A0A087YLQ9_POEFO Loading...

Kinesin family member 27

AlphaFold DB , UniProt , Accession A0A087YLQ9, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 1,269 aa.

						>A0A087YLQ9_POEFO|A0A087YLQ9
MSEVCVRVAVRIRPLLRKELLHQHQVCVQVVPSGSGQVRLGSDRLFSFDHAFGPTASQDEVYESCVQPLVESLLDGYNATVFCYGQTGSGKTYTLGGGSKGNLLADEGGIIDCVAEDVFLLLAKRKNDDSIEATVQISYMELYREELRDLLDMNTNHKELLIRDDEKGNTVVIGAREMVVTSAEELLGAVEMGNALRHTGATGMNEHSSRSHVILTLQVRIRSHSNNNPPLKTVRSSKLCLVDLAGSERASKTGNTGAQFKESALINTGLLALGNVIRALSDRGRSRRGNGCSSPHVPYRDAKITRLLRDSLGGNAHTVMVACVSPSHHFIAETLNVLQFASRARHIRNCPGRALSLTDVKSDPKTCQPAETRLEELVYEVQTLRELLKEKEKDMKEMEREKTRGGGGDGDGFKQPSQITASTLDKRPNQDTAAQYLFLAKEAASLLADMSKAFPSVLFRQRLQEWQERLAAVSQSHHTGSTDCSEGAGDHQLHVTNLNLREELRKCQEALQEKKQLLEEKDEELRRIRREVEKLLDEKRNRVLATEEEKERSRIQTEQLVSQQVLIDRLRSSLVAARGMTPGATEEARPSGNSCTRPQSVPLITHSLLHRPSRKIHSSPPTCSLERVMTAFRMRGHLLLAEIEEKDKVYCPFITQQVESKERTQNNHEEETKEEEAETERSLCRTEFRCTMPRSEDVINTLFPVNTLGPCLDEQNCGSHNFPMHSIKSLLANNINENAVKKVRRANTAERRIHELKVSMRLKEELIKELDTTGELTWFYVAVCREMEQKVLIGLELNPSGLYTSRLTLTQIHYQEVKINLKINCFLPTERKIQAVDRGEMGNVLERLSMQSQQVRAEVYRSLQSMRLERARLQSSLRELDETNSRKPHRNRNFNYFKIQKHLIFAGHHCVVVILCSCVQGLKSSSVPENSPVETNRMLHDSSWLEEEEERAIHQRAELQELGEELKRKVEVLQHREACVQQKNKLHIKMLQSSQALSRDLLQVSVQLESVEEQLQSQSSVRKTRGVTVRELEKERDMLKMKRDTLEAQLRDNRVLTVEEEHSLIQLEEAVEALDAALEFKNNSIQERQKHLFIGNSPLLESKDTEPAQHCDVTRKLKKLSLPEAIELLIKYFNKVVCLREAERRLHLQCEELELHAGEQEAALREMEAAMQRFALDADRRLTLQHREHQSNVRLLLQKLKGFLLYRSCVSGYLEGMSGEAQQAIQDRVQHLEKELFFYKSSSRQLKKKLKELLSDAPYNDNQSSHTQE
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	51.6	Low	87.5	Confident	201 Å²	201	50.2 Å²	50.2	99%	0.99	27%	0.267	S	S	*	.				0	139.3	0	-66.6	168.3	177	0	0	107.6
2	S	73.1	Confident	88.2	Confident	82 Å²	82	46.1 Å²	46.1	57%	0.573	25%	0.245	S	C	*	.			trans	-85.1	130	175.4	33.4	0	0	0	0	110.4	V4	S2-V4 PolarHBondContact O-N 3.35Å
3	E	83.1	Confident	88.6	Confident	78 Å²	78	44.5 Å²	44.5	36%	0.364	23%	0.234	S	C	.	.			trans	-69.1	122.5	164.7	-69.5	-178.4	173.3	0	0	108.2	R287 R348	E3-R287 IonicContact OE1-CZ 2.72Å; E3-R287 VanDerWaalsContact OE1-CZ 3.31Å; E3-R287 IonicContact OE1-NH1 2.79Å; E3-R287 PolarHBondContact OE1-NH1 3.28Å; E3-R287 IonicContact OE1-NH2 3.95Å; E3-R287 PolarHBondContact OE1-NH2 2.84Å; E3-R287 IonicContact OE2-NH1 3.77Å; E3-R287 PolarHBondContact OE2-NH1 2.97Å; E3-R287 VanDerWaalsContact OE2-NH1 3.16Å; E3-R348 HydrophobicContact CB-CB 4.5Å; E3-R348 VanDerWaalsContact OE2-CD 3.29Å; E3-R348 WeakPolarHBondContact OE2-CD 3.44Å; E3-R348 IonicContact OE2-CZ 2.74Å; E3-R348 IonicContact OE2-NE 3.58Å; E3-R348 IonicContact OE2-NH1 2.77Å; E3-R348 PolarHBondContact OE2-NH1 3.16Å
4	V	90.3	Very high	88.8	Confident	46 Å²	46	46.7 Å²	46.7	28%	0.279	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	132.9	177.7	-177.3	0	0	0	0	108.9	S2 R348 N349 P351	S2-V4 PolarHBondContact O-N 3.35Å; V4-R348 WeakPolarHBondContact O-CA 3.42Å; V4-N349 PolarHBondContact N-O 3.06Å; V4-N349 PolarHBondContact O-N 2.71Å; V4-P351 HydrophobicContact CB-CG 4.21Å; V4-P351 HydrophobicContact CG2-CG 3.83Å
5	C	91.8	Very high	88.9	Confident	60 Å²	60	46.1 Å²	46.1	41%	0.405	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	147.9	177.1	-66.5	0	0	0	0	111.8	R7 I347	C5-R7 PolarHBondContact O-N 3.37Å; C5-I347 VanDerWaalsContact CA-O 3.27Å; C5-I347 WeakPolarHBondContact CA-O 3.43Å
6	V	94.6	Very high	88.8	Confident	1 Å²	1	48.4 Å²	48.4	1%	0.006	26%	0.26	C	S	.	.	P	Polyproline II helix	trans	-63.8	122.7	168.2	175	0	0	0	0	108.7	T318 I347	V6-T318 HydrophobicContact CG1-CG2 4.13Å; V6-I347 HydrophobicContact CB-CB 4.39Å; V6-I347 HydrophobicContact CG2-CB 3.8Å; V6-I347 HydrophobicContact CG2-CG2 3.8Å; V6-I347 PolarHBondContact N-O 3.2Å
7	R	95.4	Very high	88.5	Confident	69 Å²	69	58.4 Å²	58.4	26%	0.26	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	143.4	176.5	-70.5	-166.2	-66.5	155.3	1	109.9	C5 C65 T318 V319 M320	C5-R7 PolarHBondContact O-N 3.37Å; R7-C65 PolarHBondContact NH2-O 3.29Å; R7-T318 PolarHBondContact N-O 3.17Å; R7-V319 HydrophobicContact CB-CG2 3.93Å; R7-V319 CarbonylContact O-C 3.53Å; R7-V319 WeakPolarHBondContact O-CA 3.36Å; R7-M320 PolarHBondContact O-N 3.4Å
8	V	96.2	Very high	88.1	Confident	0 Å²	0	64.4 Å²	64.4	0%	0	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	121.1	-177.6	-176.9	0	0	0	0	110.5	F48 D49 H50 M320 A341 A344 R345	V8-F48 HydrophobicContact CB-CD1 4.3Å; V8-F48 HydrophobicContact CG1-CD1 3.66Å; V8-F48 HydrophobicContact CG1-CE1 4.25Å; V8-D49 PolarHBondContact N-OD2 3.1Å; V8-D49 WeakPolarHBondContact O-CB 3.17Å; V8-D49 PolarHBondContact O-N 3.41Å; V8-H50 PolarHBondContact O-N 3.42Å; V8-M320 HydrophobicContact CG1-SD 4.46Å; V8-M320 HydrophobicContact CG2-CB 4.29Å; V8-A341 HydrophobicContact CG1-CB 3.79Å; V8-A344 HydrophobicContact CG2-CB 4.34Å; V8-R345 HydrophobicContact CB-CB 4.34Å; V8-R345 HydrophobicContact CB-CG 4.47Å; V8-R345 HydrophobicContact CG2-CB 3.67Å; V8-R345 HydrophobicContact CG2-CG 4.13Å
9	A	95.8	Very high	88.1	Confident	1 Å²	1	61.4 Å²	61.4	1%	0.008	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	138.8	170.7	0	0	0	0	0	110	H50 F52 M320 A322	A9-H50 WeakPolarHBondContact CA-O 3.19Å; A9-H50 HydrophobicContact CB-CB 4.04Å; A9-F52 HydrophobicContact CB-CD2 4.43Å; A9-F52 HydrophobicContact CB-CE2 3.94Å; A9-M320 PolarHBondContact N-O 3.16Å; A9-A322 PolarHBondContact O-N 3.43Å
10	V	96.2	Very high	88	Confident	0 Å²	0	63.5 Å²	63.5	0%	0	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	134.8	167	176.6	0	0	0	0	109.1	I12 V38 F48 H50 F52 A322 V324 L338	V10-I12 HydrophobicContact CG1-CG1 4.37Å; V10-V38 HydrophobicContact CB-CG2 4.14Å; V10-V38 HydrophobicContact CG1-CG2 4.08Å; V10-V38 HydrophobicContact CG2-CG2 4.5Å; V10-F48 HydrophobicContact CB-CD2 4.34Å; V10-F48 HydrophobicContact CG2-CB 4.42Å; V10-F48 HydrophobicContact CG2-CD1 3.97Å; V10-F48 HydrophobicContact CG2-CD2 3.4Å; V10-F48 HydrophobicContact CG2-CE1 4.04Å; V10-F48 HydrophobicContact CG2-CE2 3.47Å; V10-F48 VanDerWaalsContact CG2-CE2 3.47Å; V10-F48 HydrophobicContact CG2-CG 3.65Å; V10-F48 HydrophobicContact CG2-CZ 3.8Å; V10-H50 PolarHBondContact N-O 3.11Å; V10-F52 PolarHBondContact O-N 3.33Å; V10-A322 WeakPolarHBondContact CA-O 3.41Å; V10-A322 HydrophobicContact CG2-CB 4.12Å; V10-V324 HydrophobicContact CG1-CG2 3.99Å; V10-L338 HydrophobicContact CG1-CD2 4.04Å; V10-L338 HydrophobicContact CG2-CD2 3.88Å
11	R	95	Very high	87.9	Confident	14 Å²	14	67.1 Å²	67.1	5%	0.053	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	116.6	171.4	-166	179.1	-167.9	-168	9.7	110.4	F52 A56 S57 T94 A322 V324	R11-F52 HydrophobicContact CB-CB 4.43Å; R11-F52 HydrophobicContact CG-CB 4.12Å; R11-A56 PolarHBondContact NH2-O 3.11Å; R11-A56 VanDerWaalsContact NH2-O 3.16Å; R11-S57 PolarHBondContact NH2-O 3.31Å; R11-S57 VanDerWaalsContact NH2-O 3.1Å; R11-T94 PolarHBondContact NH1-OG1 3.33Å; R11-A322 PolarHBondContact N-O 3.13Å; R11-V324 PolarHBondContact O-N 3.45Å
12	I	94.9	Very high	89.4	Confident	1 Å²	1	64.1 Å²	64.1	1%	0.005	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	112.4	173	-48.1	174.2	0	0	0	107.2	V10 V28 V30 V38 F52 G53 P54 V324 P326	V10-I12 HydrophobicContact CG1-CG1 4.37Å; I12-V28 HydrophobicContact CD1-CB 4.19Å; I12-V28 HydrophobicContact CD1-CG1 3.69Å; I12-V28 HydrophobicContact CG1-CG1 4.19Å; I12-V28 HydrophobicContact CG2-CB 4.44Å; I12-V30 HydrophobicContact CD1-CG2 3.76Å; I12-V38 HydrophobicContact CD1-CG1 4.23Å; I12-F52 PolarHBondContact N-O 3.21Å; I12-G53 CarbonylContact O-C 3.59Å; I12-G53 VanDerWaalsContact O-C 3.25Å; I12-P54 HydrophobicContact CG2-CG 4.18Å; I12-P54 VanDerWaalsContact O-CA 3.26Å; I12-P54 WeakPolarHBondContact O-CA 3.34Å; I12-V324 HydrophobicContact CB-CG2 4.21Å; I12-V324 HydrophobicContact CG1-CG2 3.76Å; I12-V324 HydrophobicContact CG2-CG2 4.4Å; I12-P326 HydrophobicContact CG2-CB 3.96Å; I12-P326 HydrophobicContact CG2-CG 4.49Å
13	R	93.3	Very high	90	Very high	25 Å²	25	65.7 Å²	65.7	9%	0.094	32%	0.316	C	S	.	.	P	Polyproline II helix	trans	-74.6	162.1	174.6	64.3	150.4	176.8	71.6	-3.2	111.7	E19 G88 V324 S325 P326	R13-E19 IonicContact CZ-OE1 3.87Å; R13-E19 IonicContact CZ-OE2 2.71Å; R13-E19 IonicContact NH1-OE1 3.69Å; R13-E19 IonicContact NH1-OE2 3.89Å; R13-E19 PolarHBondContact NH1-OE2 3.36Å; R13-E19 VanDerWaalsContact NH2-CD 3.31Å; R13-E19 IonicContact NH2-OE1 3.01Å; R13-E19 PolarHBondContact NH2-OE1 2.94Å; R13-E19 IonicContact NH2-OE2 2.65Å; R13-E19 PolarHBondContact NH2-OE2 3.02Å; R13-G88 VanDerWaalsContact CZ-O 3.28Å; R13-G88 PolarHBondContact NE-O 2.77Å; R13-G88 PolarHBondContact NH2-O 2.8Å; R13-V324 PolarHBondContact N-O 2.82Å; R13-S325 PolarHBondContact NH2-OG 2.94Å; R13-P326 WeakPolarHBondContact O-CD 3.5Å; R13-P326 VanDerWaalsContact O-CG 3.27Å; R13-P326 WeakPolarHBondContact O-CG 3.37Å
14	P	92	Very high	90.3	Very high	76 Å²	76	63 Å²	63	49%	0.494	30%	0.303	S	S	.	.	P	Polyproline II helix	trans	-62.2	162.6	166.6	26.1	-35	0	0	0	112.8	P54	P14-P54 HydrophobicContact CB-CB 4.32Å
15	L	89.8	Confident	90.2	Very high	38 Å²	38	67.8 Å²	67.8	20%	0.199	32%	0.322	C	S	.	.	P	Polyproline II helix	trans	-65.5	129.8	171	-76.8	166.2	0	0	0	110	E19 L20 H24 V26 P326	L15-E19 WeakPolarHBondContact CA-OE2 3.33Å; L15-E19 HydrophobicContact CD2-CB 3.96Å; L15-L20 HydrophobicContact CB-CD2 3.71Å; L15-L20 HydrophobicContact CB-CG 3.95Å; L15-L20 HydrophobicContact CD1-CD2 3.82Å; L15-L20 HydrophobicContact CG-CD2 4.41Å; L15-H24 VanDerWaalsContact CD1-O 3.28Å; L15-H24 WeakPolarHBondContact CD1-O 3.43Å; L15-H24 HydrophobicContact CD2-CB 4.06Å; L15-V26 HydrophobicContact CD1-CG2 3.67Å; L15-V26 HydrophobicContact CG-CG2 4.3Å; L15-P326 HydrophobicContact CD2-CG 3.8Å; L15-P326 HydrophobicContact CG-CG 3.84Å
16	L	88.2	Confident	90.2	Very high	83 Å²	83	68.2 Å²	68.2	44%	0.435	32%	0.323	S	S	.	.	P	Polyproline II helix	trans	-73.5	155.3	178.4	-61.6	174.2	0	0	0	110.8	K18 E19 L20	L16-K18 PolarHBondContact O-N 3.46Å; L16-K18 VanDerWaalsContact O-N 3.1Å; L16-E19 HydrophobicContact CB-CG 4.2Å; L16-E19 PolarHBondContact N-OE2 3.25Å; L16-E19 WeakPolarHBondContact O-CA 3.37Å; L16-E19 WeakPolarHBondContact O-CB 3.17Å; L16-E19 PolarHBondContact O-N 3.12Å; L16-L20 PolarHBondContact O-N 3.04Å
17	R	83.6	Confident	90	Very high	217 Å²	217	68.9 Å²	68.9	82%	0.819	33%	0.328	S	S	*	.	H	α-helix	trans	-49.9	-40.5	175.5	-66.7	-175.9	-178.4	176.1	0.7	112.9	E19 L20 L21	R17-E19 PolarHBondContact O-N 2.93Å; R17-L20 PolarHBondContact O-N 2.79Å; R17-L21 WeakPolarHBondContact O-CB 3.36Å; R17-L21 WeakPolarHBondContact O-CD1 3.5Å; R17-L21 VanDerWaalsContact O-CG 3.23Å; R17-L21 WeakPolarHBondContact O-CG 3.48Å; R17-L21 PolarHBondContact O-N 2.79Å
18	K	81	Confident	89.8	Confident	167 Å²	167	65.7 Å²	65.7	73%	0.726	32%	0.316	S	S	*	.	H	α-helix	trans	-62.2	-38.9	174.3	-69.8	-175.7	178.5	179	0	112.8	L16 H22	L16-K18 PolarHBondContact O-N 3.46Å; L16-K18 VanDerWaalsContact O-N 3.1Å; K18-H22 PolarHBondContact O-N 2.77Å; K18-H22 PolarHBondContact O-ND1 3.13Å
19	E	87.9	Confident	89.5	Confident	8 Å²	8	70.8 Å²	70.8	4%	0.037	34%	0.34	C	S	.	.	H	α-helix	trans	-73.3	-37.9	179.3	-62.4	176.7	139.5	0	0	111.3	R13 L15 L16 R17 H22 Q23 H24 S325 F330	R13-E19 IonicContact CZ-OE1 3.87Å; R13-E19 IonicContact CZ-OE2 2.71Å; R13-E19 IonicContact NH1-OE1 3.69Å; R13-E19 IonicContact NH1-OE2 3.89Å; R13-E19 PolarHBondContact NH1-OE2 3.36Å; R13-E19 VanDerWaalsContact NH2-CD 3.31Å; R13-E19 IonicContact NH2-OE1 3.01Å; R13-E19 PolarHBondContact NH2-OE1 2.94Å; R13-E19 IonicContact NH2-OE2 2.65Å; R13-E19 PolarHBondContact NH2-OE2 3.02Å; L15-E19 WeakPolarHBondContact CA-OE2 3.33Å; L15-E19 HydrophobicContact CD2-CB 3.96Å; L16-E19 HydrophobicContact CB-CG 4.2Å; L16-E19 PolarHBondContact N-OE2 3.25Å; L16-E19 WeakPolarHBondContact O-CA 3.37Å; L16-E19 WeakPolarHBondContact O-CB 3.17Å; L16-E19 PolarHBondContact O-N 3.12Å; R17-E19 PolarHBondContact O-N 2.93Å; E19-H22 CarbonylContact O-C 3.56Å; E19-H22 PolarHBondContact O-N 3.41Å; E19-Q23 PolarHBondContact O-N 3.25Å; E19-H24 WeakPolarHBondContact CA-ND1 3.11Å; E19-H24 HydrophobicContact CB-CB 3.95Å; E19-H24 VanDerWaalsContact CB-ND1 3.29Å; E19-H24 WeakPolarHBondContact CB-ND1 3.5Å; E19-H24 WeakPolarHBondContact CG-ND1 3.41Å; E19-H24 VanDerWaalsContact O-CB 3.28Å; E19-H24 WeakPolarHBondContact O-CB 3.36Å; E19-H24 PolarHBondContact O-N 2.96Å; E19-S325 PolarHBondContact OE1-OG 3.03Å; E19-F330 WeakPolarHBondContact OE1-CE2 3.34Å
20	L	86.7	Confident	89.2	Confident	102 Å²	102	72.7 Å²	72.7	53%	0.534	35%	0.351	S	S	.	.	H	α-helix	trans	-64.4	-43	173.6	-64.7	171.3	0	0	0	112	L15 L16 R17 H22 Q23	L15-L20 HydrophobicContact CB-CD2 3.71Å; L15-L20 HydrophobicContact CB-CG 3.95Å; L15-L20 HydrophobicContact CD1-CD2 3.82Å; L15-L20 HydrophobicContact CG-CD2 4.41Å; L16-L20 PolarHBondContact O-N 3.04Å; R17-L20 PolarHBondContact O-N 2.79Å; L20-H22 VanDerWaalsContact C-N 3.25Å; L20-H22 PolarHBondContact O-N 2.97Å; L20-Q23 PolarHBondContact O-N 2.86Å
21	L	85.3	Confident	88.7	Confident	141 Å²	141	73.9 Å²	73.9	74%	0.738	36%	0.358	S	S	*	.	H	α-helix	trans	-61.5	-31.2	175.3	-74.6	166.2	0	0	0	113.1	R17 Q23	R17-L21 WeakPolarHBondContact O-CB 3.36Å; R17-L21 WeakPolarHBondContact O-CD1 3.5Å; R17-L21 VanDerWaalsContact O-CG 3.23Å; R17-L21 WeakPolarHBondContact O-CG 3.48Å; R17-L21 PolarHBondContact O-N 2.79Å; L21-Q23 VanDerWaalsContact C-N 3.32Å
22	H	83.2	Confident	87.5	Confident	138 Å²	138	78.1 Å²	78.1	64%	0.639	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.5	15.4	173.6	-64.9	83.1	0	0	0	112.9	K18 E19 L20 H24	K18-H22 PolarHBondContact O-N 2.77Å; K18-H22 PolarHBondContact O-ND1 3.13Å; E19-H22 CarbonylContact O-C 3.56Å; E19-H22 PolarHBondContact O-N 3.41Å; L20-H22 VanDerWaalsContact C-N 3.25Å; L20-H22 PolarHBondContact O-N 2.97Å; H22-H24 VanDerWaalsContact C-N 3.27Å; H22-H24 PolarHBondContact O-CD2 3.48Å; H22-H24 PolarHBondContact O-N 2.79Å
23	Q	85.6	Confident	85.4	Confident	114 Å²	114	83.7 Å²	83.7	53%	0.533	43%	0.427	S	S	.	.	T	Hydrogen-bonded Turn	trans	55.3	37.1	174.7	-52.8	-169.8	-44.2	0	0	114.2	E19 L20 L21 Q25 N1260	E19-Q23 PolarHBondContact O-N 3.25Å; L20-Q23 PolarHBondContact O-N 2.86Å; L21-Q23 VanDerWaalsContact C-N 3.32Å; Q23-Q25 PolarHBondContact O-N 3.01Å; Q23-N1260 PolarHBondContact NE2-OD1 3.25Å
24	H	89.7	Confident	83.7	Confident	21 Å²	21	86.9 Å²	86.9	10%	0.097	47%	0.467	C	S	.	.			trans	-66.8	101.7	180	-72.1	-176.9	0	0	0	112.4	L15 E19 H22 S327 H329	L15-H24 VanDerWaalsContact CD1-O 3.28Å; L15-H24 WeakPolarHBondContact CD1-O 3.43Å; L15-H24 HydrophobicContact CD2-CB 4.06Å; E19-H24 WeakPolarHBondContact CA-ND1 3.11Å; E19-H24 HydrophobicContact CB-CB 3.95Å; E19-H24 VanDerWaalsContact CB-ND1 3.29Å; E19-H24 WeakPolarHBondContact CB-ND1 3.5Å; E19-H24 WeakPolarHBondContact CG-ND1 3.41Å; E19-H24 VanDerWaalsContact O-CB 3.28Å; E19-H24 WeakPolarHBondContact O-CB 3.36Å; E19-H24 PolarHBondContact O-N 2.96Å; H22-H24 VanDerWaalsContact C-N 3.27Å; H22-H24 PolarHBondContact O-CD2 3.48Å; H22-H24 PolarHBondContact O-N 2.79Å; H24-S327 WeakPolarHBondContact CB-OG 3.29Å; H24-S327 PolarHBondContact ND1-OG 2.92Å; H24-H329 AromaticContact CD2-CE1 3.85Å; H24-H329 AromaticContact CD2-CG 3.98Å; H24-H329 AromaticContact CD2-ND1 3.64Å; H24-H329 AromaticContact NE2-CD2 3.7Å; H24-H329 AromaticContact NE2-CE1 3.89Å; H24-H329 AromaticContact NE2-CG 3.61Å; H24-H329 AromaticContact NE2-ND1 3.73Å; H24-H329 AromaticContact NE2-NE2 3.91Å
25	Q	88.8	Confident	82.5	Confident	147 Å²	147	85.8 Å²	85.8	69%	0.687	46%	0.461	S	S	*	.			trans	-55.8	146.2	167.6	-60.6	-177.6	-6.3	0	0	112.5	Q23 H328	Q23-Q25 PolarHBondContact O-N 3.01Å; Q25-H328 PolarHBondContact N-CE1 2.79Å; Q25-H328 PolarHBondContact N-ND1 3.16Å; Q25-H328 VanDerWaalsContact N-ND1 3.1Å; Q25-H328 PolarHBondContact O-N 3.38Å; Q25-H328 PolarHBondContact O-ND1 2.94Å; Q25-H328 VanDerWaalsContact O-ND1 3.08Å
26	V	91.4	Very high	82.1	Confident	70 Å²	70	84.5 Å²	84.5	42%	0.424	46%	0.457	S	S	.	.	B	Isolated β-bridge	trans	-76.9	122.8	176	176.2	0	0	0	0	110.7	L15 V28 Q29 P326	L15-V26 HydrophobicContact CD1-CG2 3.67Å; L15-V26 HydrophobicContact CG-CG2 4.3Å; V26-V28 WeakPolarHBondContact CG1-O 3.49Å; V26-Q29 HydrophobicContact CG1-CG 4.17Å; V26-P326 CarbonylContact C-O 3.58Å; V26-P326 WeakPolarHBondContact CA-O 3.47Å; V26-P326 HydrophobicContact CG1-CB 4.11Å; V26-P326 HydrophobicContact CG2-CB 4.44Å
27	C	90.4	Very high	82.1	Confident	15 Å²	15	83.4 Å²	83.4	10%	0.101	45%	0.45	C	S	.	.			trans	-109.7	-4.6	176.5	74.1	0	0	0	0	114.4	L40 G41 P326 H328 I331	C27-L40 WeakPolarHBondContact O-CA 3.35Å; C27-G41 PolarHBondContact O-N 2.98Å; C27-P326 PolarHBondContact N-O 2.65Å; C27-P326 PolarHBondContact SG-O 3.43Å; C27-H328 HydrophobicContact CB-CB 3.92Å; C27-I331 HydrophobicContact CB-CD1 4.19Å; C27-I331 HydrophobicContact CB-CG1 4.46Å
28	V	91.7	Very high	82.5	Confident	2 Å²	2	73 Å²	73	1%	0.012	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	130.1	-178.1	-155.4	0	0	0	0	109.5	I12 V26 V38 R39 L40 S325 T334	I12-V28 HydrophobicContact CD1-CB 4.19Å; I12-V28 HydrophobicContact CD1-CG1 3.69Å; I12-V28 HydrophobicContact CG1-CG1 4.19Å; I12-V28 HydrophobicContact CG2-CB 4.44Å; V26-V28 WeakPolarHBondContact CG1-O 3.49Å; V28-V38 HydrophobicContact CG1-CG1 3.5Å; V28-V38 VanDerWaalsContact CG1-CG1 3.5Å; V28-R39 WeakPolarHBondContact CA-O 3.47Å; V28-L40 HydrophobicContact CG2-CD1 3.89Å; V28-S325 WeakPolarHBondContact CG2-O 3.41Å; V28-T334 HydrophobicContact CG2-CG2 3.77Å
29	Q	89.1	Confident	83	Confident	107 Å²	107	68.7 Å²	68.7	50%	0.5	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	143.2	178.3	-65	177.8	-5.8	0	0	110.3	V26 R39	V26-Q29 HydrophobicContact CG1-CG 4.17Å; Q29-R39 PolarHBondContact N-O 2.85Å; Q29-R39 PolarHBondContact O-N 3.46Å
30	V	89.4	Confident	83.2	Confident	40 Å²	40	68.7 Å²	68.7	24%	0.242	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	141	165.5	-173.1	0	0	0	0	108.3	I12 A51	I12-V30 HydrophobicContact CD1-CG2 3.76Å; V30-A51 HydrophobicContact CG1-CB 4.1Å
31	V	85.3	Confident	83	Confident	26 Å²	26	65.7 Å²	65.7	16%	0.158	38%	0.384	C	S	.	.	P	Polyproline II helix	trans	-78.2	127.4	171.4	-174.8	0	0	0	0	108.3	Q37 R39 L45	V31-Q37 HydrophobicContact CB-CB 4.01Å; V31-Q37 HydrophobicContact CG2-CB 3.8Å; V31-Q37 PolarHBondContact N-O 2.86Å; V31-R39 HydrophobicContact CG2-CB 4.38Å; V31-L45 HydrophobicContact CG2-CD2 3.65Å
32	P	70.6	Confident	82.5	Confident	102 Å²	102	63.3 Å²	63.3	66%	0.662	38%	0.379	S	S	*	.	S	Bend	trans	-52.4	148	-175.1	-30.2	36.1	0	0	0	114.8
33	S	50.2	Low	82.1	Confident	118 Å²	118	63.3 Å²	63.3	83%	0.825	38%	0.384	S	S	*	.	S	Bend	trans	62.8	91.3	170.8	-56	0	0	0	0	116.6	S35	S33-S35 PolarHBondContact O-N 2.72Å
34	G	57.8	Low	82.2	Confident	92 Å²	92	64.6 Å²	64.6	95%	0.948	38%	0.384	S	S	*	.	S	Bend	trans	68	-4.8	152.2	0	0	0	0	0	118.7	G36	G34-G36 PolarHBondContact O-N 2.79Å
35	S	66.4	Low	82.3	Confident	53 Å²	53	68.1 Å²	68.1	37%	0.371	40%	0.403	S	S	.	.	S	Bend	trans	-80.3	-9.6	-168.9	64.7	0	0	0	0	115.8	S33 Q37	S33-S35 PolarHBondContact O-N 2.72Å; S35-Q37 WeakPolarHBondContact O-CG 3.43Å; S35-Q37 PolarHBondContact O-N 3Å
36	G	81.1	Confident	82.5	Confident	11 Å²	11	62.6 Å²	62.6	11%	0.113	38%	0.376	C	S	.	.			trans	64.6	19.3	-173.3	0	0	0	0	0	113.9	G34 F48	G34-G36 PolarHBondContact O-N 2.79Å; G36-F48 PolarHBondContact O-N 2.72Å
37	Q	89.8	Confident	82.5	Confident	60 Å²	60	61.9 Å²	61.9	28%	0.28	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	140.3	-173.1	-61.2	-173	8.5	0	0	113.7	V31 S35 F46	V31-Q37 HydrophobicContact CB-CB 4.01Å; V31-Q37 HydrophobicContact CG2-CB 3.8Å; V31-Q37 PolarHBondContact N-O 2.86Å; S35-Q37 WeakPolarHBondContact O-CG 3.43Å; S35-Q37 PolarHBondContact O-N 3Å; Q37-F46 CarbonylContact C-O 3.18Å; Q37-F46 VanDerWaalsContact CA-O 3.28Å; Q37-F46 WeakPolarHBondContact CA-O 3.46Å
38	V	91.9	Very high	82.7	Confident	0 Å²	0	61.5 Å²	61.5	0%	0	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	129.6	176.2	179.6	0	0	0	0	109.1	V10 I12 V28 F46 F48 A51 L338	V10-V38 HydrophobicContact CB-CG2 4.14Å; V10-V38 HydrophobicContact CG1-CG2 4.08Å; V10-V38 HydrophobicContact CG2-CG2 4.5Å; I12-V38 HydrophobicContact CD1-CG1 4.23Å; V28-V38 HydrophobicContact CG1-CG1 3.5Å; V28-V38 VanDerWaalsContact CG1-CG1 3.5Å; V38-F46 PolarHBondContact N-O 2.86Å; V38-F46 PolarHBondContact O-N 2.94Å; V38-F48 HydrophobicContact CB-CE2 4.31Å; V38-F48 HydrophobicContact CG2-CD2 4.16Å; V38-F48 HydrophobicContact CG2-CE2 4.28Å; V38-A51 HydrophobicContact CG2-CB 3.74Å; V38-L338 HydrophobicContact CG1-CD1 4.43Å; V38-L338 HydrophobicContact CG1-CD2 4.44Å
39	R	90.9	Very high	82.8	Confident	76 Å²	76	64.1 Å²	64.1	29%	0.287	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	132.9	173.4	-165.4	-174.4	-63.6	110.2	0.2	110	V28 Q29 V31 R44 L45	V28-R39 WeakPolarHBondContact CA-O 3.47Å; Q29-R39 PolarHBondContact N-O 2.85Å; Q29-R39 PolarHBondContact O-N 3.46Å; V31-R39 HydrophobicContact CG2-CB 4.38Å; R39-R44 CarbonylContact C-O 3.54Å; R39-R44 WeakPolarHBondContact CA-O 3.37Å; R39-L45 HydrophobicContact CB-CD2 3.92Å; R39-L45 HydrophobicContact CG-CD2 4.08Å
40	L	91.1	Very high	83	Confident	8 Å²	8	61.5 Å²	61.5	4%	0.042	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	115.1	176.1	-177.2	73.6	0	0	0	109.6	C27 V28 R44 F46 I331 T334 L335 L338	C27-L40 WeakPolarHBondContact O-CA 3.35Å; V28-L40 HydrophobicContact CG2-CD1 3.89Å; L40-R44 HydrophobicContact CB-CB 4.28Å; L40-R44 PolarHBondContact N-O 3.38Å; L40-R44 WeakPolarHBondContact O-CB 3.45Å; L40-R44 PolarHBondContact O-N 3.02Å; L40-F46 HydrophobicContact CB-CE2 4.18Å; L40-F46 HydrophobicContact CD2-CE2 4.28Å; L40-I331 HydrophobicContact CD1-CG1 4.02Å; L40-I331 HydrophobicContact CG-CG1 4.33Å; L40-T334 HydrophobicContact CD1-CG2 3.85Å; L40-L335 HydrophobicContact CD2-CB 3.92Å; L40-L335 HydrophobicContact CD2-CD1 3.77Å; L40-L335 HydrophobicContact CD2-CG 4.43Å; L40-L338 HydrophobicContact CB-CD1 4.3Å; L40-L338 HydrophobicContact CD1-CD1 4.4Å; L40-L338 HydrophobicContact CD2-CD1 4.28Å
41	G	83.7	Confident	83.2	Confident	39 Å²	39	60.5 Å²	60.5	40%	0.402	37%	0.369	S	S	.	.	T	Hydrogen-bonded Turn	trans	62.5	-149	-168.8	0	0	0	0	0	112.1	C27	C27-G41 PolarHBondContact O-N 2.98Å
42	S	74	Confident	83.5	Confident	90 Å²	90	59.5 Å²	59.5	63%	0.629	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.8	-52.5	176.7	38.2	0	0	0	0	112.9
43	D	75.1	Confident	84.5	Confident	139 Å²	139	55.4 Å²	55.4	74%	0.743	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-116.3	-6.2	-154	-45.8	-64.6	0	0	0	115.6
44	R	88.8	Confident	86.4	Confident	140 Å²	140	53 Å²	53	53%	0.528	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	105	-172.6	-60.1	-175.6	-178.7	-167.1	0.1	111.8	R39 L40 F46	R39-R44 CarbonylContact C-O 3.54Å; R39-R44 WeakPolarHBondContact CA-O 3.37Å; L40-R44 HydrophobicContact CB-CB 4.28Å; L40-R44 PolarHBondContact N-O 3.38Å; L40-R44 WeakPolarHBondContact O-CB 3.45Å; L40-R44 PolarHBondContact O-N 3.02Å; R44-F46 HydrophobicContact CB-CE2 4.06Å
45	L	91	Very high	87.8	Confident	96 Å²	96	55.2 Å²	55.2	50%	0.503	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	138.4	172.5	-72	164.2	0	0	0	111.2	V31 R39	V31-L45 HydrophobicContact CG2-CD2 3.65Å; R39-L45 HydrophobicContact CB-CD2 3.92Å; R39-L45 HydrophobicContact CG-CD2 4.08Å
46	F	92.6	Very high	88.9	Confident	30 Å²	30	53.2 Å²	53.2	13%	0.132	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	145.9	172.1	-63.5	-95.7	0	0	0	109.2	Q37 V38 L40 R44 F48 L335 L338 Q339	Q37-F46 CarbonylContact C-O 3.18Å; Q37-F46 VanDerWaalsContact CA-O 3.28Å; Q37-F46 WeakPolarHBondContact CA-O 3.46Å; V38-F46 PolarHBondContact N-O 2.86Å; V38-F46 PolarHBondContact O-N 2.94Å; L40-F46 HydrophobicContact CB-CE2 4.18Å; L40-F46 HydrophobicContact CD2-CE2 4.28Å; R44-F46 HydrophobicContact CB-CE2 4.06Å; F46-F48 HydrophobicContact CB-CD2 4.34Å; F46-F48 HydrophobicContact CB-CE2 3.37Å; F46-F48 HydrophobicContact CB-CZ 3.67Å; F46-F48 HydrophobicContact CD1-CZ 4.45Å; F46-F48 HydrophobicContact CG-CE2 4.38Å; F46-F48 HydrophobicContact CG-CZ 4.33Å; F46-L335 HydrophobicContact CZ-CD1 3.91Å; F46-L338 HydrophobicContact CD1-CB 4.19Å; F46-L338 HydrophobicContact CD2-CB 4.34Å; F46-L338 HydrophobicContact CD2-CD1 4.02Å; F46-L338 HydrophobicContact CE1-CB 4.14Å; F46-L338 HydrophobicContact CE2-CB 4.29Å; F46-L338 HydrophobicContact CE2-CD1 4.07Å; F46-L338 HydrophobicContact CG-CB 4.29Å; F46-L338 HydrophobicContact CZ-CB 4.19Å; F46-Q339 HydrophobicContact CE1-CG 4.28Å
47	S	92.4	Very high	89.3	Confident	56 Å²	56	54.2 Å²	54.2	39%	0.392	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	124.4	-178.6	-45.7	0	0	0	0	111	R345	S47-R345 PolarHBondContact O-NH1 3.39Å
48	F	94.1	Very high	89.3	Confident	7 Å²	7	51.6 Å²	51.6	3%	0.031	30%	0.296	C	S	.	.			trans	-119.7	-172.4	-177.3	-59	-76.6	0	0	0	110.1	V8 V10 G36 V38 F46 L338 A341 R345	V8-F48 HydrophobicContact CB-CD1 4.3Å; V8-F48 HydrophobicContact CG1-CD1 3.66Å; V8-F48 HydrophobicContact CG1-CE1 4.25Å; V10-F48 HydrophobicContact CB-CD2 4.34Å; V10-F48 HydrophobicContact CG2-CB 4.42Å; V10-F48 HydrophobicContact CG2-CD1 3.97Å; V10-F48 HydrophobicContact CG2-CD2 3.4Å; V10-F48 HydrophobicContact CG2-CE1 4.04Å; V10-F48 HydrophobicContact CG2-CE2 3.47Å; V10-F48 VanDerWaalsContact CG2-CE2 3.47Å; V10-F48 HydrophobicContact CG2-CG 3.65Å; V10-F48 HydrophobicContact CG2-CZ 3.8Å; G36-F48 PolarHBondContact O-N 2.72Å; V38-F48 HydrophobicContact CB-CE2 4.31Å; V38-F48 HydrophobicContact CG2-CD2 4.16Å; V38-F48 HydrophobicContact CG2-CE2 4.28Å; F46-F48 HydrophobicContact CB-CD2 4.34Å; F46-F48 HydrophobicContact CB-CE2 3.37Å; F46-F48 HydrophobicContact CB-CZ 3.67Å; F46-F48 HydrophobicContact CD1-CZ 4.45Å; F46-F48 HydrophobicContact CG-CE2 4.38Å; F46-F48 HydrophobicContact CG-CZ 4.33Å; F48-L338 HydrophobicContact CE2-CD2 3.8Å; F48-L338 HydrophobicContact CZ-CB 4.33Å; F48-L338 HydrophobicContact CZ-CD2 3.76Å; F48-A341 HydrophobicContact CD1-CB 4.41Å; F48-A341 HydrophobicContact CE1-CB 3.67Å; F48-A341 HydrophobicContact CZ-CB 4.35Å; F48-R345 PolarHBondContact O-NH2 2.98Å
49	D	93.6	Very high	89.2	Confident	56 Å²	56	55.5 Å²	55.5	30%	0.299	32%	0.316	S	S	.	.	S	Bend	trans	-86.4	-36	175.5	-53	-66.2	0	0	0	110.5	V8 R345	V8-D49 PolarHBondContact N-OD2 3.1Å; V8-D49 WeakPolarHBondContact O-CB 3.17Å; V8-D49 PolarHBondContact O-N 3.41Å; D49-R345 IonicContact OD1-CZ 3.82Å; D49-R345 IonicContact OD1-NE 2.72Å; D49-R345 PolarHBondContact OD1-NE 3.06Å; D49-R345 IonicContact OD1-NH2 2.73Å; D49-R345 PolarHBondContact OD1-NH2 2.83Å; D49-R345 IonicContact OD2-NE 3.67Å; D49-R345 PolarHBondContact OD2-NE 3.39Å; D49-R345 VanDerWaalsContact OD2-NE 3.14Å
50	H	92.9	Very high	89.2	Confident	52 Å²	52	56 Å²	56	24%	0.241	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	150.7	169.2	-55.2	-96.2	0	0	0	110.9	V8 A9 V10 F52	V8-H50 PolarHBondContact O-N 3.42Å; A9-H50 WeakPolarHBondContact CA-O 3.19Å; A9-H50 HydrophobicContact CB-CB 4.04Å; V10-H50 PolarHBondContact N-O 3.11Å; H50-F52 HydrophobicContact CB-CD2 4.46Å; H50-F52 HydrophobicContact CB-CE2 3.66Å; H50-F52 HydrophobicContact CB-CZ 3.74Å
51	A	93.4	Very high	89.3	Confident	20 Å²	20	55.7 Å²	55.7	17%	0.165	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	101.9	179.1	0	0	0	0	0	110.7	V30 V38	V30-A51 HydrophobicContact CG1-CB 4.1Å; V38-A51 HydrophobicContact CG2-CB 3.74Å
52	F	93	Very high	89.8	Confident	5 Å²	5	54.4 Å²	54.4	2%	0.022	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	131.5	-174.9	-58.9	-71.7	0	0	0	111.4	A9 V10 R11 I12 H50 A56 E60 V61	A9-F52 HydrophobicContact CB-CD2 4.43Å; A9-F52 HydrophobicContact CB-CE2 3.94Å; V10-F52 PolarHBondContact O-N 3.33Å; R11-F52 HydrophobicContact CB-CB 4.43Å; R11-F52 HydrophobicContact CG-CB 4.12Å; I12-F52 PolarHBondContact N-O 3.21Å; H50-F52 HydrophobicContact CB-CD2 4.46Å; H50-F52 HydrophobicContact CB-CE2 3.66Å; H50-F52 HydrophobicContact CB-CZ 3.74Å; F52-A56 HydrophobicContact CB-CB 3.74Å; F52-A56 HydrophobicContact CD1-CB 4.11Å; F52-A56 HydrophobicContact CG-CB 4.33Å; F52-E60 HydrophobicContact CD1-CG 4.32Å; F52-E60 WeakPolarHBondContact CD1-OE1 3.49Å; F52-E60 HydrophobicContact CE1-CG 4.07Å; F52-V61 HydrophobicContact CB-CG2 4.38Å; F52-V61 HydrophobicContact CD1-CG2 4.01Å; F52-V61 HydrophobicContact CD2-CG1 4.48Å; F52-V61 HydrophobicContact CD2-CG2 3.85Å; F52-V61 HydrophobicContact CE1-CG2 4.24Å; F52-V61 HydrophobicContact CE2-CB 4.39Å; F52-V61 HydrophobicContact CE2-CG1 4.19Å; F52-V61 HydrophobicContact CE2-CG2 4.07Å; F52-V61 HydrophobicContact CG-CG2 3.81Å; F52-V61 HydrophobicContact CZ-CB 4.48Å; F52-V61 HydrophobicContact CZ-CG2 4.28Å
53	G	90.6	Very high	90.7	Very high	16 Å²	16	55.8 Å²	55.8	17%	0.165	30%	0.3	C	S	.	.			trans	-86.1	177.1	179.7	0	0	0	0	0	113.7	I12 T55 A56	I12-G53 CarbonylContact O-C 3.59Å; I12-G53 VanDerWaalsContact O-C 3.25Å; G53-T55 PolarHBondContact O-N 3.16Å; G53-A56 WeakPolarHBondContact O-CB 3.42Å; G53-A56 PolarHBondContact O-N 2.98Å; G53-A56 VanDerWaalsContact O-N 3.09Å
54	P	89.3	Confident	91.5	Very high	66 Å²	66	51 Å²	51	43%	0.429	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.6	-10.9	177.8	-29.6	38.6	0	0	0	116.8	I12 P14	I12-P54 HydrophobicContact CG2-CG 4.18Å; I12-P54 VanDerWaalsContact O-CA 3.26Å; I12-P54 WeakPolarHBondContact O-CA 3.34Å; P14-P54 HydrophobicContact CB-CB 4.32Å
55	T	88.1	Confident	91.6	Very high	139 Å²	139	44.4 Å²	44.4	85%	0.853	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.4	1.5	-178	54.9	0	0	0	0	113.5	G53	G53-T55 PolarHBondContact O-N 3.16Å
56	A	88.8	Confident	91.7	Very high	11 Å²	11	39.9 Å²	39.9	9%	0.091	23%	0.229	C	C	.	.			trans	-79.1	123.3	-177.2	0	0	0	0	0	111.7	R11 F52 G53 E60	R11-A56 PolarHBondContact NH2-O 3.11Å; R11-A56 VanDerWaalsContact NH2-O 3.16Å; F52-A56 HydrophobicContact CB-CB 3.74Å; F52-A56 HydrophobicContact CD1-CB 4.11Å; F52-A56 HydrophobicContact CG-CB 4.33Å; G53-A56 WeakPolarHBondContact O-CB 3.42Å; G53-A56 PolarHBondContact O-N 2.98Å; G53-A56 VanDerWaalsContact O-N 3.09Å; A56-E60 VanDerWaalsContact CA-OE2 3.26Å; A56-E60 WeakPolarHBondContact CA-OE2 3.25Å; A56-E60 WeakPolarHBondContact CB-OE2 3.38Å
57	S	90.1	Very high	91.8	Very high	33 Å²	33	41.6 Å²	41.6	23%	0.231	24%	0.237	C	C	.	.			trans	-65.9	178.7	-179.8	72.3	0	0	0	0	112.1	R11 D59 E60 V61	R11-S57 PolarHBondContact NH2-O 3.31Å; R11-S57 VanDerWaalsContact NH2-O 3.1Å; S57-D59 PolarHBondContact OG-N 3.26Å; S57-E60 PolarHBondContact OG-N 3.42Å; S57-V61 WeakPolarHBondContact O-CG2 3.5Å
58	Q	90.1	Very high	91.9	Very high	5 Å²	5	41.1 Å²	41.1	2%	0.023	23%	0.233	C	C	.	.	H	α-helix	trans	-68.2	-41.9	170.4	-59.5	-80.2	76.6	0	0	110.9	V61 Y62 Y93 E107 G108	Q58-V61 WeakPolarHBondContact O-CB 3.47Å; Q58-V61 PolarHBondContact O-N 3.19Å; Q58-Y62 PolarHBondContact O-N 3.21Å; Q58-Y93 PolarHBondContact NE2-O 2.99Å; Q58-E107 HydrophobicContact CG-CB 3.89Å; Q58-E107 HydrophobicContact CG-CG 4.35Å; Q58-G108 VanDerWaalsContact CB-O 3.24Å; Q58-G108 WeakPolarHBondContact CB-O 3.24Å; Q58-G108 WeakPolarHBondContact CG-O 3.16Å; Q58-G108 PolarHBondContact NE2-O 3.37Å
59	D	90.3	Very high	91.9	Very high	81 Å²	81	41 Å²	41	43%	0.433	23%	0.233	S	C	.	.	H	α-helix	trans	-64.7	-44.9	-175.3	-38	-51.7	0	0	0	112	S57 V61 Y62 E63	S57-D59 PolarHBondContact OG-N 3.26Å; D59-V61 PolarHBondContact O-N 2.87Å; D59-Y62 CarbonylContact O-C 3.25Å; D59-Y62 WeakPolarHBondContact O-CA 3.12Å; D59-Y62 PolarHBondContact O-N 3.5Å; D59-E63 WeakPolarHBondContact O-CG 3.29Å; D59-E63 PolarHBondContact O-N 3.2Å
60	E	91	Very high	91.9	Very high	87 Å²	87	38.3 Å²	38.3	41%	0.407	22%	0.219	S	C	.	.	H	α-helix	trans	-56.5	-37.4	177.9	-168.2	-161.2	151.2	0	0	111.5	F52 A56 S57 S64	F52-E60 HydrophobicContact CD1-CG 4.32Å; F52-E60 WeakPolarHBondContact CD1-OE1 3.49Å; F52-E60 HydrophobicContact CE1-CG 4.07Å; A56-E60 VanDerWaalsContact CA-OE2 3.26Å; A56-E60 WeakPolarHBondContact CA-OE2 3.25Å; A56-E60 WeakPolarHBondContact CB-OE2 3.38Å; S57-E60 PolarHBondContact OG-N 3.42Å; E60-S64 WeakPolarHBondContact O-CB 3.42Å; E60-S64 PolarHBondContact O-N 2.66Å; E60-S64 PolarHBondContact O-OG 2.84Å
61	V	92.3	Very high	91.8	Very high	1 Å²	1	40.8 Å²	40.8	1%	0.006	23%	0.23	C	C	.	.	H	α-helix	trans	-74	-40.8	176.3	179.4	0	0	0	0	110.8	F52 S57 Q58 D59 C65 T94	F52-V61 HydrophobicContact CB-CG2 4.38Å; F52-V61 HydrophobicContact CD1-CG2 4.01Å; F52-V61 HydrophobicContact CD2-CG1 4.48Å; F52-V61 HydrophobicContact CD2-CG2 3.85Å; F52-V61 HydrophobicContact CE1-CG2 4.24Å; F52-V61 HydrophobicContact CE2-CB 4.39Å; F52-V61 HydrophobicContact CE2-CG1 4.19Å; F52-V61 HydrophobicContact CE2-CG2 4.07Å; F52-V61 HydrophobicContact CG-CG2 3.81Å; F52-V61 HydrophobicContact CZ-CB 4.48Å; F52-V61 HydrophobicContact CZ-CG2 4.28Å; S57-V61 WeakPolarHBondContact O-CG2 3.5Å; Q58-V61 WeakPolarHBondContact O-CB 3.47Å; Q58-V61 PolarHBondContact O-N 3.19Å; D59-V61 PolarHBondContact O-N 2.87Å; V61-C65 WeakPolarHBondContact O-CB 3.47Å; V61-C65 PolarHBondContact O-N 2.9Å; V61-C65 VanDerWaalsContact O-N 3.16Å; V61-T94 HydrophobicContact CG1-CG2 4.38Å
62	Y	94.5	Very high	91.7	Very high	12 Å²	12	41.3 Å²	41.3	5%	0.047	23%	0.232	C	C	.	.	H	α-helix	trans	-65.1	-55.3	179.1	176.5	-97.7	0	0	0	112.5	Q58 D59 S64 C65 V66 Q67 C113 V114 D117	Q58-Y62 PolarHBondContact O-N 3.21Å; D59-Y62 CarbonylContact O-C 3.25Å; D59-Y62 WeakPolarHBondContact O-CA 3.12Å; D59-Y62 PolarHBondContact O-N 3.5Å; Y62-S64 PolarHBondContact O-N 3.3Å; Y62-C65 PolarHBondContact O-N 2.92Å; Y62-V66 HydrophobicContact CD2-CB 3.71Å; Y62-V66 HydrophobicContact CD2-CG1 4.01Å; Y62-V66 HydrophobicContact CD2-CG2 4.41Å; Y62-V66 HydrophobicContact CE2-CB 3.82Å; Y62-V66 HydrophobicContact CE2-CG1 3.7Å; Y62-V66 WeakPolarHBondContact O-CA 3.36Å; Y62-V66 PolarHBondContact O-N 3.11Å; Y62-Q67 HydrophobicContact CD1-CB 4.34Å; Y62-Q67 HydrophobicContact CE1-CB 3.75Å; Y62-Q67 HydrophobicContact CE1-CG 4.27Å; Y62-Q67 PolarHBondContact O-N 3.49Å; Y62-C113 HydrophobicContact CD1-CB 3.85Å; Y62-C113 HydrophobicContact CD2-CB 3.41Å; Y62-C113 VanDerWaalsContact CD2-CB 3.41Å; Y62-C113 HydrophobicContact CE1-CB 4.01Å; Y62-C113 HydrophobicContact CE2-CB 3.58Å; Y62-C113 HydrophobicContact CG-CB 3.56Å; Y62-V114 HydrophobicContact CE2-CG2 3.82Å; Y62-D117 VanDerWaalsContact OH-CB 3.24Å; Y62-D117 WeakPolarHBondContact OH-CB 3.24Å; Y62-D117 PolarHBondContact OH-OD2 3.19Å; Y62-D117 VanDerWaalsContact OH-OD2 3.11Å
63	E	93.3	Very high	91.7	Very high	119 Å²	119	41 Å²	41	56%	0.556	23%	0.231	S	C	*	.	H	α-helix	trans	-56.9	-51.4	-180	-68.6	-175.8	156.7	0	0	110.9	D59 C65 P68	D59-E63 WeakPolarHBondContact O-CG 3.29Å; D59-E63 PolarHBondContact O-N 3.2Å; E63-C65 PolarHBondContact O-N 3Å; E63-P68 WeakPolarHBondContact O-CD 3.34Å
64	S	90.6	Very high	91.7	Very high	40 Å²	40	40.4 Å²	40.4	28%	0.28	22%	0.224	S	C	.	.	H	α-helix	trans	-61.3	-41.3	-177.7	-67.1	0	0	0	0	113.5	E60 Y62	E60-S64 WeakPolarHBondContact O-CB 3.42Å; E60-S64 PolarHBondContact O-N 2.66Å; E60-S64 PolarHBondContact O-OG 2.84Å; Y62-S64 PolarHBondContact O-N 3.3Å
65	C	91.4	Very high	91.6	Very high	1 Å²	1	40.3 Å²	40.3	1%	0.007	22%	0.22	C	C	.	.	H	α-helix	trans	-108.4	-43.3	-165.8	-64.5	0	0	0	0	113.8	R7 V61 Y62 E63 V319	R7-C65 PolarHBondContact NH2-O 3.29Å; V61-C65 WeakPolarHBondContact O-CB 3.47Å; V61-C65 PolarHBondContact O-N 2.9Å; V61-C65 VanDerWaalsContact O-N 3.16Å; Y62-C65 PolarHBondContact O-N 2.92Å; E63-C65 PolarHBondContact O-N 3Å; C65-V319 HydrophobicContact CB-CG1 4.23Å
66	V	94.3	Very high	91.6	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	18%	0.18	C	C	.	.	T	Hydrogen-bonded Turn	trans	-105.7	-39.6	-163	-173.5	0	0	0	0	112.7	Y62 P68 L69 V70 V81 I110 V114	Y62-V66 HydrophobicContact CD2-CB 3.71Å; Y62-V66 HydrophobicContact CD2-CG1 4.01Å; Y62-V66 HydrophobicContact CD2-CG2 4.41Å; Y62-V66 HydrophobicContact CE2-CB 3.82Å; Y62-V66 HydrophobicContact CE2-CG1 3.7Å; Y62-V66 WeakPolarHBondContact O-CA 3.36Å; Y62-V66 PolarHBondContact O-N 3.11Å; V66-P68 VanDerWaalsContact C-N 3.35Å; V66-L69 WeakPolarHBondContact O-CA 3.43Å; V66-L69 VanDerWaalsContact O-CB 3.25Å; V66-L69 WeakPolarHBondContact O-CB 3.27Å; V66-L69 PolarHBondContact O-N 3.39Å; V66-V70 HydrophobicContact CG1-CG2 4.37Å; V66-V70 PolarHBondContact O-N 2.89Å; V66-V70 VanDerWaalsContact O-N 3.15Å; V66-V81 HydrophobicContact CG1-CG2 4.05Å; V66-V81 HydrophobicContact CG2-CG1 4.36Å; V66-V81 HydrophobicContact CG2-CG2 4.03Å; V66-I110 HydrophobicContact CG1-CG2 4.06Å; V66-I110 HydrophobicContact CG2-CD1 4.05Å; V66-I110 HydrophobicContact CG2-CG1 4.27Å; V66-I110 HydrophobicContact CG2-CG2 4.03Å; V66-V114 HydrophobicContact CG1-CG2 3.76Å
67	Q	94.3	Very high	91.7	Very high	66 Å²	66	36.7 Å²	36.7	31%	0.308	19%	0.189	S	C	.	.	H	α-helix	trans	-51.8	-44.4	179.8	-176.7	174.2	63.7	0	0	113.3	Y62 L69 V70 E71 D117	Y62-Q67 HydrophobicContact CD1-CB 4.34Å; Y62-Q67 HydrophobicContact CE1-CB 3.75Å; Y62-Q67 HydrophobicContact CE1-CG 4.27Å; Y62-Q67 PolarHBondContact O-N 3.49Å; Q67-L69 PolarHBondContact O-N 2.86Å; Q67-L69 VanDerWaalsContact O-N 3.16Å; Q67-V70 WeakPolarHBondContact O-CB 3.5Å; Q67-V70 PolarHBondContact O-N 3.39Å; Q67-E71 PolarHBondContact O-N 3Å; Q67-E71 VanDerWaalsContact O-N 3.11Å; Q67-D117 PolarHBondContact NE2-OD2 3.3Å
68	P	93.3	Very high	91.8	Very high	47 Å²	47	36.3 Å²	36.3	31%	0.305	18%	0.184	S	C	.	.	H	α-helix	trans	-65.6	-20.4	175.5	-22	34.5	0	0	0	114.4	E63 V66 S72	E63-P68 WeakPolarHBondContact O-CD 3.34Å; V66-P68 VanDerWaalsContact C-N 3.35Å; P68-S72 WeakPolarHBondContact O-CB 3.45Å; P68-S72 PolarHBondContact O-N 3.32Å; P68-S72 PolarHBondContact O-OG 2.73Å
69	L	93.8	Very high	92	Very high	4 Å²	4	36.1 Å²	36.1	2%	0.021	18%	0.183	C	C	.	.	H	α-helix	trans	-77.9	-32.4	171.4	-61.5	-179	0	0	0	112	V66 Q67 S72 L73 A79 V81 H317 V319	V66-L69 WeakPolarHBondContact O-CA 3.43Å; V66-L69 VanDerWaalsContact O-CB 3.25Å; V66-L69 WeakPolarHBondContact O-CB 3.27Å; V66-L69 PolarHBondContact O-N 3.39Å; Q67-L69 PolarHBondContact O-N 2.86Å; Q67-L69 VanDerWaalsContact O-N 3.16Å; L69-S72 PolarHBondContact O-N 3.24Å; L69-L73 WeakPolarHBondContact O-CB 3.37Å; L69-L73 PolarHBondContact O-N 2.72Å; L69-A79 HydrophobicContact CB-CB 4.07Å; L69-V81 HydrophobicContact CD1-CG2 3.61Å; L69-H317 HydrophobicContact CD2-CB 3.63Å; L69-V319 HydrophobicContact CD1-CB 4.06Å; L69-V319 HydrophobicContact CD1-CG2 3.7Å; L69-V319 HydrophobicContact CD2-CG2 4.49Å; L69-V319 HydrophobicContact CG-CG2 4.31Å
70	V	94.2	Very high	92.3	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-68.7	-41.6	175.5	179.2	0	0	0	0	110.3	V66 Q67 S72 L73 L74 V114 V118 L121	V66-V70 HydrophobicContact CG1-CG2 4.37Å; V66-V70 PolarHBondContact O-N 2.89Å; V66-V70 VanDerWaalsContact O-N 3.15Å; Q67-V70 WeakPolarHBondContact O-CB 3.5Å; Q67-V70 PolarHBondContact O-N 3.39Å; V70-S72 PolarHBondContact O-N 3.42Å; V70-L73 WeakPolarHBondContact O-CB 3.36Å; V70-L73 PolarHBondContact O-N 2.9Å; V70-L74 WeakPolarHBondContact O-CG 3.31Å; V70-L74 PolarHBondContact O-N 2.91Å; V70-V114 HydrophobicContact CG2-CG2 4.09Å; V70-V118 HydrophobicContact CG1-CG2 3.64Å; V70-L121 HydrophobicContact CG1-CD1 4.03Å
71	E	92.1	Very high	92.6	Very high	103 Å²	103	28.2 Å²	28.2	48%	0.481	14%	0.144	S	C	.	.	H	α-helix	trans	-59.4	-48.1	170.6	-62.5	-174.8	134.9	0	0	111.6	Q67 L73 L74 D75	Q67-E71 PolarHBondContact O-N 3Å; Q67-E71 VanDerWaalsContact O-N 3.11Å; E71-L73 VanDerWaalsContact C-N 3.27Å; E71-L73 PolarHBondContact O-N 3.44Å; E71-L74 PolarHBondContact O-N 3.26Å; E71-D75 PolarHBondContact O-N 3.49Å
72	S	91.1	Very high	92.8	Very high	31 Å²	31	28.2 Å²	28.2	22%	0.217	14%	0.144	C	C	.	.	H	α-helix	trans	-59.6	-35.2	177	-60.4	0	0	0	0	113	P68 L69 V70 D75 G76 Y77	P68-S72 WeakPolarHBondContact O-CB 3.45Å; P68-S72 PolarHBondContact O-N 3.32Å; P68-S72 PolarHBondContact O-OG 2.73Å; L69-S72 PolarHBondContact O-N 3.24Å; V70-S72 PolarHBondContact O-N 3.42Å; S72-D75 PolarHBondContact O-N 3.48Å; S72-G76 PolarHBondContact O-N 2.92Å; S72-Y77 WeakPolarHBondContact O-CB 3.13Å; S72-Y77 PolarHBondContact O-N 3.31Å; S72-Y77 VanDerWaalsContact O-N 3.1Å
73	L	92.6	Very high	92.8	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-61.4	-49.9	176.1	-178.6	71.6	0	0	0	110.9	L69 V70 E71 D75 G76 Y77 V118 V219 S237 K238 L239	L69-L73 WeakPolarHBondContact O-CB 3.37Å; L69-L73 PolarHBondContact O-N 2.72Å; V70-L73 WeakPolarHBondContact O-CB 3.36Å; V70-L73 PolarHBondContact O-N 2.9Å; E71-L73 VanDerWaalsContact C-N 3.27Å; E71-L73 PolarHBondContact O-N 3.44Å; L73-D75 PolarHBondContact O-N 3.24Å; L73-G76 PolarHBondContact O-N 3.3Å; L73-G76 VanDerWaalsContact O-N 3.11Å; L73-Y77 WeakPolarHBondContact CA-O 3.2Å; L73-V118 HydrophobicContact CD2-CG2 4.49Å; L73-V219 HydrophobicContact CD2-CG2 3.76Å; L73-V219 HydrophobicContact CG-CG2 4.14Å; L73-S237 WeakPolarHBondContact O-CB 3.39Å; L73-S237 PolarHBondContact O-OG 2.76Å; L73-K238 VanDerWaalsContact CD1-C 3.49Å; L73-L239 HydrophobicContact CD1-CB 3.81Å; L73-L239 HydrophobicContact CD2-CB 3.7Å; L73-L239 HydrophobicContact CD2-CD2 4.16Å; L73-L239 HydrophobicContact CG-CB 4.35Å
74	L	89.8	Confident	92.9	Very high	2 Å²	2	22.7 Å²	22.7	1%	0.01	12%	0.118	C	C	.	.	H	α-helix	trans	-68.6	-20.4	-178.4	-60.8	-179.3	0	0	0	113.1	V70 E71 G76 L121 L122 R125 V219 I221	V70-L74 WeakPolarHBondContact O-CG 3.31Å; V70-L74 PolarHBondContact O-N 2.91Å; E71-L74 PolarHBondContact O-N 3.26Å; L74-G76 VanDerWaalsContact C-N 3.35Å; L74-L121 HydrophobicContact CD1-CB 3.42Å; L74-L121 VanDerWaalsContact CD1-CB 3.42Å; L74-L121 HydrophobicContact CD1-CD1 4.07Å; L74-L121 HydrophobicContact CD1-CG 4.39Å; L74-L122 HydrophobicContact CD2-CD1 4.42Å; L74-L122 HydrophobicContact CD2-CD2 3.69Å; L74-L122 HydrophobicContact CD2-CG 3.87Å; L74-R125 PolarHBondContact O-NH1 2.98Å; L74-R125 VanDerWaalsContact O-NH1 3.13Å; L74-V219 HydrophobicContact CD2-CG1 4.1Å; L74-I221 HydrophobicContact CD2-CD1 4.37Å; L74-I221 WeakPolarHBondContact O-CD1 3.17Å
75	D	88	Confident	93	Very high	65 Å²	65	20.8 Å²	20.8	35%	0.348	11%	0.105	S	C	.	.	H	α-helix	trans	-83.2	-12.4	174.8	-78.6	11.4	0	0	0	113.6	E71 S72 L73 Y77 R125 R353	E71-D75 PolarHBondContact O-N 3.49Å; S72-D75 PolarHBondContact O-N 3.48Å; L73-D75 PolarHBondContact O-N 3.24Å; D75-Y77 HydrophobicContact CB-CD2 4.4Å; D75-R125 IonicContact OD1-CZ 3.26Å; D75-R125 VanDerWaalsContact OD1-CZ 3.26Å; D75-R125 IonicContact OD1-NH1 2.77Å; D75-R125 PolarHBondContact OD1-NH1 2.86Å; D75-R125 IonicContact OD1-NH2 2.79Å; D75-R125 PolarHBondContact OD1-NH2 3.23Å; D75-R353 PolarHBondContact O-NE 3.02Å; D75-R353 PolarHBondContact O-NH2 2.86Å
76	G	88.2	Confident	92.9	Very high	0 Å²	0	21.6 Å²	21.6	0%	0	11%	0.109	C	C	.	.	T	Hydrogen-bonded Turn	trans	108.6	23.8	173.6	0	0	0	0	0	115.2	S72 L73 L74 R353 A354	S72-G76 PolarHBondContact O-N 2.92Å; L73-G76 PolarHBondContact O-N 3.3Å; L73-G76 VanDerWaalsContact O-N 3.11Å; L74-G76 VanDerWaalsContact C-N 3.35Å; G76-R353 WeakPolarHBondContact O-CA 3.49Å; G76-A354 PolarHBondContact O-N 3Å
77	Y	90.7	Very high	92.5	Very high	74 Å²	74	23.1 Å²	23.1	29%	0.29	12%	0.118	S	C	.	.			trans	-103.8	148.4	171.7	-61.4	-85.5	0	0	0	111.4	S72 L73 D75 S237 H317 P351 R353	S72-Y77 WeakPolarHBondContact O-CB 3.13Å; S72-Y77 PolarHBondContact O-N 3.31Å; S72-Y77 VanDerWaalsContact O-N 3.1Å; L73-Y77 WeakPolarHBondContact CA-O 3.2Å; D75-Y77 HydrophobicContact CB-CD2 4.4Å; Y77-S237 WeakPolarHBondContact O-CB 3.32Å; Y77-H317 AromaticContact CD1-NE2 4Å; Y77-P351 HydrophobicContact CD1-CB 4.26Å; Y77-R353 HydrophobicContact CD1-CB 4.26Å; Y77-R353 HydrophobicContact CE1-CB 3.81Å; Y77-R353 HydrophobicContact CE1-CG 4.46Å; Y77-R353 HydrophobicContact CE2-CG 4.44Å
78	N	92.3	Very high	92	Very high	24 Å²	24	21.7 Å²	21.7	13%	0.128	12%	0.121	C	C	.	.			trans	-75.3	149.3	169.7	-60.8	-34.7	0	0	0	110.9	K238 N315 A316 H317	N78-K238 CarbonylContact C-O 3.52Å; N78-K238 VanDerWaalsContact CA-O 3.31Å; N78-K238 WeakPolarHBondContact CA-O 3.17Å; N78-K238 PolarHBondContact OD1-N 3.04Å; N78-N315 WeakPolarHBondContact CB-O 3.48Å; N78-N315 PolarHBondContact ND2-O 2.78Å; N78-A316 HydrophobicContact CB-CB 3.9Å; N78-A316 CarbonylContact O-C 3.54Å; N78-A316 WeakPolarHBondContact O-CA 3.41Å; N78-H317 PolarHBondContact O-N 2.85Å
79	A	94.7	Very high	91.8	Very high	1 Å²	1	19.5 Å²	19.5	1%	0.008	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	153.9	179.6	0	0	0	0	0	111.5	L69 K238 L239 C240 H317	L69-A79 HydrophobicContact CB-CB 4.07Å; A79-K238 PolarHBondContact N-O 3.25Å; A79-L239 HydrophobicContact CB-CB 4.47Å; A79-L239 HydrophobicContact CB-CD1 3.64Å; A79-L239 WeakPolarHBondContact O-CA 3.44Å; A79-C240 PolarHBondContact O-N 2.88Å; A79-H317 CarbonylContact C-O 3.6Å; A79-H317 VanDerWaalsContact CA-O 3.26Å; A79-H317 WeakPolarHBondContact CA-O 3.39Å
80	T	95.8	Very high	91.5	Very high	3 Å²	3	20.1 Å²	20.1	2%	0.018	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.7	132.6	170.6	-58	0	0	0	0	110.9	F82 C240 S311 H317 T318 V319	T80-F82 HydrophobicContact CG2-CD1 4.49Å; T80-C240 CarbonylContact C-O 3.58Å; T80-C240 VanDerWaalsContact CA-O 3.28Å; T80-C240 WeakPolarHBondContact CA-O 3.25Å; T80-C240 HydrophobicContact CG2-CB 4.04Å; T80-S311 WeakPolarHBondContact CG2-OG 3.37Å; T80-S311 PolarHBondContact OG1-OG 3.4Å; T80-H317 PolarHBondContact N-O 3.4Å; T80-T318 HydrophobicContact CG2-CG2 4.34Å; T80-T318 WeakPolarHBondContact O-CA 3.42Å; T80-V319 PolarHBondContact O-N 2.75Å
81	V	97.1	Very high	91.4	Very high	0 Å²	0	20.5 Å²	20.5	0%	0	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	124.8	166.4	-175.2	0	0	0	0	107.5	V66 L69 C240 L241 V242 V319 V321	V66-V81 HydrophobicContact CG1-CG2 4.05Å; V66-V81 HydrophobicContact CG2-CG1 4.36Å; V66-V81 HydrophobicContact CG2-CG2 4.03Å; L69-V81 HydrophobicContact CD1-CG2 3.61Å; V81-C240 PolarHBondContact N-O 2.82Å; V81-L241 HydrophobicContact CB-CD2 3.82Å; V81-L241 HydrophobicContact CG2-CD2 3.97Å; V81-V242 PolarHBondContact O-N 3.14Å; V81-V319 WeakPolarHBondContact CA-O 3.36Å; V81-V321 HydrophobicContact CG1-CG2 4.02Å
82	F	95.9	Very high	91.3	Very high	0 Å²	0	18.2 Å²	18.2	0%	0	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	130.4	174.6	73.1	-88.3	0	0	0	112.8	T80 V242 L244 L312 T318 V319 M320 V321	T80-F82 HydrophobicContact CG2-CD1 4.49Å; F82-V242 WeakPolarHBondContact CA-O 3.43Å; F82-V242 HydrophobicContact CB-CB 3.8Å; F82-V242 HydrophobicContact CB-CG1 4.3Å; F82-L244 HydrophobicContact CD2-CD1 3.81Å; F82-L244 HydrophobicContact CE2-CD1 4.4Å; F82-L312 HydrophobicContact CE1-CD2 4.02Å; F82-L312 HydrophobicContact CZ-CD2 4.19Å; F82-T318 HydrophobicContact CD1-CG2 3.94Å; F82-T318 HydrophobicContact CE1-CG2 3.76Å; F82-V319 PolarHBondContact N-O 2.9Å; F82-M320 HydrophobicContact CD1-CB 4.48Å; F82-M320 HydrophobicContact CD2-CG 4.24Å; F82-M320 HydrophobicContact CE1-CB 3.84Å; F82-M320 HydrophobicContact CE1-CG 4.31Å; F82-M320 HydrophobicContact CE2-CB 4.04Å; F82-M320 HydrophobicContact CE2-CG 3.58Å; F82-M320 HydrophobicContact CE2-SD 4.1Å; F82-M320 HydrophobicContact CZ-CB 3.6Å; F82-M320 HydrophobicContact CZ-CG 3.63Å; F82-M320 HydrophobicContact CZ-SD 4.08Å; F82-V321 PolarHBondContact O-N 2.95Å
83	C	95.6	Very high	91.2	Very high	0 Å²	0	21 Å²	21	0%	0	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88	129.8	175.5	-68.1	0	0	0	0	110.3	K91 V242 L244 V321	C83-K91 HydrophobicContact CB-CB 3.86Å; C83-K91 HydrophobicContact CB-CG 4.26Å; C83-V242 PolarHBondContact N-O 2.8Å; C83-L244 WeakPolarHBondContact O-CB 3.37Å; C83-L244 WeakPolarHBondContact O-CG 3.48Å; C83-L244 PolarHBondContact O-N 3.01Å; C83-V321 WeakPolarHBondContact CA-O 3.44Å
84	Y	94.9	Very high	91.1	Very high	16 Å²	16	21 Å²	21	6%	0.063	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	146	179	178.4	-98.9	0	0	0	111.5	L244 L270 M320 V321 A322 C323 V337 F340	Y84-L244 HydrophobicContact CD2-CD1 3.9Å; Y84-L270 HydrophobicContact CD2-CD2 4.42Å; Y84-L270 HydrophobicContact CE2-CD2 4.06Å; Y84-M320 HydrophobicContact CD1-CE 3.43Å; Y84-M320 VanDerWaalsContact CD1-CE 3.43Å; Y84-M320 HydrophobicContact CE1-CE 4.4Å; Y84-M320 HydrophobicContact CG-CE 3.84Å; Y84-V321 PolarHBondContact N-O 2.99Å; Y84-A322 CarbonylContact O-C 3.48Å; Y84-A322 WeakPolarHBondContact O-CA 3.49Å; Y84-C323 PolarHBondContact O-N 2.77Å; Y84-V337 HydrophobicContact CD1-CG1 4.15Å; Y84-V337 HydrophobicContact CE1-CB 4.43Å; Y84-V337 HydrophobicContact CE1-CG1 4.32Å; Y84-V337 HydrophobicContact CE1-CG2 4.09Å; Y84-F340 AromaticContact CD1-CD1 3.68Å; Y84-F340 HydrophobicContact CD1-CD1 3.68Å; Y84-F340 AromaticContact CD1-CE1 3.82Å; Y84-F340 HydrophobicContact CD1-CE1 3.82Å; Y84-F340 HydrophobicContact CD1-CG 4.2Å; Y84-F340 HydrophobicContact CD1-CZ 4.45Å; Y84-F340 HydrophobicContact CD2-CE1 4.05Å; Y84-F340 HydrophobicContact CD2-CZ 4.06Å; Y84-F340 HydrophobicContact CE1-CB 3.86Å; Y84-F340 AromaticContact CE1-CD1 3.49Å; Y84-F340 HydrophobicContact CE1-CD1 3.49Å; Y84-F340 VanDerWaalsContact CE1-CD1 3.49Å; Y84-F340 AromaticContact CE1-CD2 3.93Å; Y84-F340 HydrophobicContact CE1-CD2 3.93Å; Y84-F340 AromaticContact CE1-CE1 3.81Å; Y84-F340 HydrophobicContact CE1-CE1 3.81Å; Y84-F340 HydrophobicContact CE1-CE2 4.23Å; Y84-F340 AromaticContact CE1-CG 3.52Å; Y84-F340 HydrophobicContact CE1-CG 3.52Å; Y84-F340 HydrophobicContact CE1-CZ 4.15Å; Y84-F340 HydrophobicContact CE2-CD2 4.44Å; Y84-F340 HydrophobicContact CE2-CE1 4.06Å; Y84-F340 AromaticContact CE2-CE2 3.98Å; Y84-F340 HydrophobicContact CE2-CE2 3.98Å; Y84-F340 AromaticContact CE2-CZ 3.73Å; Y84-F340 HydrophobicContact CE2-CZ 3.73Å; Y84-F340 HydrophobicContact CG-CD1 4.27Å; Y84-F340 AromaticContact CG-CE1 3.93Å; Y84-F340 HydrophobicContact CG-CE1 3.93Å; Y84-F340 HydrophobicContact CG-CZ 4.4Å; Y84-F340 AromaticContact CZ-CD1 3.95Å; Y84-F340 AromaticContact CZ-CD2 3.69Å; Y84-F340 AromaticContact CZ-CE1 3.93Å; Y84-F340 AromaticContact CZ-CE2 3.68Å; Y84-F340 AromaticContact CZ-CG 3.81Å; Y84-F340 AromaticContact CZ-CZ 3.77Å; Y84-F340 WeakPolarHBondContact OH-CD2 3.47Å
85	G	93.1	Very high	91.1	Very high	0 Å²	0	21.3 Å²	21.3	0%	0	12%	0.117	C	C	.	.	S	Bend	trans	150.4	173.8	-174.7	0	0	0	0	0	113.4	K91 S247	G85-K91 PolarHBondContact O-NZ 2.85Å; G85-S247 PolarHBondContact O-N 3.28Å
86	Q	88.4	Confident	90.9	Very high	18 Å²	18	20 Å²	20	8%	0.084	12%	0.119	C	C	.	.			trans	-59.8	157.4	175.9	-161.5	-170.7	-24.7	0	0	111.7	S89 K91 S247 E248 F330 E333	Q86-S89 VanDerWaalsContact O-CB 3.24Å; Q86-S89 WeakPolarHBondContact O-CB 3.4Å; Q86-S89 PolarHBondContact O-N 3.33Å; Q86-S89 PolarHBondContact O-OG 3.16Å; Q86-K91 PolarHBondContact O-NZ 2.78Å; Q86-S247 PolarHBondContact N-OG 3.43Å; Q86-E248 HydrophobicContact CG-CB 4.01Å; Q86-F330 VanDerWaalsContact NE2-CE1 3.32Å; Q86-E333 HydrophobicContact CB-CB 4.49Å; Q86-E333 HydrophobicContact CG-CB 4.28Å; Q86-E333 HydrophobicContact CG-CG 4.25Å; Q86-E333 VanDerWaalsContact OE1-CB 3.26Å
87	T	86.1	Confident	90.2	Very high	31 Å²	31	20.6 Å²	20.6	19%	0.19	13%	0.125	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.2	143.9	160.1	-70.2	0	0	0	0	111.1	S89 S209 G246 E248	T87-S89 PolarHBondContact O-N 3.38Å; T87-S209 WeakPolarHBondContact OG1-CB 3.44Å; T87-G246 WeakPolarHBondContact OG1-CA 3.24Å; T87-E248 VanDerWaalsContact CB-CD 3.48Å; T87-E248 WeakPolarHBondContact CB-OE1 3.1Å; T87-E248 WeakPolarHBondContact CB-OE2 3.45Å; T87-E248 PolarHBondContact N-OE2 3.32Å; T87-E248 VanDerWaalsContact OG1-CD 3.22Å; T87-E248 PolarHBondContact OG1-OE1 3.1Å; T87-E248 PolarHBondContact OG1-OE2 3.28Å
