.12Å
980	E	90.6	Very high	78.3	Confident	5 Å²	5	80.6 Å²	80.6	2%	0.023	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	122.3	-176.4	-176.3	173	158	0	0	110.1	V966 Q967 R969 Q982 R988 Q989 I990	V966-E980 WeakPolarHBondContact CA-O 3.46Å; Q967-E980 HydrophobicContact CB-CB 4.46Å; Q967-E980 PolarHBondContact N-O 3.02Å; Q967-E980 PolarHBondContact O-N 3.24Å; R969-E980 IonicContact CZ-OE2 3.19Å; R969-E980 VanDerWaalsContact CZ-OE2 3.25Å; R969-E980 IonicContact NE-OE2 2.82Å; R969-E980 PolarHBondContact NE-OE2 2.95Å; R969-E980 IonicContact NH2-OE2 2.71Å; R969-E980 PolarHBondContact NH2-OE2 3.49Å; E980-Q982 PolarHBondContact O-N 3.23Å; E980-R988 HydrophobicContact CG-CB 4.34Å; E980-R988 VanDerWaalsContact OE1-CD 3.26Å; E980-R988 WeakPolarHBondContact OE1-CD 3.26Å; E980-R988 IonicContact OE1-CZ 2.63Å; E980-R988 IonicContact OE1-NE 3.25Å; E980-R988 IonicContact OE1-NH1 2.67Å; E980-R988 PolarHBondContact OE1-NH1 3.46Å; E980-Q989 WeakPolarHBondContact CA-O 3.39Å; E980-I990 HydrophobicContact CB-CG1 3.95Å; E980-I990 HydrophobicContact CG-CD1 4.39Å; E980-I990 HydrophobicContact CG-CG1 3.8Å
981	L	88.7	Confident	78.5	Confident	8 Å²	8	78.3 Å²	78.3	4%	0.042	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	117.1	-175.3	178.9	60.1	0	0	0	111.5	L958 Q964 V966 Q983 Q989	L958-L981 HydrophobicContact CD1-CB 4.13Å; L958-L981 HydrophobicContact CD2-CB 4.23Å; Q964-L981 HydrophobicContact CB-CD1 3.84Å; Q964-L981 VanDerWaalsContact CD-CD1 3.49Å; Q964-L981 HydrophobicContact CG-CD1 3.96Å; V966-L981 HydrophobicContact CG2-CD1 4.32Å; L981-Q983 HydrophobicContact CD1-CG 4.19Å; L981-Q983 HydrophobicContact CD2-CG 4.32Å; L981-Q983 HydrophobicContact CG-CG 4.04Å; L981-Q983 PolarHBondContact O-N 2.92Å; L981-Q989 HydrophobicContact CB-CB 4.3Å; L981-Q989 PolarHBondContact N-O 3.5Å
982	Q	78.3	Confident	78.7	Confident	78 Å²	78	79 Å²	79	36%	0.364	39%	0.388	S	S	.	.			trans	-90.2	79.2	-179.5	-68.5	-69.3	-10.2	0	0	110.8	F943 V965 Q967 E980	F943-Q982 HydrophobicContact CE1-CG 4.3Å; V965-Q982 HydrophobicContact CB-CB 4.25Å; V965-Q982 HydrophobicContact CG1-CB 4.3Å; V965-Q982 WeakPolarHBondContact O-CB 3.37Å; V965-Q982 PolarHBondContact O-N 2.89Å; Q967-Q982 HydrophobicContact CB-CG 4.21Å; E980-Q982 PolarHBondContact O-N 3.23Å
983	Q	67.6	Low	79.3	Confident	79 Å²	79	77.6 Å²	77.6	37%	0.369	38%	0.378	S	S	.	.			trans	-113.4	128.1	170	-76.6	-172.9	-40.4	0	0	111.4	L981 G985 H986	L981-Q983 HydrophobicContact CD1-CG 4.19Å; L981-Q983 HydrophobicContact CD2-CG 4.32Å; L981-Q983 HydrophobicContact CG-CG 4.04Å; L981-Q983 PolarHBondContact O-N 2.92Å; Q983-G985 PolarHBondContact O-N 2.99Å; Q983-H986 HydrophobicContact CB-CB 4.31Å
984	R	59.1	Low	80.5	Confident	258 Å²	258	73.1 Å²	73.1	97%	0.974	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.4	125.7	170.5	-82.2	-171.8	171.4	-159.2	-1.2	109.8
985	G	55.8	Low	81.1	Confident	78 Å²	78	67.1 Å²	67.1	80%	0.804	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	83.1	13.6	172	0	0	0	0	0	115.7	Q983	Q983-G985 PolarHBondContact O-N 2.99Å
986	H	62	Low	81.5	Confident	136 Å²	136	71.9 Å²	71.9	63%	0.63	34%	0.344	S	S	*	.	S	Bend	trans	-123.5	160.6	169.8	-82.6	17.3	0	0	0	111	Q983	Q983-H986 HydrophobicContact CB-CB 4.31Å
987	I	57.9	Low	81.6	Confident	155 Å²	155	70.4 Å²	70.4	80%	0.795	34%	0.34	S	S	*	.			trans	-63.4	139.7	177.6	-61.5	173.1	0	0	0	109.1	Q989	I987-Q989 PolarHBondContact O-N 3.5Å
988	R	69.8	Low	81.5	Confident	170 Å²	170	68.9 Å²	68.9	64%	0.642	34%	0.335	S	S	*	.			trans	-62.9	92	176.5	-68.3	168.4	-179.2	-106.1	5.3	110.3	E980	E980-R988 HydrophobicContact CG-CB 4.34Å; E980-R988 VanDerWaalsContact OE1-CD 3.26Å; E980-R988 WeakPolarHBondContact OE1-CD 3.26Å; E980-R988 IonicContact OE1-CZ 2.63Å; E980-R988 IonicContact OE1-NE 3.25Å; E980-R988 IonicContact OE1-NH1 2.67Å; E980-R988 PolarHBondContact OE1-NH1 3.46Å
989	Q	82.6	Confident	81.5	Confident	98 Å²	98	75.8 Å²	75.8	46%	0.458	36%	0.36	S	S	.	.			trans	-76.6	128.3	172.6	-65.3	-177.7	-2.8	0	0	109.1	L958 E980 L981 I987	L958-Q989 HydrophobicContact CD1-CB 3.46Å; L958-Q989 VanDerWaalsContact CD1-CB 3.46Å; E980-Q989 WeakPolarHBondContact CA-O 3.39Å; L981-Q989 HydrophobicContact CB-CB 4.3Å; L981-Q989 PolarHBondContact N-O 3.5Å; I987-Q989 PolarHBondContact O-N 3.5Å
990	I	87.3	Confident	81.3	Confident	62 Å²	62	78.5 Å²	78.5	32%	0.318	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	135.3	176.8	-61.6	166.6	0	0	0	107.4	V27 E978 G979 E980	V27-I990 HydrophobicContact CG1-CD1 3.8Å; E978-I990 HydrophobicContact CG-CG2 4.16Å; G979-I990 WeakPolarHBondContact O-CA 3.44Å; E980-I990 HydrophobicContact CB-CG1 3.95Å; E980-I990 HydrophobicContact CG-CD1 4.39Å; E980-I990 HydrophobicContact CG-CG1 3.8Å
991	G	90.5	Very high	80.9	Confident	3 Å²	3	81.8 Å²	81.8	3%	0.031	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-178.6	175.6	175.8	0	0	0	0	0	113.1	G956 E978 G979	G956-G991 CarbonylContact O-C 3.59Å; G956-G991 WeakPolarHBondContact O-CA 3.43Å; E978-G991 WeakPolarHBondContact CA-O 3.43Å; G979-G991 PolarHBondContact N-O 2.94Å; G979-G991 PolarHBondContact O-N 3.44Å; G979-G991 VanDerWaalsContact O-N 3.12Å
992	W	92.3	Very high	79.8	Confident	68 Å²	68	85.9 Å²	85.9	26%	0.258	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	144.7	177	-64.6	88.2	0	0	0	112.1	G956 Q957 L958 K970 W976 W977 E978	G956-W992 PolarHBondContact O-N 2.85Å; Q957-W992 CarbonylContact C-O 3.59Å; Q957-W992 WeakPolarHBondContact CA-O 3.46Å; Q957-W992 WeakPolarHBondContact CB-O 3.4Å; L958-W992 PolarHBondContact N-O 2.92Å; K970-W992 HydrophobicContact CB-CH2 3.84Å; K970-W992 HydrophobicContact CB-CZ2 4.44Å; K970-W992 HydrophobicContact CB-CZ3 4.32Å; K970-W992 HydrophobicContact CD-CH2 3.95Å; K970-W992 HydrophobicContact CD-CZ2 3.75Å; W976-W992 HydrophobicContact CB-CE3 3.96Å; W976-W992 HydrophobicContact CB-CZ3 4.41Å; W976-W992 HydrophobicContact CE3-CB 4Å; W976-W992 HydrophobicContact CZ3-CB 4.47Å; W976-W992 WeakPolarHBondContact O-CZ3 3.39Å; W977-W992 VanDerWaalsContact C-CE3 3.5Å; W977-W992 CarbonylContact O-C 3.6Å; W977-W992 WeakPolarHBondContact O-CA 3.27Å; E978-W992 HydrophobicContact CB-CD2 3.85Å; E978-W992 HydrophobicContact CB-CE3 3.95Å; E978-W992 HydrophobicContact CB-CG 4.43Å; E978-W992 HydrophobicContact CB-CH2 4.21Å; E978-W992 HydrophobicContact CB-CZ2 4.09Å; E978-W992 HydrophobicContact CB-CZ3 4.12Å; E978-W992 HydrophobicContact CG-CD2 4.5Å
993	F	93.3	Very high	78.2	Confident	0 Å²	0	88.1 Å²	88.1	0%	0	44%	0.438	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148	156.1	173	52.2	-89	0	0	0	109.4	Y950 L958 L960 V966 L968 W976 W977 V998	Y950-F993 HydrophobicContact CD1-CB 3.86Å; Y950-F993 HydrophobicContact CE1-CB 4.01Å; L958-F993 HydrophobicContact CB-CD1 4.06Å; L958-F993 HydrophobicContact CD2-CD1 4.05Å; L958-F993 HydrophobicContact CD2-CE1 4.13Å; L960-F993 HydrophobicContact CD1-CB 3.74Å; L960-F993 HydrophobicContact CD1-CD1 4.49Å; L960-F993 HydrophobicContact CD1-CD2 3.84Å; L960-F993 HydrophobicContact CD1-CG 3.76Å; L960-F993 HydrophobicContact CD2-CD1 4.34Å; L960-F993 HydrophobicContact CD2-CG 4.39Å; L960-F993 HydrophobicContact CG-CB 4.24Å; L960-F993 HydrophobicContact CG-CG 4.4Å; V966-F993 HydrophobicContact CB-CZ 4.43Å; V966-F993 HydrophobicContact CG1-CE1 3.68Å; V966-F993 HydrophobicContact CG1-CZ 3.84Å; L968-F993 HydrophobicContact CD2-CE2 4.39Å; L968-F993 HydrophobicContact CD2-CZ 3.76Å; W976-F993 VanDerWaalsContact CE3-C 3.49Å; W977-F993 HydrophobicContact CB-CD2 4.46Å; W977-F993 HydrophobicContact CB-CE2 3.83Å; W977-F993 HydrophobicContact CB-CZ 3.97Å; W977-F993 HydrophobicContact CE3-CE2 4.3Å; W977-F993 PolarHBondContact N-O 3.49Å; W977-F993 WeakPolarHBondContact O-CD1 3.36Å; W977-F993 WeakPolarHBondContact O-CE1 3.21Å; W977-F993 PolarHBondContact O-N 3.32Å; F993-V998 HydrophobicContact CD2-CG1 3.91Å; F993-V998 HydrophobicContact CD2-CG2 4.44Å; F993-V998 HydrophobicContact CE2-CB 4.34Å; F993-V998 HydrophobicContact CE2-CG1 3.59Å; F993-V998 HydrophobicContact CE2-CG2 3.73Å; F993-V998 HydrophobicContact CZ-CG1 4.39Å