88	G	83.3	Confident	88.7	Confident	36 Å²	36	18.9 Å²	18.9	37%	0.371	13%	0.13	S	C	.	.	T	Hydrogen-bonded Turn	trans	67.4	11.4	-175.1	0	0	0	0	0	115.3	R13	R13-G88 VanDerWaalsContact CZ-O 3.28Å; R13-G88 PolarHBondContact NE-O 2.77Å; R13-G88 PolarHBondContact NH2-O 2.8Å
89	S	89.3	Confident	86.5	Confident	2 Å²	2	23.2 Å²	23.2	1%	0.014	16%	0.162	C	C	.	.	S	Bend	trans	-86.6	-12.4	176.6	64.4	0	0	0	0	115.1	Q86 T87 C323	Q86-S89 VanDerWaalsContact O-CB 3.24Å; Q86-S89 WeakPolarHBondContact O-CB 3.4Å; Q86-S89 PolarHBondContact O-N 3.33Å; Q86-S89 PolarHBondContact O-OG 3.16Å; T87-S89 PolarHBondContact O-N 3.38Å; S89-C323 WeakPolarHBondContact CB-O 3.24Å; S89-C323 PolarHBondContact OG-O 3.34Å
90	G	89	Confident	84.2	Confident	17 Å²	17	29.9 Å²	29.9	18%	0.175	19%	0.191	C	C	.	.	S	Bend	trans	105.9	13.6	178.7	0	0	0	0	0	116.5	Y93 T94	G90-Y93 PolarHBondContact O-N 3.39Å; G90-T94 WeakPolarHBondContact O-CB 3.45Å; G90-T94 PolarHBondContact O-N 3.47Å; G90-T94 PolarHBondContact O-OG1 2.83Å
91	K	91.6	Very high	81.5	Confident	8 Å²	8	32.9 Å²	32.9	4%	0.035	22%	0.222	C	C	.	.	H	α-helix	trans	-53	-61.9	178.2	-58.8	-169.9	-64.1	-71.7	0	113.2	C83 G85 Q86 Y93 T94 L95 D243 L244 A245 C323	C83-K91 HydrophobicContact CB-CB 3.86Å; C83-K91 HydrophobicContact CB-CG 4.26Å; G85-K91 PolarHBondContact O-NZ 2.85Å; Q86-K91 PolarHBondContact O-NZ 2.78Å; K91-Y93 PolarHBondContact O-N 3.37Å; K91-T94 PolarHBondContact O-N 2.84Å; K91-T94 VanDerWaalsContact O-N 3.12Å; K91-L95 PolarHBondContact O-N 2.93Å; K91-D243 WeakPolarHBondContact CB-OD1 3.27Å; K91-L244 WeakPolarHBondContact CE-O 3.45Å; K91-A245 WeakPolarHBondContact CE-O 3.35Å; K91-C323 HydrophobicContact CG-CB 4.07Å
92	T	89.2	Confident	78.7	Confident	54 Å²	54	38.9 Å²	38.9	33%	0.331	25%	0.254	S	S	.	.	H	α-helix	trans	-62.8	-38.5	-178.4	-40.3	0	0	0	0	112.3	T94 L95 G96 D243	T92-T94 VanDerWaalsContact C-N 3.34Å; T92-T94 PolarHBondContact O-N 3.27Å; T92-L95 PolarHBondContact O-N 2.83Å; T92-G96 PolarHBondContact O-N 2.98Å; T92-D243 WeakPolarHBondContact CB-OD2 3.15Å; T92-D243 WeakPolarHBondContact CG2-OD2 3.24Å; T92-D243 PolarHBondContact N-OD1 3.02Å; T92-D243 PolarHBondContact OG1-OD2 3.22Å
93	Y	89	Confident	75.9	Confident	89 Å²	89	47.4 Å²	47.4	35%	0.349	30%	0.299	S	S	.	.	H	α-helix	trans	-63.1	-37.3	173.8	165.4	-103.3	0	0	0	112.6	Q58 G90 K91 G97 E107	Q58-Y93 PolarHBondContact NE2-O 2.99Å; G90-Y93 PolarHBondContact O-N 3.39Å; K91-Y93 PolarHBondContact O-N 3.37Å; Y93-G97 WeakPolarHBondContact CD2-O 3.4Å; Y93-G97 WeakPolarHBondContact O-CA 3.32Å; Y93-G97 PolarHBondContact O-N 3.15Å; Y93-E107 PolarHBondContact OH-OE2 2.87Å
94	T	91.8	Very high	73.4	Confident	2 Å²	2	55.7 Å²	55.7	1%	0.012	34%	0.342	C	S	.	.	H	α-helix	trans	-70	-34.5	175.8	-54.3	0	0	0	0	111.5	R11 V61 G90 K91 T92 I110 V321	R11-T94 PolarHBondContact NH1-OG1 3.33Å; V61-T94 HydrophobicContact CG1-CG2 4.38Å; G90-T94 WeakPolarHBondContact O-CB 3.45Å; G90-T94 PolarHBondContact O-N 3.47Å; G90-T94 PolarHBondContact O-OG1 2.83Å; K91-T94 PolarHBondContact O-N 2.84Å; K91-T94 VanDerWaalsContact O-N 3.12Å; T92-T94 VanDerWaalsContact C-N 3.34Å; T92-T94 PolarHBondContact O-N 3.27Å; T94-I110 HydrophobicContact CG2-CD1 3.81Å; T94-I110 WeakPolarHBondContact O-CD1 3.17Å; T94-I110 VanDerWaalsContact O-CG1 3.27Å; T94-I110 WeakPolarHBondContact O-CG1 3.3Å; T94-I110 PolarHBondContact O-N 3.02Å; T94-V321 HydrophobicContact CG2-CG1 4.08Å
95	L	90.1	Very high	71	Confident	8 Å²	8	57.9 Å²	57.9	4%	0.042	36%	0.363	C	S	.	.	H	α-helix	trans	-83.2	-41.1	-179.1	-155.6	73.6	0	0	0	113.6	K91 T92 I110 I111 L241 D243	K91-L95 PolarHBondContact O-N 2.93Å; T92-L95 PolarHBondContact O-N 2.83Å; L95-I110 HydrophobicContact CD1-CB 4.46Å; L95-I110 HydrophobicContact CD1-CG2 4.39Å; L95-I110 PolarHBondContact O-N 3.5Å; L95-I111 HydrophobicContact CD2-CD1 4.12Å; L95-I111 HydrophobicContact CG-CD1 3.9Å; L95-I111 HydrophobicContact CG-CG1 4.14Å; L95-I111 WeakPolarHBondContact O-CB 3.15Å; L95-I111 WeakPolarHBondContact O-CD1 3.48Å; L95-I111 VanDerWaalsContact O-CG1 3.24Å; L95-I111 WeakPolarHBondContact O-CG1 3.49Å; L95-I111 PolarHBondContact O-N 3.07Å; L95-L241 HydrophobicContact CD1-CB 4.25Å; L95-L241 HydrophobicContact CD2-CB 4.48Å; L95-D243 HydrophobicContact CD2-CB 3.86Å
96	G	82.1	Confident	68.8	Low	38 Å²	38	66.2 Å²	66.2	39%	0.392	41%	0.408	S	S	.	.	H	α-helix	trans	-133.2	24.3	-170.8	0	0	0	0	0	115.3	T92	T92-G96 PolarHBondContact O-N 2.98Å
97	G	73.6	Confident	67.5	Low	12 Å²	12	68.9 Å²	68.9	12%	0.124	42%	0.421	C	S	.	.			trans	78.8	-172.4	162.7	0	0	0	0	0	116.5	Y93 G109	Y93-G97 WeakPolarHBondContact CD2-O 3.4Å; Y93-G97 WeakPolarHBondContact O-CA 3.32Å; Y93-G97 PolarHBondContact O-N 3.15Å; G97-G109 VanDerWaalsContact N-CA 3.33Å
98	G	60.7	Low	67.1	Low	38 Å²	38	68.7 Å²	68.7	39%	0.392	42%	0.424	S	S	.	.	S	Bend	trans	-79.6	146.2	162.6	0	0	0	0	0	110.8	K100	G98-K100 PolarHBondContact O-N 3.18Å
99	S	45.3	Very low	67.3	Low	114 Å²	114	67 Å²	67	80%	0.797	41%	0.407	S	S	*	.			trans	-67.8	126.9	173.7	-172	0	0	0	0	110	G101	S99-G101 PolarHBondContact O-N 2.84Å
100	K	46.4	Very low	67.5	Low	142 Å²	142	67 Å²	67	62%	0.617	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.3	10.7	-171.4	-61.4	174	-179.6	168	0	116.1	G98 E191	G98-K100 PolarHBondContact O-N 3.18Å; K100-E191 IonicContact NZ-OE1 2.65Å; K100-E191 PolarHBondContact NZ-OE1 3.45Å
101	G	40.1	Very low	67.8	Low	66 Å²	66	66.7 Å²	66.7	68%	0.68	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86	-7.7	176.9	0	0	0	0	0	115.6	S99	S99-G101 PolarHBondContact O-N 2.84Å
102	N	38	Very low	67.8	Low	125 Å²	125	67.5 Å²	67.5	67%	0.668	41%	0.406	S	S	*	.			trans	-98.7	109.7	172.3	-87.6	-15.7	0	0	0	110.3	L104 A105	N102-L104 PolarHBondContact O-N 3.02Å; N102-A105 PolarHBondContact O-N 2.92Å
103	L	37.2	Very low	68	Low	179 Å²	179	66 Å²	66	94%	0.937	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.2	22.1	179.5	-67.2	162.5	0	0	0	115.3
104	L	41.7	Very low	68.3	Low	175 Å²	175	61.8 Å²	61.8	92%	0.916	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-141.1	7.2	-171.9	-67.7	175	0	0	0	113.6	N102	N102-L104 PolarHBondContact O-N 3.02Å
105	A	44.8	Very low	68.4	Low	61 Å²	61	61.7 Å²	61.7	50%	0.504	38%	0.38	S	S	.	.			trans	-144.3	92	-179.7	0	0	0	0	0	110.5	N102 E107	N102-A105 PolarHBondContact O-N 2.92Å; A105-E107 PolarHBondContact O-N 2.88Å
106	D	47.7	Very low	68.5	Low	176 Å²	176	67.1 Å²	67.1	94%	0.941	41%	0.405	S	S	*	.			trans	-83.5	16.2	-178.9	-143.4	21.7	0	0	0	112.7	G108	D106-G108 PolarHBondContact O-N 3.47Å
107	E	61.6	Low	69.1	Low	74 Å²	74	66.5 Å²	66.5	35%	0.346	39%	0.393	S	S	.	.			trans	-80.7	96.3	-175.3	-81.3	-162	154.3	0	0	112	Q58 Y93 A105	Q58-E107 HydrophobicContact CG-CB 3.89Å; Q58-E107 HydrophobicContact CG-CG 4.35Å; Y93-E107 PolarHBondContact OH-OE2 2.87Å; A105-E107 PolarHBondContact O-N 2.88Å
108	G	76.3	Confident	70	Confident	26 Å²	26	66 Å²	66	27%	0.268	39%	0.387	S	S	.	.			trans	-60.2	164.1	170.9	0	0	0	0	0	113.9	Q58 D106	Q58-G108 VanDerWaalsContact CB-O 3.24Å; Q58-G108 WeakPolarHBondContact CB-O 3.24Å; Q58-G108 WeakPolarHBondContact CG-O 3.16Å; Q58-G108 PolarHBondContact NE2-O 3.37Å; D106-G108 PolarHBondContact O-N 3.47Å
109	G	89.2	Confident	71.6	Confident	0 Å²	0	65.9 Å²	65.9	0%	0	38%	0.376	C	S	.	.			trans	-87.9	176	172	0	0	0	0	0	113.3	G97 I111 D112 C113	G97-G109 VanDerWaalsContact N-CA 3.33Å; G109-I111 PolarHBondContact O-N 3.09Å; G109-I111 VanDerWaalsContact O-N 3.14Å; G109-D112 WeakPolarHBondContact CA-OD2 3.23Å; G109-D112 PolarHBondContact N-OD2 2.96Å; G109-D112 PolarHBondContact O-N 3.49Å; G109-C113 PolarHBondContact O-N 2.92Å; G109-C113 VanDerWaalsContact O-N 3.09Å; G109-C113 PolarHBondContact O-SG 3.2Å; G109-C113 VanDerWaalsContact O-SG 3.38Å
110	I	93.4	Very high	73.8	Confident	4 Å²	4	64.3 Å²	64.3	2%	0.021	36%	0.358	C	S	.	.	H	α-helix	trans	-52.6	-34.6	169.6	-72.8	167.8	0	0	0	111.7	V66 T94 L95 V114 L241	V66-I110 HydrophobicContact CG1-CG2 4.06Å; V66-I110 HydrophobicContact CG2-CD1 4.05Å; V66-I110 HydrophobicContact CG2-CG1 4.27Å; V66-I110 HydrophobicContact CG2-CG2 4.03Å; T94-I110 HydrophobicContact CG2-CD1 3.81Å; T94-I110 WeakPolarHBondContact O-CD1 3.17Å; T94-I110 VanDerWaalsContact O-CG1 3.27Å; T94-I110 WeakPolarHBondContact O-CG1 3.3Å; T94-I110 PolarHBondContact O-N 3.02Å; L95-I110 HydrophobicContact CD1-CB 4.46Å; L95-I110 HydrophobicContact CD1-CG2 4.39Å; L95-I110 PolarHBondContact O-N 3.5Å; I110-V114 HydrophobicContact CG2-CG2 4.1Å; I110-V114 VanDerWaalsContact O-CB 3.24Å; I110-V114 WeakPolarHBondContact O-CB 3.34Å; I110-V114 WeakPolarHBondContact O-CG2 3.32Å; I110-V114 PolarHBondContact O-N 3.37Å; I110-L241 HydrophobicContact CG2-CD2 4.27Å
111	I	93.9	Very high	75.9	Confident	10 Å²	10	59 Å²	59	5%	0.051	34%	0.336	C	S	.	.	H	α-helix	trans	-64.3	-43.4	176.7	-71.4	163.8	0	0	0	111.6	L95 G109 V114 A115 L187 V190 L215 L241	L95-I111 HydrophobicContact CD2-CD1 4.12Å; L95-I111 HydrophobicContact CG-CD1 3.9Å; L95-I111 HydrophobicContact CG-CG1 4.14Å; L95-I111 WeakPolarHBondContact O-CB 3.15Å; L95-I111 WeakPolarHBondContact O-CD1 3.48Å; L95-I111 VanDerWaalsContact O-CG1 3.24Å; L95-I111 WeakPolarHBondContact O-CG1 3.49Å; L95-I111 PolarHBondContact O-N 3.07Å; G109-I111 PolarHBondContact O-N 3.09Å; G109-I111 VanDerWaalsContact O-N 3.14Å; I111-V114 PolarHBondContact O-N 2.66Å; I111-A115 WeakPolarHBondContact O-CB 3.42Å; I111-A115 PolarHBondContact O-N 2.79Å; I111-L187 HydrophobicContact CG2-CD2 3.78Å; I111-V190 HydrophobicContact CD1-CG1 4.49Å; I111-V190 HydrophobicContact CG2-CG1 4.34Å; I111-V190 HydrophobicContact CG2-CG2 4.22Å; I111-L215 HydrophobicContact CD1-CD2 4.25Å; I111-L215 HydrophobicContact CG1-CD2 4.16Å; I111-L215 HydrophobicContact CG2-CD2 4.14Å; I111-L241 HydrophobicContact CG1-CD1 3.75Å
112	D	92	Very high	78.2	Confident	25 Å²	25	56.7 Å²	56.7	13%	0.134	31%	0.309	C	S	.	.	H	α-helix	trans	-64.3	-51.6	178.5	-51.8	-92.5	0	0	0	110.4	G109 V114 A115 E116 L187	G109-D112 WeakPolarHBondContact CA-OD2 3.23Å; G109-D112 PolarHBondContact N-OD2 2.96Å; G109-D112 PolarHBondContact O-N 3.49Å; D112-V114 PolarHBondContact O-N 2.72Å; D112-A115 WeakPolarHBondContact O-CB 3.39Å; D112-A115 PolarHBondContact O-N 3.4Å; D112-A115 VanDerWaalsContact O-N 3.09Å; D112-E116 PolarHBondContact O-N 3.49Å; D112-L187 HydrophobicContact CB-CD1 4.41Å; D112-L187 HydrophobicContact CB-CD2 4.45Å
113	C	92.8	Very high	80.5	Confident	21 Å²	21	53.3 Å²	53.3	14%	0.142	30%	0.298	C	S	.	.	H	α-helix	trans	-60.2	-41.2	175.9	-51.6	0	0	0	0	112.5	Y62 G109 A115 E116 D117	Y62-C113 HydrophobicContact CD1-CB 3.85Å; Y62-C113 HydrophobicContact CD2-CB 3.41Å; Y62-C113 VanDerWaalsContact CD2-CB 3.41Å; Y62-C113 HydrophobicContact CE1-CB 4.01Å; Y62-C113 HydrophobicContact CE2-CB 3.58Å; Y62-C113 HydrophobicContact CG-CB 3.56Å; G109-C113 PolarHBondContact O-N 2.92Å; G109-C113 VanDerWaalsContact O-N 3.09Å; G109-C113 PolarHBondContact O-SG 3.2Å; G109-C113 VanDerWaalsContact O-SG 3.38Å; C113-A115 VanDerWaalsContact C-N 3.35Å; C113-A115 PolarHBondContact O-N 2.98Å; C113-E116 PolarHBondContact O-N 3.45Å; C113-D117 WeakPolarHBondContact O-CB 3.49Å; C113-D117 PolarHBondContact O-N 3.11Å
114	V	95.3	Very high	82.8	Confident	1 Å²	1	51 Å²	51	1%	0.006	28%	0.281	C	S	.	.	H	α-helix	trans	-62.6	-40.5	174.6	164.9	0	0	0	0	111.5	Y62 V66 V70 I110 I111 D112 V118 L217 L239 L241	Y62-V114 HydrophobicContact CE2-CG2 3.82Å; V66-V114 HydrophobicContact CG1-CG2 3.76Å; V70-V114 HydrophobicContact CG2-CG2 4.09Å; I110-V114 HydrophobicContact CG2-CG2 4.1Å; I110-V114 VanDerWaalsContact O-CB 3.24Å; I110-V114 WeakPolarHBondContact O-CB 3.34Å; I110-V114 WeakPolarHBondContact O-CG2 3.32Å; I110-V114 PolarHBondContact O-N 3.37Å; I111-V114 PolarHBondContact O-N 2.66Å; D112-V114 PolarHBondContact O-N 2.72Å; V114-V118 HydrophobicContact CG1-CG2 4Å; V114-V118 VanDerWaalsContact O-CB 3.23Å; V114-V118 WeakPolarHBondContact O-CB 3.42Å; V114-V118 WeakPolarHBondContact O-CG2 3.41Å; V114-V118 PolarHBondContact O-N 3.28Å; V114-L217 HydrophobicContact CG1-CD2 3.95Å; V114-L239 HydrophobicContact CG1-CD2 3.64Å; V114-L239 HydrophobicContact CG2-CD2 4.31Å; V114-L241 HydrophobicContact CB-CD1 4.3Å; V114-L241 HydrophobicContact CG1-CD1 4.2Å; V114-L241 HydrophobicContact CG2-CD1 4.24Å
115	A	94.1	Very high	84.6	Confident	0 Å²	0	46.5 Å²	46.5	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-62	-48.9	179.3	0	0	0	0	0	110.8	I111 D112 C113 F119 A183 L186 L187	I111-A115 WeakPolarHBondContact O-CB 3.42Å; I111-A115 PolarHBondContact O-N 2.79Å; D112-A115 WeakPolarHBondContact O-CB 3.39Å; D112-A115 PolarHBondContact O-N 3.4Å; D112-A115 VanDerWaalsContact O-N 3.09Å; C113-A115 VanDerWaalsContact C-N 3.35Å; C113-A115 PolarHBondContact O-N 2.98Å; A115-F119 WeakPolarHBondContact O-CD2 3.23Å; A115-F119 PolarHBondContact O-N 3.29Å; A115-A183 HydrophobicContact CB-CB 4.04Å; A115-L186 HydrophobicContact CB-CD2 3.5Å; A115-L186 VanDerWaalsContact CB-CD2 3.5Å; A115-L186 HydrophobicContact CB-CG 4.04Å; A115-L187 HydrophobicContact CB-CD1 4.31Å; A115-L187 HydrophobicContact CB-CD2 3.84Å; A115-L187 HydrophobicContact CB-CG 3.94Å
116	E	92.7	Very high	85.8	Confident	122 Å²	122	50.9 Å²	50.9	57%	0.57	26%	0.259	S	S	*	.	H	α-helix	trans	-62.8	-54.2	178.4	-67.4	-179.3	-177.2	0	0	111.8	D112 C113 V118 F119 L120	D112-E116 PolarHBondContact O-N 3.49Å; C113-E116 PolarHBondContact O-N 3.45Å; E116-V118 PolarHBondContact O-N 2.91Å; E116-F119 PolarHBondContact O-N 3.18Å; E116-L120 WeakPolarHBondContact O-CB 3.32Å; E116-L120 PolarHBondContact O-N 2.94Å
117	D	93.6	Very high	86.5	Confident	26 Å²	26	49.2 Å²	49.2	14%	0.139	25%	0.25	C	S	.	.	H	α-helix	trans	-66.5	-35.7	-174.6	-123.4	3.8	0	0	0	112.2	Y62 Q67 C113 L121	Y62-D117 VanDerWaalsContact OH-CB 3.24Å; Y62-D117 WeakPolarHBondContact OH-CB 3.24Å; Y62-D117 PolarHBondContact OH-OD2 3.19Å; Y62-D117 VanDerWaalsContact OH-OD2 3.11Å; Q67-D117 PolarHBondContact NE2-OD2 3.3Å; C113-D117 WeakPolarHBondContact O-CB 3.49Å; C113-D117 PolarHBondContact O-N 3.11Å; D117-L121 WeakPolarHBondContact O-CB 3.39Å; D117-L121 WeakPolarHBondContact O-CD1 3.37Å; D117-L121 WeakPolarHBondContact O-CG 3.45Å; D117-L121 PolarHBondContact O-N 2.69Å
118	V	94	Very high	86.6	Confident	0 Å²	0	50.6 Å²	50.6	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-61.3	-50.7	175	166.7	0	0	0	0	110.9	V70 L73 V114 E116 L122 V135	V70-V118 HydrophobicContact CG1-CG2 3.64Å; L73-V118 HydrophobicContact CD2-CG2 4.49Å; V114-V118 HydrophobicContact CG1-CG2 4Å; V114-V118 VanDerWaalsContact O-CB 3.23Å; V114-V118 WeakPolarHBondContact O-CB 3.42Å; V114-V118 WeakPolarHBondContact O-CG2 3.41Å; V114-V118 PolarHBondContact O-N 3.28Å; E116-V118 PolarHBondContact O-N 2.91Å; V118-L122 HydrophobicContact CG1-CD1 3.93Å; V118-L122 VanDerWaalsContact O-CB 3.25Å; V118-L122 WeakPolarHBondContact O-CB 3.15Å; V118-L122 WeakPolarHBondContact O-CG 3.4Å; V118-L122 PolarHBondContact O-N 3.41Å; V118-V135 HydrophobicContact CG1-CG2 4.4Å
119	F	93.2	Very high	85.6	Confident	36 Å²	36	57.7 Å²	57.7	16%	0.158	29%	0.292	C	S	.	.	H	α-helix	trans	-72.3	-33.7	-178.5	-78.6	-73.4	0	0	0	112.4	A115 E116 A123 V135 V180 T181 S182 A183 L186	A115-F119 WeakPolarHBondContact O-CD2 3.23Å; A115-F119 PolarHBondContact O-N 3.29Å; E116-F119 PolarHBondContact O-N 3.18Å; F119-A123 VanDerWaalsContact O-CB 3.29Å; F119-A123 WeakPolarHBondContact O-CB 3.48Å; F119-A123 PolarHBondContact O-N 3.04Å; F119-V135 HydrophobicContact CE1-CG2 4.15Å; F119-V135 HydrophobicContact CZ-CB 4.21Å; F119-V135 HydrophobicContact CZ-CG1 4.47Å; F119-V135 HydrophobicContact CZ-CG2 4.2Å; F119-V180 HydrophobicContact CZ-CB 4.46Å; F119-V180 HydrophobicContact CZ-CG2 4.08Å; F119-T181 VanDerWaalsContact CE1-C 3.43Å; F119-T181 WeakPolarHBondContact CE1-O 3.44Å; F119-S182 VanDerWaalsContact CE2-O 3.23Å; F119-S182 WeakPolarHBondContact CE2-O 3.47Å; F119-A183 HydrophobicContact CD2-CB 4.07Å; F119-A183 VanDerWaalsContact CD2-N 3.32Å; F119-L186 HydrophobicContact CE2-CB 4.31Å; F119-L186 HydrophobicContact CE2-CD2 4.13Å
120	L	91.8	Very high	84.6	Confident	81 Å²	81	59.6 Å²	59.6	42%	0.424	31%	0.305	S	S	.	.	H	α-helix	trans	-69.9	-42.1	177.1	-178.8	146.5	0	0	0	112.5	E116 A123 K124	E116-L120 WeakPolarHBondContact O-CB 3.32Å; E116-L120 PolarHBondContact O-N 2.94Å; L120-A123 PolarHBondContact O-N 2.67Å; L120-K124 HydrophobicContact CD2-CD 4.01Å; L120-K124 VanDerWaalsContact CD2-CE 3.45Å; L120-K124 WeakPolarHBondContact O-CG 3.35Å; L120-K124 PolarHBondContact O-N 3.12Å
121	L	90.1	Very high	83.8	Confident	30 Å²	30	61.3 Å²	61.3	16%	0.157	31%	0.314	C	S	.	.	H	α-helix	trans	-71.4	-35.5	174.3	-68.2	169	0	0	0	111.9	V70 L74 D117 K124 R125	V70-L121 HydrophobicContact CG1-CD1 4.03Å; L74-L121 HydrophobicContact CD1-CB 3.42Å; L74-L121 VanDerWaalsContact CD1-CB 3.42Å; L74-L121 HydrophobicContact CD1-CD1 4.07Å; L74-L121 HydrophobicContact CD1-CG 4.39Å; D117-L121 WeakPolarHBondContact O-CB 3.39Å; D117-L121 WeakPolarHBondContact O-CD1 3.37Å; D117-L121 WeakPolarHBondContact O-CG 3.45Å; D117-L121 PolarHBondContact O-N 2.69Å; L121-K124 HydrophobicContact CD2-CD 4.3Å; L121-K124 PolarHBondContact O-N 3.44Å; L121-R125 WeakPolarHBondContact O-CG 3.39Å; L121-R125 PolarHBondContact O-N 2.9Å
122	L	89.1	Confident	83.4	Confident	19 Å²	19	65.2 Å²	65.2	10%	0.099	33%	0.332	C	S	.	.	H	α-helix	trans	-65	-41.7	170.9	-77.1	175.7	0	0	0	111.9	L74 V118 R125 K126 A133 V135 V219 I221	L74-L122 HydrophobicContact CD2-CD1 4.42Å; L74-L122 HydrophobicContact CD2-CD2 3.69Å; L74-L122 HydrophobicContact CD2-CG 3.87Å; V118-L122 HydrophobicContact CG1-CD1 3.93Å; V118-L122 VanDerWaalsContact O-CB 3.25Å; V118-L122 WeakPolarHBondContact O-CB 3.15Å; V118-L122 WeakPolarHBondContact O-CG 3.4Å; V118-L122 PolarHBondContact O-N 3.41Å; L122-R125 CarbonylContact O-C 3.59Å; L122-R125 PolarHBondContact O-N 3.21Å; L122-K126 WeakPolarHBondContact O-CB 3.5Å; L122-K126 PolarHBondContact O-N 3.46Å; L122-A133 HydrophobicContact CD1-CB 4.34Å; L122-A133 HydrophobicContact CD2-CB 3.58Å; L122-V135 HydrophobicContact CD1-CG2 3.62Å; L122-V219 HydrophobicContact CD1-CG1 4.38Å; L122-V219 HydrophobicContact CD2-CG1 4.49Å; L122-I221 HydrophobicContact CD2-CD1 4.2Å
123	A	87	Confident	83.1	Confident	54 Å²	54	66 Å²	66	45%	0.446	34%	0.341	S	S	.	.	H	α-helix	trans	-61.4	-45	174.6	0	0	0	0	0	111.8	F119 L120 R125 K126	F119-A123 VanDerWaalsContact O-CB 3.29Å; F119-A123 WeakPolarHBondContact O-CB 3.48Å; F119-A123 PolarHBondContact O-N 3.04Å; L120-A123 PolarHBondContact O-N 2.67Å; A123-R125 VanDerWaalsContact C-N 3.34Å; A123-R125 PolarHBondContact O-N 3.34Å; A123-K126 WeakPolarHBondContact O-CB 3.29Å; A123-K126 PolarHBondContact O-N 3.11Å; A123-K126 VanDerWaalsContact O-N 3.12Å
124	K	85.1	Confident	83.1	Confident	131 Å²	131	67.7 Å²	67.7	57%	0.57	35%	0.351	S	S	*	.	H	α-helix	trans	-56.6	-44.4	172.8	-74.4	169.1	178.1	173.3	0	112.2	L120 L121 K126	L120-K124 HydrophobicContact CD2-CD 4.01Å; L120-K124 VanDerWaalsContact CD2-CE 3.45Å; L120-K124 WeakPolarHBondContact O-CG 3.35Å; L120-K124 PolarHBondContact O-N 3.12Å; L121-K124 HydrophobicContact CD2-CD 4.3Å; L121-K124 PolarHBondContact O-N 3.44Å; K124-K126 VanDerWaalsContact C-N 3.31Å; K124-K126 PolarHBondContact O-N 3.45Å
125	R	79.3	Confident	83	Confident	80 Å²	80	67.8 Å²	67.8	30%	0.302	35%	0.352	S	S	.	.	H	α-helix	trans	-73	-16.3	177.6	-69.6	178.9	-176.3	-145.7	-3.3	114	L74 D75 L121 L122 A123	L74-R125 PolarHBondContact O-NH1 2.98Å; L74-R125 VanDerWaalsContact O-NH1 3.13Å; D75-R125 IonicContact OD1-CZ 3.26Å; D75-R125 VanDerWaalsContact OD1-CZ 3.26Å; D75-R125 IonicContact OD1-NH1 2.77Å; D75-R125 PolarHBondContact OD1-NH1 2.86Å; D75-R125 IonicContact OD1-NH2 2.79Å; D75-R125 PolarHBondContact OD1-NH2 3.23Å; L121-R125 WeakPolarHBondContact O-CG 3.39Å; L121-R125 PolarHBondContact O-N 2.9Å; L122-R125 CarbonylContact O-C 3.59Å; L122-R125 PolarHBondContact O-N 3.21Å; A123-R125 VanDerWaalsContact C-N 3.34Å; A123-R125 PolarHBondContact O-N 3.34Å
126	K	69.8	Low	83	Confident	152 Å²	152	69 Å²	69	66%	0.661	36%	0.358	S	S	*	.	H	α-helix	trans	-83.6	-12.8	-179.8	-168.8	177.2	177.9	-175.5	0	113.6	L122 A123 K124 D128	L122-K126 WeakPolarHBondContact O-CB 3.5Å; L122-K126 PolarHBondContact O-N 3.46Å; A123-K126 WeakPolarHBondContact O-CB 3.29Å; A123-K126 PolarHBondContact O-N 3.11Å; A123-K126 VanDerWaalsContact O-N 3.12Å; K124-K126 VanDerWaalsContact C-N 3.31Å; K124-K126 PolarHBondContact O-N 3.45Å; K126-D128 PolarHBondContact O-N 3.43Å
127	N	61.8	Low	83.2	Confident	142 Å²	142	63.3 Å²	63.3	76%	0.759	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70	-14.6	171.8	-72.2	-12.5	0	0	0	112.9
128	D	63.9	Low	83.2	Confident	102 Å²	102	62.8 Å²	62.8	55%	0.545	33%	0.329	S	S	.	.	S	Bend	trans	-82.4	109.5	160.3	-69.6	-41.1	0	0	0	108.7	K126 S130 I131	K126-D128 PolarHBondContact O-N 3.43Å; D128-S130 PolarHBondContact O-N 2.95Å; D128-I131 HydrophobicContact CB-CD1 4.41Å; D128-I131 HydrophobicContact CB-CG1 4.5Å; D128-I131 PolarHBondContact O-N 2.95Å
129	D	55.9	Low	83.1	Confident	176 Å²	176	63.1 Å²	63.1	94%	0.941	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.1	1.6	-178.2	-79.6	-40.2	0	0	0	116
130	S	67.1	Low	83.1	Confident	40 Å²	40	61.9 Å²	61.9	28%	0.28	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.3	-1.7	-175.5	67.8	0	0	0	0	114.8	D128 S223 H224	D128-S130 PolarHBondContact O-N 2.95Å; S130-S223 WeakPolarHBondContact O-CA 3.35Å; S130-H224 WeakPolarHBondContact CB-O 3.11Å; S130-H224 PolarHBondContact O-N 2.86Å
131	I	77.5	Confident	83	Confident	40 Å²	40	58.4 Å²	58.4	21%	0.205	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	118.8	-170.8	-54	-174.9	0	0	0	111.8	D128 I221	D128-I131 HydrophobicContact CB-CD1 4.41Å; D128-I131 HydrophobicContact CB-CG1 4.5Å; D128-I131 PolarHBondContact O-N 2.95Å; I131-I221 HydrophobicContact CG2-CG2 3.54Å
132	E	84.5	Confident	83	Confident	92 Å²	92	57.1 Å²	57.1	43%	0.43	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	126.3	172	-174.6	-162	-177.9	0	0	109.3	I221 R222	E132-I221 WeakPolarHBondContact O-CA 3.15Å; E132-R222 HydrophobicContact CB-CB 4.42Å; E132-R222 PolarHBondContact N-O 2.82Å; E132-R222 PolarHBondContact O-N 2.96Å; E132-R222 IonicContact OE1-CZ 2.73Å; E132-R222 IonicContact OE1-NE 3.76Å; E132-R222 IonicContact OE1-NH2 2.86Å; E132-R222 PolarHBondContact OE1-NH2 2.97Å; E132-R222 IonicContact OE2-CZ 3.63Å; E132-R222 IonicContact OE2-NE 3.68Å; E132-R222 PolarHBondContact OE2-NE 3.04Å; E132-R222 IonicContact OE2-NH2 3.87Å; E132-R222 PolarHBondContact OE2-NH2 2.95Å
133	A	87.4	Confident	82.8	Confident	40 Å²	40	57.3 Å²	57.3	33%	0.331	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	139.5	179.2	0	0	0	0	0	111.5	L122 R220 I221	L122-A133 HydrophobicContact CD1-CB 4.34Å; L122-A133 HydrophobicContact CD2-CB 3.58Å; A133-R220 CarbonylContact C-O 3.56Å; A133-R220 WeakPolarHBondContact CA-O 3.34Å; A133-I221 HydrophobicContact CB-CG1 4.17Å
134	T	91.1	Very high	82.4	Confident	57 Å²	57	60.1 Å²	60.1	35%	0.35	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	140	168.5	59.3	0	0	0	0	110.2	R220	T134-R220 PolarHBondContact N-O 3.47Å; T134-R220 PolarHBondContact O-N 2.76Å
135	V	94.3	Very high	82.5	Confident	4 Å²	4	56.5 Å²	56.5	2%	0.024	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	128.3	176.1	-175.1	0	0	0	0	108.1	V118 F119 L122 V179 V180 V219	V118-V135 HydrophobicContact CG1-CG2 4.4Å; F119-V135 HydrophobicContact CE1-CG2 4.15Å; F119-V135 HydrophobicContact CZ-CB 4.21Å; F119-V135 HydrophobicContact CZ-CG1 4.47Å; F119-V135 HydrophobicContact CZ-CG2 4.2Å; L122-V135 HydrophobicContact CD1-CG2 3.62Å; V135-V179 WeakPolarHBondContact O-CA 3.27Å; V135-V180 HydrophobicContact CB-CG2 4.06Å; V135-V180 HydrophobicContact CG1-CG2 3.74Å; V135-V180 PolarHBondContact O-N 2.99Å; V135-V219 HydrophobicContact CG2-CG2 4.47Å
136	Q	94.7	Very high	82.8	Confident	26 Å²	26	57.3 Å²	57.3	12%	0.121	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	150.1	173.5	-66.8	-175.2	-96.2	0	0	109.8	E177 M178 V179 L217 Q218	Q136-E177 PolarHBondContact NE2-OE2 3.27Å; Q136-M178 CarbonylContact C-O 3.46Å; Q136-M178 VanDerWaalsContact CA-O 3.3Å; Q136-M178 WeakPolarHBondContact CA-O 3.4Å; Q136-V179 HydrophobicContact CG-CG2 4.12Å; Q136-L217 CarbonylContact O-C 3.59Å; Q136-L217 WeakPolarHBondContact O-CA 3.34Å; Q136-Q218 HydrophobicContact CB-CB 4.45Å; Q136-Q218 PolarHBondContact N-O 2.9Å; Q136-Q218 PolarHBondContact O-N 3.3Å
137	I	95.6	Very high	83.7	Confident	2 Å²	2	51 Å²	51	1%	0.01	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	140.4	-177.6	121.8	-171	0	0	0	110.7	L151 E177 M178 V180 L186 A189 L215 T216 L217	I137-L151 HydrophobicContact CD1-CD1 4.43Å; I137-L151 HydrophobicContact CG1-CD1 3.83Å; I137-E177 WeakPolarHBondContact O-CB 3.5Å; I137-M178 HydrophobicContact CG1-CB 4.39Å; I137-M178 PolarHBondContact N-O 2.92Å; I137-M178 PolarHBondContact O-N 2.98Å; I137-V180 HydrophobicContact CD1-CG1 4.12Å; I137-L186 HydrophobicContact CD1-CD1 3.96Å; I137-L186 HydrophobicContact CG2-CD1 3.71Å; I137-A189 HydrophobicContact CD1-CB 3.59Å; I137-L215 HydrophobicContact CG1-CD1 4.5Å; I137-L215 HydrophobicContact CG2-CD1 4.09Å; I137-T216 VanDerWaalsContact CA-O 3.3Å; I137-T216 WeakPolarHBondContact CA-O 3.48Å; I137-T216 WeakPolarHBondContact CG2-O 3.36Å; I137-L217 HydrophobicContact CG2-CB 4.43Å; I137-L217 HydrophobicContact CG2-CG 3.89Å
138	S	93.4	Very high	84.9	Confident	15 Å²	15	48 Å²	48	11%	0.105	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	139.8	162.4	52	0	0	0	0	109.2	T216	S138-T216 PolarHBondContact N-O 3.5Å; S138-T216 PolarHBondContact O-N 3Å
139	Y	93.4	Very high	86.2	Confident	7 Å²	7	43.4 Å²	43.4	3%	0.027	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128	123.6	-177.2	-165.3	-152.7	0	0	0	109	L150 V190 N194 V213 L215	Y139-L150 HydrophobicContact CD1-CB 3.55Å; Y139-L150 HydrophobicContact CD1-CD1 3.78Å; Y139-L150 HydrophobicContact CD1-CG 4.33Å; Y139-L150 HydrophobicContact CD2-CD1 4.19Å; Y139-L150 HydrophobicContact CE1-CB 4.2Å; Y139-L150 HydrophobicContact CE1-CD1 3.7Å; Y139-L150 HydrophobicContact CE2-CD1 4.15Å; Y139-L150 HydrophobicContact CG-CB 3.9Å; Y139-L150 HydrophobicContact CG-CD1 4.02Å; Y139-L150 PolarHBondContact O-N 3.11Å; Y139-V190 HydrophobicContact CE1-CG1 4.31Å; Y139-N194 PolarHBondContact OH-OD1 3.14Å; Y139-V213 HydrophobicContact CD2-CG1 4.06Å; Y139-V213 HydrophobicContact CE2-CG1 3.21Å; Y139-L215 HydrophobicContact CD2-CB 3.66Å; Y139-L215 HydrophobicContact CD2-CD1 3.73Å; Y139-L215 HydrophobicContact CD2-CG 4.27Å; Y139-L215 HydrophobicContact CE2-CB 3.82Å; Y139-L215 HydrophobicContact CE2-CD1 4.38Å; Y139-L215 HydrophobicContact CG-CD1 3.95Å
140	M	91.6	Very high	87.8	Confident	10 Å²	10	35.4 Å²	35.4	5%	0.049	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	146.6	-170.7	-66.4	179.2	-72.1	0	0	112	R148 V172 A175 V213 I214	M140-R148 WeakPolarHBondContact CA-O 3.43Å; M140-V172 HydrophobicContact CE-CG2 4.16Å; M140-V172 HydrophobicContact SD-CB 4.15Å; M140-V172 HydrophobicContact SD-CG1 3.95Å; M140-V172 HydrophobicContact SD-CG2 4.13Å; M140-A175 HydrophobicContact SD-CB 4.03Å; M140-V213 WeakPolarHBondContact O-CA 3.4Å; M140-I214 PolarHBondContact N-O 2.8Å; M140-I214 PolarHBondContact O-N 2.86Å
141	E	90.5	Very high	88.8	Confident	7 Å²	7	34.1 Å²	34.1	3%	0.033	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	138.1	169.3	-177.5	168.1	-115.6	0	0	110.5	L147 R148 L150 R197 H207 S211 H212 V213	E141-L147 CarbonylContact O-C 3.56Å; E141-L147 WeakPolarHBondContact O-CA 3.43Å; E141-R148 HydrophobicContact CB-CB 4.48Å; E141-R148 PolarHBondContact N-O 3.34Å; E141-R148 PolarHBondContact O-N 3.3Å; E141-L150 HydrophobicContact CB-CD1 4.14Å; E141-L150 HydrophobicContact CB-CD2 4Å; E141-L150 HydrophobicContact CB-CG 4.08Å; E141-R197 WeakPolarHBondContact OE1-CG 3.49Å; E141-R197 IonicContact OE1-NE 2.87Å; E141-R197 PolarHBondContact OE1-NE 3.15Å; E141-H207 IonicContact OE1-CE1 3.86Å; E141-H207 PolarHBondContact OE1-CE1 3.39Å; E141-H207 VanDerWaalsContact OE1-CE1 3.28Å; E141-H207 IonicContact OE1-ND1 3.19Å; E141-H207 IonicContact OE2-CE1 2.67Å; E141-S211 WeakPolarHBondContact OE1-CB 3.27Å; E141-S211 PolarHBondContact OE1-OG 2.61Å; E141-H212 CarbonylContact C-O 3.51Å; E141-H212 WeakPolarHBondContact CA-O 3.28Å; E141-V213 HydrophobicContact CB-CG2 4.13Å; E141-V213 HydrophobicContact CG-CG2 4.11Å
142	L	89.2	Confident	89.1	Confident	3 Å²	3	33.8 Å²	33.8	2%	0.016	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	109.2	167.8	-178.4	76	0	0	0	108.6	E146 L147 S211 H212 K303 I304	L142-E146 WeakPolarHBondContact CA-O 3.45Å; L142-L147 HydrophobicContact CB-CD2 4.02Å; L142-L147 HydrophobicContact CD1-CD2 3.81Å; L142-L147 HydrophobicContact CD1-CG 3.84Å; L142-S211 WeakPolarHBondContact O-CA 3.29Å; L142-S211 WeakPolarHBondContact O-CB 3.47Å; L142-H212 HydrophobicContact CB-CB 4.28Å; L142-H212 PolarHBondContact N-O 2.89Å; L142-H212 PolarHBondContact O-N 2.9Å; L142-K303 HydrophobicContact CD1-CB 3.74Å; L142-K303 HydrophobicContact CD1-CD 4.04Å; L142-K303 HydrophobicContact CD2-CB 4.16Å; L142-I304 HydrophobicContact CD2-CB 3.67Å; L142-I304 HydrophobicContact CD2-CD1 4.38Å
143	Y	85.7	Confident	88.3	Confident	24 Å²	24	36.2 Å²	36.2	9%	0.094	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	126.9	-178.8	177.3	-113.1	0	0	0	109.6	E145 E146 R210 E262	Y143-E145 PolarHBondContact O-N 3.34Å; Y143-E146 PolarHBondContact N-O 3.16Å; Y143-E146 WeakPolarHBondContact O-CA 3.29Å; Y143-E146 WeakPolarHBondContact O-CB 3.4Å; Y143-E146 PolarHBondContact O-N 2.99Å; Y143-R210 WeakPolarHBondContact CD2-O 3.33Å; Y143-R210 HydrophobicContact CE2-CB 4.12Å; Y143-E262 PolarHBondContact OH-OE1 3.14Å; Y143-E262 PolarHBondContact OH-OE2 3.03Å; Y143-E262 VanDerWaalsContact OH-OE2 3.13Å
144	R	79.4	Confident	87.2	Confident	113 Å²	113	40.1 Å²	40.1	43%	0.426	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	51.2	35.6	-177.2	-57.5	176.2	177.2	176.3	0.8	114.5	E146 E262 L265	R144-E146 PolarHBondContact O-N 3.07Å; R144-E262 HydrophobicContact CG-CG 4.31Å; R144-E262 IonicContact CZ-OE2 2.67Å; R144-E262 IonicContact NE-OE2 2.71Å; R144-E262 PolarHBondContact NE-OE2 3.44Å; R144-E262 IonicContact NH2-OE2 3.59Å; R144-E262 PolarHBondContact NH2-OE2 2.91Å; R144-L265 HydrophobicContact CB-CD1 4.45Å
145	E	85.6	Confident	85.7	Confident	55 Å²	55	39.1 Å²	39.1	26%	0.257	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	61.9	15.7	-171.5	-67.7	-72.7	112.2	0	0	115.2	Y143 K303	Y143-E145 PolarHBondContact O-N 3.34Å; E145-K303 VanDerWaalsContact O-CD 3.25Å; E145-K303 WeakPolarHBondContact O-CD 3.49Å; E145-K303 WeakPolarHBondContact O-CE 3.28Å; E145-K303 PolarHBondContact O-NZ 3.11Å; E145-K303 WeakPolarHBondContact OE2-CB 3.29Å; E145-K303 WeakPolarHBondContact OE2-CG 3.43Å; E145-K303 PolarHBondContact OE2-N 3.37Å
146	E	85.9	Confident	83.9	Confident	97 Å²	97	45.5 Å²	45.5	45%	0.453	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	137.5	163.6	-62.3	174	178.4	0	0	110	L142 Y143 R144 R148	L142-E146 WeakPolarHBondContact CA-O 3.45Å; Y143-E146 PolarHBondContact N-O 3.16Å; Y143-E146 WeakPolarHBondContact O-CA 3.29Å; Y143-E146 WeakPolarHBondContact O-CB 3.4Å; Y143-E146 PolarHBondContact O-N 2.99Å; R144-E146 PolarHBondContact O-N 3.07Å; E146-R148 IonicContact OE2-CZ 3.69Å; E146-R148 IonicContact OE2-NE 2.75Å; E146-R148 IonicContact OE2-NH2 3.74Å; E146-R148 PolarHBondContact OE2-NH2 3.33Å
147	L	88.2	Confident	81.9	Confident	18 Å²	18	52.9 Å²	52.9	9%	0.094	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	137	171.4	-86.2	175	0	0	0	109.8	E141 L142 L160 I162 V172 L307	E141-L147 CarbonylContact O-C 3.56Å; E141-L147 WeakPolarHBondContact O-CA 3.43Å; L142-L147 HydrophobicContact CB-CD2 4.02Å; L142-L147 HydrophobicContact CD1-CD2 3.81Å; L142-L147 HydrophobicContact CD1-CG 3.84Å; L147-L160 HydrophobicContact CB-CB 3.78Å; L147-L160 HydrophobicContact CB-CD1 4.02Å; L147-L160 HydrophobicContact CB-CG 4.48Å; L147-L160 HydrophobicContact CD1-CB 4.34Å; L147-I162 HydrophobicContact CD1-CD1 3.91Å; L147-I162 HydrophobicContact CD1-CG1 3.66Å; L147-V172 HydrophobicContact CD1-CG1 4.25Å; L147-L307 HydrophobicContact CD1-CD1 4.47Å; L147-L307 HydrophobicContact CD2-CD1 4.01Å
148	R	88.1	Confident	80.5	Confident	80 Å²	80	56.5 Å²	56.5	30%	0.302	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	142	-180	-59.3	177.9	-177.4	-171.8	-4.4	109.8	M140 E141 E146	M140-R148 WeakPolarHBondContact CA-O 3.43Å; E141-R148 HydrophobicContact CB-CB 4.48Å; E141-R148 PolarHBondContact N-O 3.34Å; E141-R148 PolarHBondContact O-N 3.3Å; E146-R148 IonicContact OE2-CZ 3.69Å; E146-R148 IonicContact OE2-NE 2.75Å; E146-R148 IonicContact OE2-NH2 3.74Å; E146-R148 PolarHBondContact OE2-NH2 3.33Å
149	D	90.6	Very high	79.6	Confident	5 Å²	5	63.1 Å²	63.1	3%	0.027	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	120.8	178.6	-161.8	-38.4	0	0	0	109.4	L151 D152 T155 L160 R176	D149-L151 VanDerWaalsContact C-N 3.28Å; D149-L151 WeakPolarHBondContact OD1-CA 3.29Å; D149-L151 WeakPolarHBondContact OD1-CB 3.31Å; D149-L151 PolarHBondContact OD1-N 2.97Å; D149-D152 HydrophobicContact CB-CB 3.99Å; D149-T155 HydrophobicContact CB-CG2 3.75Å; D149-T155 WeakPolarHBondContact O-CG2 3.49Å; D149-L160 HydrophobicContact CB-CD1 4.24Å; D149-R176 VanDerWaalsContact OD2-CB 3.28Å; D149-R176 WeakPolarHBondContact OD2-CB 3.4Å; D149-R176 PolarHBondContact OD2-N 2.93Å
150	L	89.5	Confident	79.3	Confident	8 Å²	8	63.3 Å²	63.3	4%	0.042	30%	0.301	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.7	1	178.1	-63.4	-179.6	0	0	0	112.5	Y139 E141 G193 R197 V213	Y139-L150 HydrophobicContact CD1-CB 3.55Å; Y139-L150 HydrophobicContact CD1-CD1 3.78Å; Y139-L150 HydrophobicContact CD1-CG 4.33Å; Y139-L150 HydrophobicContact CD2-CD1 4.19Å; Y139-L150 HydrophobicContact CE1-CB 4.2Å; Y139-L150 HydrophobicContact CE1-CD1 3.7Å; Y139-L150 HydrophobicContact CE2-CD1 4.15Å; Y139-L150 HydrophobicContact CG-CB 3.9Å; Y139-L150 HydrophobicContact CG-CD1 4.02Å; Y139-L150 PolarHBondContact O-N 3.11Å; E141-L150 HydrophobicContact CB-CD1 4.14Å; E141-L150 HydrophobicContact CB-CD2 4Å; E141-L150 HydrophobicContact CB-CG 4.08Å; L150-G193 VanDerWaalsContact O-CA 3.24Å; L150-G193 WeakPolarHBondContact O-CA 3.42Å; L150-R197 HydrophobicContact CD2-CB 4.37Å; L150-V213 HydrophobicContact CD1-CG1 4.3Å; L150-V213 HydrophobicContact CD1-CG2 4.2Å
151	L	88.9	Confident	79	Confident	13 Å²	13	65.9 Å²	65.9	7%	0.068	31%	0.314	C	S	.	.	T	Hydrogen-bonded Turn	trans	-107	2.8	173.6	-53.3	-178.5	0	0	0	112.6	I137 D149 R176 M178 A189	I137-L151 HydrophobicContact CD1-CD1 4.43Å; I137-L151 HydrophobicContact CG1-CD1 3.83Å; D149-L151 VanDerWaalsContact C-N 3.28Å; D149-L151 WeakPolarHBondContact OD1-CA 3.29Å; D149-L151 WeakPolarHBondContact OD1-CB 3.31Å; D149-L151 PolarHBondContact OD1-N 2.97Å; L151-R176 HydrophobicContact CB-CB 4.32Å; L151-R176 HydrophobicContact CB-CG 4.46Å; L151-R176 WeakPolarHBondContact O-CD 3.47Å; L151-R176 PolarHBondContact O-NH1 3.45Å; L151-M178 HydrophobicContact CB-CE 4.36Å; L151-M178 HydrophobicContact CD1-CB 3.99Å; L151-M178 HydrophobicContact CD1-CE 4.46Å; L151-M178 HydrophobicContact CD2-CE 4.44Å; L151-A189 HydrophobicContact CD2-CB 4.36Å
152	D	83.1	Confident	78.9	Confident	34 Å²	34	66.2 Å²	66.2	18%	0.182	32%	0.316	C	S	.	.			trans	-123.9	127.6	-179.3	-161.6	-25.7	0	0	0	110.8	D149 N154 T155 K158	D149-D152 HydrophobicContact CB-CB 3.99Å; D152-N154 VanDerWaalsContact C-N 3.25Å; D152-N154 PolarHBondContact O-N 3.49Å; D152-N154 PolarHBondContact OD1-N 3.16Å; D152-T155 HydrophobicContact CB-CG2 4.5Å; D152-K158 IonicContact OD2-NZ 2.68Å; D152-K158 PolarHBondContact OD2-NZ 3.38Å
153	M	68.7	Low	78.8	Confident	143 Å²	143	72.7 Å²	72.7	70%	0.704	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.8	-23.9	178.4	-63.8	-66.8	-61.1	0	0	112.3	L196	M153-L196 HydrophobicContact CE-CD2 4.15Å; M153-L196 HydrophobicContact SD-CD1 4.14Å; M153-L196 HydrophobicContact SD-CD2 3.82Å; M153-L196 HydrophobicContact SD-CG 4.47Å
154	N	63.6	Low	78.6	Confident	121 Å²	121	74.5 Å²	74.5	65%	0.647	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.9	31.9	-165.2	-68.3	-14.1	0	0	0	113.2	D152 N156	D152-N154 VanDerWaalsContact C-N 3.25Å; D152-N154 PolarHBondContact O-N 3.49Å; D152-N154 PolarHBondContact OD1-N 3.16Å; N154-N156 PolarHBondContact O-N 3.32Å; N154-N156 VanDerWaalsContact O-N 3.08Å
155	T	60	Low	78.4	Confident	36 Å²	36	71.7 Å²	71.7	22%	0.221	35%	0.345	C	S	.	.	G	3₁₀ helix	trans	-53.1	-30.4	-174.7	38.5	0	0	0	0	115.9	D149 D152 H157 K158	D149-T155 HydrophobicContact CB-CG2 3.75Å; D149-T155 WeakPolarHBondContact O-CG2 3.49Å; D152-T155 HydrophobicContact CB-CG2 4.5Å; T155-H157 PolarHBondContact O-N 3.44Å; T155-K158 PolarHBondContact O-N 3.1Å
156	N	56	Low	77.6	Confident	139 Å²	139	78.7 Å²	78.7	74%	0.743	38%	0.378	S	S	*	.	G	3₁₀ helix	trans	-60.8	-6.1	-174.3	-67.8	-22.8	0	0	0	115.7	N154	N154-N156 PolarHBondContact O-N 3.32Å; N154-N156 VanDerWaalsContact O-N 3.08Å
157	H	52	Low	76.6	Confident	181 Å²	181	82.3 Å²	82.3	84%	0.838	39%	0.392	S	S	*	.	G	3₁₀ helix	trans	-125.2	11.8	-177.7	-57.4	-43.8	0	0	0	114.3	T155	T155-H157 PolarHBondContact O-N 3.44Å
158	K	67.3	Low	75.5	Confident	78 Å²	78	82.8 Å²	82.8	34%	0.339	40%	0.401	S	S	.	.			trans	-131.5	102.7	-169.3	-162.8	-169.4	-160.6	-174.2	0	111.4	D152 T155 L160 G174	D152-K158 IonicContact OD2-NZ 2.68Å; D152-K158 PolarHBondContact OD2-NZ 3.38Å; T155-K158 PolarHBondContact O-N 3.1Å; K158-L160 PolarHBondContact O-N 3.2Å; K158-G174 WeakPolarHBondContact CE-O 3.14Å; K158-G174 PolarHBondContact NZ-O 3.16Å
159	E	74.7	Confident	74.7	Confident	153 Å²	153	80.7 Å²	80.7	72%	0.715	40%	0.396	S	S	*	.			trans	-71.8	122.2	177.7	-169.8	-179.6	-163.7	0	0	111.3	L161	E159-L161 HydrophobicContact CG-CD2 3.95Å; E159-L161 HydrophobicContact CG-CG 4.24Å
160	L	86.1	Confident	74.2	Confident	12 Å²	12	80.7 Å²	80.7	6%	0.063	40%	0.396	C	S	.	.			trans	-92.2	112.6	176.5	-64.9	-175.8	0	0	0	110.9	L147 D149 K158 V172 G174 A175	L147-L160 HydrophobicContact CB-CB 3.78Å; L147-L160 HydrophobicContact CB-CD1 4.02Å; L147-L160 HydrophobicContact CB-CG 4.48Å; L147-L160 HydrophobicContact CD1-CB 4.34Å; D149-L160 HydrophobicContact CB-CD1 4.24Å; K158-L160 PolarHBondContact O-N 3.2Å; L160-V172 HydrophobicContact CB-CG1 4.15Å; L160-G174 WeakPolarHBondContact CD2-O 3.31Å; L160-A175 HydrophobicContact CD2-CB 4.43Å
161	L	85.8	Confident	73.9	Confident	64 Å²	64	83.1 Å²	83.1	34%	0.335	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	115	-171.1	-69	176.8	0	0	0	112.3	E159 R163 I173	E159-L161 HydrophobicContact CG-CD2 3.95Å; E159-L161 HydrophobicContact CG-CG 4.24Å; L161-R163 PolarHBondContact O-N 3.04Å; L161-I173 PolarHBondContact N-O 3.35Å; L161-I173 PolarHBondContact O-N 3.09Å
162	I	88.9	Confident	73.9	Confident	14 Å²	14	84 Å²	84	7%	0.072	42%	0.417	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	121.2	172.2	-49.3	174.4	0	0	0	109.5	L147 T170 K303 R306 L307	L147-I162 HydrophobicContact CD1-CD1 3.91Å; L147-I162 HydrophobicContact CD1-CG1 3.66Å; I162-T170 HydrophobicContact CG2-CG2 3.37Å; I162-K303 HydrophobicContact CD1-CB 3.77Å; I162-K303 HydrophobicContact CD1-CD 4.2Å; I162-K303 HydrophobicContact CD1-CG 3.79Å; I162-R306 HydrophobicContact CD1-CB 4.37Å; I162-R306 HydrophobicContact CG2-CB 4.21Å; I162-R306 PolarHBondContact O-NH2 2.98Å; I162-L307 HydrophobicContact CD1-CD1 4.23Å; I162-L307 HydrophobicContact CD1-CD2 4.04Å; I162-L307 HydrophobicContact CD1-CG 3.94Å; I162-L307 HydrophobicContact CG1-CD2 4.19Å
163	R	85.9	Confident	74	Confident	139 Å²	139	86.3 Å²	86.3	53%	0.525	43%	0.428	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	168.7	171	-60.1	-160.8	-173.2	166.3	-0.6	110.8	L161 V171 I173	L161-R163 PolarHBondContact O-N 3.04Å; R163-V171 HydrophobicContact CB-CG2 4.3Å; R163-V171 PolarHBondContact N-O 3.1Å; R163-V171 PolarHBondContact O-N 3.01Å; R163-V171 VanDerWaalsContact O-O 3.07Å; R163-I173 HydrophobicContact CB-CD1 4.42Å; R163-I173 HydrophobicContact CG-CD1 4.02Å
164	D	82.4	Confident	74.6	Confident	62 Å²	62	80.9 Å²	80.9	33%	0.332	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	143.8	168.1	-58.5	-28	0	0	0	108.1	N169 T170 R309	D164-N169 CarbonylContact C-O 3.59Å; D164-N169 VanDerWaalsContact CA-O 3.29Å; D164-N169 WeakPolarHBondContact CA-O 3.24Å; D164-T170 PolarHBondContact OD1-OG1 2.98Å; D164-R309 IonicContact OD1-CZ 2.95Å; D164-R309 IonicContact OD1-NH1 3.31Å; D164-R309 PolarHBondContact OD1-NH1 2.81Å; D164-R309 IonicContact OD2-CZ 2.67Å; D164-R309 IonicContact OD2-NH1 2.95Å; D164-R309 PolarHBondContact OD2-NH1 2.92Å; D164-R309 IonicContact OD2-NH2 3.04Å
165	D	74.2	Confident	75.7	Confident	54 Å²	54	76.3 Å²	76.3	29%	0.289	39%	0.388	S	S	.	.			trans	-83.9	173.8	174.3	78.1	2.4	0	0	0	112.4	K167 G168 N169 V171	D165-K167 PolarHBondContact O-N 3.4Å; D165-K167 VanDerWaalsContact O-N 3.08Å; D165-K167 VanDerWaalsContact OD1-CA 3.29Å; D165-K167 WeakPolarHBondContact OD1-CA 3.41Å; D165-K167 WeakPolarHBondContact OD1-CB 3.25Å; D165-K167 PolarHBondContact OD1-N 3.01Å; D165-G168 PolarHBondContact O-N 3.02Å; D165-G168 PolarHBondContact OD1-N 3.35Å; D165-N169 PolarHBondContact N-O 3.24Å; D165-N169 PolarHBondContact OD1-N 3.17Å; D165-N169 PolarHBondContact OD1-ND2 3.28Å; D165-N169 VanDerWaalsContact OD1-ND2 3.13Å; D165-N169 PolarHBondContact OD2-ND2 3Å; D165-V171 HydrophobicContact CB-CG1 4.27Å
166	E	70.6	Confident	77	Confident	202 Å²	202	80.1 Å²	80.1	94%	0.944	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.3	-19.8	178	-58.6	-176.3	148.2	0	0	113.9
167	K	64.1	Low	78.6	Confident	173 Å²	173	78.6 Å²	78.6	75%	0.752	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.4	-0.9	-179.7	-63.3	166.7	-173.6	171.2	0	111.6	D165 N169	D165-K167 PolarHBondContact O-N 3.4Å; D165-K167 VanDerWaalsContact O-N 3.08Å; D165-K167 VanDerWaalsContact OD1-CA 3.29Å; D165-K167 WeakPolarHBondContact OD1-CA 3.41Å; D165-K167 WeakPolarHBondContact OD1-CB 3.25Å; D165-K167 PolarHBondContact OD1-N 3.01Å; K167-N169 WeakPolarHBondContact CB-ND2 3.16Å
168	G	66.1	Low	80.5	Confident	27 Å²	27	71.6 Å²	71.6	28%	0.278	36%	0.355	S	S	.	.	S	Bend	trans	84.4	7.5	177.3	0	0	0	0	0	115.9	D165 R309	D165-G168 PolarHBondContact O-N 3.02Å; D165-G168 PolarHBondContact OD1-N 3.35Å; G168-R309 PolarHBondContact O-NH2 2.92Å
169	N	70.6	Confident	81.7	Confident	36 Å²	36	71.8 Å²	71.8	19%	0.193	36%	0.363	C	S	.	.			trans	-79.8	156.4	175.5	-43.3	-76.6	0	0	0	110.6	D164 D165 K167 D310	D164-N169 CarbonylContact C-O 3.59Å; D164-N169 VanDerWaalsContact CA-O 3.29Å; D164-N169 WeakPolarHBondContact CA-O 3.24Å; D165-N169 PolarHBondContact N-O 3.24Å; D165-N169 PolarHBondContact OD1-N 3.17Å; D165-N169 PolarHBondContact OD1-ND2 3.28Å; D165-N169 VanDerWaalsContact OD1-ND2 3.13Å; D165-N169 PolarHBondContact OD2-ND2 3Å; K167-N169 WeakPolarHBondContact CB-ND2 3.16Å; N169-D310 WeakPolarHBondContact CA-OD1 3.27Å
170	T	80.3	Confident	82.6	Confident	6 Å²	6	64.7 Å²	64.7	4%	0.037	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	123.9	179.4	-70.1	0	0	0	0	112.7	I162 D164 R306 D310	I162-T170 HydrophobicContact CG2-CG2 3.37Å; D164-T170 PolarHBondContact OD1-OG1 2.98Å; T170-R306 PolarHBondContact OG1-O 3.47Å; T170-D310 PolarHBondContact N-OD1 3.44Å; T170-D310 PolarHBondContact N-OD2 3.09Å
171	V	83.6	Confident	82.9	Confident	59 Å²	59	69.2 Å²	69.2	36%	0.358	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	148.7	-178.3	-65.4	0	0	0	0	111.5	R163 D165	R163-V171 HydrophobicContact CB-CG2 4.3Å; R163-V171 PolarHBondContact N-O 3.1Å; R163-V171 PolarHBondContact O-N 3.01Å; R163-V171 VanDerWaalsContact O-O 3.07Å; D165-V171 HydrophobicContact CB-CG1 4.27Å
172	V	87.6	Confident	83.2	Confident	32 Å²	32	68.1 Å²	68.1	19%	0.194	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	110.3	177.7	-175.1	0	0	0	0	109.2	M140 L147 L160 A175 L307	M140-V172 HydrophobicContact CE-CG2 4.16Å; M140-V172 HydrophobicContact SD-CB 4.15Å; M140-V172 HydrophobicContact SD-CG1 3.95Å; M140-V172 HydrophobicContact SD-CG2 4.13Å; L147-V172 HydrophobicContact CD1-CG1 4.25Å; L160-V172 HydrophobicContact CB-CG1 4.15Å; V172-A175 HydrophobicContact CB-CB 4.47Å; V172-A175 HydrophobicContact CG1-CB 4.22Å; V172-L307 HydrophobicContact CG2-CD2 3.5Å; V172-L307 VanDerWaalsContact CG2-CD2 3.5Å
173	I	84.9	Confident	83.4	Confident	81 Å²	81	68.4 Å²	68.4	42%	0.415	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	133.6	178.2	-59	-174.5	0	0	0	109.1	L161 R163	L161-I173 PolarHBondContact N-O 3.35Å; L161-I173 PolarHBondContact O-N 3.09Å; R163-I173 HydrophobicContact CB-CD1 4.42Å; R163-I173 HydrophobicContact CG-CD1 4.02Å
174	G	82.1	Confident	83.7	Confident	30 Å²	30	69.6 Å²	69.6	31%	0.309	37%	0.372	S	S	.	.	T	Hydrogen-bonded Turn	trans	99.6	-13.6	179.9	0	0	0	0	0	114.8	K158 L160	K158-G174 WeakPolarHBondContact CE-O 3.14Å; K158-G174 PolarHBondContact NZ-O 3.16Å; L160-G174 WeakPolarHBondContact CD2-O 3.31Å
175	A	86	Confident	84.2	Confident	24 Å²	24	70.5 Å²	70.5	20%	0.198	37%	0.374	C	S	.	.			trans	-68.2	147.6	176.2	0	0	0	0	0	111.4	M140 L160 V172 E177	M140-A175 HydrophobicContact SD-CB 4.03Å; L160-A175 HydrophobicContact CD2-CB 4.43Å; V172-A175 HydrophobicContact CB-CB 4.47Å; V172-A175 HydrophobicContact CG1-CB 4.22Å; A175-E177 PolarHBondContact O-N 3.38Å
176	R	87.8	Confident	85.1	Confident	117 Å²	117	68 Å²	68	44%	0.442	36%	0.36	S	S	.	.			trans	-82	109.1	-178.3	-174.7	-179.9	179.6	176.4	1.4	111.7	D149 L151 M178	D149-R176 VanDerWaalsContact OD2-CB 3.28Å; D149-R176 WeakPolarHBondContact OD2-CB 3.4Å; D149-R176 PolarHBondContact OD2-N 2.93Å; L151-R176 HydrophobicContact CB-CB 4.32Å; L151-R176 HydrophobicContact CB-CG 4.46Å; L151-R176 WeakPolarHBondContact O-CD 3.47Å; L151-R176 PolarHBondContact O-NH1 3.45Å; R176-M178 PolarHBondContact O-N 2.73Å
177	E	89.9	Confident	86.1	Confident	106 Å²	106	59.4 Å²	59.4	50%	0.495	32%	0.321	S	S	.	.			trans	-61	109.5	160.9	56.7	91.9	151.2	0	0	111.9	Q136 I137 A175	Q136-E177 PolarHBondContact NE2-OE2 3.27Å; I137-E177 WeakPolarHBondContact O-CB 3.5Å; A175-E177 PolarHBondContact O-N 3.38Å
178	M	90.5	Very high	87.4	Confident	35 Å²	35	52.5 Å²	52.5	17%	0.172	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	123.3	169.4	-174.3	179.2	-69	0	0	110.6	Q136 I137 L151 R176 V180 A189	Q136-M178 CarbonylContact C-O 3.46Å; Q136-M178 VanDerWaalsContact CA-O 3.3Å; Q136-M178 WeakPolarHBondContact CA-O 3.4Å; I137-M178 HydrophobicContact CG1-CB 4.39Å; I137-M178 PolarHBondContact N-O 2.92Å; I137-M178 PolarHBondContact O-N 2.98Å; L151-M178 HydrophobicContact CB-CE 4.36Å; L151-M178 HydrophobicContact CD1-CB 3.99Å; L151-M178 HydrophobicContact CD1-CE 4.46Å; L151-M178 HydrophobicContact CD2-CE 4.44Å; R176-M178 PolarHBondContact O-N 2.73Å; M178-V180 HydrophobicContact CG-CG1 4.41Å; M178-A189 HydrophobicContact SD-CB 3.97Å
179	V	93.3	Very high	88.6	Confident	82 Å²	82	51.2 Å²	51.2	50%	0.497	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	137.8	170.4	-178.7	0	0	0	0	108.4	V135 Q136	V135-V179 WeakPolarHBondContact O-CA 3.27Å; Q136-V179 HydrophobicContact CG-CG2 4.12Å
180	V	94.1	Very high	89.6	Confident	4 Å²	4	49.9 Å²	49.9	2%	0.024	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	145.6	175.7	-69.8	0	0	0	0	111.4	F119 V135 I137 M178 E185 L186	F119-V180 HydrophobicContact CZ-CB 4.46Å; F119-V180 HydrophobicContact CZ-CG2 4.08Å; V135-V180 HydrophobicContact CB-CG2 4.06Å; V135-V180 HydrophobicContact CG1-CG2 3.74Å; V135-V180 PolarHBondContact O-N 2.99Å; I137-V180 HydrophobicContact CD1-CG1 4.12Å; M178-V180 HydrophobicContact CG-CG1 4.41Å; V180-E185 HydrophobicContact CB-CG 4.44Å; V180-E185 HydrophobicContact CG1-CG 4.09Å; V180-L186 HydrophobicContact CG2-CB 4.43Å
181	T	91.3	Very high	90	Very high	107 Å²	107	54.4 Å²	54.4	66%	0.656	30%	0.299	S	S	*	.			trans	-119.6	-18.8	-168.2	63.9	0	0	0	0	114	F119 E185	F119-T181 VanDerWaalsContact CE1-C 3.43Å; F119-T181 WeakPolarHBondContact CE1-O 3.44Å; T181-E185 WeakPolarHBondContact CB-OE2 3.43Å; T181-E185 PolarHBondContact N-OE2 3.08Å; T181-E185 PolarHBondContact OG1-OE2 2.91Å
182	S	92.6	Very high	90.2	Very high	40 Å²	40	57.3 Å²	57.3	28%	0.28	31%	0.311	S	S	.	.	S	Bend	trans	-140	164.8	174.9	74.5	0	0	0	0	112	F119 E184 E185 L186	F119-S182 VanDerWaalsContact CE2-O 3.23Å; F119-S182 WeakPolarHBondContact CE2-O 3.47Å; S182-E184 VanDerWaalsContact C-N 3.3Å; S182-E184 PolarHBondContact OG-N 3.49Å; S182-E185 PolarHBondContact O-N 2.83Å; S182-E185 PolarHBondContact OG-N 2.82Å; S182-E185 VanDerWaalsContact OG-N 3.11Å; S182-L186 PolarHBondContact O-N 2.93Å
183	A	92.9	Very high	90.1	Very high	21 Å²	21	55.8 Å²	55.8	17%	0.174	30%	0.301	C	S	.	.	H	α-helix	trans	-61.8	-39.2	172	0	0	0	0	0	111.5	A115 F119 E185 L186 L187	A115-A183 HydrophobicContact CB-CB 4.04Å; F119-A183 HydrophobicContact CD2-CB 4.07Å; F119-A183 VanDerWaalsContact CD2-N 3.32Å; A183-E185 PolarHBondContact O-N 2.96Å; A183-L186 WeakPolarHBondContact O-CB 3.38Å; A183-L186 PolarHBondContact O-N 2.82Å; A183-L187 WeakPolarHBondContact O-CG 3.33Å; A183-L187 PolarHBondContact O-N 3.41Å
184	E	92	Very high	90.2	Very high	164 Å²	164	54.3 Å²	54.3	77%	0.766	29%	0.294	S	S	*	.	H	α-helix	trans	-59.8	-42.3	176.2	-60.4	175.3	170.2	0	0	112.5	S182 L187 G188	S182-E184 VanDerWaalsContact C-N 3.3Å; S182-E184 PolarHBondContact OG-N 3.49Å; E184-L187 PolarHBondContact O-N 3.17Å; E184-G188 PolarHBondContact O-N 3.43Å
185	E	93.6	Very high	90.1	Very high	80 Å²	80	55.5 Å²	55.5	37%	0.374	30%	0.301	S	S	.	.	H	α-helix	trans	-66.7	-39.8	178.7	-168.6	179.3	-164.7	0	0	111.4	V180 T181 S182 A183 A189	V180-E185 HydrophobicContact CB-CG 4.44Å; V180-E185 HydrophobicContact CG1-CG 4.09Å; T181-E185 WeakPolarHBondContact CB-OE2 3.43Å; T181-E185 PolarHBondContact N-OE2 3.08Å; T181-E185 PolarHBondContact OG1-OE2 2.91Å; S182-E185 PolarHBondContact O-N 2.83Å; S182-E185 PolarHBondContact OG-N 2.82Å; S182-E185 VanDerWaalsContact OG-N 3.11Å; A183-E185 PolarHBondContact O-N 2.96Å; E185-A189 WeakPolarHBondContact O-CB 3.48Å; E185-A189 PolarHBondContact O-N 2.84Å
186	L	93.8	Very high	89.8	Confident	2 Å²	2	56.8 Å²	56.8	1%	0.01	30%	0.304	C	S	.	.	H	α-helix	trans	-62.4	-48.9	173.4	169.2	56.3	0	0	0	111.9	A115 F119 I137 V180 S182 A183 A189 V190 L217	A115-L186 HydrophobicContact CB-CD2 3.5Å; A115-L186 VanDerWaalsContact CB-CD2 3.5Å; A115-L186 HydrophobicContact CB-CG 4.04Å; F119-L186 HydrophobicContact CE2-CB 4.31Å; F119-L186 HydrophobicContact CE2-CD2 4.13Å; I137-L186 HydrophobicContact CD1-CD1 3.96Å; I137-L186 HydrophobicContact CG2-CD1 3.71Å; V180-L186 HydrophobicContact CG2-CB 4.43Å; S182-L186 PolarHBondContact O-N 2.93Å; A183-L186 WeakPolarHBondContact O-CB 3.38Å; A183-L186 PolarHBondContact O-N 2.82Å; L186-A189 PolarHBondContact O-N 3.43Å; L186-V190 WeakPolarHBondContact O-CG2 3.47Å; L186-V190 PolarHBondContact O-N 2.83Å; L186-V190 VanDerWaalsContact O-N 3.1Å; L186-L217 HydrophobicContact CD2-CD2 3.85Å
187	L	92.2	Very high	89.3	Confident	22 Å²	22	51.9 Å²	51.9	12%	0.115	29%	0.286	C	S	.	.	H	α-helix	trans	-69.2	-39.4	-179.6	-63.6	178.5	0	0	0	111.9	I111 D112 A115 A183 E184 A189 V190 E191	I111-L187 HydrophobicContact CG2-CD2 3.78Å; D112-L187 HydrophobicContact CB-CD1 4.41Å; D112-L187 HydrophobicContact CB-CD2 4.45Å; A115-L187 HydrophobicContact CB-CD1 4.31Å; A115-L187 HydrophobicContact CB-CD2 3.84Å; A115-L187 HydrophobicContact CB-CG 3.94Å; A183-L187 WeakPolarHBondContact O-CG 3.33Å; A183-L187 PolarHBondContact O-N 3.41Å; E184-L187 PolarHBondContact O-N 3.17Å; L187-A189 VanDerWaalsContact C-N 3.3Å; L187-A189 PolarHBondContact O-N 3Å; L187-V190 PolarHBondContact O-N 2.96Å; L187-V190 VanDerWaalsContact O-N 3.14Å; L187-E191 WeakPolarHBondContact O-CG 3.46Å; L187-E191 PolarHBondContact O-N 3.38Å