994	P	91.8	Very high	76.8	Confident	18 Å²	18	90 Å²	90	12%	0.117	45%	0.45	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	139.7	175.8	-8.9	25.1	0	0	0	110.3	Y950 W976 D996 F997	Y950-P994 HydrophobicContact CD2-CG 4.28Å; Y950-P994 HydrophobicContact CE2-CG 3.93Å; W976-P994 HydrophobicContact CE3-CG 4.36Å; W976-P994 HydrophobicContact CH2-CG 4.05Å; W976-P994 HydrophobicContact CZ2-CG 4.3Å; W976-P994 HydrophobicContact CZ3-CG 4.07Å; P994-D996 PolarHBondContact O-N 2.65Å; P994-D996 VanDerWaalsContact O-N 3.17Å; P994-F997 HydrophobicContact CB-CD2 3.79Å; P994-F997 HydrophobicContact CB-CE2 3.99Å; P994-F997 HydrophobicContact CG-CD2 3.82Å; P994-F997 HydrophobicContact CG-CE2 3.8Å; P994-F997 PolarHBondContact O-N 2.68Å
995	A	89.6	Confident	75.2	Confident	14 Å²	14	83.9 Å²	83.9	12%	0.116	44%	0.442	C	S	.	.	G	3₁₀ helix	trans	-55.8	-35.1	-175.1	0	0	0	0	0	112.7	G975 W977 F997 V998	G975-A995 VanDerWaalsContact O-CB 3.27Å; G975-A995 WeakPolarHBondContact O-CB 3.13Å; G975-A995 PolarHBondContact O-N 3.23Å; W977-A995 HydrophobicContact CD2-CB 3.85Å; W977-A995 VanDerWaalsContact CE2-CB 3.48Å; W977-A995 HydrophobicContact CE3-CB 4.42Å; W977-A995 HydrophobicContact CG-CB 4.21Å; W977-A995 HydrophobicContact CH2-CB 4.37Å; W977-A995 HydrophobicContact CZ2-CB 3.78Å; A995-F997 PolarHBondContact O-N 2.79Å; A995-F997 VanDerWaalsContact O-N 3.09Å; A995-V998 WeakPolarHBondContact O-CG2 3.19Å; A995-V998 PolarHBondContact O-N 2.68Å; A995-V998 VanDerWaalsContact O-O 3.05Å
996	D	91.2	Very high	74.1	Confident	130 Å²	130	86.7 Å²	86.7	70%	0.695	44%	0.443	S	S	*	.	G	3₁₀ helix	trans	-65	-15.4	-175	-45.3	-57	0	0	0	113.8	P994 V998	P994-D996 PolarHBondContact O-N 2.65Å; P994-D996 VanDerWaalsContact O-N 3.17Å; D996-V998 VanDerWaalsContact C-N 3.34Å
997	F	91.7	Very high	73	Confident	59 Å²	59	87.7 Å²	87.7	26%	0.259	45%	0.453	S	S	.	.	G	3₁₀ helix	trans	-86	-5.2	176.2	-67.1	-98.3	0	0	0	113	V946 I947 A948 P949 Y950 L960 P994 A995	V946-F997 WeakPolarHBondContact CA-O 3.1Å; I947-F997 WeakPolarHBondContact CG1-O 3.45Å; I947-F997 PolarHBondContact N-O 2.98Å; A948-F997 HydrophobicContact CB-CD1 3.65Å; A948-F997 HydrophobicContact CB-CE1 4.24Å; A948-F997 HydrophobicContact CB-CG 4.43Å; A948-F997 PolarHBondContact N-O 3.46Å; P949-F997 WeakPolarHBondContact O-CD1 3.48Å; P949-F997 VanDerWaalsContact O-CE1 3.31Å; P949-F997 WeakPolarHBondContact O-CE1 3.29Å; Y950-F997 HydrophobicContact CD2-CD1 4.39Å; Y950-F997 HydrophobicContact CD2-CD2 4.36Å; Y950-F997 HydrophobicContact CD2-CE1 4.19Å; Y950-F997 HydrophobicContact CD2-CE2 4.17Å; Y950-F997 HydrophobicContact CD2-CG 4.47Å; Y950-F997 HydrophobicContact CD2-CZ 4.08Å; Y950-F997 HydrophobicContact CG-CD1 4.39Å; Y950-F997 HydrophobicContact CG-CG 4.4Å; L960-F997 HydrophobicContact CD1-CB 3.95Å; P994-F997 HydrophobicContact CB-CD2 3.79Å; P994-F997 HydrophobicContact CB-CE2 3.99Å; P994-F997 HydrophobicContact CG-CD2 3.82Å; P994-F997 HydrophobicContact CG-CE2 3.8Å; P994-F997 PolarHBondContact O-N 2.68Å; A995-F997 PolarHBondContact O-N 2.79Å; A995-F997 VanDerWaalsContact O-N 3.09Å
998	V	91.2	Very high	71.5	Confident	9 Å²	9	83.2 Å²	83.2	6%	0.055	45%	0.445	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	155.9	178	-54.1	0	0	0	0	112.5	A944 R945 V946 L960 W977 F993 A995 D996	A944-V998 HydrophobicContact CB-CB 3.8Å; A944-V998 HydrophobicContact CB-CG2 3.68Å; R945-V998 CarbonylContact O-C 3.59Å; R945-V998 WeakPolarHBondContact O-CA 3.43Å; V946-V998 HydrophobicContact CG2-CG1 4.18Å; L960-V998 HydrophobicContact CD1-CG1 3.84Å; W977-V998 HydrophobicContact CE3-CG2 3.58Å; W977-V998 HydrophobicContact CZ3-CG2 3.48Å; W977-V998 VanDerWaalsContact CZ3-CG2 3.48Å; F993-V998 HydrophobicContact CD2-CG1 3.91Å; F993-V998 HydrophobicContact CD2-CG2 4.44Å; F993-V998 HydrophobicContact CE2-CB 4.34Å; F993-V998 HydrophobicContact CE2-CG1 3.59Å; F993-V998 HydrophobicContact CE2-CG2 3.73Å; F993-V998 HydrophobicContact CZ-CG1 4.39Å; A995-V998 WeakPolarHBondContact O-CG2 3.19Å; A995-V998 PolarHBondContact O-N 2.68Å; A995-V998 VanDerWaalsContact O-O 3.05Å; D996-V998 VanDerWaalsContact C-N 3.34Å
999	R	90.9	Very high	69.4	Low	164 Å²	164	80.2 Å²	80.2	62%	0.619	45%	0.45	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-122.7	129.5	171.7	-169.3	176	-168.8	-95.5	9.3	109.4	A944 R945 I947	A944-R999 CarbonylContact C-O 3.51Å; A944-R999 WeakPolarHBondContact CA-O 3.49Å; R945-R999 PolarHBondContact N-O 2.9Å; R945-R999 PolarHBondContact O-N 3.36Å; I947-R999 HydrophobicContact CD1-CB 4.42Å; I947-R999 HydrophobicContact CG2-CB 3.63Å
1000	L	85.3	Confident	66.9	Low	57 Å²	57	80.5 Å²	80.5	30%	0.298	46%	0.463	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.1	138.6	-176.6	-155.2	66.4	0	0	0	111.8	E942 A944 L968 W977 T1002	E942-L1000 HydrophobicContact CG-CD1 4Å; E942-L1000 WeakPolarHBondContact OE1-CD2 3.42Å; A944-L1000 HydrophobicContact CB-CD1 4.41Å; L968-L1000 HydrophobicContact CD1-CD1 3.65Å; W977-L1000 HydrophobicContact CZ3-CD1 4.39Å; L1000-T1002 PolarHBondContact O-N 3.27Å
1001	I	82.4	Confident	64.4	Low	73 Å²	73	85.3 Å²	85.3	37%	0.374	49%	0.489	S	S	.	.			trans	-91.8	78.2	175	-52.2	-179.1	0	0	0	107.9	F943 R945 V965	F943-I1001 HydrophobicContact CB-CB 4.21Å; F943-I1001 HydrophobicContact CB-CD1 4.02Å; F943-I1001 HydrophobicContact CB-CG1 4.37Å; F943-I1001 WeakPolarHBondContact O-CB 3.36Å; F943-I1001 PolarHBondContact O-N 3.44Å; R945-I1001 HydrophobicContact CB-CD1 3.98Å; R945-I1001 HydrophobicContact CB-CG1 3.96Å; V965-I1001 HydrophobicContact CG1-CD1 3.91Å; V965-I1001 HydrophobicContact CG2-CD1 4.07Å
1002	T	64.9	Low	61.7	Low	95 Å²	95	90.3 Å²	90.3	58%	0.583	52%	0.524	S	S	*	.			trans	-68.1	129.4	172.2	-36.4	0	0	0	0	109.7	L1000	L1000-T1002 PolarHBondContact O-N 3.27Å
1003	P	45.3	Very low	59.1	Low	124 Å²	124	91.5 Å²	91.5	81%	0.805	54%	0.542	S	S	*	.			trans	-66.1	148.4	169.5	28.2	-33.7	0	0	0	110.7
1004	L	38.1	Very low	56.4	Low	120 Å²	120	97.6 Å²	97.6	63%	0.628	58%	0.575	S	S	*	*			trans	-120.5	138.8	-164.3	-81.7	168.7	0	0	0	114.6
1005	T	25.8	Very low	53.6	Low	129 Å²	129	103.2 Å²	103.2	79%	0.791	60%	0.599	S	S	*	*	S	Bend	trans	-144.9	133.6	150.3	50.9	0	0	0	0	108.4
1006	V	33	Very low	51.6	Low	137 Å²	137	110.5 Å²	110.5	83%	0.83	63%	0.628	S	S	*	*	S	Bend	trans	56.3	153.3	-167.1	-68	0	0	0	0	115.7
1007	N	38.4	Very low	49.3	Very low	157 Å²	157	111.1 Å²	111.1	84%	0.84	63%	0.631	S	S	*	*	S	Bend	trans	58	139.9	-142.6	-92.8	-24.1	0	0	0	114.1
1008	G	25.6	Very low	46.8	Very low	60 Å²	60	115.5 Å²	115.5	62%	0.619	66%	0.656	S	S	*	*			trans	-78.8	165	-178.4	0	0	0	0	0	113.5
1009	S	27.4	Very low	44.2	Very low	107 Å²	107	118.2 Å²	118.2	75%	0.748	68%	0.676	S	S	*	*			cis	-150.2	164.7	9.1	-68.2	0	0	0	0	112
1010	S	29.3	Very low	41.7	Very low	105 Å²	105	119.5 Å²	119.5	73%	0.734	69%	0.686	S	S	*	*			trans	74.4	108.3	174.3	69	0	0	0	0	118.9
1011	N	34.6	Very low	39.3	Very low	162 Å²	162	122 Å²	122	87%	0.866	70%	0.699	S	S	*	*				39.9	124.5	126.7	-47.3	-9.1	0	0	0	119.5
1012	S	33.5	Very low	37	Very low	109 Å²	109	122.9 Å²	122.9	76%	0.762	70%	0.704	S	S	*	*			cis	-159.7	165.8	-0.6	66	0	0	0	0	114.2
1013	S	37.5	Very low	35.9	Very low	92 Å²	92	122.8 Å²	122.8	64%	0.643	71%	0.706	S	S	*	*			trans	66.3	101.2	150.5	52.9	0	0	0	0	121.5
1014	D	37	Very low	35.2	Very low	128 Å²	128	119 Å²	119	68%	0.684	68%	0.682	S	S	*	*				82.7	108.6	119	-73.4	-67.9	0	0	0	124.1
1015	Q	33.3	Very low	34.9	Very low	136 Å²	136	117.5 Å²	117.5	64%	0.636	68%	0.678	S	S	*	*				80.3	151.8	119.8	-81.8	-179.3	58.7	0	0	123.3
1016	K	48.3	Very low	35.4	Very low	167 Å²	167	114.4 Å²	114.4	73%	0.726	66%	0.657	S	S	*	*			trans	86.7	134.1	141	-94.1	167.4	-174.4	160	0	119.7
1017	L	41.1	Very low	35.6	Very low	144 Å²	144	112.7 Å²	112.7	75%	0.754	64%	0.643	S	S	*	*			trans	64.9	100.5	161.8	-58.7	167.2	0	0	0	113.7
1018	L	39.6	Very low	35.4	Very low	150 Å²	150	112.7 Å²	112.7	79%	0.785	64%	0.638	S	S	*	*				52.3	134.6	74.7	-72.5	160.7	0	0	0	113
1019	S	36.9	Very low	36.1	Very low	66 Å²	66	116.6 Å²	116.6	46%	0.462	64%	0.643	S	S	.	*			trans	-1.4	123.3	150.8	61.8	0	0	0	0	116.2
1020	K	39	Very low	36.5	Very low	191 Å²	191	117.5 Å²	117.5	83%	0.83	64%	0.635	S	S	*	*				-166.4	142.3	98.1	-95.8	144.9	-174.7	-179.3	0	111.7
1021	L	34.6	Very low	36.7	Very low	111 Å²	111	116 Å²	116	58%	0.581	62%	0.619	S	S	*	*			cis	-166.9	150.2	-22.8	-123.4	-169.8	0	0	0	106.4
1022	I	34.7	Very low	36.5	Very low	91 Å²	91	110.3 Å²	110.3	47%	0.467	59%	0.59	S	S	.	*			trans	51.1	128.4	157.6	-34.6	172.1	0	0	0	117.4
1023	S	39.9	Very low	36.6	Very low	92 Å²	92	110.4 Å²	110.4	64%	0.643	59%	0.588	S	S	*	*			trans	-61.3	-147.7	150.4	-31.5	0	0	0	0	110.3	L922	L922-S1023 VanDerWaalsContact CD2-O 3.26Å; L922-S1023 WeakPolarHBondContact CD2-O 3.1Å
1024	P	31.1	Very low	36.2	Very low	44 Å²	44	107 Å²	107	29%	0.286	56%	0.564	S	S	.	*			cis	-118.4	-155.4	-39.6	29.6	-8	0	0	0	108.5
1025	T	32.9	Very low	35.8	Very low	89 Å²	89	103.1 Å²	103.1	55%	0.546	55%	0.546	S	S	.	.			trans	60.7	163.9	153.3	46	0	0	0	0	116.4	L921	L921-T1025 WeakPolarHBondContact O-CB 3.09Å; L921-T1025 PolarHBondContact O-OG1 2.88Å
1026	N	35.7	Very low	35.7	Very low	65 Å²	65	100.2 Å²	100.2	35%	0.348	54%	0.535	S	S	.	.			cis	-135.7	169	-0.6	-129.8	-8.3	0	0	0	106.8
1027	N	36.4	Very low	35.1	Very low	101 Å²	101	95 Å²	95	54%	0.54	51%	0.512	S	S	.	.	S	Bend	cis	-174.1	158.6	41	-125.5	-21.3	0	0	0	106
1028	Q	35.7	Very low	35	Very low	157 Å²	157	90.8 Å²	90.8	73%	0.734	50%	0.498	S	S	*	.	S	Bend	cis	-138.8	160.3	3.8	-46.6	171.2	-8.3	0	0	105.6
1029	I	38.7	Very low	34.9	Very low	142 Å²	142	87.6 Å²	87.6	73%	0.728	48%	0.482	S	S	*	.	S	Bend	cis	-131.6	139.4	9.7	-77.3	-179	0	0	0	106
1030	E	36.1	Very low	35.2	Very low	125 Å²	125	88.5 Å²	88.5	58%	0.584	49%	0.493	S	S	*	.			cis	-159.2	175.6	-6.4	-114.9	-172	144.1	0	0	109.9
1031	N	34.5	Very low	35.3	Very low	74 Å²	74	81 Å²	81	40%	0.396	47%	0.465	S	S	.	.			trans	28.5	117.9	137.9	-43	-18.8	0	0	0	117.3	L921	L921-N1031 HydrophobicContact CD1-CB 4.01Å; L921-N1031 WeakPolarHBondContact CD1-OD1 3.41Å
1032	T	29.6	Very low	35.3	Very low	43 Å²	43	84.4 Å²	84.4	26%	0.264	48%	0.475	S	S	.	.				28	126.2	87.9	74.7	0	0	0	0	114.6	L921 T1034	L921-T1032 HydrophobicContact CB-CG2 4.09Å; L921-T1032 HydrophobicContact CD1-CG2 4.05Å; L921-T1032 WeakPolarHBondContact CD1-OG1 3.35Å; L921-T1032 HydrophobicContact CD2-CG2 4.06Å; L921-T1032 HydrophobicContact CG-CG2 4.28Å; T1032-T1034 WeakPolarHBondContact CB-OG1 3.49Å; T1032-T1034 WeakPolarHBondContact CG2-OG1 3.47Å
1033	P	36.1	Very low	35.3	Very low	110 Å²	110	84 Å²	84	71%	0.714	49%	0.485	S	S	*	.			cis	-80.2	144.2	15.1	-13.5	32.3	0	0	0	111.3
1034	T	29.4	Very low	34.9	Very low	22 Å²	22	86.7 Å²	86.7	14%	0.135	49%	0.491	C	S	.	.			cis	54.7	179.9	33.9	-26.2	0	0	0	0	110.8	Q383 S923 T1032	Q383-T1034 HydrophobicContact CB-CG2 3.88Å; S923-T1034 PolarHBondContact O-OG1 3.38Å; T1032-T1034 WeakPolarHBondContact CB-OG1 3.49Å; T1032-T1034 WeakPolarHBondContact CG2-OG1 3.47Å
1035	S	28.9	Very low	34.7	Very low	45 Å²	45	90 Å²	90	32%	0.315	51%	0.51	S	S	.	.			trans	58.8	110	151	-48	0	0	0	0	119.9	Q383	Q383-S1035 WeakPolarHBondContact CB-OG 3.43Å; Q383-S1035 WeakPolarHBondContact CG-OG 3.36Å; Q383-S1035 PolarHBondContact NE2-OG 3.49Å; Q383-S1035 PolarHBondContact OE1-OG 2.96Å; Q383-S1035 VanDerWaalsContact OE1-OG 3.1Å
1036	L	31.3	Very low	34.6	Very low	76 Å²	76	91.3 Å²	91.3	40%	0.398	52%	0.518	S	S	.	.			cis	-161	158.9	8.4	-115.6	-163.2	0	0	0	111.4	Q383 A1038	Q383-L1036 VanDerWaalsContact CA-CD2 3.49Å; Q383-L1036 HydrophobicContact CB-CD2 4.25Å; Q383-L1036 HydrophobicContact CG-CD1 4.5Å; Q383-L1036 HydrophobicContact CG-CD2 4.44Å; Q383-L1036 HydrophobicContact CG-CG 4.36Å; Q383-L1036 WeakPolarHBondContact O-CD2 3.41Å; L1036-A1038 PolarHBondContact O-N 3.1Å; L1036-A1038 VanDerWaalsContact O-N 3.14Å
1037	K	35.8	Very low	34.3	Very low	56 Å²	56	92.1 Å²	92.1	24%	0.243	53%	0.529	C	S	.	.				32.5	78.1	105.5	-175.6	-169.3	-32	-162.1	0	109.5	E382 A386 L1039	E382-K1037 PolarHBondContact O-NZ 3.27Å; E382-K1037 IonicContact OE1-NZ 2.7Å; E382-K1037 PolarHBondContact OE1-NZ 3.45Å; A386-K1037 HydrophobicContact CB-CB 3.59Å; A386-K1037 HydrophobicContact CB-CD 3.94Å; A386-K1037 HydrophobicContact CB-CG 3.5Å; A386-K1037 WeakPolarHBondContact O-CA 3.29Å; A386-K1037 PolarHBondContact O-N 3.21Å; K1037-L1039 HydrophobicContact CD-CD2 4.36Å; K1037-L1039 HydrophobicContact CG-CB 3.94Å; K1037-L1039 HydrophobicContact CG-CD2 4.11Å
1038	A	38.9	Very low	33.9	Very low	56 Å²	56	94.6 Å²	94.6	46%	0.463	54%	0.542	S	S	.	.			cis	53.8	-156.7	42.2	0	0	0	0	0	110.8	S390 L1036	S390-A1038 VanDerWaalsContact OG-CB 3.27Å; S390-A1038 WeakPolarHBondContact OG-CB 3.36Å; L1036-A1038 PolarHBondContact O-N 3.1Å; L1036-A1038 VanDerWaalsContact O-N 3.14Å
1039	L	37.7	Very low	33.6	Very low	84 Å²	84	90.8 Å²	90.8	44%	0.44	53%	0.533	S	S	.	.			trans	74.6	73.7	167.8	-172.5	76.7	0	0	0	114.3	A386 A389 E393 K1037	A386-L1039 HydrophobicContact CB-CB 4.28Å; A386-L1039 HydrophobicContact CB-CD1 4.45Å; A386-L1039 HydrophobicContact CB-CD2 4.08Å; A389-L1039 HydrophobicContact CB-CB 4.46Å; A389-L1039 HydrophobicContact CB-CD1 3.4Å; A389-L1039 VanDerWaalsContact CB-CD1 3.4Å; A389-L1039 HydrophobicContact CB-CG 4.48Å; E393-L1039 WeakPolarHBondContact OE2-CA 3.44Å; E393-L1039 PolarHBondContact OE2-N 2.93Å; K1037-L1039 HydrophobicContact CD-CD2 4.36Å; K1037-L1039 HydrophobicContact CG-CB 3.94Å; K1037-L1039 HydrophobicContact CG-CD2 4.11Å
1040	A	42.4	Very low	33.3	Very low	84 Å²	84	92.4 Å²	92.4	69%	0.694	54%	0.535	S	S	*	.			trans	-130.4	13.9	154.8	0	0	0	0	0	115.3	E393	E393-A1040 WeakPolarHBondContact OE1-CA 3.24Å; E393-A1040 PolarHBondContact OE1-N 2.79Å; E393-A1040 PolarHBondContact OE2-N 3.1Å; E393-A1040 VanDerWaalsContact OE2-N 3.14Å
1041	S	40	Very low	33	Very low	34 Å²	34	93.4 Å²	93.4	24%	0.238	54%	0.544	C	S	.	.				53.6	147.5	115.4	79.6	0	0	0	0	120	E393	E393-S1041 PolarHBondContact OE1-N 2.92Å
1042	K	35.5	Very low	32.6	Very low	182 Å²	182	95.7 Å²	95.7	79%	0.791	56%	0.557	S	S	*	*			trans	72.8	160.2	174.2	-44.3	135.1	-170.3	156.1	0	110.7
1043	A	35.6	Very low	32.6	Very low	83 Å²	83	100 Å²	100	69%	0.686	58%	0.578	S	S	*	*			cis	-133.3	148.8	15.3	0	0	0	0	0	109.4
1044	I	30.6	Very low	32.3	Very low	148 Å²	148	99.3 Å²	99.3	76%	0.759	58%	0.576	S	S	*	*				57.1	116.2	63	-65.3	166.5	0	0	0	109.2
1045	T	27.9	Very low	32.3	Very low	113 Å²	113	103.8 Å²	103.8	69%	0.693	60%	0.603	S	S	*	*			cis	-177	173.9	6.5	-177.5	0	0	0	0	110.3
1046	T	29.1	Very low	32.3	Very low	118 Å²	118	110.2 Å²	110.2	72%	0.724	63%	0.628	S	S	*	*			trans	73.3	143	148.7	-59.9	0	0	0	0	115.2
1047	S	30.2	Very low	32.2	Very low	81 Å²	81	111.9 Å²	111.9	57%	0.566	65%	0.646	S	S	*	*			cis	-174.5	165.1	-4.5	52	0	0	0	0	112.2
1048	N	29.2	Very low	31.8	Very low	154 Å²	154	117.7 Å²	117.7	82%	0.824	67%	0.674	S	S	*	*			trans	62.3	153.8	143.7	-65.5	-4.1	0	0	0	119.5
1049	S	29.1	Very low	31.4	Very low	77 Å²	77	123.7 Å²	123.7	54%	0.538	69%	0.693	S	S	.	*			cis	-172.8	170.8	-18.6	177.7	0	0	0	0	109.1
1050	F	31.8	Very low	30.7	Very low	175 Å²	175	124.1 Å²	124.1	77%	0.768	70%	0.699	S	S	*	*			trans	84.7	122.7	160.6	-54.3	-69.2	0	0	0	121
1051	N	29.4	Very low	30	Very low	146 Å²	146	128.8 Å²	128.8	78%	0.781	71%	0.706	S	S	*	*				65.7	150.4	128.7	-67.7	29.6	0	0	0	121.3
1052	D	27.4	Very low	29.6	Very low	123 Å²	123	132.1 Å²	132.1	66%	0.658	73%	0.73	S	S	*	*			cis	-171.5	149.6	-16.7	173.9	39.1	0	0	0	109.7
1053	N	29.7	Very low	29.5	Very low	132 Å²	132	130.2 Å²	130.2	71%	0.706	73%	0.728	S	S	*	*			trans	59.5	157.9	168.2	-84.6	-54.6	0	0	0	118.2
1054	S	28.9	Very low	30	Very low	96 Å²	96	137.7 Å²	137.7	67%	0.671	74%	0.739	S	S	*	*			cis	-163.7	-179.8	-19.3	-167	0	0	0	0	110.2
1055	V	29.2	Very low	31.5	Very low	117 Å²	117	134.1 Å²	134.1	71%	0.709	72%	0.723	S	S	*	*			trans	62.4	96.7	167.8	-167.9	0	0	0	0	116.2
1056	Q	28	Very low	34	Very low	179 Å²	179	132.1 Å²	132.1	84%	0.836	71%	0.706	S	S	*	*				66.1	89	78.4	-67.5	-173.8	-29.3	0	0	117.8
1057	S	29.7	Very low	36.9	Very low	112 Å²	112	129.6 Å²	129.6	78%	0.783	69%	0.687	S	S	*	*			trans	-174.3	109.4	132.5	24.6	0	0	0	0	107.4
1058	Q	28.3	Very low	39.8	Very low	177 Å²	177	126 Å²	126	83%	0.827	66%	0.661	S	S	*	*				48.1	83.1	68	-68.7	-161.6	5.1	0	0	114.6
1059	Q	29.8	Very low	42.9	Very low	183 Å²	183	120.5 Å²	120.5	86%	0.855	63%	0.631	S	S	*	*			trans	-153.5	89.2	138.8	-105.5	159.4	61.6	0	0	107.1
1060	T	24.2	Very low	46	Very low	92 Å²	92	117 Å²	117	56%	0.564	61%	0.606	S	S	*	*				55.9	122.8	76	70.9	0	0	0	0	114.5
1061	Q	27.7	Very low	48.9	Very low	183 Å²	183	111.1 Å²	111.1	86%	0.855	58%	0.582	S	S	*	*			trans	54.9	108.6	139.4	-61.7	164.6	-13	0	0	117.8
1062	S	30.9	Very low	51.8	Low	104 Å²	104	109.5 Å²	109.5	73%	0.727	57%	0.568	S	S	*	*				-155.5	154	109.1	-164.1	0	0	0	0	110.5	R1064	S1062-R1064 VanDerWaalsContact C-N 3.33Å; S1062-R1064 PolarHBondContact O-N 3.37Å
1063	N	32.8	Very low	54.9	Low	141 Å²	141	107.5 Å²	107.5	75%	0.754	56%	0.564	S	S	*	*			trans	-63.2	104	148.8	-76.9	-6.6	0	0	0	105.8	V1065	N1063-V1065 HydrophobicContact CB-CG2 4.24Å; N1063-V1065 PolarHBondContact O-N 2.91Å