188	G	90.7	Very high	87.9	Confident	27 Å²	27	53.3 Å²	53.3	28%	0.278	29%	0.292	S	S	.	.	H	α-helix	trans	-59.6	-38.2	172.3	0	0	0	0	0	112.9	E184 E191 M192	E184-G188 PolarHBondContact O-N 3.43Å; G188-E191 PolarHBondContact O-N 2.74Å; G188-M192 WeakPolarHBondContact O-CB 3.48Å; G188-M192 WeakPolarHBondContact O-CG 3.47Å; G188-M192 PolarHBondContact O-N 2.8Å
189	A	91.6	Very high	85.9	Confident	1 Å²	1	57 Å²	57	1%	0.008	32%	0.317	C	S	.	.	H	α-helix	trans	-67.4	-36.9	174.3	0	0	0	0	0	112.9	I137 L151 M178 E185 L186 L187 M192 G193	I137-A189 HydrophobicContact CD1-CB 3.59Å; L151-A189 HydrophobicContact CD2-CB 4.36Å; M178-A189 HydrophobicContact SD-CB 3.97Å; E185-A189 WeakPolarHBondContact O-CB 3.48Å; E185-A189 PolarHBondContact O-N 2.84Å; L186-A189 PolarHBondContact O-N 3.43Å; L187-A189 VanDerWaalsContact C-N 3.3Å; L187-A189 PolarHBondContact O-N 3Å; A189-M192 HydrophobicContact CB-CE 4.5Å; A189-G193 PolarHBondContact O-N 2.95Å
190	V	91	Very high	83.5	Confident	8 Å²	8	56 Å²	56	5%	0.048	32%	0.324	C	S	.	.	H	α-helix	trans	-68.8	-41.6	173.5	172.9	0	0	0	0	111.5	I111 Y139 L186 L187 G193 N194 L215	I111-V190 HydrophobicContact CD1-CG1 4.49Å; I111-V190 HydrophobicContact CG2-CG1 4.34Å; I111-V190 HydrophobicContact CG2-CG2 4.22Å; Y139-V190 HydrophobicContact CE1-CG1 4.31Å; L186-V190 WeakPolarHBondContact O-CG2 3.47Å; L186-V190 PolarHBondContact O-N 2.83Å; L186-V190 VanDerWaalsContact O-N 3.1Å; L187-V190 PolarHBondContact O-N 2.96Å; L187-V190 VanDerWaalsContact O-N 3.14Å; V190-G193 PolarHBondContact O-N 3.24Å; V190-N194 WeakPolarHBondContact O-CB 3.22Å; V190-N194 PolarHBondContact O-N 2.68Å; V190-N194 PolarHBondContact O-ND2 2.87Å; V190-L215 HydrophobicContact CG2-CD1 4.05Å; V190-L215 HydrophobicContact CG2-CD2 3.63Å; V190-L215 HydrophobicContact CG2-CG 4.5Å
191	E	88.8	Confident	80.8	Confident	100 Å²	100	59.4 Å²	59.4	47%	0.467	35%	0.352	S	S	.	.	H	α-helix	trans	-62.3	-43.4	175.3	-74.1	-179.2	-175	0	0	111.8	K100 L187 G188 N194 A195	K100-E191 IonicContact NZ-OE1 2.65Å; K100-E191 PolarHBondContact NZ-OE1 3.45Å; L187-E191 WeakPolarHBondContact O-CG 3.46Å; L187-E191 PolarHBondContact O-N 3.38Å; G188-E191 PolarHBondContact O-N 2.74Å; E191-N194 PolarHBondContact O-N 3.36Å; E191-A195 PolarHBondContact O-N 2.95Å
192	M	87.1	Confident	78.1	Confident	121 Å²	121	60.2 Å²	60.2	60%	0.596	36%	0.357	S	S	*	.	H	α-helix	trans	-61.1	-45.2	172.8	-74.9	-171.5	-66.9	0	0	112.4	G188 A189 N194 A195 L196	G188-M192 WeakPolarHBondContact O-CB 3.48Å; G188-M192 WeakPolarHBondContact O-CG 3.47Å; G188-M192 PolarHBondContact O-N 2.8Å; A189-M192 HydrophobicContact CB-CE 4.5Å; M192-N194 VanDerWaalsContact C-N 3.33Å; M192-N194 PolarHBondContact O-N 2.87Å; M192-A195 WeakPolarHBondContact O-CB 3.16Å; M192-A195 PolarHBondContact O-N 2.8Å; M192-L196 PolarHBondContact O-N 3.06Å
193	G	87.1	Confident	75.4	Confident	0 Å²	0	62.2 Å²	62.2	0%	0	38%	0.384	C	S	.	.	H	α-helix	trans	-66	-34.4	177.5	0	0	0	0	0	113.4	L150 A189 V190 L196 R197	L150-G193 VanDerWaalsContact O-CA 3.24Å; L150-G193 WeakPolarHBondContact O-CA 3.42Å; A189-G193 PolarHBondContact O-N 2.95Å; V190-G193 PolarHBondContact O-N 3.24Å; G193-L196 PolarHBondContact O-N 3.15Å; G193-R197 WeakPolarHBondContact O-CB 3.2Å; G193-R197 PolarHBondContact O-N 3.28Å
194	N	85.1	Confident	72.7	Confident	50 Å²	50	67.5 Å²	67.5	27%	0.267	41%	0.406	S	S	.	.	H	α-helix	trans	-67.2	-39.2	171.5	-78.8	-36.5	0	0	0	111.9	Y139 V190 E191 M192 L196 R197 H198	Y139-N194 PolarHBondContact OH-OD1 3.14Å; V190-N194 WeakPolarHBondContact O-CB 3.22Å; V190-N194 PolarHBondContact O-N 2.68Å; V190-N194 PolarHBondContact O-ND2 2.87Å; E191-N194 PolarHBondContact O-N 3.36Å; M192-N194 VanDerWaalsContact C-N 3.33Å; M192-N194 PolarHBondContact O-N 2.87Å; N194-L196 VanDerWaalsContact C-N 3.35Å; N194-L196 PolarHBondContact O-N 3.33Å; N194-R197 WeakPolarHBondContact O-CB 3.46Å; N194-R197 PolarHBondContact O-N 2.83Å; N194-H198 PolarHBondContact O-CD2 2.84Å; N194-H198 PolarHBondContact O-N 3.02Å
195	A	81.8	Confident	70.4	Confident	55 Å²	55	62 Å²	62	46%	0.455	38%	0.383	S	S	.	.	H	α-helix	trans	-61	-43.8	172.8	0	0	0	0	0	111.4	E191 M192 R197 H198 T199	E191-A195 PolarHBondContact O-N 2.95Å; M192-A195 WeakPolarHBondContact O-CB 3.16Å; M192-A195 PolarHBondContact O-N 2.8Å; A195-R197 PolarHBondContact O-N 2.98Å; A195-H198 PolarHBondContact O-N 2.87Å; A195-T199 WeakPolarHBondContact O-CG2 3.27Å; A195-T199 PolarHBondContact O-N 2.96Å; A195-T199 VanDerWaalsContact O-N 3.09Å
196	L	79	Confident	68.6	Low	51 Å²	51	64.2 Å²	64.2	27%	0.267	39%	0.393	S	S	.	.	H	α-helix	trans	-60.9	-42.8	173.4	-72.3	172.5	0	0	0	112.1	M153 M192 G193 N194 H198 T199	M153-L196 HydrophobicContact CE-CD2 4.15Å; M153-L196 HydrophobicContact SD-CD1 4.14Å; M153-L196 HydrophobicContact SD-CD2 3.82Å; M153-L196 HydrophobicContact SD-CG 4.47Å; M192-L196 PolarHBondContact O-N 3.06Å; G193-L196 PolarHBondContact O-N 3.15Å; N194-L196 VanDerWaalsContact C-N 3.35Å; N194-L196 PolarHBondContact O-N 3.33Å; L196-H198 PolarHBondContact O-N 3.13Å; L196-T199 PolarHBondContact O-N 3.34Å; L196-T199 PolarHBondContact O-OG1 2.84Å
197	R	78.2	Confident	66.8	Low	13 Å²	13	65.9 Å²	65.9	5%	0.049	40%	0.401	C	S	.	.	H	α-helix	trans	-58	-26.9	172.3	-173.3	175.2	-166.5	-156.8	5	113.4	E141 L150 G193 N194 A195 H207 S211 D243	E141-R197 WeakPolarHBondContact OE1-CG 3.49Å; E141-R197 IonicContact OE1-NE 2.87Å; E141-R197 PolarHBondContact OE1-NE 3.15Å; L150-R197 HydrophobicContact CD2-CB 4.37Å; G193-R197 WeakPolarHBondContact O-CB 3.2Å; G193-R197 PolarHBondContact O-N 3.28Å; N194-R197 WeakPolarHBondContact O-CB 3.46Å; N194-R197 PolarHBondContact O-N 2.83Å; A195-R197 PolarHBondContact O-N 2.98Å; R197-H207 PolarHBondContact O-ND1 2.83Å; R197-S211 PolarHBondContact NE-OG 3.33Å; R197-S211 PolarHBondContact NH2-O 2.77Å; R197-S211 VanDerWaalsContact NH2-O 3.16Å; R197-S211 PolarHBondContact NH2-OG 3.38Å; R197-D243 IonicContact NH1-OD2 3.69Å
198	H	59.3	Low	65.3	Low	137 Å²	137	66.3 Å²	66.3	63%	0.634	41%	0.405	S	S	*	.	H	α-helix	trans	-87.3	-28.2	176.9	-81.4	-67.9	0	0	0	114.4	N194 A195 L196 G200 A201	N194-H198 PolarHBondContact O-CD2 2.84Å; N194-H198 PolarHBondContact O-N 3.02Å; A195-H198 PolarHBondContact O-N 2.87Å; L196-H198 PolarHBondContact O-N 3.13Å; H198-G200 VanDerWaalsContact C-N 3.31Å; H198-G200 PolarHBondContact O-N 2.79Å; H198-A201 WeakPolarHBondContact O-CB 3.46Å
199	T	47.9	Very low	64.2	Low	111 Å²	111	65.6 Å²	65.6	68%	0.681	40%	0.396	S	S	*	.	H	α-helix	trans	-72.6	-14.5	-173.9	53.9	0	0	0	0	115.6	A195 L196 A201	A195-T199 WeakPolarHBondContact O-CG2 3.27Å; A195-T199 PolarHBondContact O-N 2.96Å; A195-T199 VanDerWaalsContact O-N 3.09Å; L196-T199 PolarHBondContact O-N 3.34Å; L196-T199 PolarHBondContact O-OG1 2.84Å; T199-A201 PolarHBondContact O-N 3.1Å; T199-A201 VanDerWaalsContact O-N 3.14Å
200	G	44.2	Very low	63.5	Low	63 Å²	63	66.9 Å²	66.9	65%	0.649	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.1	10	175.6	0	0	0	0	0	115.8	H198 T202	H198-G200 VanDerWaalsContact C-N 3.31Å; H198-G200 PolarHBondContact O-N 2.79Å; G200-T202 PolarHBondContact O-N 3.49Å
201	A	37.4	Very low	63.2	Low	74 Å²	74	66.5 Å²	66.5	61%	0.612	40%	0.398	S	S	*	.			trans	-81	108.9	-164.2	0	0	0	0	0	115	H198 T199 G203	H198-A201 WeakPolarHBondContact O-CB 3.46Å; T199-A201 PolarHBondContact O-N 3.1Å; T199-A201 VanDerWaalsContact O-N 3.14Å; A201-G203 VanDerWaalsContact C-N 3.34Å; A201-G203 PolarHBondContact O-N 2.84Å; A201-G203 VanDerWaalsContact O-N 3.17Å
202	T	34.8	Very low	63.3	Low	125 Å²	125	62 Å²	62	77%	0.767	38%	0.377	S	S	*	.			trans	-81.7	78.3	157.6	42.2	0	0	0	0	111.1	G200 M204	G200-T202 PolarHBondContact O-N 3.49Å; T202-M204 VanDerWaalsContact C-N 3.29Å; T202-M204 PolarHBondContact O-N 3.38Å
203	G	35	Very low	63.5	Low	82 Å²	82	56.5 Å²	56.5	85%	0.845	35%	0.35	S	S	*	.	S	Bend	trans	68.1	-40.8	156.8	0	0	0	0	0	120	A201	A201-G203 VanDerWaalsContact C-N 3.34Å; A201-G203 PolarHBondContact O-N 2.84Å; A201-G203 VanDerWaalsContact O-N 3.17Å
204	M	36.6	Very low	63.8	Low	131 Å²	131	57 Å²	57	65%	0.645	35%	0.353	S	S	*	.	S	Bend	trans	-132.2	9.8	-148.9	-156.7	164.7	67.1	0	0	116	T202	T202-M204 VanDerWaalsContact C-N 3.29Å; T202-M204 PolarHBondContact O-N 3.38Å
205	N	42.4	Very low	64.3	Low	50 Å²	50	54.7 Å²	54.7	27%	0.267	34%	0.34	S	S	.	.			trans	-136.5	130.5	-168.7	-52.4	-76.4	0	0	0	113.5	H207 R210	N205-H207 PolarHBondContact O-N 3.32Å; N205-R210 PolarHBondContact OD1-NH1 2.83Å; N205-R210 PolarHBondContact OD1-NH2 2.98Å
206	E	57.7	Low	64.9	Low	125 Å²	125	52.6 Å²	52.6	58%	0.584	32%	0.322	S	S	*	.			trans	-71.7	87.7	173.2	-173.4	177.8	179.2	0	0	110	S208 S209	E206-S208 VanDerWaalsContact C-N 3.25Å; E206-S208 PolarHBondContact O-N 2.82Å; E206-S208 VanDerWaalsContact O-N 3.08Å; E206-S209 WeakPolarHBondContact O-CB 3.34Å; E206-S209 PolarHBondContact O-N 2.85Å; E206-S209 PolarHBondContact O-OG 3.14Å
207	H	55	Low	65.7	Low	38 Å²	38	50.2 Å²	50.2	18%	0.176	31%	0.31	C	S	.	.	G	3₁₀ helix	trans	-56.6	-31.5	-163	-164	-124.9	0	0	0	114.9	E141 R197 N205 S209 R210	E141-H207 IonicContact OE1-CE1 3.86Å; E141-H207 PolarHBondContact OE1-CE1 3.39Å; E141-H207 VanDerWaalsContact OE1-CE1 3.28Å; E141-H207 IonicContact OE1-ND1 3.19Å; E141-H207 IonicContact OE2-CE1 2.67Å; R197-H207 PolarHBondContact O-ND1 2.83Å; N205-H207 PolarHBondContact O-N 3.32Å; H207-S209 PolarHBondContact O-N 3.46Å; H207-S209 VanDerWaalsContact O-N 3.1Å; H207-R210 PolarHBondContact O-N 2.9Å
208	S	61.6	Low	66.4	Low	31 Å²	31	51.7 Å²	51.7	22%	0.217	32%	0.317	C	S	.	.	G	3₁₀ helix	trans	-56.4	-25	174.9	54.3	0	0	0	0	114.1	E206 R210	E206-S208 VanDerWaalsContact C-N 3.25Å; E206-S208 PolarHBondContact O-N 2.82Å; E206-S208 VanDerWaalsContact O-N 3.08Å; S208-R210 VanDerWaalsContact C-N 3.3Å; S208-R210 PolarHBondContact O-N 3.22Å
209	S	67.7	Low	68	Low	11 Å²	11	45.1 Å²	45.1	8%	0.077	29%	0.287	C	S	.	.	G	3₁₀ helix	trans	-70.3	-20.6	174.6	61.7	0	0	0	0	114.5	T87 E206 H207 A245 G246	T87-S209 WeakPolarHBondContact OG1-CB 3.44Å; E206-S209 WeakPolarHBondContact O-CB 3.34Å; E206-S209 PolarHBondContact O-N 2.85Å; E206-S209 PolarHBondContact O-OG 3.14Å; H207-S209 PolarHBondContact O-N 3.46Å; H207-S209 VanDerWaalsContact O-N 3.1Å; S209-A245 WeakPolarHBondContact O-CB 3.3Å; S209-G246 PolarHBondContact O-N 2.85Å
210	R	75.9	Confident	70	Confident	29 Å²	29	44.2 Å²	44.2	11%	0.109	27%	0.271	C	S	.	.	T	Hydrogen-bonded Turn	trans	-117.6	-5.7	-158.7	-57	-147.8	180	159.5	7.4	116.3	Y143 N205 H207 S208 E262 I266	Y143-R210 WeakPolarHBondContact CD2-O 3.33Å; Y143-R210 HydrophobicContact CE2-CB 4.12Å; N205-R210 PolarHBondContact OD1-NH1 2.83Å; N205-R210 PolarHBondContact OD1-NH2 2.98Å; H207-R210 PolarHBondContact O-N 2.9Å; S208-R210 VanDerWaalsContact C-N 3.3Å; S208-R210 PolarHBondContact O-N 3.22Å; R210-E262 WeakPolarHBondContact CD-OE1 3.33Å; R210-E262 IonicContact CZ-OE1 3.75Å; R210-E262 IonicContact NE-OE1 2.63Å; R210-E262 IonicContact NH1-OE1 3.9Å; R210-E262 PolarHBondContact NH1-OE1 3.31Å; R210-I266 HydrophobicContact CB-CD1 3.74Å; R210-I266 HydrophobicContact CG-CD1 4.25Å; R210-I266 VanDerWaalsContact O-CD1 3.25Å; R210-I266 WeakPolarHBondContact O-CD1 3.26Å; R210-I266 WeakPolarHBondContact O-CG1 3.33Å
211	S	85	Confident	72.1	Confident	0 Å²	0	41.6 Å²	41.6	0%	0	24%	0.242	C	C	.	.			trans	-132.2	151.3	177.3	61.3	0	0	0	0	110.7	E141 L142 R197	E141-S211 WeakPolarHBondContact OE1-CB 3.27Å; E141-S211 PolarHBondContact OE1-OG 2.61Å; L142-S211 WeakPolarHBondContact O-CA 3.29Å; L142-S211 WeakPolarHBondContact O-CB 3.47Å; R197-S211 PolarHBondContact NE-OG 3.33Å; R197-S211 PolarHBondContact NH2-O 2.77Å; R197-S211 VanDerWaalsContact NH2-O 3.16Å; R197-S211 PolarHBondContact NH2-OG 3.38Å
212	H	90.1	Very high	74.3	Confident	6 Å²	6	42.1 Å²	42.1	3%	0.028	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	135.1	168.6	-48.8	-96.1	0	0	0	107.9	E141 L142 D243 L244 A245 I304	E141-H212 CarbonylContact C-O 3.51Å; E141-H212 WeakPolarHBondContact CA-O 3.28Å; L142-H212 HydrophobicContact CB-CB 4.28Å; L142-H212 PolarHBondContact N-O 2.89Å; L142-H212 PolarHBondContact O-N 2.9Å; H212-D243 CarbonylContact C-O 3.51Å; H212-D243 WeakPolarHBondContact CA-O 3.48Å; H212-L244 HydrophobicContact CB-CD2 4.33Å; H212-L244 VanDerWaalsContact ND1-CD2 3.33Å; H212-L244 WeakPolarHBondContact ND1-CD2 3.44Å; H212-A245 PolarHBondContact ND1-N 3.27Å; H212-I304 HydrophobicContact CB-CD1 3.91Å
213	V	92.1	Very high	76.3	Confident	4 Å²	4	37.3 Å²	37.3	2%	0.024	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	135.9	177.9	161.7	0	0	0	0	109.8	Y139 M140 E141 L150 V242 D243	Y139-V213 HydrophobicContact CD2-CG1 4.06Å; Y139-V213 HydrophobicContact CE2-CG1 3.21Å; M140-V213 WeakPolarHBondContact O-CA 3.4Å; E141-V213 HydrophobicContact CB-CG2 4.13Å; E141-V213 HydrophobicContact CG-CG2 4.11Å; L150-V213 HydrophobicContact CD1-CG1 4.3Å; L150-V213 HydrophobicContact CD1-CG2 4.2Å; V213-V242 CarbonylContact O-C 3.6Å; V213-V242 VanDerWaalsContact O-CA 3.32Å; V213-V242 WeakPolarHBondContact O-CA 3.44Å; V213-D243 PolarHBondContact N-O 3.2Å; V213-D243 PolarHBondContact O-N 2.85Å
214	I	93.9	Very high	77.8	Confident	10 Å²	10	37.5 Å²	37.5	5%	0.051	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	108.7	-176.3	-60.9	168.2	0	0	0	107.6	M140 V242 I304 L307	M140-I214 PolarHBondContact N-O 2.8Å; M140-I214 PolarHBondContact O-N 2.86Å; I214-V242 HydrophobicContact CG1-CG1 4.02Å; I214-V242 HydrophobicContact CG1-CG2 4.08Å; I214-V242 HydrophobicContact CG2-CG2 4.28Å; I214-I304 HydrophobicContact CD1-CD1 4.26Å; I214-L307 HydrophobicContact CD1-CB 3.96Å; I214-L307 HydrophobicContact CD1-CD1 3.78Å; I214-L307 HydrophobicContact CD1-CG 4.38Å
215	L	95.2	Very high	78.8	Confident	2 Å²	2	34.6 Å²	34.6	1%	0.01	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	127.1	163.2	-178.9	63.9	0	0	0	108	I111 I137 Y139 V190 L217 C240 L241	I111-L215 HydrophobicContact CD1-CD2 4.25Å; I111-L215 HydrophobicContact CG1-CD2 4.16Å; I111-L215 HydrophobicContact CG2-CD2 4.14Å; I137-L215 HydrophobicContact CG1-CD1 4.5Å; I137-L215 HydrophobicContact CG2-CD1 4.09Å; Y139-L215 HydrophobicContact CD2-CB 3.66Å; Y139-L215 HydrophobicContact CD2-CD1 3.73Å; Y139-L215 HydrophobicContact CD2-CG 4.27Å; Y139-L215 HydrophobicContact CE2-CB 3.82Å; Y139-L215 HydrophobicContact CE2-CD1 4.38Å; Y139-L215 HydrophobicContact CG-CD1 3.95Å; V190-L215 HydrophobicContact CG2-CD1 4.05Å; V190-L215 HydrophobicContact CG2-CD2 3.63Å; V190-L215 HydrophobicContact CG2-CG 4.5Å; L215-L217 HydrophobicContact CD2-CD1 4.13Å; L215-L217 HydrophobicContact CG-CD1 4.01Å; L215-C240 WeakPolarHBondContact O-CA 3.42Å; L215-L241 HydrophobicContact CB-CB 4.34Å; L215-L241 HydrophobicContact CD2-CD1 4.44Å; L215-L241 PolarHBondContact N-O 3.09Å; L215-L241 PolarHBondContact O-N 3.38Å
216	T	94.6	Very high	79.2	Confident	11 Å²	11	39.5 Å²	39.5	7%	0.067	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	120.5	175.5	-68	0	0	0	0	109.3	I137 S138 K238 L239 C240	I137-T216 VanDerWaalsContact CA-O 3.3Å; I137-T216 WeakPolarHBondContact CA-O 3.48Å; I137-T216 WeakPolarHBondContact CG2-O 3.36Å; S138-T216 PolarHBondContact N-O 3.5Å; S138-T216 PolarHBondContact O-N 3Å; T216-K238 HydrophobicContact CG2-CD 4.16Å; T216-K238 HydrophobicContact CG2-CG 3.58Å; T216-L239 WeakPolarHBondContact CA-O 3.26Å; T216-C240 PolarHBondContact OG1-SG 2.86Å
217	L	95	Very high	79.1	Confident	1 Å²	1	40.2 Å²	40.2	1%	0.005	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	120.1	167.4	-60.4	80.9	0	0	0	107.6	V114 Q136 I137 L186 L215 K238 L239 L241	V114-L217 HydrophobicContact CG1-CD2 3.95Å; Q136-L217 CarbonylContact O-C 3.59Å; Q136-L217 WeakPolarHBondContact O-CA 3.34Å; I137-L217 HydrophobicContact CG2-CB 4.43Å; I137-L217 HydrophobicContact CG2-CG 3.89Å; L186-L217 HydrophobicContact CD2-CD2 3.85Å; L215-L217 HydrophobicContact CD2-CD1 4.13Å; L215-L217 HydrophobicContact CG-CD1 4.01Å; L217-K238 CarbonylContact O-C 3.57Å; L217-K238 WeakPolarHBondContact O-CA 3.2Å; L217-L239 HydrophobicContact CB-CB 4.43Å; L217-L239 HydrophobicContact CD1-CD2 4.46Å; L217-L239 PolarHBondContact N-O 3.1Å; L217-L239 PolarHBondContact O-N 3.34Å; L217-L241 HydrophobicContact CD1-CD1 4.09Å; L217-L241 HydrophobicContact CD1-CG 4.35Å
218	Q	92.8	Very high	78.8	Confident	44 Å²	44	43.8 Å²	43.8	21%	0.206	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	123.9	168.9	-169.7	-175.7	46.2	0	0	109.3	Q136 R220 S236 S237	Q136-Q218 HydrophobicContact CB-CB 4.45Å; Q136-Q218 PolarHBondContact N-O 2.9Å; Q136-Q218 PolarHBondContact O-N 3.3Å; Q218-R220 HydrophobicContact CG-CG 4.44Å; Q218-R220 VanDerWaalsContact OE1-CZ 3.27Å; Q218-S236 PolarHBondContact NE2-OG 2.91Å; Q218-S237 CarbonylContact C-O 3.59Å; Q218-S237 WeakPolarHBondContact CA-O 3.25Å; Q218-S237 WeakPolarHBondContact CG-O 3.43Å
219	V	92.5	Very high	78.3	Confident	0 Å²	0	48.3 Å²	48.3	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	126.9	176	-171.2	0	0	0	0	108.4	L73 L74 L122 V135 I221 S236 S237	L73-V219 HydrophobicContact CD2-CG2 3.76Å; L73-V219 HydrophobicContact CG-CG2 4.14Å; L74-V219 HydrophobicContact CD2-CG1 4.1Å; L122-V219 HydrophobicContact CD1-CG1 4.38Å; L122-V219 HydrophobicContact CD2-CG1 4.49Å; V135-V219 HydrophobicContact CG2-CG2 4.47Å; V219-I221 HydrophobicContact CG1-CD1 4.12Å; V219-I221 HydrophobicContact CG1-CG1 3.84Å; V219-S236 WeakPolarHBondContact O-CA 3.47Å; V219-S237 PolarHBondContact N-O 2.74Å; V219-S237 PolarHBondContact O-N 3.43Å
220	R	90.5	Very high	77.5	Confident	91 Å²	91	50.8 Å²	50.8	34%	0.343	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	122	174.8	-56.5	-176.3	-173.3	-177.4	7.8	108.3	A133 T134 Q218 R235	A133-R220 CarbonylContact C-O 3.56Å; A133-R220 WeakPolarHBondContact CA-O 3.34Å; T134-R220 PolarHBondContact N-O 3.47Å; T134-R220 PolarHBondContact O-N 2.76Å; Q218-R220 HydrophobicContact CG-CG 4.44Å; Q218-R220 VanDerWaalsContact OE1-CZ 3.27Å; R220-R235 CarbonylContact C-O 3.58Å; R220-R235 WeakPolarHBondContact CA-O 3.22Å
221	I	87.9	Confident	76.3	Confident	8 Å²	8	52.9 Å²	52.9	4%	0.041	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	117.3	-176.4	-53.3	-178.3	0	0	0	109	L74 L122 I131 E132 A133 V219 R235	L74-I221 HydrophobicContact CD2-CD1 4.37Å; L74-I221 WeakPolarHBondContact O-CD1 3.17Å; L122-I221 HydrophobicContact CD2-CD1 4.2Å; I131-I221 HydrophobicContact CG2-CG2 3.54Å; E132-I221 WeakPolarHBondContact O-CA 3.15Å; A133-I221 HydrophobicContact CB-CG1 4.17Å; V219-I221 HydrophobicContact CG1-CD1 4.12Å; V219-I221 HydrophobicContact CG1-CG1 3.84Å; I221-R235 HydrophobicContact CB-CB 4.47Å; I221-R235 PolarHBondContact N-O 3Å; I221-R235 PolarHBondContact O-N 2.78Å
222	R	84.6	Confident	75.3	Confident	85 Å²	85	55.9 Å²	55.9	32%	0.321	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	133.8	172.1	-54.7	-161.5	-80.7	-154.1	-3.1	108.5	E132 V234	E132-R222 HydrophobicContact CB-CB 4.42Å; E132-R222 PolarHBondContact N-O 2.82Å; E132-R222 PolarHBondContact O-N 2.96Å; E132-R222 IonicContact OE1-CZ 2.73Å; E132-R222 IonicContact OE1-NE 3.76Å; E132-R222 IonicContact OE1-NH2 2.86Å; E132-R222 PolarHBondContact OE1-NH2 2.97Å; E132-R222 IonicContact OE2-CZ 3.63Å; E132-R222 IonicContact OE2-NE 3.68Å; E132-R222 PolarHBondContact OE2-NE 3.04Å; E132-R222 IonicContact OE2-NH2 3.87Å; E132-R222 PolarHBondContact OE2-NH2 2.95Å; R222-V234 HydrophobicContact CG-CG2 4.32Å
223	S	75.9	Confident	74.4	Confident	25 Å²	25	56.9 Å²	56.9	18%	0.175	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	139.4	177.5	178.8	0	0	0	0	110.5	S130 T233	S130-S223 WeakPolarHBondContact O-CA 3.35Å; S223-T233 PolarHBondContact N-O 2.82Å; S223-T233 PolarHBondContact O-N 3.22Å
224	H	67	Low	73.9	Confident	86 Å²	86	58.6 Å²	58.6	40%	0.398	31%	0.313	S	S	.	.			trans	-112.5	123.5	177.6	-73.3	12.6	0	0	0	110.3	S130	S130-H224 WeakPolarHBondContact CB-O 3.11Å; S130-H224 PolarHBondContact O-N 2.86Å
225	S	57	Low	73.4	Confident	70 Å²	70	60.8 Å²	60.8	49%	0.49	32%	0.32	S	S	.	.			trans	-92.9	110.7	178.1	-174.3	0	0	0	0	110.5	N227 N228	S225-N227 PolarHBondContact O-N 2.87Å; S225-N228 PolarHBondContact O-N 2.81Å
226	N	52.2	Low	73.1	Confident	152 Å²	152	62.4 Å²	62.4	81%	0.813	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.3	-15.7	177	-76.2	-8.9	0	0	0	113.7
227	N	54.5	Low	72.9	Confident	141 Å²	141	62 Å²	62	75%	0.754	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.3	-5.8	-175.3	-68.3	-6.8	0	0	0	114.5	S225	S225-N227 PolarHBondContact O-N 2.87Å
228	N	49.9	Very low	72.8	Confident	113 Å²	113	64.8 Å²	64.8	60%	0.604	34%	0.341	S	S	*	.	S	Bend	trans	-156.8	109.2	174.1	-99	-49.4	0	0	0	111	S225 P230	S225-N228 PolarHBondContact O-N 2.81Å; N228-P230 WeakPolarHBondContact O-CD 3.38Å
229	P	50.1	Low	72.9	Confident	125 Å²	125	62.7 Å²	62.7	81%	0.812	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.9	-28.2	-168.3	-29.1	36.5	0	0	0	120.5
230	P	51.4	Low	73	Confident	64 Å²	64	63 Å²	63	42%	0.416	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.5	-22.4	-169.8	32	-34.9	0	0	0	114.9	N228 K232 V360	N228-P230 WeakPolarHBondContact O-CD 3.38Å; P230-K232 PolarHBondContact O-N 2.87Å; P230-K232 VanDerWaalsContact O-N 3.13Å; P230-V360 WeakPolarHBondContact O-CG2 3.24Å
231	L	50.3	Low	73.3	Confident	73 Å²	73	58.8 Å²	58.8	38%	0.382	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	73	-161.4	-132.8	78.9	0	0	0	113.5	T233 L357	L231-T233 PolarHBondContact O-N 2.94Å; L231-L357 HydrophobicContact CD2-CD1 4.49Å; L231-L357 HydrophobicContact CD2-CD2 4.03Å; L231-L357 HydrophobicContact CG-CD2 4.33Å
232	K	63	Low	73.6	Confident	63 Å²	63	58.4 Å²	58.4	27%	0.274	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.8	114.2	168.6	-69	-175.6	-179.8	176.4	0	109	P230 T358 V360 D363	P230-K232 PolarHBondContact O-N 2.87Å; P230-K232 VanDerWaalsContact O-N 3.13Å; K232-T358 PolarHBondContact O-N 3.5Å; K232-T358 PolarHBondContact O-OG1 3.25Å; K232-V360 HydrophobicContact CD-CG2 3.9Å; K232-V360 HydrophobicContact CG-CG2 4.03Å; K232-D363 IonicContact NZ-OD1 3.97Å
233	T	72.6	Confident	74.1	Confident	27 Å²	27	54.5 Å²	54.5	17%	0.166	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	121.9	177.8	-60.6	0	0	0	0	109.6	S223 L231 L355 L357	S223-T233 PolarHBondContact N-O 2.82Å; S223-T233 PolarHBondContact O-N 3.22Å; L231-T233 PolarHBondContact O-N 2.94Å; T233-L355 HydrophobicContact CG2-CD2 3.77Å; T233-L357 HydrophobicContact CG2-CD2 4.35Å
234	V	80.3	Confident	74.8	Confident	39 Å²	39	53.3 Å²	53.3	24%	0.236	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	128.9	174.4	-174.2	0	0	0	0	109.3	R222 S356	R222-V234 HydrophobicContact CG-CG2 4.32Å; V234-S356 PolarHBondContact N-O 2.88Å; V234-S356 PolarHBondContact O-N 3.38Å
235	R	84.7	Confident	75.9	Confident	56 Å²	56	49.2 Å²	49.2	21%	0.211	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	138.6	170.5	-65.2	168.8	-163.5	131.9	9.7	108	R220 I221 A354 L355	R220-R235 CarbonylContact C-O 3.58Å; R220-R235 WeakPolarHBondContact CA-O 3.22Å; I221-R235 HydrophobicContact CB-CB 4.47Å; I221-R235 PolarHBondContact N-O 3Å; I221-R235 PolarHBondContact O-N 2.78Å; R235-A354 WeakPolarHBondContact CA-O 3.35Å; R235-L355 HydrophobicContact CG-CD2 3.7Å
236	S	87.4	Confident	77.2	Confident	37 Å²	37	46 Å²	46	26%	0.259	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	124	175.4	-178.1	0	0	0	0	109.1	Q218 V219 A354	Q218-S236 PolarHBondContact NE2-OG 2.91Å; V219-S236 WeakPolarHBondContact O-CA 3.47Å; S236-A354 PolarHBondContact N-O 2.85Å; S236-A354 WeakPolarHBondContact O-CB 3.43Å
237	S	91.2	Very high	78.8	Confident	2 Å²	2	39.6 Å²	39.6	1%	0.014	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	154	-174.4	55.8	0	0	0	0	111.4	L73 Y77 Q218 V219	L73-S237 WeakPolarHBondContact O-CB 3.39Å; L73-S237 PolarHBondContact O-OG 2.76Å; Y77-S237 WeakPolarHBondContact O-CB 3.32Å; Q218-S237 CarbonylContact C-O 3.59Å; Q218-S237 WeakPolarHBondContact CA-O 3.25Å; Q218-S237 WeakPolarHBondContact CG-O 3.43Å; V219-S237 PolarHBondContact N-O 2.74Å; V219-S237 PolarHBondContact O-N 3.43Å
238	K	92.4	Very high	79.7	Confident	59 Å²	59	34.1 Å²	34.1	26%	0.257	19%	0.189	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	123.4	-171.5	-170.8	-167.2	-172.4	-167.9	0	110.5	L73 N78 A79 T216 L217 C240	L73-K238 VanDerWaalsContact CD1-C 3.49Å; N78-K238 CarbonylContact C-O 3.52Å; N78-K238 VanDerWaalsContact CA-O 3.31Å; N78-K238 WeakPolarHBondContact CA-O 3.17Å; N78-K238 PolarHBondContact OD1-N 3.04Å; A79-K238 PolarHBondContact N-O 3.25Å; T216-K238 HydrophobicContact CG2-CD 4.16Å; T216-K238 HydrophobicContact CG2-CG 3.58Å; L217-K238 CarbonylContact O-C 3.57Å; L217-K238 WeakPolarHBondContact O-CA 3.2Å; K238-C240 WeakPolarHBondContact CE-SG 3.17Å
239	L	95.2	Very high	80.7	Confident	0 Å²	0	35.1 Å²	35.1	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	120.6	166.5	171.2	61.8	0	0	0	109	L73 A79 V114 T216 L217 L241	L73-L239 HydrophobicContact CD1-CB 3.81Å; L73-L239 HydrophobicContact CD2-CB 3.7Å; L73-L239 HydrophobicContact CD2-CD2 4.16Å; L73-L239 HydrophobicContact CG-CB 4.35Å; A79-L239 HydrophobicContact CB-CB 4.47Å; A79-L239 HydrophobicContact CB-CD1 3.64Å; A79-L239 WeakPolarHBondContact O-CA 3.44Å; V114-L239 HydrophobicContact CG1-CD2 3.64Å; V114-L239 HydrophobicContact CG2-CD2 4.31Å; T216-L239 WeakPolarHBondContact CA-O 3.26Å; L217-L239 HydrophobicContact CB-CB 4.43Å; L217-L239 HydrophobicContact CD1-CD2 4.46Å; L217-L239 PolarHBondContact N-O 3.1Å; L217-L239 PolarHBondContact O-N 3.34Å; L239-L241 HydrophobicContact CD1-CD2 3.93Å; L239-L241 HydrophobicContact CD2-CD2 4.21Å; L239-L241 HydrophobicContact CD2-CG 4.38Å; L239-L241 HydrophobicContact CG-CD2 4.07Å; L239-L241 HydrophobicContact CG-CG 4.19Å
240	C	95	Very high	81.4	Confident	8 Å²	8	30 Å²	30	5%	0.054	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	123.4	170.7	-66.2	0	0	0	0	110.5	A79 T80 V81 L215 T216 K238 V242	A79-C240 PolarHBondContact O-N 2.88Å; T80-C240 CarbonylContact C-O 3.58Å; T80-C240 VanDerWaalsContact CA-O 3.28Å; T80-C240 WeakPolarHBondContact CA-O 3.25Å; T80-C240 HydrophobicContact CG2-CB 4.04Å; V81-C240 PolarHBondContact N-O 2.82Å; L215-C240 WeakPolarHBondContact O-CA 3.42Å; T216-C240 PolarHBondContact OG1-SG 2.86Å; K238-C240 WeakPolarHBondContact CE-SG 3.17Å; C240-V242 HydrophobicContact CB-CG2 4.26Å
241	L	96.1	Very high	81.8	Confident	1 Å²	1	31.7 Å²	31.7	1%	0.005	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	120.1	171.9	-61	-177.5	0	0	0	108.2	V81 L95 I110 I111 V114 L215 L217 L239	V81-L241 HydrophobicContact CB-CD2 3.82Å; V81-L241 HydrophobicContact CG2-CD2 3.97Å; L95-L241 HydrophobicContact CD1-CB 4.25Å; L95-L241 HydrophobicContact CD2-CB 4.48Å; I110-L241 HydrophobicContact CG2-CD2 4.27Å; I111-L241 HydrophobicContact CG1-CD1 3.75Å; V114-L241 HydrophobicContact CB-CD1 4.3Å; V114-L241 HydrophobicContact CG1-CD1 4.2Å; V114-L241 HydrophobicContact CG2-CD1 4.24Å; L215-L241 HydrophobicContact CB-CB 4.34Å; L215-L241 HydrophobicContact CD2-CD1 4.44Å; L215-L241 PolarHBondContact N-O 3.09Å; L215-L241 PolarHBondContact O-N 3.38Å; L217-L241 HydrophobicContact CD1-CD1 4.09Å; L217-L241 HydrophobicContact CD1-CG 4.35Å; L239-L241 HydrophobicContact CD1-CD2 3.93Å; L239-L241 HydrophobicContact CD2-CD2 4.21Å; L239-L241 HydrophobicContact CD2-CG 4.38Å; L239-L241 HydrophobicContact CG-CD2 4.07Å; L239-L241 HydrophobicContact CG-CG 4.19Å
242	V	95.4	Very high	82.4	Confident	0 Å²	0	33.7 Å²	33.7	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	120.9	-165.1	-175.6	0	0	0	0	112.5	V81 F82 C83 V213 I214 C240 L244 L308	V81-V242 PolarHBondContact O-N 3.14Å; F82-V242 WeakPolarHBondContact CA-O 3.43Å; F82-V242 HydrophobicContact CB-CB 3.8Å; F82-V242 HydrophobicContact CB-CG1 4.3Å; C83-V242 PolarHBondContact N-O 2.8Å; V213-V242 CarbonylContact O-C 3.6Å; V213-V242 VanDerWaalsContact O-CA 3.32Å; V213-V242 WeakPolarHBondContact O-CA 3.44Å; I214-V242 HydrophobicContact CG1-CG1 4.02Å; I214-V242 HydrophobicContact CG1-CG2 4.08Å; I214-V242 HydrophobicContact CG2-CG2 4.28Å; C240-V242 HydrophobicContact CB-CG2 4.26Å; V242-L244 HydrophobicContact CG1-CD2 3.68Å; V242-L244 HydrophobicContact CG1-CG 4.17Å; V242-L308 HydrophobicContact CG2-CD2 4.27Å
243	D	93.4	Very high	82.3	Confident	4 Å²	4	33.4 Å²	33.4	2%	0.021	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	110.3	168.8	-172.1	29.4	0	0	0	108.2	K91 T92 L95 R197 H212 V213	K91-D243 WeakPolarHBondContact CB-OD1 3.27Å; T92-D243 WeakPolarHBondContact CB-OD2 3.15Å; T92-D243 WeakPolarHBondContact CG2-OD2 3.24Å; T92-D243 PolarHBondContact N-OD1 3.02Å; T92-D243 PolarHBondContact OG1-OD2 3.22Å; L95-D243 HydrophobicContact CD2-CB 3.86Å; R197-D243 IonicContact NH1-OD2 3.69Å; H212-D243 CarbonylContact C-O 3.51Å; H212-D243 WeakPolarHBondContact CA-O 3.48Å; V213-D243 PolarHBondContact N-O 3.2Å; V213-D243 PolarHBondContact O-N 2.85Å
244	L	92.1	Very high	81.8	Confident	0 Å²	0	35.1 Å²	35.1	0%	0	20%	0.198	C	C	.	.	P	Polyproline II helix	trans	-82.4	159.5	178.8	-61.5	175.4	0	0	0	111.1	F82 C83 Y84 K91 H212 V242 L273 I304 L308	F82-L244 HydrophobicContact CD2-CD1 3.81Å; F82-L244 HydrophobicContact CE2-CD1 4.4Å; C83-L244 WeakPolarHBondContact O-CB 3.37Å; C83-L244 WeakPolarHBondContact O-CG 3.48Å; C83-L244 PolarHBondContact O-N 3.01Å; Y84-L244 HydrophobicContact CD2-CD1 3.9Å; K91-L244 WeakPolarHBondContact CE-O 3.45Å; H212-L244 HydrophobicContact CB-CD2 4.33Å; H212-L244 VanDerWaalsContact ND1-CD2 3.33Å; H212-L244 WeakPolarHBondContact ND1-CD2 3.44Å; V242-L244 HydrophobicContact CG1-CD2 3.68Å; V242-L244 HydrophobicContact CG1-CG 4.17Å; L244-L273 HydrophobicContact CD1-CD2 3.85Å; L244-I304 HydrophobicContact CD2-CD1 3.86Å; L244-I304 HydrophobicContact CD2-CG1 4.03Å; L244-L308 HydrophobicContact CD2-CD1 4.38Å
245	A	88.8	Confident	81.1	Confident	0 Å²	0	34.3 Å²	34.3	0%	0	19%	0.193	C	C	.	.	P	Polyproline II helix	trans	-62.8	170.5	169.3	0	0	0	0	0	113	K91 S209 H212 I266	K91-A245 WeakPolarHBondContact CE-O 3.35Å; S209-A245 WeakPolarHBondContact O-CB 3.3Å; H212-A245 PolarHBondContact ND1-N 3.27Å; A245-I266 HydrophobicContact CB-CG2 3.49Å; A245-I266 VanDerWaalsContact CB-CG2 3.49Å
246	G	85.1	Confident	80.1	Confident	2 Å²	2	36.9 Å²	36.9	2%	0.021	22%	0.215	C	C	.	.	P	Polyproline II helix	trans	-67	135.6	177.1	0	0	0	0	0	114.4	T87 S209 E248 L270	T87-G246 WeakPolarHBondContact OG1-CA 3.24Å; S209-G246 PolarHBondContact O-N 2.85Å; G246-E248 VanDerWaalsContact C-N 3.32Å; G246-E248 VanDerWaalsContact C-OE2 3.27Å; G246-E248 VanDerWaalsContact CA-OE2 3.26Å; G246-E248 WeakPolarHBondContact CA-OE2 3.33Å; G246-E248 PolarHBondContact O-N 2.88Å; G246-L270 VanDerWaalsContact O-CD1 3.25Å; G246-L270 WeakPolarHBondContact O-CD1 3.45Å
247	S	85	Confident	79.6	Confident	18 Å²	18	37.8 Å²	37.8	13%	0.126	23%	0.23	C	C	.	.			trans	-89.8	18.9	178.1	73	0	0	0	0	114.6	G85 Q86	G85-S247 PolarHBondContact O-N 3.28Å; Q86-S247 PolarHBondContact N-OG 3.43Å
248	E	74.8	Confident	78.4	Confident	26 Å²	26	41.3 Å²	41.3	12%	0.121	26%	0.259	C	S	.	.			trans	-79	147.2	178.2	59.2	-78.4	-179.4	0	0	113.7	Q86 T87 G246 T253 N267	Q86-E248 HydrophobicContact CG-CB 4.01Å; T87-E248 VanDerWaalsContact CB-CD 3.48Å; T87-E248 WeakPolarHBondContact CB-OE1 3.1Å; T87-E248 WeakPolarHBondContact CB-OE2 3.45Å; T87-E248 PolarHBondContact N-OE2 3.32Å; T87-E248 VanDerWaalsContact OG1-CD 3.22Å; T87-E248 PolarHBondContact OG1-OE1 3.1Å; T87-E248 PolarHBondContact OG1-OE2 3.28Å; G246-E248 VanDerWaalsContact C-N 3.32Å; G246-E248 VanDerWaalsContact C-OE2 3.27Å; G246-E248 VanDerWaalsContact CA-OE2 3.26Å; G246-E248 WeakPolarHBondContact CA-OE2 3.33Å; G246-E248 PolarHBondContact O-N 2.88Å; E248-T253 HydrophobicContact CG-CG2 4Å; E248-N267 PolarHBondContact O-ND2 2.99Å; E248-N267 PolarHBondContact O-OD1 3.45Å
249	R	69.4	Low	77.2	Confident	134 Å²	134	41.2 Å²	41.2	51%	0.506	26%	0.259	S	S	.	.			trans	-73.6	128.8	177.2	-55.9	178.9	-171.8	-176.3	2.3	109.6	S251 K252 N336	R249-S251 PolarHBondContact O-N 3.05Å; R249-K252 PolarHBondContact O-N 3.43Å; R249-N336 PolarHBondContact NH2-ND2 3.47Å
250	A	65.6	Low	76.2	Confident	16 Å²	16	46.2 Å²	46.2	13%	0.132	28%	0.281	C	S	.	.	H	α-helix	trans	-55.1	-19.1	176.3	0	0	0	0	0	114.3	K252 T253 F260	A250-K252 VanDerWaalsContact C-N 3.3Å; A250-K252 PolarHBondContact O-N 3.47Å; A250-T253 PolarHBondContact O-OG1 3.42Å; A250-T253 VanDerWaalsContact O-OG1 3.1Å; A250-F260 HydrophobicContact CB-CD2 4.16Å; A250-F260 HydrophobicContact CB-CE2 3.93Å
251	S	60.3	Low	75.3	Confident	101 Å²	101	53.1 Å²	53.1	71%	0.706	31%	0.311	S	S	*	.	H	α-helix	trans	-70.2	-19.7	172.5	64	0	0	0	0	114.5	R249	R249-S251 PolarHBondContact O-N 3.05Å
252	K	62.8	Low	74.1	Confident	114 Å²	114	53.8 Å²	53.8	50%	0.496	31%	0.314	S	S	.	.	H	α-helix	trans	-92.7	-18.7	177.1	-83.3	-166.4	173.1	-175.4	0	113.5	R249 A250 E333	R249-K252 PolarHBondContact O-N 3.43Å; A250-K252 VanDerWaalsContact C-N 3.3Å; A250-K252 PolarHBondContact O-N 3.47Å; K252-E333 WeakPolarHBondContact CD-OE1 3.5Å; K252-E333 VanDerWaalsContact CE-OE1 3.23Å; K252-E333 WeakPolarHBondContact CE-OE1 3.35Å; K252-E333 IonicContact NZ-OE1 2.8Å; K252-E333 PolarHBondContact NZ-OE1 2.99Å; K252-E333 IonicContact NZ-OE2 2.8Å; K252-E333 PolarHBondContact NZ-OE2 2.8Å
253	T	61.1	Low	73.1	Confident	58 Å²	58	54.2 Å²	54.2	36%	0.356	32%	0.317	S	S	.	.	H	α-helix	trans	-85.4	-13.9	-177.6	56.7	0	0	0	0	113.5	E248 A250 N255	E248-T253 HydrophobicContact CG-CG2 4Å; A250-T253 PolarHBondContact O-OG1 3.42Å; A250-T253 VanDerWaalsContact O-OG1 3.1Å; T253-N255 PolarHBondContact O-N 3.01Å; T253-N255 PolarHBondContact O-OD1 3.4Å; T253-N255 PolarHBondContact OG1-ND2 3.45Å
254	G	62.2	Low	72.3	Confident	62 Å²	62	55.8 Å²	55.8	64%	0.639	33%	0.33	S	S	*	.			trans	75.2	1.9	-177.6	0	0	0	0	0	114.6	T256	G254-T256 PolarHBondContact O-N 3.21Å
255	N	64.8	Low	71.6	Confident	23 Å²	23	59.7 Å²	59.7	12%	0.123	35%	0.351	C	S	.	.			trans	-60.4	130.9	-175	-64	-11.1	0	0	0	111.6	T253 Q259 S263	T253-N255 PolarHBondContact O-N 3.01Å; T253-N255 PolarHBondContact O-OD1 3.4Å; T253-N255 PolarHBondContact OG1-ND2 3.45Å; N255-Q259 HydrophobicContact CB-CB 3.97Å; N255-S263 PolarHBondContact ND2-OG 3.13Å
256	T	63.9	Low	71	Confident	110 Å²	110	60.4 Å²	60.4	68%	0.675	35%	0.354	S	S	*	.			trans	-120.2	165.8	178.2	56.4	0	0	0	0	112	G254 A258 Q259 F260	G254-T256 PolarHBondContact O-N 3.21Å; T256-A258 PolarHBondContact O-N 3Å; T256-Q259 PolarHBondContact O-N 3.46Å; T256-F260 PolarHBondContact O-N 3.45Å
257	G	76.4	Confident	70.9	Confident	56 Å²	56	62.5 Å²	62.5	58%	0.577	37%	0.365	S	S	*	.	H	α-helix	trans	56.3	-126	174.2	0	0	0	0	0	114	Q259 F260 K261	G257-Q259 VanDerWaalsContact C-N 3.35Å; G257-Q259 PolarHBondContact O-N 3.46Å; G257-F260 WeakPolarHBondContact O-CB 3.42Å; G257-F260 PolarHBondContact O-N 2.98Å; G257-K261 PolarHBondContact O-N 3.32Å
258	A	66.5	Low	70.9	Confident	76 Å²	76	65.3 Å²	65.3	63%	0.628	38%	0.382	S	S	*	.	H	α-helix	trans	-63.7	-36.7	-179.3	0	0	0	0	0	113.1	T256 F260 K261 E262	T256-A258 PolarHBondContact O-N 3Å; A258-F260 VanDerWaalsContact C-N 3.27Å; A258-F260 PolarHBondContact O-N 3.27Å; A258-K261 PolarHBondContact O-N 2.89Å; A258-E262 PolarHBondContact O-N 2.65Å
259	Q	67.3	Low	71.5	Confident	56 Å²	56	64.1 Å²	64.1	26%	0.262	38%	0.377	S	S	.	.	H	α-helix	trans	-66	-31.9	178.5	-62.8	177.6	-6	0	0	111.7	N255 T256 G257 S263	N255-Q259 HydrophobicContact CB-CB 3.97Å; T256-Q259 PolarHBondContact O-N 3.46Å; G257-Q259 VanDerWaalsContact C-N 3.35Å; G257-Q259 PolarHBondContact O-N 3.46Å; Q259-S263 WeakPolarHBondContact O-CB 3.49Å; Q259-S263 PolarHBondContact O-N 2.98Å; Q259-S263 PolarHBondContact O-OG 3.39Å
260	F	74.3	Confident	72.5	Confident	105 Å²	105	58.2 Å²	58.2	46%	0.461	36%	0.355	S	S	.	.	H	α-helix	trans	-65.9	-44.4	172.7	-175.3	-95.9	0	0	0	111.6	A250 T256 G257 A258 E262 S263 A264	A250-F260 HydrophobicContact CB-CD2 4.16Å; A250-F260 HydrophobicContact CB-CE2 3.93Å; T256-F260 PolarHBondContact O-N 3.45Å; G257-F260 WeakPolarHBondContact O-CB 3.42Å; G257-F260 PolarHBondContact O-N 2.98Å; A258-F260 VanDerWaalsContact C-N 3.27Å; A258-F260 PolarHBondContact O-N 3.27Å; F260-E262 PolarHBondContact O-N 3.27Å; F260-S263 PolarHBondContact O-N 3.19Å; F260-A264 WeakPolarHBondContact O-CB 3.44Å; F260-A264 PolarHBondContact O-N 3Å
261	K	74.9	Confident	73.7	Confident	154 Å²	154	62.9 Å²	62.9	67%	0.67	38%	0.377	S	S	*	.	H	α-helix	trans	-60.4	-44.2	176.3	-66	-174.7	177.1	-175.1	0	111.8	G257 A258 A264 L265	G257-K261 PolarHBondContact O-N 3.32Å; A258-K261 PolarHBondContact O-N 2.89Å; K261-A264 PolarHBondContact O-N 3.48Å; K261-L265 WeakPolarHBondContact O-CG 3.45Å; K261-L265 PolarHBondContact O-N 3.48Å
262	E	71.5	Confident	75.2	Confident	14 Å²	14	58.4 Å²	58.4	7%	0.065	35%	0.346	C	S	.	.	H	α-helix	trans	-57.5	-50.4	172.2	173.5	-176.1	140.7	0	0	111.8	Y143 R144 R210 A258 F260 A264 L265 I266	Y143-E262 PolarHBondContact OH-OE1 3.14Å; Y143-E262 PolarHBondContact OH-OE2 3.03Å; Y143-E262 VanDerWaalsContact OH-OE2 3.13Å; R144-E262 HydrophobicContact CG-CG 4.31Å; R144-E262 IonicContact CZ-OE2 2.67Å; R144-E262 IonicContact NE-OE2 2.71Å; R144-E262 PolarHBondContact NE-OE2 3.44Å; R144-E262 IonicContact NH2-OE2 3.59Å; R144-E262 PolarHBondContact NH2-OE2 2.91Å; R210-E262 WeakPolarHBondContact CD-OE1 3.33Å; R210-E262 IonicContact CZ-OE1 3.75Å; R210-E262 IonicContact NE-OE1 2.63Å; R210-E262 IonicContact NH1-OE1 3.9Å; R210-E262 PolarHBondContact NH1-OE1 3.31Å; A258-E262 PolarHBondContact O-N 2.65Å; F260-E262 PolarHBondContact O-N 3.27Å; E262-A264 PolarHBondContact O-N 3.5Å; E262-L265 PolarHBondContact O-N 3.2Å; E262-I266 HydrophobicContact CG-CD1 3.86Å; E262-I266 WeakPolarHBondContact O-CD1 3.5Å; E262-I266 WeakPolarHBondContact O-CG1 3.46Å; E262-I266 PolarHBondContact O-N 2.99Å; E262-I266 VanDerWaalsContact O-N 3.09Å
263	S	74.4	Confident	76.7	Confident	9 Å²	9	53 Å²	53	6%	0.063	32%	0.322	C	S	.	.	H	α-helix	trans	-62.5	-32	180	-53.9	0	0	0	0	112.8	N255 Q259 F260 N267	N255-S263 PolarHBondContact ND2-OG 3.13Å; Q259-S263 WeakPolarHBondContact O-CB 3.49Å; Q259-S263 PolarHBondContact O-N 2.98Å; Q259-S263 PolarHBondContact O-OG 3.39Å; F260-S263 PolarHBondContact O-N 3.19Å; S263-N267 WeakPolarHBondContact O-CB 3.47Å; S263-N267 PolarHBondContact O-N 3.3Å; S263-N267 PolarHBondContact O-ND2 3.17Å
264	A	77.9	Confident	78.1	Confident	38 Å²	38	50.9 Å²	50.9	31%	0.314	31%	0.313	S	S	.	.	H	α-helix	trans	-70	-46.1	174.4	0	0	0	0	0	111.6	F260 K261 E262 I266 N267 T268	F260-A264 WeakPolarHBondContact O-CB 3.44Å; F260-A264 PolarHBondContact O-N 3Å; K261-A264 PolarHBondContact O-N 3.48Å; E262-A264 PolarHBondContact O-N 3.5Å; A264-I266 PolarHBondContact O-N 3.01Å; A264-N267 CarbonylContact O-C 3.55Å; A264-N267 PolarHBondContact O-N 3.44Å; A264-T268 PolarHBondContact O-N 3.33Å; A264-T268 PolarHBondContact O-OG1 3.33Å
265	L	76.9	Confident	79.6	Confident	82 Å²	82	50.1 Å²	50.1	43%	0.429	29%	0.294	S	S	.	.	H	α-helix	trans	-59.3	-44	177.2	-71.2	169.4	0	0	0	112.3	R144 K261 E262 N267 T268 G269	R144-L265 HydrophobicContact CB-CD1 4.45Å; K261-L265 WeakPolarHBondContact O-CG 3.45Å; K261-L265 PolarHBondContact O-N 3.48Å; E262-L265 PolarHBondContact O-N 3.2Å; L265-N267 PolarHBondContact O-N 3.04Å; L265-T268 WeakPolarHBondContact O-CB 3.3Å; L265-T268 PolarHBondContact O-N 3.27Å; L265-T268 VanDerWaalsContact O-N 3.16Å; L265-G269 PolarHBondContact O-N 3.32Å
266	I	75.6	Confident	80.9	Confident	14 Å²	14	49 Å²	49	7%	0.072	29%	0.288	C	S	.	.	H	α-helix	trans	-61.5	-44.9	176.7	-63	158.1	0	0	0	110.7	R210 A245 E262 A264 T268 G269 L270	R210-I266 HydrophobicContact CB-CD1 3.74Å; R210-I266 HydrophobicContact CG-CD1 4.25Å; R210-I266 VanDerWaalsContact O-CD1 3.25Å; R210-I266 WeakPolarHBondContact O-CD1 3.26Å; R210-I266 WeakPolarHBondContact O-CG1 3.33Å; A245-I266 HydrophobicContact CB-CG2 3.49Å; A245-I266 VanDerWaalsContact CB-CG2 3.49Å; E262-I266 HydrophobicContact CG-CD1 3.86Å; E262-I266 WeakPolarHBondContact O-CD1 3.5Å; E262-I266 WeakPolarHBondContact O-CG1 3.46Å; E262-I266 PolarHBondContact O-N 2.99Å; E262-I266 VanDerWaalsContact O-N 3.09Å; A264-I266 PolarHBondContact O-N 3.01Å; I266-T268 VanDerWaalsContact C-N 3.31Å; I266-T268 PolarHBondContact O-N 3.01Å; I266-G269 PolarHBondContact O-N 3.16Å; I266-L270 PolarHBondContact O-N 3.34Å
267	N	82.3	Confident	82.3	Confident	46 Å²	46	43.8 Å²	43.8	25%	0.246	26%	0.256	C	S	.	.	H	α-helix	trans	-65.8	-29.9	175.5	-89.3	-80.9	0	0	0	113	E248 S263 A264 L265 L270 L271	E248-N267 PolarHBondContact O-ND2 2.99Å; E248-N267 PolarHBondContact O-OD1 3.45Å; S263-N267 WeakPolarHBondContact O-CB 3.47Å; S263-N267 PolarHBondContact O-N 3.3Å; S263-N267 PolarHBondContact O-ND2 3.17Å; A264-N267 CarbonylContact O-C 3.55Å; A264-N267 PolarHBondContact O-N 3.44Å; L265-N267 PolarHBondContact O-N 3.04Å; N267-L270 PolarHBondContact O-N 3.44Å; N267-L271 VanDerWaalsContact O-CB 3.29Å; N267-L271 WeakPolarHBondContact O-CB 3.31Å; N267-L271 PolarHBondContact O-N 3.3Å
268	T	86.1	Confident	83	Confident	77 Å²	77	46.9 Å²	46.9	47%	0.472	25%	0.25	S	S	.	.	H	α-helix	trans	-62.5	-43.2	174.3	-58.8	0	0	0	0	111.5	A264 L265 I266 L270 L271 A272	A264-T268 PolarHBondContact O-N 3.33Å; A264-T268 PolarHBondContact O-OG1 3.33Å; L265-T268 WeakPolarHBondContact O-CB 3.3Å; L265-T268 PolarHBondContact O-N 3.27Å; L265-T268 VanDerWaalsContact O-N 3.16Å; I266-T268 VanDerWaalsContact C-N 3.31Å; I266-T268 PolarHBondContact O-N 3.01Å; T268-L270 PolarHBondContact O-N 2.93Å; T268-L271 PolarHBondContact O-N 3.06Å; T268-A272 PolarHBondContact O-N 3.13Å
269	G	87.8	Confident	84.1	Confident	2 Å²	2	44.1 Å²	44.1	2%	0.021	23%	0.227	C	C	.	.	H	α-helix	trans	-61.1	-42	175.6	0	0	0	0	0	113	L265 I266 L273 I304	L265-G269 PolarHBondContact O-N 3.32Å; I266-G269 PolarHBondContact O-N 3.16Å; G269-L273 PolarHBondContact O-N 3.1Å; G269-L273 VanDerWaalsContact O-N 3.08Å; G269-I304 WeakPolarHBondContact O-CG2 3.27Å
270	L	89.6	Confident	85.1	Confident	10 Å²	10	41.9 Å²	41.9	5%	0.052	22%	0.217	C	C	.	.	H	α-helix	trans	-71.9	-29.8	175.3	-69.6	-178.3	0	0	0	113.5	Y84 G246 I266 N267 T268 L273 G274	Y84-L270 HydrophobicContact CD2-CD2 4.42Å; Y84-L270 HydrophobicContact CE2-CD2 4.06Å; G246-L270 VanDerWaalsContact O-CD1 3.25Å; G246-L270 WeakPolarHBondContact O-CD1 3.45Å; I266-L270 PolarHBondContact O-N 3.34Å; N267-L270 PolarHBondContact O-N 3.44Å; T268-L270 PolarHBondContact O-N 2.93Å; L270-L273 HydrophobicContact CD2-CD2 4.22Å; L270-L273 PolarHBondContact O-N 2.95Å; L270-G274 PolarHBondContact O-N 3.09Å
271	L	90.6	Very high	85.7	Confident	114 Å²	114	37.3 Å²	37.3	60%	0.597	20%	0.198	S	C	*	.	H	α-helix	trans	-69.2	-43.2	173.4	179.7	61.4	0	0	0	111.4	N267 T268 L273 G274 N275	N267-L271 VanDerWaalsContact O-CB 3.29Å; N267-L271 WeakPolarHBondContact O-CB 3.31Å; N267-L271 PolarHBondContact O-N 3.3Å; T268-L271 PolarHBondContact O-N 3.06Å; L271-L273 VanDerWaalsContact C-N 3.33Å; L271-L273 PolarHBondContact O-N 3.15Å; L271-G274 PolarHBondContact O-N 3.35Å; L271-N275 PolarHBondContact O-N 3.2Å
272	A	92.6	Very high	85.7	Confident	6 Å²	6	33.2 Å²	33.2	5%	0.05	18%	0.184	C	C	.	.	H	α-helix	trans	-57.9	-45.5	171.8	0	0	0	0	0	111.1	T268 G274 N275 V276 D301 A302 T305	T268-A272 PolarHBondContact O-N 3.13Å; A272-G274 VanDerWaalsContact C-N 3.33Å; A272-G274 PolarHBondContact O-N 2.74Å; A272-N275 WeakPolarHBondContact O-CB 3.44Å; A272-N275 PolarHBondContact O-N 3.01Å; A272-N275 VanDerWaalsContact O-N 3.09Å; A272-V276 PolarHBondContact O-N 3.23Å; A272-D301 HydrophobicContact CB-CB 3.85Å; A272-A302 HydrophobicContact CB-CB 3.74Å; A272-T305 HydrophobicContact CB-CG2 4.08Å
273	L	93.3	Very high	85.5	Confident	0 Å²	0	38.2 Å²	38.2	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-59.4	-42	175	-170.8	64.1	0	0	0	112.2	L244 G269 L270 L271 N275 V276 I277 T305 L308 L312 F340	L244-L273 HydrophobicContact CD1-CD2 3.85Å; G269-L273 PolarHBondContact O-N 3.1Å; G269-L273 VanDerWaalsContact O-N 3.08Å; L270-L273 HydrophobicContact CD2-CD2 4.22Å; L270-L273 PolarHBondContact O-N 2.95Å; L271-L273 VanDerWaalsContact C-N 3.33Å; L271-L273 PolarHBondContact O-N 3.15Å; L273-N275 VanDerWaalsContact C-N 3.35Å; L273-N275 PolarHBondContact O-N 2.88Å; L273-V276 PolarHBondContact O-N 2.92Å; L273-I277 HydrophobicContact CD1-CD1 4.44Å; L273-I277 HydrophobicContact CG-CD1 4.08Å; L273-I277 WeakPolarHBondContact O-CB 3.41Å; L273-I277 WeakPolarHBondContact O-CG1 3.46Å; L273-I277 PolarHBondContact O-N 3.21Å; L273-T305 VanDerWaalsContact CA-CG2 3.45Å; L273-T305 HydrophobicContact CB-CG2 4Å; L273-T305 HydrophobicContact CD1-CG2 4Å; L273-L308 HydrophobicContact CD1-CD1 3.92Å; L273-L308 HydrophobicContact CD2-CD1 4.41Å; L273-L312 HydrophobicContact CD1-CD1 3.58Å; L273-F340 HydrophobicContact CD2-CZ 4.05Å; L273-F340 HydrophobicContact CG-CZ 4.07Å
274	G	92.1	Very high	84.6	Confident	15 Å²	15	39.8 Å²	39.8	16%	0.155	22%	0.22	C	C	.	.	H	α-helix	trans	-63.5	-34.7	173.2	0	0	0	0	0	114.1	L270 L271 A272 R278	L270-G274 PolarHBondContact O-N 3.09Å; L271-G274 PolarHBondContact O-N 3.35Å; A272-G274 VanDerWaalsContact C-N 3.33Å; A272-G274 PolarHBondContact O-N 2.74Å; G274-R278 WeakPolarHBondContact O-CB 3.42Å; G274-R278 PolarHBondContact O-N 3.12Å
275	N	92.4	Very high	83.5	Confident	45 Å²	45	46.6 Å²	46.6	24%	0.241	24%	0.237	C	C	.	.	H	α-helix	trans	-70.6	-42.8	174.8	-83.5	-33.5	0	0	0	112.4	L271 A272 L273 R278 A279 P298	L271-N275 PolarHBondContact O-N 3.2Å; A272-N275 WeakPolarHBondContact O-CB 3.44Å; A272-N275 PolarHBondContact O-N 3.01Å; A272-N275 VanDerWaalsContact O-N 3.09Å; L273-N275 VanDerWaalsContact C-N 3.35Å; L273-N275 PolarHBondContact O-N 2.88Å; N275-R278 PolarHBondContact O-N 3.42Å; N275-R278 PolarHBondContact OD1-NH2 3.47Å; N275-A279 WeakPolarHBondContact O-CB 3.43Å; N275-A279 PolarHBondContact O-N 2.89Å; N275-P298 HydrophobicContact CB-CG 4.24Å
276	V	93.4	Very high	82.2	Confident	1 Å²	1	46.7 Å²	46.7	1%	0.006	25%	0.245	C	C	.	.	H	α-helix	trans	-58.5	-49.3	172.8	165.6	0	0	0	0	110.7	A272 L273 R278 A279 L280 V297 P298 Y299 T305	A272-V276 PolarHBondContact O-N 3.23Å; L273-V276 PolarHBondContact O-N 2.92Å; V276-R278 VanDerWaalsContact C-N 3.34Å; V276-R278 PolarHBondContact O-N 3.43Å; V276-A279 PolarHBondContact O-N 2.59Å; V276-L280 HydrophobicContact CG1-CD1 3.75Å; V276-L280 WeakPolarHBondContact O-CB 3.5Å; V276-L280 WeakPolarHBondContact O-CG 3.29Å; V276-L280 PolarHBondContact O-N 2.86Å; V276-V297 HydrophobicContact CB-CG1 4.29Å; V276-V297 HydrophobicContact CG1-CG1 3.85Å; V276-V297 HydrophobicContact CG2-CG1 4.19Å; V276-P298 HydrophobicContact CG2-CG 4.15Å; V276-P298 WeakPolarHBondContact CG2-O 3.44Å; V276-Y299 HydrophobicContact CG1-CD1 3.87Å; V276-Y299 HydrophobicContact CG1-CE1 3.63Å; V276-Y299 HydrophobicContact CG2-CD1 4.2Å; V276-T305 HydrophobicContact CB-CG2 4.32Å; V276-T305 HydrophobicContact CG2-CG2 3.78Å
277	I	92.3	Very high	81.1	Confident	0 Å²	0	54.7 Å²	54.7	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-60.9	-41.5	179.5	-74.1	166.2	0	0	0	111.8	L273 L280 S281 L312 F340 R343 A344 I347	L273-I277 HydrophobicContact CD1-CD1 4.44Å; L273-I277 HydrophobicContact CG-CD1 4.08Å; L273-I277 WeakPolarHBondContact O-CB 3.41Å; L273-I277 WeakPolarHBondContact O-CG1 3.46Å; L273-I277 PolarHBondContact O-N 3.21Å; I277-L280 PolarHBondContact O-N 3.43Å; I277-S281 WeakPolarHBondContact O-CB 3.25Å; I277-S281 PolarHBondContact O-N 3.09Å; I277-S281 PolarHBondContact O-OG 2.93Å; I277-L312 HydrophobicContact CD1-CD1 4.45Å; I277-L312 HydrophobicContact CG1-CD1 4.25Å; I277-F340 HydrophobicContact CD1-CD1 4.15Å; I277-F340 HydrophobicContact CD1-CE1 3.34Å; I277-F340 HydrophobicContact CD1-CE2 3.97Å; I277-F340 HydrophobicContact CD1-CZ 3.25Å; I277-R343 HydrophobicContact CG2-CB 3.92Å; I277-A344 HydrophobicContact CG2-CB 4.41Å; I277-I347 HydrophobicContact CB-CD1 4.12Å; I277-I347 HydrophobicContact CG1-CD1 3.77Å; I277-I347 HydrophobicContact CG2-CD1 4.09Å
278	R	90.4	Very high	79.6	Confident	121 Å²	121	64.4 Å²	64.4	46%	0.457	31%	0.307	S	S	.	.	H	α-helix	trans	-61.9	-51	175	179.1	171.9	60.2	88.3	-2.9	112	G274 N275 V276 L280 S281 D282	G274-R278 WeakPolarHBondContact O-CB 3.42Å; G274-R278 PolarHBondContact O-N 3.12Å; N275-R278 PolarHBondContact O-N 3.42Å; N275-R278 PolarHBondContact OD1-NH2 3.47Å; V276-R278 VanDerWaalsContact C-N 3.34Å; V276-R278 PolarHBondContact O-N 3.43Å; R278-L280 PolarHBondContact O-N 3.39Å; R278-S281 PolarHBondContact O-N 3.35Å; R278-S281 PolarHBondContact O-OG 3.06Å; R278-D282 PolarHBondContact O-N 3.43Å
279	A	90.2	Very high	77.6	Confident	17 Å²	17	63.3 Å²	63.3	14%	0.14	31%	0.311	C	S	.	.	H	α-helix	trans	-59.3	-36.3	179.6	0	0	0	0	0	112.5	N275 V276 V297	N275-A279 WeakPolarHBondContact O-CB 3.43Å; N275-A279 PolarHBondContact O-N 2.89Å; V276-A279 PolarHBondContact O-N 2.59Å; A279-V297 HydrophobicContact CB-CG1 4.45Å; A279-V297 HydrophobicContact CB-CG2 4.29Å
280	L	89.3	Confident	75.6	Confident	10 Å²	10	72 Å²	72	5%	0.052	36%	0.357	C	S	.	.	H	α-helix	trans	-74.1	-40.3	175.7	-69.8	168.7	0	0	0	113	V276 I277 R278 R283 V297 L312 I347	V276-L280 HydrophobicContact CG1-CD1 3.75Å; V276-L280 WeakPolarHBondContact O-CB 3.5Å; V276-L280 WeakPolarHBondContact O-CG 3.29Å; V276-L280 PolarHBondContact O-N 2.86Å; I277-L280 PolarHBondContact O-N 3.43Å; R278-L280 PolarHBondContact O-N 3.39Å; L280-R283 VanDerWaalsContact O-CB 3.29Å; L280-R283 WeakPolarHBondContact O-CB 3.37Å; L280-R283 PolarHBondContact O-N 2.97Å; L280-V297 HydrophobicContact CD1-CG1 4.39Å; L280-V297 HydrophobicContact CD2-CG1 4.28Å; L280-V297 HydrophobicContact CD2-CG2 3.9Å; L280-V297 HydrophobicContact CG-CG1 4.03Å; L280-V297 HydrophobicContact CG-CG2 4.3Å; L280-L312 HydrophobicContact CD1-CB 4.07Å; L280-L312 VanDerWaalsContact CD1-O 3.29Å; L280-L312 WeakPolarHBondContact CD1-O 3.29Å; L280-I347 HydrophobicContact CB-CB 4.49Å; L280-I347 HydrophobicContact CB-CD1 4.09Å; L280-I347 HydrophobicContact CB-CG1 3.79Å; L280-I347 HydrophobicContact CB-CG2 4.18Å; L280-I347 HydrophobicContact CD1-CD1 4.09Å; L280-I347 HydrophobicContact CD1-CG2 4.08Å
281	S	85.9	Confident	73.5	Confident	9 Å²	9	74.4 Å²	74.4	6%	0.063	39%	0.385	C	S	.	.	H	α-helix	trans	-67	-38	179.3	63.9	0	0	0	0	112.8	I277 R278 R283 G284	I277-S281 WeakPolarHBondContact O-CB 3.25Å; I277-S281 PolarHBondContact O-N 3.09Å; I277-S281 PolarHBondContact O-OG 2.93Å; R278-S281 PolarHBondContact O-N 3.35Å; R278-S281 PolarHBondContact O-OG 3.06Å; S281-R283 VanDerWaalsContact C-N 3.31Å; S281-R283 PolarHBondContact O-N 3.27Å; S281-G284 PolarHBondContact O-N 3.19Å
282	D	74.8	Confident	71.3	Confident	68 Å²	68	76 Å²	76	36%	0.364	40%	0.404	S	S	.	.	H	α-helix	trans	-72	-27.6	-179.3	-64.9	-26.4	0	0	0	112	R278 G284 R285 S286	R278-D282 PolarHBondContact O-N 3.43Å; D282-G284 PolarHBondContact O-N 3.41Å; D282-G284 VanDerWaalsContact O-N 3.12Å; D282-R285 PolarHBondContact O-N 2.81Å; D282-S286 PolarHBondContact O-N 3.04Å
283	R	68.1	Low	69.2	Low	119 Å²	119	80.5 Å²	80.5	45%	0.449	44%	0.435	S	S	.	.	H	α-helix	trans	-55.5	-29	175.4	-148.1	177.5	-167.9	-139.6	4.9	112.8	L280 S281 S294 P295	L280-R283 VanDerWaalsContact O-CB 3.29Å; L280-R283 WeakPolarHBondContact O-CB 3.37Å; L280-R283 PolarHBondContact O-N 2.97Å; S281-R283 VanDerWaalsContact C-N 3.31Å; S281-R283 PolarHBondContact O-N 3.27Å; R283-S294 PolarHBondContact NH2-OG 2.9Å; R283-P295 HydrophobicContact CG-CG 4.35Å