1064	R	45.7	Very low	57.9	Low	241 Å²	241	102.7 Å²	102.7	91%	0.909	54%	0.536	S	S	*	.			trans	-69.3	81.4	159.6	-86.6	-166.7	172.3	-165.9	-1.7	107.1	S1062 E1066	S1062-R1064 VanDerWaalsContact C-N 3.33Å; S1062-R1064 PolarHBondContact O-N 3.37Å; R1064-E1066 PolarHBondContact O-N 3.12Å
1065	V	62.6	Low	61	Low	72 Å²	72	106.4 Å²	106.4	44%	0.436	54%	0.54	S	S	.	.			trans	-51.4	107.4	164.4	-178.4	0	0	0	0	105.5	N1063 M1067 T1091	N1063-V1065 HydrophobicContact CB-CG2 4.24Å; N1063-V1065 PolarHBondContact O-N 2.91Å; V1065-M1067 HydrophobicContact CG1-CG 4.44Å; V1065-M1067 PolarHBondContact O-N 3.12Å; V1065-T1091 HydrophobicContact CG1-CG2 3.37Å; V1065-T1091 VanDerWaalsContact CG1-OG1 3.31Å; V1065-T1091 WeakPolarHBondContact CG1-OG1 3.46Å
1066	E	80.8	Confident	63.9	Low	72 Å²	72	102.7 Å²	102.7	34%	0.336	52%	0.522	S	S	.	.			trans	-72.7	102	-175.1	-178.5	170.6	-160	0	0	107.4	R1064 M1068 V1092 R1095	R1064-E1066 PolarHBondContact O-N 3.12Å; E1066-M1068 HydrophobicContact CG-CE 3.72Å; E1066-M1068 VanDerWaalsContact OE1-CE 3.22Å; E1066-M1068 WeakPolarHBondContact OE1-CE 3.44Å; E1066-V1092 HydrophobicContact CB-CB 4.2Å; E1066-V1092 HydrophobicContact CB-CG2 4.33Å; E1066-V1092 HydrophobicContact CG-CG2 4.15Å; E1066-V1092 WeakPolarHBondContact O-CG2 3.19Å; E1066-V1092 PolarHBondContact O-N 3.26Å; E1066-R1095 IonicContact OE1-CZ 2.71Å; E1066-R1095 IonicContact OE1-NH2 2.79Å; E1066-R1095 PolarHBondContact OE1-NH2 2.72Å; E1066-R1095 IonicContact OE2-CZ 3.25Å; E1066-R1095 IonicContact OE2-NE 3.56Å; E1066-R1095 IonicContact OE2-NH2 3.9Å; E1066-R1095 PolarHBondContact OE2-NH2 2.78Å
1067	M	89.4	Confident	66.8	Low	64 Å²	64	99.3 Å²	99.3	32%	0.315	51%	0.513	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	132.9	179.6	-71.7	178.8	-73.2	0	0	109.2	V1065 I1089 I1090 Y1122	V1065-M1067 HydrophobicContact CG1-CG 4.44Å; V1065-M1067 PolarHBondContact O-N 3.12Å; M1067-I1089 HydrophobicContact CB-CG2 3.96Å; M1067-I1089 HydrophobicContact CG-CG2 4.06Å; M1067-I1089 HydrophobicContact SD-CG2 4.19Å; M1067-I1090 WeakPolarHBondContact CA-O 3.47Å; M1067-Y1122 HydrophobicContact CB-CD1 3.8Å; M1067-Y1122 HydrophobicContact CB-CG 4.28Å; M1067-Y1122 HydrophobicContact CE-CD1 4.03Å; M1067-Y1122 HydrophobicContact CE-CE1 4.27Å; M1067-Y1122 WeakPolarHBondContact O-CB 3.45Å; M1067-Y1122 PolarHBondContact O-N 2.71Å; M1067-Y1122 HydrophobicContact SD-CD1 3.99Å; M1067-Y1122 HydrophobicContact SD-CE1 4.25Å
1068	M	92.5	Very high	69.6	Low	6 Å²	6	99.5 Å²	99.5	3%	0.03	50%	0.501	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	129.2	177.9	-72.6	-70.3	162	0	0	107.7	E1066 I1089 I1090 V1092 W1101 V1119 R1120 P1121	E1066-M1068 HydrophobicContact CG-CE 3.72Å; E1066-M1068 VanDerWaalsContact OE1-CE 3.22Å; E1066-M1068 WeakPolarHBondContact OE1-CE 3.44Å; M1068-I1089 WeakPolarHBondContact O-CA 3.33Å; M1068-I1090 PolarHBondContact N-O 3.25Å; M1068-I1090 PolarHBondContact O-N 3.08Å; M1068-V1092 HydrophobicContact CB-CG2 4.44Å; M1068-V1092 HydrophobicContact CG-CG2 3.54Å; M1068-W1101 HydrophobicContact CE-CZ3 3.86Å; M1068-W1101 HydrophobicContact SD-CZ3 4.27Å; M1068-V1119 HydrophobicContact CB-CB 3.94Å; M1068-V1119 HydrophobicContact CB-CG1 4.19Å; M1068-V1119 HydrophobicContact CB-CG2 4.05Å; M1068-V1119 HydrophobicContact CG-CG2 4.15Å; M1068-V1119 HydrophobicContact SD-CG2 3.96Å; M1068-R1120 CarbonylContact C-O 3.46Å; M1068-R1120 WeakPolarHBondContact CA-O 3.43Å; M1068-P1121 HydrophobicContact CE-CB 4.49Å; M1068-P1121 HydrophobicContact CE-CG 4.26Å; M1068-P1121 HydrophobicContact SD-CG 4.33Å
1069	Q	93.6	Very high	72.3	Confident	39 Å²	39	96.7 Å²	96.7	18%	0.182	51%	0.508	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	130.7	172.5	-179.7	169.2	48.7	0	0	109.2	G1087 A1088 I1089 V1119 R1120 Y1122	Q1069-G1087 PolarHBondContact NE2-O 2.71Å; Q1069-G1087 VanDerWaalsContact NE2-O 3.08Å; Q1069-A1088 WeakPolarHBondContact CA-O 3.47Å; Q1069-I1089 HydrophobicContact CB-CD1 3.82Å; Q1069-I1089 HydrophobicContact CG-CD1 3.93Å; Q1069-V1119 CarbonylContact O-C 3.58Å; Q1069-V1119 VanDerWaalsContact O-CA 3.31Å; Q1069-V1119 WeakPolarHBondContact O-CA 3.45Å; Q1069-R1120 HydrophobicContact CB-CG 4.22Å; Q1069-R1120 PolarHBondContact N-O 3.03Å; Q1069-R1120 PolarHBondContact O-N 3.49Å; Q1069-Y1122 HydrophobicContact CB-CD2 4.2Å
1070	T	93.4	Very high	75.2	Confident	2 Å²	2	91.8 Å²	91.8	1%	0.012	49%	0.488	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	135.7	176.1	59.1	0	0	0	0	110.3	F1084 E1085 G1087 A1088 I1090 Y1118 V1119	T1070-F1084 HydrophobicContact CG2-CB 4.33Å; T1070-F1084 HydrophobicContact CG2-CD2 3.24Å; T1070-F1084 HydrophobicContact CG2-CE2 3.53Å; T1070-F1084 HydrophobicContact CG2-CG 3.83Å; T1070-F1084 HydrophobicContact CG2-CZ 4.35Å; T1070-E1085 WeakPolarHBondContact CB-O 3.5Å; T1070-E1085 PolarHBondContact OG1-O 2.79Å; T1070-G1087 WeakPolarHBondContact O-CA 3.4Å; T1070-G1087 PolarHBondContact O-N 2.91Å; T1070-G1087 PolarHBondContact OG1-N 3.05Å; T1070-A1088 HydrophobicContact CG2-CB 4.5Å; T1070-A1088 PolarHBondContact N-O 3.47Å; T1070-A1088 PolarHBondContact OG1-N 3.44Å; T1070-A1088 PolarHBondContact OG1-O 2.73Å; T1070-I1090 HydrophobicContact CG2-CD1 3.55Å; T1070-I1090 HydrophobicContact CG2-CG1 4.04Å; T1070-Y1118 CarbonylContact C-O 3.58Å; T1070-Y1118 WeakPolarHBondContact CA-O 3.32Å; T1070-V1119 HydrophobicContact CG2-CG1 4.13Å
1071	I	93.6	Very high	78.5	Confident	53 Å²	53	88.6 Å²	88.6	27%	0.272	47%	0.466	S	S	.	.	S	Bend	trans	-106.9	-7.1	177.8	56.5	165.2	0	0	0	112.9	Y1118 R1120	I1071-Y1118 WeakPolarHBondContact CG1-O 3.36Å; I1071-Y1118 PolarHBondContact N-O 3.36Å; I1071-R1120 HydrophobicContact CG2-CB 4.04Å; I1071-R1120 HydrophobicContact CG2-CG 3.71Å
1072	F	90.7	Very high	81.5	Confident	112 Å²	112	80 Å²	80	49%	0.491	43%	0.427	S	S	.	.	S	Bend	trans	-142.9	162	171.1	-57.1	-64.1	0	0	0	108.9	F1084 Y1118	F1072-F1084 WeakPolarHBondContact O-CE2 3.22Å; F1072-Y1118 HydrophobicContact CB-CD1 3.58Å; F1072-Y1118 HydrophobicContact CB-CE1 3.78Å; F1072-Y1118 HydrophobicContact CB-CG 4.37Å; F1072-Y1118 HydrophobicContact CD2-CD1 4.38Å; F1072-Y1118 HydrophobicContact CD2-CG 4.44Å; F1072-Y1118 HydrophobicContact CG-CD1 4.47Å
1073	S	92.3	Very high	84.6	Confident	81 Å²	81	78.9 Å²	78.9	57%	0.566	42%	0.415	S	S	*	.			trans	-85.8	147.8	169.2	57.5	0	0	0	0	111.4	F1084 Y1118	S1073-F1084 WeakPolarHBondContact CA-O 3.43Å; S1073-Y1118 WeakPolarHBondContact O-CE1 3.36Å
1074	Y	92.9	Very high	87.5	Confident	31 Å²	31	72.5 Å²	72.5	12%	0.122	38%	0.381	C	S	.	.	B	Isolated β-bridge	trans	-141.9	142.5	-175.7	-178.4	-96.7	0	0	0	111.3	E1081 L1082 F1084 W1100 P1115 Y1118	Y1074-E1081 PolarHBondContact OH-OE2 2.69Å; Y1074-E1081 VanDerWaalsContact OH-OE2 3.09Å; Y1074-L1082 WeakPolarHBondContact CD1-O 3.37Å; Y1074-F1084 VanDerWaalsContact CB-CE2 3.47Å; Y1074-F1084 HydrophobicContact CD1-CD1 4.42Å; Y1074-F1084 AromaticContact CD1-CE1 3.8Å; Y1074-F1084 HydrophobicContact CD1-CE1 3.8Å; Y1074-F1084 HydrophobicContact CD1-CZ 4.18Å; Y1074-F1084 HydrophobicContact CG-CE1 4.03Å; Y1074-F1084 AromaticContact CG-CZ 3.93Å; Y1074-F1084 HydrophobicContact CG-CZ 3.93Å; Y1074-F1084 PolarHBondContact N-O 2.87Å; Y1074-F1084 PolarHBondContact O-N 3.42Å; Y1074-F1084 VanDerWaalsContact O-O 3.12Å; Y1074-W1100 WeakPolarHBondContact OH-CH2 3.33Å; Y1074-P1115 HydrophobicContact CD2-CG 3.98Å; Y1074-P1115 HydrophobicContact CE2-CG 4.03Å; Y1074-P1115 HydrophobicContact CG-CG 4.38Å; Y1074-Y1118 HydrophobicContact CD2-CD1 4.21Å; Y1074-Y1118 AromaticContact CD2-CE1 3.95Å; Y1074-Y1118 HydrophobicContact CD2-CE1 3.95Å; Y1074-Y1118 HydrophobicContact CG-CD1 4.42Å; Y1074-Y1118 HydrophobicContact CG-CE1 4.5Å
1075	K	93	Very high	89.7	Confident	173 Å²	173	68.4 Å²	68.4	75%	0.752	37%	0.372	S	S	*	.			trans	-121.3	128.4	177.7	-66	-178.5	-179.3	178.9	0	109.2	V1077	K1075-V1077 PolarHBondContact O-N 3.32Å
1076	A	90.1	Very high	91.2	Very high	40 Å²	40	71.5 Å²	71.5	33%	0.331	38%	0.382	S	S	.	.			trans	-60.1	129.3	178.2	0	0	0	0	0	111.8	E1081 T1083	A1076-E1081 WeakPolarHBondContact CA-OE2 3.32Å; A1076-E1081 HydrophobicContact CB-CB 3.78Å; A1076-T1083 WeakPolarHBondContact CB-OG1 3.32Å; A1076-T1083 PolarHBondContact N-OG1 3.2Å
1077	V	89.8	Confident	91.7	Very high	108 Å²	108	69.7 Å²	69.7	66%	0.655	38%	0.383	S	S	*	.	S	Bend	trans	-91.5	-30.2	169.2	-174	0	0	0	0	110.2	K1075 E1081	K1075-V1077 PolarHBondContact O-N 3.32Å; V1077-E1081 WeakPolarHBondContact CA-OE2 3.03Å; V1077-E1081 PolarHBondContact N-OE2 2.98Å