284	G	56.2	Low	67.6	Low	42 Å²	42	84.1 Å²	84.1	43%	0.433	46%	0.461	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.3	-21.7	175.6	0	0	0	0	0	114.9	S281 D282	S281-G284 PolarHBondContact O-N 3.19Å; D282-G284 PolarHBondContact O-N 3.41Å; D282-G284 VanDerWaalsContact O-N 3.12Å
285	R	54.1	Low	66.5	Low	180 Å²	180	86.6 Å²	86.6	68%	0.679	47%	0.474	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.6	-36.8	-178.9	-66.5	-177.4	176.5	-170.6	-1.4	112.5	D282 R287	D282-R285 PolarHBondContact O-N 2.81Å; R285-R287 VanDerWaalsContact C-N 3.27Å; R285-R287 PolarHBondContact O-N 3.04Å
286	S	49.6	Very low	66.1	Low	85 Å²	85	92.1 Å²	92.1	59%	0.594	50%	0.498	S	S	*	.	G	3₁₀ helix	trans	-74.4	-5.2	-173.9	-58.6	0	0	0	0	115.7	D282 R288 G289	D282-S286 PolarHBondContact O-N 3.04Å; S286-R288 PolarHBondContact O-N 2.98Å; S286-G289 PolarHBondContact O-N 2.71Å
287	R	52.4	Low	65.9	Low	182 Å²	182	92.9 Å²	92.9	69%	0.687	50%	0.503	S	S	*	.	G	3₁₀ helix	trans	-60.1	0.5	173.3	-86.2	-175.1	173.1	158.4	0.1	114.7	E3 R285	E3-R287 IonicContact OE1-CZ 2.72Å; E3-R287 VanDerWaalsContact OE1-CZ 3.31Å; E3-R287 IonicContact OE1-NH1 2.79Å; E3-R287 PolarHBondContact OE1-NH1 3.28Å; E3-R287 IonicContact OE1-NH2 3.95Å; E3-R287 PolarHBondContact OE1-NH2 2.84Å; E3-R287 IonicContact OE2-NH1 3.77Å; E3-R287 PolarHBondContact OE2-NH1 2.97Å; E3-R287 VanDerWaalsContact OE2-NH1 3.16Å; R285-R287 VanDerWaalsContact C-N 3.27Å; R285-R287 PolarHBondContact O-N 3.04Å
288	R	51.1	Low	65.8	Low	249 Å²	249	93.9 Å²	93.9	94%	0.94	51%	0.509	S	S	*	.	G	3₁₀ helix	trans	-105.2	2.3	177.2	-72.6	-173.3	173.3	-175.2	-1.9	115.3	S286	S286-R288 PolarHBondContact O-N 2.98Å
289	G	43.6	Very low	65.8	Low	54 Å²	54	90.2 Å²	90.2	56%	0.557	50%	0.495	S	S	*	.	S	Bend	trans	-122.3	144	176.9	0	0	0	0	0	112.5	S286 G291	S286-G289 PolarHBondContact O-N 2.71Å; G289-G291 PolarHBondContact O-N 3.01Å
290	N	46.5	Very low	65.9	Low	184 Å²	184	99 Å²	99	98%	0.984	53%	0.525	S	S	*	.			trans	-65.1	122.9	179	-81.8	-11.6	0	0	0	111.8
291	G	45.1	Very low	65.9	Low	62 Å²	62	103.1 Å²	103.1	64%	0.639	55%	0.547	S	S	*	.			trans	171.1	111.5	172.5	0	0	0	0	0	111.9	G289 S293	G289-G291 PolarHBondContact O-N 3.01Å; G291-S293 PolarHBondContact O-N 2.92Å
292	C	44.6	Very low	66.2	Low	146 Å²	146	103 Å²	103	99%	0.986	55%	0.546	S	S	*	.	S	Bend	trans	-84.8	44.5	-172	-164.8	0	0	0	0	113.7
293	S	49	Very low	67	Low	102 Å²	102	102.9 Å²	102.9	71%	0.713	54%	0.543	S	S	*	.			trans	-140.8	114.3	177.9	47.9	0	0	0	0	110.6	G291	G291-S293 PolarHBondContact O-N 2.92Å
294	S	59.6	Low	68.1	Low	76 Å²	76	97.2 Å²	97.2	53%	0.531	52%	0.521	S	S	.	.	P	Polyproline II helix	trans	-74.5	133.7	174	89.7	0	0	0	0	109.2	R283 H296	R283-S294 PolarHBondContact NH2-OG 2.9Å; S294-H296 PolarHBondContact O-N 2.93Å
295	P	67.5	Low	69.9	Low	67 Å²	67	95.3 Å²	95.3	44%	0.435	50%	0.501	S	S	.	.	P	Polyproline II helix	trans	-58.6	136.2	-176.7	23.4	-34	0	0	0	111.4	R283 V297	R283-P295 HydrophobicContact CG-CG 4.35Å; P295-V297 PolarHBondContact O-N 2.8Å
296	H	84.4	Confident	71.7	Confident	161 Å²	161	89.8 Å²	89.8	75%	0.745	48%	0.48	S	S	*	.	P	Polyproline II helix	trans	-62.8	126.6	176.2	173.3	-93.9	0	0	0	110.2	S294	S294-H296 PolarHBondContact O-N 2.93Å
297	V	88.9	Confident	73.7	Confident	17 Å²	17	86.6 Å²	86.6	10%	0.103	46%	0.456	C	S	.	.	P	Polyproline II helix	trans	-97.7	119.6	-179.9	-176.8	0	0	0	0	108.8	V276 A279 L280 P295 Y299	V276-V297 HydrophobicContact CB-CG1 4.29Å; V276-V297 HydrophobicContact CG1-CG1 3.85Å; V276-V297 HydrophobicContact CG2-CG1 4.19Å; A279-V297 HydrophobicContact CB-CG1 4.45Å; A279-V297 HydrophobicContact CB-CG2 4.29Å; L280-V297 HydrophobicContact CD1-CG1 4.39Å; L280-V297 HydrophobicContact CD2-CG1 4.28Å; L280-V297 HydrophobicContact CD2-CG2 3.9Å; L280-V297 HydrophobicContact CG-CG1 4.03Å; L280-V297 HydrophobicContact CG-CG2 4.3Å; P295-V297 PolarHBondContact O-N 2.8Å; V297-Y299 HydrophobicContact CB-CD2 4.03Å; V297-Y299 HydrophobicContact CB-CE2 3.59Å; V297-Y299 HydrophobicContact CG1-CD1 4.32Å; V297-Y299 HydrophobicContact CG1-CD2 3.89Å; V297-Y299 HydrophobicContact CG1-CE1 3.92Å; V297-Y299 HydrophobicContact CG1-CE2 3.47Å; V297-Y299 VanDerWaalsContact CG1-CE2 3.47Å; V297-Y299 HydrophobicContact CG1-CG 4.3Å; V297-Y299 VanDerWaalsContact CG1-CZ 3.48Å; V297-Y299 WeakPolarHBondContact O-CD2 3.48Å; V297-Y299 PolarHBondContact O-N 2.9Å
298	P	91.2	Very high	75.6	Confident	21 Å²	21	78.1 Å²	78.1	14%	0.136	43%	0.425	C	S	.	.			trans	-82.3	58.2	-167.3	34.4	-37.9	0	0	0	113.2	N275 V276 R300 D301	N275-P298 HydrophobicContact CB-CG 4.24Å; V276-P298 HydrophobicContact CG2-CG 4.15Å; V276-P298 WeakPolarHBondContact CG2-O 3.44Å; P298-R300 PolarHBondContact O-N 3.13Å; P298-R300 VanDerWaalsContact O-N 3.16Å; P298-D301 WeakPolarHBondContact CB-OD1 3.36Å; P298-D301 PolarHBondContact O-N 3.4Å
299	Y	90.6	Very high	77.5	Confident	43 Å²	43	69.6 Å²	69.6	17%	0.169	39%	0.393	C	S	.	.	G	3₁₀ helix	trans	-62.4	-22.2	179.1	-61.4	-77.4	0	0	0	113.6	V276 V297 T305 R306 R309 L312	V276-Y299 HydrophobicContact CG1-CD1 3.87Å; V276-Y299 HydrophobicContact CG1-CE1 3.63Å; V276-Y299 HydrophobicContact CG2-CD1 4.2Å; V297-Y299 HydrophobicContact CB-CD2 4.03Å; V297-Y299 HydrophobicContact CB-CE2 3.59Å; V297-Y299 HydrophobicContact CG1-CD1 4.32Å; V297-Y299 HydrophobicContact CG1-CD2 3.89Å; V297-Y299 HydrophobicContact CG1-CE1 3.92Å; V297-Y299 HydrophobicContact CG1-CE2 3.47Å; V297-Y299 VanDerWaalsContact CG1-CE2 3.47Å; V297-Y299 HydrophobicContact CG1-CG 4.3Å; V297-Y299 VanDerWaalsContact CG1-CZ 3.48Å; V297-Y299 WeakPolarHBondContact O-CD2 3.48Å; V297-Y299 PolarHBondContact O-N 2.9Å; Y299-T305 CarbonylContact O-C 3.58Å; Y299-T305 WeakPolarHBondContact O-CB 3.41Å; Y299-T305 PolarHBondContact O-OG1 2.93Å; Y299-R306 WeakPolarHBondContact O-CG 3.31Å; Y299-R306 PolarHBondContact O-N 3.16Å; Y299-R309 HydrophobicContact CD1-CB 4.02Å; Y299-R309 HydrophobicContact CD1-CG 4.21Å; Y299-R309 HydrophobicContact CD2-CG 4.42Å; Y299-R309 HydrophobicContact CE1-CB 4.33Å; Y299-R309 HydrophobicContact CE1-CG 4.31Å; Y299-R309 HydrophobicContact CE2-CG 4.48Å; Y299-R309 HydrophobicContact CG-CB 4.38Å; Y299-R309 HydrophobicContact CG-CG 4.27Å; Y299-L312 WeakPolarHBondContact CE1-O 3.38Å; Y299-L312 PolarHBondContact OH-O 3.07Å
300	R	90.6	Very high	79.6	Confident	201 Å²	201	67.9 Å²	67.9	76%	0.758	37%	0.371	S	S	*	.	G	3₁₀ helix	trans	-82	-11	-174.7	-70.8	-175.2	173.9	-175.6	-2.6	114.4	P298 A302	P298-R300 PolarHBondContact O-N 3.13Å; P298-R300 VanDerWaalsContact O-N 3.16Å; R300-A302 VanDerWaalsContact C-N 3.26Å; R300-A302 PolarHBondContact O-N 2.99Å
301	D	89.7	Confident	81.8	Confident	98 Å²	98	59.3 Å²	59.3	52%	0.524	33%	0.325	S	S	.	.	G	3₁₀ helix	trans	-65.9	-24.5	-174.3	-68.7	20.3	0	0	0	113.6	A272 P298	A272-D301 HydrophobicContact CB-CB 3.85Å; P298-D301 WeakPolarHBondContact CB-OD1 3.36Å; P298-D301 PolarHBondContact O-N 3.4Å
302	A	92	Very high	84	Confident	5 Å²	5	56.4 Å²	56.4	4%	0.041	30%	0.295	C	S	.	.	S	Bend	trans	-146.7	157.4	172.7	0	0	0	0	0	111.5	A272 R300 I304 T305 R306	A272-A302 HydrophobicContact CB-CB 3.74Å; R300-A302 VanDerWaalsContact C-N 3.26Å; R300-A302 PolarHBondContact O-N 2.99Å; A302-I304 VanDerWaalsContact C-N 3.32Å; A302-I304 HydrophobicContact CB-CG2 4.05Å; A302-I304 PolarHBondContact O-N 3.11Å; A302-T305 PolarHBondContact N-OG1 3.46Å; A302-T305 PolarHBondContact O-N 3.32Å; A302-T305 PolarHBondContact O-OG1 3.45Å; A302-R306 PolarHBondContact O-N 2.87Å
303	K	91.9	Very high	85.9	Confident	67 Å²	67	50.7 Å²	50.7	29%	0.291	26%	0.26	S	S	.	.	H	α-helix	trans	-63.8	-36.4	175.9	-73.3	-176.4	-171.7	174.9	0	111.9	L142 E145 I162 T305 R306 L307	L142-K303 HydrophobicContact CD1-CB 3.74Å; L142-K303 HydrophobicContact CD1-CD 4.04Å; L142-K303 HydrophobicContact CD2-CB 4.16Å; E145-K303 VanDerWaalsContact O-CD 3.25Å; E145-K303 WeakPolarHBondContact O-CD 3.49Å; E145-K303 WeakPolarHBondContact O-CE 3.28Å; E145-K303 PolarHBondContact O-NZ 3.11Å; E145-K303 WeakPolarHBondContact OE2-CB 3.29Å; E145-K303 WeakPolarHBondContact OE2-CG 3.43Å; E145-K303 PolarHBondContact OE2-N 3.37Å; I162-K303 HydrophobicContact CD1-CB 3.77Å; I162-K303 HydrophobicContact CD1-CD 4.2Å; I162-K303 HydrophobicContact CD1-CG 3.79Å; K303-T305 VanDerWaalsContact C-N 3.33Å; K303-T305 PolarHBondContact O-N 3.17Å; K303-R306 WeakPolarHBondContact O-CB 3.16Å; K303-R306 PolarHBondContact O-N 2.9Å; K303-R306 VanDerWaalsContact O-N 3.16Å; K303-L307 VanDerWaalsContact O-CG 3.31Å; K303-L307 WeakPolarHBondContact O-CG 3.34Å; K303-L307 PolarHBondContact O-N 2.88Å
304	I	92.3	Very high	87.8	Confident	0 Å²	0	46.8 Å²	46.8	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-61	-38.9	177.1	-168.9	57.9	0	0	0	112.6	L142 H212 I214 L244 G269 A302 R306 L307 L308	L142-I304 HydrophobicContact CD2-CB 3.67Å; L142-I304 HydrophobicContact CD2-CD1 4.38Å; H212-I304 HydrophobicContact CB-CD1 3.91Å; I214-I304 HydrophobicContact CD1-CD1 4.26Å; L244-I304 HydrophobicContact CD2-CD1 3.86Å; L244-I304 HydrophobicContact CD2-CG1 4.03Å; G269-I304 WeakPolarHBondContact O-CG2 3.27Å; A302-I304 VanDerWaalsContact C-N 3.32Å; A302-I304 HydrophobicContact CB-CG2 4.05Å; A302-I304 PolarHBondContact O-N 3.11Å; I304-R306 VanDerWaalsContact C-N 3.34Å; I304-L307 PolarHBondContact O-N 2.91Å; I304-L308 HydrophobicContact CD1-CD1 4.07Å; I304-L308 HydrophobicContact CD1-CG 4.32Å; I304-L308 HydrophobicContact CG1-CD1 4.04Å; I304-L308 WeakPolarHBondContact O-CB 3.5Å; I304-L308 WeakPolarHBondContact O-CG 3.28Å; I304-L308 PolarHBondContact O-N 2.8Å
305	T	93.3	Very high	89.1	Confident	1 Å²	1	45.1 Å²	45.1	1%	0.006	22%	0.221	C	C	.	.	H	α-helix	trans	-73.6	-24.9	177.5	43.4	0	0	0	0	113.3	A272 L273 V276 Y299 A302 K303 R309	A272-T305 HydrophobicContact CB-CG2 4.08Å; L273-T305 VanDerWaalsContact CA-CG2 3.45Å; L273-T305 HydrophobicContact CB-CG2 4Å; L273-T305 HydrophobicContact CD1-CG2 4Å; V276-T305 HydrophobicContact CB-CG2 4.32Å; V276-T305 HydrophobicContact CG2-CG2 3.78Å; Y299-T305 CarbonylContact O-C 3.58Å; Y299-T305 WeakPolarHBondContact O-CB 3.41Å; Y299-T305 PolarHBondContact O-OG1 2.93Å; A302-T305 PolarHBondContact N-OG1 3.46Å; A302-T305 PolarHBondContact O-N 3.32Å; A302-T305 PolarHBondContact O-OG1 3.45Å; K303-T305 VanDerWaalsContact C-N 3.33Å; K303-T305 PolarHBondContact O-N 3.17Å; T305-R309 PolarHBondContact O-N 3.07Å
306	R	92.1	Very high	90.2	Very high	65 Å²	65	42 Å²	42	25%	0.245	20%	0.201	C	C	.	.	H	α-helix	trans	-69.8	-47.3	169.5	-62.2	-178.2	63.5	-161.9	-7.8	110.8	I162 T170 Y299 A302 K303 I304 L308 R309	I162-R306 HydrophobicContact CD1-CB 4.37Å; I162-R306 HydrophobicContact CG2-CB 4.21Å; I162-R306 PolarHBondContact O-NH2 2.98Å; T170-R306 PolarHBondContact OG1-O 3.47Å; Y299-R306 WeakPolarHBondContact O-CG 3.31Å; Y299-R306 PolarHBondContact O-N 3.16Å; A302-R306 PolarHBondContact O-N 2.87Å; K303-R306 WeakPolarHBondContact O-CB 3.16Å; K303-R306 PolarHBondContact O-N 2.9Å; K303-R306 VanDerWaalsContact O-N 3.16Å; I304-R306 VanDerWaalsContact C-N 3.34Å; R306-L308 VanDerWaalsContact C-N 3.29Å; R306-L308 PolarHBondContact O-N 2.93Å; R306-R309 WeakPolarHBondContact O-CB 3.49Å; R306-R309 PolarHBondContact O-N 2.98Å; R306-R309 VanDerWaalsContact O-N 3.17Å
307	L	92.2	Very high	90.7	Very high	17 Å²	17	36.3 Å²	36.3	9%	0.089	18%	0.175	C	C	.	.	H	α-helix	trans	-64.8	-31	-178.8	-65.1	163	0	0	0	113	L147 I162 V172 I214 K303 I304	L147-L307 HydrophobicContact CD1-CD1 4.47Å; L147-L307 HydrophobicContact CD2-CD1 4.01Å; I162-L307 HydrophobicContact CD1-CD1 4.23Å; I162-L307 HydrophobicContact CD1-CD2 4.04Å; I162-L307 HydrophobicContact CD1-CG 3.94Å; I162-L307 HydrophobicContact CG1-CD2 4.19Å; V172-L307 HydrophobicContact CG2-CD2 3.5Å; V172-L307 VanDerWaalsContact CG2-CD2 3.5Å; I214-L307 HydrophobicContact CD1-CB 3.96Å; I214-L307 HydrophobicContact CD1-CD1 3.78Å; I214-L307 HydrophobicContact CD1-CG 4.38Å; K303-L307 VanDerWaalsContact O-CG 3.31Å; K303-L307 WeakPolarHBondContact O-CG 3.34Å; K303-L307 PolarHBondContact O-N 2.88Å; I304-L307 PolarHBondContact O-N 2.91Å
308	L	92.6	Very high	91	Very high	4 Å²	4	35.8 Å²	35.8	2%	0.021	17%	0.172	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.4	7.2	176.4	-64.8	176.1	0	0	0	114.4	V242 L244 L273 I304 R306 D310 S311 L312	V242-L308 HydrophobicContact CG2-CD2 4.27Å; L244-L308 HydrophobicContact CD2-CD1 4.38Å; L273-L308 HydrophobicContact CD1-CD1 3.92Å; L273-L308 HydrophobicContact CD2-CD1 4.41Å; I304-L308 HydrophobicContact CD1-CD1 4.07Å; I304-L308 HydrophobicContact CD1-CG 4.32Å; I304-L308 HydrophobicContact CG1-CD1 4.04Å; I304-L308 WeakPolarHBondContact O-CB 3.5Å; I304-L308 WeakPolarHBondContact O-CG 3.28Å; I304-L308 PolarHBondContact O-N 2.8Å; R306-L308 VanDerWaalsContact C-N 3.29Å; R306-L308 PolarHBondContact O-N 2.93Å; L308-D310 VanDerWaalsContact C-N 3.32Å; L308-D310 PolarHBondContact O-N 2.81Å; L308-S311 WeakPolarHBondContact O-CB 3.15Å; L308-S311 PolarHBondContact O-N 2.95Å; L308-S311 VanDerWaalsContact O-N 3.11Å; L308-L312 HydrophobicContact CB-CD1 4.27Å; L308-L312 PolarHBondContact O-N 2.78Å
309	R	90.3	Very high	91.3	Very high	71 Å²	71	34.9 Å²	34.9	27%	0.268	17%	0.166	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.7	-44.6	179.5	172.4	-178.4	163.7	173.2	-6.9	112.5	D164 G168 Y299 T305 R306 S311	D164-R309 IonicContact OD1-CZ 2.95Å; D164-R309 IonicContact OD1-NH1 3.31Å; D164-R309 PolarHBondContact OD1-NH1 2.81Å; D164-R309 IonicContact OD2-CZ 2.67Å; D164-R309 IonicContact OD2-NH1 2.95Å; D164-R309 PolarHBondContact OD2-NH1 2.92Å; D164-R309 IonicContact OD2-NH2 3.04Å; G168-R309 PolarHBondContact O-NH2 2.92Å; Y299-R309 HydrophobicContact CD1-CB 4.02Å; Y299-R309 HydrophobicContact CD1-CG 4.21Å; Y299-R309 HydrophobicContact CD2-CG 4.42Å; Y299-R309 HydrophobicContact CE1-CB 4.33Å; Y299-R309 HydrophobicContact CE1-CG 4.31Å; Y299-R309 HydrophobicContact CE2-CG 4.48Å; Y299-R309 HydrophobicContact CG-CB 4.38Å; Y299-R309 HydrophobicContact CG-CG 4.27Å; T305-R309 PolarHBondContact O-N 3.07Å; R306-R309 WeakPolarHBondContact O-CB 3.49Å; R306-R309 PolarHBondContact O-N 2.98Å; R306-R309 VanDerWaalsContact O-N 3.17Å; R309-S311 PolarHBondContact O-N 2.95Å
310	D	87.8	Confident	91.6	Very high	18 Å²	18	32.9 Å²	32.9	10%	0.096	16%	0.158	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.9	-26.8	-178.6	-56.9	-26.8	0	0	0	111.5	N169 T170 L308 G314 N315 A316	N169-D310 WeakPolarHBondContact CA-OD1 3.27Å; T170-D310 PolarHBondContact N-OD1 3.44Å; T170-D310 PolarHBondContact N-OD2 3.09Å; L308-D310 VanDerWaalsContact C-N 3.32Å; L308-D310 PolarHBondContact O-N 2.81Å; D310-G314 CarbonylContact O-C 3.58Å; D310-G314 VanDerWaalsContact O-CA 3.29Å; D310-G314 WeakPolarHBondContact O-CA 3.41Å; D310-N315 CarbonylContact O-C 3.6Å; D310-N315 PolarHBondContact O-N 3.22Å; D310-A316 PolarHBondContact O-N 2.9Å
311	S	91.4	Very high	91.9	Very high	4 Å²	4	23.3 Å²	23.3	3%	0.028	12%	0.122	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.6	-24	-179.3	-45.4	0	0	0	0	114.2	T80 L308 R309 T318 N349	T80-S311 WeakPolarHBondContact CG2-OG 3.37Å; T80-S311 PolarHBondContact OG1-OG 3.4Å; L308-S311 WeakPolarHBondContact O-CB 3.15Å; L308-S311 PolarHBondContact O-N 2.95Å; L308-S311 VanDerWaalsContact O-N 3.11Å; R309-S311 PolarHBondContact O-N 2.95Å; S311-T318 WeakPolarHBondContact O-CB 3.42Å; S311-T318 PolarHBondContact O-OG1 3.42Å; S311-N349 PolarHBondContact O-ND2 3.36Å
312	L	91.8	Very high	92.2	Very high	1 Å²	1	18.6 Å²	18.6	1%	0.005	10%	0.097	C	C	.	.	S	Bend	trans	-124.1	95.4	-174.6	-65.3	177.2	0	0	0	110	F82 L273 I277 L280 Y299 L308 G314 I347	F82-L312 HydrophobicContact CE1-CD2 4.02Å; F82-L312 HydrophobicContact CZ-CD2 4.19Å; L273-L312 HydrophobicContact CD1-CD1 3.58Å; I277-L312 HydrophobicContact CD1-CD1 4.45Å; I277-L312 HydrophobicContact CG1-CD1 4.25Å; L280-L312 HydrophobicContact CD1-CB 4.07Å; L280-L312 VanDerWaalsContact CD1-O 3.29Å; L280-L312 WeakPolarHBondContact CD1-O 3.29Å; Y299-L312 WeakPolarHBondContact CE1-O 3.38Å; Y299-L312 PolarHBondContact OH-O 3.07Å; L308-L312 HydrophobicContact CB-CD1 4.27Å; L308-L312 PolarHBondContact O-N 2.78Å; L312-G314 VanDerWaalsContact C-N 3.35Å; L312-I347 HydrophobicContact CD2-CD1 4.15Å
313	G	85.8	Confident	92.4	Very high	25 Å²	25	18.5 Å²	18.5	26%	0.258	10%	0.095	S	C	.	.	S	Bend	trans	84.7	5.6	-174.4	0	0	0	0	0	114.6	N349	G313-N349 WeakPolarHBondContact CA-OD1 3.45Å; G313-N349 PolarHBondContact N-OD1 3.45Å
314	G	87.4	Confident	92.5	Very high	20 Å²	20	15.4 Å²	15.4	21%	0.206	8%	0.082	C	C	.	.	S	Bend	trans	-111.7	-150.8	-175	0	0	0	0	0	115	D310 L312 A316 N349 C350	D310-G314 CarbonylContact O-C 3.58Å; D310-G314 VanDerWaalsContact O-CA 3.29Å; D310-G314 WeakPolarHBondContact O-CA 3.41Å; L312-G314 VanDerWaalsContact C-N 3.35Å; G314-A316 PolarHBondContact O-N 3.23Å; G314-N349 WeakPolarHBondContact O-CB 3.21Å; G314-C350 PolarHBondContact O-N 3Å
315	N	88.3	Confident	92.5	Very high	42 Å²	42	15.5 Å²	15.5	23%	0.225	8%	0.083	C	C	.	.	S	Bend	trans	-97.9	69.6	-176.4	-179.3	21.2	0	0	0	112.3	N78 D310 G352	N78-N315 WeakPolarHBondContact CB-O 3.48Å; N78-N315 PolarHBondContact ND2-O 2.78Å; D310-N315 CarbonylContact O-C 3.6Å; D310-N315 PolarHBondContact O-N 3.22Å; N315-G352 PolarHBondContact OD1-N 3.06Å; N315-G352 PolarHBondContact OD1-O 3.38Å
316	A	90.9	Very high	92.5	Very high	1 Å²	1	15.5 Å²	15.5	1%	0.008	8%	0.083	C	C	.	.	S	Bend	trans	-156.9	153	168.9	0	0	0	0	0	112.2	N78 D310 G314 N349	N78-A316 HydrophobicContact CB-CB 3.9Å; N78-A316 CarbonylContact O-C 3.54Å; N78-A316 WeakPolarHBondContact O-CA 3.41Å; D310-A316 PolarHBondContact O-N 2.9Å; G314-A316 PolarHBondContact O-N 3.23Å; A316-N349 VanDerWaalsContact O-CB 3.29Å; A316-N349 WeakPolarHBondContact O-CB 3.49Å; A316-N349 PolarHBondContact O-ND2 2.78Å
317	H	93.9	Very high	92.6	Very high	42 Å²	42	12.4 Å²	12.4	19%	0.194	7%	0.071	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	134.4	156.6	-69.2	-92.6	0	0	0	108.4	L69 Y77 N78 A79 T80 P351	L69-H317 HydrophobicContact CD2-CB 3.63Å; Y77-H317 AromaticContact CD1-NE2 4Å; N78-H317 PolarHBondContact O-N 2.85Å; A79-H317 CarbonylContact C-O 3.6Å; A79-H317 VanDerWaalsContact CA-O 3.26Å; A79-H317 WeakPolarHBondContact CA-O 3.39Å; T80-H317 PolarHBondContact N-O 3.4Å; H317-P351 VanDerWaalsContact CD2-CB 3.5Å; H317-P351 WeakPolarHBondContact CD2-CB 3.34Å; H317-P351 WeakPolarHBondContact NE2-CB 3.4Å; H317-P351 WeakPolarHBondContact NE2-CG 3.26Å
318	T	95.6	Very high	92.5	Very high	6 Å²	6	14.8 Å²	14.8	4%	0.037	8%	0.082	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	134.9	-173.7	-59.8	0	0	0	0	112.2	V6 R7 T80 F82 S311 N349	V6-T318 HydrophobicContact CG1-CG2 4.13Å; R7-T318 PolarHBondContact N-O 3.17Å; T80-T318 HydrophobicContact CG2-CG2 4.34Å; T80-T318 WeakPolarHBondContact O-CA 3.42Å; F82-T318 HydrophobicContact CD1-CG2 3.94Å; F82-T318 HydrophobicContact CE1-CG2 3.76Å; S311-T318 WeakPolarHBondContact O-CB 3.42Å; S311-T318 PolarHBondContact O-OG1 3.42Å; T318-N349 PolarHBondContact OG1-ND2 2.89Å
319	V	96.7	Very high	92.3	Very high	2 Å²	2	19.6 Å²	19.6	1%	0.012	10%	0.104	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	127.8	173.5	167.2	0	0	0	0	108.6	R7 C65 L69 T80 V81 F82 V321	R7-V319 HydrophobicContact CB-CG2 3.93Å; R7-V319 CarbonylContact O-C 3.53Å; R7-V319 WeakPolarHBondContact O-CA 3.36Å; C65-V319 HydrophobicContact CB-CG1 4.23Å; L69-V319 HydrophobicContact CD1-CB 4.06Å; L69-V319 HydrophobicContact CD1-CG2 3.7Å; L69-V319 HydrophobicContact CD2-CG2 4.49Å; L69-V319 HydrophobicContact CG-CG2 4.31Å; T80-V319 PolarHBondContact O-N 2.75Å; V81-V319 WeakPolarHBondContact CA-O 3.36Å; F82-V319 PolarHBondContact N-O 2.9Å; V319-V321 HydrophobicContact CG1-CG2 4.02Å
320	M	96.8	Very high	92.2	Very high	0 Å²	0	18.9 Å²	18.9	0%	0	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	127.9	165.9	178.8	-175	172.5	0	0	109.3	R7 V8 A9 F82 Y84 A322 F340 A341 A344	R7-M320 PolarHBondContact O-N 3.4Å; V8-M320 HydrophobicContact CG1-SD 4.46Å; V8-M320 HydrophobicContact CG2-CB 4.29Å; A9-M320 PolarHBondContact N-O 3.16Å; F82-M320 HydrophobicContact CD1-CB 4.48Å; F82-M320 HydrophobicContact CD2-CG 4.24Å; F82-M320 HydrophobicContact CE1-CB 3.84Å; F82-M320 HydrophobicContact CE1-CG 4.31Å; F82-M320 HydrophobicContact CE2-CB 4.04Å; F82-M320 HydrophobicContact CE2-CG 3.58Å; F82-M320 HydrophobicContact CE2-SD 4.1Å; F82-M320 HydrophobicContact CZ-CB 3.6Å; F82-M320 HydrophobicContact CZ-CG 3.63Å; F82-M320 HydrophobicContact CZ-SD 4.08Å; Y84-M320 HydrophobicContact CD1-CE 3.43Å; Y84-M320 VanDerWaalsContact CD1-CE 3.43Å; Y84-M320 HydrophobicContact CE1-CE 4.4Å; Y84-M320 HydrophobicContact CG-CE 3.84Å; M320-A322 HydrophobicContact CE-CB 3.99Å; M320-F340 HydrophobicContact CE-CD1 3.54Å; M320-F340 HydrophobicContact CE-CE1 3.86Å; M320-F340 HydrophobicContact SD-CD1 4.21Å; M320-F340 HydrophobicContact SD-CE1 4.36Å; M320-A341 HydrophobicContact CE-CB 3.88Å; M320-A341 HydrophobicContact SD-CB 4.16Å; M320-A344 HydrophobicContact SD-CB 3.63Å
321	V	96.7	Very high	92.3	Very high	0 Å²	0	21.5 Å²	21.5	0%	0	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	103.7	170.5	-171.2	0	0	0	0	109.1	V81 F82 C83 Y84 T94 V319 C323	V81-V321 HydrophobicContact CG1-CG2 4.02Å; F82-V321 PolarHBondContact O-N 2.95Å; C83-V321 WeakPolarHBondContact CA-O 3.44Å; Y84-V321 PolarHBondContact N-O 2.99Å; T94-V321 HydrophobicContact CG2-CG1 4.08Å; V319-V321 HydrophobicContact CG1-CG2 4.02Å; V321-C323 PolarHBondContact O-N 2.81Å
322	A	96.6	Very high	92.3	Very high	0 Å²	0	23.2 Å²	23.2	0%	0	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	99	-179.4	0	0	0	0	0	110.4	A9 V10 R11 Y84 M320 V337 A341	A9-A322 PolarHBondContact O-N 3.43Å; V10-A322 WeakPolarHBondContact CA-O 3.41Å; V10-A322 HydrophobicContact CG2-CB 4.12Å; R11-A322 PolarHBondContact N-O 3.13Å; Y84-A322 CarbonylContact O-C 3.48Å; Y84-A322 WeakPolarHBondContact O-CA 3.49Å; M320-A322 HydrophobicContact CE-CB 3.99Å; A322-V337 HydrophobicContact CB-CG1 4.08Å; A322-A341 HydrophobicContact CB-CB 3.87Å
323	C	95.4	Very high	92.2	Very high	2 Å²	2	23.4 Å²	23.4	1%	0.014	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	129.5	179.6	-58.2	0	0	0	0	110.3	Y84 S89 K91 V321	Y84-C323 PolarHBondContact O-N 2.77Å; S89-C323 WeakPolarHBondContact CB-O 3.24Å; S89-C323 PolarHBondContact OG-O 3.34Å; K91-C323 HydrophobicContact CG-CB 4.07Å; V321-C323 PolarHBondContact O-N 2.81Å
324	V	95.1	Very high	92.5	Very high	2 Å²	2	22.3 Å²	22.3	1%	0.012	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	145.2	-176.8	-63.4	0	0	0	0	112.5	V10 R11 I12 R13 T334 V337	V10-V324 HydrophobicContact CG1-CG2 3.99Å; R11-V324 PolarHBondContact O-N 3.45Å; I12-V324 HydrophobicContact CB-CG2 4.21Å; I12-V324 HydrophobicContact CG1-CG2 3.76Å; I12-V324 HydrophobicContact CG2-CG2 4.4Å; R13-V324 PolarHBondContact N-O 2.82Å; V324-T334 HydrophobicContact CB-CG2 3.94Å; V324-T334 HydrophobicContact CG1-CG2 3.97Å; V324-V337 HydrophobicContact CG1-CB 4.1Å; V324-V337 HydrophobicContact CG1-CG1 3.65Å
325	S	92.9	Very high	92.8	Very high	3 Å²	3	22.8 Å²	22.8	2%	0.021	12%	0.118	C	C	.	.			trans	-81.1	138.1	167.5	175.8	0	0	0	0	109.8	R13 E19 V28 S327 T334	R13-S325 PolarHBondContact NH2-OG 2.94Å; E19-S325 PolarHBondContact OE1-OG 3.03Å; V28-S325 WeakPolarHBondContact CG2-O 3.41Å; S325-S327 PolarHBondContact O-N 3.14Å; S325-S327 PolarHBondContact OG-N 2.72Å; S325-S327 VanDerWaalsContact OG-N 3.11Å; S325-T334 PolarHBondContact O-OG1 3.38Å
326	P	93.3	Very high	93	Very high	1 Å²	1	23.2 Å²	23.2	1%	0.006	12%	0.12	C	C	.	.			trans	-70.3	-16.5	170.6	30.2	-36.2	0	0	0	113.1	I12 R13 L15 V26 C27	I12-P326 HydrophobicContact CG2-CB 3.96Å; I12-P326 HydrophobicContact CG2-CG 4.49Å; R13-P326 WeakPolarHBondContact O-CD 3.5Å; R13-P326 VanDerWaalsContact O-CG 3.27Å; R13-P326 WeakPolarHBondContact O-CG 3.37Å; L15-P326 HydrophobicContact CD2-CG 3.8Å; L15-P326 HydrophobicContact CG-CG 3.84Å; V26-P326 CarbonylContact C-O 3.58Å; V26-P326 WeakPolarHBondContact CA-O 3.47Å; V26-P326 HydrophobicContact CG1-CB 4.11Å; V26-P326 HydrophobicContact CG2-CB 4.44Å; C27-P326 PolarHBondContact N-O 2.65Å; C27-P326 PolarHBondContact SG-O 3.43Å
327	S	92.3	Very high	93.2	Very high	0 Å²	0	23.3 Å²	23.3	0%	0	12%	0.12	C	C	.	.	B	Isolated β-bridge	trans	-66.8	132.4	-173	170.3	0	0	0	0	113.7	H24 S325 H329 F330	H24-S327 WeakPolarHBondContact CB-OG 3.29Å; H24-S327 PolarHBondContact ND1-OG 2.92Å; S325-S327 PolarHBondContact O-N 3.14Å; S325-S327 PolarHBondContact OG-N 2.72Å; S325-S327 VanDerWaalsContact OG-N 3.11Å; S327-H329 PolarHBondContact O-N 3.38Å; S327-H329 PolarHBondContact OG-N 3.36Å; S327-H329 VanDerWaalsContact OG-N 3.12Å; S327-F330 PolarHBondContact O-N 3.39Å
328	H	90.7	Very high	93.2	Very high	66 Å²	66	21.3 Å²	21.3	31%	0.306	11%	0.111	S	C	.	.	G	3₁₀ helix	trans	-58.3	-25	172.5	73.1	-87.3	0	0	0	114.6	Q25 C27 F330 I331	Q25-H328 PolarHBondContact N-CE1 2.79Å; Q25-H328 PolarHBondContact N-ND1 3.16Å; Q25-H328 VanDerWaalsContact N-ND1 3.1Å; Q25-H328 PolarHBondContact O-N 3.38Å; Q25-H328 PolarHBondContact O-ND1 2.94Å; Q25-H328 VanDerWaalsContact O-ND1 3.08Å; C27-H328 HydrophobicContact CB-CB 3.92Å; H328-F330 PolarHBondContact O-N 3.44Å; H328-I331 WeakPolarHBondContact O-CB 3.21Å; H328-I331 WeakPolarHBondContact O-CG2 3.42Å; H328-I331 PolarHBondContact O-N 3.48Å
329	H	88.4	Confident	93.1	Very high	106 Å²	106	24.9 Å²	24.9	49%	0.491	13%	0.127	S	C	.	.	G	3₁₀ helix	trans	-64.2	-23.2	174.7	-83.3	53.7	0	0	0	112.8	H24 S327	H24-H329 AromaticContact CD2-CE1 3.85Å; H24-H329 AromaticContact CD2-CG 3.98Å; H24-H329 AromaticContact CD2-ND1 3.64Å; H24-H329 AromaticContact NE2-CD2 3.7Å; H24-H329 AromaticContact NE2-CE1 3.89Å; H24-H329 AromaticContact NE2-CG 3.61Å; H24-H329 AromaticContact NE2-ND1 3.73Å; H24-H329 AromaticContact NE2-NE2 3.91Å; S327-H329 PolarHBondContact O-N 3.38Å; S327-H329 PolarHBondContact OG-N 3.36Å; S327-H329 VanDerWaalsContact OG-N 3.12Å
330	F	88.3	Confident	92.9	Very high	55 Å²	55	25.1 Å²	25.1	24%	0.241	13%	0.128	C	C	.	.	G	3₁₀ helix	trans	-107.4	14.1	179.1	-57.6	-52.2	0	0	0	113	E19 Q86 S327 H328 A332 E333 T334	E19-F330 WeakPolarHBondContact OE1-CE2 3.34Å; Q86-F330 VanDerWaalsContact NE2-CE1 3.32Å; S327-F330 PolarHBondContact O-N 3.39Å; H328-F330 PolarHBondContact O-N 3.44Å; F330-A332 PolarHBondContact O-N 3.25Å; F330-A332 VanDerWaalsContact O-N 3.11Å; F330-E333 PolarHBondContact O-N 2.99Å; F330-T334 PolarHBondContact O-N 3.31Å; F330-T334 PolarHBondContact O-OG1 3Å
331	I	90.6	Very high	92.9	Very high	73 Å²	73	25.1 Å²	25.1	37%	0.374	13%	0.128	S	C	.	.	H	α-helix	trans	-55.3	-33.1	-178.5	-164.8	172.8	0	0	0	113	C27 L40 H328 L335	C27-I331 HydrophobicContact CB-CD1 4.19Å; C27-I331 HydrophobicContact CB-CG1 4.46Å; L40-I331 HydrophobicContact CD1-CG1 4.02Å; L40-I331 HydrophobicContact CG-CG1 4.33Å; H328-I331 WeakPolarHBondContact O-CB 3.21Å; H328-I331 WeakPolarHBondContact O-CG2 3.42Å; H328-I331 PolarHBondContact O-N 3.48Å; I331-L335 VanDerWaalsContact O-CB 3.24Å; I331-L335 WeakPolarHBondContact O-CB 3.48Å; I331-L335 PolarHBondContact O-N 3.3Å
332	A	89.9	Confident	92.7	Very high	41 Å²	41	27 Å²	27	34%	0.339	14%	0.142	S	C	.	.	H	α-helix	trans	-72.1	-40.4	177.9	0	0	0	0	0	112.3	F330 N336	F330-A332 PolarHBondContact O-N 3.25Å; F330-A332 VanDerWaalsContact O-N 3.11Å; A332-N336 PolarHBondContact O-N 2.91Å; A332-N336 PolarHBondContact O-ND2 2.77Å; A332-N336 PolarHBondContact O-OD1 3.16Å
333	E	90.6	Very high	92.5	Very high	4 Å²	4	31.5 Å²	31.5	2%	0.019	16%	0.159	C	C	.	.	H	α-helix	trans	-69.5	-48.8	175.6	-72.4	66.2	-148.1	0	0	110.6	Q86 K252 F330 L335 N336 V337	Q86-E333 HydrophobicContact CB-CB 4.49Å; Q86-E333 HydrophobicContact CG-CB 4.28Å; Q86-E333 HydrophobicContact CG-CG 4.25Å; Q86-E333 VanDerWaalsContact OE1-CB 3.26Å; K252-E333 WeakPolarHBondContact CD-OE1 3.5Å; K252-E333 VanDerWaalsContact CE-OE1 3.23Å; K252-E333 WeakPolarHBondContact CE-OE1 3.35Å; K252-E333 IonicContact NZ-OE1 2.8Å; K252-E333 PolarHBondContact NZ-OE1 2.99Å; K252-E333 IonicContact NZ-OE2 2.8Å; K252-E333 PolarHBondContact NZ-OE2 2.8Å; F330-E333 PolarHBondContact O-N 2.99Å; E333-L335 VanDerWaalsContact C-N 3.3Å; E333-L335 PolarHBondContact O-N 3.01Å; E333-N336 WeakPolarHBondContact O-CB 3.47Å; E333-N336 PolarHBondContact O-N 2.98Å; E333-V337 WeakPolarHBondContact O-CG2 3.46Å; E333-V337 PolarHBondContact O-N 3.4Å
334	T	92.8	Very high	92.4	Very high	2 Å²	2	31.4 Å²	31.4	1%	0.012	16%	0.158	C	C	.	.	H	α-helix	trans	-57.4	-40.4	175.1	-68.5	0	0	0	0	112	V28 L40 V324 S325 F330 N336 V337 L338	V28-T334 HydrophobicContact CG2-CG2 3.77Å; L40-T334 HydrophobicContact CD1-CG2 3.85Å; V324-T334 HydrophobicContact CB-CG2 3.94Å; V324-T334 HydrophobicContact CG1-CG2 3.97Å; S325-T334 PolarHBondContact O-OG1 3.38Å; F330-T334 PolarHBondContact O-N 3.31Å; F330-T334 PolarHBondContact O-OG1 3Å; T334-N336 VanDerWaalsContact C-N 3.35Å; T334-N336 PolarHBondContact O-N 2.96Å; T334-V337 PolarHBondContact O-N 3.43Å; T334-L338 HydrophobicContact CG2-CD1 3.9Å; T334-L338 HydrophobicContact CG2-CG 4.28Å; T334-L338 WeakPolarHBondContact O-CG 3.4Å; T334-L338 PolarHBondContact O-N 3.26Å
335	L	92.8	Very high	92.3	Very high	31 Å²	31	35.1 Å²	35.1	16%	0.162	17%	0.172	C	C	.	.	H	α-helix	trans	-58.3	-45.1	172.8	177.6	64	0	0	0	112	L40 F46 I331 E333 V337 L338 Q339	L40-L335 HydrophobicContact CD2-CB 3.92Å; L40-L335 HydrophobicContact CD2-CD1 3.77Å; L40-L335 HydrophobicContact CD2-CG 4.43Å; F46-L335 HydrophobicContact CZ-CD1 3.91Å; I331-L335 VanDerWaalsContact O-CB 3.24Å; I331-L335 WeakPolarHBondContact O-CB 3.48Å; I331-L335 PolarHBondContact O-N 3.3Å; E333-L335 VanDerWaalsContact C-N 3.3Å; E333-L335 PolarHBondContact O-N 3.01Å; L335-V337 VanDerWaalsContact C-N 3.32Å; L335-V337 PolarHBondContact O-N 3.12Å; L335-L338 PolarHBondContact O-N 2.93Å; L335-Q339 HydrophobicContact CD1-CG 4.22Å; L335-Q339 WeakPolarHBondContact O-CB 3.34Å; L335-Q339 VanDerWaalsContact O-CG 3.28Å; L335-Q339 WeakPolarHBondContact O-CG 3.49Å; L335-Q339 PolarHBondContact O-N 2.98Å
336	N	92.3	Very high	92.2	Very high	51 Å²	51	39 Å²	39	27%	0.273	19%	0.19	S	C	.	.	H	α-helix	trans	-63.6	-40.4	178.4	-56.4	-39.4	0	0	0	110.8	R249 A332 E333 T334 Q339 F340	R249-N336 PolarHBondContact NH2-ND2 3.47Å; A332-N336 PolarHBondContact O-N 2.91Å; A332-N336 PolarHBondContact O-ND2 2.77Å; A332-N336 PolarHBondContact O-OD1 3.16Å; E333-N336 WeakPolarHBondContact O-CB 3.47Å; E333-N336 PolarHBondContact O-N 2.98Å; T334-N336 VanDerWaalsContact C-N 3.35Å; T334-N336 PolarHBondContact O-N 2.96Å; N336-Q339 PolarHBondContact O-N 3.04Å; N336-F340 VanDerWaalsContact O-CB 3.25Å; N336-F340 WeakPolarHBondContact O-CB 3.46Å; N336-F340 PolarHBondContact O-N 3.29Å
337	V	94.6	Very high	92.1	Very high	2 Å²	2	39 Å²	39	1%	0.012	19%	0.189	C	C	.	.	H	α-helix	trans	-63.8	-47.8	177.5	175.6	0	0	0	0	111.4	Y84 A322 V324 E333 T334 L335 Q339 F340 A341	Y84-V337 HydrophobicContact CD1-CG1 4.15Å; Y84-V337 HydrophobicContact CE1-CB 4.43Å; Y84-V337 HydrophobicContact CE1-CG1 4.32Å; Y84-V337 HydrophobicContact CE1-CG2 4.09Å; A322-V337 HydrophobicContact CB-CG1 4.08Å; V324-V337 HydrophobicContact CG1-CB 4.1Å; V324-V337 HydrophobicContact CG1-CG1 3.65Å; E333-V337 WeakPolarHBondContact O-CG2 3.46Å; E333-V337 PolarHBondContact O-N 3.4Å; T334-V337 PolarHBondContact O-N 3.43Å; L335-V337 VanDerWaalsContact C-N 3.32Å; L335-V337 PolarHBondContact O-N 3.12Å; V337-Q339 VanDerWaalsContact C-N 3.35Å; V337-Q339 PolarHBondContact O-N 3.2Å; V337-F340 PolarHBondContact O-N 3.46Å; V337-A341 VanDerWaalsContact O-CB 3.26Å; V337-A341 WeakPolarHBondContact O-CB 3.4Å; V337-A341 PolarHBondContact O-N 2.99Å
338	L	94.6	Very high	92	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-64.4	-36.9	177.7	-66	172.4	0	0	0	112.1	V10 V38 L40 F46 F48 T334 L335 S342	V10-L338 HydrophobicContact CG1-CD2 4.04Å; V10-L338 HydrophobicContact CG2-CD2 3.88Å; V38-L338 HydrophobicContact CG1-CD1 4.43Å; V38-L338 HydrophobicContact CG1-CD2 4.44Å; L40-L338 HydrophobicContact CB-CD1 4.3Å; L40-L338 HydrophobicContact CD1-CD1 4.4Å; L40-L338 HydrophobicContact CD2-CD1 4.28Å; F46-L338 HydrophobicContact CD1-CB 4.19Å; F46-L338 HydrophobicContact CD2-CB 4.34Å; F46-L338 HydrophobicContact CD2-CD1 4.02Å; F46-L338 HydrophobicContact CE1-CB 4.14Å; F46-L338 HydrophobicContact CE2-CB 4.29Å; F46-L338 HydrophobicContact CE2-CD1 4.07Å; F46-L338 HydrophobicContact CG-CB 4.29Å; F46-L338 HydrophobicContact CZ-CB 4.19Å; F48-L338 HydrophobicContact CE2-CD2 3.8Å; F48-L338 HydrophobicContact CZ-CB 4.33Å; F48-L338 HydrophobicContact CZ-CD2 3.76Å; T334-L338 HydrophobicContact CG2-CD1 3.9Å; T334-L338 HydrophobicContact CG2-CG 4.28Å; T334-L338 WeakPolarHBondContact O-CG 3.4Å; T334-L338 PolarHBondContact O-N 3.26Å; L335-L338 PolarHBondContact O-N 2.93Å; L338-S342 WeakPolarHBondContact O-CB 3.49Å; L338-S342 PolarHBondContact O-N 2.98Å
339	Q	93.3	Very high	92	Very high	81 Å²	81	41.7 Å²	41.7	38%	0.379	20%	0.197	S	C	.	.	H	α-helix	trans	-70.7	-33.1	173.9	-73.9	179.2	-8.9	0	0	113.6	F46 L335 N336 V337 R343	F46-Q339 HydrophobicContact CE1-CG 4.28Å; L335-Q339 HydrophobicContact CD1-CG 4.22Å; L335-Q339 WeakPolarHBondContact O-CB 3.34Å; L335-Q339 VanDerWaalsContact O-CG 3.28Å; L335-Q339 WeakPolarHBondContact O-CG 3.49Å; L335-Q339 PolarHBondContact O-N 2.98Å; N336-Q339 PolarHBondContact O-N 3.04Å; V337-Q339 VanDerWaalsContact C-N 3.35Å; V337-Q339 PolarHBondContact O-N 3.2Å; Q339-R343 WeakPolarHBondContact O-CG 3.46Å; Q339-R343 PolarHBondContact O-N 2.88Å; Q339-R343 PolarHBondContact O-NE 2.91Å
340	F	93.8	Very high	92	Very high	7 Å²	7	39.3 Å²	39.3	3%	0.031	19%	0.191	C	C	.	.	H	α-helix	trans	-69.1	-49.2	173.6	-174.9	-75.7	0	0	0	110.2	Y84 L273 I277 M320 N336 V337 S342 R343 A344	Y84-F340 AromaticContact CD1-CD1 3.68Å; Y84-F340 HydrophobicContact CD1-CD1 3.68Å; Y84-F340 AromaticContact CD1-CE1 3.82Å; Y84-F340 HydrophobicContact CD1-CE1 3.82Å; Y84-F340 HydrophobicContact CD1-CG 4.2Å; Y84-F340 HydrophobicContact CD1-CZ 4.45Å; Y84-F340 HydrophobicContact CD2-CE1 4.05Å; Y84-F340 HydrophobicContact CD2-CZ 4.06Å; Y84-F340 HydrophobicContact CE1-CB 3.86Å; Y84-F340 AromaticContact CE1-CD1 3.49Å; Y84-F340 HydrophobicContact CE1-CD1 3.49Å; Y84-F340 VanDerWaalsContact CE1-CD1 3.49Å; Y84-F340 AromaticContact CE1-CD2 3.93Å; Y84-F340 HydrophobicContact CE1-CD2 3.93Å; Y84-F340 AromaticContact CE1-CE1 3.81Å; Y84-F340 HydrophobicContact CE1-CE1 3.81Å; Y84-F340 HydrophobicContact CE1-CE2 4.23Å; Y84-F340 AromaticContact CE1-CG 3.52Å; Y84-F340 HydrophobicContact CE1-CG 3.52Å; Y84-F340 HydrophobicContact CE1-CZ 4.15Å; Y84-F340 HydrophobicContact CE2-CD2 4.44Å; Y84-F340 HydrophobicContact CE2-CE1 4.06Å; Y84-F340 AromaticContact CE2-CE2 3.98Å; Y84-F340 HydrophobicContact CE2-CE2 3.98Å; Y84-F340 AromaticContact CE2-CZ 3.73Å; Y84-F340 HydrophobicContact CE2-CZ 3.73Å; Y84-F340 HydrophobicContact CG-CD1 4.27Å; Y84-F340 AromaticContact CG-CE1 3.93Å; Y84-F340 HydrophobicContact CG-CE1 3.93Å; Y84-F340 HydrophobicContact CG-CZ 4.4Å; Y84-F340 AromaticContact CZ-CD1 3.95Å; Y84-F340 AromaticContact CZ-CD2 3.69Å; Y84-F340 AromaticContact CZ-CE1 3.93Å; Y84-F340 AromaticContact CZ-CE2 3.68Å; Y84-F340 AromaticContact CZ-CG 3.81Å; Y84-F340 AromaticContact CZ-CZ 3.77Å; Y84-F340 WeakPolarHBondContact OH-CD2 3.47Å; L273-F340 HydrophobicContact CD2-CZ 4.05Å; L273-F340 HydrophobicContact CG-CZ 4.07Å; I277-F340 HydrophobicContact CD1-CD1 4.15Å; I277-F340 HydrophobicContact CD1-CE1 3.34Å; I277-F340 HydrophobicContact CD1-CE2 3.97Å; I277-F340 HydrophobicContact CD1-CZ 3.25Å; M320-F340 HydrophobicContact CE-CD1 3.54Å; M320-F340 HydrophobicContact CE-CE1 3.86Å; M320-F340 HydrophobicContact SD-CD1 4.21Å; M320-F340 HydrophobicContact SD-CE1 4.36Å; N336-F340 VanDerWaalsContact O-CB 3.25Å; N336-F340 WeakPolarHBondContact O-CB 3.46Å; N336-F340 PolarHBondContact O-N 3.29Å; V337-F340 PolarHBondContact O-N 3.46Å; F340-S342 PolarHBondContact O-N 3.29Å; F340-R343 PolarHBondContact O-N 2.93Å; F340-R343 VanDerWaalsContact O-N 3.15Å; F340-A344 PolarHBondContact O-N 3.15Å
341	A	94.9	Very high	91.8	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-57	-44.9	175	0	0	0	0	0	112.4	V8 F48 M320 A322 V337 R343 A344 R345	V8-A341 HydrophobicContact CG1-CB 3.79Å; F48-A341 HydrophobicContact CD1-CB 4.41Å; F48-A341 HydrophobicContact CE1-CB 3.67Å; F48-A341 HydrophobicContact CZ-CB 4.35Å; M320-A341 HydrophobicContact CE-CB 3.88Å; M320-A341 HydrophobicContact SD-CB 4.16Å; A322-A341 HydrophobicContact CB-CB 3.87Å; V337-A341 VanDerWaalsContact O-CB 3.26Å; V337-A341 WeakPolarHBondContact O-CB 3.4Å; V337-A341 PolarHBondContact O-N 2.99Å; A341-R343 VanDerWaalsContact C-N 3.3Å; A341-R343 PolarHBondContact O-N 3.21Å; A341-A344 PolarHBondContact O-N 3.35Å; A341-R345 PolarHBondContact O-N 2.97Å; A341-R345 VanDerWaalsContact O-N 3.13Å
342	S	93.4	Very high	91.3	Very high	41 Å²	41	34.4 Å²	34.4	29%	0.287	17%	0.173	S	C	.	.	H	α-helix	trans	-61.6	-35.6	177.3	-176.4	0	0	0	0	112.7	L338 F340 H346	L338-S342 WeakPolarHBondContact O-CB 3.49Å; L338-S342 PolarHBondContact O-N 2.98Å; F340-S342 PolarHBondContact O-N 3.29Å; S342-H346 PolarHBondContact O-CE1 2.86Å; S342-H346 PolarHBondContact O-ND1 3.42Å
343	R	92.6	Very high	90.7	Very high	93 Å²	93	37.5 Å²	37.5	35%	0.351	18%	0.176	S	C	.	.	H	α-helix	trans	-73.3	-41.9	173.2	-74.8	174.8	-71	179.7	2.6	112.4	I277 Q339 F340 A341 R345 H346	I277-R343 HydrophobicContact CG2-CB 3.92Å; Q339-R343 WeakPolarHBondContact O-CG 3.46Å; Q339-R343 PolarHBondContact O-N 2.88Å; Q339-R343 PolarHBondContact O-NE 2.91Å; F340-R343 PolarHBondContact O-N 2.93Å; F340-R343 VanDerWaalsContact O-N 3.15Å; A341-R343 VanDerWaalsContact C-N 3.3Å; A341-R343 PolarHBondContact O-N 3.21Å; R343-R345 VanDerWaalsContact C-N 3.26Å; R343-R345 PolarHBondContact O-N 3.3Å; R343-H346 WeakPolarHBondContact O-CB 2.92Å; R343-H346 PolarHBondContact O-N 2.88Å
344	A	94.1	Very high	89.5	Confident	0 Å²	0	39 Å²	39	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-56.3	-39.5	178.1	0	0	0	0	0	112.3	V8 I277 M320 F340 A341 H346 I347	V8-A344 HydrophobicContact CG2-CB 4.34Å; I277-A344 HydrophobicContact CG2-CB 4.41Å; M320-A344 HydrophobicContact SD-CB 3.63Å; F340-A344 PolarHBondContact O-N 3.15Å; A341-A344 PolarHBondContact O-N 3.35Å; A344-H346 PolarHBondContact O-N 2.9Å; A344-I347 VanDerWaalsContact O-CB 3.31Å; A344-I347 WeakPolarHBondContact O-CB 3.43Å; A344-I347 WeakPolarHBondContact O-CG1 3.47Å; A344-I347 PolarHBondContact O-N 3.31Å
345	R	92.9	Very high	88.1	Confident	80 Å²	80	43.1 Å²	43.1	30%	0.302	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.8	-21.1	176.3	-160.7	177.4	-178.5	-149.4	-4.6	114.8	V8 S47 F48 D49 A341 R343	V8-R345 HydrophobicContact CB-CB 4.34Å; V8-R345 HydrophobicContact CB-CG 4.47Å; V8-R345 HydrophobicContact CG2-CB 3.67Å; V8-R345 HydrophobicContact CG2-CG 4.13Å; S47-R345 PolarHBondContact O-NH1 3.39Å; F48-R345 PolarHBondContact O-NH2 2.98Å; D49-R345 IonicContact OD1-CZ 3.82Å; D49-R345 IonicContact OD1-NE 2.72Å; D49-R345 PolarHBondContact OD1-NE 3.06Å; D49-R345 IonicContact OD1-NH2 2.73Å; D49-R345 PolarHBondContact OD1-NH2 2.83Å; D49-R345 IonicContact OD2-NE 3.67Å; D49-R345 PolarHBondContact OD2-NE 3.39Å; D49-R345 VanDerWaalsContact OD2-NE 3.14Å; A341-R345 PolarHBondContact O-N 2.97Å; A341-R345 VanDerWaalsContact O-N 3.13Å; R343-R345 VanDerWaalsContact C-N 3.26Å; R343-R345 PolarHBondContact O-N 3.3Å
346	H	90.5	Very high	86.5	Confident	86 Å²	86	44.5 Å²	44.5	40%	0.398	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.7	-5.8	179.2	-66.9	80.9	0	0	0	113.6	S342 R343 A344	S342-H346 PolarHBondContact O-CE1 2.86Å; S342-H346 PolarHBondContact O-ND1 3.42Å; R343-H346 WeakPolarHBondContact O-CB 2.92Å; R343-H346 PolarHBondContact O-N 2.88Å; A344-H346 PolarHBondContact O-N 2.9Å
347	I	91.8	Very high	84.6	Confident	0 Å²	0	47.3 Å²	47.3	0%	0	24%	0.237	C	C	.	.			trans	-71.8	140.2	175.9	-60.4	178.1	0	0	0	109.4	C5 V6 I277 L280 L312 A344	C5-I347 VanDerWaalsContact CA-O 3.27Å; C5-I347 WeakPolarHBondContact CA-O 3.43Å; V6-I347 HydrophobicContact CB-CB 4.39Å; V6-I347 HydrophobicContact CG2-CB 3.8Å; V6-I347 HydrophobicContact CG2-CG2 3.8Å; V6-I347 PolarHBondContact N-O 3.2Å; I277-I347 HydrophobicContact CB-CD1 4.12Å; I277-I347 HydrophobicContact CG1-CD1 3.77Å; I277-I347 HydrophobicContact CG2-CD1 4.09Å; L280-I347 HydrophobicContact CB-CB 4.49Å; L280-I347 HydrophobicContact CB-CD1 4.09Å; L280-I347 HydrophobicContact CB-CG1 3.79Å; L280-I347 HydrophobicContact CB-CG2 4.18Å; L280-I347 HydrophobicContact CD1-CD1 4.09Å; L280-I347 HydrophobicContact CD1-CG2 4.08Å; L312-I347 HydrophobicContact CD2-CD1 4.15Å; A344-I347 VanDerWaalsContact O-CB 3.31Å; A344-I347 WeakPolarHBondContact O-CB 3.43Å; A344-I347 WeakPolarHBondContact O-CG1 3.47Å; A344-I347 PolarHBondContact O-N 3.31Å
348	R	89.7	Confident	82.4	Confident	121 Å²	121	50.1 Å²	50.1	46%	0.457	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	120.5	179.2	-64	-180	173	-122.2	-14.3	110	E3 V4	E3-R348 HydrophobicContact CB-CB 4.5Å; E3-R348 VanDerWaalsContact OE2-CD 3.29Å; E3-R348 WeakPolarHBondContact OE2-CD 3.44Å; E3-R348 IonicContact OE2-CZ 2.74Å; E3-R348 IonicContact OE2-NE 3.58Å; E3-R348 IonicContact OE2-NH1 2.77Å; E3-R348 PolarHBondContact OE2-NH1 3.16Å; V4-R348 WeakPolarHBondContact O-CA 3.42Å
349	N	91	Very high	79.5	Confident	2 Å²	2	56.4 Å²	56.4	1%	0.011	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	160.9	172.6	-67.7	8	0	0	0	109.7	V4 S311 G313 G314 A316 T318 P351	V4-N349 PolarHBondContact N-O 3.06Å; V4-N349 PolarHBondContact O-N 2.71Å; S311-N349 PolarHBondContact O-ND2 3.36Å; G313-N349 WeakPolarHBondContact CA-OD1 3.45Å; G313-N349 PolarHBondContact N-OD1 3.45Å; G314-N349 WeakPolarHBondContact O-CB 3.21Å; A316-N349 VanDerWaalsContact O-CB 3.29Å; A316-N349 WeakPolarHBondContact O-CB 3.49Å; A316-N349 PolarHBondContact O-ND2 2.78Å; T318-N349 PolarHBondContact OG1-ND2 2.89Å; N349-P351 VanDerWaalsContact C-CD 3.46Å; N349-P351 WeakPolarHBondContact O-CD 3.33Å
350	C	88.1	Confident	76.8	Confident	55 Å²	55	55.6 Å²	55.6	37%	0.372	29%	0.288	S	S	.	.			trans	-122.4	72.5	175.9	-71.5	0	0	0	0	109.6	G314 G352	G314-C350 PolarHBondContact O-N 3Å; C350-G352 PolarHBondContact O-N 2.82Å
351	P	83.8	Confident	73.9	Confident	9 Å²	9	65.3 Å²	65.3	6%	0.058	33%	0.33	C	S	.	.			trans	-61.8	122.5	179	25.4	-33	0	0	0	111.1	V4 Y77 H317 N349	V4-P351 HydrophobicContact CB-CG 4.21Å; V4-P351 HydrophobicContact CG2-CG 3.83Å; Y77-P351 HydrophobicContact CD1-CB 4.26Å; H317-P351 VanDerWaalsContact CD2-CB 3.5Å; H317-P351 WeakPolarHBondContact CD2-CB 3.34Å; H317-P351 WeakPolarHBondContact NE2-CB 3.4Å; H317-P351 WeakPolarHBondContact NE2-CG 3.26Å; N349-P351 VanDerWaalsContact C-CD 3.46Å; N349-P351 WeakPolarHBondContact O-CD 3.33Å
352	G	80.5	Confident	71.1	Confident	16 Å²	16	69.8 Å²	69.8	17%	0.165	36%	0.362	C	S	.	.			trans	-122	133.2	178.9	0	0	0	0	0	110.3	N315 C350 A354	N315-G352 PolarHBondContact OD1-N 3.06Å; N315-G352 PolarHBondContact OD1-O 3.38Å; C350-G352 PolarHBondContact O-N 2.82Å; G352-A354 PolarHBondContact O-N 3.39Å
353	R	75.9	Confident	68.6	Low	106 Å²	106	74.8 Å²	74.8	40%	0.4	39%	0.386	S	S	.	.			trans	-72.4	120.1	-175.2	-165.1	-177.6	-174.7	-170.1	9.3	110.9	D75 G76 Y77 L355	D75-R353 PolarHBondContact O-NE 3.02Å; D75-R353 PolarHBondContact O-NH2 2.86Å; G76-R353 WeakPolarHBondContact O-CA 3.49Å; Y77-R353 HydrophobicContact CD1-CB 4.26Å; Y77-R353 HydrophobicContact CE1-CB 3.81Å; Y77-R353 HydrophobicContact CE1-CG 4.46Å; Y77-R353 HydrophobicContact CE2-CG 4.44Å; R353-L355 HydrophobicContact CG-CD1 4.36Å; R353-L355 HydrophobicContact CG-CG 4.28Å; R353-L355 PolarHBondContact O-N 2.93Å
354	A	66.4	Low	66.1	Low	37 Å²	37	73.2 Å²	73.2	31%	0.306	39%	0.387	S	S	.	.			trans	-82.9	82.8	-175.5	0	0	0	0	0	111.4	G76 R235 S236 G352	G76-A354 PolarHBondContact O-N 3Å; R235-A354 WeakPolarHBondContact CA-O 3.35Å; S236-A354 PolarHBondContact N-O 2.85Å; S236-A354 WeakPolarHBondContact O-CB 3.43Å; G352-A354 PolarHBondContact O-N 3.39Å
355	L	63.4	Low	63.2	Low	88 Å²	88	82.9 Å²	82.9	46%	0.461	43%	0.429	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	132	174.4	-73	159.5	0	0	0	110.6	T233 R235 R353	T233-L355 HydrophobicContact CG2-CD2 3.77Å; R235-L355 HydrophobicContact CG-CD2 3.7Å; R353-L355 HydrophobicContact CG-CD1 4.36Å; R353-L355 HydrophobicContact CG-CG 4.28Å; R353-L355 PolarHBondContact O-N 2.93Å
356	S	58.8	Low	60.4	Low	59 Å²	59	82.8 Å²	82.8	41%	0.413	44%	0.438	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	122	164.6	-158.6	0	0	0	0	108.7	V234	V234-S356 PolarHBondContact N-O 2.88Å; V234-S356 PolarHBondContact O-N 3.38Å
357	L	51.8	Low	57.6	Low	111 Å²	111	83.4 Å²	83.4	58%	0.581	45%	0.451	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.7	130.8	168.6	-63.5	176.2	0	0	0	107.7	L231 T233	L231-L357 HydrophobicContact CD2-CD1 4.49Å; L231-L357 HydrophobicContact CD2-CD2 4.03Å; L231-L357 HydrophobicContact CG-CD2 4.33Å; T233-L357 HydrophobicContact CG2-CD2 4.35Å
358	T	48.3	Very low	54.7	Low	61 Å²	61	89.3 Å²	89.3	37%	0.374	48%	0.478	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	107.5	177.9	53.8	0	0	0	0	109.3	K232	K232-T358 PolarHBondContact O-N 3.5Å; K232-T358 PolarHBondContact O-OG1 3.25Å
359	D	35.1	Very low	52.3	Low	131 Å²	131	89.2 Å²	89.2	70%	0.701	49%	0.494	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-67.1	134.5	169.3	-78.8	-51	0	0	0	110.2	K361	D359-K361 PolarHBondContact O-N 2.81Å
360	V	35.9	Very low	49.7	Very low	64 Å²	64	92 Å²	92	39%	0.388	52%	0.517	S	S	.	.			trans	-82.4	112.1	-166.4	174.2	0	0	0	0	112.3	P230 K232	P230-V360 WeakPolarHBondContact O-CG2 3.24Å; K232-V360 HydrophobicContact CD-CG2 3.9Å; K232-V360 HydrophobicContact CG-CG2 4.03Å
361	K	33.6	Very low	47.4	Very low	211 Å²	211	93.1 Å²	93.1	92%	0.917	52%	0.517	S	S	*	.	S	Bend	trans	-141.7	29	158.6	-83.9	-151.6	175.9	-177.2	0	115.8	D359	D359-K361 PolarHBondContact O-N 2.81Å
362	S	34.5	Very low	45.4	Very low	95 Å²	95	96.7 Å²	96.7	66%	0.664	54%	0.538	S	S	*	.			trans	-157.6	152.9	158.3	51.5	0	0	0	0	110.7	P364	S362-P364 WeakPolarHBondContact O-CD 3.42Å
363	D	42.3	Very low	44	Very low	146 Å²	146	104 Å²	104	78%	0.781	56%	0.561	S	S	*	*			trans	-99	116.7	170.4	-98	-36.5	0	0	0	109.8	K232	K232-D363 IonicContact NZ-OD1 3.97Å
364	P	40.7	Very low	42.9	Very low	60 Å²	60	104 Å²	104	39%	0.39	57%	0.569	S	S	.	*			trans	-108.1	92.6	176.5	35.3	-25	0	0	0	111.2	S362	S362-P364 WeakPolarHBondContact O-CD 3.42Å
365	K	33.2	Very low	42.3	Very low	202 Å²	202	109 Å²	109	88%	0.878	59%	0.586	S	S	*	*	S	Bend	trans	-81.7	138.7	138.6	-75.4	-175.4	179.5	178.7	0	106.4
366	T	34	Very low	42.1	Very low	78 Å²	78	110.4 Å²	110.4	48%	0.479	59%	0.59	S	S	.	*			trans	74.5	133.4	-159.8	-32.3	0	0	0	0	112.5	Q368 E371	T366-Q368 HydrophobicContact CG2-CB 4.25Å; T366-Q368 HydrophobicContact CG2-CG 3.82Å; T366-E371 WeakPolarHBondContact CB-OE1 3.46Å; T366-E371 WeakPolarHBondContact CB-OE2 3.33Å; T366-E371 WeakPolarHBondContact CG2-OE1 3.49Å; T366-E371 WeakPolarHBondContact CG2-OE2 3.39Å
367	C	30.7	Very low	42.1	Very low	100 Å²	100	111.5 Å²	111.5	68%	0.676	59%	0.591	S	S	*	*			trans	-150.7	67.6	165.8	-84.8	0	0	0	0	105	E371	C367-E371 PolarHBondContact N-OE2 2.95Å
368	Q	30.8	Very low	42.7	Very low	123 Å²	123	110 Å²	110	58%	0.575	59%	0.586	S	S	*	*			trans	-92.4	143.3	172.9	-70.3	-174.7	14	0	0	108.8	T366 A370 E371	T366-Q368 HydrophobicContact CG2-CB 4.25Å; T366-Q368 HydrophobicContact CG2-CG 3.82Å; Q368-A370 PolarHBondContact O-N 2.94Å; Q368-E371 PolarHBondContact N-OE2 2.68Å; Q368-E371 PolarHBondContact O-N 3.5Å
369	P	40.6	Very low	43.6	Very low	120 Å²	120	115 Å²	115	78%	0.779	60%	0.599	S	S	*	*	H	α-helix	trans	-64.3	-3.3	177.8	27	-34.8	0	0	0	114
370	A	35.8	Very low	45.3	Very low	61 Å²	61	113.9 Å²	113.9	50%	0.504	59%	0.589	S	S	.	*	H	α-helix	trans	-72	-30.4	167.7	0	0	0	0	0	113.1	Q368 R373 L374	Q368-A370 PolarHBondContact O-N 2.94Å; A370-R373 PolarHBondContact O-N 2.88Å; A370-L374 WeakPolarHBondContact O-CB 3.31Å; A370-L374 PolarHBondContact O-N 3.03Å
371	E	38.9	Very low	46.9	Very low	77 Å²	77	113.7 Å²	113.7	36%	0.36	59%	0.588	S	S	.	*	H	α-helix	trans	-75.1	-44.3	-173.1	-70.5	168.1	132	0	0	111.8	T366 C367 Q368 R373 L374 E375	T366-E371 WeakPolarHBondContact CB-OE1 3.46Å; T366-E371 WeakPolarHBondContact CB-OE2 3.33Å; T366-E371 WeakPolarHBondContact CG2-OE1 3.49Å; T366-E371 WeakPolarHBondContact CG2-OE2 3.39Å; C367-E371 PolarHBondContact N-OE2 2.95Å; Q368-E371 PolarHBondContact N-OE2 2.68Å; Q368-E371 PolarHBondContact O-N 3.5Å; E371-R373 VanDerWaalsContact C-N 3.26Å; E371-R373 PolarHBondContact O-N 3.44Å; E371-L374 CarbonylContact O-C 3.53Å; E371-L374 WeakPolarHBondContact O-CA 3.2Å; E371-L374 WeakPolarHBondContact O-CB 3.39Å; E371-L374 PolarHBondContact O-N 3.42Å; E371-E375 PolarHBondContact O-N 3.12Å
372	T	42.3	Very low	48.6	Very low	84 Å²	84	108.5 Å²	108.5	52%	0.515	57%	0.567	S	S	.	*	H	α-helix	trans	-58.8	-40.5	173.1	-45.1	0	0	0	0	111.4	L374 E375 E376	T372-L374 VanDerWaalsContact C-N 3.32Å; T372-L374 PolarHBondContact O-N 2.95Å; T372-E375 PolarHBondContact O-N 2.89Å; T372-E376 WeakPolarHBondContact O-CG 3.32Å; T372-E376 PolarHBondContact O-N 2.84Å
373	R	51.3	Low	50.5	Low	169 Å²	169	106 Å²	106	64%	0.638	55%	0.548	S	S	*	.	H	α-helix	trans	-72.9	-25.1	176.3	-165.6	165.7	-176	141.7	2.3	113	A370 E371 L377	A370-R373 PolarHBondContact O-N 2.88Å; E371-R373 VanDerWaalsContact C-N 3.26Å; E371-R373 PolarHBondContact O-N 3.44Å; R373-L377 HydrophobicContact CG-CD1 4.31Å; R373-L377 VanDerWaalsContact O-CB 3.25Å; R373-L377 WeakPolarHBondContact O-CB 3.44Å; R373-L377 WeakPolarHBondContact O-CD1 3.36Å; R373-L377 WeakPolarHBondContact O-CG 3.42Å; R373-L377 PolarHBondContact O-N 2.97Å
374	L	53.2	Low	51.8	Low	107 Å²	107	103.4 Å²	103.4	56%	0.56	53%	0.534	S	S	*	.	H	α-helix	trans	-74.1	-37.2	170.6	-176.1	63.1	0	0	0	110.9	A370 E371 T372 L377 V378	A370-L374 WeakPolarHBondContact O-CB 3.31Å; A370-L374 PolarHBondContact O-N 3.03Å; E371-L374 CarbonylContact O-C 3.53Å; E371-L374 WeakPolarHBondContact O-CA 3.2Å; E371-L374 WeakPolarHBondContact O-CB 3.39Å; E371-L374 PolarHBondContact O-N 3.42Å; T372-L374 VanDerWaalsContact C-N 3.32Å; T372-L374 PolarHBondContact O-N 2.95Å; L374-L377 PolarHBondContact O-N 3.22Å; L374-V378 HydrophobicContact CD1-CG2 4.27Å; L374-V378 HydrophobicContact CG-CG2 4.37Å; L374-V378 WeakPolarHBondContact O-CB 3.26Å; L374-V378 WeakPolarHBondContact O-CG2 3.19Å; L374-V378 PolarHBondContact O-N 2.91Å
375	E	53	Low	53	Low	142 Å²	142	108.1 Å²	108.1	66%	0.664	54%	0.544	S	S	*	.	H	α-helix	trans	-66.6	-43.4	172.6	-70.4	-178.8	145.7	0	0	111.5	E371 T372 V378 Y379	E371-E375 PolarHBondContact O-N 3.12Å; T372-E375 PolarHBondContact O-N 2.89Å; E375-V378 PolarHBondContact O-N 2.96Å; E375-Y379 WeakPolarHBondContact O-CB 3.27Å; E375-Y379 PolarHBondContact O-N 3.05Å
376	E	59.5	Low	55.1	Low	118 Å²	118	103.3 Å²	103.3	55%	0.551	52%	0.524	S	S	*	.	H	α-helix	trans	-56.6	-51.8	169.9	-73.4	171.4	168.8	0	0	111.4	T372 V378 Y379 E380	T372-E376 WeakPolarHBondContact O-CG 3.32Å; T372-E376 PolarHBondContact O-N 2.84Å; E376-V378 VanDerWaalsContact C-N 3.34Å; E376-V378 PolarHBondContact O-N 3.4Å; E376-Y379 PolarHBondContact O-N 2.91Å; E376-E380 WeakPolarHBondContact O-CB 3.2Å; E376-E380 PolarHBondContact O-N 3.47Å