1078	H	87	Confident	91.8	Very high	116 Å²	116	67.1 Å²	67.1	54%	0.537	37%	0.371	S	S	.	.	S	Bend	trans	-121.1	156.7	-179.7	-60.1	-33	0	0	0	112.8	D1080 E1081	H1078-D1080 PolarHBondContact O-N 3.26Å; H1078-E1081 HydrophobicContact CB-CG 4.06Å; H1078-E1081 IonicContact CD2-OE1 2.79Å; H1078-E1081 PolarHBondContact CD2-OE1 3.02Å; H1078-E1081 IonicContact CG-OE1 2.71Å; H1078-E1081 PolarHBondContact N-OE2 2.98Å; H1078-E1081 PolarHBondContact O-N 2.9Å
1079	A	85.6	Confident	91.9	Very high	117 Å²	117	68 Å²	68	97%	0.967	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.6	-10	-168.4	0	0	0	0	0	114.5
1080	D	90.4	Very high	91.9	Very high	80 Å²	80	66.1 Å²	66.1	43%	0.428	37%	0.367	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.3	3.9	177.9	59.4	-43.7	0	0	0	113.5	H1078 G1112 L1113	H1078-D1080 PolarHBondContact O-N 3.26Å; D1080-G1112 CarbonylContact O-C 3.49Å; D1080-G1112 WeakPolarHBondContact O-CA 2.89Å; D1080-L1113 PolarHBondContact O-N 3.1Å
1081	E	93.7	Very high	92	Very high	25 Å²	25	66.9 Å²	66.9	12%	0.117	37%	0.372	C	S	.	.	B	Isolated β-bridge	trans	-91.8	155.1	174.2	-64.4	169.1	175.8	0	0	112.5	Y1074 A1076 V1077 H1078 W1100 L1113	Y1074-E1081 PolarHBondContact OH-OE2 2.69Å; Y1074-E1081 VanDerWaalsContact OH-OE2 3.09Å; A1076-E1081 WeakPolarHBondContact CA-OE2 3.32Å; A1076-E1081 HydrophobicContact CB-CB 3.78Å; V1077-E1081 WeakPolarHBondContact CA-OE2 3.03Å; V1077-E1081 PolarHBondContact N-OE2 2.98Å; H1078-E1081 HydrophobicContact CB-CG 4.06Å; H1078-E1081 IonicContact CD2-OE1 2.79Å; H1078-E1081 PolarHBondContact CD2-OE1 3.02Å; H1078-E1081 IonicContact CG-OE1 2.71Å; H1078-E1081 PolarHBondContact N-OE2 2.98Å; H1078-E1081 PolarHBondContact O-N 2.9Å; E1081-W1100 HydrophobicContact CG-CH2 4.32Å; E1081-W1100 HydrophobicContact CG-CZ3 3.81Å; E1081-W1100 WeakPolarHBondContact OE1-CH2 3.36Å; E1081-L1113 CarbonylContact C-O 3.6Å; E1081-L1113 VanDerWaalsContact CA-O 3.31Å; E1081-L1113 WeakPolarHBondContact CA-O 3.12Å; E1081-L1113 HydrophobicContact CG-CB 4.43Å
1082	L	91.8	Very high	91.9	Very high	4 Å²	4	65.3 Å²	65.3	2%	0.021	37%	0.365	C	S	.	.	P	Polyproline II helix	trans	-100.9	121.6	-176.3	-173.8	63.5	0	0	0	111.1	Y1074 F1084 I1090 L1105 A1110 L1113	Y1074-L1082 WeakPolarHBondContact CD1-O 3.37Å; L1082-F1084 HydrophobicContact CB-CD1 4.47Å; L1082-F1084 HydrophobicContact CG-CD1 4.26Å; L1082-F1084 WeakPolarHBondContact O-CD1 3.47Å; L1082-F1084 WeakPolarHBondContact O-CE1 3.46Å; L1082-I1090 HydrophobicContact CD2-CD1 4.06Å; L1082-I1090 HydrophobicContact CD2-CG1 4.17Å; L1082-I1090 HydrophobicContact CD2-CG2 4.23Å; L1082-L1105 HydrophobicContact CD1-CB 4.24Å; L1082-L1105 HydrophobicContact CD2-CB 4.25Å; L1082-A1110 HydrophobicContact CD1-CB 3.81Å; L1082-A1110 WeakPolarHBondContact CD1-O 3.44Å; L1082-L1113 PolarHBondContact N-O 2.75Å
1083	T	94.1	Very high	91.9	Very high	80 Å²	80	64 Å²	64	49%	0.491	36%	0.362	S	S	.	.	P	Polyproline II helix	trans	-83.8	133.7	170.6	-65.9	0	0	0	0	110.7	A1076	A1076-T1083 WeakPolarHBondContact CB-OG1 3.32Å; A1076-T1083 PolarHBondContact N-OG1 3.2Å
1084	F	93.9	Very high	91.7	Very high	7 Å²	7	61 Å²	61	3%	0.031	34%	0.344	C	S	.	.	B	Isolated β-bridge	trans	-153.1	156.7	-178	54.1	-96.8	0	0	0	113.8	T1070 F1072 S1073 Y1074 L1082 I1090 L1105 F1114 Y1118	T1070-F1084 HydrophobicContact CG2-CB 4.33Å; T1070-F1084 HydrophobicContact CG2-CD2 3.24Å; T1070-F1084 HydrophobicContact CG2-CE2 3.53Å; T1070-F1084 HydrophobicContact CG2-CG 3.83Å; T1070-F1084 HydrophobicContact CG2-CZ 4.35Å; F1072-F1084 WeakPolarHBondContact O-CE2 3.22Å; S1073-F1084 WeakPolarHBondContact CA-O 3.43Å; Y1074-F1084 VanDerWaalsContact CB-CE2 3.47Å; Y1074-F1084 HydrophobicContact CD1-CD1 4.42Å; Y1074-F1084 AromaticContact CD1-CE1 3.8Å; Y1074-F1084 HydrophobicContact CD1-CE1 3.8Å; Y1074-F1084 HydrophobicContact CD1-CZ 4.18Å; Y1074-F1084 HydrophobicContact CG-CE1 4.03Å; Y1074-F1084 AromaticContact CG-CZ 3.93Å; Y1074-F1084 HydrophobicContact CG-CZ 3.93Å; Y1074-F1084 PolarHBondContact N-O 2.87Å; Y1074-F1084 PolarHBondContact O-N 3.42Å; Y1074-F1084 VanDerWaalsContact O-O 3.12Å; L1082-F1084 HydrophobicContact CB-CD1 4.47Å; L1082-F1084 HydrophobicContact CG-CD1 4.26Å; L1082-F1084 WeakPolarHBondContact O-CD1 3.47Å; L1082-F1084 WeakPolarHBondContact O-CE1 3.46Å; F1084-I1090 HydrophobicContact CD1-CD1 3.92Å; F1084-I1090 HydrophobicContact CE1-CD1 4.11Å; F1084-I1090 HydrophobicContact CG-CD1 4.19Å; F1084-I1090 HydrophobicContact CZ-CD1 4.49Å; F1084-L1105 HydrophobicContact CB-CD1 3.85Å; F1084-L1105 HydrophobicContact CB-CD2 4.45Å; F1084-F1114 HydrophobicContact CD1-CB 4.46Å; F1084-F1114 HydrophobicContact CE1-CB 3.58Å; F1084-F1114 HydrophobicContact CZ-CB 4.2Å; F1084-Y1118 HydrophobicContact CE2-CD1 4.25Å; F1084-Y1118 HydrophobicContact CZ-CD1 4.37Å; F1084-Y1118 HydrophobicContact CZ-CG 4.46Å
1085	E	93.7	Very high	91.7	Very high	154 Å²	154	65.5 Å²	65.5	72%	0.72	36%	0.361	S	S	*	.			trans	-95	168	173.9	-63.8	179.4	165.5	0	0	111	T1070 A1088	T1070-E1085 WeakPolarHBondContact CB-O 3.5Å; T1070-E1085 PolarHBondContact OG1-O 2.79Å; E1085-A1088 WeakPolarHBondContact O-CB 3.22Å
1086	E	93.2	Very high	90.9	Very high	138 Å²	138	61.9 Å²	61.9	65%	0.645	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.6	144.6	174.7	-174.6	-178.4	147.9	0	0	111.3	A1088	E1086-A1088 PolarHBondContact O-N 3.49Å
1087	G	90.7	Very high	90.6	Very high	34 Å²	34	64.6 Å²	64.6	35%	0.351	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	trans	77.5	-9.8	179.8	0	0	0	0	0	115.4	Q1069 T1070	Q1069-G1087 PolarHBondContact NE2-O 2.71Å; Q1069-G1087 VanDerWaalsContact NE2-O 3.08Å; T1070-G1087 WeakPolarHBondContact O-CA 3.4Å; T1070-G1087 PolarHBondContact O-N 2.91Å; T1070-G1087 PolarHBondContact OG1-N 3.05Å
1088	A	93	Very high	90.1	Very high	10 Å²	10	65.2 Å²	65.2	8%	0.083	36%	0.362	C	S	.	.			trans	-64.6	154.5	175.5	0	0	0	0	0	112.3	Q1069 T1070 E1085 E1086 L1105	Q1069-A1088 WeakPolarHBondContact CA-O 3.47Å; T1070-A1088 HydrophobicContact CG2-CB 4.5Å; T1070-A1088 PolarHBondContact N-O 3.47Å; T1070-A1088 PolarHBondContact OG1-N 3.44Å; T1070-A1088 PolarHBondContact OG1-O 2.73Å; E1085-A1088 WeakPolarHBondContact O-CB 3.22Å; E1086-A1088 PolarHBondContact O-N 3.49Å; A1088-L1105 HydrophobicContact CB-CD1 3.96Å
1089	I	94	Very high	90.2	Very high	23 Å²	23	66.6 Å²	66.6	12%	0.118	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	126.9	-177.5	-52	-54.9	0	0	0	110.2	M1067 M1068 Q1069 Q1106 Y1122	M1067-I1089 HydrophobicContact CB-CG2 3.96Å; M1067-I1089 HydrophobicContact CG-CG2 4.06Å; M1067-I1089 HydrophobicContact SD-CG2 4.19Å; M1068-I1089 WeakPolarHBondContact O-CA 3.33Å; Q1069-I1089 HydrophobicContact CB-CD1 3.82Å; Q1069-I1089 HydrophobicContact CG-CD1 3.93Å; I1089-Q1106 HydrophobicContact CB-CB 4.04Å; I1089-Q1106 HydrophobicContact CG2-CB 4.38Å; I1089-Q1106 VanDerWaalsContact O-CB 3.27Å; I1089-Q1106 WeakPolarHBondContact O-CB 3.44Å; I1089-Q1106 PolarHBondContact O-N 3.19Å; I1089-Y1122 HydrophobicContact CD1-CD1 4.4Å; I1089-Y1122 HydrophobicContact CD1-CD2 3.49Å; I1089-Y1122 VanDerWaalsContact CD1-CD2 3.49Å; I1089-Y1122 HydrophobicContact CD1-CE2 3.8Å; I1089-Y1122 HydrophobicContact CD1-CG 3.82Å; I1089-Y1122 HydrophobicContact CG2-CD1 4.49Å
1090	I	93.9	Very high	90.4	Very high	0 Å²	0	64.4 Å²	64.4	0%	0	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	125.5	174.5	-60.1	171.9	0	0	0	108.6	M1067 M1068 T1070 L1082 F1084 R1104 L1105 F1114 V1119	M1067-I1090 WeakPolarHBondContact CA-O 3.47Å; M1068-I1090 PolarHBondContact N-O 3.25Å; M1068-I1090 PolarHBondContact O-N 3.08Å; T1070-I1090 HydrophobicContact CG2-CD1 3.55Å; T1070-I1090 HydrophobicContact CG2-CG1 4.04Å; L1082-I1090 HydrophobicContact CD2-CD1 4.06Å; L1082-I1090 HydrophobicContact CD2-CG1 4.17Å; L1082-I1090 HydrophobicContact CD2-CG2 4.23Å; F1084-I1090 HydrophobicContact CD1-CD1 3.92Å; F1084-I1090 HydrophobicContact CE1-CD1 4.11Å; F1084-I1090 HydrophobicContact CG-CD1 4.19Å; F1084-I1090 HydrophobicContact CZ-CD1 4.49Å; I1090-R1104 CarbonylContact C-O 3.43Å; I1090-R1104 WeakPolarHBondContact CA-O 3.49Å; I1090-L1105 HydrophobicContact CG1-CD1 3.68Å; I1090-F1114 HydrophobicContact CD1-CB 4.29Å; I1090-F1114 HydrophobicContact CD1-CD1 4.24Å; I1090-F1114 HydrophobicContact CD1-CD2 4.2Å; I1090-F1114 HydrophobicContact CD1-CG 3.98Å; I1090-F1114 HydrophobicContact CG2-CD1 3.86Å; I1090-F1114 HydrophobicContact CG2-CE1 3.57Å; I1090-F1114 HydrophobicContact CG2-CZ 4.09Å; I1090-V1119 HydrophobicContact CD1-CG1 4.21Å