377	L	58.3	Low	57.1	Low	82 Å²	82	103.9 Å²	103.9	43%	0.429	52%	0.524	S	S	.	.	H	α-helix	trans	-66.8	-30.5	178.6	-76.4	168.1	0	0	0	113.1	R373 L374 V381	R373-L377 HydrophobicContact CG-CD1 4.31Å; R373-L377 VanDerWaalsContact O-CB 3.25Å; R373-L377 WeakPolarHBondContact O-CB 3.44Å; R373-L377 WeakPolarHBondContact O-CD1 3.36Å; R373-L377 WeakPolarHBondContact O-CG 3.42Å; R373-L377 PolarHBondContact O-N 2.97Å; L374-L377 PolarHBondContact O-N 3.22Å; L377-V381 WeakPolarHBondContact O-CB 3.39Å; L377-V381 WeakPolarHBondContact O-CG2 3.34Å; L377-V381 PolarHBondContact O-N 3.47Å
378	V	64.9	Low	59	Low	79 Å²	79	104.4 Å²	104.4	48%	0.479	52%	0.52	S	S	.	.	H	α-helix	trans	-72.8	-39.3	174.6	163.3	0	0	0	0	110.4	L374 E375 E376 Q382	L374-V378 HydrophobicContact CD1-CG2 4.27Å; L374-V378 HydrophobicContact CG-CG2 4.37Å; L374-V378 WeakPolarHBondContact O-CB 3.26Å; L374-V378 WeakPolarHBondContact O-CG2 3.19Å; L374-V378 PolarHBondContact O-N 2.91Å; E375-V378 PolarHBondContact O-N 2.96Å; E376-V378 VanDerWaalsContact C-N 3.34Å; E376-V378 PolarHBondContact O-N 3.4Å; V378-Q382 WeakPolarHBondContact O-CB 3.28Å; V378-Q382 PolarHBondContact O-N 2.72Å
379	Y	67.9	Low	60.8	Low	165 Å²	165	105.1 Å²	105.1	65%	0.647	52%	0.521	S	S	*	.	H	α-helix	trans	-67.3	-40.9	173.6	-174.5	-95.1	0	0	0	111.8	E375 E376 Q382 T383	E375-Y379 WeakPolarHBondContact O-CB 3.27Å; E375-Y379 PolarHBondContact O-N 3.05Å; E376-Y379 PolarHBondContact O-N 2.91Å; Y379-Q382 PolarHBondContact O-N 3.21Å; Y379-T383 HydrophobicContact CD1-CG2 4.3Å; Y379-T383 HydrophobicContact CE1-CG2 3.88Å; Y379-T383 HydrophobicContact CE2-CG2 4.46Å; Y379-T383 WeakPolarHBondContact O-CB 3.46Å; Y379-T383 WeakPolarHBondContact O-CG2 3Å; Y379-T383 PolarHBondContact O-N 3.32Å; Y379-T383 PolarHBondContact O-OG1 2.75Å
380	E	70.9	Confident	62.4	Low	108 Å²	108	104.5 Å²	104.5	51%	0.505	51%	0.508	S	S	.	.	H	α-helix	trans	-65	-46.4	173.5	-171.3	172	-139.2	0	0	111.1	E376 Q382 T383 L384	E376-E380 WeakPolarHBondContact O-CB 3.2Å; E376-E380 PolarHBondContact O-N 3.47Å; E380-Q382 VanDerWaalsContact C-N 3.3Å; E380-Q382 PolarHBondContact O-N 3.35Å; E380-T383 WeakPolarHBondContact CA-OG1 3.5Å; E380-T383 PolarHBondContact O-N 2.99Å; E380-T383 PolarHBondContact O-OG1 2.74Å; E380-T383 VanDerWaalsContact O-OG1 3.1Å; E380-L384 HydrophobicContact CG-CD1 4.01Å; E380-L384 WeakPolarHBondContact O-CB 3.46Å; E380-L384 WeakPolarHBondContact O-CG 3.41Å; E380-L384 PolarHBondContact O-N 2.85Å
381	V	69.3	Low	63.9	Low	60 Å²	60	107.7 Å²	107.7	36%	0.364	51%	0.51	S	S	.	.	H	α-helix	trans	-64.3	-32.7	173.4	165.8	0	0	0	0	112.1	L377 R385	L377-V381 WeakPolarHBondContact O-CB 3.39Å; L377-V381 WeakPolarHBondContact O-CG2 3.34Å; L377-V381 PolarHBondContact O-N 3.47Å; V381-R385 HydrophobicContact CG1-CG 4.44Å; V381-R385 VanDerWaalsContact O-CB 3.24Å; V381-R385 WeakPolarHBondContact O-CB 3.37Å; V381-R385 WeakPolarHBondContact O-CD 3.39Å; V381-R385 WeakPolarHBondContact O-CG 3.45Å; V381-R385 PolarHBondContact O-N 3.3Å
382	Q	69	Low	65.2	Low	102 Å²	102	108.2 Å²	108.2	48%	0.477	51%	0.513	S	S	.	.	H	α-helix	trans	-74.2	-45.9	178.2	-177.6	163.7	-20.5	0	0	111.7	V378 Y379 E380 R385 E386	V378-Q382 WeakPolarHBondContact O-CB 3.28Å; V378-Q382 PolarHBondContact O-N 2.72Å; Y379-Q382 PolarHBondContact O-N 3.21Å; E380-Q382 VanDerWaalsContact C-N 3.3Å; E380-Q382 PolarHBondContact O-N 3.35Å; Q382-R385 CarbonylContact O-C 3.56Å; Q382-R385 WeakPolarHBondContact O-CB 3.47Å; Q382-R385 PolarHBondContact O-N 3.47Å; Q382-R385 VanDerWaalsContact O-N 3.14Å; Q382-E386 PolarHBondContact NE2-OE1 2.71Å; Q382-E386 WeakPolarHBondContact O-CG 3.47Å; Q382-E386 PolarHBondContact O-N 3.04Å
383	T	74.3	Confident	66.3	Low	43 Å²	43	111.3 Å²	111.3	26%	0.264	52%	0.519	S	S	.	.	H	α-helix	trans	-64.6	-39.3	173.4	48.9	0	0	0	0	111.7	Y379 E380 R385 E386 L387	Y379-T383 HydrophobicContact CD1-CG2 4.3Å; Y379-T383 HydrophobicContact CE1-CG2 3.88Å; Y379-T383 HydrophobicContact CE2-CG2 4.46Å; Y379-T383 WeakPolarHBondContact O-CB 3.46Å; Y379-T383 WeakPolarHBondContact O-CG2 3Å; Y379-T383 PolarHBondContact O-N 3.32Å; Y379-T383 PolarHBondContact O-OG1 2.75Å; E380-T383 WeakPolarHBondContact CA-OG1 3.5Å; E380-T383 PolarHBondContact O-N 2.99Å; E380-T383 PolarHBondContact O-OG1 2.74Å; E380-T383 VanDerWaalsContact O-OG1 3.1Å; T383-R385 VanDerWaalsContact C-N 3.34Å; T383-R385 PolarHBondContact O-N 3.41Å; T383-E386 PolarHBondContact O-N 3.07Å; T383-L387 WeakPolarHBondContact O-CB 3.19Å; T383-L387 VanDerWaalsContact O-CG 3.31Å; T383-L387 WeakPolarHBondContact O-CG 3.36Å; T383-L387 PolarHBondContact O-N 2.85Å
384	L	68.4	Low	67.1	Low	91 Å²	91	106.2 Å²	106.2	48%	0.476	50%	0.504	S	S	.	.	H	α-helix	trans	-63.1	-36.2	170.2	-73.2	170.3	0	0	0	112.5	E380 L388	E380-L384 HydrophobicContact CG-CD1 4.01Å; E380-L384 WeakPolarHBondContact O-CB 3.46Å; E380-L384 WeakPolarHBondContact O-CG 3.41Å; E380-L384 PolarHBondContact O-N 2.85Å; L384-L388 VanDerWaalsContact O-CB 3.27Å; L384-L388 WeakPolarHBondContact O-CB 3.45Å; L384-L388 WeakPolarHBondContact O-CG 3.24Å; L384-L388 PolarHBondContact O-N 3.42Å
385	R	66.7	Low	67.2	Low	160 Å²	160	106.1 Å²	106.1	60%	0.604	50%	0.502	S	S	*	.	H	α-helix	trans	-70.9	-30.6	173.5	-79.7	167.2	177.1	179.9	0.7	113	V381 Q382 T383 K389	V381-R385 HydrophobicContact CG1-CG 4.44Å; V381-R385 VanDerWaalsContact O-CB 3.24Å; V381-R385 WeakPolarHBondContact O-CB 3.37Å; V381-R385 WeakPolarHBondContact O-CD 3.39Å; V381-R385 WeakPolarHBondContact O-CG 3.45Å; V381-R385 PolarHBondContact O-N 3.3Å; Q382-R385 CarbonylContact O-C 3.56Å; Q382-R385 WeakPolarHBondContact O-CB 3.47Å; Q382-R385 PolarHBondContact O-N 3.47Å; Q382-R385 VanDerWaalsContact O-N 3.14Å; T383-R385 VanDerWaalsContact C-N 3.34Å; T383-R385 PolarHBondContact O-N 3.41Å; R385-K389 WeakPolarHBondContact O-CB 3.46Å; R385-K389 VanDerWaalsContact O-CG 3.27Å; R385-K389 WeakPolarHBondContact O-CG 3.48Å; R385-K389 PolarHBondContact O-N 3.02Å
386	E	77.8	Confident	67.5	Low	100 Å²	100	103.9 Å²	103.9	47%	0.467	49%	0.49	S	S	.	.	H	α-helix	trans	-74.8	-43.6	174.8	-75.1	166.4	-168.7	0	0	110.5	Q382 T383 L388 K389 E390	Q382-E386 PolarHBondContact NE2-OE1 2.71Å; Q382-E386 WeakPolarHBondContact O-CG 3.47Å; Q382-E386 PolarHBondContact O-N 3.04Å; T383-E386 PolarHBondContact O-N 3.07Å; E386-L388 VanDerWaalsContact C-N 3.33Å; E386-L388 PolarHBondContact O-N 3.07Å; E386-K389 CarbonylContact O-C 3.55Å; E386-K389 WeakPolarHBondContact O-CB 3.32Å; E386-K389 PolarHBondContact O-N 3.1Å; E386-K389 VanDerWaalsContact O-N 3.17Å; E386-E390 WeakPolarHBondContact O-CB 3.5Å; E386-E390 PolarHBondContact O-N 3.31Å
387	L	75.4	Confident	67.3	Low	91 Å²	91	103.6 Å²	103.6	48%	0.476	49%	0.489	S	S	.	.	H	α-helix	trans	-61.2	-36.9	169.4	-71.2	167.9	0	0	0	112.6	T383 E390 K391	T383-L387 WeakPolarHBondContact O-CB 3.19Å; T383-L387 VanDerWaalsContact O-CG 3.31Å; T383-L387 WeakPolarHBondContact O-CG 3.36Å; T383-L387 PolarHBondContact O-N 2.85Å; L387-E390 PolarHBondContact O-N 3.3Å; L387-K391 WeakPolarHBondContact O-CB 3.25Å; L387-K391 VanDerWaalsContact O-CG 3.28Å; L387-K391 WeakPolarHBondContact O-CG 3.39Å; L387-K391 PolarHBondContact O-N 3.03Å
388	L	70.2	Confident	66.9	Low	110 Å²	110	105.9 Å²	105.9	58%	0.576	50%	0.499	S	S	*	.	H	α-helix	trans	-68.6	-38.7	172.7	-79.7	166.9	0	0	0	112.1	L384 E386 E390 K391 E392	L384-L388 VanDerWaalsContact O-CB 3.27Å; L384-L388 WeakPolarHBondContact O-CB 3.45Å; L384-L388 WeakPolarHBondContact O-CG 3.24Å; L384-L388 PolarHBondContact O-N 3.42Å; E386-L388 VanDerWaalsContact C-N 3.33Å; E386-L388 PolarHBondContact O-N 3.07Å; L388-E390 VanDerWaalsContact C-N 3.31Å; L388-K391 PolarHBondContact O-N 3.27Å; L388-E392 WeakPolarHBondContact O-CB 3.29Å; L388-E392 WeakPolarHBondContact O-CG 3.45Å; L388-E392 PolarHBondContact O-N 3.11Å
389	K	69.9	Low	66.2	Low	138 Å²	138	107.7 Å²	107.7	60%	0.6	50%	0.502	S	S	*	.	H	α-helix	trans	-66.6	-33.1	172.3	-77.6	169.6	-178.8	174.3	0	112.5	R385 E386 K393	R385-K389 WeakPolarHBondContact O-CB 3.46Å; R385-K389 VanDerWaalsContact O-CG 3.27Å; R385-K389 WeakPolarHBondContact O-CG 3.48Å; R385-K389 PolarHBondContact O-N 3.02Å; E386-K389 CarbonylContact O-C 3.55Å; E386-K389 WeakPolarHBondContact O-CB 3.32Å; E386-K389 PolarHBondContact O-N 3.1Å; E386-K389 VanDerWaalsContact O-N 3.17Å; K389-K393 PolarHBondContact O-N 3.04Å
390	E	74.4	Confident	65.3	Low	108 Å²	108	107.5 Å²	107.5	51%	0.505	50%	0.5	S	S	.	.	H	α-helix	trans	-70.7	-46	174.1	-167.7	163.7	-122.1	0	0	110.5	E386 L387 L388 E392 K393 D394	E386-E390 WeakPolarHBondContact O-CB 3.5Å; E386-E390 PolarHBondContact O-N 3.31Å; L387-E390 PolarHBondContact O-N 3.3Å; L388-E390 VanDerWaalsContact C-N 3.31Å; E390-E392 VanDerWaalsContact C-N 3.32Å; E390-E392 PolarHBondContact O-N 3.22Å; E390-K393 CarbonylContact O-C 3.36Å; E390-K393 WeakPolarHBondContact O-CA 3.47Å; E390-K393 VanDerWaalsContact O-CB 3.31Å; E390-K393 WeakPolarHBondContact O-CB 3.46Å; E390-K393 PolarHBondContact O-N 3.01Å; E390-D394 VanDerWaalsContact O-CG 3.26Å; E390-D394 PolarHBondContact O-N 3.47Å
391	K	67.3	Low	64.3	Low	127 Å²	127	110 Å²	110	55%	0.552	51%	0.512	S	S	*	.	H	α-helix	trans	-64.9	-31.9	172.4	-68.7	-74.1	157.1	-117.7	0	113.2	L387 L388 D394 M395	L387-K391 WeakPolarHBondContact O-CB 3.25Å; L387-K391 VanDerWaalsContact O-CG 3.28Å; L387-K391 WeakPolarHBondContact O-CG 3.39Å; L387-K391 PolarHBondContact O-N 3.03Å; L388-K391 PolarHBondContact O-N 3.27Å; K391-D394 IonicContact NZ-OD2 3.85Å; K391-D394 PolarHBondContact NZ-OD2 3.1Å; K391-M395 WeakPolarHBondContact O-CB 3.35Å; K391-M395 PolarHBondContact O-N 2.93Å
392	E	64.8	Low	63.3	Low	89 Å²	89	115.9 Å²	115.9	42%	0.416	53%	0.533	S	S	.	.	H	α-helix	trans	-66.8	-36.8	168.5	-86.2	-169.8	-140.5	0	0	112.3	L388 E390 M395 K396	L388-E392 WeakPolarHBondContact O-CB 3.29Å; L388-E392 WeakPolarHBondContact O-CG 3.45Å; L388-E392 PolarHBondContact O-N 3.11Å; E390-E392 VanDerWaalsContact C-N 3.32Å; E390-E392 PolarHBondContact O-N 3.22Å; E392-M395 HydrophobicContact CG-CE 4.4Å; E392-K396 VanDerWaalsContact O-CB 3.27Å; E392-K396 WeakPolarHBondContact O-CB 3.38Å; E392-K396 VanDerWaalsContact O-CD 3.25Å; E392-K396 WeakPolarHBondContact O-CD 3.48Å; E392-K396 WeakPolarHBondContact O-CG 3.45Å; E392-K396 PolarHBondContact O-N 3.44Å; E392-K396 IonicContact OE2-NZ 2.7Å; E392-K396 PolarHBondContact OE2-NZ 3.26Å
393	K	66.8	Low	62.2	Low	149 Å²	149	116.2 Å²	116.2	65%	0.648	54%	0.542	S	S	*	.	H	α-helix	trans	-64.6	-53.3	171.2	-83.3	180	173.6	-177.9	0	110.3	K389 E390 M395 K396 E397	K389-K393 PolarHBondContact O-N 3.04Å; E390-K393 CarbonylContact O-C 3.36Å; E390-K393 WeakPolarHBondContact O-CA 3.47Å; E390-K393 VanDerWaalsContact O-CB 3.31Å; E390-K393 WeakPolarHBondContact O-CB 3.46Å; E390-K393 PolarHBondContact O-N 3.01Å; K393-M395 PolarHBondContact O-N 2.75Å; K393-K396 CarbonylContact O-C 3.56Å; K393-K396 PolarHBondContact O-N 2.93Å; K393-E397 VanDerWaalsContact O-CB 3.27Å; K393-E397 WeakPolarHBondContact O-CB 3.25Å; K393-E397 PolarHBondContact O-N 3.42Å
394	D	66.8	Low	60.6	Low	61 Å²	61	125.6 Å²	125.6	33%	0.326	57%	0.572	S	S	.	*	H	α-helix	trans	-51	-45.9	177.4	-61.7	-17.8	0	0	0	111.2	E390 K391 E397 M398	E390-D394 VanDerWaalsContact O-CG 3.26Å; E390-D394 PolarHBondContact O-N 3.47Å; K391-D394 IonicContact NZ-OD2 3.85Å; K391-D394 PolarHBondContact NZ-OD2 3.1Å; D394-E397 PolarHBondContact O-N 3.09Å; D394-M398 VanDerWaalsContact O-CB 3.25Å; D394-M398 WeakPolarHBondContact O-CB 3.43Å; D394-M398 PolarHBondContact O-N 2.98Å
395	M	55.8	Low	59.1	Low	106 Å²	106	124.8 Å²	124.8	52%	0.522	59%	0.586	S	S	.	*	H	α-helix	trans	-65.9	-44.8	178.6	-175.9	162.9	55.2	0	0	112	K391 E392 K393 E397 M398 E399	K391-M395 WeakPolarHBondContact O-CB 3.35Å; K391-M395 PolarHBondContact O-N 2.93Å; E392-M395 HydrophobicContact CG-CE 4.4Å; K393-M395 PolarHBondContact O-N 2.75Å; M395-E397 VanDerWaalsContact C-N 3.31Å; M395-E397 PolarHBondContact O-N 3.16Å; M395-M398 PolarHBondContact O-N 3.44Å; M395-E399 WeakPolarHBondContact O-CB 3.28Å; M395-E399 WeakPolarHBondContact O-CG 3.39Å; M395-E399 PolarHBondContact O-N 3.42Å
396	K	59.8	Low	57.4	Low	94 Å²	94	120.9 Å²	120.9	41%	0.409	60%	0.596	S	S	.	*	H	α-helix	trans	-70.6	-24.7	176.5	-71.1	162.4	-172.2	166.7	0	112.9	E392 K393 R400	E392-K396 VanDerWaalsContact O-CB 3.27Å; E392-K396 WeakPolarHBondContact O-CB 3.38Å; E392-K396 VanDerWaalsContact O-CD 3.25Å; E392-K396 WeakPolarHBondContact O-CD 3.48Å; E392-K396 WeakPolarHBondContact O-CG 3.45Å; E392-K396 PolarHBondContact O-N 3.44Å; E392-K396 IonicContact OE2-NZ 2.7Å; E392-K396 PolarHBondContact OE2-NZ 3.26Å; K393-K396 CarbonylContact O-C 3.56Å; K393-K396 PolarHBondContact O-N 2.93Å; K396-R400 VanDerWaalsContact O-CD 3.24Å; K396-R400 WeakPolarHBondContact O-CD 3.25Å; K396-R400 WeakPolarHBondContact O-CG 3.44Å; K396-R400 PolarHBondContact O-N 3.41Å; K396-R400 VanDerWaalsContact O-N 3.15Å
397	E	54.9	Low	55.2	Low	112 Å²	112	120 Å²	120	52%	0.523	61%	0.613	S	S	.	*	H	α-helix	trans	-77.9	-43.4	174.9	-157.8	124.2	-104.4	0	0	110.1	K393 D394 M395 E399 R400 E401	K393-E397 VanDerWaalsContact O-CB 3.27Å; K393-E397 WeakPolarHBondContact O-CB 3.25Å; K393-E397 PolarHBondContact O-N 3.42Å; D394-E397 PolarHBondContact O-N 3.09Å; M395-E397 VanDerWaalsContact C-N 3.31Å; M395-E397 PolarHBondContact O-N 3.16Å; E397-E399 VanDerWaalsContact C-N 3.33Å; E397-E399 PolarHBondContact O-N 3.28Å; E397-R400 WeakPolarHBondContact O-CA 3.34Å; E397-R400 WeakPolarHBondContact O-CB 3.48Å; E397-R400 PolarHBondContact O-N 3.47Å; E397-E401 PolarHBondContact O-N 3.45Å
398	M	48.8	Very low	53.2	Low	130 Å²	130	119.4 Å²	119.4	64%	0.64	63%	0.63	S	S	*	*	H	α-helix	trans	-61	-37.6	170.4	-165.3	-170.4	-53.6	0	0	112.2	D394 M395 K402	D394-M398 VanDerWaalsContact O-CB 3.25Å; D394-M398 WeakPolarHBondContact O-CB 3.43Å; D394-M398 PolarHBondContact O-N 2.98Å; M395-M398 PolarHBondContact O-N 3.44Å; M398-K402 WeakPolarHBondContact O-CB 3.47Å; M398-K402 PolarHBondContact O-N 3.45Å; M398-K402 VanDerWaalsContact O-N 3.09Å
399	E	51.2	Low	51.3	Low	117 Å²	117	122.3 Å²	122.3	55%	0.547	65%	0.646	S	S	.	*	H	α-helix	trans	-67.3	-33.2	171.4	-75.7	178.6	151.1	0	0	113.1	M395 E397 K402 T403	M395-E399 WeakPolarHBondContact O-CB 3.28Å; M395-E399 WeakPolarHBondContact O-CG 3.39Å; M395-E399 PolarHBondContact O-N 3.42Å; E397-E399 VanDerWaalsContact C-N 3.33Å; E397-E399 PolarHBondContact O-N 3.28Å; E399-K402 PolarHBondContact O-N 3.47Å; E399-T403 PolarHBondContact O-N 2.88Å; E399-T403 PolarHBondContact O-OG1 3.44Å
400	R	49	Very low	49.5	Very low	162 Å²	162	118.6 Å²	118.6	61%	0.611	65%	0.647	S	S	*	*	H	α-helix	trans	-72.1	-37.3	175.5	-76.2	162.1	-178.6	175.8	-1	112.7	K396 E397 K402 T403	K396-R400 VanDerWaalsContact O-CD 3.24Å; K396-R400 WeakPolarHBondContact O-CD 3.25Å; K396-R400 WeakPolarHBondContact O-CG 3.44Å; K396-R400 PolarHBondContact O-N 3.41Å; K396-R400 VanDerWaalsContact O-N 3.15Å; E397-R400 WeakPolarHBondContact O-CA 3.34Å; E397-R400 WeakPolarHBondContact O-CB 3.48Å; E397-R400 PolarHBondContact O-N 3.47Å; R400-K402 VanDerWaalsContact C-N 3.29Å; R400-T403 WeakPolarHBondContact CA-OG1 3.16Å; R400-T403 PolarHBondContact O-N 3.02Å; R400-T403 PolarHBondContact O-OG1 3.29Å
401	E	49.2	Very low	47.3	Very low	159 Å²	159	121.7 Å²	121.7	74%	0.743	67%	0.667	S	S	*	*	H	α-helix	trans	-65.1	-37.1	169.9	-68.9	-163.3	123.8	0	0	111.2	E397 T403	E397-E401 PolarHBondContact O-N 3.45Å; E401-T403 PolarHBondContact O-N 3.23Å
402	K	48.7	Very low	45.5	Very low	185 Å²	185	118.7 Å²	118.7	80%	0.804	67%	0.672	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.3	-11	178	-150.1	172	-171.1	177.2	0	114.9	M398 E399 R400	M398-K402 WeakPolarHBondContact O-CB 3.47Å; M398-K402 PolarHBondContact O-N 3.45Å; M398-K402 VanDerWaalsContact O-N 3.09Å; E399-K402 PolarHBondContact O-N 3.47Å; R400-K402 VanDerWaalsContact C-N 3.29Å
403	T	45.2	Very low	43.9	Very low	109 Å²	109	122.9 Å²	122.9	67%	0.669	69%	0.689	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109.8	0.9	-179.4	40.7	0	0	0	0	114.5	E399 R400 E401 G405	E399-T403 PolarHBondContact O-N 2.88Å; E399-T403 PolarHBondContact O-OG1 3.44Å; R400-T403 WeakPolarHBondContact CA-OG1 3.16Å; R400-T403 PolarHBondContact O-N 3.02Å; R400-T403 PolarHBondContact O-OG1 3.29Å; E401-T403 PolarHBondContact O-N 3.23Å; T403-G405 PolarHBondContact O-N 2.98Å
404	R	41.6	Very low	42.2	Very low	239 Å²	239	124 Å²	124	90%	0.902	69%	0.693	S	S	*	*			trans	-80.8	66.8	170.3	-89.1	-176.7	152.2	178.2	-6.5	112.2
405	G	36.2	Very low	40.5	Very low	74 Å²	74	129.6 Å²	129.6	76%	0.763	72%	0.718	S	S	*	*	S	Bend	trans	-133.2	20.9	-174.6	0	0	0	0	0	116.4	T403	T403-G405 PolarHBondContact O-N 2.98Å
406	G	32.2	Very low	40.6	Very low	79 Å²	79	129.7 Å²	129.7	81%	0.814	73%	0.726	S	S	*	*			trans	83.8	155	-178	0	0	0	0	0	114.4
407	G	31.9	Very low	39	Very low	80 Å²	80	130.9 Å²	130.9	83%	0.825	75%	0.747	S	S	*	*			cis	169.3	129.3	-8.9	0	0	0	0	0	113.3
408	G	31.8	Very low	37.8	Very low	80 Å²	80	133.5 Å²	133.5	83%	0.825	76%	0.759	S	S	*	*			trans	77.8	162.1	176.1	0	0	0	0	0	115.8
409	D	31.8	Very low	36.8	Very low	171 Å²	171	133.5 Å²	133.5	91%	0.914	76%	0.76	S	S	*	*			cis	-163.3	166	-18	-149.5	-13.5	0	0	0	110.9
410	G	31.2	Very low	35.7	Very low	60 Å²	60	134.7 Å²	134.7	62%	0.619	78%	0.776	S	S	*	*			trans	87	123.1	177.5	0	0	0	0	0	115
411	D	29.1	Very low	35.2	Very low	173 Å²	173	131.9 Å²	131.9	93%	0.925	79%	0.787	S	S	*	*				83.1	125.4	56.4	-165.6	54.1	0	0	0	113.4
412	G	29.6	Very low	34.1	Very low	64 Å²	64	129.4 Å²	129.4	66%	0.66	79%	0.787	S	S	*	*			cis	-178.5	179.8	-4.8	0	0	0	0	0	115.5
413	F	30.2	Very low	33.1	Very low	176 Å²	176	126.5 Å²	126.5	77%	0.772	79%	0.785	S	S	*	*			trans	66.4	112	160.5	-100.5	-137.9	0	0	0	123.9
414	K	31.8	Very low	32.6	Very low	172 Å²	172	128.4 Å²	128.4	75%	0.748	79%	0.79	S	S	*	*				71.9	107.6	128.9	-67.7	-171.2	-178.4	176.6	0	124.3
415	Q	29.8	Very low	32.3	Very low	180 Å²	180	123.4 Å²	123.4	84%	0.841	78%	0.782	S	S	*	*			trans	-65.5	-174.8	136.8	-95.1	-173.3	10.3	0	0	113.3
416	P	58.9	Low	32.3	Very low	108 Å²	108	129.7 Å²	129.7	70%	0.701	79%	0.788	S	S	*	*			cis	-141.3	164.4	-33.7	36.7	-19.6	0	0	0	115.8
417	S	26.6	Very low	32.9	Very low	119 Å²	119	135.1 Å²	135.1	83%	0.832	78%	0.784	S	S	*	*			trans	179.7	161.2	153.1	51.8	0	0	0	0	110
418	Q	28.4	Very low	33.4	Very low	167 Å²	167	135.7 Å²	135.7	78%	0.78	77%	0.773	S	S	*	*			cis	179.7	155.8	-36.3	-138.4	-171.2	3.3	0	0	105.6
419	I	29	Very low	34.2	Very low	129 Å²	129	136.7 Å²	136.7	66%	0.662	76%	0.759	S	S	*	*			trans	82.9	124.2	147.7	-75.4	167.3	0	0	0	122.7
420	T	26.9	Very low	35.1	Very low	143 Å²	143	132.8 Å²	132.8	88%	0.877	74%	0.736	S	S	*	*			trans	69.6	159.3	156.7	47.8	0	0	0	0	122.9
421	A	38.7	Very low	36.2	Very low	102 Å²	102	134.7 Å²	134.7	84%	0.843	73%	0.732	S	S	*	*			trans	-125.4	157	-170.8	0	0	0	0	0	112.5
422	S	25.4	Very low	37.6	Very low	108 Å²	108	128.3 Å²	128.3	76%	0.755	70%	0.699	S	S	*	*			trans	-156.9	117.2	166.3	56.7	0	0	0	0	113.9
423	T	28.9	Very low	38.9	Very low	123 Å²	123	126.6 Å²	126.6	76%	0.755	68%	0.678	S	S	*	*			trans	27	127	141.5	52.2	0	0	0	0	123.7
424	L	34.8	Very low	40.7	Very low	149 Å²	149	120.9 Å²	120.9	78%	0.78	66%	0.664	S	S	*	*			trans	78.8	137	137.8	-90.2	84.4	0	0	0	123.8
425	D	35.9	Very low	42.5	Very low	135 Å²	135	116.9 Å²	116.9	72%	0.722	65%	0.648	S	S	*	*			trans	52.1	100.1	147.9	-66.4	4.4	0	0	0	122.6
426	K	35.8	Very low	44.3	Very low	206 Å²	206	108.7 Å²	108.7	90%	0.896	61%	0.609	S	S	*	*				-161	122.8	100.9	-97.7	154.4	-173.9	175.9	0	111.1
427	R	43.3	Very low	45	Very low	192 Å²	192	107 Å²	107	73%	0.725	59%	0.594	S	S	*	*			trans	-145	123.2	171	-74.2	-172.8	-178.9	-180	-1.2	111.6
428	P	43	Very low	47.3	Very low	93 Å²	93	107.6 Å²	107.6	60%	0.604	58%	0.582	S	S	*	*	S	Bend	trans	-121.8	-18	152	30.1	-17.8	0	0	0	113.3
429	N	48.3	Very low	49.6	Very low	100 Å²	100	100 Å²	100	54%	0.535	55%	0.546	S	S	.	.	S	Bend	trans	-95	1.8	-163.4	-69.6	5.3	0	0	0	115.9
430	Q	50.9	Low	51.7	Low	90 Å²	90	94.8 Å²	94.8	42%	0.421	52%	0.523	S	S	.	.	S	Bend	trans	-92.6	-26.2	176.9	-77.9	-167.3	-19.6	0	0	113.9	T432 A433 A434	Q430-T432 PolarHBondContact O-N 3.2Å; Q430-A433 PolarHBondContact O-N 3.49Å; Q430-A434 PolarHBondContact O-N 3.08Å
431	D	55.5	Low	53.9	Low	99 Å²	99	94.4 Å²	94.4	53%	0.529	51%	0.509	S	S	.	.	H	α-helix	trans	-72.9	-31.9	-173.4	-59.1	-33.1	0	0	0	112.3	A434 Q435	D431-A434 WeakPolarHBondContact O-CB 3.36Å; D431-A434 PolarHBondContact O-N 3.48Å; D431-Q435 VanDerWaalsContact O-CG 3.24Å; D431-Q435 WeakPolarHBondContact O-CG 3.42Å; D431-Q435 PolarHBondContact O-N 3.33Å
432	T	56.9	Low	55.8	Low	39 Å²	39	91 Å²	91	24%	0.239	48%	0.476	C	S	.	.	H	α-helix	trans	-64.4	-41.6	175.5	54.5	0	0	0	0	112.1	Q430 A434 Q435 Y436	Q430-T432 PolarHBondContact O-N 3.2Å; T432-A434 VanDerWaalsContact C-N 3.33Å; T432-A434 PolarHBondContact O-N 2.83Å; T432-Q435 PolarHBondContact O-N 3.39Å; T432-Y436 WeakPolarHBondContact O-CD2 3.41Å; T432-Y436 PolarHBondContact O-N 3.43Å; T432-Y436 VanDerWaalsContact O-N 3.11Å
433	A	58.8	Low	58.2	Low	28 Å²	28	85.9 Å²	85.9	23%	0.231	44%	0.44	C	S	.	.	H	α-helix	trans	-64.8	-37.8	174.7	0	0	0	0	0	111.9	Q430 L437	Q430-A433 PolarHBondContact O-N 3.49Å; A433-L437 WeakPolarHBondContact O-CB 3.24Å; A433-L437 PolarHBondContact O-N 2.84Å; A433-L437 VanDerWaalsContact O-N 3.11Å
434	A	66.3	Low	60.3	Low	57 Å²	57	82.7 Å²	82.7	47%	0.471	43%	0.426	S	S	.	.	H	α-helix	trans	-65.7	-39.3	174.3	0	0	0	0	0	112.4	Q430 D431 T432 L437 F438	Q430-A434 PolarHBondContact O-N 3.08Å; D431-A434 WeakPolarHBondContact O-CB 3.36Å; D431-A434 PolarHBondContact O-N 3.48Å; T432-A434 VanDerWaalsContact C-N 3.33Å; T432-A434 PolarHBondContact O-N 2.83Å; A434-L437 PolarHBondContact O-N 3.33Å; A434-F438 WeakPolarHBondContact O-CB 3.38Å; A434-F438 PolarHBondContact O-N 2.77Å
435	Q	69.5	Low	62.3	Low	87 Å²	87	77.7 Å²	77.7	41%	0.407	40%	0.404	S	S	.	.	H	α-helix	trans	-64	-47.3	177.1	-72	163.3	21.1	0	0	112.3	D431 T432 L437 F438 L439	D431-Q435 VanDerWaalsContact O-CG 3.24Å; D431-Q435 WeakPolarHBondContact O-CG 3.42Å; D431-Q435 PolarHBondContact O-N 3.33Å; T432-Q435 PolarHBondContact O-N 3.39Å; Q435-L437 VanDerWaalsContact C-N 3.34Å; Q435-L437 PolarHBondContact O-N 2.91Å; Q435-F438 PolarHBondContact O-N 3.24Å; Q435-L439 PolarHBondContact O-N 3.35Å
436	Y	69.4	Low	64.2	Low	8 Å²	8	71.3 Å²	71.3	3%	0.031	37%	0.369	C	S	.	.	H	α-helix	trans	-62.8	-39.5	175.1	-71.6	-62.2	0	0	0	112.2	T432 F438 L439 A440 V473 H477 R501 L504	T432-Y436 WeakPolarHBondContact O-CD2 3.41Å; T432-Y436 PolarHBondContact O-N 3.43Å; T432-Y436 VanDerWaalsContact O-N 3.11Å; Y436-F438 VanDerWaalsContact C-N 3.33Å; Y436-F438 PolarHBondContact O-N 2.98Å; Y436-L439 PolarHBondContact O-N 2.76Å; Y436-A440 WeakPolarHBondContact O-CB 3.48Å; Y436-A440 PolarHBondContact O-N 3.03Å; Y436-V473 HydrophobicContact CD1-CG1 4.25Å; Y436-V473 HydrophobicContact CE1-CG1 3.64Å; Y436-V473 HydrophobicContact CE2-CG1 4.4Å; Y436-H477 PolarHBondContact OH-CD2 3.49Å; Y436-R501 HydrophobicContact CD1-CG 4.37Å; Y436-R501 HydrophobicContact CE1-CG 4.17Å; Y436-R501 HydrophobicContact CE2-CG 4.46Å; Y436-R501 PolarHBondContact OH-NE 3.42Å; Y436-R501 PolarHBondContact OH-NH2 2.72Å; Y436-L504 HydrophobicContact CD1-CD2 3.8Å; Y436-L504 HydrophobicContact CE1-CD2 4.34Å
437	L	72.2	Confident	65.9	Low	74 Å²	74	63.5 Å²	63.5	39%	0.387	34%	0.337	S	S	.	.	H	α-helix	trans	-65.5	-34.4	175.9	-172.4	69	0	0	0	112.6	A433 A434 Q435 K441 L500	A433-L437 WeakPolarHBondContact O-CB 3.24Å; A433-L437 PolarHBondContact O-N 2.84Å; A433-L437 VanDerWaalsContact O-N 3.11Å; A434-L437 PolarHBondContact O-N 3.33Å; Q435-L437 VanDerWaalsContact C-N 3.34Å; Q435-L437 PolarHBondContact O-N 2.91Å; L437-K441 VanDerWaalsContact O-CG 3.32Å; L437-K441 WeakPolarHBondContact O-CG 2.8Å; L437-K441 PolarHBondContact O-N 3.45Å; L437-L500 HydrophobicContact CD1-CD2 4.11Å
438	F	75.4	Confident	67.3	Low	130 Å²	130	57 Å²	57	57%	0.57	32%	0.324	S	S	*	.	H	α-helix	trans	-67.7	-50.1	174.2	-175.3	-87.4	0	0	0	111.2	A434 Q435 Y436 A440 K441 E442	A434-F438 WeakPolarHBondContact O-CB 3.38Å; A434-F438 PolarHBondContact O-N 2.77Å; Q435-F438 PolarHBondContact O-N 3.24Å; Y436-F438 VanDerWaalsContact C-N 3.33Å; Y436-F438 PolarHBondContact O-N 2.98Å; F438-A440 VanDerWaalsContact C-N 3.3Å; F438-A440 PolarHBondContact O-N 3.29Å; F438-K441 PolarHBondContact O-N 3.21Å; F438-K441 VanDerWaalsContact O-N 3.12Å; F438-E442 PolarHBondContact O-N 3.4Å
439	L	76.7	Confident	68.6	Low	7 Å²	7	54.9 Å²	54.9	4%	0.037	31%	0.308	C	S	.	.	H	α-helix	trans	-60.3	-38.1	178.8	-72.1	172.3	0	0	0	112.4	Q435 Y436 E442 A443 W466 R469 L470 V473 L504	Q435-L439 PolarHBondContact O-N 3.35Å; Y436-L439 PolarHBondContact O-N 2.76Å; L439-E442 PolarHBondContact O-N 2.59Å; L439-A443 WeakPolarHBondContact O-CB 3.5Å; L439-A443 PolarHBondContact O-N 2.96Å; L439-W466 PolarHBondContact O-NE1 2.96Å; L439-R469 HydrophobicContact CD2-CB 4.07Å; L439-L470 HydrophobicContact CD1-CD1 4.25Å; L439-V473 HydrophobicContact CD1-CB 4.24Å; L439-V473 HydrophobicContact CD1-CG1 4.45Å; L439-V473 HydrophobicContact CD1-CG2 4.07Å; L439-L504 HydrophobicContact CB-CD1 4.07Å
440	A	72.3	Confident	69.1	Low	21 Å²	21	51.9 Å²	51.9	17%	0.174	29%	0.291	C	S	.	.	H	α-helix	trans	-65.9	-39	175.1	0	0	0	0	0	112.7	Y436 F438 A443 A444 L504	Y436-A440 WeakPolarHBondContact O-CB 3.48Å; Y436-A440 PolarHBondContact O-N 3.03Å; F438-A440 VanDerWaalsContact C-N 3.3Å; F438-A440 PolarHBondContact O-N 3.29Å; A440-A443 PolarHBondContact O-N 2.78Å; A440-A444 WeakPolarHBondContact O-CB 3.38Å; A440-A444 PolarHBondContact O-N 3.36Å; A440-L504 HydrophobicContact CB-CD1 4.13Å
441	K	74.9	Confident	69.7	Low	135 Å²	135	52.3 Å²	52.3	59%	0.587	31%	0.305	S	S	*	.	H	α-helix	trans	-68.3	-40	174.3	-74.4	172.6	179.3	178.9	0	112.2	L437 F438 A444 S445	L437-K441 VanDerWaalsContact O-CG 3.32Å; L437-K441 WeakPolarHBondContact O-CG 2.8Å; L437-K441 PolarHBondContact O-N 3.45Å; F438-K441 PolarHBondContact O-N 3.21Å; F438-K441 VanDerWaalsContact O-N 3.12Å; K441-A444 PolarHBondContact O-N 3.42Å; K441-S445 PolarHBondContact O-N 3.42Å
442	E	77.6	Confident	70	Confident	31 Å²	31	53.6 Å²	53.6	15%	0.145	31%	0.305	C	S	.	.	H	α-helix	trans	-64.4	-42.8	175.4	-168.2	166.1	-145.6	0	0	110.5	F438 L439 A444 S445 L446 R469	F438-E442 PolarHBondContact O-N 3.4Å; L439-E442 PolarHBondContact O-N 2.59Å; E442-A444 PolarHBondContact O-N 2.85Å; E442-S445 WeakPolarHBondContact O-CB 3.35Å; E442-S445 PolarHBondContact O-N 3.21Å; E442-S445 VanDerWaalsContact O-N 3.13Å; E442-S445 PolarHBondContact O-OG 2.77Å; E442-L446 WeakPolarHBondContact O-CG 3.49Å; E442-L446 PolarHBondContact O-N 3.38Å; E442-R469 IonicContact OE1-NH1 2.76Å; E442-R469 PolarHBondContact OE1-NH1 3.27Å; E442-R469 IonicContact OE2-NH1 3.48Å; E442-R469 PolarHBondContact OE2-NH1 2.99Å
443	A	74.8	Confident	69.4	Low	0 Å²	0	55.9 Å²	55.9	0%	0	33%	0.329	C	S	.	.	H	α-helix	trans	-59	-45.7	173.7	0	0	0	0	0	113	L439 A440 S445 L446 L447 W466 C507	L439-A443 WeakPolarHBondContact O-CB 3.5Å; L439-A443 PolarHBondContact O-N 2.96Å; A440-A443 PolarHBondContact O-N 2.78Å; A443-S445 VanDerWaalsContact C-N 3.28Å; A443-S445 PolarHBondContact O-N 2.95Å; A443-L446 PolarHBondContact O-N 3.11Å; A443-L447 WeakPolarHBondContact O-CG 3.46Å; A443-L447 PolarHBondContact O-N 2.88Å; A443-W466 HydrophobicContact CB-CH2 4.26Å; A443-W466 HydrophobicContact CB-CZ2 3.53Å; A443-C507 HydrophobicContact CB-CB 4.31Å
444	A	73.2	Confident	69.3	Low	56 Å²	56	63 Å²	63	46%	0.463	36%	0.355	S	S	.	.	H	α-helix	trans	-60.9	-36.8	175.2	0	0	0	0	0	112.2	A440 K441 E442 A448	A440-A444 WeakPolarHBondContact O-CB 3.38Å; A440-A444 PolarHBondContact O-N 3.36Å; K441-A444 PolarHBondContact O-N 3.42Å; E442-A444 PolarHBondContact O-N 2.85Å; A444-A448 WeakPolarHBondContact O-CB 3.2Å; A444-A448 PolarHBondContact O-N 3.28Å
445	S	77.4	Confident	69	Low	44 Å²	44	61.8 Å²	61.8	31%	0.308	34%	0.342	S	S	.	.	H	α-helix	trans	-67	-39.4	174.5	83	0	0	0	0	112.6	K441 E442 A443 A448 D449	K441-S445 PolarHBondContact O-N 3.42Å; E442-S445 WeakPolarHBondContact O-CB 3.35Å; E442-S445 PolarHBondContact O-N 3.21Å; E442-S445 VanDerWaalsContact O-N 3.13Å; E442-S445 PolarHBondContact O-OG 2.77Å; A443-S445 VanDerWaalsContact C-N 3.28Å; A443-S445 PolarHBondContact O-N 2.95Å; S445-A448 PolarHBondContact O-N 2.68Å; S445-D449 PolarHBondContact O-N 3.25Å
446	L	75.4	Confident	68.6	Low	0 Å²	0	60.7 Å²	60.7	0%	0	34%	0.344	C	S	.	.	H	α-helix	trans	-67.5	-41.2	176.7	-68.5	170	0	0	0	111.4	E442 A443 A448 D449 M450 F459 R462 L463 W466	E442-L446 WeakPolarHBondContact O-CG 3.49Å; E442-L446 PolarHBondContact O-N 3.38Å; A443-L446 PolarHBondContact O-N 3.11Å; L446-A448 VanDerWaalsContact C-N 3.3Å; L446-A448 PolarHBondContact O-N 2.94Å; L446-D449 PolarHBondContact O-N 3.24Å; L446-M450 WeakPolarHBondContact O-CG 3.43Å; L446-M450 PolarHBondContact O-N 2.84Å; L446-F459 HydrophobicContact CB-CE2 4.02Å; L446-F459 HydrophobicContact CD2-CD2 4.05Å; L446-F459 HydrophobicContact CD2-CE2 3.63Å; L446-F459 HydrophobicContact CD2-CZ 4.49Å; L446-F459 HydrophobicContact CG-CE2 4.44Å; L446-R462 HydrophobicContact CD2-CB 4.11Å; L446-L463 HydrophobicContact CD1-CD1 4.42Å; L446-W466 HydrophobicContact CD1-CB 3.9Å; L446-W466 HydrophobicContact CD1-CD2 4.31Å; L446-W466 HydrophobicContact CD1-CG 3.92Å
447	L	71.8	Confident	68.5	Low	42 Å²	42	66 Å²	66	22%	0.22	38%	0.376	C	S	.	.	H	α-helix	trans	-61.7	-36.6	173.2	-76.6	164.8	0	0	0	112.4	A443 M450 C507 L511 K514	A443-L447 WeakPolarHBondContact O-CG 3.46Å; A443-L447 PolarHBondContact O-N 2.88Å; L447-M450 HydrophobicContact CD2-CE 3.89Å; L447-C507 HydrophobicContact CD1-CB 4.47Å; L447-L511 HydrophobicContact CD2-CD1 4.48Å; L447-L511 HydrophobicContact CD2-CG 3.96Å; L447-L511 HydrophobicContact CG-CD1 4.19Å; L447-L511 HydrophobicContact CG-CG 4.21Å; L447-K514 HydrophobicContact CD2-CD 4.45Å
448	A	74.1	Confident	68.3	Low	55 Å²	55	68.1 Å²	68.1	46%	0.455	39%	0.388	S	S	.	.	H	α-helix	trans	-71.8	-41	174.5	0	0	0	0	0	112.3	A444 S445 L446 M450 S451	A444-A448 WeakPolarHBondContact O-CB 3.2Å; A444-A448 PolarHBondContact O-N 3.28Å; S445-A448 PolarHBondContact O-N 2.68Å; L446-A448 VanDerWaalsContact C-N 3.3Å; L446-A448 PolarHBondContact O-N 2.94Å; A448-M450 VanDerWaalsContact C-N 3.32Å; A448-M450 PolarHBondContact O-N 2.51Å; A448-S451 WeakPolarHBondContact O-CB 3.35Å; A448-S451 PolarHBondContact O-N 2.76Å; A448-S451 VanDerWaalsContact O-N 3.14Å; A448-S451 PolarHBondContact O-OG 2.81Å
449	D	68.5	Low	68.3	Low	49 Å²	49	62.5 Å²	62.5	26%	0.262	36%	0.363	S	S	.	.	H	α-helix	trans	-64.2	-35.5	175.8	-84.9	-23.7	0	0	0	112	S445 L446 S451 K452 F459 R462	S445-D449 PolarHBondContact O-N 3.25Å; L446-D449 PolarHBondContact O-N 3.24Å; D449-S451 PolarHBondContact O-N 3.16Å; D449-K452 WeakPolarHBondContact O-CB 3.45Å; D449-K452 PolarHBondContact O-N 3.45Å; D449-K452 IonicContact OD1-NZ 3.12Å; D449-K452 PolarHBondContact OD1-NZ 3.06Å; D449-F459 HydrophobicContact CB-CD2 4.19Å; D449-F459 HydrophobicContact CB-CE2 4.44Å; D449-R462 IonicContact OD2-NH1 2.79Å; D449-R462 PolarHBondContact OD2-NH1 2.95Å
450	M	60.5	Low	67.9	Low	37 Å²	37	67.4 Å²	67.4	18%	0.182	38%	0.381	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.5	-12.8	173.2	-73.4	-160.3	-58.9	0	0	115.2	L446 L447 A448 K452 F459 L511 K514	L446-M450 WeakPolarHBondContact O-CG 3.43Å; L446-M450 PolarHBondContact O-N 2.84Å; L447-M450 HydrophobicContact CD2-CE 3.89Å; A448-M450 VanDerWaalsContact C-N 3.32Å; A448-M450 PolarHBondContact O-N 2.51Å; M450-K452 PolarHBondContact O-N 3.33Å; M450-F459 HydrophobicContact CG-CD2 4.48Å; M450-F459 HydrophobicContact CG-CE1 3.65Å; M450-F459 HydrophobicContact CG-CE2 3.6Å; M450-F459 HydrophobicContact CG-CZ 3.14Å; M450-F459 HydrophobicContact SD-CE1 3.86Å; M450-F459 HydrophobicContact SD-CZ 3.55Å; M450-F459 VanDerWaalsContact SD-CZ 3.55Å; M450-L511 HydrophobicContact CE-CD2 3.39Å; M450-L511 HydrophobicContact CE-CG 3.97Å; M450-L511 HydrophobicContact SD-CD2 4.1Å; M450-K514 HydrophobicContact CE-CB 4.09Å; M450-K514 HydrophobicContact CE-CD 4.17Å
451	S	62.1	Low	68.1	Low	100 Å²	100	71.4 Å²	71.4	70%	0.699	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.2	-8.7	174.6	71.9	0	0	0	0	113.4	A448 D449	A448-S451 WeakPolarHBondContact O-CB 3.35Å; A448-S451 PolarHBondContact O-N 2.76Å; A448-S451 VanDerWaalsContact O-N 3.14Å; A448-S451 PolarHBondContact O-OG 2.81Å; D449-S451 PolarHBondContact O-N 3.16Å
452	K	61.5	Low	68.2	Low	125 Å²	125	69.1 Å²	69.1	54%	0.543	38%	0.384	S	S	.	.	S	Bend	trans	-90.1	142.3	-179.8	-58.3	164.1	-171.4	169.6	0	109.6	D449 M450 F454	D449-K452 WeakPolarHBondContact O-CB 3.45Å; D449-K452 PolarHBondContact O-N 3.45Å; D449-K452 IonicContact OD1-NZ 3.12Å; D449-K452 PolarHBondContact OD1-NZ 3.06Å; M450-K452 PolarHBondContact O-N 3.33Å; K452-F454 PolarHBondContact O-N 3.28Å
453	A	45.5	Very low	68.2	Low	88 Å²	88	68.2 Å²	68.2	73%	0.727	38%	0.38	S	S	*	.	S	Bend	trans	-57.4	-20.8	-158.7	0	0	0	0	0	117.7
454	F	56.9	Low	68.3	Low	178 Å²	178	73.7 Å²	73.7	78%	0.781	41%	0.406	S	S	*	.	S	Bend	trans	-143	114.6	178.3	-67.3	-75.8	0	0	0	111.8	K452 S456	K452-F454 PolarHBondContact O-N 3.28Å; F454-S456 PolarHBondContact O-N 2.88Å
455	P	59.1	Low	68.6	Low	30 Å²	30	74.4 Å²	74.4	20%	0.195	40%	0.399	C	S	.	.			trans	-69	125.4	174.5	-22.2	35	0	0	0	112.5	F459 L518	P455-F459 HydrophobicContact CB-CD1 3.81Å; P455-F459 HydrophobicContact CB-CG 4.32Å; P455-L518 HydrophobicContact CB-CD2 4.34Å; P455-L518 HydrophobicContact CG-CD1 3.94Å; P455-L518 HydrophobicContact CG-CD2 3.96Å
456	S	61.8	Low	68.9	Low	65 Å²	65	72.3 Å²	72.3	46%	0.455	39%	0.385	S	S	.	.			trans	-73.3	165.4	178.5	68.4	0	0	0	0	112.7	F454 L458 F459 R460	F454-S456 PolarHBondContact O-N 2.88Å; S456-L458 PolarHBondContact O-N 2.89Å; S456-F459 WeakPolarHBondContact O-CB 3.39Å; S456-F459 PolarHBondContact O-N 3.47Å; S456-F459 VanDerWaalsContact O-N 3.11Å; S456-F459 PolarHBondContact OG-N 3.2Å; S456-F459 VanDerWaalsContact OG-N 3.16Å; S456-R460 PolarHBondContact O-N 2.82Å
457	V	67.6	Low	69	Low	118 Å²	118	75.2 Å²	75.2	72%	0.715	40%	0.398	S	S	*	.	H	α-helix	trans	-58.9	-40.7	172.3	-179.1	0	0	0	0	110.7	F459 R460 Q461	V457-F459 VanDerWaalsContact C-N 3.28Å; V457-F459 PolarHBondContact O-N 3.25Å; V457-R460 PolarHBondContact O-N 3.15Å; V457-R460 VanDerWaalsContact O-N 3.16Å; V457-Q461 PolarHBondContact O-N 3.2Å; V457-Q461 VanDerWaalsContact O-N 3.1Å
458	L	66.8	Low	69.3	Low	119 Å²	119	78.6 Å²	78.6	62%	0.623	41%	0.413	S	S	*	.	H	α-helix	trans	-61.9	-31.4	175.5	-62.9	173	0	0	0	113	S456 R462	S456-L458 PolarHBondContact O-N 2.89Å; L458-R462 WeakPolarHBondContact O-CG 3.09Å; L458-R462 PolarHBondContact O-N 2.85Å
459	F	75.6	Confident	69.5	Low	12 Å²	12	80.5 Å²	80.5	5%	0.053	41%	0.408	C	S	.	.	H	α-helix	trans	-65.4	-47.5	172.7	171.2	-90.6	0	0	0	111.4	L446 D449 M450 P455 S456 V457 Q461 R462 L463	L446-F459 HydrophobicContact CB-CE2 4.02Å; L446-F459 HydrophobicContact CD2-CD2 4.05Å; L446-F459 HydrophobicContact CD2-CE2 3.63Å; L446-F459 HydrophobicContact CD2-CZ 4.49Å; L446-F459 HydrophobicContact CG-CE2 4.44Å; D449-F459 HydrophobicContact CB-CD2 4.19Å; D449-F459 HydrophobicContact CB-CE2 4.44Å; M450-F459 HydrophobicContact CG-CD2 4.48Å; M450-F459 HydrophobicContact CG-CE1 3.65Å; M450-F459 HydrophobicContact CG-CE2 3.6Å; M450-F459 HydrophobicContact CG-CZ 3.14Å; M450-F459 HydrophobicContact SD-CE1 3.86Å; M450-F459 HydrophobicContact SD-CZ 3.55Å; M450-F459 VanDerWaalsContact SD-CZ 3.55Å; P455-F459 HydrophobicContact CB-CD1 3.81Å; P455-F459 HydrophobicContact CB-CG 4.32Å; S456-F459 WeakPolarHBondContact O-CB 3.39Å; S456-F459 PolarHBondContact O-N 3.47Å; S456-F459 VanDerWaalsContact O-N 3.11Å; S456-F459 PolarHBondContact OG-N 3.2Å; S456-F459 VanDerWaalsContact OG-N 3.16Å; V457-F459 VanDerWaalsContact C-N 3.28Å; V457-F459 PolarHBondContact O-N 3.25Å; F459-Q461 VanDerWaalsContact C-N 3.25Å; F459-Q461 PolarHBondContact O-N 3.41Å; F459-R462 PolarHBondContact O-N 2.98Å; F459-L463 HydrophobicContact CE1-CB 4.37Å; F459-L463 HydrophobicContact CE1-CD2 4.06Å; F459-L463 HydrophobicContact CZ-CB 4.3Å; F459-L463 HydrophobicContact CZ-CD2 4.23Å; F459-L463 WeakPolarHBondContact O-CB 3.47Å; F459-L463 PolarHBondContact O-N 3.08Å
460	R	68.9	Low	69.8	Low	110 Å²	110	78.7 Å²	78.7	42%	0.415	40%	0.399	S	S	.	.	H	α-helix	trans	-60.9	-37.1	178.7	-68.8	-173.9	-125.8	-135.8	-0.4	111.5	S456 V457 Q464 D522	S456-R460 PolarHBondContact O-N 2.82Å; V457-R460 PolarHBondContact O-N 3.15Å; V457-R460 VanDerWaalsContact O-N 3.16Å; R460-Q464 PolarHBondContact O-N 2.91Å; R460-Q464 VanDerWaalsContact O-N 3.15Å; R460-D522 IonicContact CZ-OD2 3.16Å; R460-D522 IonicContact NH1-OD2 2.73Å; R460-D522 PolarHBondContact NH1-OD2 3.06Å; R460-D522 IonicContact NH2-OD2 2.93Å; R460-D522 PolarHBondContact NH2-OD2 3.03Å
461	Q	75.3	Confident	70.5	Confident	105 Å²	105	78.9 Å²	78.9	49%	0.491	41%	0.406	S	S	.	.	H	α-helix	trans	-66.1	-50.6	174.9	-170.2	172.1	-1.8	0	0	112.6	V457 F459 L463 Q464 E465	V457-Q461 PolarHBondContact O-N 3.2Å; V457-Q461 VanDerWaalsContact O-N 3.1Å; F459-Q461 VanDerWaalsContact C-N 3.25Å; F459-Q461 PolarHBondContact O-N 3.41Å; Q461-L463 VanDerWaalsContact C-N 3.27Å; Q461-L463 PolarHBondContact O-N 3.3Å; Q461-Q464 PolarHBondContact O-N 3.5Å; Q461-Q464 VanDerWaalsContact O-N 3.1Å; Q461-E465 PolarHBondContact O-N 3.09Å
462	R	76.9	Confident	71.1	Confident	87 Å²	87	77 Å²	77	33%	0.328	40%	0.396	S	S	.	.	H	α-helix	trans	-58.4	-36.9	175.7	-76	175.9	64.6	-145.4	-4	112.9	L446 D449 L458 F459 W466	L446-R462 HydrophobicContact CD2-CB 4.11Å; D449-R462 IonicContact OD2-NH1 2.79Å; D449-R462 PolarHBondContact OD2-NH1 2.95Å; L458-R462 WeakPolarHBondContact O-CG 3.09Å; L458-R462 PolarHBondContact O-N 2.85Å; F459-R462 PolarHBondContact O-N 2.98Å; R462-W466 WeakPolarHBondContact O-CB 3.25Å; R462-W466 PolarHBondContact O-N 3.19Å; R462-W466 VanDerWaalsContact O-N 3.07Å
463	L	77.8	Confident	71.5	Confident	13 Å²	13	72 Å²	72	7%	0.068	38%	0.377	C	S	.	.	H	α-helix	trans	-63.7	-44.2	175	173.5	56.9	0	0	0	111.6	L446 F459 Q461 W466 Q467 L511	L446-L463 HydrophobicContact CD1-CD1 4.42Å; F459-L463 HydrophobicContact CE1-CB 4.37Å; F459-L463 HydrophobicContact CE1-CD2 4.06Å; F459-L463 HydrophobicContact CZ-CB 4.3Å; F459-L463 HydrophobicContact CZ-CD2 4.23Å; F459-L463 WeakPolarHBondContact O-CB 3.47Å; F459-L463 PolarHBondContact O-N 3.08Å; Q461-L463 VanDerWaalsContact C-N 3.27Å; Q461-L463 PolarHBondContact O-N 3.3Å; L463-W466 HydrophobicContact CD1-CE3 4.33Å; L463-W466 PolarHBondContact O-N 3.17Å; L463-Q467 HydrophobicContact CD1-CG 4.37Å; L463-Q467 WeakPolarHBondContact O-CG 3.34Å; L463-Q467 PolarHBondContact O-N 3.42Å; L463-L511 HydrophobicContact CD1-CD1 4.47Å; L463-L511 HydrophobicContact CD1-CD2 3.68Å; L463-L511 HydrophobicContact CD2-CD2 4.19Å
464	Q	76.8	Confident	72.4	Confident	115 Å²	115	70.7 Å²	70.7	54%	0.537	36%	0.362	S	S	.	.	H	α-helix	trans	-64.9	-45	178.4	-172.2	177.3	-31.1	0	0	111.7	R460 Q461 W466 Q467 E468	R460-Q464 PolarHBondContact O-N 2.91Å; R460-Q464 VanDerWaalsContact O-N 3.15Å; Q461-Q464 PolarHBondContact O-N 3.5Å; Q461-Q464 VanDerWaalsContact O-N 3.1Å; Q464-W466 VanDerWaalsContact C-N 3.29Å; Q464-W466 PolarHBondContact O-N 3.04Å; Q464-Q467 PolarHBondContact O-N 3.41Å; Q464-Q467 VanDerWaalsContact O-N 3.13Å; Q464-E468 WeakPolarHBondContact CG-OE1 3.27Å; Q464-E468 PolarHBondContact NE2-OE1 3.14Å; Q464-E468 VanDerWaalsContact NE2-OE1 3.09Å; Q464-E468 WeakPolarHBondContact O-CG 3.27Å; Q464-E468 PolarHBondContact O-N 3.07Å
465	E	80.6	Confident	72.5	Confident	70 Å²	70	68.9 Å²	68.9	33%	0.327	36%	0.356	S	S	.	.	H	α-helix	trans	-56.9	-40.8	174.1	-69.6	173.5	-153.7	0	0	112.6	Q461 E468 R469	Q461-E465 PolarHBondContact O-N 3.09Å; E465-E468 PolarHBondContact O-N 2.9Å; E465-R469 VanDerWaalsContact O-CG 3.29Å; E465-R469 WeakPolarHBondContact O-CG 3.29Å; E465-R469 PolarHBondContact O-N 2.67Å; E465-R469 IonicContact OE2-CZ 3.88Å; E465-R469 IonicContact OE2-NH2 3.82Å; E465-R469 PolarHBondContact OE2-NH2 2.71Å
466	W	82.9	Confident	72.4	Confident	0 Å²	0	70.8 Å²	70.8	0%	0	37%	0.37	C	S	.	.	H	α-helix	trans	-65.7	-39.5	176.9	177.6	86.7	0	0	0	112.1	L439 A443 L446 R462 L463 Q464 R469 L470 L504 Q508 L511	L439-W466 PolarHBondContact O-NE1 2.96Å; A443-W466 HydrophobicContact CB-CH2 4.26Å; A443-W466 HydrophobicContact CB-CZ2 3.53Å; L446-W466 HydrophobicContact CD1-CB 3.9Å; L446-W466 HydrophobicContact CD1-CD2 4.31Å; L446-W466 HydrophobicContact CD1-CG 3.92Å; R462-W466 WeakPolarHBondContact O-CB 3.25Å; R462-W466 PolarHBondContact O-N 3.19Å; R462-W466 VanDerWaalsContact O-N 3.07Å; L463-W466 HydrophobicContact CD1-CE3 4.33Å; L463-W466 PolarHBondContact O-N 3.17Å; Q464-W466 VanDerWaalsContact C-N 3.29Å; Q464-W466 PolarHBondContact O-N 3.04Å; W466-R469 PolarHBondContact O-N 3.45Å; W466-L470 HydrophobicContact CH2-CD2 3.63Å; W466-L470 HydrophobicContact CZ2-CD2 4.09Å; W466-L470 HydrophobicContact CZ3-CD2 3.95Å; W466-L470 WeakPolarHBondContact O-CB 3.41Å; W466-L470 PolarHBondContact O-N 3.22Å; W466-L504 HydrophobicContact CZ2-CD1 4.1Å; W466-Q508 HydrophobicContact CH2-CB 4.4Å; W466-L511 HydrophobicContact CZ3-CD1 4.31Å
467	Q	77.6	Confident	72	Confident	61 Å²	61	71.5 Å²	71.5	29%	0.285	37%	0.366	S	S	.	.	H	α-helix	trans	-64.1	-39.3	175	-71	-176.1	-38.9	0	0	112.1	L463 Q464 L470 A471	L463-Q467 HydrophobicContact CD1-CG 4.37Å; L463-Q467 WeakPolarHBondContact O-CG 3.34Å; L463-Q467 PolarHBondContact O-N 3.42Å; Q464-Q467 PolarHBondContact O-N 3.41Å; Q464-Q467 VanDerWaalsContact O-N 3.13Å; Q467-L470 PolarHBondContact O-N 3.4Å; Q467-A471 PolarHBondContact O-N 3.47Å; Q467-A471 VanDerWaalsContact O-N 3.09Å
468	E	78	Confident	71.1	Confident	113 Å²	113	74.1 Å²	74.1	53%	0.528	37%	0.37	S	S	.	.	H	α-helix	trans	-67.1	-42.8	176.5	-70.1	170.7	-164.3	0	0	111.9	Q464 E465 L470 A471 A472	Q464-E468 WeakPolarHBondContact CG-OE1 3.27Å; Q464-E468 PolarHBondContact NE2-OE1 3.14Å; Q464-E468 VanDerWaalsContact NE2-OE1 3.09Å; Q464-E468 WeakPolarHBondContact O-CG 3.27Å; Q464-E468 PolarHBondContact O-N 3.07Å; E465-E468 PolarHBondContact O-N 2.9Å; E468-L470 PolarHBondContact O-N 2.9Å; E468-A471 PolarHBondContact O-N 3.17Å; E468-A472 PolarHBondContact O-N 2.98Å; E468-A472 VanDerWaalsContact O-N 3.17Å
469	R	78.1	Confident	70	Confident	96 Å²	96	74.9 Å²	74.9	36%	0.362	38%	0.38	S	S	.	.	H	α-helix	trans	-62	-41.6	173.8	-68.2	169.2	-162.2	149.9	11.7	112.3	L439 E442 E465 W466 A471 A472 V473	L439-R469 HydrophobicContact CD2-CB 4.07Å; E442-R469 IonicContact OE1-NH1 2.76Å; E442-R469 PolarHBondContact OE1-NH1 3.27Å; E442-R469 IonicContact OE2-NH1 3.48Å; E442-R469 PolarHBondContact OE2-NH1 2.99Å; E465-R469 VanDerWaalsContact O-CG 3.29Å; E465-R469 WeakPolarHBondContact O-CG 3.29Å; E465-R469 PolarHBondContact O-N 2.67Å; E465-R469 IonicContact OE2-CZ 3.88Å; E465-R469 IonicContact OE2-NH2 3.82Å; E465-R469 PolarHBondContact OE2-NH2 2.71Å; W466-R469 PolarHBondContact O-N 3.45Å; R469-A471 VanDerWaalsContact C-N 3.35Å; R469-A472 PolarHBondContact O-N 2.93Å; R469-V473 PolarHBondContact O-N 2.94Å; R469-V473 VanDerWaalsContact O-N 3.16Å
470	L	76.3	Confident	68.3	Low	11 Å²	11	77.6 Å²	77.6	6%	0.058	41%	0.411	C	S	.	.	H	α-helix	trans	-62.5	-40.9	177.9	178.2	61.1	0	0	0	111.9	L439 W466 Q467 E468 S474 L504 Q508	L439-L470 HydrophobicContact CD1-CD1 4.25Å; W466-L470 HydrophobicContact CH2-CD2 3.63Å; W466-L470 HydrophobicContact CZ2-CD2 4.09Å; W466-L470 HydrophobicContact CZ3-CD2 3.95Å; W466-L470 WeakPolarHBondContact O-CB 3.41Å; W466-L470 PolarHBondContact O-N 3.22Å; Q467-L470 PolarHBondContact O-N 3.4Å; E468-L470 PolarHBondContact O-N 2.9Å; L470-S474 WeakPolarHBondContact O-CB 3.47Å; L470-S474 PolarHBondContact O-N 3.38Å; L470-S474 VanDerWaalsContact O-N 3.1Å; L470-S474 PolarHBondContact O-OG 2.9Å; L470-L504 HydrophobicContact CD1-CD2 3.53Å; L470-L504 HydrophobicContact CD1-CG 4.14Å; L470-Q508 HydrophobicContact CD2-CG 4.42Å
471	A	74	Confident	66.7	Low	41 Å²	41	77.9 Å²	77.9	34%	0.339	43%	0.43	S	S	.	.	H	α-helix	trans	-62.5	-44.2	175.3	0	0	0	0	0	111.8	Q467 E468 R469 S474 Q475	Q467-A471 PolarHBondContact O-N 3.47Å; Q467-A471 VanDerWaalsContact O-N 3.09Å; E468-A471 PolarHBondContact O-N 3.17Å; R469-A471 VanDerWaalsContact C-N 3.35Å; A471-S474 PolarHBondContact O-N 3Å; A471-Q475 WeakPolarHBondContact O-CG 3.35Å; A471-Q475 PolarHBondContact O-N 3.2Å
472	A	74.1	Confident	65.2	Low	59 Å²	59	78.4 Å²	78.4	49%	0.488	44%	0.44	S	S	.	.	H	α-helix	trans	-60.9	-47	179.2	0	0	0	0	0	113	E468 R469 S474 Q475 S476	E468-A472 PolarHBondContact O-N 2.98Å; E468-A472 VanDerWaalsContact O-N 3.17Å; R469-A472 PolarHBondContact O-N 2.93Å; A472-S474 VanDerWaalsContact C-N 3.26Å; A472-S474 PolarHBondContact O-N 3.23Å; A472-Q475 PolarHBondContact O-N 3.37Å; A472-S476 PolarHBondContact O-N 3.42Å
473	V	70.4	Confident	63.2	Low	22 Å²	22	80.9 Å²	80.9	13%	0.133	46%	0.46	C	S	.	.	H	α-helix	trans	-66.8	-27.3	177	175.9	0	0	0	0	112.2	Y436 L439 R469 S476	Y436-V473 HydrophobicContact CD1-CG1 4.25Å; Y436-V473 HydrophobicContact CE1-CG1 3.64Å; Y436-V473 HydrophobicContact CE2-CG1 4.4Å; L439-V473 HydrophobicContact CD1-CB 4.24Å; L439-V473 HydrophobicContact CD1-CG1 4.45Å; L439-V473 HydrophobicContact CD1-CG2 4.07Å; R469-V473 PolarHBondContact O-N 2.94Å; R469-V473 VanDerWaalsContact O-N 3.16Å; V473-S476 PolarHBondContact O-OG 3.15Å; V473-S476 VanDerWaalsContact O-OG 3.04Å
474	S	64.4	Low	61.2	Low	60 Å²	60	86.3 Å²	86.3	42%	0.42	50%	0.498	S	S	.	.	H	α-helix	trans	-74.2	-37.6	175.2	-57.2	0	0	0	0	112.1	L470 A471 A472	L470-S474 WeakPolarHBondContact O-CB 3.47Å; L470-S474 PolarHBondContact O-N 3.38Å; L470-S474 VanDerWaalsContact O-N 3.1Å; L470-S474 PolarHBondContact O-OG 2.9Å; A471-S474 PolarHBondContact O-N 3Å; A472-S474 VanDerWaalsContact C-N 3.26Å; A472-S474 PolarHBondContact O-N 3.23Å
475	Q	59	Low	59.3	Low	139 Å²	139	86.8 Å²	86.8	65%	0.65	51%	0.514	S	S	*	.	H	α-helix	trans	-74.9	-26.6	-178.4	-71.3	172.9	12.9	0	0	113.5	A471 A472 H477 H478	A471-Q475 WeakPolarHBondContact O-CG 3.35Å; A471-Q475 PolarHBondContact O-N 3.2Å; A472-Q475 PolarHBondContact O-N 3.37Å; Q475-H477 PolarHBondContact O-N 2.87Å; Q475-H478 PolarHBondContact O-N 3.07Å
476	S	57.8	Low	57.6	Low	70 Å²	70	93.1 Å²	93.1	49%	0.49	54%	0.543	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.5	-1.6	-177.8	61.8	0	0	0	0	115.5	A472 V473	A472-S476 PolarHBondContact O-N 3.42Å; V473-S476 PolarHBondContact O-OG 3.15Å; V473-S476 VanDerWaalsContact O-OG 3.04Å
477	H	53.8	Low	55.4	Low	80 Å²	80	95.5 Å²	95.5	37%	0.37	57%	0.568	S	S	.	*	T	Hydrogen-bonded Turn	trans	-112.5	10.7	-175.9	-74.6	-64.9	0	0	0	115	Y436 Q475 R501	Y436-H477 PolarHBondContact OH-CD2 3.49Å; Q475-H477 PolarHBondContact O-N 2.87Å; H477-R501 PolarHBondContact CD2-NH2 3.04Å; H477-R501 VanDerWaalsContact CD2-NH2 3.27Å; H477-R501 PolarHBondContact NE2-NH2 3.21Å
478	H	48.1	Very low	53.7	Low	173 Å²	173	97.8 Å²	97.8	80%	0.801	60%	0.598	S	S	*	*	S	Bend	trans	-108.7	7.2	-178.4	-74.9	-17.1	0	0	0	115.7	Q475	Q475-H478 PolarHBondContact O-N 3.07Å
479	T	43.1	Very low	52.1	Low	135 Å²	135	95.5 Å²	95.5	83%	0.828	60%	0.604	S	S	*	*	S	Bend	trans	-120.4	6.7	-178.9	48.8	0	0	0	0	114.2
480	G	39.5	Very low	50.6	Low	69 Å²	69	95.3 Å²	95.3	71%	0.711	61%	0.61	S	S	*	*	S	Bend	trans	-113.4	84.4	-169.2	0	0	0	0	0	115.9
481	S	36.1	Very low	49.2	Very low	117 Å²	117	101.7 Å²	101.7	82%	0.818	64%	0.64	S	S	*	*			trans	56.1	132.7	155.8	-148.5	0	0	0	0	121.9
482	T	43.6	Very low	48	Very low	115 Å²	115	107.2 Å²	107.2	71%	0.706	66%	0.659	S	S	*	*			trans	-66.5	175.2	151.9	-30.2	0	0	0	0	111.3
483	D	35.8	Very low	46.9	Very low	140 Å²	140	108.4 Å²	108.4	75%	0.749	66%	0.656	S	S	*	*			trans	86.3	111.2	161.6	-58.1	-22	0	0	0	120.4
484	C	34.4	Very low	46.2	Very low	126 Å²	126	113.1 Å²	113.1	85%	0.851	68%	0.676	S	S	*	*			trans	42.4	111.3	133.8	-59.2	0	0	0	0	121.8
485	S	37.8	Very low	45.9	Very low	126 Å²	126	113.6 Å²	113.6	88%	0.881	68%	0.677	S	S	*	*				-179	151.4	111	-166.2	0	0	0	0	111.6
486	E	45.7	Very low	46.1	Very low	202 Å²	202	110 Å²	110	94%	0.944	66%	0.664	S	S	*	*			trans	-87.8	130.4	178.4	-65.4	-176.6	123.4	0	0	112.5
487	G	36.3	Very low	46.3	Very low	50 Å²	50	107.9 Å²	107.9	52%	0.515	65%	0.647	S	S	.	*			trans	-145	110.8	174.6	0	0	0	0	0	111.8	G489 D490	G487-G489 PolarHBondContact O-N 3.24Å; G487-D490 PolarHBondContact O-N 3.16Å
488	A	40.7	Very low	46.9	Very low	110 Å²	110	108 Å²	108	91%	0.909	65%	0.651	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.4	-2.2	-169.8	0	0	0	0	0	116
489	G	45.6	Very low	48	Very low	65 Å²	65	104.4 Å²	104.4	67%	0.67	64%	0.637	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.7	-26.5	175.9	0	0	0	0	0	115.1	G487	G487-G489 PolarHBondContact O-N 3.24Å
490	D	45.6	Very low	49.3	Very low	91 Å²	91	100.1 Å²	100.1	49%	0.487	61%	0.609	S	S	.	*	T	Hydrogen-bonded Turn	trans	-83.7	-15.9	-167.9	-114.4	-20.1	0	0	0	114.1	G487 Q492 L493 H494	G487-D490 PolarHBondContact O-N 3.16Å; D490-Q492 VanDerWaalsContact C-N 3.31Å; D490-Q492 PolarHBondContact O-N 3.05Å; D490-L493 PolarHBondContact O-N 3.29Å; D490-H494 WeakPolarHBondContact O-CB 3.36Å; D490-H494 PolarHBondContact O-N 2.68Å
491	H	48.3	Very low	50.7	Low	146 Å²	146	101.2 Å²	101.2	68%	0.676	59%	0.592	S	S	*	*	H	α-helix	trans	-57.1	-40.2	-178.8	-101.9	59.5	0	0	0	113.1	L493 H494 V495	H491-L493 PolarHBondContact O-N 3.04Å; H491-H494 PolarHBondContact O-N 3.35Å; H491-V495 WeakPolarHBondContact O-CB 3.37Å; H491-V495 WeakPolarHBondContact O-CG2 3.4Å; H491-V495 PolarHBondContact O-N 2.71Å
492	Q	48.4	Very low	52.5	Low	157 Å²	157	99.7 Å²	99.7	73%	0.734	57%	0.572	S	S	*	*	H	α-helix	trans	-62.8	-44.2	179.5	-162.3	89.1	43.8	0	0	111.2	D490 T496	D490-Q492 VanDerWaalsContact C-N 3.31Å; D490-Q492 PolarHBondContact O-N 3.05Å; Q492-T496 WeakPolarHBondContact O-CG2 3.41Å; Q492-T496 PolarHBondContact O-N 2.9Å; Q492-T496 PolarHBondContact O-OG1 3.5Å
493	L	49.5	Very low	53.8	Low	83 Å²	83	99 Å²	99	44%	0.435	56%	0.56	S	S	.	*	H	α-helix	trans	-69.9	-43.8	179.1	-68.1	175.1	0	0	0	111.1	D490 H491 V495 T496 N497	D490-L493 PolarHBondContact O-N 3.29Å; H491-L493 PolarHBondContact O-N 3.04Å; L493-V495 PolarHBondContact O-N 2.88Å; L493-T496 PolarHBondContact O-N 2.88Å; L493-T496 PolarHBondContact O-OG1 2.85Å; L493-N497 PolarHBondContact O-N 3.37Å
494	H	56.3	Low	55.6	Low	121 Å²	121	92.6 Å²	92.6	56%	0.56	53%	0.526	S	S	*	.	H	α-helix	trans	-58	-47.9	177.9	-167.1	81.8	0	0	0	112	D490 H491 T496 N497 L498	D490-H494 WeakPolarHBondContact O-CB 3.36Å; D490-H494 PolarHBondContact O-N 2.68Å; H491-H494 PolarHBondContact O-N 3.35Å; H494-T496 PolarHBondContact O-N 3.46Å; H494-N497 PolarHBondContact O-N 2.91Å; H494-L498 WeakPolarHBondContact O-CG 3.42Å; H494-L498 PolarHBondContact O-N 2.85Å
495	V	59.2	Low	57.6	Low	71 Å²	71	91.7 Å²	91.7	43%	0.43	51%	0.505	S	S	.	.	H	α-helix	trans	-61.6	-41.8	176.2	171.2	0	0	0	0	111.7	H491 L493 N497 L498 N499	H491-V495 WeakPolarHBondContact O-CB 3.37Å; H491-V495 WeakPolarHBondContact O-CG2 3.4Å; H491-V495 PolarHBondContact O-N 2.71Å; L493-V495 PolarHBondContact O-N 2.88Å; V495-N497 VanDerWaalsContact C-N 3.32Å; V495-N497 PolarHBondContact O-N 2.82Å; V495-L498 PolarHBondContact O-N 3.04Å; V495-N499 VanDerWaalsContact O-CG 3.31Å; V495-N499 PolarHBondContact O-N 2.74Å; V495-N499 PolarHBondContact O-OD1 3.37Å