1091	T	93.9	Very high	90.6	Very high	18 Å²	18	62.2 Å²	62.2	11%	0.11	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	118.9	165.2	-80.6	0	0	0	0	108.6	V1065 L1093 G1103 R1104 Q1106	V1065-T1091 HydrophobicContact CG1-CG2 3.37Å; V1065-T1091 VanDerWaalsContact CG1-OG1 3.31Å; V1065-T1091 WeakPolarHBondContact CG1-OG1 3.46Å; T1091-L1093 HydrophobicContact CG2-CD2 4.02Å; T1091-L1093 PolarHBondContact O-N 2.78Å; T1091-G1103 CarbonylContact O-C 3.56Å; T1091-G1103 WeakPolarHBondContact O-CA 3.24Å; T1091-R1104 PolarHBondContact N-O 3.26Å; T1091-R1104 PolarHBondContact O-N 3.35Å; T1091-Q1106 PolarHBondContact OG1-OE1 3.21Å
1092	V	93.4	Very high	90.6	Very high	21 Å²	21	65.2 Å²	65.2	13%	0.127	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	129.1	173.7	-176.8	0	0	0	0	109.7	E1066 M1068 R1095 W1101 F1114	E1066-V1092 HydrophobicContact CB-CB 4.2Å; E1066-V1092 HydrophobicContact CB-CG2 4.33Å; E1066-V1092 HydrophobicContact CG-CG2 4.15Å; E1066-V1092 WeakPolarHBondContact O-CG2 3.19Å; E1066-V1092 PolarHBondContact O-N 3.26Å; M1068-V1092 HydrophobicContact CB-CG2 4.44Å; M1068-V1092 HydrophobicContact CG-CG2 3.54Å; V1092-R1095 HydrophobicContact CG1-CG 4.23Å; V1092-W1101 HydrophobicContact CG2-CE3 4.32Å; V1092-F1114 HydrophobicContact CG2-CZ 4.2Å
1093	L	90.5	Very high	90.7	Very high	83 Å²	83	65 Å²	65	44%	0.435	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	-27.8	177.1	-63.4	177.9	0	0	0	112.6	T1091 R1102 R1104 E1111	T1091-L1093 HydrophobicContact CG2-CD2 4.02Å; T1091-L1093 PolarHBondContact O-N 2.78Å; L1093-R1102 WeakPolarHBondContact CA-O 3.3Å; L1093-R1102 HydrophobicContact CB-CG 4.38Å; L1093-R1102 PolarHBondContact N-O 3.37Å; L1093-R1104 HydrophobicContact CD1-CB 4.09Å; L1093-R1104 HydrophobicContact CG-CB 4.39Å; L1093-E1111 HydrophobicContact CD1-CB 4.46Å; L1093-E1111 HydrophobicContact CD1-CG 3.99Å; L1093-E1111 WeakPolarHBondContact CD1-OE1 3.48Å
1094	G	88.2	Confident	90.7	Very high	18 Å²	18	66.7 Å²	66.7	19%	0.186	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-169.6	153.7	179.5	0	0	0	0	0	112.8	W1101 R1102	G1094-W1101 CarbonylContact O-C 3.58Å; G1094-W1101 WeakPolarHBondContact O-CA 3.39Å; G1094-W1101 WeakPolarHBondContact O-CB 3.49Å; G1094-R1102 PolarHBondContact N-O 2.88Å; G1094-R1102 PolarHBondContact O-N 2.83Å
1095	R	91.1	Very high	90.7	Very high	127 Å²	127	67 Å²	67	48%	0.479	33%	0.33	S	S	.	.			trans	-121.7	52.7	177.7	-53.4	-169.8	-163.6	-153.4	20.5	110.2	E1066 V1092 E1097 W1101	E1066-R1095 IonicContact OE1-CZ 2.71Å; E1066-R1095 IonicContact OE1-NH2 2.79Å; E1066-R1095 PolarHBondContact OE1-NH2 2.72Å; E1066-R1095 IonicContact OE2-CZ 3.25Å; E1066-R1095 IonicContact OE2-NE 3.56Å; E1066-R1095 IonicContact OE2-NH2 3.9Å; E1066-R1095 PolarHBondContact OE2-NH2 2.78Å; V1092-R1095 HydrophobicContact CG1-CG 4.23Å; R1095-E1097 PolarHBondContact O-N 2.66Å; R1095-W1101 HydrophobicContact CB-CG 4.18Å; R1095-W1101 HydrophobicContact CG-CD2 3.88Å; R1095-W1101 HydrophobicContact CG-CG 3.86Å
1096	D	77.7	Confident	90.5	Very high	97 Å²	97	65.2 Å²	65.2	52%	0.519	32%	0.321	S	S	.	.			trans	-69.3	-21.3	-174.7	-77.9	-82.3	0	0	0	113.6	K974	K974-D1096 IonicContact NZ-OD1 2.76Å; K974-D1096 PolarHBondContact NZ-OD1 2.7Å
1097	E	83	Confident	90	Very high	96 Å²	96	64.5 Å²	64.5	45%	0.449	32%	0.322	S	S	.	.	S	Bend	trans	-127.5	152	178.7	-65.5	172.3	-153.7	0	0	110.9	R1095 W1100	R1095-E1097 PolarHBondContact O-N 2.66Å; E1097-W1100 HydrophobicContact CB-CB 4.28Å; E1097-W1100 VanDerWaalsContact O-O 3.12Å
1098	P	79.8	Confident	89.8	Confident	122 Å²	122	66.5 Å²	66.5	79%	0.792	33%	0.331	S	S	*	.	S	Bend	trans	-67.4	-42.8	-172.8	-21.9	34.2	0	0	0	113.8
1099	E	87.8	Confident	89.7	Confident	145 Å²	145	68 Å²	68	68%	0.678	35%	0.347	S	S	*	.	S	Bend	trans	-101.4	-7.2	-175.4	-59.5	-165.9	139.9	0	0	113.5	P1115 V1116	E1099-P1115 CarbonylContact O-C 3.6Å; E1099-P1115 WeakPolarHBondContact O-CA 3.45Å; E1099-V1116 WeakPolarHBondContact O-CG2 3.49Å; E1099-V1116 PolarHBondContact O-N 3.34Å
1100	W	91.2	Very high	89.5	Confident	71 Å²	71	69.1 Å²	69.1	27%	0.269	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	119.2	-179.1	-65.7	84.6	0	0	0	110.8	Y1074 E1081 E1097 L1113 F1114 P1115	Y1074-W1100 WeakPolarHBondContact OH-CH2 3.33Å; E1081-W1100 HydrophobicContact CG-CH2 4.32Å; E1081-W1100 HydrophobicContact CG-CZ3 3.81Å; E1081-W1100 WeakPolarHBondContact OE1-CH2 3.36Å; E1097-W1100 HydrophobicContact CB-CB 4.28Å; E1097-W1100 VanDerWaalsContact O-O 3.12Å; W1100-L1113 HydrophobicContact CE3-CB 3.98Å; W1100-F1114 WeakPolarHBondContact CA-O 3.3Å; W1100-P1115 HydrophobicContact CD2-CB 4.41Å; W1100-P1115 HydrophobicContact CE3-CB 4.31Å; W1100-P1115 HydrophobicContact CZ3-CB 4.43Å; W1100-P1115 HydrophobicContact CZ3-CG 4.42Å
1101	W	94.4	Very high	89.5	Confident	33 Å²	33	73.7 Å²	73.7	13%	0.125	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	146.4	175.8	-65.3	-10	0	0	0	110.1	M1068 V1092 G1094 R1095 L1113 F1114 V1116	M1068-W1101 HydrophobicContact CE-CZ3 3.86Å; M1068-W1101 HydrophobicContact SD-CZ3 4.27Å; V1092-W1101 HydrophobicContact CG2-CE3 4.32Å; G1094-W1101 CarbonylContact O-C 3.58Å; G1094-W1101 WeakPolarHBondContact O-CA 3.39Å; G1094-W1101 WeakPolarHBondContact O-CB 3.49Å; R1095-W1101 HydrophobicContact CB-CG 4.18Å; R1095-W1101 HydrophobicContact CG-CD2 3.88Å; R1095-W1101 HydrophobicContact CG-CG 3.86Å; W1101-L1113 CarbonylContact O-C 3.53Å; W1101-L1113 WeakPolarHBondContact O-CA 3.07Å; W1101-F1114 HydrophobicContact CB-CE1 3.82Å; W1101-F1114 HydrophobicContact CB-CE2 4.15Å; W1101-F1114 HydrophobicContact CB-CZ 3.61Å; W1101-F1114 HydrophobicContact CE3-CE2 4.27Å; W1101-F1114 HydrophobicContact CE3-CZ 4.08Å; W1101-F1114 PolarHBondContact N-O 3.02Å; W1101-F1114 WeakPolarHBondContact O-CD1 3.46Å; W1101-F1114 VanDerWaalsContact O-CE1 3.31Å; W1101-F1114 WeakPolarHBondContact O-CE1 3.43Å; W1101-F1114 PolarHBondContact O-N 2.81Å; W1101-V1116 HydrophobicContact CB-CG2 4.38Å; W1101-V1116 HydrophobicContact CD2-CG1 4.48Å; W1101-V1116 HydrophobicContact CD2-CG2 3.5Å; W1101-V1116 VanDerWaalsContact CD2-CG2 3.5Å; W1101-V1116 HydrophobicContact CE3-CG2 4.13Å; W1101-V1116 HydrophobicContact CG-CG2 3.61Å; W1101-V1116 HydrophobicContact CH2-CG1 3.65Å; W1101-V1116 HydrophobicContact CH2-CG2 4.4Å; W1101-V1116 HydrophobicContact CZ2-CB 4.42Å; W1101-V1116 HydrophobicContact CZ2-CG1 3.6Å; W1101-V1116 HydrophobicContact CZ2-CG2 3.84Å; W1101-V1116 HydrophobicContact CZ3-CG1 4.16Å
1102	R	93.5	Very high	89.5	Confident	89 Å²	89	72.9 Å²	72.9	34%	0.336	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	131.5	172.2	-173.8	164.3	-70.1	-79.4	-6.9	108.8	L1093 G1094 G1112 L1113	L1093-R1102 WeakPolarHBondContact CA-O 3.3Å; L1093-R1102 HydrophobicContact CB-CG 4.38Å; L1093-R1102 PolarHBondContact N-O 3.37Å; G1094-R1102 PolarHBondContact N-O 2.88Å; G1094-R1102 PolarHBondContact O-N 2.83Å; R1102-G1112 WeakPolarHBondContact CA-O 3.45Å; R1102-L1113 HydrophobicContact CB-CD2 4.12Å
1103	G	93.3	Very high	89.5	Confident	0 Å²	0	72.8 Å²	72.8	0%	0	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.8	168.6	179.5	0	0	0	0	0	113.9	T1091 E1111 G1112	T1091-G1103 CarbonylContact O-C 3.56Å; T1091-G1103 WeakPolarHBondContact O-CA 3.24Å; G1103-E1111 VanDerWaalsContact O-CA 3.29Å; G1103-E1111 WeakPolarHBondContact O-CA 3.4Å; G1103-G1112 PolarHBondContact N-O 2.73Å; G1103-G1112 PolarHBondContact O-N 3.43Å
1104	R	94.8	Very high	89.7	Confident	115 Å²	115	68.8 Å²	68.8	43%	0.434	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	126.6	173.9	-174.4	-175.2	-71.1	-167.2	-3.8	109.9	I1090 T1091 L1093 Q1106 A1110 E1111	I1090-R1104 CarbonylContact C-O 3.43Å; I1090-R1104 WeakPolarHBondContact CA-O 3.49Å; T1091-R1104 PolarHBondContact N-O 3.26Å; T1091-R1104 PolarHBondContact O-N 3.35Å; L1093-R1104 HydrophobicContact CD1-CB 4.09Å; L1093-R1104 HydrophobicContact CG-CB 4.39Å; R1104-Q1106 PolarHBondContact O-N 3.02Å; R1104-A1110 CarbonylContact C-O 3.53Å; R1104-A1110 VanDerWaalsContact CA-O 3.28Å; R1104-A1110 WeakPolarHBondContact CA-O 3.38Å; R1104-E1111 HydrophobicContact CB-CG 3.96Å; R1104-E1111 HydrophobicContact CG-CG 3.93Å; R1104-E1111 IonicContact CZ-OE1 2.79Å; R1104-E1111 IonicContact NE-OE1 3.93Å; R1104-E1111 PolarHBondContact NE-OE1 3.01Å; R1104-E1111 IonicContact NH2-OE1 3.25Å; R1104-E1111 PolarHBondContact NH2-OE1 3.26Å
1105	L	93.9	Very high	89.9	Confident	14 Å²	14	68.4 Å²	68.4	7%	0.073	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	125.3	173.3	-162.3	70.2	0	0	0	110	L1082 F1084 A1088 I1090 N1107 G1109 A1110	L1082-L1105 HydrophobicContact CD1-CB 4.24Å; L1082-L1105 HydrophobicContact CD2-CB 4.25Å; F1084-L1105 HydrophobicContact CB-CD1 3.85Å; F1084-L1105 HydrophobicContact CB-CD2 4.45Å; A1088-L1105 HydrophobicContact CB-CD1 3.96Å; I1090-L1105 HydrophobicContact CG1-CD1 3.68Å; L1105-N1107 PolarHBondContact O-N 3.15Å; L1105-G1109 WeakPolarHBondContact O-CA 3.38Å; L1105-G1109 PolarHBondContact O-N 3.39Å; L1105-A1110 PolarHBondContact N-O 2.69Å
1106	Q	88.7	Confident	90	Very high	115 Å²	115	64 Å²	64	54%	0.537	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-27.5	-175.9	-164.2	68.9	5.6	0	0	112.6	I1089 T1091 R1104	I1089-Q1106 HydrophobicContact CB-CB 4.04Å; I1089-Q1106 HydrophobicContact CG2-CB 4.38Å; I1089-Q1106 VanDerWaalsContact O-CB 3.27Å; I1089-Q1106 WeakPolarHBondContact O-CB 3.44Å; I1089-Q1106 PolarHBondContact O-N 3.19Å; T1091-Q1106 PolarHBondContact OG1-OE1 3.21Å; R1104-Q1106 PolarHBondContact O-N 3.02Å
1107	N	83.9	Confident	90.6	Very high	123 Å²	123	64.8 Å²	64.8	66%	0.658	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.9	-37.6	-173.4	-55.1	23.4	0	0	0	112.8	L1105	L1105-N1107 PolarHBondContact O-N 3.15Å
1108	S	87.1	Confident	91.2	Very high	77 Å²	77	63.7 Å²	63.7	54%	0.538	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	-113.7	-14.8	-173.8	66.4	0	0	0	0	114.1	A1110	S1108-A1110 PolarHBondContact O-N 3.43Å; S1108-A1110 WeakPolarHBondContact OG-CB 3.24Å; S1108-A1110 PolarHBondContact OG-N 3.48Å
1109	G	89.1	Confident	91.8	Very high	42 Å²	42	58.7 Å²	58.7	43%	0.433	30%	0.299	S	S	.	.			trans	71.6	1	-172.3	0	0	0	0	0	114.8	L1105	L1105-G1109 WeakPolarHBondContact O-CA 3.38Å; L1105-G1109 PolarHBondContact O-N 3.39Å
1110	A	90.6	Very high	92	Very high	46 Å²	46	58.3 Å²	58.3	38%	0.38	29%	0.291	S	S	.	.			trans	-65.1	143.6	177.6	0	0	0	0	0	111.4	L1082 R1104 L1105 S1108	L1082-A1110 HydrophobicContact CD1-CB 3.81Å; L1082-A1110 WeakPolarHBondContact CD1-O 3.44Å; R1104-A1110 CarbonylContact C-O 3.53Å; R1104-A1110 VanDerWaalsContact CA-O 3.28Å; R1104-A1110 WeakPolarHBondContact CA-O 3.38Å; L1105-A1110 PolarHBondContact N-O 2.69Å; S1108-A1110 PolarHBondContact O-N 3.43Å; S1108-A1110 WeakPolarHBondContact OG-CB 3.24Å; S1108-A1110 PolarHBondContact OG-N 3.48Å
1111	E	93.4	Very high	92	Very high	96 Å²	96	59.7 Å²	59.7	45%	0.449	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	137.8	-179.8	-61.8	-171.2	163.8	0	0	111.3	L1093 G1103 R1104	L1093-E1111 HydrophobicContact CD1-CB 4.46Å; L1093-E1111 HydrophobicContact CD1-CG 3.99Å; L1093-E1111 WeakPolarHBondContact CD1-OE1 3.48Å; G1103-E1111 VanDerWaalsContact O-CA 3.29Å; G1103-E1111 WeakPolarHBondContact O-CA 3.4Å; R1104-E1111 HydrophobicContact CB-CG 3.96Å; R1104-E1111 HydrophobicContact CG-CG 3.93Å; R1104-E1111 IonicContact CZ-OE1 2.79Å; R1104-E1111 IonicContact NE-OE1 3.93Å; R1104-E1111 PolarHBondContact NE-OE1 3.01Å; R1104-E1111 IonicContact NH2-OE1 3.25Å; R1104-E1111 PolarHBondContact NH2-OE1 3.26Å
1112	G	93.4	Very high	91.7	Very high	0 Å²	0	61.6 Å²	61.6	0%	0	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-175.6	178.4	178.7	0	0	0	0	0	112.8	D1080 R1102 G1103	D1080-G1112 CarbonylContact O-C 3.49Å; D1080-G1112 WeakPolarHBondContact O-CA 2.89Å; R1102-G1112 WeakPolarHBondContact CA-O 3.45Å; G1103-G1112 PolarHBondContact N-O 2.73Å; G1103-G1112 PolarHBondContact O-N 3.43Å
1113	L	93.6	Very high	90.9	Very high	19 Å²	19	64.4 Å²	64.4	10%	0.099	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	139.3	169.2	-64.1	173.6	0	0	0	110.3	D1080 E1081 L1082 W1100 W1101 R1102	D1080-L1113 PolarHBondContact O-N 3.1Å; E1081-L1113 CarbonylContact C-O 3.6Å; E1081-L1113 VanDerWaalsContact CA-O 3.31Å; E1081-L1113 WeakPolarHBondContact CA-O 3.12Å; E1081-L1113 HydrophobicContact CG-CB 4.43Å; L1082-L1113 PolarHBondContact N-O 2.75Å; W1100-L1113 HydrophobicContact CE3-CB 3.98Å; W1101-L1113 CarbonylContact O-C 3.53Å; W1101-L1113 WeakPolarHBondContact O-CA 3.07Å; R1102-L1113 HydrophobicContact CB-CD2 4.12Å
1114	F	94.7	Very high	89.8	Confident	0 Å²	0	67.7 Å²	67.7	0%	0	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	143.5	172.3	66.2	-88	0	0	0	110.3	F1084 I1090 V1092 W1100 W1101 V1119	F1084-F1114 HydrophobicContact CD1-CB 4.46Å; F1084-F1114 HydrophobicContact CE1-CB 3.58Å; F1084-F1114 HydrophobicContact CZ-CB 4.2Å; I1090-F1114 HydrophobicContact CD1-CB 4.29Å; I1090-F1114 HydrophobicContact CD1-CD1 4.24Å; I1090-F1114 HydrophobicContact CD1-CD2 4.2Å; I1090-F1114 HydrophobicContact CD1-CG 3.98Å; I1090-F1114 HydrophobicContact CG2-CD1 3.86Å; I1090-F1114 HydrophobicContact CG2-CE1 3.57Å; I1090-F1114 HydrophobicContact CG2-CZ 4.09Å; V1092-F1114 HydrophobicContact CG2-CZ 4.2Å; W1100-F1114 WeakPolarHBondContact CA-O 3.3Å; W1101-F1114 HydrophobicContact CB-CE1 3.82Å; W1101-F1114 HydrophobicContact CB-CE2 4.15Å; W1101-F1114 HydrophobicContact CB-CZ 3.61Å; W1101-F1114 HydrophobicContact CE3-CE2 4.27Å; W1101-F1114 HydrophobicContact CE3-CZ 4.08Å; W1101-F1114 PolarHBondContact N-O 3.02Å; W1101-F1114 WeakPolarHBondContact O-CD1 3.46Å; W1101-F1114 VanDerWaalsContact O-CE1 3.31Å; W1101-F1114 WeakPolarHBondContact O-CE1 3.43Å; W1101-F1114 PolarHBondContact O-N 2.81Å; F1114-V1119 HydrophobicContact CD2-CG1 3.82Å; F1114-V1119 HydrophobicContact CD2-CG2 4.4Å; F1114-V1119 HydrophobicContact CE2-CB 4.43Å; F1114-V1119 HydrophobicContact CE2-CG1 3.77Å; F1114-V1119 HydrophobicContact CE2-CG2 3.75Å
1115	P	93.2	Very high	88.5	Confident	9 Å²	9	67.4 Å²	67.4	6%	0.058	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	133.4	-179.4	28.7	-33.7	0	0	0	111.3	Y1074 E1099 W1100 N1117 Y1118	Y1074-P1115 HydrophobicContact CD2-CG 3.98Å; Y1074-P1115 HydrophobicContact CE2-CG 4.03Å; Y1074-P1115 HydrophobicContact CG-CG 4.38Å; E1099-P1115 CarbonylContact O-C 3.6Å; E1099-P1115 WeakPolarHBondContact O-CA 3.45Å; W1100-P1115 HydrophobicContact CD2-CB 4.41Å; W1100-P1115 HydrophobicContact CE3-CB 4.31Å; W1100-P1115 HydrophobicContact CZ3-CB 4.43Å; W1100-P1115 HydrophobicContact CZ3-CG 4.42Å; P1115-N1117 VanDerWaalsContact C-N 3.32Å; P1115-N1117 PolarHBondContact O-N 3.07Å; P1115-Y1118 HydrophobicContact CB-CD2 4.08Å; P1115-Y1118 HydrophobicContact CG-CD2 3.58Å; P1115-Y1118 HydrophobicContact CG-CE2 4.17Å; P1115-Y1118 HydrophobicContact CG-CG 3.85Å; P1115-Y1118 WeakPolarHBondContact O-CB 3.46Å; P1115-Y1118 PolarHBondContact O-N 3.06Å; P1115-Y1118 VanDerWaalsContact O-N 3.07Å
1116	V	92.1	Very high	85.8	Confident	34 Å²	34	71.7 Å²	71.7	21%	0.206	40%	0.404	C	S	.	.	G	3₁₀ helix	trans	-66.3	-32.7	-168.7	173.8	0	0	0	0	112.8	E1099 W1101 Y1118 V1119	E1099-V1116 WeakPolarHBondContact O-CG2 3.49Å; E1099-V1116 PolarHBondContact O-N 3.34Å; W1101-V1116 HydrophobicContact CB-CG2 4.38Å; W1101-V1116 HydrophobicContact CD2-CG1 4.48Å; W1101-V1116 HydrophobicContact CD2-CG2 3.5Å; W1101-V1116 VanDerWaalsContact CD2-CG2 3.5Å; W1101-V1116 HydrophobicContact CE3-CG2 4.13Å; W1101-V1116 HydrophobicContact CG-CG2 3.61Å; W1101-V1116 HydrophobicContact CH2-CG1 3.65Å; W1101-V1116 HydrophobicContact CH2-CG2 4.4Å; W1101-V1116 HydrophobicContact CZ2-CB 4.42Å; W1101-V1116 HydrophobicContact CZ2-CG1 3.6Å; W1101-V1116 HydrophobicContact CZ2-CG2 3.84Å; W1101-V1116 HydrophobicContact CZ3-CG1 4.16Å; V1116-Y1118 PolarHBondContact O-N 2.94Å; V1116-V1119 WeakPolarHBondContact O-CG2 3.45Å; V1116-V1119 PolarHBondContact O-N 3.12Å
1117	N	92.1	Very high	83	Confident	115 Å²	115	75.6 Å²	75.6	62%	0.615	42%	0.422	S	S	*	.	G	3₁₀ helix	trans	-71.8	-5	175.9	58.7	-16.8	0	0	0	114.1	P1115	P1115-N1117 VanDerWaalsContact C-N 3.32Å; P1115-N1117 PolarHBondContact O-N 3.07Å