496	T	62.2	Low	59.4	Low	63 Å²	63	89.8 Å²	89.8	39%	0.387	48%	0.481	S	S	.	.	H	α-helix	trans	-65.2	-33.7	175.7	58.6	0	0	0	0	113.2	Q492 L493 H494 L500	Q492-T496 WeakPolarHBondContact O-CG2 3.41Å; Q492-T496 PolarHBondContact O-N 2.9Å; Q492-T496 PolarHBondContact O-OG1 3.5Å; L493-T496 PolarHBondContact O-N 2.88Å; L493-T496 PolarHBondContact O-OG1 2.85Å; H494-T496 PolarHBondContact O-N 3.46Å; T496-L500 WeakPolarHBondContact O-CB 3.37Å; T496-L500 VanDerWaalsContact O-CG 3.3Å; T496-L500 WeakPolarHBondContact O-CG 3.43Å; T496-L500 PolarHBondContact O-N 3.11Å
497	N	63.1	Low	60.6	Low	25 Å²	25	81.5 Å²	81.5	13%	0.134	45%	0.445	C	S	.	.	H	α-helix	trans	-70.7	-40.7	177.5	-154.5	-83.9	0	0	0	111.6	L493 H494 V495 L500 R501	L493-N497 PolarHBondContact O-N 3.37Å; H494-N497 PolarHBondContact O-N 2.91Å; V495-N497 VanDerWaalsContact C-N 3.32Å; V495-N497 PolarHBondContact O-N 2.82Å; N497-L500 PolarHBondContact O-N 2.86Å; N497-R501 VanDerWaalsContact O-CG 3.31Å; N497-R501 WeakPolarHBondContact O-CG 3.48Å; N497-R501 PolarHBondContact O-N 3.37Å; N497-R501 PolarHBondContact OD1-NE 3.23Å; N497-R501 VanDerWaalsContact OD1-NE 3.15Å
498	L	66.7	Low	62.4	Low	84 Å²	84	82.9 Å²	82.9	44%	0.44	44%	0.438	S	S	.	.	H	α-helix	trans	-60.8	-47.8	173.2	-70.1	173.5	0	0	0	111.8	H494 V495 L500 R501 E502	H494-L498 WeakPolarHBondContact O-CG 3.42Å; H494-L498 PolarHBondContact O-N 2.85Å; V495-L498 PolarHBondContact O-N 3.04Å; L498-L500 PolarHBondContact O-N 3.03Å; L498-R501 PolarHBondContact O-N 3.33Å; L498-E502 PolarHBondContact O-N 3.24Å
499	N	69.8	Low	64.2	Low	97 Å²	97	81.9 Å²	81.9	52%	0.519	41%	0.414	S	S	.	.	H	α-helix	trans	-61.9	-42.3	178.2	-69.4	-2.7	0	0	0	111.9	V495 R501 E502 E503	V495-N499 VanDerWaalsContact O-CG 3.31Å; V495-N499 PolarHBondContact O-N 2.74Å; V495-N499 PolarHBondContact O-OD1 3.37Å; N499-R501 VanDerWaalsContact C-N 3.34Å; N499-R501 PolarHBondContact O-N 3.28Å; N499-E502 PolarHBondContact O-N 3.46Å; N499-E503 PolarHBondContact O-N 3.38Å
500	L	70.3	Confident	65.6	Low	45 Å²	45	80.3 Å²	80.3	24%	0.236	40%	0.395	C	S	.	.	H	α-helix	trans	-63.8	-37.8	175.9	-75.8	170	0	0	0	112.3	L437 T496 N497 L498 L504	L437-L500 HydrophobicContact CD1-CD2 4.11Å; T496-L500 WeakPolarHBondContact O-CB 3.37Å; T496-L500 VanDerWaalsContact O-CG 3.3Å; T496-L500 WeakPolarHBondContact O-CG 3.43Å; T496-L500 PolarHBondContact O-N 3.11Å; N497-L500 PolarHBondContact O-N 2.86Å; L498-L500 PolarHBondContact O-N 3.03Å; L500-L504 VanDerWaalsContact O-CB 3.27Å; L500-L504 WeakPolarHBondContact O-CB 3.47Å; L500-L504 PolarHBondContact O-N 3.36Å
501	R	69.9	Low	67	Low	91 Å²	91	76.2 Å²	76.2	34%	0.343	37%	0.373	S	S	.	.	H	α-helix	trans	-65.8	-38.2	174.7	-75.3	170.9	171.6	-168.3	-3.6	112.3	Y436 H477 N497 L498 N499 L504 R505	Y436-R501 HydrophobicContact CD1-CG 4.37Å; Y436-R501 HydrophobicContact CE1-CG 4.17Å; Y436-R501 HydrophobicContact CE2-CG 4.46Å; Y436-R501 PolarHBondContact OH-NE 3.42Å; Y436-R501 PolarHBondContact OH-NH2 2.72Å; H477-R501 PolarHBondContact CD2-NH2 3.04Å; H477-R501 VanDerWaalsContact CD2-NH2 3.27Å; H477-R501 PolarHBondContact NE2-NH2 3.21Å; N497-R501 VanDerWaalsContact O-CG 3.31Å; N497-R501 WeakPolarHBondContact O-CG 3.48Å; N497-R501 PolarHBondContact O-N 3.37Å; N497-R501 PolarHBondContact OD1-NE 3.23Å; N497-R501 VanDerWaalsContact OD1-NE 3.15Å; L498-R501 PolarHBondContact O-N 3.33Å; N499-R501 VanDerWaalsContact C-N 3.34Å; N499-R501 PolarHBondContact O-N 3.28Å; R501-L504 PolarHBondContact O-N 3.48Å; R501-R505 WeakPolarHBondContact O-CB 3.24Å; R501-R505 PolarHBondContact O-N 2.86Å
502	E	72.6	Confident	68.4	Low	86 Å²	86	74.1 Å²	74.1	40%	0.402	36%	0.364	S	S	.	.	H	α-helix	trans	-70.6	-41.5	176.7	175.4	148.2	-109.1	0	0	112.8	L498 N499 L504 R505 K506	L498-E502 PolarHBondContact O-N 3.24Å; N499-E502 PolarHBondContact O-N 3.46Å; E502-L504 VanDerWaalsContact C-N 3.3Å; E502-L504 PolarHBondContact O-N 2.57Å; E502-R505 WeakPolarHBondContact O-CB 3.45Å; E502-R505 PolarHBondContact O-N 3.02Å; E502-R505 IonicContact OE1-CZ 3.79Å; E502-R505 IonicContact OE1-NE 3.74Å; E502-R505 IonicContact OE1-NH2 2.61Å; E502-R505 PolarHBondContact OE1-NH2 3.12Å; E502-K506 HydrophobicContact CG-CD 4.42Å; E502-K506 WeakPolarHBondContact O-CG 3.28Å; E502-K506 PolarHBondContact O-N 3.2Å
503	E	70.9	Confident	69.7	Low	99 Å²	99	73.1 Å²	73.1	46%	0.463	36%	0.359	S	S	.	.	H	α-helix	trans	-63.7	-36.8	173	-68.9	-54.3	120.5	0	0	112.1	N499 K506 C507	N499-E503 PolarHBondContact O-N 3.38Å; E503-K506 PolarHBondContact O-N 2.77Å; E503-K506 WeakPolarHBondContact OE1-CD 3.5Å; E503-K506 IonicContact OE1-NZ 3.23Å; E503-K506 PolarHBondContact OE1-NZ 3.19Å; E503-C507 WeakPolarHBondContact O-CB 3.29Å; E503-C507 PolarHBondContact O-N 2.85Å; E503-C507 PolarHBondContact O-SG 3.08Å
504	L	75.1	Confident	70.8	Confident	6 Å²	6	74.3 Å²	74.3	3%	0.031	36%	0.361	C	S	.	.	H	α-helix	trans	-64	-40.5	174.3	-165.4	70.5	0	0	0	112	Y436 L439 A440 W466 L470 L500 R501 E502 C507 Q508	Y436-L504 HydrophobicContact CD1-CD2 3.8Å; Y436-L504 HydrophobicContact CE1-CD2 4.34Å; L439-L504 HydrophobicContact CB-CD1 4.07Å; A440-L504 HydrophobicContact CB-CD1 4.13Å; W466-L504 HydrophobicContact CZ2-CD1 4.1Å; L470-L504 HydrophobicContact CD1-CD2 3.53Å; L470-L504 HydrophobicContact CD1-CG 4.14Å; L500-L504 VanDerWaalsContact O-CB 3.27Å; L500-L504 WeakPolarHBondContact O-CB 3.47Å; L500-L504 PolarHBondContact O-N 3.36Å; R501-L504 PolarHBondContact O-N 3.48Å; E502-L504 VanDerWaalsContact C-N 3.3Å; E502-L504 PolarHBondContact O-N 2.57Å; L504-C507 PolarHBondContact O-N 3.3Å; L504-Q508 WeakPolarHBondContact O-CB 3.21Å; L504-Q508 PolarHBondContact O-N 3.1Å
505	R	75.2	Confident	71.8	Confident	108 Å²	108	72.5 Å²	72.5	41%	0.408	35%	0.351	S	S	.	.	H	α-helix	trans	-60.8	-49.1	173.3	179.3	179.7	69.3	80.3	-4.1	111.6	R501 E502 C507 Q508 E509	R501-R505 WeakPolarHBondContact O-CB 3.24Å; R501-R505 PolarHBondContact O-N 2.86Å; E502-R505 WeakPolarHBondContact O-CB 3.45Å; E502-R505 PolarHBondContact O-N 3.02Å; E502-R505 IonicContact OE1-CZ 3.79Å; E502-R505 IonicContact OE1-NE 3.74Å; E502-R505 IonicContact OE1-NH2 2.61Å; E502-R505 PolarHBondContact OE1-NH2 3.12Å; R505-C507 VanDerWaalsContact C-N 3.3Å; R505-C507 PolarHBondContact O-N 3.18Å; R505-Q508 WeakPolarHBondContact O-CB 3.34Å; R505-Q508 PolarHBondContact O-N 3.38Å; R505-Q508 VanDerWaalsContact O-N 3.12Å; R505-E509 WeakPolarHBondContact CG-OE1 3.2Å; R505-E509 IonicContact CZ-OE1 3.95Å; R505-E509 VanDerWaalsContact NH1-CD 3.3Å; R505-E509 IonicContact NH1-OE1 2.68Å; R505-E509 PolarHBondContact NH1-OE1 2.96Å; R505-E509 IonicContact NH1-OE2 2.76Å; R505-E509 PolarHBondContact NH1-OE2 3.1Å; R505-E509 VanDerWaalsContact NH1-OE2 3.1Å; R505-E509 WeakPolarHBondContact O-CG 3.42Å; R505-E509 PolarHBondContact O-N 2.95Å
506	K	75.6	Confident	72.7	Confident	85 Å²	85	74.6 Å²	74.6	37%	0.37	36%	0.356	S	S	.	.	H	α-helix	trans	-58.8	-41.4	175.8	-67.4	167.8	-169.6	164.1	0	111.7	E502 E503 A510	E502-K506 HydrophobicContact CG-CD 4.42Å; E502-K506 WeakPolarHBondContact O-CG 3.28Å; E502-K506 PolarHBondContact O-N 3.2Å; E503-K506 PolarHBondContact O-N 2.77Å; E503-K506 WeakPolarHBondContact OE1-CD 3.5Å; E503-K506 IonicContact OE1-NZ 3.23Å; E503-K506 PolarHBondContact OE1-NZ 3.19Å; K506-A510 WeakPolarHBondContact O-CB 3.35Å; K506-A510 PolarHBondContact O-N 2.95Å
507	C	71.6	Confident	73.4	Confident	29 Å²	29	76.2 Å²	76.2	20%	0.196	36%	0.362	C	S	.	.	H	α-helix	trans	-63.2	-41.2	175.3	-69.4	0	0	0	0	112.1	A443 L447 E503 L504 R505 L511	A443-C507 HydrophobicContact CB-CB 4.31Å; L447-C507 HydrophobicContact CD1-CB 4.47Å; E503-C507 WeakPolarHBondContact O-CB 3.29Å; E503-C507 PolarHBondContact O-N 2.85Å; E503-C507 PolarHBondContact O-SG 3.08Å; L504-C507 PolarHBondContact O-N 3.3Å; R505-C507 VanDerWaalsContact C-N 3.3Å; R505-C507 PolarHBondContact O-N 3.18Å; C507-L511 WeakPolarHBondContact O-CB 3.26Å; C507-L511 PolarHBondContact O-N 2.71Å
508	Q	74.8	Confident	73.9	Confident	78 Å²	78	77.1 Å²	77.1	36%	0.364	37%	0.367	S	S	.	.	H	α-helix	trans	-66	-45.2	177.6	-175.9	180	-2.6	0	0	112	W466 L470 L504 R505 L511 Q512	W466-Q508 HydrophobicContact CH2-CB 4.4Å; L470-Q508 HydrophobicContact CD2-CG 4.42Å; L504-Q508 WeakPolarHBondContact O-CB 3.21Å; L504-Q508 PolarHBondContact O-N 3.1Å; R505-Q508 WeakPolarHBondContact O-CB 3.34Å; R505-Q508 PolarHBondContact O-N 3.38Å; R505-Q508 VanDerWaalsContact O-N 3.12Å; Q508-L511 PolarHBondContact O-N 3.47Å; Q508-Q512 WeakPolarHBondContact O-CB 3.25Å; Q508-Q512 PolarHBondContact O-N 3Å
509	E	78.4	Confident	74.5	Confident	89 Å²	89	77.9 Å²	77.9	42%	0.416	37%	0.368	S	S	.	.	H	α-helix	trans	-57.7	-52.8	175.7	-72.7	163.6	-175.3	0	0	110.5	R505 L511 Q512 E513	R505-E509 WeakPolarHBondContact CG-OE1 3.2Å; R505-E509 IonicContact CZ-OE1 3.95Å; R505-E509 VanDerWaalsContact NH1-CD 3.3Å; R505-E509 IonicContact NH1-OE1 2.68Å; R505-E509 PolarHBondContact NH1-OE1 2.96Å; R505-E509 IonicContact NH1-OE2 2.76Å; R505-E509 PolarHBondContact NH1-OE2 3.1Å; R505-E509 VanDerWaalsContact NH1-OE2 3.1Å; R505-E509 WeakPolarHBondContact O-CG 3.42Å; R505-E509 PolarHBondContact O-N 2.95Å; E509-L511 VanDerWaalsContact C-N 3.3Å; E509-L511 PolarHBondContact O-N 2.92Å; E509-Q512 PolarHBondContact O-N 2.95Å; E509-E513 PolarHBondContact O-N 2.6Å
510	A	74.3	Confident	74.9	Confident	33 Å²	33	79 Å²	79	27%	0.273	37%	0.37	S	S	.	.	H	α-helix	trans	-65.8	-26.4	178.8	0	0	0	0	0	114.3	K506 K514	K506-A510 WeakPolarHBondContact O-CB 3.35Å; K506-A510 PolarHBondContact O-N 2.95Å; A510-K514 WeakPolarHBondContact O-CB 3.4Å; A510-K514 VanDerWaalsContact O-CG 3.32Å; A510-K514 WeakPolarHBondContact O-CG 3.48Å; A510-K514 PolarHBondContact O-N 3.34Å
511	L	74.8	Confident	75	Confident	5 Å²	5	81.1 Å²	81.1	3%	0.026	38%	0.378	C	S	.	.	H	α-helix	trans	-73.3	-35.7	171.8	-112.6	155.4	0	0	0	111.8	L447 M450 L463 W466 C507 Q508 E509 K515	L447-L511 HydrophobicContact CD2-CD1 4.48Å; L447-L511 HydrophobicContact CD2-CG 3.96Å; L447-L511 HydrophobicContact CG-CD1 4.19Å; L447-L511 HydrophobicContact CG-CG 4.21Å; M450-L511 HydrophobicContact CE-CD2 3.39Å; M450-L511 HydrophobicContact CE-CG 3.97Å; M450-L511 HydrophobicContact SD-CD2 4.1Å; L463-L511 HydrophobicContact CD1-CD1 4.47Å; L463-L511 HydrophobicContact CD1-CD2 3.68Å; L463-L511 HydrophobicContact CD2-CD2 4.19Å; W466-L511 HydrophobicContact CZ3-CD1 4.31Å; C507-L511 WeakPolarHBondContact O-CB 3.26Å; C507-L511 PolarHBondContact O-N 2.71Å; Q508-L511 PolarHBondContact O-N 3.47Å; E509-L511 VanDerWaalsContact C-N 3.3Å; E509-L511 PolarHBondContact O-N 2.92Å; L511-K515 WeakPolarHBondContact O-CB 3.14Å; L511-K515 PolarHBondContact O-N 3.22Å
512	Q	78.1	Confident	75.3	Confident	102 Å²	102	78.6 Å²	78.6	48%	0.477	37%	0.371	S	S	.	.	H	α-helix	trans	-75.2	-40.9	-178	-168.4	151.7	-56.3	0	0	112.2	Q508 E509 K514 K515 Q516	Q508-Q512 WeakPolarHBondContact O-CB 3.25Å; Q508-Q512 PolarHBondContact O-N 3Å; E509-Q512 PolarHBondContact O-N 2.95Å; Q512-K514 VanDerWaalsContact C-N 3.34Å; Q512-K514 PolarHBondContact O-N 3.19Å; Q512-K515 PolarHBondContact O-N 3.33Å; Q512-Q516 PolarHBondContact O-N 3.43Å; Q512-Q516 VanDerWaalsContact O-N 3.1Å
513	E	75.1	Confident	75.7	Confident	135 Å²	135	77.8 Å²	77.8	63%	0.631	37%	0.367	S	S	*	.	H	α-helix	trans	-57.4	-46	169.9	-68.2	179.3	162.7	0	0	111.4	E509 K515 Q516 L517	E509-E513 PolarHBondContact O-N 2.6Å; E513-K515 VanDerWaalsContact C-N 3.34Å; E513-K515 PolarHBondContact O-N 2.94Å; E513-Q516 PolarHBondContact O-N 2.81Å; E513-L517 PolarHBondContact O-N 2.97Å
514	K	72.1	Confident	76.1	Confident	108 Å²	108	77.3 Å²	77.3	47%	0.47	37%	0.365	S	S	.	.	H	α-helix	trans	-68.7	-29.3	178.6	-73.9	179.2	179	-179.6	0	113.4	L447 M450 A510 Q512 L518	L447-K514 HydrophobicContact CD2-CD 4.45Å; M450-K514 HydrophobicContact CE-CB 4.09Å; M450-K514 HydrophobicContact CE-CD 4.17Å; A510-K514 WeakPolarHBondContact O-CB 3.4Å; A510-K514 VanDerWaalsContact O-CG 3.32Å; A510-K514 WeakPolarHBondContact O-CG 3.48Å; A510-K514 PolarHBondContact O-N 3.34Å; Q512-K514 VanDerWaalsContact C-N 3.34Å; Q512-K514 PolarHBondContact O-N 3.19Å; K514-L518 WeakPolarHBondContact O-CB 3.46Å; K514-L518 PolarHBondContact O-N 3.1Å
515	K	78.1	Confident	75.9	Confident	83 Å²	83	80.9 Å²	80.9	36%	0.361	38%	0.383	S	S	.	.	H	α-helix	trans	-65.6	-44.6	171.5	-178.6	179.5	171.3	-179.2	0	111.2	L511 Q512 E513 L518 E519	L511-K515 WeakPolarHBondContact O-CB 3.14Å; L511-K515 PolarHBondContact O-N 3.22Å; Q512-K515 PolarHBondContact O-N 3.33Å; E513-K515 VanDerWaalsContact C-N 3.34Å; E513-K515 PolarHBondContact O-N 2.94Å; K515-L518 PolarHBondContact O-N 3.08Å; K515-E519 WeakPolarHBondContact CE-OE1 3.37Å; K515-E519 IonicContact NZ-OE1 3.17Å; K515-E519 WeakPolarHBondContact O-CG 3.25Å; K515-E519 PolarHBondContact O-N 2.97Å
516	Q	78.3	Confident	76.3	Confident	116 Å²	116	81.5 Å²	81.5	54%	0.542	39%	0.386	S	S	.	.	H	α-helix	trans	-61	-46.9	176	-70.2	174.1	-21.6	0	0	111.2	Q512 E513 L518 E519 E520	Q512-Q516 PolarHBondContact O-N 3.43Å; Q512-Q516 VanDerWaalsContact O-N 3.1Å; E513-Q516 PolarHBondContact O-N 2.81Å; Q516-L518 VanDerWaalsContact C-N 3.27Å; Q516-L518 PolarHBondContact O-N 2.99Å; Q516-E519 PolarHBondContact O-N 3.31Å; Q516-E519 VanDerWaalsContact O-N 3.11Å; Q516-E520 PolarHBondContact O-N 3.48Å
517	L	76.8	Confident	76.9	Confident	97 Å²	97	84.9 Å²	84.9	51%	0.508	40%	0.396	S	S	.	.	H	α-helix	trans	-56.9	-39.3	174.8	-169.1	77.9	0	0	0	112.5	E513 K521	E513-L517 PolarHBondContact O-N 2.97Å; L517-K521 VanDerWaalsContact O-CG 3.29Å; L517-K521 WeakPolarHBondContact O-CG 3.48Å; L517-K521 PolarHBondContact O-N 2.68Å; L517-K521 VanDerWaalsContact O-N 3.07Å
518	L	74.5	Confident	77.3	Confident	44 Å²	44	87.9 Å²	87.9	23%	0.23	41%	0.409	C	S	.	.	H	α-helix	trans	-67.5	-39.6	176.8	-173.8	69.9	0	0	0	112.1	P455 K514 K515 Q516 K521 D522	P455-L518 HydrophobicContact CB-CD2 4.34Å; P455-L518 HydrophobicContact CG-CD1 3.94Å; P455-L518 HydrophobicContact CG-CD2 3.96Å; K514-L518 WeakPolarHBondContact O-CB 3.46Å; K514-L518 PolarHBondContact O-N 3.1Å; K515-L518 PolarHBondContact O-N 3.08Å; Q516-L518 VanDerWaalsContact C-N 3.27Å; Q516-L518 PolarHBondContact O-N 2.99Å; L518-K521 PolarHBondContact O-N 2.9Å; L518-D522 WeakPolarHBondContact O-CB 3.37Å; L518-D522 PolarHBondContact O-N 3.16Å
519	E	78.8	Confident	77.5	Confident	100 Å²	100	93.1 Å²	93.1	47%	0.467	43%	0.426	S	S	.	.	H	α-helix	trans	-68.2	-37	178.5	-73.1	172.1	-172.7	0	0	112	K515 Q516 E523	K515-E519 WeakPolarHBondContact CE-OE1 3.37Å; K515-E519 IonicContact NZ-OE1 3.17Å; K515-E519 WeakPolarHBondContact O-CG 3.25Å; K515-E519 PolarHBondContact O-N 2.97Å; Q516-E519 PolarHBondContact O-N 3.31Å; Q516-E519 VanDerWaalsContact O-N 3.11Å; E519-E523 PolarHBondContact O-N 3.4Å; E519-E523 VanDerWaalsContact O-N 3.16Å
520	E	78.5	Confident	78.1	Confident	121 Å²	121	95.2 Å²	95.2	57%	0.565	43%	0.43	S	S	*	.	H	α-helix	trans	-61.2	-45.7	169.2	-70.3	-177.9	161	0	0	111.9	Q516 E523 E524	Q516-E520 PolarHBondContact O-N 3.48Å; E520-E523 PolarHBondContact O-N 3.14Å; E520-E523 VanDerWaalsContact O-N 3.17Å; E520-E524 PolarHBondContact O-N 2.69Å
521	K	72.6	Confident	78.5	Confident	89 Å²	89	99.4 Å²	99.4	39%	0.387	44%	0.444	S	S	.	.	H	α-helix	trans	-70.6	-35.1	179.8	-66.2	-61.9	167.7	-154.1	0	113.4	L517 L518 E523 E524 L525	L517-K521 VanDerWaalsContact O-CG 3.29Å; L517-K521 WeakPolarHBondContact O-CG 3.48Å; L517-K521 PolarHBondContact O-N 2.68Å; L517-K521 VanDerWaalsContact O-N 3.07Å; L518-K521 PolarHBondContact O-N 2.9Å; K521-E523 VanDerWaalsContact C-N 3.26Å; K521-E523 PolarHBondContact O-N 3.42Å; K521-E524 VanDerWaalsContact CD-OE2 3.27Å; K521-E524 WeakPolarHBondContact CD-OE2 3.37Å; K521-E524 IonicContact NZ-OE1 2.72Å; K521-E524 PolarHBondContact NZ-OE1 3.17Å; K521-E524 IonicContact NZ-OE2 3.61Å; K521-E524 PolarHBondContact NZ-OE2 3.01Å; K521-E524 PolarHBondContact O-N 2.93Å; K521-L525 WeakPolarHBondContact O-CB 3.37Å; K521-L525 VanDerWaalsContact O-CG 3.29Å; K521-L525 WeakPolarHBondContact O-CG 3.29Å; K521-L525 PolarHBondContact O-N 2.96Å
522	D	74.5	Confident	78.8	Confident	37 Å²	37	102.8 Å²	102.8	20%	0.198	47%	0.465	C	S	.	.	H	α-helix	trans	-61.2	-35.2	169.7	-93.8	-9.6	0	0	0	110.9	R460 L518 R526	R460-D522 IonicContact CZ-OD2 3.16Å; R460-D522 IonicContact NH1-OD2 2.73Å; R460-D522 PolarHBondContact NH1-OD2 3.06Å; R460-D522 IonicContact NH2-OD2 2.93Å; R460-D522 PolarHBondContact NH2-OD2 3.03Å; L518-D522 WeakPolarHBondContact O-CB 3.37Å; L518-D522 PolarHBondContact O-N 3.16Å; D522-R526 WeakPolarHBondContact O-CG 3.49Å; D522-R526 PolarHBondContact O-N 3.44Å
523	E	82.3	Confident	79.2	Confident	69 Å²	69	103.9 Å²	103.9	32%	0.322	47%	0.47	S	S	.	.	H	α-helix	trans	-78.3	-35.6	175.8	-174.9	52.2	-148.2	0	0	114.1	E519 E520 K521 L525 R526 R527 R530	E519-E523 PolarHBondContact O-N 3.4Å; E519-E523 VanDerWaalsContact O-N 3.16Å; E520-E523 PolarHBondContact O-N 3.14Å; E520-E523 VanDerWaalsContact O-N 3.17Å; K521-E523 VanDerWaalsContact C-N 3.26Å; K521-E523 PolarHBondContact O-N 3.42Å; E523-L525 VanDerWaalsContact C-N 3.29Å; E523-L525 PolarHBondContact O-N 3.43Å; E523-R526 PolarHBondContact O-N 2.99Å; E523-R526 WeakPolarHBondContact OE2-CD 3.49Å; E523-R526 IonicContact OE2-CZ 3.14Å; E523-R526 IonicContact OE2-NE 2.59Å; E523-R526 IonicContact OE2-NH1 2.61Å; E523-R526 PolarHBondContact OE2-NH1 3.02Å; E523-R527 WeakPolarHBondContact O-CB 3.28Å; E523-R527 PolarHBondContact O-N 3.48Å; E523-R530 IonicContact OE1-CZ 3.96Å; E523-R530 IonicContact OE1-NH2 3.62Å; E523-R530 PolarHBondContact OE1-NH2 3.34Å
524	E	79.1	Confident	79.9	Confident	89 Å²	89	103.5 Å²	103.5	42%	0.416	47%	0.466	S	S	.	.	H	α-helix	trans	-56.5	-45.1	167	-77.6	179.5	-163.7	0	0	110.9	E520 K521 R526 R527 I528	E520-E524 PolarHBondContact O-N 2.69Å; K521-E524 VanDerWaalsContact CD-OE2 3.27Å; K521-E524 WeakPolarHBondContact CD-OE2 3.37Å; K521-E524 IonicContact NZ-OE1 2.72Å; K521-E524 PolarHBondContact NZ-OE1 3.17Å; K521-E524 IonicContact NZ-OE2 3.61Å; K521-E524 PolarHBondContact NZ-OE2 3.01Å; K521-E524 PolarHBondContact O-N 2.93Å; E524-R526 PolarHBondContact O-N 3Å; E524-R527 WeakPolarHBondContact O-CB 3.28Å; E524-R527 PolarHBondContact O-N 3.04Å; E524-R527 VanDerWaalsContact O-N 3.15Å; E524-I528 WeakPolarHBondContact O-CG1 3.05Å; E524-I528 PolarHBondContact O-N 2.72Å
525	L	70.6	Confident	80.3	Confident	81 Å²	81	103.2 Å²	103.2	42%	0.424	47%	0.469	S	S	.	.	H	α-helix	trans	-64.3	-38.8	176.2	-71.9	171.1	0	0	0	112.4	K521 E523 R527 R529	K521-L525 WeakPolarHBondContact O-CB 3.37Å; K521-L525 VanDerWaalsContact O-CG 3.29Å; K521-L525 WeakPolarHBondContact O-CG 3.29Å; K521-L525 PolarHBondContact O-N 2.96Å; E523-L525 VanDerWaalsContact C-N 3.29Å; E523-L525 PolarHBondContact O-N 3.43Å; L525-R527 VanDerWaalsContact C-N 3.32Å; L525-R529 WeakPolarHBondContact O-CB 3.36Å; L525-R529 VanDerWaalsContact O-CG 3.25Å; L525-R529 WeakPolarHBondContact O-CG 3.41Å; L525-R529 PolarHBondContact O-N 3.01Å
526	R	82.8	Confident	80.4	Confident	122 Å²	122	103.4 Å²	103.4	46%	0.46	47%	0.474	S	S	.	.	H	α-helix	trans	-64.8	-34.1	171.8	-72.7	-178.2	-141.9	104.1	4.7	112.4	D522 E523 E524 R530	D522-R526 WeakPolarHBondContact O-CG 3.49Å; D522-R526 PolarHBondContact O-N 3.44Å; E523-R526 PolarHBondContact O-N 2.99Å; E523-R526 WeakPolarHBondContact OE2-CD 3.49Å; E523-R526 IonicContact OE2-CZ 3.14Å; E523-R526 IonicContact OE2-NE 2.59Å; E523-R526 IonicContact OE2-NH1 2.61Å; E523-R526 PolarHBondContact OE2-NH1 3.02Å; E524-R526 PolarHBondContact O-N 3Å; R526-R530 WeakPolarHBondContact O-CG 3.23Å; R526-R530 PolarHBondContact O-N 3.11Å; R526-R530 PolarHBondContact O-NE 3.11Å
527	R	88.4	Confident	80.8	Confident	156 Å²	156	101.2 Å²	101.2	59%	0.589	47%	0.466	S	S	*	.	H	α-helix	trans	-68	-51.6	175.5	-172	-174.6	-58.4	-133.8	1.6	111.2	E523 E524 L525 R529 R530 E531	E523-R527 WeakPolarHBondContact O-CB 3.28Å; E523-R527 PolarHBondContact O-N 3.48Å; E524-R527 WeakPolarHBondContact O-CB 3.28Å; E524-R527 PolarHBondContact O-N 3.04Å; E524-R527 VanDerWaalsContact O-N 3.15Å; L525-R527 VanDerWaalsContact C-N 3.32Å; R527-R529 VanDerWaalsContact C-N 3.32Å; R527-R529 PolarHBondContact O-N 3.32Å; R527-R530 PolarHBondContact O-N 3.05Å; R527-E531 PolarHBondContact O-N 3Å
528	I	80.8	Confident	81.2	Confident	92 Å²	92	99.7 Å²	99.7	47%	0.472	46%	0.456	S	S	.	.	H	α-helix	trans	-60.4	-41.1	179.9	-66.8	164.2	0	0	0	110.9	E524 R530 E531 V532	E524-I528 WeakPolarHBondContact O-CG1 3.05Å; E524-I528 PolarHBondContact O-N 2.72Å; I528-R530 PolarHBondContact O-N 3.5Å; I528-E531 PolarHBondContact O-N 3.28Å; I528-V532 HydrophobicContact CG2-CG2 4.33Å; I528-V532 WeakPolarHBondContact O-CG2 3.43Å; I528-V532 PolarHBondContact O-N 3.48Å
529	R	79.3	Confident	81.3	Confident	188 Å²	188	104.4 Å²	104.4	71%	0.709	47%	0.474	S	S	*	.	H	α-helix	trans	-58	-47.4	175.4	-77.3	171.9	-179.1	-111.7	2.2	112.7	L525 R527 E531 V532 E533	L525-R529 WeakPolarHBondContact O-CB 3.36Å; L525-R529 VanDerWaalsContact O-CG 3.25Å; L525-R529 WeakPolarHBondContact O-CG 3.41Å; L525-R529 PolarHBondContact O-N 3.01Å; R527-R529 VanDerWaalsContact C-N 3.32Å; R527-R529 PolarHBondContact O-N 3.32Å; R529-E531 VanDerWaalsContact C-N 3.3Å; R529-E531 PolarHBondContact O-N 2.97Å; R529-V532 PolarHBondContact O-N 2.93Å; R529-E533 WeakPolarHBondContact O-CB 3.39Å; R529-E533 PolarHBondContact O-N 3.32Å
530	R	89.8	Confident	81.5	Confident	133 Å²	133	106.8 Å²	106.8	50%	0.502	48%	0.479	S	S	.	.	H	α-helix	trans	-62.4	-36.3	176.7	-74.4	174.5	-75.8	159.2	-13.1	112.6	E523 R526 R527 I528 K534	E523-R530 IonicContact OE1-CZ 3.96Å; E523-R530 IonicContact OE1-NH2 3.62Å; E523-R530 PolarHBondContact OE1-NH2 3.34Å; R526-R530 WeakPolarHBondContact O-CG 3.23Å; R526-R530 PolarHBondContact O-N 3.11Å; R526-R530 PolarHBondContact O-NE 3.11Å; R527-R530 PolarHBondContact O-N 3.05Å; I528-R530 PolarHBondContact O-N 3.5Å; R530-K534 WeakPolarHBondContact O-CB 3.48Å; R530-K534 PolarHBondContact O-N 2.92Å
531	E	84.5	Confident	81.9	Confident	120 Å²	120	106 Å²	106	56%	0.561	48%	0.479	S	S	*	.	H	α-helix	trans	-73.1	-40.1	179.2	-169.3	159.2	-155.3	0	0	112.1	R527 I528 R529 K534 L535	R527-E531 PolarHBondContact O-N 3Å; I528-E531 PolarHBondContact O-N 3.28Å; R529-E531 VanDerWaalsContact C-N 3.3Å; R529-E531 PolarHBondContact O-N 2.97Å; E531-K534 PolarHBondContact O-N 3.28Å; E531-L535 VanDerWaalsContact O-CG 3.3Å; E531-L535 WeakPolarHBondContact O-CG 3.43Å; E531-L535 PolarHBondContact O-N 3.18Å
532	V	79.4	Confident	82.2	Confident	77 Å²	77	109.9 Å²	109.9	47%	0.467	49%	0.491	S	S	.	.	H	α-helix	trans	-62.3	-43.5	170.8	170.1	0	0	0	0	111.4	I528 R529 L535 L536	I528-V532 HydrophobicContact CG2-CG2 4.33Å; I528-V532 WeakPolarHBondContact O-CG2 3.43Å; I528-V532 PolarHBondContact O-N 3.48Å; R529-V532 PolarHBondContact O-N 2.93Å; V532-L535 PolarHBondContact O-N 3.22Å; V532-L536 HydrophobicContact CG1-CD1 4.13Å; V532-L536 HydrophobicContact CG1-CG 4.49Å; V532-L536 WeakPolarHBondContact O-CG 3.29Å; V532-L536 PolarHBondContact O-N 2.86Å
533	E	86.8	Confident	82.3	Confident	124 Å²	124	111.2 Å²	111.2	58%	0.579	50%	0.5	S	S	*	.	H	α-helix	trans	-60.8	-47.1	177.7	-171.3	162	-131.8	0	0	111.6	R529 L535 L536 D537	R529-E533 WeakPolarHBondContact O-CB 3.39Å; R529-E533 PolarHBondContact O-N 3.32Å; E533-L535 VanDerWaalsContact C-N 3.33Å; E533-L535 PolarHBondContact O-N 3.35Å; E533-L536 WeakPolarHBondContact O-CB 3.48Å; E533-L536 PolarHBondContact O-N 3.29Å; E533-L536 VanDerWaalsContact O-N 3.14Å; E533-D537 PolarHBondContact O-N 3.25Å
534	K	89.6	Confident	82.6	Confident	128 Å²	128	112.5 Å²	112.5	56%	0.557	51%	0.509	S	S	*	.	H	α-helix	trans	-57.9	-41.8	172.8	-177.2	176.3	179.9	-74.3	0	112.8	R530 E531 L536 D537 E538	R530-K534 WeakPolarHBondContact O-CB 3.48Å; R530-K534 PolarHBondContact O-N 2.92Å; E531-K534 PolarHBondContact O-N 3.28Å; K534-L536 VanDerWaalsContact C-N 3.34Å; K534-D537 PolarHBondContact O-N 2.82Å; K534-E538 IonicContact NZ-OE1 2.83Å; K534-E538 PolarHBondContact NZ-OE1 2.91Å; K534-E538 PolarHBondContact O-N 3.44Å
535	L	81.5	Confident	82.9	Confident	102 Å²	102	110.9 Å²	110.9	53%	0.534	51%	0.511	S	S	.	.	H	α-helix	trans	-68.7	-30.9	177.6	-72.7	169.5	0	0	0	112.7	E531 V532 E533 K539	E531-L535 VanDerWaalsContact O-CG 3.3Å; E531-L535 WeakPolarHBondContact O-CG 3.43Å; E531-L535 PolarHBondContact O-N 3.18Å; V532-L535 PolarHBondContact O-N 3.22Å; E533-L535 VanDerWaalsContact C-N 3.33Å; E533-L535 PolarHBondContact O-N 3.35Å; L535-K539 WeakPolarHBondContact O-CB 3.4Å; L535-K539 PolarHBondContact O-N 2.78Å
536	L	79.4	Confident	83	Confident	87 Å²	87	110.6 Å²	110.6	46%	0.455	51%	0.512	S	S	.	.	H	α-helix	trans	-69.2	-39.2	172.6	-71.2	170.2	0	0	0	111.7	V532 E533 K534 K539 R540	V532-L536 HydrophobicContact CG1-CD1 4.13Å; V532-L536 HydrophobicContact CG1-CG 4.49Å; V532-L536 WeakPolarHBondContact O-CG 3.29Å; V532-L536 PolarHBondContact O-N 2.86Å; E533-L536 WeakPolarHBondContact O-CB 3.48Å; E533-L536 PolarHBondContact O-N 3.29Å; E533-L536 VanDerWaalsContact O-N 3.14Å; K534-L536 VanDerWaalsContact C-N 3.34Å; L536-K539 WeakPolarHBondContact O-CB 3.26Å; L536-K539 PolarHBondContact O-N 3.49Å; L536-R540 WeakPolarHBondContact O-CG 3.45Å; L536-R540 PolarHBondContact O-N 2.97Å
537	D	86.6	Confident	82.8	Confident	70 Å²	70	109.4 Å²	109.4	37%	0.374	51%	0.512	S	S	.	.	H	α-helix	trans	-70.4	-40.3	174.6	-74.5	-24.9	0	0	0	112.7	E533 K534 K539 R540 N541	E533-D537 PolarHBondContact O-N 3.25Å; K534-D537 PolarHBondContact O-N 2.82Å; D537-K539 PolarHBondContact O-N 3.06Å; D537-R540 PolarHBondContact O-N 3.37Å; D537-R540 WeakPolarHBondContact OD1-CD 3.38Å; D537-R540 IonicContact OD1-CZ 2.87Å; D537-R540 IonicContact OD1-NE 3.47Å; D537-R540 IonicContact OD1-NH1 2.77Å; D537-R540 PolarHBondContact OD1-NH1 3.14Å; D537-N541 WeakPolarHBondContact O-CB 3.36Å; D537-N541 VanDerWaalsContact O-CG 3.24Å; D537-N541 PolarHBondContact O-N 3.27Å; D537-N541 PolarHBondContact O-ND2 3.2Å
538	E	85.7	Confident	82.8	Confident	64 Å²	64	107.1 Å²	107.1	30%	0.299	51%	0.508	S	S	.	.	H	α-helix	trans	-59.3	-35.9	169.7	-77.2	-173.3	-144.4	0	0	112.2	K534 R542	K534-E538 IonicContact NZ-OE1 2.83Å; K534-E538 PolarHBondContact NZ-OE1 2.91Å; K534-E538 PolarHBondContact O-N 3.44Å; E538-R542 VanDerWaalsContact O-CG 3.27Å; E538-R542 WeakPolarHBondContact O-CG 3.49Å; E538-R542 PolarHBondContact O-N 2.98Å; E538-R542 IonicContact OE2-NH2 2.68Å; E538-R542 PolarHBondContact OE2-NH2 3.04Å
539	K	77	Confident	82.9	Confident	143 Å²	143	107.6 Å²	107.6	62%	0.622	51%	0.508	S	S	*	.	H	α-helix	trans	-68.2	-45.4	174.1	-173.9	-177.8	177.8	-175.3	0	111.7	L535 L536 D537 N541 R542 V543	L535-K539 WeakPolarHBondContact O-CB 3.4Å; L535-K539 PolarHBondContact O-N 2.78Å; L536-K539 WeakPolarHBondContact O-CB 3.26Å; L536-K539 PolarHBondContact O-N 3.49Å; D537-K539 PolarHBondContact O-N 3.06Å; K539-N541 PolarHBondContact O-N 3.04Å; K539-R542 PolarHBondContact O-N 3.37Å; K539-V543 WeakPolarHBondContact O-CG2 3.47Å; K539-V543 PolarHBondContact O-N 3.46Å
540	R	82.5	Confident	82.7	Confident	150 Å²	150	105.1 Å²	105.1	57%	0.566	50%	0.503	S	S	*	.	H	α-helix	trans	-55.8	-49.9	175.3	-74.4	166.1	175.1	148.5	-2.6	111	L536 D537 R542 V543 L544	L536-R540 WeakPolarHBondContact O-CG 3.45Å; L536-R540 PolarHBondContact O-N 2.97Å; D537-R540 PolarHBondContact O-N 3.37Å; D537-R540 WeakPolarHBondContact OD1-CD 3.38Å; D537-R540 IonicContact OD1-CZ 2.87Å; D537-R540 IonicContact OD1-NE 3.47Å; D537-R540 IonicContact OD1-NH1 2.77Å; D537-R540 PolarHBondContact OD1-NH1 3.14Å; R540-R542 VanDerWaalsContact C-N 3.31Å; R540-R542 PolarHBondContact O-N 3.07Å; R540-V543 PolarHBondContact O-N 3.38Å; R540-V543 VanDerWaalsContact O-N 3.11Å; R540-L544 WeakPolarHBondContact O-CG 3.47Å; R540-L544 PolarHBondContact O-N 3.3Å
541	N	87.1	Confident	82.3	Confident	106 Å²	106	102.7 Å²	102.7	57%	0.567	50%	0.497	S	S	*	.	H	α-helix	trans	-62.3	-36.1	-179.3	-67.2	-19.3	0	0	0	112.6	D537 K539 A545	D537-N541 WeakPolarHBondContact O-CB 3.36Å; D537-N541 VanDerWaalsContact O-CG 3.24Å; D537-N541 PolarHBondContact O-N 3.27Å; D537-N541 PolarHBondContact O-ND2 3.2Å; K539-N541 PolarHBondContact O-N 3.04Å; N541-A545 WeakPolarHBondContact O-CB 3.3Å; N541-A545 PolarHBondContact O-N 3.3Å
542	R	77.6	Confident	82.1	Confident	169 Å²	169	102.9 Å²	102.9	64%	0.638	49%	0.493	S	S	*	.	H	α-helix	trans	-68.5	-38.1	173.7	-70.4	174.1	-157.2	-158.7	8.9	112.6	E538 K539 R540 A545 T546	E538-R542 VanDerWaalsContact O-CG 3.27Å; E538-R542 WeakPolarHBondContact O-CG 3.49Å; E538-R542 PolarHBondContact O-N 2.98Å; E538-R542 IonicContact OE2-NH2 2.68Å; E538-R542 PolarHBondContact OE2-NH2 3.04Å; K539-R542 PolarHBondContact O-N 3.37Å; R540-R542 VanDerWaalsContact C-N 3.31Å; R540-R542 PolarHBondContact O-N 3.07Å; R542-A545 PolarHBondContact O-N 3.3Å; R542-T546 WeakPolarHBondContact O-CG2 3.34Å; R542-T546 PolarHBondContact O-N 3.42Å; R542-T546 VanDerWaalsContact O-N 3.11Å
543	V	77.3	Confident	81.8	Confident	65 Å²	65	102 Å²	102	39%	0.394	49%	0.49	S	S	.	.	H	α-helix	trans	-62.8	-51.6	175.6	172.7	0	0	0	0	110.2	K539 R540 A545 T546 E547	K539-V543 WeakPolarHBondContact O-CG2 3.47Å; K539-V543 PolarHBondContact O-N 3.46Å; R540-V543 PolarHBondContact O-N 3.38Å; R540-V543 VanDerWaalsContact O-N 3.11Å; V543-A545 VanDerWaalsContact C-N 3.32Å; V543-A545 PolarHBondContact O-N 3.47Å; V543-T546 CarbonylContact O-C 3.55Å; V543-T546 WeakPolarHBondContact O-CA 3.19Å; V543-T546 PolarHBondContact O-N 3.43Å; V543-T546 PolarHBondContact O-OG1 3.44Å; V543-E547 PolarHBondContact O-N 3.04Å
544	L	88.4	Confident	81.7	Confident	96 Å²	96	101.9 Å²	101.9	50%	0.503	48%	0.484	S	S	.	.	H	α-helix	trans	-55.6	-44.3	177.3	-67.8	171.1	0	0	0	112.1	R540 T546 E547 E548	R540-L544 WeakPolarHBondContact O-CG 3.47Å; R540-L544 PolarHBondContact O-N 3.3Å; L544-T546 VanDerWaalsContact C-N 3.3Å; L544-T546 PolarHBondContact O-N 2.99Å; L544-E547 PolarHBondContact O-N 3.28Å; L544-E548 PolarHBondContact O-N 3.49Å
545	A	86.1	Confident	81.6	Confident	55 Å²	55	99.2 Å²	99.2	46%	0.455	48%	0.476	S	S	.	.	H	α-helix	trans	-60.9	-36	175.4	0	0	0	0	0	113.1	N541 R542 V543 E547 E549	N541-A545 WeakPolarHBondContact O-CB 3.3Å; N541-A545 PolarHBondContact O-N 3.3Å; R542-A545 PolarHBondContact O-N 3.3Å; V543-A545 VanDerWaalsContact C-N 3.32Å; V543-A545 PolarHBondContact O-N 3.47Å; A545-E547 VanDerWaalsContact C-N 3.33Å; A545-E549 WeakPolarHBondContact O-CB 3.44Å; A545-E549 PolarHBondContact O-N 2.62Å; A545-E549 VanDerWaalsContact O-N 3.11Å
546	T	72.7	Confident	81.5	Confident	75 Å²	75	100 Å²	100	46%	0.46	48%	0.477	S	S	.	.	H	α-helix	trans	-75.2	-19.8	173.8	62.6	0	0	0	0	113.9	R542 V543 L544 K550	R542-T546 WeakPolarHBondContact O-CG2 3.34Å; R542-T546 PolarHBondContact O-N 3.42Å; R542-T546 VanDerWaalsContact O-N 3.11Å; V543-T546 CarbonylContact O-C 3.55Å; V543-T546 WeakPolarHBondContact O-CA 3.19Å; V543-T546 PolarHBondContact O-N 3.43Å; V543-T546 PolarHBondContact O-OG1 3.44Å; L544-T546 VanDerWaalsContact C-N 3.3Å; L544-T546 PolarHBondContact O-N 2.99Å; T546-K550 WeakPolarHBondContact O-CD 3.27Å; T546-K550 WeakPolarHBondContact O-CG 3.5Å; T546-K550 PolarHBondContact O-N 3.18Å
547	E	79.3	Confident	81.3	Confident	98 Å²	98	99.7 Å²	99.7	46%	0.458	48%	0.478	S	S	.	.	H	α-helix	trans	-81.3	-41.4	173.8	-70.6	173	162.4	0	0	110.9	V543 L544 A545 E549 K550 E551	V543-E547 PolarHBondContact O-N 3.04Å; L544-E547 PolarHBondContact O-N 3.28Å; A545-E547 VanDerWaalsContact C-N 3.33Å; E547-E549 VanDerWaalsContact C-N 3.34Å; E547-E549 PolarHBondContact O-N 3.37Å; E547-K550 PolarHBondContact O-N 2.99Å; E547-E551 PolarHBondContact O-N 3.05Å
548	E	87.8	Confident	81.3	Confident	108 Å²	108	100.8 Å²	100.8	51%	0.505	48%	0.481	S	S	.	.	H	α-helix	trans	-56.5	-45.6	168.2	-76.1	-170.6	-146.2	0	0	112.1	L544 K550 E551 R552	L544-E548 PolarHBondContact O-N 3.49Å; E548-K550 VanDerWaalsContact C-N 3.32Å; E548-K550 PolarHBondContact O-N 2.7Å; E548-E551 PolarHBondContact O-N 2.93Å; E548-R552 WeakPolarHBondContact O-CB 3.47Å; E548-R552 VanDerWaalsContact O-CG 3.24Å; E548-R552 WeakPolarHBondContact O-CG 3.48Å; E548-R552 PolarHBondContact O-N 3.2Å; E548-R552 IonicContact OE2-CZ 3.38Å; E548-R552 IonicContact OE2-NH2 2.81Å; E548-R552 PolarHBondContact OE2-NH2 3.43Å
549	E	82.9	Confident	81.2	Confident	101 Å²	101	103.1 Å²	103.1	47%	0.472	49%	0.492	S	S	.	.	H	α-helix	trans	-69.1	-31.2	-178.2	-159.6	66.2	-173.2	0	0	112.4	A545 E547 R552 S553	A545-E549 WeakPolarHBondContact O-CB 3.44Å; A545-E549 PolarHBondContact O-N 2.62Å; A545-E549 VanDerWaalsContact O-N 3.11Å; E547-E549 VanDerWaalsContact C-N 3.34Å; E547-E549 PolarHBondContact O-N 3.37Å; E549-R552 WeakPolarHBondContact OE2-CD 3.27Å; E549-R552 IonicContact OE2-CZ 3.78Å; E549-R552 IonicContact OE2-NE 3.62Å; E549-R552 IonicContact OE2-NH1 3.65Å; E549-R552 PolarHBondContact OE2-NH1 3.49Å; E549-S553 WeakPolarHBondContact O-CB 3.42Å; E549-S553 PolarHBondContact O-N 3.09Å; E549-S553 PolarHBondContact O-OG 3.18Å
550	K	74.1	Confident	81.4	Confident	136 Å²	136	101.5 Å²	101.5	59%	0.591	49%	0.489	S	S	*	.	H	α-helix	trans	-66.3	-45.8	169.8	-76.3	166.1	-171.6	168.3	0	111.7	T546 E547 E548 S553 R554	T546-K550 WeakPolarHBondContact O-CD 3.27Å; T546-K550 WeakPolarHBondContact O-CG 3.5Å; T546-K550 PolarHBondContact O-N 3.18Å; E547-K550 PolarHBondContact O-N 2.99Å; E548-K550 VanDerWaalsContact C-N 3.32Å; E548-K550 PolarHBondContact O-N 2.7Å; K550-S553 WeakPolarHBondContact O-CB 3.24Å; K550-S553 PolarHBondContact O-N 2.87Å; K550-R554 WeakPolarHBondContact O-CB 3.37Å; K550-R554 PolarHBondContact O-N 3.28Å
551	E	81.9	Confident	81.4	Confident	82 Å²	82	98.8 Å²	98.8	38%	0.383	49%	0.49	S	S	.	.	H	α-helix	trans	-69.5	-35.9	-179.3	-169	63.7	-170.4	0	0	111.5	E547 E548 S553 R554 I555	E547-E551 PolarHBondContact O-N 3.05Å; E548-E551 PolarHBondContact O-N 2.93Å; E551-S553 PolarHBondContact O-N 2.87Å; E551-R554 VanDerWaalsContact CD-NH1 3.29Å; E551-R554 PolarHBondContact O-N 3.16Å; E551-R554 IonicContact OE1-CZ 3.76Å; E551-R554 IonicContact OE1-NH1 2.71Å; E551-R554 PolarHBondContact OE1-NH1 2.89Å; E551-R554 WeakPolarHBondContact OE2-CD 3.37Å; E551-R554 IonicContact OE2-CZ 2.96Å; E551-R554 IonicContact OE2-NH1 3.74Å; E551-R554 PolarHBondContact OE2-NH1 3.29Å; E551-I555 HydrophobicContact CG-CD1 4.18Å; E551-I555 WeakPolarHBondContact O-CB 3.48Å; E551-I555 VanDerWaalsContact O-CG1 3.27Å; E551-I555 WeakPolarHBondContact O-CG1 3.45Å; E551-I555 PolarHBondContact O-N 3.22Å
552	R	81.1	Confident	81	Confident	125 Å²	125	97.6 Å²	97.6	47%	0.472	49%	0.49	S	S	.	.	H	α-helix	trans	-58.8	-45.9	168.1	-69.8	168	-165.1	175.5	1.8	111.6	E548 E549 R554 I555 Q556	E548-R552 WeakPolarHBondContact O-CB 3.47Å; E548-R552 VanDerWaalsContact O-CG 3.24Å; E548-R552 WeakPolarHBondContact O-CG 3.48Å; E548-R552 PolarHBondContact O-N 3.2Å; E548-R552 IonicContact OE2-CZ 3.38Å; E548-R552 IonicContact OE2-NH2 2.81Å; E548-R552 PolarHBondContact OE2-NH2 3.43Å; E549-R552 WeakPolarHBondContact OE2-CD 3.27Å; E549-R552 IonicContact OE2-CZ 3.78Å; E549-R552 IonicContact OE2-NE 3.62Å; E549-R552 IonicContact OE2-NH1 3.65Å; E549-R552 PolarHBondContact OE2-NH1 3.49Å; R552-R554 VanDerWaalsContact C-N 3.34Å; R552-I555 PolarHBondContact O-N 2.86Å; R552-Q556 WeakPolarHBondContact O-CG 3.45Å; R552-Q556 PolarHBondContact O-N 3.23Å
553	S	72.6	Confident	81.1	Confident	59 Å²	59	94.9 Å²	94.9	41%	0.413	48%	0.484	S	S	.	.	H	α-helix	trans	-61.8	-42.7	176.6	-59.6	0	0	0	0	111.5	E549 K550 E551 Q556 T557	E549-S553 WeakPolarHBondContact O-CB 3.42Å; E549-S553 PolarHBondContact O-N 3.09Å; E549-S553 PolarHBondContact O-OG 3.18Å; K550-S553 WeakPolarHBondContact O-CB 3.24Å; K550-S553 PolarHBondContact O-N 2.87Å; E551-S553 PolarHBondContact O-N 2.87Å; S553-Q556 WeakPolarHBondContact O-CB 3.5Å; S553-Q556 PolarHBondContact O-N 2.94Å; S553-T557 PolarHBondContact O-N 3.39Å
554	R	85.6	Confident	81	Confident	120 Å²	120	93.8 Å²	93.8	45%	0.453	48%	0.475	S	S	.	.	H	α-helix	trans	-61.2	-50.6	175.6	179.3	-179.4	154.6	-132.8	-16.5	111.4	K550 E551 R552 Q556 T557 E558	K550-R554 WeakPolarHBondContact O-CB 3.37Å; K550-R554 PolarHBondContact O-N 3.28Å; E551-R554 VanDerWaalsContact CD-NH1 3.29Å; E551-R554 PolarHBondContact O-N 3.16Å; E551-R554 IonicContact OE1-CZ 3.76Å; E551-R554 IonicContact OE1-NH1 2.71Å; E551-R554 PolarHBondContact OE1-NH1 2.89Å; E551-R554 WeakPolarHBondContact OE2-CD 3.37Å; E551-R554 IonicContact OE2-CZ 2.96Å; E551-R554 IonicContact OE2-NH1 3.74Å; E551-R554 PolarHBondContact OE2-NH1 3.29Å; R552-R554 VanDerWaalsContact C-N 3.34Å; R554-Q556 VanDerWaalsContact C-N 3.26Å; R554-Q556 PolarHBondContact O-N 3.06Å; R554-T557 WeakPolarHBondContact CA-OG1 3.26Å; R554-T557 CarbonylContact O-C 3.6Å; R554-T557 WeakPolarHBondContact O-CA 3.35Å; R554-T557 PolarHBondContact O-N 2.73Å; R554-T557 PolarHBondContact O-OG1 3.29Å; R554-E558 HydrophobicContact CG-CG 4.46Å; R554-E558 IonicContact CZ-OE1 2.74Å; R554-E558 VanDerWaalsContact CZ-OE1 3.22Å; R554-E558 IonicContact NE-OE1 3.63Å; R554-E558 PolarHBondContact NE-OE1 3.13Å; R554-E558 IonicContact NH2-OE1 3.99Å; R554-E558 PolarHBondContact NH2-OE1 3.35Å; R554-E558 IonicContact NH2-OE2 3.1Å; R554-E558 PolarHBondContact O-N 2.93Å
555	I	87	Confident	80.6	Confident	73 Å²	73	93.8 Å²	93.8	37%	0.374	48%	0.478	S	S	.	.	H	α-helix	trans	-57.9	-39.5	177	-68.9	164.4	0	0	0	110.9	E551 R552 E558 Q559	E551-I555 HydrophobicContact CG-CD1 4.18Å; E551-I555 WeakPolarHBondContact O-CB 3.48Å; E551-I555 VanDerWaalsContact O-CG1 3.27Å; E551-I555 WeakPolarHBondContact O-CG1 3.45Å; E551-I555 PolarHBondContact O-N 3.22Å; R552-I555 PolarHBondContact O-N 2.86Å; I555-E558 PolarHBondContact O-N 3.47Å; I555-Q559 WeakPolarHBondContact O-CB 3.43Å; I555-Q559 VanDerWaalsContact O-CG 3.27Å; I555-Q559 WeakPolarHBondContact O-CG 3.34Å; I555-Q559 PolarHBondContact O-N 2.69Å
556	Q	79	Confident	80.5	Confident	119 Å²	119	96 Å²	96	56%	0.556	48%	0.482	S	S	*	.	H	α-helix	trans	-63	-41.6	172.7	-71.8	176.4	21.6	0	0	112.3	R552 S553 R554 Q559 L560	R552-Q556 WeakPolarHBondContact O-CG 3.45Å; R552-Q556 PolarHBondContact O-N 3.23Å; S553-Q556 WeakPolarHBondContact O-CB 3.5Å; S553-Q556 PolarHBondContact O-N 2.94Å; R554-Q556 VanDerWaalsContact C-N 3.26Å; R554-Q556 PolarHBondContact O-N 3.06Å; Q556-Q559 PolarHBondContact O-N 3.16Å; Q556-L560 WeakPolarHBondContact O-CG 3.23Å; Q556-L560 PolarHBondContact O-N 2.77Å
557	T	76.3	Confident	80.9	Confident	80 Å²	80	95.4 Å²	95.4	49%	0.491	48%	0.475	S	S	.	.	H	α-helix	trans	-66.3	-40	174.9	58	0	0	0	0	113	S553 R554 Q559 L560 V561	S553-T557 PolarHBondContact O-N 3.39Å; R554-T557 WeakPolarHBondContact CA-OG1 3.26Å; R554-T557 CarbonylContact O-C 3.6Å; R554-T557 WeakPolarHBondContact O-CA 3.35Å; R554-T557 PolarHBondContact O-N 2.73Å; R554-T557 PolarHBondContact O-OG1 3.29Å; T557-Q559 VanDerWaalsContact C-N 3.34Å; T557-Q559 PolarHBondContact O-N 2.79Å; T557-L560 PolarHBondContact O-N 3.32Å; T557-V561 WeakPolarHBondContact O-CG2 2.95Å; T557-V561 PolarHBondContact O-N 3.36Å
558	E	84.6	Confident	80.8	Confident	93 Å²	93	93.3 Å²	93.3	44%	0.435	47%	0.467	S	S	.	.	H	α-helix	trans	-63.7	-39.3	175	-69.6	178.7	-175.8	0	0	111.3	R554 I555 V561 S562	R554-E558 HydrophobicContact CG-CG 4.46Å; R554-E558 IonicContact CZ-OE1 2.74Å; R554-E558 VanDerWaalsContact CZ-OE1 3.22Å; R554-E558 IonicContact NE-OE1 3.63Å; R554-E558 PolarHBondContact NE-OE1 3.13Å; R554-E558 IonicContact NH2-OE1 3.99Å; R554-E558 PolarHBondContact NH2-OE1 3.35Å; R554-E558 IonicContact NH2-OE2 3.1Å; R554-E558 PolarHBondContact O-N 2.93Å; I555-E558 PolarHBondContact O-N 3.47Å; E558-V561 PolarHBondContact O-N 3.17Å; E558-S562 WeakPolarHBondContact O-CB 3.47Å; E558-S562 PolarHBondContact O-N 3.36Å
559	Q	84.2	Confident	80.5	Confident	113 Å²	113	97.5 Å²	97.5	53%	0.528	48%	0.479	S	S	.	.	H	α-helix	trans	-64.6	-41.8	172.4	-74	176.7	13.2	0	0	112.6	I555 Q556 T557 S562 Q563	I555-Q559 WeakPolarHBondContact O-CB 3.43Å; I555-Q559 VanDerWaalsContact O-CG 3.27Å; I555-Q559 WeakPolarHBondContact O-CG 3.34Å; I555-Q559 PolarHBondContact O-N 2.69Å; Q556-Q559 PolarHBondContact O-N 3.16Å; T557-Q559 VanDerWaalsContact C-N 3.34Å; T557-Q559 PolarHBondContact O-N 2.79Å; Q559-S562 PolarHBondContact O-N 3.11Å; Q559-Q563 WeakPolarHBondContact O-CB 3.44Å; Q559-Q563 WeakPolarHBondContact O-CG 3.41Å; Q559-Q563 PolarHBondContact O-N 3.33Å
560	L	81.1	Confident	80.2	Confident	108 Å²	108	97.9 Å²	97.9	57%	0.565	48%	0.483	S	S	*	.	H	α-helix	trans	-65.5	-38.7	176	-74.2	168.6	0	0	0	112.2	Q556 T557 Q563 Q564	Q556-L560 WeakPolarHBondContact O-CG 3.23Å; Q556-L560 PolarHBondContact O-N 2.77Å; T557-L560 PolarHBondContact O-N 3.32Å; L560-Q563 PolarHBondContact O-N 3.27Å; L560-Q564 WeakPolarHBondContact O-CB 3.4Å; L560-Q564 PolarHBondContact O-N 2.77Å
561	V	82.3	Confident	80.1	Confident	94 Å²	94	96 Å²	96	57%	0.57	47%	0.472	S	S	*	.	H	α-helix	trans	-64.5	-45.3	172.9	170.5	0	0	0	0	110.7	T557 E558 Q563 Q564 V565	T557-V561 WeakPolarHBondContact O-CG2 2.95Å; T557-V561 PolarHBondContact O-N 3.36Å; E558-V561 PolarHBondContact O-N 3.17Å; V561-Q563 PolarHBondContact O-N 3.44Å; V561-Q564 PolarHBondContact O-N 2.98Å; V561-Q564 VanDerWaalsContact O-N 3.08Å; V561-V565 WeakPolarHBondContact O-CG2 3.49Å; V561-V565 PolarHBondContact O-N 2.98Å
562	S	79.2	Confident	79.7	Confident	81 Å²	81	96 Å²	96	57%	0.566	48%	0.481	S	S	*	.	H	α-helix	trans	-60.4	-43.5	176.2	-175.2	0	0	0	0	112.4	E558 Q559 Q564 V565 L566	E558-S562 WeakPolarHBondContact O-CB 3.47Å; E558-S562 PolarHBondContact O-N 3.36Å; Q559-S562 PolarHBondContact O-N 3.11Å; S562-Q564 VanDerWaalsContact C-N 3.32Å; S562-Q564 PolarHBondContact O-N 2.95Å; S562-V565 PolarHBondContact O-N 3.35Å; S562-L566 PolarHBondContact O-N 3.08Å
563	Q	78.9	Confident	79.3	Confident	111 Å²	111	93.8 Å²	93.8	52%	0.519	49%	0.485	S	S	.	.	H	α-helix	trans	-61.7	-38.4	171.9	-74	-179.5	14.3	0	0	112.1	Q559 L560 V561 L566 I567	Q559-Q563 WeakPolarHBondContact O-CB 3.44Å; Q559-Q563 WeakPolarHBondContact O-CG 3.41Å; Q559-Q563 PolarHBondContact O-N 3.33Å; L560-Q563 PolarHBondContact O-N 3.27Å; V561-Q563 PolarHBondContact O-N 3.44Å; Q563-L566 PolarHBondContact O-N 2.9Å; Q563-I567 WeakPolarHBondContact O-CB 3.47Å; Q563-I567 VanDerWaalsContact O-CG1 3.26Å; Q563-I567 WeakPolarHBondContact O-CG1 3.44Å; Q563-I567 PolarHBondContact O-N 3.46Å
564	Q	75.8	Confident	79.2	Confident	43 Å²	43	96.6 Å²	96.6	20%	0.201	50%	0.495	C	S	.	.	H	α-helix	trans	-68.4	-42	178.4	-172.5	53	31.1	0	0	112.4	L560 V561 S562 L566 I567 D568 R633	L560-Q564 WeakPolarHBondContact O-CB 3.4Å; L560-Q564 PolarHBondContact O-N 2.77Å; V561-Q564 PolarHBondContact O-N 2.98Å; V561-Q564 VanDerWaalsContact O-N 3.08Å; S562-Q564 VanDerWaalsContact C-N 3.32Å; S562-Q564 PolarHBondContact O-N 2.95Å; Q564-L566 VanDerWaalsContact C-N 3.3Å; Q564-L566 PolarHBondContact O-N 2.72Å; Q564-I567 PolarHBondContact O-N 3.44Å; Q564-D568 PolarHBondContact NE2-OD1 2.91Å; Q564-D568 VanDerWaalsContact NE2-OD1 3.11Å; Q564-D568 PolarHBondContact NE2-OD2 3.25Å; Q564-D568 PolarHBondContact O-N 3.3Å; Q564-R633 VanDerWaalsContact NE2-NH1 3.16Å; Q564-R633 VanDerWaalsContact OE1-CZ 3.27Å
565	V	81.3	Confident	78.3	Confident	96 Å²	96	95.8 Å²	95.8	58%	0.582	50%	0.503	S	S	*	.	H	α-helix	trans	-60.3	-40.2	172.4	172.4	0	0	0	0	110.9	V561 S562 D568 R569	V561-V565 WeakPolarHBondContact O-CG2 3.49Å; V561-V565 PolarHBondContact O-N 2.98Å; S562-V565 PolarHBondContact O-N 3.35Å; V565-D568 PolarHBondContact O-N 2.64Å; V565-R569 VanDerWaalsContact O-CB 3.29Å; V565-R569 WeakPolarHBondContact O-CB 3.36Å; V565-R569 PolarHBondContact O-N 2.93Å
566	L	82.4	Confident	77.4	Confident	100 Å²	100	95.4 Å²	95.4	52%	0.524	51%	0.511	S	S	.	.	H	α-helix	trans	-64.3	-44.5	174.4	-175.2	65.8	0	0	0	111.9	S562 Q563 Q564 D568 R569 L570	S562-L566 PolarHBondContact O-N 3.08Å; Q563-L566 PolarHBondContact O-N 2.9Å; Q564-L566 VanDerWaalsContact C-N 3.3Å; Q564-L566 PolarHBondContact O-N 2.72Å; L566-D568 PolarHBondContact O-N 3.45Å; L566-R569 PolarHBondContact O-N 2.85Å; L566-L570 HydrophobicContact CG-CD1 4.13Å; L566-L570 WeakPolarHBondContact O-CB 3.37Å; L566-L570 VanDerWaalsContact O-CG 3.26Å; L566-L570 WeakPolarHBondContact O-CG 3.39Å; L566-L570 PolarHBondContact O-N 3.41Å
567	I	81.4	Confident	76.3	Confident	64 Å²	64	93.6 Å²	93.6	33%	0.328	52%	0.516	S	S	.	.	H	α-helix	trans	-59.3	-45.6	176.4	-75	163.5	0	0	0	110.9	Q563 Q564 L570 R571	Q563-I567 WeakPolarHBondContact O-CB 3.47Å; Q563-I567 VanDerWaalsContact O-CG1 3.26Å; Q563-I567 WeakPolarHBondContact O-CG1 3.44Å; Q563-I567 PolarHBondContact O-N 3.46Å; Q564-I567 PolarHBondContact O-N 3.44Å; I567-L570 PolarHBondContact O-N 2.69Å; I567-R571 WeakPolarHBondContact O-CB 3.32Å; I567-R571 WeakPolarHBondContact O-CD 3.36Å; I567-R571 VanDerWaalsContact O-CG 3.26Å; I567-R571 WeakPolarHBondContact O-CG 3.36Å; I567-R571 PolarHBondContact O-N 2.97Å
568	D	77	Confident	75.4	Confident	53 Å²	53	100.1 Å²	100.1	28%	0.283	53%	0.532	S	S	.	.	H	α-helix	trans	-78.6	-25.7	-177.2	-64.8	-29.2	0	0	0	112.8	Q564 V565 L566 R571 S572	Q564-D568 PolarHBondContact NE2-OD1 2.91Å; Q564-D568 VanDerWaalsContact NE2-OD1 3.11Å; Q564-D568 PolarHBondContact NE2-OD2 3.25Å; Q564-D568 PolarHBondContact O-N 3.3Å; V565-D568 PolarHBondContact O-N 2.64Å; L566-D568 PolarHBondContact O-N 3.45Å; D568-R571 VanDerWaalsContact OD1-CD 3.25Å; D568-R571 WeakPolarHBondContact OD1-CD 3.24Å; D568-R571 IonicContact OD1-CZ 3.91Å; D568-R571 IonicContact OD1-NE 3.24Å; D568-R571 IonicContact OD1-NH1 3.25Å; D568-R571 PolarHBondContact OD1-NH1 3.41Å; D568-S572 WeakPolarHBondContact O-CB 3.48Å; D568-S572 PolarHBondContact O-N 3.3Å; D568-S572 PolarHBondContact O-OG 2.98Å
569	R	82.9	Confident	73.4	Confident	197 Å²	197	98.5 Å²	98.5	74%	0.743	54%	0.54	S	S	*	.	H	α-helix	trans	-66	-43.2	165.2	-171.9	177.9	-176.4	-175.5	2.2	111.7	V565 L566 S572 S573	V565-R569 VanDerWaalsContact O-CB 3.29Å; V565-R569 WeakPolarHBondContact O-CB 3.36Å; V565-R569 PolarHBondContact O-N 2.93Å; L566-R569 PolarHBondContact O-N 2.85Å; R569-S572 PolarHBondContact O-N 3.31Å; R569-S573 PolarHBondContact O-N 3.41Å
570	L	76.2	Confident	71.4	Confident	108 Å²	108	101.1 Å²	101.1	57%	0.565	56%	0.555	S	S	*	*	H	α-helix	trans	-65.4	-40.4	175.3	-73.6	169	0	0	0	111.7	L566 I567 S573 L574	L566-L570 HydrophobicContact CG-CD1 4.13Å; L566-L570 WeakPolarHBondContact O-CB 3.37Å; L566-L570 VanDerWaalsContact O-CG 3.26Å; L566-L570 WeakPolarHBondContact O-CG 3.39Å; L566-L570 PolarHBondContact O-N 3.41Å; I567-L570 PolarHBondContact O-N 2.69Å; L570-S573 PolarHBondContact O-N 3Å; L570-L574 WeakPolarHBondContact O-CB 3.46Å; L570-L574 PolarHBondContact O-N 3.48Å
571	R	71.8	Confident	69.3	Low	97 Å²	97	102 Å²	102	37%	0.366	57%	0.565	S	S	.	*	H	α-helix	trans	-63.7	-44.6	173.2	-74.6	162	164.7	-169.7	-11	112.2	I567 D568 S573 L574 V575	I567-R571 WeakPolarHBondContact O-CB 3.32Å; I567-R571 WeakPolarHBondContact O-CD 3.36Å; I567-R571 VanDerWaalsContact O-CG 3.26Å; I567-R571 WeakPolarHBondContact O-CG 3.36Å; I567-R571 PolarHBondContact O-N 2.97Å; D568-R571 VanDerWaalsContact OD1-CD 3.25Å; D568-R571 WeakPolarHBondContact OD1-CD 3.24Å; D568-R571 IonicContact OD1-CZ 3.91Å; D568-R571 IonicContact OD1-NE 3.24Å; D568-R571 IonicContact OD1-NH1 3.25Å; D568-R571 PolarHBondContact OD1-NH1 3.41Å; R571-S573 VanDerWaalsContact C-N 3.3Å; R571-S573 PolarHBondContact O-N 2.87Å; R571-L574 WeakPolarHBondContact O-CB 3.49Å; R571-L574 PolarHBondContact O-N 2.97Å; R571-L574 VanDerWaalsContact O-N 3.15Å; R571-V575 WeakPolarHBondContact O-CG2 3.36Å; R571-V575 PolarHBondContact O-N 3.11Å
572	S	73.8	Confident	67.4	Low	81 Å²	81	103.9 Å²	103.9	57%	0.566	58%	0.578	S	S	*	*	H	α-helix	trans	-59.1	-42	174.7	-63.3	0	0	0	0	111.4	D568 R569 V575 A576	D568-S572 WeakPolarHBondContact O-CB 3.48Å; D568-S572 PolarHBondContact O-N 3.3Å; D568-S572 PolarHBondContact O-OG 2.98Å; R569-S572 PolarHBondContact O-N 3.31Å; S572-V575 PolarHBondContact O-N 2.83Å; S572-A576 WeakPolarHBondContact O-CB 3.34Å; S572-A576 PolarHBondContact O-N 2.98Å
573	S	72.8	Confident	65.4	Low	79 Å²	79	103.8 Å²	103.8	55%	0.552	59%	0.591	S	S	*	*	H	α-helix	trans	-64.1	-41.2	173.7	-165.1	0	0	0	0	112.5	R569 L570 R571 V575 A576 A577	R569-S573 PolarHBondContact O-N 3.41Å; L570-S573 PolarHBondContact O-N 3Å; R571-S573 VanDerWaalsContact C-N 3.3Å; R571-S573 PolarHBondContact O-N 2.87Å; S573-V575 VanDerWaalsContact C-N 3.34Å; S573-V575 PolarHBondContact O-N 2.91Å; S573-A576 PolarHBondContact O-N 3.34Å; S573-A577 WeakPolarHBondContact O-CB 3.29Å; S573-A577 PolarHBondContact O-N 3.44Å
574	L	70	Confident	63	Low	118 Å²	118	103.6 Å²	103.6	62%	0.618	61%	0.608	S	S	*	*	H	α-helix	trans	-66.1	-34.2	176	-165	78	0	0	0	112.7	L570 R571 R578	L570-L574 WeakPolarHBondContact O-CB 3.46Å; L570-L574 PolarHBondContact O-N 3.48Å; R571-L574 WeakPolarHBondContact O-CB 3.49Å; R571-L574 PolarHBondContact O-N 2.97Å; R571-L574 VanDerWaalsContact O-N 3.15Å; L574-R578 PolarHBondContact O-N 2.77Å; L574-R578 VanDerWaalsContact O-N 3.14Å
575	V	67.2	Low	61	Low	103 Å²	103	107.7 Å²	107.7	62%	0.624	64%	0.636	S	S	*	*	H	α-helix	trans	-72.7	-42.6	174.6	170.2	0	0	0	0	110.6	R571 S572 S573 A577 R578 G579	R571-V575 WeakPolarHBondContact O-CG2 3.36Å; R571-V575 PolarHBondContact O-N 3.11Å; S572-V575 PolarHBondContact O-N 2.83Å; S573-V575 VanDerWaalsContact C-N 3.34Å; S573-V575 PolarHBondContact O-N 2.91Å; V575-A577 VanDerWaalsContact C-N 3.33Å; V575-A577 PolarHBondContact O-N 3.42Å; V575-R578 CarbonylContact O-C 3.59Å; V575-R578 WeakPolarHBondContact O-CA 3.36Å; V575-R578 PolarHBondContact O-N 3.48Å; V575-G579 PolarHBondContact O-N 2.88Å
576	A	67.4	Low	58.6	Low	66 Å²	66	111.9 Å²	111.9	55%	0.545	65%	0.649	S	S	.	*	H	α-helix	trans	-59.1	-44.3	172.4	0	0	0	0	0	111.6	S572 S573 R578 G579	S572-A576 WeakPolarHBondContact O-CB 3.34Å; S572-A576 PolarHBondContact O-N 2.98Å; S573-A576 PolarHBondContact O-N 3.34Å; A576-R578 PolarHBondContact O-N 3.41Å; A576-G579 PolarHBondContact O-N 3.35Å
577	A	56.7	Low	56.1	Low	80 Å²	80	116 Å²	116	66%	0.661	67%	0.666	S	S	*	*	H	α-helix	trans	-65.1	-18.3	174	0	0	0	0	0	114.1	S573 V575	S573-A577 WeakPolarHBondContact O-CB 3.29Å; S573-A577 PolarHBondContact O-N 3.44Å; V575-A577 VanDerWaalsContact C-N 3.33Å; V575-A577 PolarHBondContact O-N 3.42Å
578	R	55.5	Low	53.7	Low	217 Å²	217	118 Å²	118	82%	0.819	69%	0.691	S	S	*	*	H	α-helix	trans	-93.1	-11.8	170.6	-91.4	-174	167.7	-166	-3.3	114.2	L574 V575 A576	L574-R578 PolarHBondContact O-N 2.77Å; L574-R578 VanDerWaalsContact O-N 3.14Å; V575-R578 CarbonylContact O-C 3.59Å; V575-R578 WeakPolarHBondContact O-CA 3.36Å; V575-R578 PolarHBondContact O-N 3.48Å; A576-R578 PolarHBondContact O-N 3.41Å
579	G	43.3	Very low	51.2	Low	60 Å²	60	127 Å²	127	62%	0.619	72%	0.721	S	S	*	*	H	α-helix	trans	-78.8	-19.9	-178.5	0	0	0	0	0	114.3	V575 A576 T581	V575-G579 PolarHBondContact O-N 2.88Å; A576-G579 PolarHBondContact O-N 3.35Å; G579-T581 PolarHBondContact O-N 2.91Å
580	M	42.8	Very low	49.8	Very low	168 Å²	168	122.9 Å²	122.9	83%	0.828	72%	0.72	S	S	*	*			trans	-89.1	81.6	179.6	-76.6	-174.7	156.9	0	0	112.6
581	T	37.5	Very low	47.5	Very low	127 Å²	127	123.6 Å²	123.6	78%	0.779	74%	0.735	S	S	*	*			trans	-175.7	122.8	139.9	14.8	0	0	0	0	111.6	G579	G579-T581 PolarHBondContact O-N 2.91Å
582	P	41.4	Very low	45.3	Very low	132 Å²	132	121.9 Å²	121.9	86%	0.857	75%	0.747	S	S	*	*				-113.3	146.9	122.3	32.9	-32	0	0	0	110.2
583	G	36.9	Very low	43.2	Very low	80 Å²	80	126.2 Å²	126.2	83%	0.825	76%	0.764	S	S	*	*			trans	-88.4	160.8	-164.9	0	0	0	0	0	116.2
584	A	29.5	Very low	41.2	Very low	106 Å²	106	127.8 Å²	127.8	88%	0.876	78%	0.775	S	S	*	*			trans	-135.2	170.9	162.1	0	0	0	0	0	109.3
585	T	33.4	Very low	39.2	Very low	129 Å²	129	127.9 Å²	127.9	79%	0.791	78%	0.784	S	S	*	*			trans	-87.3	167.8	-165.9	35.7	0	0	0	0	115.9
586	E	30	Very low	37.4	Very low	185 Å²	185	130 Å²	130	86%	0.864	80%	0.797	S	S	*	*			trans	87.4	165.5	153.3	-82.3	168.2	175.5	0	0	121.3
587	E	31.5	Very low	35.9	Very low	186 Å²	186	137.1 Å²	137.1	87%	0.869	81%	0.81	S	S	*	*			trans	-44.7	137.2	-153.4	-50.8	-170	130.5	0	0	120.3
588	A	29.3	Very low	35	Very low	105 Å²	105	138.5 Å²	138.5	87%	0.868	81%	0.812	S	S	*	*				-173.9	151.3	116.2	0	0	0	0	0	114.5
589	R	25.6	Very low	33.8	Very low	242 Å²	242	135.9 Å²	135.9	91%	0.913	81%	0.809	S	S	*	*			trans	-123.8	165.6	160.7	-88.4	-177.5	175.5	179.2	0.3	107.2
590	P	53.3	Low	33.3	Very low	111 Å²	111	138.4 Å²	138.4	72%	0.721	82%	0.817	S	S	*	*			cis	-132.6	-155.1	-30.1	39.6	-21.4	0	0	0	110.8
591	S	27.6	Very low	32.8	Very low	124 Å²	124	136.5 Å²	136.5	87%	0.867	82%	0.815	S	S	*	*			trans	75.7	151.6	169.6	82.4	0	0	0	0	116.9
592	G	25.6	Very low	33.4	Very low	60 Å²	60	135.8 Å²	135.8	62%	0.619	81%	0.812	S	S	*	*			cis	168.3	143.5	-11.6	0	0	0	0	0	114.4
593	N	29.3	Very low	32.8	Very low	173 Å²	173	137.1 Å²	137.1	93%	0.925	81%	0.811	S	S	*	*			trans	65	162.7	175.2	-52.8	-28.9	0	0	0	114.7
594	S	31	Very low	32.5	Very low	112 Å²	112	140.3 Å²	140.3	78%	0.783	81%	0.808	S	S	*	*			cis	-135.6	160.5	0	57.4	0	0	0	0	112.2
595	C	28.9	Very low	32.6	Very low	120 Å²	120	140.4 Å²	140.4	81%	0.811	80%	0.798	S	S	*	*			trans	-77.8	156.1	173.2	-52	0	0	0	0	112
596	T	29.1	Very low	32.5	Very low	147 Å²	147	142.3 Å²	142.3	90%	0.902	80%	0.798	S	S	*	*			trans	-154.4	145.6	131.6	5.5	0	0	0	0	111.9
597	R	35.4	Very low	32.4	Very low	216 Å²	216	139.3 Å²	139.3	82%	0.815	80%	0.797	S	S	*	*			trans	-145.5	137.3	175.6	-178.2	-167.9	-175.7	-163.1	4.3	108
598	P	38	Very low	32.4	Very low	108 Å²	108	138.4 Å²	138.4	70%	0.701	80%	0.797	S	S	*	*			trans	-117.2	140.9	131.5	-4.6	25.6	0	0	0	109.6
599	Q	31.5	Very low	32.5	Very low	162 Å²	162	141.1 Å²	141.1	76%	0.757	80%	0.796	S	S	*	*				63.1	127.9	69.1	-61.9	177.1	-19.5	0	0	111
600	S	32.7	Very low	32.7	Very low	113 Å²	113	137.4 Å²	137.4	79%	0.79	79%	0.789	S	S	*	*				-143.4	176.3	51.5	56	0	0	0	0	112.7
601	V	32.3	Very low	31.7	Very low	128 Å²	128	143 Å²	143	78%	0.776	80%	0.796	S	S	*	*			cis	-153.4	150.6	-26	129.9	0	0	0	0	107.3
602	P	49.1	Very low	32.4	Very low	112 Å²	112	142.6 Å²	142.6	73%	0.727	79%	0.79	S	S	*	*			trans	-98.2	-173.8	-170.2	40.4	-38.7	0	0	0	114.5
603	L	29.9	Very low	32.8	Very low	160 Å²	160	145 Å²	145	84%	0.838	80%	0.798	S	S	*	*			trans	154.2	138.7	154.7	-83.5	165.8	0	0	0	107.2
604	I	30.1	Very low	33.1	Very low	147 Å²	147	148.2 Å²	148.2	75%	0.754	80%	0.797	S	S	*	*			cis	-141.5	162.4	0.2	-90.9	154.9	0	0	0	109.2
605	T	30.8	Very low	33.2	Very low	109 Å²	109	151.9 Å²	151.9	67%	0.669	80%	0.798	S	S	*	*			trans	-101.9	-170.4	-176.5	43.6	0	0	0	0	115.4
606	H	31.3	Very low	33.3	Very low	169 Å²	169	153.5 Å²	153.5	78%	0.782	80%	0.797	S	S	*	*			trans	90.2	135.5	173.3	-48.7	-75.1	0	0	0	114.8
607	S	29.3	Very low	33.4	Very low	121 Å²	121	154.7 Å²	154.7	85%	0.846	79%	0.792	S	S	*	*			cis	-136.9	166.2	12.9	-70.8	0	0	0	0	114.4
608	L	30.7	Very low	33.3	Very low	168 Å²	168	149.4 Å²	149.4	88%	0.88	79%	0.788	S	S	*	*			trans	-78.9	155.6	-175	-65.5	147	0	0	0	114.9
609	L	31.3	Very low	33.2	Very low	161 Å²	161	149.2 Å²	149.2	84%	0.843	79%	0.79	S	S	*	*				-168.1	125.4	124.3	-105.8	165.9	0	0	0	116.1
610	H	29.9	Very low	33.4	Very low	164 Å²	164	146.9 Å²	146.9	76%	0.759	79%	0.788	S	S	*	*			trans	44.3	118.2	153.7	-93	-13.6	0	0	0	127.5
611	R	31.2	Very low	33.6	Very low	230 Å²	230	147 Å²	147	87%	0.868	79%	0.787	S	S	*	*			trans	70.4	154.4	138.1	-82.8	-160.5	165.9	-177.6	-2.1	121
612	P	43.5	Very low	34	Very low	115 Å²	115	147.4 Å²	147.4	75%	0.747	79%	0.79	S	S	*	*			trans	-131.4	-167.1	-150.4	43.8	-25.8	0	0	0	115.8
613	S	34.2	Very low	34.1	Very low	111 Å²	111	147.5 Å²	147.5	78%	0.776	79%	0.791	S	S	*	*			trans	82.3	77.1	162.5	73.8	0	0	0	0	120.3
614	R	34.8	Very low	35.1	Very low	240 Å²	240	142.6 Å²	142.6	91%	0.906	77%	0.771	S	S	*	*			trans	-151.9	133.6	130.8	-116.6	168.3	-106.2	-152.1	-4	109.9	I616	R614-I616 PolarHBondContact O-N 2.92Å
615	K	32.7	Very low	35.6	Very low	189 Å²	189	141.5 Å²	141.5	82%	0.822	77%	0.766	S	S	*	*			trans	-78.2	115.1	178.1	-72.5	-177.7	178.1	179.5	0	109.3
616	I	31.6	Very low	36	Very low	153 Å²	153	143 Å²	143	79%	0.785	77%	0.765	S	S	*	*			trans	-93.1	115.1	165.4	-62.2	175.8	0	0	0	107.1	R614 S618	R614-I616 PolarHBondContact O-N 2.92Å; I616-S618 PolarHBondContact O-N 2.73Å
617	H	31.3	Very low	36.8	Very low	173 Å²	173	144.2 Å²	144.2	80%	0.801	76%	0.763	S	S	*	*			trans	-86	94.5	164.9	-77.9	-92	0	0	0	108.2	S619	H617-S619 PolarHBondContact O-N 3.28Å
618	S	33.7	Very low	38	Very low	104 Å²	104	142.9 Å²	142.9	73%	0.727	75%	0.749	S	S	*	*			trans	-75.1	112.5	166.9	51.7	0	0	0	0	109	I616	I616-S618 PolarHBondContact O-N 2.73Å
619	S	34.8	Very low	38.9	Very low	105 Å²	105	139.1 Å²	139.1	73%	0.734	73%	0.728	S	S	*	*	P	Polyproline II helix	trans	-61.7	145	164.2	44	0	0	0	0	110.2	H617	H617-S619 PolarHBondContact O-N 3.28Å
620	P	35.6	Very low	39.6	Very low	112 Å²	112	134 Å²	134	73%	0.727	70%	0.704	S	S	*	*	P	Polyproline II helix	trans	-61.3	152.6	174.6	-22.5	34	0	0	0	112.1
621	P	37	Very low	40.5	Very low	116 Å²	116	129 Å²	129	75%	0.753	69%	0.691	S	S	*	*	P	Polyproline II helix	trans	-62.1	143.6	179.2	26.6	-34.7	0	0	0	111.7	C623	P621-C623 PolarHBondContact O-N 3.38Å; P621-C623 VanDerWaalsContact O-N 3.11Å
622	T	41.8	Very low	41.5	Very low	137 Å²	137	125.8 Å²	125.8	84%	0.84	68%	0.684	S	S	*	*	S	Bend	trans	-70.9	-6.2	-168.2	40.9	0	0	0	0	115.7
623	C	51.5	Low	41.6	Very low	113 Å²	113	124.4 Å²	124.4	76%	0.764	66%	0.663	S	S	*	*			trans	-122.1	82	-176.7	-64.3	0	0	0	0	111.8	P621	P621-C623 PolarHBondContact O-N 3.38Å; P621-C623 VanDerWaalsContact O-N 3.11Å
624	S	49.2	Very low	42.1	Very low	57 Å²	57	125.1 Å²	125.1	40%	0.399	66%	0.656	S	S	.	*			trans	-91.2	133.3	162.6	70.2	0	0	0	0	110.6	E626 R627	S624-E626 PolarHBondContact O-N 3.38Å; S624-R627 PolarHBondContact O-N 2.91Å
625	L	42.4	Very low	42.9	Very low	124 Å²	124	122.8 Å²	122.8	65%	0.649	65%	0.647	S	S	*	*	H	α-helix	trans	-55.5	-35.2	178.8	179.9	61.1	0	0	0	112	R627 V628 M629	L625-R627 VanDerWaalsContact C-N 3.31Å; L625-R627 PolarHBondContact O-N 2.99Å; L625-V628 PolarHBondContact O-N 3.33Å; L625-M629 HydrophobicContact CD1-CE 4.16Å; L625-M629 HydrophobicContact CD1-CG 4.29Å; L625-M629 HydrophobicContact CG-CG 4.22Å; L625-M629 WeakPolarHBondContact O-CB 3.49Å; L625-M629 VanDerWaalsContact O-CG 3.31Å; L625-M629 WeakPolarHBondContact O-CG 3.27Å; L625-M629 PolarHBondContact O-N 3.15Å
626	E	37.4	Very low	43.8	Very low	141 Å²	141	115.3 Å²	115.3	66%	0.659	62%	0.623	S	S	*	*	H	α-helix	trans	-57.3	-38	176.3	-173.9	176.2	-153.8	0	0	113.3	S624 T630	S624-E626 PolarHBondContact O-N 3.38Å; E626-T630 WeakPolarHBondContact O-CB 3.42Å; E626-T630 PolarHBondContact O-N 3.04Å; E626-T630 PolarHBondContact O-OG1 3.04Å
627	R	48.5	Very low	44.2	Very low	195 Å²	195	113.9 Å²	113.9	74%	0.736	61%	0.613	S	S	*	*	H	α-helix	trans	-74.2	-35.7	179.9	-146.2	175.5	-168.2	-172.3	2.8	111.7	S624 L625 T630 A631	S624-R627 PolarHBondContact O-N 2.91Å; L625-R627 VanDerWaalsContact C-N 3.31Å; L625-R627 PolarHBondContact O-N 2.99Å; R627-T630 PolarHBondContact O-N 3.22Å; R627-A631 PolarHBondContact O-N 3.48Å; R627-A631 VanDerWaalsContact O-N 3.08Å
628	V	55.6	Low	45.1	Very low	92 Å²	92	111.3 Å²	111.3	56%	0.558	61%	0.605	S	S	*	*	H	α-helix	trans	-66.9	-47.9	172.9	-177.9	0	0	0	0	110.5	L625 T630 A631 F632	L625-V628 PolarHBondContact O-N 3.33Å; V628-T630 VanDerWaalsContact C-N 3.29Å; V628-T630 PolarHBondContact O-N 2.91Å; V628-A631 PolarHBondContact O-N 3.27Å; V628-F632 PolarHBondContact O-N 3.15Å
629	M	48.6	Very low	45.8	Very low	90 Å²	90	111.3 Å²	111.3	44%	0.443	60%	0.596	S	S	.	*	H	α-helix	trans	-58.4	-39.7	175.1	-75.3	-73.2	178.3	0	0	112.2	L625 F632 R633	L625-M629 HydrophobicContact CD1-CE 4.16Å; L625-M629 HydrophobicContact CD1-CG 4.29Å; L625-M629 HydrophobicContact CG-CG 4.22Å; L625-M629 WeakPolarHBondContact O-CB 3.49Å; L625-M629 VanDerWaalsContact O-CG 3.31Å; L625-M629 WeakPolarHBondContact O-CG 3.27Å; L625-M629 PolarHBondContact O-N 3.15Å; M629-F632 PolarHBondContact O-N 3.46Å; M629-R633 WeakPolarHBondContact O-CB 3.38Å; M629-R633 VanDerWaalsContact O-CG 3.23Å; M629-R633 WeakPolarHBondContact O-CG 3.46Å; M629-R633 PolarHBondContact O-N 3.44Å
630	T	45.5	Very low	46.2	Very low	54 Å²	54	111.1 Å²	111.1	33%	0.331	59%	0.586	S	S	.	*	H	α-helix	trans	-65.8	-44.8	176.6	-58.7	0	0	0	0	111.5	E626 R627 V628 F632 R633 M634	E626-T630 WeakPolarHBondContact O-CB 3.42Å; E626-T630 PolarHBondContact O-N 3.04Å; E626-T630 PolarHBondContact O-OG1 3.04Å; R627-T630 PolarHBondContact O-N 3.22Å; V628-T630 VanDerWaalsContact C-N 3.29Å; V628-T630 PolarHBondContact O-N 2.91Å; T630-F632 VanDerWaalsContact C-N 3.32Å; T630-F632 PolarHBondContact O-N 2.96Å; T630-R633 PolarHBondContact O-N 3.37Å; T630-M634 WeakPolarHBondContact O-CG 3.43Å; T630-M634 PolarHBondContact O-N 2.97Å
631	A	49.9	Very low	46.7	Very low	59 Å²	59	108.4 Å²	108.4	49%	0.488	57%	0.573	S	S	.	*	H	α-helix	trans	-62.8	-37	175.3	0	0	0	0	0	112.7	R627 V628 R635	R627-A631 PolarHBondContact O-N 3.48Å; R627-A631 VanDerWaalsContact O-N 3.08Å; V628-A631 PolarHBondContact O-N 3.27Å; A631-R635 PolarHBondContact O-N 2.95Å
632	F	51.5	Low	47.1	Very low	162 Å²	162	107.8 Å²	107.8	71%	0.711	56%	0.56	S	S	*	*	H	α-helix	trans	-67.1	-44.4	176.9	-154.3	-86.6	0	0	0	111.8	V628 M629 T630 R635 G636	V628-F632 PolarHBondContact O-N 3.15Å; M629-F632 PolarHBondContact O-N 3.46Å; T630-F632 VanDerWaalsContact C-N 3.32Å; T630-F632 PolarHBondContact O-N 2.96Å; F632-R635 PolarHBondContact O-N 3.25Å; F632-G636 PolarHBondContact O-N 2.99Å
633	R	45.8	Very low	47.2	Very low	86 Å²	86	105.4 Å²	105.4	33%	0.325	54%	0.541	S	S	.	.	H	α-helix	trans	-63.6	-40.2	175.6	-69.2	167.3	-169.2	-156.3	-1.9	112.3	Q564 M629 T630 R635 G636 H637	Q564-R633 VanDerWaalsContact NE2-NH1 3.16Å; Q564-R633 VanDerWaalsContact OE1-CZ 3.27Å; M629-R633 WeakPolarHBondContact O-CB 3.38Å; M629-R633 VanDerWaalsContact O-CG 3.23Å; M629-R633 WeakPolarHBondContact O-CG 3.46Å; M629-R633 PolarHBondContact O-N 3.44Å; T630-R633 PolarHBondContact O-N 3.37Å; R633-R635 VanDerWaalsContact C-N 3.31Å; R633-R635 PolarHBondContact O-N 3.47Å; R633-G636 WeakPolarHBondContact O-CA 3.46Å; R633-G636 PolarHBondContact O-N 3.24Å; R633-G636 VanDerWaalsContact O-N 3.09Å; R633-H637 PolarHBondContact O-CD2 2.93Å; R633-H637 VanDerWaalsContact O-CD2 3.22Å; R633-H637 PolarHBondContact O-N 2.65Å
634	M	44.3	Very low	46.7	Very low	125 Å²	125	105.7 Å²	105.7	62%	0.616	53%	0.532	S	S	*	.	H	α-helix	trans	-62.1	-36.3	175	-72.9	-174	75.2	0	0	112.6	T630 L638	T630-M634 WeakPolarHBondContact O-CG 3.43Å; T630-M634 PolarHBondContact O-N 2.97Å; M634-L638 WeakPolarHBondContact O-CB 3.44Å; M634-L638 PolarHBondContact O-N 2.83Å; M634-L638 VanDerWaalsContact O-N 3.11Å
635	R	52.9	Low	46.3	Very low	192 Å²	192	110.1 Å²	110.1	73%	0.725	55%	0.546	S	S	*	.	H	α-helix	trans	-65.3	-40.7	169.8	-79.6	-171.5	174.9	-172.3	-0.4	112.5	A631 F632 R633 L638 L639	A631-R635 PolarHBondContact O-N 2.95Å; F632-R635 PolarHBondContact O-N 3.25Å; R633-R635 VanDerWaalsContact C-N 3.31Å; R633-R635 PolarHBondContact O-N 3.47Å; R635-L638 PolarHBondContact O-N 3.1Å; R635-L639 WeakPolarHBondContact O-CB 3.36Å; R635-L639 WeakPolarHBondContact O-CG 3.23Å; R635-L639 PolarHBondContact O-N 3.36Å
636	G	50	Low	46.2	Very low	31 Å²	31	109.8 Å²	109.8	32%	0.32	54%	0.539	S	S	.	.	H	α-helix	trans	-59.2	-48.2	176.2	0	0	0	0	0	113	F632 R633 L639 L640	F632-G636 PolarHBondContact O-N 2.99Å; R633-G636 WeakPolarHBondContact O-CA 3.46Å; R633-G636 PolarHBondContact O-N 3.24Å; R633-G636 VanDerWaalsContact O-N 3.09Å; G636-L639 PolarHBondContact O-N 3.18Å; G636-L640 PolarHBondContact O-N 3.47Å
637	H	40.9	Very low	46.1	Very low	123 Å²	123	108.9 Å²	108.9	57%	0.569	54%	0.539	S	S	*	.	H	α-helix	trans	-66.5	-37	177.3	-73	-70.7	0	0	0	113.3	R633 L640 A641	R633-H637 PolarHBondContact O-CD2 2.93Å; R633-H637 VanDerWaalsContact O-CD2 3.22Å; R633-H637 PolarHBondContact O-N 2.65Å; H637-L640 PolarHBondContact O-N 3.3Å; H637-A641 WeakPolarHBondContact O-CB 3.16Å; H637-A641 PolarHBondContact O-N 3.4Å
638	L	49.4	Very low	45.5	Very low	120 Å²	120	107.4 Å²	107.4	63%	0.628	54%	0.538	S	S	*	.	H	α-helix	trans	-62.9	-44.4	173.5	-87.3	162.3	0	0	0	111.9	M634 R635 A641 E642	M634-L638 WeakPolarHBondContact O-CB 3.44Å; M634-L638 PolarHBondContact O-N 2.83Å; M634-L638 VanDerWaalsContact O-N 3.11Å; R635-L638 PolarHBondContact O-N 3.1Å; L638-A641 PolarHBondContact O-N 3.38Å; L638-E642 WeakPolarHBondContact O-CB 3.39Å; L638-E642 PolarHBondContact O-N 3.01Å
639	L	49.9	Very low	44.8	Very low	104 Å²	104	108.6 Å²	108.6	55%	0.545	55%	0.545	S	S	.	.	H	α-helix	trans	-65.3	-37.8	177	-75.3	166.5	0	0	0	112.6	R635 G636 E642 I643	R635-L639 WeakPolarHBondContact O-CB 3.36Å; R635-L639 WeakPolarHBondContact O-CG 3.23Å; R635-L639 PolarHBondContact O-N 3.36Å; G636-L639 PolarHBondContact O-N 3.18Å; L639-E642 PolarHBondContact O-N 3.04Å; L639-I643 WeakPolarHBondContact O-CD1 3.29Å; L639-I643 VanDerWaalsContact O-CG1 3.26Å; L639-I643 WeakPolarHBondContact O-CG1 3.48Å; L639-I643 PolarHBondContact O-N 3.31Å; L639-I643 VanDerWaalsContact O-N 3.16Å
640	L	43.4	Very low	43.9	Very low	101 Å²	101	114 Å²	114	53%	0.529	56%	0.562	S	S	.	*	H	α-helix	trans	-66.5	-43.8	175.2	-86.4	160	0	0	0	112.3	G636 H637 E642 I643 E644	G636-L640 PolarHBondContact O-N 3.47Å; H637-L640 PolarHBondContact O-N 3.3Å; L640-E642 VanDerWaalsContact C-N 3.31Å; L640-E642 PolarHBondContact O-N 3.4Å; L640-I643 PolarHBondContact O-N 3.18Å; L640-E644 PolarHBondContact O-N 3.4Å
641	A	44.8	Very low	43	Very low	54 Å²	54	116.9 Å²	116.9	45%	0.446	58%	0.583	S	S	.	*	H	α-helix	trans	-60.5	-41.6	173.1	0	0	0	0	0	111.5	H637 L638 I643 E644 E645	H637-A641 WeakPolarHBondContact O-CB 3.16Å; H637-A641 PolarHBondContact O-N 3.4Å; L638-A641 PolarHBondContact O-N 3.38Å; A641-I643 PolarHBondContact O-N 2.78Å; A641-E644 PolarHBondContact O-N 3.41Å; A641-E645 WeakPolarHBondContact O-CB 3.49Å; A641-E645 PolarHBondContact O-N 3.2Å
642	E	46.4	Very low	42	Very low	103 Å²	103	119 Å²	119	48%	0.481	59%	0.592	S	S	.	*	H	α-helix	trans	-64.8	-12.9	173.6	-110.6	-156.5	98.8	0	0	114.3	L638 L639 L640 K646	L638-E642 WeakPolarHBondContact O-CB 3.39Å; L638-E642 PolarHBondContact O-N 3.01Å; L639-E642 PolarHBondContact O-N 3.04Å; L640-E642 VanDerWaalsContact C-N 3.31Å; L640-E642 PolarHBondContact O-N 3.4Å; E642-K646 VanDerWaalsContact O-CD 3.29Å; E642-K646 WeakPolarHBondContact O-CD 3.49Å; E642-K646 WeakPolarHBondContact O-CE 3.25Å; E642-K646 VanDerWaalsContact O-CG 3.25Å; E642-K646 WeakPolarHBondContact O-CG 3.23Å; E642-K646 PolarHBondContact O-NZ 3.09Å; E642-K646 IonicContact OE1-NZ 3.97Å; E642-K646 PolarHBondContact OE1-NZ 3.04Å
643	I	44.1	Very low	40.9	Very low	88 Å²	88	121 Å²	121	45%	0.451	60%	0.6	S	S	.	*	H	α-helix	trans	-96.5	-46.8	175.2	-69.6	162.6	0	0	0	109.8	L639 L640 A641 E645 K646 D647	L639-I643 WeakPolarHBondContact O-CD1 3.29Å; L639-I643 VanDerWaalsContact O-CG1 3.26Å; L639-I643 WeakPolarHBondContact O-CG1 3.48Å; L639-I643 PolarHBondContact O-N 3.31Å; L639-I643 VanDerWaalsContact O-N 3.16Å; L640-I643 PolarHBondContact O-N 3.18Å; A641-I643 PolarHBondContact O-N 2.78Å; I643-E645 PolarHBondContact O-N 3.24Å; I643-K646 PolarHBondContact O-N 2.98Å; I643-D647 PolarHBondContact O-N 2.86Å
644	E	39.9	Very low	40.1	Very low	119 Å²	119	124.2 Å²	124.2	56%	0.556	62%	0.623	S	S	*	*	H	α-helix	trans	-60.1	-25.8	175	-71.1	-171.8	173.5	0	0	113.7	L640 A641 K648	L640-E644 PolarHBondContact O-N 3.4Å; A641-E644 PolarHBondContact O-N 3.41Å; E644-K648 VanDerWaalsContact O-CD 3.27Å; E644-K648 WeakPolarHBondContact O-CD 3.43Å; E644-K648 WeakPolarHBondContact O-CE 3.48Å; E644-K648 WeakPolarHBondContact O-CG 3.48Å
645	E	41.4	Very low	39.3	Very low	150 Å²	150	124.5 Å²	124.5	70%	0.701	63%	0.632	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.2	-21.6	174.4	-163.7	168.7	-123.9	0	0	112.6	A641 I643	A641-E645 WeakPolarHBondContact O-CB 3.49Å; A641-E645 PolarHBondContact O-N 3.2Å; I643-E645 PolarHBondContact O-N 3.24Å
646	K	39.4	Very low	38.2	Very low	116 Å²	116	123.8 Å²	123.8	50%	0.504	64%	0.636	S	S	.	*	T	Hydrogen-bonded Turn	trans	-91.2	-36.7	178	-67.2	-178.2	-174	92.1	0	112.6	E642 I643 K648 V649	E642-K646 VanDerWaalsContact O-CD 3.29Å; E642-K646 WeakPolarHBondContact O-CD 3.49Å; E642-K646 WeakPolarHBondContact O-CE 3.25Å; E642-K646 VanDerWaalsContact O-CG 3.25Å; E642-K646 WeakPolarHBondContact O-CG 3.23Å; E642-K646 PolarHBondContact O-NZ 3.09Å; E642-K646 IonicContact OE1-NZ 3.97Å; E642-K646 PolarHBondContact OE1-NZ 3.04Å; I643-K646 PolarHBondContact O-N 2.98Å; K646-K648 PolarHBondContact O-N 3.22Å; K646-V649 PolarHBondContact O-N 2.68Å
647	D	34.9	Very low	37	Very low	123 Å²	123	131.2 Å²	131.2	66%	0.658	66%	0.663	S	S	*	*	G	3₁₀ helix	trans	-70.6	-16	179.5	-74.7	-15.8	0	0	0	113.5	I643 V649	I643-D647 PolarHBondContact O-N 2.86Å; D647-V649 PolarHBondContact O-N 3.11Å
648	K	36.1	Very low	36.2	Very low	164 Å²	164	132.1 Å²	132.1	71%	0.713	68%	0.677	S	S	*	*	G	3₁₀ helix	trans	-77.1	0.5	176.7	-75	170.4	-171.8	154.5	0	115	E644 K646	E644-K648 VanDerWaalsContact O-CD 3.27Å; E644-K648 WeakPolarHBondContact O-CD 3.43Å; E644-K648 WeakPolarHBondContact O-CE 3.48Å; E644-K648 WeakPolarHBondContact O-CG 3.48Å; K646-K648 PolarHBondContact O-N 3.22Å
649	V	41.4	Very low	35	Very low	116 Å²	116	135.1 Å²	135.1	70%	0.703	69%	0.687	S	S	*	*	G	3₁₀ helix	trans	-111.5	-2.2	-172.6	-171.3	0	0	0	0	113.1	K646 D647	K646-V649 PolarHBondContact O-N 2.68Å; D647-V649 PolarHBondContact O-N 3.11Å
650	Y	30.1	Very low	33.9	Very low	203 Å²	203	135.4 Å²	135.4	80%	0.796	70%	0.698	S	S	*	*	S	Bend	trans	-113.7	97.9	179	-107.4	-94.6	0	0	0	113.4
651	C	26.2	Very low	33.1	Very low	116 Å²	116	139.2 Å²	139.2	78%	0.784	71%	0.711	S	S	*	*			trans	69.6	147.5	170.3	-68.3	0	0	0	0	114.7
652	P	29.5	Very low	32.1	Very low	103 Å²	103	145.1 Å²	145.1	67%	0.669	73%	0.729	S	S	*	*			cis	-114.7	135	46.3	37.2	-30.1	0	0	0	116.4
653	F	28.1	Very low	30.9	Very low	203 Å²	203	151.7 Å²	151.7	89%	0.89	75%	0.749	S	S	*	*	S	Bend	trans	-131.8	28.3	148.4	-139.3	-80.5	0	0	0	111.7
654	I	28.9	Very low	30	Very low	154 Å²	154	153.6 Å²	153.6	79%	0.79	77%	0.765	S	S	*	*			trans	-137.3	83.1	168.2	-52.5	-179.3	0	0	0	108.8
655	T	28.5	Very low	29.3	Very low	131 Å²	131	155.3 Å²	155.3	80%	0.804	77%	0.773	S	S	*	*			trans	-145.5	50.4	160.2	19.6	0	0	0	0	109.5
656	Q	27.9	Very low	28.5	Very low	177 Å²	177	154.1 Å²	154.1	83%	0.827	77%	0.772	S	S	*	*			trans	-141.3	137.1	168.3	-118.1	179.9	7.5	0	0	108.4
657	Q	25.3	Very low	27.8	Very low	187 Å²	187	154.1 Å²	154.1	87%	0.874	78%	0.777	S	S	*	*			trans	61.5	85.6	-170.7	-48.6	-177.9	7.9	0	0	112.4
658	V	25	Very low	27.2	Very low	142 Å²	142	155 Å²	155	86%	0.861	78%	0.777	S	S	*	*				-138.1	119.4	74	-179.1	0	0	0	0	111.7
659	E	24	Very low	26.7	Very low	183 Å²	183	153.8 Å²	153.8	86%	0.855	77%	0.774	S	S	*	*				-176.7	124.9	129.6	-106.1	177.1	-168.5	0	0	109.7
660	S	25.5	Very low	25.8	Very low	110 Å²	110	156.2 Å²	156.2	77%	0.769	78%	0.778	S	S	*	*			trans	-154.4	133.8	173.9	66.4	0	0	0	0	108.2
661	K	26.7	Very low	25.5	Very low	182 Å²	182	154.2 Å²	154.2	79%	0.791	78%	0.775	S	S	*	*			trans	80.5	136.7	-147.2	-56.2	171.8	-178.4	-175.4	0	110.9
662	E	24.3	Very low	25.3	Very low	178 Å²	178	153.9 Å²	153.9	83%	0.832	77%	0.77	S	S	*	*			cis	-140.2	163.6	6.3	-130.4	148.1	-124.4	0	0	112.7
663	R	22.6	Very low	25	Very low	240 Å²	240	156.4 Å²	156.4	91%	0.906	77%	0.771	S	S	*	*			trans	-110.9	118.3	-175.2	-83.4	179.7	168.3	175.9	-4.5	111.6
664	T	24.3	Very low	24.7	Very low	128 Å²	128	152.7 Å²	152.7	79%	0.785	76%	0.756	S	S	*	*			trans	-171.5	147.9	153.3	32.4	0	0	0	0	108.3
665	Q	25.3	Very low	24.6	Very low	155 Å²	155	153.2 Å²	153.2	72%	0.724	76%	0.755	S	S	*	*			cis	-169.9	157.4	-25.2	-157.6	177.3	-33.9	0	0	106.6
666	N	23.9	Very low	24.3	Very low	125 Å²	125	155 Å²	155	67%	0.668	75%	0.754	S	S	*	*			trans	72.4	149.8	173.1	-42.7	-35.4	0	0	0	115.1
667	N	24.6	Very low	24.2	Very low	117 Å²	117	150.7 Å²	150.7	63%	0.626	75%	0.749	S	S	*	*			cis	-170.3	148.3	-17.6	-112.4	7.4	0	0	0	110.6
668	H	24	Very low	24.2	Very low	142 Å²	142	148.6 Å²	148.6	66%	0.657	74%	0.739	S	S	*	*			trans	58.2	153.7	156.7	-57.4	-65.7	0	0	0	117.9
669	E	24.2	Very low	24.1	Very low	138 Å²	138	147.3 Å²	147.3	65%	0.645	73%	0.732	S	S	*	*			cis	-161.6	161.9	-13.3	-115.6	154.1	-170.3	0	0	109.6
670	E	23.9	Very low	24.3	Very low	167 Å²	167	143.6 Å²	143.6	78%	0.78	71%	0.714	S	S	*	*			trans	47.5	159.4	144.7	-69.5	174	-173.4	0	0	122.8
671	E	23.3	Very low	24.4	Very low	160 Å²	160	147.8 Å²	147.8	75%	0.748	71%	0.714	S	S	*	*			cis	-164.1	160.5	-41.2	-141.6	-175.3	-156.1	0	0	108.9
672	T	22.1	Very low	24.6	Very low	110 Å²	110	143.2 Å²	143.2	68%	0.675	71%	0.705	S	S	*	*			trans	62.7	141.4	164	51.1	0	0	0	0	118.5
673	K	22.8	Very low	24.6	Very low	155 Å²	155	142.1 Å²	142.1	67%	0.674	70%	0.703	S	S	*	*				64.6	138	56	-72.9	167.1	148	-81.5	0	112.5
674	E	22.6	Very low	24.7	Very low	126 Å²	126	135.2 Å²	135.2	59%	0.589	69%	0.691	S	S	*	*			cis	-161.6	168	2.3	-125.7	152.5	175.5	0	0	111.2
675	E	24.8	Very low	24.7	Very low	165 Å²	165	139.8 Å²	139.8	77%	0.771	69%	0.694	S	S	*	*			trans	64.8	161.8	154.2	-70.6	164.7	177.2	0	0	118.4
676	E	22.9	Very low	24.6	Very low	168 Å²	168	138.5 Å²	138.5	79%	0.785	70%	0.697	S	S	*	*			cis	-152.7	168.1	-2.8	-136.8	-177.7	-179.6	0	0	111.7
677	A	25.9	Very low	24.9	Very low	87 Å²	87	140.4 Å²	140.4	72%	0.719	70%	0.702	S	S	*	*			trans	36.2	144.4	149.3	0	0	0	0	0	122.2
678	E	24.8	Very low	24.8	Very low	142 Å²	142	143.7 Å²	143.7	66%	0.664	71%	0.711	S	S	*	*			cis	-155	-154.4	-3.5	-130	-141	105.2	0	0	108	E680	E678-E680 WeakPolarHBondContact OE1-CG 3.35Å; E678-E680 PolarHBondContact OE1-N 3.22Å; E678-E680 VanDerWaalsContact OE1-N 3.16Å
679	T	24.3	Very low	24.7	Very low	115 Å²	115	147.6 Å²	147.6	71%	0.706	72%	0.72	S	S	*	*			cis	-149.7	152.5	17.1	-13.7	0	0	0	0	114.4
680	E	27.3	Very low	24.6	Very low	105 Å²	105	146.1 Å²	146.1	49%	0.491	72%	0.724	S	S	.	*			trans	-10.4	160.9	145.5	-78.1	-174.2	124.3	0	0	122.3	E678	E678-E680 WeakPolarHBondContact OE1-CG 3.35Å; E678-E680 PolarHBondContact OE1-N 3.22Å; E678-E680 VanDerWaalsContact OE1-N 3.16Å
681	R	27.8	Very low	24.4	Very low	199 Å²	199	144.8 Å²	144.8	75%	0.751	73%	0.727	S	S	*	*			cis	-159	156.6	21	-125.9	147.7	-164.3	161.3	20.5	109.1
682	S	30.3	Very low	24.5	Very low	86 Å²	86	145.4 Å²	145.4	60%	0.601	73%	0.732	S	S	*	*			cis	-175.2	-154.5	-23.9	62.6	0	0	0	0	108.5
683	L	24.8	Very low	24.9	Very low	154 Å²	154	145.6 Å²	145.6	81%	0.806	74%	0.735	S	S	*	*			trans	76.3	147.5	168.6	-55	-179	0	0	0	118.6
684	C	25.3	Very low	24.9	Very low	96 Å²	96	149.1 Å²	149.1	65%	0.649	74%	0.744	S	S	*	*			cis	-165	116.5	-41	-129.4	0	0	0	0	113
685	R	23.7	Very low	24.8	Very low	223 Å²	223	146.9 Å²	146.9	84%	0.842	74%	0.742	S	S	*	*				57.3	158.7	129	-70.8	-172.8	159.2	-169	-5.5	121.1
686	T	23.6	Very low	24.7	Very low	128 Å²	128	146.9 Å²	146.9	79%	0.785	74%	0.742	S	S	*	*			cis	-149.2	-178.3	11.9	-16.7	0	0	0	0	112.1
687	E	29	Very low	24.6	Very low	166 Å²	166	145.7 Å²	145.7	78%	0.776	74%	0.741	S	S	*	*			trans	-119	-177.6	-168.3	-59.3	179.6	116	0	0	116.3
688	F	24.2	Very low	24.5	Very low	186 Å²	186	146.6 Å²	146.6	82%	0.816	74%	0.738	S	S	*	*			trans	101.7	161.1	158.5	-84	-85	0	0	0	122.2
689	R	22	Very low	24.5	Very low	223 Å²	223	147.5 Å²	147.5	84%	0.842	75%	0.745	S	S	*	*			trans	-102.1	155.2	-156.6	-65.6	174.5	164.9	-179.4	-3.9	115.2
690	C	20.9	Very low	24.4	Very low	108 Å²	108	147.8 Å²	147.8	73%	0.73	74%	0.743	S	S	*	*				168.1	154.2	104.2	-101.5	0	0	0	0	117.6
691	T	19.1	Very low	24.1	Very low	139 Å²	139	147.6 Å²	147.6	85%	0.853	75%	0.749	S	S	*	*			trans	70.4	154.7	151.8	43.8	0	0	0	0	122.7
692	M	26	Very low	23.9	Very low	173 Å²	173	145.2 Å²	145.2	85%	0.852	75%	0.75	S	S	*	*			trans	-122	160.9	-179.1	-70.1	-87.8	-72	0	0	109.5
693	P	31.2	Very low	23.7	Very low	113 Å²	113	149.3 Å²	149.3	73%	0.734	76%	0.758	S	S	*	*				-156.8	156	93.3	39.4	-20.3	0	0	0	118.6
694	R	21.5	Very low	24.3	Very low	229 Å²	229	147.6 Å²	147.6	86%	0.864	76%	0.756	S	S	*	*			trans	67.3	152.1	148.1	-75.7	176.5	-179.2	169.5	0.1	119.1
695	S	22	Very low	24.2	Very low	79 Å²	79	148 Å²	148	55%	0.552	76%	0.755	S	S	*	*			cis	-168.5	153	-7.2	41.6	0	0	0	0	110.9
696	E	21.6	Very low	24.2	Very low	165 Å²	165	144.1 Å²	144.1	77%	0.771	75%	0.751	S	S	*	*			trans	56.9	146.1	140.6	-71.6	144	-142	0	0	119.9
697	D	22.1	Very low	24.2	Very low	143 Å²	143	142.8 Å²	142.8	77%	0.765	74%	0.743	S	S	*	*			cis	-158.8	-178.2	-2.2	-134	-5.5	0	0	0	115.2
698	V	23.6	Very low	24	Very low	107 Å²	107	142.9 Å²	142.9	65%	0.648	75%	0.748	S	S	*	*			trans	-40.4	144.6	171.5	-172.1	0	0	0	0	117.4
699	I	24.4	Very low	24	Very low	160 Å²	160	137.3 Å²	137.3	82%	0.821	74%	0.742	S	S	*	*			trans	168.8	122.6	131.2	-87.3	157.2	0	0	0	108.3
700	N	22.2	Very low	24.8	Very low	121 Å²	121	132.2 Å²	132.2	65%	0.647	74%	0.738	S	S	*	*			cis	101.5	122.7	31.9	-160.2	35.6	0	0	0	113.7
701	T	21.8	Very low	24.9	Very low	102 Å²	102	132.5 Å²	132.5	63%	0.626	74%	0.74	S	S	*	*			trans	65.5	135.4	152.3	40.5	0	0	0	0	125
702	L	22.5	Very low	25.1	Very low	148 Å²	148	133.1 Å²	133.1	78%	0.775	74%	0.737	S	S	*	*			trans	84.5	129.7	132.2	-72.9	166.3	0	0	0	124
703	F	25.9	Very low	25.1	Very low	173 Å²	173	131.3 Å²	131.3	76%	0.759	73%	0.731	S	S	*	*			trans	-15.5	152.3	130	-72.2	-76.7	0	0	0	117	V705	F703-V705 HydrophobicContact CD1-CG2 4.11Å
704	P	37.7	Very low	24.8	Very low	118 Å²	118	132.9 Å²	132.9	77%	0.766	73%	0.729	S	S	*	*				-134	158.1	56.8	21	4.2	0	0	0	115
705	V	23.6	Very low	25.1	Very low	105 Å²	105	129.1 Å²	129.1	64%	0.636	72%	0.721	S	S	*	*				62.7	116.5	62	-169.1	0	0	0	0	114.1	F703	F703-V705 HydrophobicContact CD1-CG2 4.11Å
706	N	23.7	Very low	25.3	Very low	141 Å²	141	132.3 Å²	132.3	75%	0.754	73%	0.732	S	S	*	*			trans	154.8	146	144.6	-85.8	-15.6	0	0	0	111.6
707	T	23.1	Very low	25.3	Very low	100 Å²	100	130.5 Å²	130.5	61%	0.613	74%	0.736	S	S	*	*			cis	-175.1	170.3	-31.3	16.8	0	0	0	0	108.2
708	L	25.7	Very low	25.3	Very low	168 Å²	168	127.4 Å²	127.4	88%	0.88	74%	0.738	S	S	*	*			trans	84.1	134.8	161.3	-61.2	132.7	0	0	0	119.4
709	G	23	Very low	25.3	Very low	68 Å²	68	127.7 Å²	127.7	70%	0.701	75%	0.745	S	S	*	*			trans	-94	-139.3	154.7	0	0	0	0	0	109.9
710	P	38.8	Very low	25.3	Very low	116 Å²	116	127.7 Å²	127.7	75%	0.753	74%	0.741	S	S	*	*			cis	-122.2	154.8	10.2	43.4	-29.3	0	0	0	113.4
711	C	23.3	Very low	25.4	Very low	114 Å²	114	129.6 Å²	129.6	77%	0.77	75%	0.751	S	S	*	*				71.4	157.3	98.3	-54.1	0	0	0	0	117.9
712	L	23.9	Very low	25.3	Very low	152 Å²	152	133.8 Å²	133.8	80%	0.796	76%	0.761	S	S	*	*			trans	76.6	146.7	169.7	-49.3	-173	0	0	0	115.6
713	D	25.5	Very low	26.2	Very low	135 Å²	135	131.8 Å²	131.8	72%	0.722	76%	0.757	S	S	*	*			cis	-151.7	-173.4	-2.7	-122.5	-18.7	0	0	0	115.7
714	E	25.4	Very low	26	Very low	147 Å²	147	130.9 Å²	130.9	69%	0.687	76%	0.757	S	S	*	*			trans	-76.6	168.7	-161.6	-62.1	-159.4	91.8	0	0	121.4
715	Q	27.5	Very low	25.4	Very low	150 Å²	150	132.5 Å²	132.5	70%	0.701	75%	0.754	S	S	*	*			trans	52.8	141.8	142.6	-70.3	172.6	53.4	0	0	120.4
716	N	25.3	Very low	25.5	Very low	146 Å²	146	131.8 Å²	131.8	78%	0.781	75%	0.753	S	S	*	*				-172	-171.6	61.2	-157.1	-15.9	0	0	0	112
717	C	22.4	Very low	25.7	Very low	126 Å²	126	131.6 Å²	131.6	85%	0.851	75%	0.751	S	S	*	*			trans	-131.2	159.9	-168.5	-71	0	0	0	0	116.1
718	G	21.9	Very low	25.8	Very low	79 Å²	79	136.3 Å²	136.3	81%	0.814	76%	0.763	S	S	*	*			trans	107.5	162	166.2	0	0	0	0	0	115.3
719	S	23.4	Very low	25.7	Very low	112 Å²	112	134.2 Å²	134.2	78%	0.783	76%	0.762	S	S	*	*			cis	-160.1	155.4	-9.6	-169.2	0	0	0	0	111.7
720	H	24.1	Very low	26.2	Very low	161 Å²	161	138.9 Å²	138.9	75%	0.745	77%	0.77	S	S	*	*			trans	-8.1	141.6	173.6	-66.8	-79.7	0	0	0	122.5
721	N	24.3	Very low	26	Very low	161 Å²	161	141.8 Å²	141.8	86%	0.861	78%	0.779	S	S	*	*				-159.5	150.9	117.1	-98.8	-32.6	0	0	0	114.4
722	F	21.3	Very low	26.3	Very low	189 Å²	189	139.8 Å²	139.8	83%	0.829	77%	0.77	S	S	*	*			trans	-133.1	-177.9	172.9	-98.4	-83.3	0	0	0	106
723	P	39.6	Very low	26.9	Very low	106 Å²	106	139.7 Å²	139.7	69%	0.688	77%	0.77	S	S	*	*			cis	-142.8	176.9	15.2	44.5	-25.6	0	0	0	118.7
724	M	23.3	Very low	27.3	Very low	155 Å²	155	139.8 Å²	139.8	76%	0.764	77%	0.771	S	S	*	*			trans	68	155.8	154	-76.3	-60.4	171.3	0	0	119.6
725	H	25.5	Very low	27.9	Very low	152 Å²	152	139.4 Å²	139.4	70%	0.704	77%	0.772	S	S	*	*			cis	-150.3	148.9	16	-140.2	-63	0	0	0	114.2
726	S	25.2	Very low	28.9	Very low	89 Å²	89	137.6 Å²	137.6	62%	0.622	77%	0.768	S	S	*	*			trans	64	149.9	154.9	-72.8	0	0	0	0	119.7
727	I	28.1	Very low	29.5	Very low	138 Å²	138	136 Å²	136	71%	0.708	76%	0.755	S	S	*	*			cis	-156.2	157.9	0.3	-118.1	162.7	0	0	0	110.3
728	K	24.1	Very low	30.6	Very low	198 Å²	198	134.9 Å²	134.9	86%	0.861	74%	0.741	S	S	*	*			trans	57.2	103.2	167.6	-78	163.9	-175.5	174.9	0	119.3
729	S	24.6	Very low	31.9	Very low	124 Å²	124	133.3 Å²	133.3	87%	0.867	72%	0.72	S	S	*	*				-178.2	119.7	110.1	-170.7	0	0	0	0	111.1
730	L	33.6	Very low	33	Very low	166 Å²	166	130.9 Å²	130.9	87%	0.869	70%	0.701	S	S	*	*			trans	-119.5	154.6	174	-82.1	168.7	0	0	0	109.7
731	L	33.3	Very low	34.4	Very low	178 Å²	178	127.5 Å²	127.5	93%	0.932	68%	0.684	S	S	*	*			trans	100.8	73.2	174.5	-57.8	164.2	0	0	0	116.9
732	A	30.8	Very low	35.7	Very low	71 Å²	71	124 Å²	124	59%	0.587	66%	0.661	S	S	*	*	S	Bend	trans	-142.7	-56.2	157.9	0	0	0	0	0	112.9	N734	A732-N734 PolarHBondContact O-N 2.91Å
733	N	34.8	Very low	37.2	Very low	150 Å²	150	119 Å²	119	80%	0.802	65%	0.646	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.8	-16.6	-156.7	-64.3	-8.3	0	0	0	116.4	I735	N733-I735 VanDerWaalsContact C-N 3.29Å; N733-I735 PolarHBondContact O-N 3.43Å
734	N	35.4	Very low	37.7	Very low	138 Å²	138	122.5 Å²	122.5	74%	0.738	65%	0.645	S	S	*	*	H	α-helix	trans	-76.5	-6.5	-176	-94.5	-23.9	0	0	0	115.5	A732	A732-N734 PolarHBondContact O-N 2.91Å
735	I	38.5	Very low	39.4	Very low	138 Å²	138	124 Å²	124	71%	0.708	64%	0.642	S	S	*	*	H	α-helix	trans	-81.7	-34.6	-174.1	-61.9	178.8	0	0	0	112.2	N733	N733-I735 VanDerWaalsContact C-N 3.29Å; N733-I735 PolarHBondContact O-N 3.43Å
736	N	46.9	Very low	41.1	Very low	113 Å²	113	117.5 Å²	117.5	60%	0.604	62%	0.615	S	S	*	*	H	α-helix	trans	-83.3	-41	-168.2	-155.9	15.5	0	0	0	113.5	N738 A739 V740	N736-N738 VanDerWaalsContact C-N 3.35Å; N736-N738 PolarHBondContact O-N 3.5Å; N736-A739 PolarHBondContact O-N 2.93Å; N736-V740 WeakPolarHBondContact O-CG2 3.46Å; N736-V740 PolarHBondContact O-N 3.37Å
737	E	38.9	Very low	42.6	Very low	111 Å²	111	116.9 Å²	116.9	52%	0.519	61%	0.605	S	S	.	*	H	α-helix	trans	-56.8	-45.8	178	-100.6	-127.7	116.1	0	0	112.5	A739 V740 K741	E737-A739 VanDerWaalsContact C-N 3.33Å; E737-A739 PolarHBondContact O-N 3.26Å; E737-V740 PolarHBondContact O-N 3.02Å; E737-K741 VanDerWaalsContact O-CB 3.31Å; E737-K741 WeakPolarHBondContact O-CB 3.45Å; E737-K741 VanDerWaalsContact O-CG 3.25Å; E737-K741 WeakPolarHBondContact O-CG 3.26Å; E737-K741 PolarHBondContact O-N 2.97Å; E737-K741 WeakPolarHBondContact OE1-CE 3.45Å; E737-K741 IonicContact OE1-NZ 2.66Å; E737-K741 PolarHBondContact OE1-NZ 2.9Å; E737-K741 IonicContact OE2-NZ 2.79Å; E737-K741 PolarHBondContact OE2-NZ 3.02Å
738	N	46.1	Very low	44.1	Very low	103 Å²	103	114.2 Å²	114.2	55%	0.551	60%	0.595	S	S	*	*	H	α-helix	trans	-69.1	-30.3	-179.3	-79.7	-46.2	0	0	0	112.7	N736 K742	N736-N738 VanDerWaalsContact C-N 3.35Å; N736-N738 PolarHBondContact O-N 3.5Å; N738-K742 WeakPolarHBondContact O-CB 3.26Å; N738-K742 WeakPolarHBondContact O-CG 3.4Å; N738-K742 PolarHBondContact O-N 3.36Å
739	A	47.9	Very low	46	Very low	47 Å²	47	105.6 Å²	105.6	39%	0.388	56%	0.561	S	S	.	*	H	α-helix	trans	-67.1	-49.2	171.8	0	0	0	0	0	111.2	N736 E737 K741 K742 V743	N736-A739 PolarHBondContact O-N 2.93Å; E737-A739 VanDerWaalsContact C-N 3.33Å; E737-A739 PolarHBondContact O-N 3.26Å; A739-K741 VanDerWaalsContact C-N 3.34Å; A739-K741 PolarHBondContact O-N 3.45Å; A739-K742 PolarHBondContact O-N 3.48Å; A739-V743 WeakPolarHBondContact O-CG2 3.47Å; A739-V743 PolarHBondContact O-N 2.84Å
740	V	47.8	Very low	47.6	Very low	61 Å²	61	105 Å²	105	37%	0.37	54%	0.544	S	S	.	.	H	α-helix	trans	-62.9	-39.4	177.4	175.3	0	0	0	0	111.5	N736 E737 V743 R744	N736-V740 WeakPolarHBondContact O-CG2 3.46Å; N736-V740 PolarHBondContact O-N 3.37Å; E737-V740 PolarHBondContact O-N 3.02Å; V740-V743 PolarHBondContact O-N 3.42Å; V740-R744 HydrophobicContact CG1-CG 4.46Å; V740-R744 WeakPolarHBondContact O-CB 3.26Å; V740-R744 WeakPolarHBondContact O-CG 3.47Å; V740-R744 PolarHBondContact O-N 3.35Å
741	K	51.6	Low	48.7	Very low	89 Å²	89	104.6 Å²	104.6	39%	0.387	53%	0.531	S	S	.	.	H	α-helix	trans	-65.8	-36.5	174.6	-73.4	168.3	-179.8	172.9	0	112.2	E737 A739 R745	E737-K741 VanDerWaalsContact O-CB 3.31Å; E737-K741 WeakPolarHBondContact O-CB 3.45Å; E737-K741 VanDerWaalsContact O-CG 3.25Å; E737-K741 WeakPolarHBondContact O-CG 3.26Å; E737-K741 PolarHBondContact O-N 2.97Å; E737-K741 WeakPolarHBondContact OE1-CE 3.45Å; E737-K741 IonicContact OE1-NZ 2.66Å; E737-K741 PolarHBondContact OE1-NZ 2.9Å; E737-K741 IonicContact OE2-NZ 2.79Å; E737-K741 PolarHBondContact OE2-NZ 3.02Å; A739-K741 VanDerWaalsContact C-N 3.34Å; A739-K741 PolarHBondContact O-N 3.45Å; K741-R745 VanDerWaalsContact O-CG 3.27Å; K741-R745 WeakPolarHBondContact O-CG 3.41Å; K741-R745 PolarHBondContact O-N 3.42Å; K741-R745 VanDerWaalsContact O-N 3.16Å
742	K	53.2	Low	50.3	Low	88 Å²	88	101 Å²	101	38%	0.383	51%	0.505	S	S	.	.	H	α-helix	trans	-67	-49	171.9	-83.6	-166.6	171.8	-159.6	0	112.5	N738 A739 R744 R745 A746 L880 T883	N738-K742 WeakPolarHBondContact O-CB 3.26Å; N738-K742 WeakPolarHBondContact O-CG 3.4Å; N738-K742 PolarHBondContact O-N 3.36Å; A739-K742 PolarHBondContact O-N 3.48Å; K742-R744 PolarHBondContact O-N 2.98Å; K742-R745 WeakPolarHBondContact O-CB 3.36Å; K742-R745 PolarHBondContact O-N 2.89Å; K742-A746 PolarHBondContact O-N 2.88Å; K742-L880 HydrophobicContact CB-CD2 4.38Å; K742-T883 PolarHBondContact NZ-OG1 2.95Å
743	V	52.1	Low	52	Low	84 Å²	84	98.7 Å²	98.7	51%	0.509	48%	0.483	S	S	.	.	H	α-helix	trans	-61.9	-42.2	179	174.4	0	0	0	0	111.2	A739 V740 R745 A746 N747	A739-V743 WeakPolarHBondContact O-CG2 3.47Å; A739-V743 PolarHBondContact O-N 2.84Å; V740-V743 PolarHBondContact O-N 3.42Å; V743-R745 VanDerWaalsContact C-N 3.29Å; V743-R745 PolarHBondContact O-N 3.15Å; V743-A746 PolarHBondContact O-N 3.34Å; V743-N747 PolarHBondContact O-N 2.9Å; V743-N747 PolarHBondContact O-OD1 3.49Å
744	R	51.1	Low	53	Low	179 Å²	179	97.5 Å²	97.5	68%	0.675	47%	0.472	S	S	*	.	H	α-helix	trans	-60.4	-37.2	173.6	-74.4	178.2	178.3	178.9	0.2	112.3	V740 K742 T748	V740-R744 HydrophobicContact CG1-CG 4.46Å; V740-R744 WeakPolarHBondContact O-CB 3.26Å; V740-R744 WeakPolarHBondContact O-CG 3.47Å; V740-R744 PolarHBondContact O-N 3.35Å; K742-R744 PolarHBondContact O-N 2.98Å; R744-T748 WeakPolarHBondContact O-CB 3.34Å; R744-T748 PolarHBondContact O-N 2.88Å; R744-T748 VanDerWaalsContact O-N 3.16Å; R744-T748 PolarHBondContact O-OG1 2.76Å
745	R	57.3	Low	54.1	Low	187 Å²	187	95.4 Å²	95.4	71%	0.706	46%	0.458	S	S	*	.	H	α-helix	trans	-67.5	-44.3	176.1	-75.9	171.5	-179	-174.1	0.5	111.6	K741 K742 V743 T748 A749	K741-R745 VanDerWaalsContact O-CG 3.27Å; K741-R745 WeakPolarHBondContact O-CG 3.41Å; K741-R745 PolarHBondContact O-N 3.42Å; K741-R745 VanDerWaalsContact O-N 3.16Å; K742-R745 WeakPolarHBondContact O-CB 3.36Å; K742-R745 PolarHBondContact O-N 2.89Å; V743-R745 VanDerWaalsContact C-N 3.29Å; V743-R745 PolarHBondContact O-N 3.15Å; R745-T748 PolarHBondContact O-N 3.24Å; R745-A749 WeakPolarHBondContact O-CB 3.39Å; R745-A749 PolarHBondContact O-N 2.85Å
746	A	61.9	Low	55.3	Low	16 Å²	16	89.1 Å²	89.1	13%	0.132	43%	0.425	C	S	.	.	H	α-helix	trans	-57.4	-57.5	174.4	0	0	0	0	0	111.7	K742 V743 T748 A749 E750 L877 L880	K742-A746 PolarHBondContact O-N 2.88Å; V743-A746 PolarHBondContact O-N 3.34Å; A746-T748 PolarHBondContact O-N 2.89Å; A746-A749 PolarHBondContact O-N 2.92Å; A746-E750 WeakPolarHBondContact O-CG 3.47Å; A746-E750 PolarHBondContact O-N 3Å; A746-L877 HydrophobicContact CB-CD2 3.89Å; A746-L880 HydrophobicContact CB-CD2 4.1Å
747	N	56.7	Low	55.9	Low	76 Å²	76	88.5 Å²	88.5	41%	0.406	42%	0.418	S	S	.	.	H	α-helix	trans	-65.4	-8	-179.5	-59	29.8	0	0	0	114	V743 R751	V743-N747 PolarHBondContact O-N 2.9Å; V743-N747 PolarHBondContact O-OD1 3.49Å; N747-R751 PolarHBondContact O-NE 3.03Å; N747-R751 PolarHBondContact O-NH2 2.97Å
748	T	58.5	Low	56.7	Low	82 Å²	82	86.1 Å²	86.1	50%	0.503	41%	0.41	S	S	.	.	H	α-helix	trans	-94.1	-43.5	170.8	-57.5	0	0	0	0	110.7	R744 R745 A746 E750 R751 R752	R744-T748 WeakPolarHBondContact O-CB 3.34Å; R744-T748 PolarHBondContact O-N 2.88Å; R744-T748 VanDerWaalsContact O-N 3.16Å; R744-T748 PolarHBondContact O-OG1 2.76Å; R745-T748 PolarHBondContact O-N 3.24Å; A746-T748 PolarHBondContact O-N 2.89Å; T748-E750 PolarHBondContact O-N 2.76Å; T748-R751 PolarHBondContact O-N 3.09Å; T748-R752 WeakPolarHBondContact O-CB 3.22Å; T748-R752 PolarHBondContact O-N 3.31Å
749	A	64.9	Low	57.1	Low	17 Å²	17	83.3 Å²	83.3	14%	0.14	40%	0.399	C	S	.	.	H	α-helix	trans	-61.7	-41.3	174.2	0	0	0	0	0	112	R745 A746 R752 I753 L873 L877	R745-A749 WeakPolarHBondContact O-CB 3.39Å; R745-A749 PolarHBondContact O-N 2.85Å; A746-A749 PolarHBondContact O-N 2.92Å; A749-R752 PolarHBondContact O-N 3.47Å; A749-I753 WeakPolarHBondContact O-CB 3.43Å; A749-I753 WeakPolarHBondContact O-CD1 3.5Å; A749-I753 VanDerWaalsContact O-CG1 3.27Å; A749-I753 WeakPolarHBondContact O-CG1 3.38Å; A749-I753 PolarHBondContact O-N 2.72Å; A749-L873 HydrophobicContact CB-CD2 4.28Å; A749-L877 HydrophobicContact CB-CD1 4Å; A749-L877 HydrophobicContact CB-CG 4.22Å
750	E	57.7	Low	57.9	Low	110 Å²	110	81.6 Å²	81.6	51%	0.514	38%	0.383	S	S	.	.	H	α-helix	trans	-62.3	-46	176.2	-70.1	178.5	147.9	0	0	112.5	A746 T748 R752 I753 H754 L877	A746-E750 WeakPolarHBondContact O-CG 3.47Å; A746-E750 PolarHBondContact O-N 3Å; T748-E750 PolarHBondContact O-N 2.76Å; E750-R752 VanDerWaalsContact C-N 3.33Å; E750-R752 PolarHBondContact O-N 3.16Å; E750-I753 PolarHBondContact O-N 2.95Å; E750-H754 PolarHBondContact O-N 3.2Å; E750-L877 HydrophobicContact CG-CD1 3.9Å; E750-L877 HydrophobicContact CG-CD2 4.21Å
751	R	57.6	Low	58.2	Low	159 Å²	159	84.6 Å²	84.6	60%	0.6	39%	0.388	S	S	*	.	H	α-helix	trans	-61	-43.2	173.3	-94.5	-179	-73.6	175.6	-4.3	111.4	N747 T748 I753 H754 E755	N747-R751 PolarHBondContact O-NE 3.03Å; N747-R751 PolarHBondContact O-NH2 2.97Å; T748-R751 PolarHBondContact O-N 3.09Å; R751-I753 VanDerWaalsContact C-N 3.33Å; R751-I753 PolarHBondContact O-N 3.4Å; R751-H754 WeakPolarHBondContact O-CA 3.38Å; R751-H754 WeakPolarHBondContact O-CB 3.17Å; R751-H754 PolarHBondContact O-N 3.02Å; R751-E755 WeakPolarHBondContact O-CG 3.31Å; R751-E755 PolarHBondContact O-N 3.16Å
752	R	66.4	Low	58.5	Low	102 Å²	102	86.2 Å²	86.2	39%	0.385	40%	0.4	S	S	.	.	H	α-helix	trans	-63.2	-38.1	176.7	-171.5	56.2	177.1	176.9	1.8	112.6	T748 A749 E750 H754 E755 L756 E869 L873	T748-R752 WeakPolarHBondContact O-CB 3.22Å; T748-R752 PolarHBondContact O-N 3.31Å; A749-R752 PolarHBondContact O-N 3.47Å; E750-R752 VanDerWaalsContact C-N 3.33Å; E750-R752 PolarHBondContact O-N 3.16Å; R752-H754 VanDerWaalsContact C-N 3.32Å; R752-E755 WeakPolarHBondContact CD-OE2 3.09Å; R752-E755 IonicContact CZ-OE2 2.69Å; R752-E755 IonicContact NE-OE2 2.8Å; R752-E755 IonicContact NH1-OE2 3.34Å; R752-E755 PolarHBondContact NH1-OE2 3.24Å; R752-E755 PolarHBondContact O-N 3.05Å; R752-L756 HydrophobicContact CG-CD1 4.17Å; R752-L756 WeakPolarHBondContact O-CB 3.47Å; R752-L756 WeakPolarHBondContact O-CG 3.34Å; R752-L756 PolarHBondContact O-N 2.79Å; R752-E869 IonicContact CZ-OE1 2.74Å; R752-E869 IonicContact NE-OE1 3.55Å; R752-E869 PolarHBondContact NE-OE1 3.22Å; R752-E869 IonicContact NH2-OE1 3.04Å; R752-L873 HydrophobicContact CB-CD1 4.1Å; R752-L873 HydrophobicContact CG-CD1 3.64Å
753	I	67.5	Low	59	Low	22 Å²	22	84.4 Å²	84.4	11%	0.113	39%	0.392	C	S	.	.	H	α-helix	trans	-64.7	-36.6	172.2	-71.5	157.8	0	0	0	111.2	A749 E750 R751 K757 R870 L873 Q874 L877	A749-I753 WeakPolarHBondContact O-CB 3.43Å; A749-I753 WeakPolarHBondContact O-CD1 3.5Å; A749-I753 VanDerWaalsContact O-CG1 3.27Å; A749-I753 WeakPolarHBondContact O-CG1 3.38Å; A749-I753 PolarHBondContact O-N 2.72Å; E750-I753 PolarHBondContact O-N 2.95Å; R751-I753 VanDerWaalsContact C-N 3.33Å; R751-I753 PolarHBondContact O-N 3.4Å; I753-K757 VanDerWaalsContact O-CB 3.24Å; I753-K757 WeakPolarHBondContact O-CB 3.5Å; I753-K757 PolarHBondContact O-N 3.47Å; I753-R870 HydrophobicContact CG1-CG 4.44Å; I753-R870 HydrophobicContact CG2-CG 4.26Å; I753-L873 HydrophobicContact CD1-CB 3.86Å; I753-L873 HydrophobicContact CG1-CB 3.81Å; I753-L873 HydrophobicContact CG1-CD1 4.28Å; I753-Q874 HydrophobicContact CD1-CG 3.63Å; I753-Q874 HydrophobicContact CG1-CG 4.18Å; I753-Q874 HydrophobicContact CG2-CG 4.44Å; I753-L877 HydrophobicContact CD1-CD1 3.48Å; I753-L877 VanDerWaalsContact CD1-CD1 3.48Å
754	H	55.4	Low	59.5	Low	125 Å²	125	82.7 Å²	82.7	58%	0.579	38%	0.378	S	S	*	.	H	α-helix	trans	-66.3	-49.1	175	-164.8	110	0	0	0	111.6	E750 R751 R752 L756 K757 V758	E750-H754 PolarHBondContact O-N 3.2Å; R751-H754 WeakPolarHBondContact O-CA 3.38Å; R751-H754 WeakPolarHBondContact O-CB 3.17Å; R751-H754 PolarHBondContact O-N 3.02Å; R752-H754 VanDerWaalsContact C-N 3.32Å; H754-L756 PolarHBondContact O-N 2.89Å; H754-K757 PolarHBondContact O-N 3.3Å; H754-K757 VanDerWaalsContact O-N 3.11Å; H754-V758 PolarHBondContact O-N 3.43Å
755	E	58	Low	59.8	Low	95 Å²	95	78.5 Å²	78.5	44%	0.444	37%	0.367	S	S	.	.	H	α-helix	trans	-53.6	-51.3	173.5	-69.8	161.7	-153.7	0	0	111.3	R751 R752 K757 V758 S759	R751-E755 WeakPolarHBondContact O-CG 3.31Å; R751-E755 PolarHBondContact O-N 3.16Å; R752-E755 WeakPolarHBondContact CD-OE2 3.09Å; R752-E755 IonicContact CZ-OE2 2.69Å; R752-E755 IonicContact NE-OE2 2.8Å; R752-E755 IonicContact NH1-OE2 3.34Å; R752-E755 PolarHBondContact NH1-OE2 3.24Å; R752-E755 PolarHBondContact O-N 3.05Å; E755-K757 VanDerWaalsContact C-N 3.3Å; E755-K757 PolarHBondContact O-N 3.32Å; E755-V758 PolarHBondContact O-N 2.8Å; E755-V758 VanDerWaalsContact O-N 3.09Å; E755-S759 PolarHBondContact O-N 3.1Å
756	L	64.3	Low	59.7	Low	5 Å²	5	72 Å²	72	3%	0.026	35%	0.345	C	S	.	.	H	α-helix	trans	-61.6	-36	177.2	-70.2	168.7	0	0	0	111.8	R752 H754 V758 M760 M866 E869 R870 L873	R752-L756 HydrophobicContact CG-CD1 4.17Å; R752-L756 WeakPolarHBondContact O-CB 3.47Å; R752-L756 WeakPolarHBondContact O-CG 3.34Å; R752-L756 PolarHBondContact O-N 2.79Å; H754-L756 PolarHBondContact O-N 2.89Å; L756-V758 VanDerWaalsContact C-N 3.3Å; L756-V758 PolarHBondContact O-N 3.36Å; L756-M760 WeakPolarHBondContact O-CB 3.5Å; L756-M760 WeakPolarHBondContact O-CG 3.32Å; L756-M760 PolarHBondContact O-N 3.42Å; L756-M866 HydrophobicContact CD2-CB 4.09Å; L756-M866 HydrophobicContact CD2-CG 4.03Å; L756-M866 HydrophobicContact CD2-SD 4.26Å; L756-E869 HydrophobicContact CD1-CB 4.35Å; L756-E869 HydrophobicContact CD1-CG 3.99Å; L756-R870 HydrophobicContact CD1-CB 4.14Å; L756-L873 HydrophobicContact CD1-CD1 3.91Å
757	K	59.2	Low	59.7	Low	101 Å²	101	72 Å²	72	44%	0.439	34%	0.343	S	S	.	.	H	α-helix	trans	-71	-20.7	175.8	-174.7	-178.6	176	-172.6	0	113.4	I753 H754 E755 R761	I753-K757 VanDerWaalsContact O-CB 3.24Å; I753-K757 WeakPolarHBondContact O-CB 3.5Å; I753-K757 PolarHBondContact O-N 3.47Å; H754-K757 PolarHBondContact O-N 3.3Å; H754-K757 VanDerWaalsContact O-N 3.11Å; E755-K757 VanDerWaalsContact C-N 3.3Å; E755-K757 PolarHBondContact O-N 3.32Å; K757-R761 PolarHBondContact O-NE 2.84Å
758	V	55.5	Low	59.9	Low	60 Å²	60	73.4 Å²	73.4	36%	0.364	35%	0.345	S	S	.	.	H	α-helix	trans	-84.3	-50	170.2	176.4	0	0	0	0	110	H754 E755 L756 M760 R761 L762	H754-V758 PolarHBondContact O-N 3.43Å; E755-V758 PolarHBondContact O-N 2.8Å; E755-V758 VanDerWaalsContact O-N 3.09Å; L756-V758 VanDerWaalsContact C-N 3.3Å; L756-V758 PolarHBondContact O-N 3.36Å; V758-M760 PolarHBondContact O-N 3.47Å; V758-R761 PolarHBondContact O-N 2.98Å; V758-R761 VanDerWaalsContact O-N 3.11Å; V758-L762 HydrophobicContact CG1-CD1 4.2Å; V758-L762 PolarHBondContact O-N 3.29Å
759	S	55.5	Low	59.7	Low	45 Å²	45	74.6 Å²	74.6	32%	0.315	35%	0.345	S	S	.	.	H	α-helix	trans	-63	-37.3	179.8	-170.5	0	0	0	0	113.3	E755 K763	E755-S759 PolarHBondContact O-N 3.1Å; S759-K763 PolarHBondContact O-N 3.44Å; S759-K763 VanDerWaalsContact O-N 3.16Å
760	M	64.3	Low	59.2	Low	11 Å²	11	76.2 Å²	76.2	5%	0.054	35%	0.351	C	S	.	.	H	α-helix	trans	-58.8	-49.3	170.6	-79.8	176	56	0	0	111.3	L756 V758 L762 K763 E764 L863 M866 R867	L756-M760 WeakPolarHBondContact O-CB 3.5Å; L756-M760 WeakPolarHBondContact O-CG 3.32Å; L756-M760 PolarHBondContact O-N 3.42Å; V758-M760 PolarHBondContact O-N 3.47Å; M760-L762 PolarHBondContact O-N 2.91Å; M760-K763 CarbonylContact O-C 3.55Å; M760-K763 PolarHBondContact O-N 3Å; M760-K763 VanDerWaalsContact O-N 3.14Å; M760-E764 WeakPolarHBondContact CE-OE1 3.5Å; M760-E764 WeakPolarHBondContact O-CB 3.44Å; M760-E764 VanDerWaalsContact O-CG 3.28Å; M760-E764 WeakPolarHBondContact O-CG 3.48Å; M760-E764 PolarHBondContact O-N 2.74Å; M760-L863 HydrophobicContact CB-CD2 4.5Å; M760-L863 HydrophobicContact CE-CD2 4.35Å; M760-L863 HydrophobicContact CG-CD2 4.25Å; M760-M866 HydrophobicContact CB-CE 4.47Å; M760-M866 HydrophobicContact CG-CB 4.2Å; M760-M866 HydrophobicContact CG-CE 3.9Å; M760-R867 HydrophobicContact CE-CG 3.44Å; M760-R867 VanDerWaalsContact CE-CG 3.44Å; M760-R867 HydrophobicContact SD-CG 3.94Å
761	R	53.8	Low	58.9	Low	124 Å²	124	74.7 Å²	74.7	47%	0.468	35%	0.347	S	S	.	.	H	α-helix	trans	-63	-42	-178	-83.8	-174.7	-72.7	169.1	2.8	112.1	K757 V758 K763 E764 E765	K757-R761 PolarHBondContact O-NE 2.84Å; V758-R761 PolarHBondContact O-N 2.98Å; V758-R761 VanDerWaalsContact O-N 3.11Å; R761-K763 VanDerWaalsContact C-N 3.29Å; R761-K763 PolarHBondContact O-N 3.13Å; R761-E764 PolarHBondContact O-N 3.44Å; R761-E764 VanDerWaalsContact O-N 3.12Å; R761-E765 WeakPolarHBondContact O-CG 3.39Å; R761-E765 PolarHBondContact O-N 3.41Å
762	L	57.5	Low	58.4	Low	122 Å²	122	72.5 Å²	72.5	64%	0.639	35%	0.351	S	S	*	.	H	α-helix	trans	-60.2	-37.7	174.9	-68	170.9	0	0	0	112.4	V758 M760 L766	V758-L762 HydrophobicContact CG1-CD1 4.2Å; V758-L762 PolarHBondContact O-N 3.29Å; M760-L762 PolarHBondContact O-N 2.91Å; L762-L766 WeakPolarHBondContact O-CB 3.38Å; L762-L766 PolarHBondContact O-N 3.02Å
763	K	62.8	Low	57.5	Low	50 Å²	50	70.6 Å²	70.6	22%	0.217	35%	0.351	C	S	.	.	H	α-helix	trans	-77	-28.2	173.6	-65.7	-176.9	-167.5	167.5	0	113.4	S759 M760 R761 I767 V859 S862 L863 M866	S759-K763 PolarHBondContact O-N 3.44Å; S759-K763 VanDerWaalsContact O-N 3.16Å; M760-K763 CarbonylContact O-C 3.55Å; M760-K763 PolarHBondContact O-N 3Å; M760-K763 VanDerWaalsContact O-N 3.14Å; R761-K763 VanDerWaalsContact C-N 3.29Å; R761-K763 PolarHBondContact O-N 3.13Å; K763-I767 WeakPolarHBondContact O-CB 3.24Å; K763-I767 WeakPolarHBondContact O-CD1 3.3Å; K763-I767 VanDerWaalsContact O-CG1 3.27Å; K763-I767 WeakPolarHBondContact O-CG1 3.28Å; K763-I767 PolarHBondContact O-N 2.76Å; K763-V859 HydrophobicContact CB-CG1 4.14Å; K763-V859 HydrophobicContact CD-CG1 4.42Å; K763-V859 HydrophobicContact CG-CG1 4.39Å; K763-S862 PolarHBondContact NZ-OG 3.42Å; K763-L863 HydrophobicContact CB-CD1 3.55Å; K763-L863 HydrophobicContact CB-CG 4.15Å; K763-M866 HydrophobicContact CD-CE 3.68Å; K763-M866 PolarHBondContact NZ-SD 3.17Å; K763-M866 VanDerWaalsContact NZ-SD 3.42Å
764	E	64.1	Low	56.6	Low	48 Å²	48	73.1 Å²	73.1	22%	0.224	38%	0.383	C	S	.	.	H	α-helix	trans	-70.5	-38.9	174.9	-74.5	164.4	167.5	0	0	110.9	M760 R761 K768 L863 R867	M760-E764 WeakPolarHBondContact CE-OE1 3.5Å; M760-E764 WeakPolarHBondContact O-CB 3.44Å; M760-E764 VanDerWaalsContact O-CG 3.28Å; M760-E764 WeakPolarHBondContact O-CG 3.48Å; M760-E764 PolarHBondContact O-N 2.74Å; R761-E764 PolarHBondContact O-N 3.44Å; R761-E764 VanDerWaalsContact O-N 3.12Å; E764-K768 WeakPolarHBondContact O-CG 3.36Å; E764-K768 PolarHBondContact O-N 3.03Å; E764-L863 HydrophobicContact CG-CD1 3.72Å; E764-L863 HydrophobicContact CG-CD2 4.02Å; E764-L863 HydrophobicContact CG-CG 4.46Å; E764-R867 IonicContact OE1-CZ 2.71Å; E764-R867 IonicContact OE1-NE 2.68Å; E764-R867 IonicContact OE1-NH2 3.55Å; E764-R867 PolarHBondContact OE1-NH2 3.25Å
765	E	56.2	Low	56.2	Low	92 Å²	92	75 Å²	75	43%	0.43	39%	0.391	S	S	.	.	H	α-helix	trans	-70.7	-43	170.9	-57.2	-45.5	130.8	0	0	111.8	R761 I767 K768 E769	R761-E765 WeakPolarHBondContact O-CG 3.39Å; R761-E765 PolarHBondContact O-N 3.41Å; E765-I767 PolarHBondContact O-N 3.27Å; E765-K768 WeakPolarHBondContact O-CA 3.34Å; E765-K768 WeakPolarHBondContact O-CB 3.4Å; E765-K768 PolarHBondContact O-N 2.87Å; E765-K768 IonicContact OE1-NZ 3.11Å; E765-K768 PolarHBondContact OE1-NZ 3.22Å; E765-K768 WeakPolarHBondContact OE2-CD 3.32Å; E765-K768 WeakPolarHBondContact OE2-CE 3.43Å; E765-K768 IonicContact OE2-NZ 3.55Å; E765-K768 PolarHBondContact OE2-NZ 2.9Å; E765-E769 PolarHBondContact O-N 3.39Å
766	L	56.2	Low	55.7	Low	50 Å²	50	75 Å²	75	26%	0.262	39%	0.394	S	S	.	.	H	α-helix	trans	-57.8	-36.6	175.9	-177	68	0	0	0	112.5	L762 E769 L770	L762-L766 WeakPolarHBondContact O-CB 3.38Å; L762-L766 PolarHBondContact O-N 3.02Å; L766-E769 PolarHBondContact O-N 3.09Å; L766-L770 HydrophobicContact CD1-CD1 4.49Å; L766-L770 HydrophobicContact CG-CD1 4.11Å; L766-L770 WeakPolarHBondContact O-CB 3.32Å; L766-L770 VanDerWaalsContact O-CG 3.24Å; L766-L770 WeakPolarHBondContact O-CG 3.4Å; L766-L770 PolarHBondContact O-N 3.4Å
767	I	62.1	Low	54.7	Low	15 Å²	15	79.4 Å²	79.4	8%	0.077	42%	0.421	C	S	.	.	H	α-helix	trans	-63	-46.7	172.2	-78	163.9	0	0	0	110.8	K763 E765 E769 L770 D771 V859 Y860 L863	K763-I767 WeakPolarHBondContact O-CB 3.24Å; K763-I767 WeakPolarHBondContact O-CD1 3.3Å; K763-I767 VanDerWaalsContact O-CG1 3.27Å; K763-I767 WeakPolarHBondContact O-CG1 3.28Å; K763-I767 PolarHBondContact O-N 2.76Å; E765-I767 PolarHBondContact O-N 3.27Å; I767-E769 VanDerWaalsContact C-N 3.32Å; I767-E769 PolarHBondContact O-N 3.03Å; I767-L770 PolarHBondContact O-N 3.13Å; I767-D771 WeakPolarHBondContact CG2-OD2 3.47Å; I767-D771 WeakPolarHBondContact O-CB 3.38Å; I767-D771 PolarHBondContact O-N 2.88Å; I767-V859 HydrophobicContact CD1-CG1 4.03Å; I767-V859 HydrophobicContact CG1-CG1 3.95Å; I767-Y860 HydrophobicContact CD1-CD1 3.71Å; I767-Y860 HydrophobicContact CD1-CD2 4.49Å; I767-Y860 HydrophobicContact CD1-CE1 3.73Å; I767-Y860 HydrophobicContact CD1-CG 4.11Å; I767-Y860 HydrophobicContact CG1-CE1 4.43Å; I767-Y860 HydrophobicContact CG2-CE1 3.95Å; I767-Y860 HydrophobicContact CG2-CE2 4.24Å; I767-Y860 VanDerWaalsContact CG2-OH 3.31Å; I767-Y860 WeakPolarHBondContact CG2-OH 3.36Å; I767-L863 HydrophobicContact CD1-CD1 3.53Å