1118	Y	93.8	Very high	80.7	Confident	73 Å²	73	75.1 Å²	75.1	29%	0.286	42%	0.424	S	S	.	.	G	3₁₀ helix	trans	-93	2.6	174.2	-80.6	-118.8	0	0	0	113.4	T1070 I1071 F1072 S1073 Y1074 F1084 P1115 V1116	T1070-Y1118 CarbonylContact C-O 3.58Å; T1070-Y1118 WeakPolarHBondContact CA-O 3.32Å; I1071-Y1118 WeakPolarHBondContact CG1-O 3.36Å; I1071-Y1118 PolarHBondContact N-O 3.36Å; F1072-Y1118 HydrophobicContact CB-CD1 3.58Å; F1072-Y1118 HydrophobicContact CB-CE1 3.78Å; F1072-Y1118 HydrophobicContact CB-CG 4.37Å; F1072-Y1118 HydrophobicContact CD2-CD1 4.38Å; F1072-Y1118 HydrophobicContact CD2-CG 4.44Å; F1072-Y1118 HydrophobicContact CG-CD1 4.47Å; S1073-Y1118 WeakPolarHBondContact O-CE1 3.36Å; Y1074-Y1118 HydrophobicContact CD2-CD1 4.21Å; Y1074-Y1118 AromaticContact CD2-CE1 3.95Å; Y1074-Y1118 HydrophobicContact CD2-CE1 3.95Å; Y1074-Y1118 HydrophobicContact CG-CD1 4.42Å; Y1074-Y1118 HydrophobicContact CG-CE1 4.5Å; F1084-Y1118 HydrophobicContact CE2-CD1 4.25Å; F1084-Y1118 HydrophobicContact CZ-CD1 4.37Å; F1084-Y1118 HydrophobicContact CZ-CG 4.46Å; P1115-Y1118 HydrophobicContact CB-CD2 4.08Å; P1115-Y1118 HydrophobicContact CG-CD2 3.58Å; P1115-Y1118 HydrophobicContact CG-CE2 4.17Å; P1115-Y1118 HydrophobicContact CG-CG 3.85Å; P1115-Y1118 WeakPolarHBondContact O-CB 3.46Å; P1115-Y1118 PolarHBondContact O-N 3.06Å; P1115-Y1118 VanDerWaalsContact O-N 3.07Å; V1116-Y1118 PolarHBondContact O-N 2.94Å
1119	V	93.4	Very high	78.1	Confident	17 Å²	17	80.5 Å²	80.5	10%	0.103	44%	0.441	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	162.2	-178.7	-59.4	0	0	0	0	114.5	M1068 Q1069 T1070 I1090 F1114 V1116	M1068-V1119 HydrophobicContact CB-CB 3.94Å; M1068-V1119 HydrophobicContact CB-CG1 4.19Å; M1068-V1119 HydrophobicContact CB-CG2 4.05Å; M1068-V1119 HydrophobicContact CG-CG2 4.15Å; M1068-V1119 HydrophobicContact SD-CG2 3.96Å; Q1069-V1119 CarbonylContact O-C 3.58Å; Q1069-V1119 VanDerWaalsContact O-CA 3.31Å; Q1069-V1119 WeakPolarHBondContact O-CA 3.45Å; T1070-V1119 HydrophobicContact CG2-CG1 4.13Å; I1090-V1119 HydrophobicContact CD1-CG1 4.21Å; F1114-V1119 HydrophobicContact CD2-CG1 3.82Å; F1114-V1119 HydrophobicContact CD2-CG2 4.4Å; F1114-V1119 HydrophobicContact CE2-CB 4.43Å; F1114-V1119 HydrophobicContact CE2-CG1 3.77Å; F1114-V1119 HydrophobicContact CE2-CG2 3.75Å; V1116-V1119 WeakPolarHBondContact O-CG2 3.45Å; V1116-V1119 PolarHBondContact O-N 3.12Å
1120	R	91.9	Very high	75.4	Confident	137 Å²	137	88.5 Å²	88.5	52%	0.517	46%	0.464	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	155.7	165.2	68.8	-177.8	179.2	-163.2	0.3	110.5	M1068 Q1069 I1071 Y1122	M1068-R1120 CarbonylContact C-O 3.46Å; M1068-R1120 WeakPolarHBondContact CA-O 3.43Å; Q1069-R1120 HydrophobicContact CB-CG 4.22Å; Q1069-R1120 PolarHBondContact N-O 3.03Å; Q1069-R1120 PolarHBondContact O-N 3.49Å; I1071-R1120 HydrophobicContact CG2-CB 4.04Å; I1071-R1120 HydrophobicContact CG2-CG 3.71Å; R1120-Y1122 PolarHBondContact O-N 3.18Å
1121	P	90.8	Very high	72.8	Confident	99 Å²	99	91.7 Å²	91.7	64%	0.643	48%	0.483	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-55.4	126.2	171.7	-25.6	35.1	0	0	0	111.8	M1068 N1123	M1068-P1121 HydrophobicContact CE-CB 4.49Å; M1068-P1121 HydrophobicContact CE-CG 4.26Å; M1068-P1121 HydrophobicContact SD-CG 4.33Å; P1121-N1123 PolarHBondContact O-N 3.32Å
1122	Y	87.5	Confident	70.1	Confident	73 Å²	73	92.5 Å²	92.5	29%	0.286	50%	0.5	S	S	.	.			trans	-80.3	106.5	176.3	174.9	-112.2	0	0	0	109.9	M1067 Q1069 I1089 R1120 P1124	M1067-Y1122 HydrophobicContact CB-CD1 3.8Å; M1067-Y1122 HydrophobicContact CB-CG 4.28Å; M1067-Y1122 HydrophobicContact CE-CD1 4.03Å; M1067-Y1122 HydrophobicContact CE-CE1 4.27Å; M1067-Y1122 WeakPolarHBondContact O-CB 3.45Å; M1067-Y1122 PolarHBondContact O-N 2.71Å; M1067-Y1122 HydrophobicContact SD-CD1 3.99Å; M1067-Y1122 HydrophobicContact SD-CE1 4.25Å; Q1069-Y1122 HydrophobicContact CB-CD2 4.2Å; I1089-Y1122 HydrophobicContact CD1-CD1 4.4Å; I1089-Y1122 HydrophobicContact CD1-CD2 3.49Å; I1089-Y1122 VanDerWaalsContact CD1-CD2 3.49Å; I1089-Y1122 HydrophobicContact CD1-CE2 3.8Å; I1089-Y1122 HydrophobicContact CD1-CG 3.82Å; I1089-Y1122 HydrophobicContact CG2-CD1 4.49Å; R1120-Y1122 PolarHBondContact O-N 3.18Å; Y1122-P1124 HydrophobicContact CE1-CB 3.96Å; Y1122-P1124 WeakPolarHBondContact O-CD 3.39Å
1123	N	78.4	Confident	67.2	Low	148 Å²	148	99.9 Å²	99.9	79%	0.791	54%	0.539	S	S	*	.			trans	-95.3	107.6	173.7	-160.9	27.1	0	0	0	108.9	P1121	P1121-N1123 PolarHBondContact O-N 3.32Å
1124	P	70.1	Confident	64.5	Low	70 Å²	70	105 Å²	105	46%	0.455	58%	0.577	S	S	.	*			trans	-66.7	139.7	-175.9	27.3	-34.6	0	0	0	111	Y1122 S1126	Y1122-P1124 HydrophobicContact CE1-CB 3.96Å; Y1122-P1124 WeakPolarHBondContact O-CD 3.39Å; P1124-S1126 PolarHBondContact O-N 3.04Å; P1124-S1126 VanDerWaalsContact O-N 3.11Å
1125	P	65.9	Low	61.8	Low	108 Å²	108	110.5 Å²	110.5	70%	0.701	61%	0.61	S	S	*	*			trans	-64.6	115	179.3	25.6	-33.1	0	0	0	110.5	Q1127	P1125-Q1127 PolarHBondContact O-N 2.69Å
1126	S	37.7	Very low	59	Low	104 Å²	104	116.7 Å²	116.7	73%	0.727	64%	0.643	S	S	*	*			trans	-65	113.6	-179.7	49.7	0	0	0	0	111	P1124 T1128	P1124-S1126 PolarHBondContact O-N 3.04Å; P1124-S1126 VanDerWaalsContact O-N 3.11Å; S1126-T1128 PolarHBondContact O-N 3.3Å; S1126-T1128 VanDerWaalsContact O-N 3.07Å
1127	Q	31	Very low	56.4	Low	197 Å²	197	124.8 Å²	124.8	92%	0.921	68%	0.678	S	S	*	*			trans	-75.1	96.3	175.1	-67	-171.2	13.2	0	0	110.6	P1125	P1125-Q1127 PolarHBondContact O-N 2.69Å
1128	T	33.9	Very low	53.8	Low	114 Å²	114	127.8 Å²	127.8	70%	0.699	69%	0.688	S	S	*	*			trans	-133.9	123.5	168.9	17.6	0	0	0	0	109.7	S1126	S1126-T1128 PolarHBondContact O-N 3.3Å; S1126-T1128 VanDerWaalsContact O-N 3.07Å
1129	E	33.7	Very low	51.2	Low	190 Å²	190	129 Å²	129	89%	0.888	71%	0.705	S	S	*	*			trans	61.4	69.1	160.1	-51.8	-160.6	173.6	0	0	118.9
1130	K	31.9	Very low	48.5	Very low	209 Å²	209	135.5 Å²	135.5	91%	0.909	74%	0.737	S	S	*	*			trans	-85.9	95.7	139.2	-77.1	-174.7	175.2	-178.2	0	109.4
1131	S	35.6	Very low	45.9	Very low	114 Å²	114	134.7 Å²	134.7	80%	0.797	75%	0.747	S	S	*	*			trans	-168.9	85.9	165.7	-89.4	0	0	0	0	113.6
1132	S	36.7	Very low	43.2	Very low	113 Å²	113	135.2 Å²	135.2	79%	0.79	75%	0.753	S	S	*	*			trans	-179.5	139.8	139.3	40.2	0	0	0	0	113.7
1133	N	34.1	Very low	40.7	Very low	154 Å²	154	135.4 Å²	135.4	82%	0.824	77%	0.77	S	S	*	*			trans	45.9	100.6	150.2	-57.2	-10	0	0	0	120.6
1134	S	35.8	Very low	38.5	Very low	128 Å²	128	136.4 Å²	136.4	90%	0.895	77%	0.77	S	S	*	*				-141.9	161	116.9	-163.5	0	0	0	0	110.1
1135	V	37.8	Very low	36.8	Very low	115 Å²	115	139.3 Å²	139.3	70%	0.697	78%	0.78	S	S	*	*			trans	-117.8	134.5	-154.5	170.8	0	0	0	0	113.3
1136	N	34	Very low	35.5	Very low	139 Å²	139	140.7 Å²	140.7	74%	0.743	78%	0.78	S	S	*	*			trans	23	116.2	157.6	-58.3	-20.5	0	0	0	119.4
1137	Q	37.8	Very low	35.4	Very low	204 Å²	204	142.3 Å²	142.3	95%	0.953	78%	0.781	S	S	*	*				-141.6	131.7	126.5	-116.6	160.3	89.4	0	0	110.9
1138	H	37.1	Very low	35.8	Very low	178 Å²	178	137.9 Å²	137.9	82%	0.824	77%	0.768	S	S	*	*			trans	-115.5	178.9	179.4	-108.5	-30.9	0	0	0	107.2
1139	P	40.2	Very low	36	Very low	98 Å²	98	139.4 Å²	139.4	64%	0.636	77%	0.771	S	S	*	*			cis	-137.5	-175.2	10.4	31.3	-7.8	0	0	0	115.6
1140	I	37.1	Very low	36.5	Very low	153 Å²	153	143.3 Å²	143.3	79%	0.785	79%	0.789	S	S	*	*			trans	67.6	143.4	147.6	-78.2	156.7	0	0	0	119.5
1141	V	37.7	Very low	36.7	Very low	120 Å²	120	140 Å²	140	73%	0.727	78%	0.784	S	S	*	*			cis	-162.8	142.9	-41	108.2	0	0	0	0	108.8
1142	S	32.5	Very low	36.8	Very low	110 Å²	110	141.4 Å²	141.4	77%	0.769	78%	0.783	S	S	*	*			trans	57.4	139.1	161	-65.6	0	0	0	0	122.7
1143	A	34.7	Very low	36.8	Very low	77 Å²	77	142.9 Å²	142.9	64%	0.636	78%	0.782	S	S	*	*			trans	76.3	97.7	138.7	0	0	0	0	0	120.9
1144	Q	33.9	Very low	36.9	Very low	169 Å²	169	142.3 Å²	142.3	79%	0.79	78%	0.78	S	S	*	*				81.9	145.8	117.5	-77.8	172.1	-94.7	0	0	121.6
1145	I	34.8	Very low	37	Very low	132 Å²	132	143.2 Å²	143.2	68%	0.677	77%	0.773	S	S	*	*			trans	86.4	95.3	143.3	-77.4	164.1	0	0	0	118.3
1146	I	37.2	Very low	36.9	Very low	136 Å²	136	145.1 Å²	145.1	70%	0.697	78%	0.778	S	S	*	*				79.1	127.4	121.1	-69.6	177.5	0	0	0	119.8
1147	N	36.6	Very low	37.2	Very low	138 Å²	138	145.5 Å²	145.5	74%	0.738	78%	0.78	S	S	*	*			trans	80.1	108.3	151	-74.3	7.1	0	0	0	123.5
1148	T	38.8	Very low	37.1	Very low	105 Å²	105	141 Å²	141	64%	0.644	77%	0.767	S	S	*	*				60	146.4	115.4	0	0	0	0	0	123.9
1149	D	39.2	Very low	37.1	Very low	145 Å²	145	137.9 Å²	137.9	78%	0.775	76%	0.762	S	S	*	*			trans	62.5	91.7	152	-57.8	-33.7	0	0	0	119.7
1150	Q	42.7	Very low	36.8	Very low	272 Å²	272	141.5 Å²	141.5	100%	1.271	77%	0.774	S	S	*	*				-150.9	0	104	-107.8	177.8	25.9	0	0	111.9

Retrieved 1,150 of 1,150 residues in 662.4 ms (Link to these results)

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