768	K	59.4	Low	53.7	Low	106 Å²	106	84.5 Å²	84.5	46%	0.461	44%	0.438	S	S	.	.	H	α-helix	trans	-61.3	-39.7	177.5	-64.8	175	-151.5	165.2	0	112.1	E764 E765 D771 T772	E764-K768 WeakPolarHBondContact O-CG 3.36Å; E764-K768 PolarHBondContact O-N 3.03Å; E765-K768 WeakPolarHBondContact O-CA 3.34Å; E765-K768 WeakPolarHBondContact O-CB 3.4Å; E765-K768 PolarHBondContact O-N 2.87Å; E765-K768 IonicContact OE1-NZ 3.11Å; E765-K768 PolarHBondContact OE1-NZ 3.22Å; E765-K768 WeakPolarHBondContact OE2-CD 3.32Å; E765-K768 WeakPolarHBondContact OE2-CE 3.43Å; E765-K768 IonicContact OE2-NZ 3.55Å; E765-K768 PolarHBondContact OE2-NZ 2.9Å; K768-D771 PolarHBondContact O-N 3.49Å; K768-T772 WeakPolarHBondContact O-CB 3.35Å; K768-T772 WeakPolarHBondContact O-CG2 3.31Å; K768-T772 PolarHBondContact O-N 3.27Å; K768-T772 PolarHBondContact O-OG1 2.95Å
769	E	54.5	Low	52.8	Low	108 Å²	108	87.7 Å²	87.7	51%	0.505	45%	0.447	S	S	.	.	H	α-helix	trans	-63.3	-44.6	176.3	-70	-177.8	151.6	0	0	110.7	E765 L766 I767 D771 T772 T773	E765-E769 PolarHBondContact O-N 3.39Å; L766-E769 PolarHBondContact O-N 3.09Å; I767-E769 VanDerWaalsContact C-N 3.32Å; I767-E769 PolarHBondContact O-N 3.03Å; E769-D771 VanDerWaalsContact C-N 3.31Å; E769-D771 PolarHBondContact O-N 3.48Å; E769-T772 PolarHBondContact O-N 2.92Å; E769-T772 PolarHBondContact O-OG1 3.11Å; E769-T773 PolarHBondContact O-N 2.98Å; E769-T773 PolarHBondContact O-OG1 3.43Å
770	L	55	Low	52	Low	50 Å²	50	92.7 Å²	92.7	26%	0.262	46%	0.46	S	S	.	.	H	α-helix	trans	-69.8	-21.3	177.9	-69.9	169.6	0	0	0	114.6	L766 I767 R856	L766-L770 HydrophobicContact CD1-CD1 4.49Å; L766-L770 HydrophobicContact CG-CD1 4.11Å; L766-L770 WeakPolarHBondContact O-CB 3.32Å; L766-L770 VanDerWaalsContact O-CG 3.24Å; L766-L770 WeakPolarHBondContact O-CG 3.4Å; L766-L770 PolarHBondContact O-N 3.4Å; I767-L770 PolarHBondContact O-N 3.13Å; L770-R856 HydrophobicContact CB-CG 4.02Å; L770-R856 HydrophobicContact CD1-CG 3.98Å
771	D	51.7	Low	51	Low	78 Å²	78	96.4 Å²	96.4	42%	0.417	48%	0.483	S	S	.	.	H	α-helix	trans	-96.4	-22.6	175.9	-68.2	-26.9	0	0	0	112.9	I767 K768 E769 R856 Y860	I767-D771 WeakPolarHBondContact CG2-OD2 3.47Å; I767-D771 WeakPolarHBondContact O-CB 3.38Å; I767-D771 PolarHBondContact O-N 2.88Å; K768-D771 PolarHBondContact O-N 3.49Å; E769-D771 VanDerWaalsContact C-N 3.31Å; E769-D771 PolarHBondContact O-N 3.48Å; D771-R856 VanDerWaalsContact OD1-CD 3.27Å; D771-R856 WeakPolarHBondContact OD1-CD 3.33Å; D771-R856 IonicContact OD1-CZ 2.68Å; D771-R856 IonicContact OD1-NE 2.71Å; D771-R856 IonicContact OD1-NH1 3.91Å; D771-R856 PolarHBondContact OD1-NH1 3.09Å; D771-Y860 PolarHBondContact OD2-OH 3.17Å
772	T	47.6	Very low	50.3	Low	113 Å²	113	92.7 Å²	92.7	69%	0.693	48%	0.479	S	S	*	.	H	α-helix	trans	-88.4	-20.5	173.1	52.5	0	0	0	0	113.6	K768 E769	K768-T772 WeakPolarHBondContact O-CB 3.35Å; K768-T772 WeakPolarHBondContact O-CG2 3.31Å; K768-T772 PolarHBondContact O-N 3.27Å; K768-T772 PolarHBondContact O-OG1 2.95Å; E769-T772 PolarHBondContact O-N 2.92Å; E769-T772 PolarHBondContact O-OG1 3.11Å
773	T	47.6	Very low	49.4	Very low	63 Å²	63	89.4 Å²	89.4	39%	0.387	46%	0.464	S	S	.	.			trans	-123	91.6	176.1	57.6	0	0	0	0	111.8	E769 E775 L776	E769-T773 PolarHBondContact O-N 2.98Å; E769-T773 PolarHBondContact O-OG1 3.43Å; T773-E775 PolarHBondContact O-N 2.87Å; T773-L776 HydrophobicContact CG2-CD1 4.36Å
774	G	47.4	Very low	48.4	Very low	75 Å²	75	90 Å²	90	77%	0.773	47%	0.473	S	S	*	.	S	Bend	trans	-63.1	-18.9	174.4	0	0	0	0	0	114.2
775	E	48.5	Very low	47.2	Very low	163 Å²	163	96 Å²	96	76%	0.762	49%	0.494	S	S	*	.	S	Bend	trans	-126.8	125.2	171.6	-58.3	-175.3	155.8	0	0	108.7	T773	T773-E775 PolarHBondContact O-N 2.87Å
776	L	46.2	Very low	46.4	Very low	96 Å²	96	96.5 Å²	96.5	50%	0.503	50%	0.496	S	S	.	.			trans	176.5	21.5	151.7	-97	161	0	0	0	113.9	T773 W778 F779	T773-L776 HydrophobicContact CG2-CD1 4.36Å; L776-W778 PolarHBondContact O-N 3.47Å; L776-F779 HydrophobicContact CD2-CB 3.72Å; L776-F779 HydrophobicContact CD2-CD2 3.9Å; L776-F779 HydrophobicContact CD2-CG 4.13Å; L776-F779 PolarHBondContact O-N 2.94Å
777	T	44.3	Very low	45.5	Very low	97 Å²	97	99.7 Å²	99.7	60%	0.595	51%	0.512	S	S	*	.	H	α-helix	trans	-51.8	-28	176.6	-24.6	0	0	0	0	113.5	V781	T777-V781 WeakPolarHBondContact O-CG2 3.39Å
778	W	38.6	Very low	44.4	Very low	208 Å²	208	105.1 Å²	105.1	79%	0.788	54%	0.536	S	S	*	.	H	α-helix	trans	-64	-36.7	176.6	-170.1	85.1	0	0	0	113.5	L776 V781 A782	L776-W778 PolarHBondContact O-N 3.47Å; W778-V781 PolarHBondContact O-N 2.84Å; W778-A782 PolarHBondContact O-N 2.88Å; W778-A782 VanDerWaalsContact O-N 3.15Å
779	F	35.1	Very low	43.5	Very low	127 Å²	127	106.2 Å²	106.2	56%	0.557	54%	0.543	S	S	*	.	H	α-helix	trans	-71.3	-41.8	-174.7	-145.4	-89.4	0	0	0	111.7	L776 V781 A782 V783	L776-F779 HydrophobicContact CD2-CB 3.72Å; L776-F779 HydrophobicContact CD2-CD2 3.9Å; L776-F779 HydrophobicContact CD2-CG 4.13Å; L776-F779 PolarHBondContact O-N 2.94Å; F779-V781 VanDerWaalsContact C-N 3.34Å; F779-V781 PolarHBondContact O-N 2.9Å; F779-A782 PolarHBondContact O-N 3.41Å; F779-V783 HydrophobicContact CD1-CG2 4.24Å; F779-V783 HydrophobicContact CE1-CG2 4.44Å; F779-V783 WeakPolarHBondContact O-CG2 3.41Å; F779-V783 PolarHBondContact O-N 3.41Å
780	Y	39.2	Very low	42.8	Very low	151 Å²	151	106.8 Å²	106.8	59%	0.592	54%	0.544	S	S	*	.	H	α-helix	trans	-62.5	-40	175.6	-111.3	-89.1	0	0	0	112	A782 V783 C784	Y780-A782 VanDerWaalsContact C-N 3.34Å; Y780-A782 PolarHBondContact O-N 3.35Å; Y780-V783 PolarHBondContact O-N 2.83Å; Y780-C784 PolarHBondContact O-N 3.43Å; Y780-C784 PolarHBondContact O-SG 3.14Å
781	V	43.8	Very low	42.1	Very low	88 Å²	88	109 Å²	109	53%	0.533	56%	0.56	S	S	.	*	H	α-helix	trans	-65.6	-36.8	176.9	174.2	0	0	0	0	111.8	T777 W778 F779 R785	T777-V781 WeakPolarHBondContact O-CG2 3.39Å; W778-V781 PolarHBondContact O-N 2.84Å; F779-V781 VanDerWaalsContact C-N 3.34Å; F779-V781 PolarHBondContact O-N 2.9Å; V781-R785 PolarHBondContact O-N 2.92Å
782	A	38.2	Very low	41.5	Very low	47 Å²	47	111 Å²	111	39%	0.388	57%	0.57	S	S	.	*	H	α-helix	trans	-65.1	-47.1	174.2	0	0	0	0	0	112	W778 F779 Y780 C784 R785 E786	W778-A782 PolarHBondContact O-N 2.88Å; W778-A782 VanDerWaalsContact O-N 3.15Å; F779-A782 PolarHBondContact O-N 3.41Å; Y780-A782 VanDerWaalsContact C-N 3.34Å; Y780-A782 PolarHBondContact O-N 3.35Å; A782-C784 PolarHBondContact O-N 2.93Å; A782-R785 PolarHBondContact O-N 3.39Å; A782-E786 PolarHBondContact O-N 3.42Å
783	V	38.8	Very low	41.2	Very low	52 Å²	52	110.9 Å²	110.9	32%	0.315	56%	0.564	S	S	.	*	H	α-helix	trans	-63.9	-40.3	179	173.9	0	0	0	0	111.9	F779 Y780 E786 M787	F779-V783 HydrophobicContact CD1-CG2 4.24Å; F779-V783 HydrophobicContact CE1-CG2 4.44Å; F779-V783 WeakPolarHBondContact O-CG2 3.41Å; F779-V783 PolarHBondContact O-N 3.41Å; Y780-V783 PolarHBondContact O-N 2.83Å; V783-E786 PolarHBondContact O-N 3.29Å; V783-M787 HydrophobicContact CG1-CE 3.91Å; V783-M787 HydrophobicContact CG1-SD 4.47Å; V783-M787 WeakPolarHBondContact O-CG 3.46Å; V783-M787 PolarHBondContact O-N 3.08Å
784	C	42.4	Very low	40.9	Very low	62 Å²	62	110.6 Å²	110.6	42%	0.419	57%	0.573	S	S	.	*	H	α-helix	trans	-59.5	-48.2	175	-70.5	0	0	0	0	111.8	Y780 A782 E786 M787 E788	Y780-C784 PolarHBondContact O-N 3.43Å; Y780-C784 PolarHBondContact O-SG 3.14Å; A782-C784 PolarHBondContact O-N 2.93Å; C784-E786 VanDerWaalsContact C-N 3.31Å; C784-E786 PolarHBondContact O-N 3.09Å; C784-M787 PolarHBondContact O-N 3.22Å; C784-M787 VanDerWaalsContact O-N 3.15Å; C784-E788 WeakPolarHBondContact O-CG 3.45Å; C784-E788 PolarHBondContact O-N 3.37Å
785	R	38.4	Very low	40.5	Very low	175 Å²	175	113.8 Å²	113.8	66%	0.66	57%	0.572	S	S	*	*	H	α-helix	trans	-59.3	-39.8	175.8	-82.2	-177.3	163.6	-169.7	-4.5	113.1	V781 A782 M787 E788 Q789	V781-R785 PolarHBondContact O-N 2.92Å; A782-R785 PolarHBondContact O-N 3.39Å; R785-M787 VanDerWaalsContact C-N 3.3Å; R785-M787 PolarHBondContact O-N 3.45Å; R785-E788 PolarHBondContact O-N 2.92Å; R785-Q789 PolarHBondContact O-N 2.93Å
786	E	38.8	Very low	40.1	Very low	102 Å²	102	113.9 Å²	113.9	48%	0.477	57%	0.572	S	S	.	*	H	α-helix	trans	-68.6	-30.2	179.2	-151.1	-162	147.2	0	0	112.1	A782 V783 C784 K790	A782-E786 PolarHBondContact O-N 3.42Å; V783-E786 PolarHBondContact O-N 3.29Å; C784-E786 VanDerWaalsContact C-N 3.31Å; C784-E786 PolarHBondContact O-N 3.09Å; E786-K790 VanDerWaalsContact CD-NZ 3.3Å; E786-K790 VanDerWaalsContact O-CD 3.26Å; E786-K790 WeakPolarHBondContact O-CD 3.45Å; E786-K790 WeakPolarHBondContact O-CE 3.27Å; E786-K790 VanDerWaalsContact O-CG 3.24Å; E786-K790 WeakPolarHBondContact O-CG 3.45Å; E786-K790 PolarHBondContact O-N 2.73Å; E786-K790 WeakPolarHBondContact OE1-CE 3.48Å; E786-K790 IonicContact OE1-NZ 3.57Å; E786-K790 PolarHBondContact OE1-NZ 3.14Å
787	M	37.7	Very low	39.9	Very low	118 Å²	118	115.8 Å²	115.8	58%	0.581	58%	0.582	S	S	*	*	H	α-helix	trans	-75.9	-40.5	172	-69.2	-173.1	179.3	0	0	112.3	V783 C784 R785 Q789 K790 V791	V783-M787 HydrophobicContact CG1-CE 3.91Å; V783-M787 HydrophobicContact CG1-SD 4.47Å; V783-M787 WeakPolarHBondContact O-CG 3.46Å; V783-M787 PolarHBondContact O-N 3.08Å; C784-M787 PolarHBondContact O-N 3.22Å; C784-M787 VanDerWaalsContact O-N 3.15Å; R785-M787 VanDerWaalsContact C-N 3.3Å; R785-M787 PolarHBondContact O-N 3.45Å; M787-Q789 PolarHBondContact O-N 3.4Å; M787-K790 PolarHBondContact O-N 2.91Å; M787-V791 WeakPolarHBondContact O-CG2 3.28Å; M787-V791 PolarHBondContact O-N 2.71Å
788	E	39.5	Very low	39.5	Very low	128 Å²	128	118.6 Å²	118.6	60%	0.598	59%	0.593	S	S	*	*	H	α-helix	trans	-58.6	-45.3	175.5	-73.3	170.4	161.5	0	0	111.8	C784 R785 K790 V791 L792	C784-E788 WeakPolarHBondContact O-CG 3.45Å; C784-E788 PolarHBondContact O-N 3.37Å; R785-E788 PolarHBondContact O-N 2.92Å; E788-K790 VanDerWaalsContact C-N 3.34Å; E788-K790 PolarHBondContact O-N 3.42Å; E788-V791 PolarHBondContact O-N 2.97Å; E788-L792 PolarHBondContact O-N 3.3Å
789	Q	40	Very low	39.5	Very low	130 Å²	130	115.1 Å²	115.1	61%	0.607	60%	0.598	S	S	*	*	H	α-helix	trans	-60.9	-40.3	175.1	-75.1	-173.8	-34.8	0	0	112.7	R785 M787 L792 I793	R785-Q789 PolarHBondContact O-N 2.93Å; M787-Q789 PolarHBondContact O-N 3.4Å; Q789-L792 PolarHBondContact O-N 3.02Å; Q789-I793 WeakPolarHBondContact O-CB 3.37Å; Q789-I793 WeakPolarHBondContact O-CD1 3.24Å; Q789-I793 VanDerWaalsContact O-CG1 3.28Å; Q789-I793 WeakPolarHBondContact O-CG1 3.33Å; Q789-I793 PolarHBondContact O-N 3.37Å
790	K	40.4	Very low	39.6	Very low	119 Å²	119	114.7 Å²	114.7	52%	0.517	61%	0.611	S	S	.	*	H	α-helix	trans	-69	-33	179	-71.2	166.6	-169	169.4	0	112.7	E786 M787 E788 G794	E786-K790 VanDerWaalsContact CD-NZ 3.3Å; E786-K790 VanDerWaalsContact O-CD 3.26Å; E786-K790 WeakPolarHBondContact O-CD 3.45Å; E786-K790 WeakPolarHBondContact O-CE 3.27Å; E786-K790 VanDerWaalsContact O-CG 3.24Å; E786-K790 WeakPolarHBondContact O-CG 3.45Å; E786-K790 PolarHBondContact O-N 2.73Å; E786-K790 WeakPolarHBondContact OE1-CE 3.48Å; E786-K790 IonicContact OE1-NZ 3.57Å; E786-K790 PolarHBondContact OE1-NZ 3.14Å; M787-K790 PolarHBondContact O-N 2.91Å; E788-K790 VanDerWaalsContact C-N 3.34Å; E788-K790 PolarHBondContact O-N 3.42Å; K790-G794 PolarHBondContact O-N 2.99Å
791	V	40.9	Very low	39.2	Very low	97 Å²	97	111.1 Å²	111.1	59%	0.588	62%	0.619	S	S	*	*	H	α-helix	trans	-71.5	-40.7	173.4	172.5	0	0	0	0	111.1	M787 E788 G794 L795	M787-V791 WeakPolarHBondContact O-CG2 3.28Å; M787-V791 PolarHBondContact O-N 2.71Å; E788-V791 PolarHBondContact O-N 2.97Å; V791-G794 PolarHBondContact O-N 3.13Å; V791-L795 HydrophobicContact CG1-CD1 4.46Å
792	L	38.8	Very low	38.8	Very low	120 Å²	120	112.7 Å²	112.7	63%	0.628	62%	0.624	S	S	*	*	H	α-helix	trans	-65.3	-47.3	-179.7	-161.2	70.8	0	0	0	111.8	E788 Q789 G794 L795	E788-L792 PolarHBondContact O-N 3.3Å; Q789-L792 PolarHBondContact O-N 3.02Å; L792-G794 PolarHBondContact O-N 3.48Å; L792-L795 PolarHBondContact O-N 2.97Å; L792-L795 VanDerWaalsContact O-N 3.14Å
793	I	41.6	Very low	38.5	Very low	111 Å²	111	118.4 Å²	118.4	57%	0.569	64%	0.637	S	S	*	*	H	α-helix	trans	-63.2	-28.4	177	-66.2	165.2	0	0	0	111.7	Q789 L795	Q789-I793 WeakPolarHBondContact O-CB 3.37Å; Q789-I793 WeakPolarHBondContact O-CD1 3.24Å; Q789-I793 VanDerWaalsContact O-CG1 3.28Å; Q789-I793 WeakPolarHBondContact O-CG1 3.33Å; Q789-I793 PolarHBondContact O-N 3.37Å; I793-L795 VanDerWaalsContact C-N 3.27Å; I793-L795 PolarHBondContact O-N 2.89Å
794	G	39.4	Very low	38.1	Very low	57 Å²	57	123 Å²	123	59%	0.588	67%	0.666	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.3	-9	176.9	0	0	0	0	0	115.5	K790 V791 L792	K790-G794 PolarHBondContact O-N 2.99Å; V791-G794 PolarHBondContact O-N 3.13Å; L792-G794 PolarHBondContact O-N 3.48Å
795	L	40.3	Very low	37.6	Very low	141 Å²	141	124.5 Å²	124.5	74%	0.738	68%	0.676	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.2	-12	-176.4	-75.1	166.7	0	0	0	114.4	V791 L792 I793	V791-L795 HydrophobicContact CG1-CD1 4.46Å; L792-L795 PolarHBondContact O-N 2.97Å; L792-L795 VanDerWaalsContact O-N 3.14Å; I793-L795 VanDerWaalsContact C-N 3.27Å; I793-L795 PolarHBondContact O-N 2.89Å
796	E	40.6	Very low	37.4	Very low	166 Å²	166	122.8 Å²	122.8	78%	0.776	67%	0.67	S	S	*	*	S	Bend	trans	-93.2	-4.1	-178.4	-63.4	-170.7	137.1	0	0	113.9
797	L	41.3	Very low	37.1	Very low	135 Å²	135	125 Å²	125	71%	0.707	68%	0.684	S	S	*	*	S	Bend	trans	-118.1	111.3	-174.5	-64.1	174.7	0	0	0	112.4
798	N	35.9	Very low	36.9	Very low	156 Å²	156	124.4 Å²	124.4	83%	0.834	69%	0.687	S	S	*	*			trans	70.2	97	177.6	-69.8	-40.1	0	0	0	117.9	S800	N798-S800 PolarHBondContact O-N 3.2Å
799	P	38.1	Very low	36.7	Very low	136 Å²	136	123.9 Å²	123.9	88%	0.883	69%	0.688	S	S	*	*			trans	-77.6	-6.1	174.6	-15.7	31.4	0	0	0	116.4
800	S	37.2	Very low	36.5	Very low	118 Å²	118	121.1 Å²	121.1	83%	0.825	68%	0.68	S	S	*	*			trans	-123	97.3	-161.4	-61.8	0	0	0	0	112.9	N798	N798-S800 PolarHBondContact O-N 3.2Å
801	G	31.7	Very low	36	Very low	75 Å²	75	122.4 Å²	122.4	77%	0.773	69%	0.688	S	S	*	*			trans	179	50.3	-176.9	0	0	0	0	0	117.4
802	L	34.5	Very low	35.7	Very low	122 Å²	122	122.7 Å²	122.7	64%	0.639	69%	0.685	S	S	*	*			trans	-122	150	168.9	-65.1	169.7	0	0	0	107.7
803	Y	31.6	Very low	35.7	Very low	167 Å²	167	122.6 Å²	122.6	66%	0.655	68%	0.681	S	S	*	*			cis	-155.5	135	44.2	-90.9	-113.5	0	0	0	111.4	R806	Y803-R806 PolarHBondContact OH-NH1 2.9Å; Y803-R806 VanDerWaalsContact OH-NH1 3.16Å
804	T	30.2	Very low	35.3	Very low	149 Å²	149	125.6 Å²	125.6	91%	0.914	69%	0.687	S	S	*	*	S	Bend	trans	-172.7	11.3	140.9	28.1	0	0	0	0	116.1
805	S	31.8	Very low	34.9	Very low	92 Å²	92	129.2 Å²	129.2	64%	0.643	69%	0.688	S	S	*	*			trans	-119.5	13.6	-178.9	-56.6	0	0	0	0	115.9	L807	S805-L807 PolarHBondContact O-N 3.37Å
806	R	35.8	Very low	34.8	Very low	139 Å²	139	127.8 Å²	127.8	53%	0.525	68%	0.678	S	S	.	*	T	Hydrogen-bonded Turn	trans	-89.9	26.9	-156.1	-142.9	-179.6	88.2	177.8	7.5	117.4	Y803 T810	Y803-R806 PolarHBondContact OH-NH1 2.9Å; Y803-R806 VanDerWaalsContact OH-NH1 3.16Å; R806-T810 HydrophobicContact CG-CG2 4.22Å; R806-T810 PolarHBondContact O-OG1 3.19Å
807	L	32.8	Very low	34.7	Very low	148 Å²	148	123.1 Å²	123.1	78%	0.775	66%	0.66	S	S	*	*	T	Hydrogen-bonded Turn	trans	-132.9	-6.8	-173.8	-101.4	161.7	0	0	0	117	S805	S805-L807 PolarHBondContact O-N 3.37Å
808	T	32.3	Very low	34.1	Very low	106 Å²	106	123 Å²	123	65%	0.65	66%	0.655	S	S	*	*	T	Hydrogen-bonded Turn	trans	-111	-47.9	175.6	48.4	0	0	0	0	112.4
809	L	36.5	Very low	34.1	Very low	117 Å²	117	120.9 Å²	120.9	61%	0.613	64%	0.642	S	S	*	*	H	α-helix	trans	-65.6	-40.4	-180	-80.6	160.5	0	0	0	113.1	Q811 I812 H813	L809-Q811 VanDerWaalsContact C-N 3.26Å; L809-Q811 PolarHBondContact O-N 3.42Å; L809-I812 PolarHBondContact O-N 2.98Å; L809-H813 PolarHBondContact O-N 3.26Å
810	T	34.1	Very low	34.2	Very low	72 Å²	72	119.3 Å²	119.3	44%	0.442	63%	0.626	S	S	.	*	H	α-helix	trans	-60.2	-33.1	-178.2	38.4	0	0	0	0	113.2	R806 Y814	R806-T810 HydrophobicContact CG-CG2 4.22Å; R806-T810 PolarHBondContact O-OG1 3.19Å; T810-Y814 VanDerWaalsContact O-CB 3.31Å; T810-Y814 WeakPolarHBondContact O-CB 3.43Å; T810-Y814 PolarHBondContact O-N 3.21Å; T810-Y814 VanDerWaalsContact O-N 3.13Å
811	Q	31.3	Very low	33.9	Very low	146 Å²	146	118.8 Å²	118.8	68%	0.682	61%	0.614	S	S	*	*	H	α-helix	trans	-82.5	-20.6	-177.1	-162.3	161.2	1.2	0	0	113.5	L809	L809-Q811 VanDerWaalsContact C-N 3.26Å; L809-Q811 PolarHBondContact O-N 3.42Å
812	I	33.4	Very low	33.8	Very low	104 Å²	104	123.4 Å²	123.4	53%	0.533	61%	0.612	S	S	.	*	H	α-helix	trans	-77.2	-53.3	169.3	-63.2	169.5	0	0	0	109	L809 Y814 Q815 E816	L809-I812 PolarHBondContact O-N 2.98Å; I812-Y814 PolarHBondContact O-N 3.36Å; I812-Y814 VanDerWaalsContact O-N 3.17Å; I812-Q815 PolarHBondContact O-N 2.95Å; I812-E816 PolarHBondContact O-N 3.24Å
813	H	40.3	Very low	33.9	Very low	118 Å²	118	123.7 Å²	123.7	55%	0.546	61%	0.613	S	S	.	*	H	α-helix	trans	-57.5	-35.5	-177.9	-132.9	-43.7	0	0	0	112.7	L809 Q815 E816 V817	L809-H813 PolarHBondContact O-N 3.26Å; H813-Q815 VanDerWaalsContact C-N 3.28Å; H813-Q815 PolarHBondContact O-N 3.26Å; H813-E816 PolarHBondContact O-N 3.06Å; H813-V817 WeakPolarHBondContact O-CB 3.43Å; H813-V817 VanDerWaalsContact O-CG2 3.28Å; H813-V817 WeakPolarHBondContact O-CG2 3.48Å; H813-V817 PolarHBondContact O-N 3.05Å
814	Y	31.5	Very low	34	Very low	173 Å²	173	122 Å²	122	68%	0.678	62%	0.615	S	S	*	*	H	α-helix	trans	-69.9	-17.6	177.9	-161.8	-103.3	0	0	0	114.1	T810 I812 K818	T810-Y814 VanDerWaalsContact O-CB 3.31Å; T810-Y814 WeakPolarHBondContact O-CB 3.43Å; T810-Y814 PolarHBondContact O-N 3.21Å; T810-Y814 VanDerWaalsContact O-N 3.13Å; I812-Y814 PolarHBondContact O-N 3.36Å; I812-Y814 VanDerWaalsContact O-N 3.17Å; Y814-K818 VanDerWaalsContact O-CB 3.23Å; Y814-K818 WeakPolarHBondContact O-CB 3.34Å
815	Q	32.4	Very low	34.3	Very low	134 Å²	134	119.5 Å²	119.5	63%	0.626	60%	0.603	S	S	*	*	H	α-helix	trans	-86.2	-42.9	169.9	-68.6	-147.7	1.9	0	0	112.2	I812 H813 K818 I819	I812-Q815 PolarHBondContact O-N 2.95Å; H813-Q815 VanDerWaalsContact C-N 3.28Å; H813-Q815 PolarHBondContact O-N 3.26Å; Q815-K818 PolarHBondContact O-N 3.39Å; Q815-K818 VanDerWaalsContact O-N 3.15Å; Q815-I819 WeakPolarHBondContact O-CG1 3.34Å; Q815-I819 PolarHBondContact O-N 2.86Å
816	E	37.8	Very low	34.3	Very low	110 Å²	110	124.3 Å²	124.3	51%	0.514	61%	0.613	S	S	.	*	H	α-helix	trans	-62.7	-45.6	178.4	-65.7	177.3	132.2	0	0	111.4	I812 H813 K818 I819 N820	I812-E816 PolarHBondContact O-N 3.24Å; H813-E816 PolarHBondContact O-N 3.06Å; E816-K818 VanDerWaalsContact C-N 3.28Å; E816-K818 PolarHBondContact O-N 3.49Å; E816-I819 PolarHBondContact O-N 3.38Å; E816-I819 VanDerWaalsContact O-N 3.17Å; E816-N820 PolarHBondContact O-N 2.92Å
817	V	38.3	Very low	34.1	Very low	68 Å²	68	125.3 Å²	125.3	41%	0.412	63%	0.627	S	S	.	*	H	α-helix	trans	-61.2	-36.4	174.1	171.4	0	0	0	0	111.6	H813 I819 N820 L821	H813-V817 WeakPolarHBondContact O-CB 3.43Å; H813-V817 VanDerWaalsContact O-CG2 3.28Å; H813-V817 WeakPolarHBondContact O-CG2 3.48Å; H813-V817 PolarHBondContact O-N 3.05Å; V817-I819 VanDerWaalsContact C-N 3.34Å; V817-N820 PolarHBondContact O-N 3.43Å; V817-L821 HydrophobicContact CG1-CD1 3.74Å; V817-L821 HydrophobicContact CG1-CG 4.22Å; V817-L821 VanDerWaalsContact O-CB 3.28Å; V817-L821 WeakPolarHBondContact O-CB 3.46Å; V817-L821 VanDerWaalsContact O-CG 3.27Å; V817-L821 WeakPolarHBondContact O-CG 3.4Å; V817-L821 PolarHBondContact O-N 2.68Å
818	K	29.7	Very low	34.3	Very low	134 Å²	134	123.9 Å²	123.9	58%	0.583	63%	0.627	S	S	*	*	H	α-helix	trans	-75.2	-20.9	178.6	-168.9	171	-173.6	174.7	0	113.8	Y814 Q815 E816	Y814-K818 VanDerWaalsContact O-CB 3.23Å; Y814-K818 WeakPolarHBondContact O-CB 3.34Å; Q815-K818 PolarHBondContact O-N 3.39Å; Q815-K818 VanDerWaalsContact O-N 3.15Å; E816-K818 VanDerWaalsContact C-N 3.28Å; E816-K818 PolarHBondContact O-N 3.49Å
819	I	35.9	Very low	34.2	Very low	111 Å²	111	123.7 Å²	123.7	57%	0.569	63%	0.626	S	S	*	*	H	α-helix	trans	-79	-47.3	170.5	-70	166.2	0	0	0	109.5	Q815 E816 V817 K822	Q815-I819 WeakPolarHBondContact O-CG1 3.34Å; Q815-I819 PolarHBondContact O-N 2.86Å; E816-I819 PolarHBondContact O-N 3.38Å; E816-I819 VanDerWaalsContact O-N 3.17Å; V817-I819 VanDerWaalsContact C-N 3.34Å; I819-K822 PolarHBondContact O-N 2.7Å
820	N	38.7	Very low	33.9	Very low	103 Å²	103	126.5 Å²	126.5	55%	0.551	64%	0.636	S	S	*	*	H	α-helix	trans	-65.9	-39.8	179.5	-68.8	-12.3	0	0	0	112.6	E816 V817 K822 I823	E816-N820 PolarHBondContact O-N 2.92Å; V817-N820 PolarHBondContact O-N 3.43Å; N820-K822 PolarHBondContact O-N 2.92Å; N820-K822 VanDerWaalsContact O-N 3.13Å; N820-I823 WeakPolarHBondContact O-CB 3.43Å; N820-I823 PolarHBondContact O-N 2.97Å
821	L	31.5	Very low	34	Very low	107 Å²	107	134.7 Å²	134.7	56%	0.56	66%	0.659	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.5	-22.7	175.7	-81	169.9	0	0	0	114	V817 I823	V817-L821 HydrophobicContact CG1-CD1 3.74Å; V817-L821 HydrophobicContact CG1-CG 4.22Å; V817-L821 VanDerWaalsContact O-CB 3.28Å; V817-L821 WeakPolarHBondContact O-CB 3.46Å; V817-L821 VanDerWaalsContact O-CG 3.27Å; V817-L821 WeakPolarHBondContact O-CG 3.4Å; V817-L821 PolarHBondContact O-N 2.68Å; L821-I823 VanDerWaalsContact C-N 3.31Å
822	K	30.2	Very low	34.2	Very low	171 Å²	171	135.2 Å²	135.2	74%	0.743	66%	0.659	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.7	-13.8	175.2	-85.3	-166.2	167.4	-164.5	0	114.1	I819 N820	I819-K822 PolarHBondContact O-N 2.7Å; N820-K822 PolarHBondContact O-N 2.92Å; N820-K822 VanDerWaalsContact O-N 3.13Å
823	I	36.8	Very low	34.4	Very low	128 Å²	128	137.6 Å²	137.6	66%	0.656	67%	0.671	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.4	-27.5	177.2	-61.4	172.9	0	0	0	110.4	N820 L821 C825	N820-I823 WeakPolarHBondContact O-CB 3.43Å; N820-I823 PolarHBondContact O-N 2.97Å; L821-I823 VanDerWaalsContact C-N 3.31Å; I823-C825 PolarHBondContact O-N 3.23Å; I823-C825 VanDerWaalsContact O-N 3.08Å
824	N	33.4	Very low	34.1	Very low	131 Å²	131	141.4 Å²	141.4	70%	0.701	69%	0.689	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.6	10.2	-177.4	-72.2	2.4	0	0	0	115.5
825	C	36.6	Very low	34.3	Very low	97 Å²	97	136.3 Å²	136.3	66%	0.655	68%	0.683	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.4	7.1	-173.7	-67.9	0	0	0	0	115.6	I823	I823-C825 PolarHBondContact O-N 3.23Å; I823-C825 VanDerWaalsContact O-N 3.08Å
826	F	31	Very low	34.7	Very low	194 Å²	194	135.5 Å²	135.5	85%	0.851	69%	0.686	S	S	*	*			trans	-134.7	74.5	179.5	-99.4	-85	0	0	0	113.6
827	L	31.9	Very low	34.7	Very low	159 Å²	159	138 Å²	138	83%	0.832	70%	0.704	S	S	*	*			trans	-136.9	129.5	159.6	-79.1	178.9	0	0	0	110.8
828	P	36.4	Very low	34.8	Very low	119 Å²	119	145.4 Å²	145.4	77%	0.773	72%	0.724	S	S	*	*			trans	-99.6	94.2	148.6	-12.7	31.1	0	0	0	111.3
829	T	29.8	Very low	35.5	Very low	101 Å²	101	142.8 Å²	142.8	62%	0.62	74%	0.735	S	S	*	*			trans	29.5	109.3	141.4	42.7	0	0	0	0	120.9	R831	T829-R831 VanDerWaalsContact C-N 3.31Å; T829-R831 PolarHBondContact O-N 3.33Å
830	E	31.6	Very low	36	Very low	177 Å²	177	143.3 Å²	143.3	83%	0.827	74%	0.735	S	S	*	*	S	Bend		61.2	-18	123.6	-62.6	179.5	127.6	0	0	122.3	K832	E830-K832 PolarHBondContact O-N 3.28Å
831	R	35	Very low	35.9	Very low	244 Å²	244	144.5 Å²	144.5	92%	0.921	74%	0.739	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.1	27.5	-172.9	-76.3	-167.7	172	-171.9	-1.3	116.5	T829	T829-R831 VanDerWaalsContact C-N 3.31Å; T829-R831 PolarHBondContact O-N 3.33Å
832	K	37.1	Very low	36.4	Very low	157 Å²	157	141.8 Å²	141.8	68%	0.683	74%	0.737	S	S	*	*	T	Hydrogen-bonded Turn	trans	-128.2	-2.6	-179.2	-71.2	-173.4	178.1	176.7	0	117	E830 Q834 A835	E830-K832 PolarHBondContact O-N 3.28Å; K832-Q834 PolarHBondContact O-N 3.36Å; K832-A835 PolarHBondContact O-N 2.9Å
833	I	35.6	Very low	37.1	Very low	154 Å²	154	137.3 Å²	137.3	79%	0.79	72%	0.721	S	S	*	*	G	3₁₀ helix	trans	-69.3	-24.8	174.6	-65.7	175.9	0	0	0	111.5	A835	I833-A835 VanDerWaalsContact C-N 3.29Å; I833-A835 PolarHBondContact O-N 3.2Å
834	Q	35.8	Very low	37.4	Very low	197 Å²	197	134.1 Å²	134.1	92%	0.921	71%	0.707	S	S	*	*	G	3₁₀ helix	trans	-83.8	6.4	178.9	-131.6	172.7	15	0	0	114.7	K832	K832-Q834 PolarHBondContact O-N 3.36Å
835	A	35.8	Very low	37.9	Very low	66 Å²	66	133.1 Å²	133.1	55%	0.545	70%	0.702	S	S	.	*	G	3₁₀ helix	trans	-105	0.4	-176.1	0	0	0	0	0	114.4	K832 I833	K832-A835 PolarHBondContact O-N 2.9Å; I833-A835 VanDerWaalsContact C-N 3.29Å; I833-A835 PolarHBondContact O-N 3.2Å
836	V	39.9	Very low	38.2	Very low	117 Å²	117	134.9 Å²	134.9	71%	0.709	70%	0.7	S	S	*	*	G	3₁₀ helix	trans	-74.7	-26.3	-172.5	-178.3	0	0	0	0	112.9	R838	V836-R838 PolarHBondContact O-N 2.89Å; V836-R838 VanDerWaalsContact O-N 3.07Å
837	D	38.3	Very low	39	Very low	164 Å²	164	132.3 Å²	132.3	88%	0.877	69%	0.685	S	S	*	*	G	3₁₀ helix	trans	-73.6	9.1	179.4	-76.3	-20.7	0	0	0	115
838	R	39	Very low	39.6	Very low	223 Å²	223	128.5 Å²	128.5	84%	0.842	67%	0.665	S	S	*	*	G	3₁₀ helix	trans	-131.4	40.9	-174.8	-63.8	-166.9	-176.9	-133.6	0.4	115.5	V836 E840	V836-R838 PolarHBondContact O-N 2.89Å; V836-R838 VanDerWaalsContact O-N 3.07Å; R838-E840 VanDerWaalsContact C-N 3.28Å; R838-E840 PolarHBondContact O-N 2.88Å
839	G	44.4	Very low	40.1	Very low	78 Å²	78	126.1 Å²	126.1	80%	0.804	65%	0.651	S	S	*	*			trans	71.5	-8.8	150.8	0	0	0	0	0	119.5	M841	G839-M841 PolarHBondContact O-N 3.28Å
840	E	46.4	Very low	41.3	Very low	123 Å²	123	125.8 Å²	125.8	58%	0.575	64%	0.644	S	S	*	*			trans	-81.1	67.6	-178.8	-72.5	-171	-152.8	0	0	114	R838 N843	R838-E840 VanDerWaalsContact C-N 3.28Å; R838-E840 PolarHBondContact O-N 2.88Å; E840-N843 HydrophobicContact CB-CB 4.48Å; E840-N843 PolarHBondContact OE2-ND2 3.44Å
841	M	38.4	Very low	42.1	Very low	127 Å²	127	122.9 Å²	122.9	63%	0.626	63%	0.63	S	S	*	*			trans	-68.6	-45	176.7	-117.2	-58.2	120.1	0	0	113.2	G839 N843 V844 L845	G839-M841 PolarHBondContact O-N 3.28Å; M841-N843 PolarHBondContact O-N 3.26Å; M841-V844 HydrophobicContact CE-CB 4.46Å; M841-V844 PolarHBondContact O-N 2.94Å; M841-L845 PolarHBondContact O-N 2.65Å
842	G	40.7	Very low	42.8	Very low	51 Å²	51	113 Å²	113	53%	0.526	60%	0.598	S	S	.	*	H	α-helix	trans	-58.3	-47.7	-175.3	0	0	0	0	0	113.3	V844 L845 E846	G842-V844 PolarHBondContact O-N 3.13Å; G842-V844 VanDerWaalsContact O-N 3.09Å; G842-L845 PolarHBondContact O-N 3.11Å; G842-L845 VanDerWaalsContact O-N 3.16Å; G842-E846 PolarHBondContact O-N 3.48Å
843	N	44.4	Very low	43.7	Very low	77 Å²	77	110.8 Å²	110.8	41%	0.412	59%	0.59	S	S	.	*	H	α-helix	trans	-62.1	-18.2	177.2	-69.2	-15.9	0	0	0	113.1	E840 M841 R847	E840-N843 HydrophobicContact CB-CB 4.48Å; E840-N843 PolarHBondContact OE2-ND2 3.44Å; M841-N843 PolarHBondContact O-N 3.26Å; N843-R847 PolarHBondContact O-NE 3.39Å; N843-R847 PolarHBondContact O-NH2 3.45Å
844	V	44.1	Very low	44.9	Very low	60 Å²	60	109.3 Å²	109.3	36%	0.364	58%	0.58	S	S	.	*	H	α-helix	trans	-89.1	-44.3	174.4	176.8	0	0	0	0	110.4	M841 G842 E846 R847 L848	M841-V844 HydrophobicContact CE-CB 4.46Å; M841-V844 PolarHBondContact O-N 2.94Å; G842-V844 PolarHBondContact O-N 3.13Å; G842-V844 VanDerWaalsContact O-N 3.09Å; V844-E846 PolarHBondContact O-N 3.36Å; V844-R847 PolarHBondContact O-N 2.83Å; V844-L848 HydrophobicContact CG1-CD1 3.89Å; V844-L848 HydrophobicContact CG1-CG 4.38Å; V844-L848 WeakPolarHBondContact O-CG 3.3Å; V844-L848 PolarHBondContact O-N 2.81Å
845	L	43.8	Very low	45.8	Very low	111 Å²	111	103.7 Å²	103.7	58%	0.581	56%	0.559	S	S	*	*	H	α-helix	trans	-61.2	-43.9	-179.6	-152.3	75.8	0	0	0	112.3	M841 G842 R847 L848 S849	M841-L845 PolarHBondContact O-N 2.65Å; G842-L845 PolarHBondContact O-N 3.11Å; G842-L845 VanDerWaalsContact O-N 3.16Å; L845-R847 PolarHBondContact O-N 3.27Å; L845-L848 PolarHBondContact O-N 2.87Å; L845-S849 WeakPolarHBondContact O-CB 2.71Å; L845-S849 PolarHBondContact O-N 3.27Å
846	E	42.3	Very low	46.9	Very low	134 Å²	134	103.4 Å²	103.4	63%	0.626	54%	0.544	S	S	*	.	H	α-helix	trans	-63.9	-40.7	178.2	-171.2	177.1	-135.3	0	0	112.2	G842 V844 S849 M850	G842-E846 PolarHBondContact O-N 3.48Å; V844-E846 PolarHBondContact O-N 3.36Å; E846-S849 PolarHBondContact O-N 3.1Å; E846-M850 WeakPolarHBondContact O-CG 3.32Å; E846-M850 PolarHBondContact O-N 3Å
847	R	47.5	Very low	48.1	Very low	139 Å²	139	99.9 Å²	99.9	53%	0.525	53%	0.527	S	S	.	.	H	α-helix	trans	-69.2	-35.8	176.1	-75.2	-176.4	-71.4	-147.4	-6.1	112.6	N843 V844 L845 Q851	N843-R847 PolarHBondContact O-NE 3.39Å; N843-R847 PolarHBondContact O-NH2 3.45Å; V844-R847 PolarHBondContact O-N 2.83Å; L845-R847 PolarHBondContact O-N 3.27Å; R847-Q851 WeakPolarHBondContact O-CB 3.41Å; R847-Q851 PolarHBondContact O-N 3.09Å
848	L	45.1	Very low	49.2	Very low	80 Å²	80	97.3 Å²	97.3	42%	0.419	51%	0.51	S	S	.	.	H	α-helix	trans	-68.2	-38.7	173	-72.3	171.1	0	0	0	112.1	V844 L845 Q851 S852	V844-L848 HydrophobicContact CG1-CD1 3.89Å; V844-L848 HydrophobicContact CG1-CG 4.38Å; V844-L848 WeakPolarHBondContact O-CG 3.3Å; V844-L848 PolarHBondContact O-N 2.81Å; L845-L848 PolarHBondContact O-N 2.87Å; L848-Q851 PolarHBondContact O-N 3.02Å; L848-S852 WeakPolarHBondContact O-CB 3.37Å; L848-S852 PolarHBondContact O-N 3.47Å
849	S	47.8	Very low	50.2	Low	69 Å²	69	87.8 Å²	87.8	48%	0.483	48%	0.476	S	S	.	.	H	α-helix	trans	-60.6	-50.5	173.6	-174.9	0	0	0	0	111.3	L845 E846 Q851 S852 Q853	L845-S849 WeakPolarHBondContact O-CB 2.71Å; L845-S849 PolarHBondContact O-N 3.27Å; E846-S849 PolarHBondContact O-N 3.1Å; S849-Q851 VanDerWaalsContact C-N 3.29Å; S849-Q851 PolarHBondContact O-N 3.47Å; S849-S852 WeakPolarHBondContact O-CB 3.48Å; S849-S852 PolarHBondContact O-N 2.98Å; S849-Q853 WeakPolarHBondContact O-CB 3.36Å; S849-Q853 PolarHBondContact O-N 3.48Å
850	M	53.8	Low	51	Low	94 Å²	94	89 Å²	89	46%	0.463	46%	0.457	S	S	.	.	H	α-helix	trans	-57.5	-39.9	174.5	-76.6	-59	-54.2	0	0	112.8	E846 Q853 Q854	E846-M850 WeakPolarHBondContact O-CG 3.32Å; E846-M850 PolarHBondContact O-N 3Å; M850-Q853 PolarHBondContact O-N 3.34Å; M850-Q854 WeakPolarHBondContact O-CG 3.41Å; M850-Q854 PolarHBondContact O-N 3.19Å
851	Q	49.3	Very low	51.9	Low	116 Å²	116	89.5 Å²	89.5	54%	0.542	45%	0.454	S	S	.	.	H	α-helix	trans	-69.5	-39.5	178.3	-164.1	170.5	10	0	0	112.1	R847 L848 S849 Q854 V855	R847-Q851 WeakPolarHBondContact O-CB 3.41Å; R847-Q851 PolarHBondContact O-N 3.09Å; L848-Q851 PolarHBondContact O-N 3.02Å; S849-Q851 VanDerWaalsContact C-N 3.29Å; S849-Q851 PolarHBondContact O-N 3.47Å; Q851-Q854 PolarHBondContact O-N 3.21Å; Q851-V855 WeakPolarHBondContact O-CG2 3.36Å; Q851-V855 PolarHBondContact O-N 3.35Å
852	S	49.3	Very low	53.1	Low	36 Å²	36	85.7 Å²	85.7	25%	0.252	44%	0.44	S	S	.	.	H	α-helix	trans	-60.4	-43.9	170.8	170.7	0	0	0	0	111.9	L848 S849 V855 R856	L848-S852 WeakPolarHBondContact O-CB 3.37Å; L848-S852 PolarHBondContact O-N 3.47Å; S849-S852 WeakPolarHBondContact O-CB 3.48Å; S849-S852 PolarHBondContact O-N 2.98Å; S852-V855 PolarHBondContact O-N 3.25Å; S852-R856 PolarHBondContact O-N 3.17Å
853	Q	56.1	Low	54.3	Low	111 Å²	111	83.4 Å²	83.4	52%	0.519	42%	0.416	S	S	.	.	H	α-helix	trans	-67.2	-37.4	179.5	-158.1	173.8	21.8	0	0	112.2	S849 M850 A857	S849-Q853 WeakPolarHBondContact O-CB 3.36Å; S849-Q853 PolarHBondContact O-N 3.48Å; M850-Q853 PolarHBondContact O-N 3.34Å; Q853-A857 WeakPolarHBondContact O-CB 3.44Å; Q853-A857 PolarHBondContact O-N 3.08Å
854	Q	59.8	Low	55.3	Low	122 Å²	122	84.9 Å²	84.9	57%	0.57	42%	0.42	S	S	*	.	H	α-helix	trans	-63.8	-45.2	171.6	-76.2	178.3	-3	0	0	112.2	M850 Q851 A857 E858	M850-Q854 WeakPolarHBondContact O-CG 3.41Å; M850-Q854 PolarHBondContact O-N 3.19Å; Q851-Q854 PolarHBondContact O-N 3.21Å; Q854-A857 PolarHBondContact O-N 2.96Å; Q854-E858 PolarHBondContact O-N 2.95Å
855	V	54.9	Low	56.4	Low	79 Å²	79	85.7 Å²	85.7	48%	0.479	43%	0.428	S	S	.	.	H	α-helix	trans	-61.7	-45	176.8	170.4	0	0	0	0	111.1	Q851 S852 A857 E858 V859	Q851-V855 WeakPolarHBondContact O-CG2 3.36Å; Q851-V855 PolarHBondContact O-N 3.35Å; S852-V855 PolarHBondContact O-N 3.25Å; V855-A857 PolarHBondContact O-N 3.49Å; V855-E858 WeakPolarHBondContact O-CB 3.34Å; V855-E858 PolarHBondContact O-N 3.32Å; V855-V859 HydrophobicContact CG1-CG2 4.46Å; V855-V859 WeakPolarHBondContact O-CG2 3.46Å; V855-V859 PolarHBondContact O-N 2.96Å
856	R	59.5	Low	57.2	Low	60 Å²	60	81.3 Å²	81.3	23%	0.226	41%	0.405	C	S	.	.	H	α-helix	trans	-56.1	-48.9	172.5	-83	-172.6	-81.6	180	-5.2	111.6	L770 D771 S852 E858 V859 Y860	L770-R856 HydrophobicContact CB-CG 4.02Å; L770-R856 HydrophobicContact CD1-CG 3.98Å; D771-R856 VanDerWaalsContact OD1-CD 3.27Å; D771-R856 WeakPolarHBondContact OD1-CD 3.33Å; D771-R856 IonicContact OD1-CZ 2.68Å; D771-R856 IonicContact OD1-NE 2.71Å; D771-R856 IonicContact OD1-NH1 3.91Å; D771-R856 PolarHBondContact OD1-NH1 3.09Å; S852-R856 PolarHBondContact O-N 3.17Å; R856-E858 VanDerWaalsContact C-N 3.28Å; R856-E858 PolarHBondContact O-N 3.29Å; R856-V859 PolarHBondContact O-N 3.03Å; R856-Y860 VanDerWaalsContact O-CD2 3.24Å; R856-Y860 WeakPolarHBondContact O-CD2 3.11Å; R856-Y860 PolarHBondContact O-N 2.96Å
857	A	64.2	Low	58.5	Low	43 Å²	43	79.9 Å²	79.9	36%	0.355	39%	0.394	S	S	.	.	H	α-helix	trans	-61.6	-32.8	178.3	0	0	0	0	0	113.5	Q853 Q854 V855 R861	Q853-A857 WeakPolarHBondContact O-CB 3.44Å; Q853-A857 PolarHBondContact O-N 3.08Å; Q854-A857 PolarHBondContact O-N 2.96Å; V855-A857 PolarHBondContact O-N 3.49Å; A857-R861 WeakPolarHBondContact O-CB 3.5Å; A857-R861 WeakPolarHBondContact O-CG 3.4Å; A857-R861 PolarHBondContact O-N 2.95Å; A857-R861 VanDerWaalsContact O-N 3.11Å; A857-R861 PolarHBondContact O-NE 2.79Å; A857-R861 VanDerWaalsContact O-NE 3.09Å
858	E	63.4	Low	59.9	Low	110 Å²	110	78 Å²	78	51%	0.514	39%	0.393	S	S	.	.	H	α-helix	trans	-69.6	-44.8	174.3	-157.4	67	-125.4	0	0	111.5	Q854 V855 R856 R861 S862	Q854-E858 PolarHBondContact O-N 2.95Å; V855-E858 WeakPolarHBondContact O-CB 3.34Å; V855-E858 PolarHBondContact O-N 3.32Å; R856-E858 VanDerWaalsContact C-N 3.28Å; R856-E858 PolarHBondContact O-N 3.29Å; E858-R861 PolarHBondContact O-N 3.34Å; E858-R861 IonicContact OE1-CZ 3.76Å; E858-R861 IonicContact OE1-NH1 3.82Å; E858-R861 PolarHBondContact OE1-NH1 3.5Å; E858-R861 IonicContact OE1-NH2 3.49Å; E858-R861 IonicContact OE2-CZ 2.67Å; E858-R861 IonicContact OE2-NH1 3.93Å; E858-R861 PolarHBondContact OE2-NH1 3.13Å; E858-R861 IonicContact OE2-NH2 3.92Å; E858-R861 PolarHBondContact OE2-NH2 3.4Å; E858-S862 WeakPolarHBondContact O-CB 3.38Å; E858-S862 PolarHBondContact O-N 2.97Å
859	V	59.5	Low	61	Low	24 Å²	24	77.5 Å²	77.5	15%	0.145	39%	0.389	C	S	.	.	H	α-helix	trans	-63.5	-45.5	176.9	176.8	0	0	0	0	110.8	K763 I767 V855 R856 R861 S862 L863	K763-V859 HydrophobicContact CB-CG1 4.14Å; K763-V859 HydrophobicContact CD-CG1 4.42Å; K763-V859 HydrophobicContact CG-CG1 4.39Å; I767-V859 HydrophobicContact CD1-CG1 4.03Å; I767-V859 HydrophobicContact CG1-CG1 3.95Å; V855-V859 HydrophobicContact CG1-CG2 4.46Å; V855-V859 WeakPolarHBondContact O-CG2 3.46Å; V855-V859 PolarHBondContact O-N 2.96Å; R856-V859 PolarHBondContact O-N 3.03Å; V859-R861 PolarHBondContact O-N 3.4Å; V859-S862 WeakPolarHBondContact O-CB 3.46Å; V859-S862 PolarHBondContact O-N 2.97Å; V859-L863 WeakPolarHBondContact O-CB 3.43Å; V859-L863 PolarHBondContact O-N 3.03Å
860	Y	61.2	Low	62.3	Low	103 Å²	103	77.2 Å²	77.2	40%	0.404	38%	0.377	S	S	.	.	H	α-helix	trans	-58.6	-46.1	173.8	-83.7	-69.5	0	0	0	112.4	I767 D771 R856 S862 L863 Q864	I767-Y860 HydrophobicContact CD1-CD1 3.71Å; I767-Y860 HydrophobicContact CD1-CD2 4.49Å; I767-Y860 HydrophobicContact CD1-CE1 3.73Å; I767-Y860 HydrophobicContact CD1-CG 4.11Å; I767-Y860 HydrophobicContact CG1-CE1 4.43Å; I767-Y860 HydrophobicContact CG2-CE1 3.95Å; I767-Y860 HydrophobicContact CG2-CE2 4.24Å; I767-Y860 VanDerWaalsContact CG2-OH 3.31Å; I767-Y860 WeakPolarHBondContact CG2-OH 3.36Å; D771-Y860 PolarHBondContact OD2-OH 3.17Å; R856-Y860 VanDerWaalsContact O-CD2 3.24Å; R856-Y860 WeakPolarHBondContact O-CD2 3.11Å; R856-Y860 PolarHBondContact O-N 2.96Å; Y860-S862 VanDerWaalsContact C-N 3.35Å; Y860-S862 PolarHBondContact O-N 2.97Å; Y860-L863 PolarHBondContact O-N 2.99Å; Y860-L863 VanDerWaalsContact O-N 3.16Å; Y860-Q864 WeakPolarHBondContact O-CG 3.5Å; Y860-Q864 PolarHBondContact O-N 3.47Å
861	R	65.8	Low	63.1	Low	134 Å²	134	75 Å²	75	51%	0.506	37%	0.374	S	S	.	.	H	α-helix	trans	-60.2	-43.2	175.9	-81.9	179.4	-77.8	122.8	-2.4	111.8	A857 E858 V859 L863 Q864 S865	A857-R861 WeakPolarHBondContact O-CB 3.5Å; A857-R861 WeakPolarHBondContact O-CG 3.4Å; A857-R861 PolarHBondContact O-N 2.95Å; A857-R861 VanDerWaalsContact O-N 3.11Å; A857-R861 PolarHBondContact O-NE 2.79Å; A857-R861 VanDerWaalsContact O-NE 3.09Å; E858-R861 PolarHBondContact O-N 3.34Å; E858-R861 IonicContact OE1-CZ 3.76Å; E858-R861 IonicContact OE1-NH1 3.82Å; E858-R861 PolarHBondContact OE1-NH1 3.5Å; E858-R861 IonicContact OE1-NH2 3.49Å; E858-R861 IonicContact OE2-CZ 2.67Å; E858-R861 IonicContact OE2-NH1 3.93Å; E858-R861 PolarHBondContact OE2-NH1 3.13Å; E858-R861 IonicContact OE2-NH2 3.92Å; E858-R861 PolarHBondContact OE2-NH2 3.4Å; V859-R861 PolarHBondContact O-N 3.4Å; R861-L863 VanDerWaalsContact C-N 3.32Å; R861-L863 PolarHBondContact O-N 2.88Å; R861-Q864 PolarHBondContact O-N 3.19Å; R861-S865 WeakPolarHBondContact O-CB 3.39Å; R861-S865 PolarHBondContact O-N 3.16Å
862	S	62.1	Low	64.4	Low	46 Å²	46	77.7 Å²	77.7	32%	0.322	38%	0.379	S	S	.	.	H	α-helix	trans	-60.2	-40.7	173.9	-170.4	0	0	0	0	112.1	K763 E858 V859 Y860 S865 M866	K763-S862 PolarHBondContact NZ-OG 3.42Å; E858-S862 WeakPolarHBondContact O-CB 3.38Å; E858-S862 PolarHBondContact O-N 2.97Å; V859-S862 WeakPolarHBondContact O-CB 3.46Å; V859-S862 PolarHBondContact O-N 2.97Å; Y860-S862 VanDerWaalsContact C-N 3.35Å; Y860-S862 PolarHBondContact O-N 2.97Å; S862-S865 WeakPolarHBondContact O-CB 3.49Å; S862-S865 PolarHBondContact O-N 2.89Å; S862-M866 WeakPolarHBondContact O-CG 3.4Å; S862-M866 PolarHBondContact O-N 2.85Å
863	L	65.8	Low	65.6	Low	4 Å²	4	78 Å²	78	2%	0.021	38%	0.378	C	S	.	.	H	α-helix	trans	-70.1	-41.8	-178.6	-141.5	159.5	0	0	0	112.3	M760 K763 E764 I767 V859 Y860 R861 S865 M866 R867	M760-L863 HydrophobicContact CB-CD2 4.5Å; M760-L863 HydrophobicContact CE-CD2 4.35Å; M760-L863 HydrophobicContact CG-CD2 4.25Å; K763-L863 HydrophobicContact CB-CD1 3.55Å; K763-L863 HydrophobicContact CB-CG 4.15Å; E764-L863 HydrophobicContact CG-CD1 3.72Å; E764-L863 HydrophobicContact CG-CD2 4.02Å; E764-L863 HydrophobicContact CG-CG 4.46Å; I767-L863 HydrophobicContact CD1-CD1 3.53Å; V859-L863 WeakPolarHBondContact O-CB 3.43Å; V859-L863 PolarHBondContact O-N 3.03Å; Y860-L863 PolarHBondContact O-N 2.99Å; Y860-L863 VanDerWaalsContact O-N 3.16Å; R861-L863 VanDerWaalsContact C-N 3.32Å; R861-L863 PolarHBondContact O-N 2.88Å; L863-S865 VanDerWaalsContact C-N 3.33Å; L863-S865 PolarHBondContact O-N 3.29Å; L863-M866 HydrophobicContact CG-CE 4.48Å; L863-M866 PolarHBondContact O-N 3.2Å; L863-R867 HydrophobicContact CD2-CG 4.17Å; L863-R867 VanDerWaalsContact CD2-NE 3.29Å; L863-R867 WeakPolarHBondContact O-CG 3.41Å; L863-R867 PolarHBondContact O-N 3.34Å
864	Q	66.2	Low	66.4	Low	108 Å²	108	76.1 Å²	76.1	51%	0.505	37%	0.369	S	S	.	.	H	α-helix	trans	-64.5	-37.1	173.1	-63.2	-67.4	19.8	0	0	111.9	Y860 R861 R867 L868	Y860-Q864 WeakPolarHBondContact O-CG 3.5Å; Y860-Q864 PolarHBondContact O-N 3.47Å; R861-Q864 PolarHBondContact O-N 3.19Å; Q864-R867 PolarHBondContact O-N 3.17Å; Q864-L868 PolarHBondContact O-N 3.5Å
865	S	67.5	Low	67	Low	76 Å²	76	73.2 Å²	73.2	53%	0.531	36%	0.362	S	S	.	.	H	α-helix	trans	-60.7	-47.4	173.1	-171.7	0	0	0	0	112	R861 S862 L863 R867 L868 E869	R861-S865 WeakPolarHBondContact O-CB 3.39Å; R861-S865 PolarHBondContact O-N 3.16Å; S862-S865 WeakPolarHBondContact O-CB 3.49Å; S862-S865 PolarHBondContact O-N 2.89Å; L863-S865 VanDerWaalsContact C-N 3.33Å; L863-S865 PolarHBondContact O-N 3.29Å; S865-R867 PolarHBondContact O-N 3.27Å; S865-L868 PolarHBondContact O-N 2.92Å; S865-E869 PolarHBondContact O-N 3.4Å
866	M	60.5	Low	67.8	Low	19 Å²	19	72.4 Å²	72.4	9%	0.094	36%	0.36	C	S	.	.	H	α-helix	trans	-66	-34.3	176.4	-67	-172.1	-41.5	0	0	113.1	L756 M760 K763 S862 L863 L868 R870	L756-M866 HydrophobicContact CD2-CB 4.09Å; L756-M866 HydrophobicContact CD2-CG 4.03Å; L756-M866 HydrophobicContact CD2-SD 4.26Å; M760-M866 HydrophobicContact CB-CE 4.47Å; M760-M866 HydrophobicContact CG-CB 4.2Å; M760-M866 HydrophobicContact CG-CE 3.9Å; K763-M866 HydrophobicContact CD-CE 3.68Å; K763-M866 PolarHBondContact NZ-SD 3.17Å; K763-M866 VanDerWaalsContact NZ-SD 3.42Å; S862-M866 WeakPolarHBondContact O-CG 3.4Å; S862-M866 PolarHBondContact O-N 2.85Å; L863-M866 HydrophobicContact CG-CE 4.48Å; L863-M866 PolarHBondContact O-N 3.2Å; M866-L868 VanDerWaalsContact C-N 3.34Å; M866-R870 VanDerWaalsContact O-CB 3.27Å; M866-R870 WeakPolarHBondContact O-CB 3.31Å; M866-R870 PolarHBondContact O-N 3.47Å
867	R	70	Confident	68.3	Low	105 Å²	105	70.7 Å²	70.7	40%	0.396	36%	0.355	S	S	.	.	H	α-helix	trans	-61.4	-42.5	171.5	-77.3	170.4	176.1	178.9	0.9	111.2	M760 E764 L863 Q864 S865 A871	M760-R867 HydrophobicContact CE-CG 3.44Å; M760-R867 VanDerWaalsContact CE-CG 3.44Å; M760-R867 HydrophobicContact SD-CG 3.94Å; E764-R867 IonicContact OE1-CZ 2.71Å; E764-R867 IonicContact OE1-NE 2.68Å; E764-R867 IonicContact OE1-NH2 3.55Å; E764-R867 PolarHBondContact OE1-NH2 3.25Å; L863-R867 HydrophobicContact CD2-CG 4.17Å; L863-R867 VanDerWaalsContact CD2-NE 3.29Å; L863-R867 WeakPolarHBondContact O-CG 3.41Å; L863-R867 PolarHBondContact O-N 3.34Å; Q864-R867 PolarHBondContact O-N 3.17Å; S865-R867 PolarHBondContact O-N 3.27Å; R867-A871 WeakPolarHBondContact O-CB 3.45Å; R867-A871 PolarHBondContact O-N 2.59Å
868	L	75.1	Confident	68.3	Low	98 Å²	98	76.4 Å²	76.4	51%	0.513	37%	0.368	S	S	.	.	H	α-helix	trans	-70.3	-40.2	177.5	-167.9	69.9	0	0	0	112.8	Q864 S865 M866 A871 R872	Q864-L868 PolarHBondContact O-N 3.5Å; S865-L868 PolarHBondContact O-N 2.92Å; M866-L868 VanDerWaalsContact C-N 3.34Å; L868-A871 PolarHBondContact O-N 3.12Å; L868-R872 WeakPolarHBondContact O-CG 3.5Å; L868-R872 PolarHBondContact O-N 2.96Å
869	E	69	Low	68.4	Low	71 Å²	71	76.6 Å²	76.6	33%	0.332	37%	0.369	S	S	.	.	H	α-helix	trans	-59.5	-49	172.7	-174.3	-174.3	155.1	0	0	110.5	R752 L756 S865 A871 R872 L873	R752-E869 IonicContact CZ-OE1 2.74Å; R752-E869 IonicContact NE-OE1 3.55Å; R752-E869 PolarHBondContact NE-OE1 3.22Å; R752-E869 IonicContact NH2-OE1 3.04Å; L756-E869 HydrophobicContact CD1-CB 4.35Å; L756-E869 HydrophobicContact CD1-CG 3.99Å; S865-E869 PolarHBondContact O-N 3.4Å; E869-A871 PolarHBondContact O-N 3.47Å; E869-R872 PolarHBondContact O-N 3.37Å; E869-L873 HydrophobicContact CG-CD1 4.24Å; E869-L873 WeakPolarHBondContact O-CG 3.23Å; E869-L873 PolarHBondContact O-N 3.26Å
870	R	75.4	Confident	68.6	Low	62 Å²	62	77.5 Å²	77.5	23%	0.234	37%	0.372	C	S	.	.	H	α-helix	trans	-61.2	-42.1	176.7	177.2	174.5	159.7	-159.5	-7.9	112.2	I753 L756 M866 L873 Q874	I753-R870 HydrophobicContact CG1-CG 4.44Å; I753-R870 HydrophobicContact CG2-CG 4.26Å; L756-R870 HydrophobicContact CD1-CB 4.14Å; M866-R870 VanDerWaalsContact O-CB 3.27Å; M866-R870 WeakPolarHBondContact O-CB 3.31Å; M866-R870 PolarHBondContact O-N 3.47Å; R870-L873 PolarHBondContact O-N 2.89Å; R870-Q874 HydrophobicContact CG-CG 4.48Å; R870-Q874 WeakPolarHBondContact O-CB 3.45Å; R870-Q874 WeakPolarHBondContact O-CG 3.44Å; R870-Q874 PolarHBondContact O-N 3.05Å
871	A	71	Confident	68.3	Low	48 Å²	48	77.4 Å²	77.4	40%	0.397	38%	0.379	S	S	.	.	H	α-helix	trans	-60.9	-45.8	176.4	0	0	0	0	0	111.6	R867 L868 E869 Q874 S875	R867-A871 WeakPolarHBondContact O-CB 3.45Å; R867-A871 PolarHBondContact O-N 2.59Å; L868-A871 PolarHBondContact O-N 3.12Å; E869-A871 PolarHBondContact O-N 3.47Å; A871-Q874 PolarHBondContact O-N 3.28Å; A871-S875 PolarHBondContact O-N 2.97Å; A871-S875 PolarHBondContact O-OG 3.5Å
872	R	76.3	Confident	67.6	Low	172 Å²	172	76.7 Å²	76.7	65%	0.649	38%	0.381	S	S	*	.	H	α-helix	trans	-59.9	-46.7	175.3	-74	175.4	173.8	175.9	-1.8	112.3	L868 E869 Q874 S875 S876	L868-R872 WeakPolarHBondContact O-CG 3.5Å; L868-R872 PolarHBondContact O-N 2.96Å; E869-R872 PolarHBondContact O-N 3.37Å; R872-Q874 VanDerWaalsContact C-N 3.31Å; R872-Q874 PolarHBondContact O-N 2.93Å; R872-S875 PolarHBondContact O-N 2.93Å; R872-S876 PolarHBondContact O-N 3.36Å
873	L	73.9	Confident	67.1	Low	44 Å²	44	78.1 Å²	78.1	23%	0.23	39%	0.388	C	S	.	.	H	α-helix	trans	-61.7	-37.9	176.5	-69.9	170.2	0	0	0	112.3	A749 R752 I753 L756 E869 R870 L877	A749-L873 HydrophobicContact CB-CD2 4.28Å; R752-L873 HydrophobicContact CB-CD1 4.1Å; R752-L873 HydrophobicContact CG-CD1 3.64Å; I753-L873 HydrophobicContact CD1-CB 3.86Å; I753-L873 HydrophobicContact CG1-CB 3.81Å; I753-L873 HydrophobicContact CG1-CD1 4.28Å; L756-L873 HydrophobicContact CD1-CD1 3.91Å; E869-L873 HydrophobicContact CG-CD1 4.24Å; E869-L873 WeakPolarHBondContact O-CG 3.23Å; E869-L873 PolarHBondContact O-N 3.26Å; R870-L873 PolarHBondContact O-N 2.89Å; L873-L877 PolarHBondContact O-N 3.35Å; L873-L877 VanDerWaalsContact O-N 3.12Å
874	Q	72.3	Confident	66.4	Low	71 Å²	71	80.8 Å²	80.8	33%	0.332	40%	0.402	S	S	.	.	H	α-helix	trans	-70.2	-34.2	175.6	-72.5	-170.6	-76.9	0	0	112.7	I753 R870 A871 R872 R878	I753-Q874 HydrophobicContact CD1-CG 3.63Å; I753-Q874 HydrophobicContact CG1-CG 4.18Å; I753-Q874 HydrophobicContact CG2-CG 4.44Å; R870-Q874 HydrophobicContact CG-CG 4.48Å; R870-Q874 WeakPolarHBondContact O-CB 3.45Å; R870-Q874 WeakPolarHBondContact O-CG 3.44Å; R870-Q874 PolarHBondContact O-N 3.05Å; A871-Q874 PolarHBondContact O-N 3.28Å; R872-Q874 VanDerWaalsContact C-N 3.31Å; R872-Q874 PolarHBondContact O-N 2.93Å; Q874-R878 WeakPolarHBondContact O-CG 3.41Å; Q874-R878 PolarHBondContact O-N 3.32Å
875	S	72.9	Confident	65	Low	60 Å²	60	80 Å²	80	42%	0.42	41%	0.409	S	S	.	.	H	α-helix	trans	-67	-47	172.4	-64.9	0	0	0	0	111.9	A871 R872 L877 R878 E879	A871-S875 PolarHBondContact O-N 2.97Å; A871-S875 PolarHBondContact O-OG 3.5Å; R872-S875 PolarHBondContact O-N 2.93Å; S875-L877 PolarHBondContact O-N 2.86Å; S875-R878 WeakPolarHBondContact O-CA 3.21Å; S875-R878 WeakPolarHBondContact O-CB 3.35Å; S875-R878 PolarHBondContact O-N 2.92Å; S875-E879 WeakPolarHBondContact O-CG 3.31Å; S875-E879 PolarHBondContact O-N 2.61Å
876	S	71.6	Confident	63.9	Low	62 Å²	62	86.8 Å²	86.8	43%	0.434	42%	0.423	S	S	.	.	H	α-helix	trans	-67.3	-21.7	178.4	-65	0	0	0	0	114.2	R872 L880	R872-S876 PolarHBondContact O-N 3.36Å; S876-L880 PolarHBondContact O-N 3.04Å
877	L	69.8	Low	63.1	Low	24 Å²	24	92.8 Å²	92.8	13%	0.126	45%	0.448	C	S	.	.	H	α-helix	trans	-69.9	-46.2	166.2	-90.1	160.3	0	0	0	111.7	A746 A749 E750 I753 L873 S875 E879 L880 D881	A746-L877 HydrophobicContact CB-CD2 3.89Å; A749-L877 HydrophobicContact CB-CD1 4Å; A749-L877 HydrophobicContact CB-CG 4.22Å; E750-L877 HydrophobicContact CG-CD1 3.9Å; E750-L877 HydrophobicContact CG-CD2 4.21Å; I753-L877 HydrophobicContact CD1-CD1 3.48Å; I753-L877 VanDerWaalsContact CD1-CD1 3.48Å; L873-L877 PolarHBondContact O-N 3.35Å; L873-L877 VanDerWaalsContact O-N 3.12Å; S875-L877 PolarHBondContact O-N 2.86Å; L877-E879 VanDerWaalsContact C-N 3.32Å; L877-E879 PolarHBondContact O-N 3.25Å; L877-L880 WeakPolarHBondContact O-CA 3.29Å; L877-L880 WeakPolarHBondContact O-CB 3.44Å; L877-L880 PolarHBondContact O-N 3.2Å; L877-D881 PolarHBondContact O-N 3.08Å
878	R	65.9	Low	61.6	Low	164 Å²	164	94 Å²	94	62%	0.619	47%	0.47	S	S	*	.	H	α-helix	trans	-60.1	-40.1	174.4	-65.4	179.8	-155.4	-159.6	7.3	112.2	Q874 S875 L880 D881 E882	Q874-R878 WeakPolarHBondContact O-CG 3.41Å; Q874-R878 PolarHBondContact O-N 3.32Å; S875-R878 WeakPolarHBondContact O-CA 3.21Å; S875-R878 WeakPolarHBondContact O-CB 3.35Å; S875-R878 PolarHBondContact O-N 2.92Å; R878-L880 VanDerWaalsContact C-N 3.3Å; R878-L880 PolarHBondContact O-N 2.88Å; R878-D881 PolarHBondContact O-N 3.02Å; R878-D881 VanDerWaalsContact O-N 3.16Å; R878-E882 WeakPolarHBondContact O-CB 3.34Å; R878-E882 WeakPolarHBondContact O-CG 3.43Å; R878-E882 PolarHBondContact O-N 3.31Å
879	E	65.6	Low	60	Low	114 Å²	114	95.2 Å²	95.2	53%	0.533	47%	0.473	S	S	.	.	H	α-helix	trans	-62.6	-35.3	173.5	-68.8	168.7	171.2	0	0	112.2	S875 L877 T883	S875-E879 WeakPolarHBondContact O-CG 3.31Å; S875-E879 PolarHBondContact O-N 2.61Å; L877-E879 VanDerWaalsContact C-N 3.32Å; L877-E879 PolarHBondContact O-N 3.25Å; E879-T883 WeakPolarHBondContact O-CB 3.48Å; E879-T883 VanDerWaalsContact O-CG2 3.25Å; E879-T883 WeakPolarHBondContact O-CG2 3.41Å; E879-T883 PolarHBondContact O-N 3.32Å; E879-T883 PolarHBondContact O-OG1 3Å
880	L	62.7	Low	58.6	Low	42 Å²	42	103.3 Å²	103.3	22%	0.22	50%	0.5	C	S	.	.	H	α-helix	trans	-65.8	-41.1	172.3	-111.8	74.3	0	0	0	111.8	K742 A746 S876 L877 R878 T883 N884	K742-L880 HydrophobicContact CB-CD2 4.38Å; A746-L880 HydrophobicContact CB-CD2 4.1Å; S876-L880 PolarHBondContact O-N 3.04Å; L877-L880 WeakPolarHBondContact O-CA 3.29Å; L877-L880 WeakPolarHBondContact O-CB 3.44Å; L877-L880 PolarHBondContact O-N 3.2Å; R878-L880 VanDerWaalsContact C-N 3.3Å; R878-L880 PolarHBondContact O-N 2.88Å; L880-T883 PolarHBondContact O-OG1 3.4Å; L880-N884 PolarHBondContact O-N 3.47Å; L880-N884 PolarHBondContact O-ND2 3.23Å
881	D	54	Low	57	Low	101 Å²	101	104.9 Å²	104.9	54%	0.54	51%	0.513	S	S	.	.	H	α-helix	trans	-75	-39.6	-179.9	-71.7	-28.1	0	0	0	112.9	L877 R878 T883 N884 S885	L877-D881 PolarHBondContact O-N 3.08Å; R878-D881 PolarHBondContact O-N 3.02Å; R878-D881 VanDerWaalsContact O-N 3.16Å; D881-T883 VanDerWaalsContact C-N 3.35Å; D881-T883 PolarHBondContact O-N 3.43Å; D881-N884 CarbonylContact O-C 3.59Å; D881-N884 WeakPolarHBondContact O-CB 3.46Å; D881-N884 PolarHBondContact O-N 2.9Å; D881-N884 VanDerWaalsContact O-N 3.12Å; D881-S885 VanDerWaalsContact O-CB 3.29Å; D881-S885 WeakPolarHBondContact O-CB 3.06Å; D881-S885 PolarHBondContact O-N 2.97Å
882	E	51.8	Low	55.7	Low	119 Å²	119	109.9 Å²	109.9	56%	0.556	52%	0.522	S	S	*	.	H	α-helix	trans	-64	-39.2	172.3	-73.7	-178.9	-157.2	0	0	111.6	R878 N884 S885 R886	R878-E882 WeakPolarHBondContact O-CB 3.34Å; R878-E882 WeakPolarHBondContact O-CG 3.43Å; R878-E882 PolarHBondContact O-N 3.31Å; E882-N884 VanDerWaalsContact C-N 3.26Å; E882-N884 PolarHBondContact O-N 2.94Å; E882-S885 PolarHBondContact O-N 3.35Å; E882-R886 PolarHBondContact O-N 3.15Å
883	T	52.7	Low	53.7	Low	76 Å²	76	108.9 Å²	108.9	47%	0.466	53%	0.529	S	S	.	.	H	α-helix	trans	-73.2	-14.8	173.7	59.2	0	0	0	0	113.9	K742 E879 L880 D881	K742-T883 PolarHBondContact NZ-OG1 2.95Å; E879-T883 WeakPolarHBondContact O-CB 3.48Å; E879-T883 VanDerWaalsContact O-CG2 3.25Å; E879-T883 WeakPolarHBondContact O-CG2 3.41Å; E879-T883 PolarHBondContact O-N 3.32Å; E879-T883 PolarHBondContact O-OG1 3Å; L880-T883 PolarHBondContact O-OG1 3.4Å; D881-T883 VanDerWaalsContact C-N 3.35Å; D881-T883 PolarHBondContact O-N 3.43Å
884	N	49.1	Very low	52	Low	60 Å²	60	114 Å²	114	32%	0.321	55%	0.55	S	S	.	*	H	α-helix	trans	-84.2	-41.8	165.2	-79	-38.3	0	0	0	112	L880 D881 E882 R886 K887 H889	L880-N884 PolarHBondContact O-N 3.47Å; L880-N884 PolarHBondContact O-ND2 3.23Å; D881-N884 CarbonylContact O-C 3.59Å; D881-N884 WeakPolarHBondContact O-CB 3.46Å; D881-N884 PolarHBondContact O-N 2.9Å; D881-N884 VanDerWaalsContact O-N 3.12Å; E882-N884 VanDerWaalsContact C-N 3.26Å; E882-N884 PolarHBondContact O-N 2.94Å; N884-R886 VanDerWaalsContact C-N 3.3Å; N884-R886 PolarHBondContact O-N 3.17Å; N884-K887 PolarHBondContact O-N 3.13Å; N884-H889 PolarHBondContact O-CE1 3.17Å; N884-H889 PolarHBondContact O-ND1 2.97Å
885	S	38.3	Very low	50.1	Low	93 Å²	93	113.6 Å²	113.6	65%	0.65	55%	0.55	S	S	*	*	H	α-helix	trans	-60.7	-34.9	-176.3	-176	0	0	0	0	112.8	D881 E882 K887	D881-S885 VanDerWaalsContact O-CB 3.29Å; D881-S885 WeakPolarHBondContact O-CB 3.06Å; D881-S885 PolarHBondContact O-N 2.97Å; E882-S885 PolarHBondContact O-N 3.35Å; S885-K887 PolarHBondContact O-N 2.95Å
886	R	43.9	Very low	48.4	Very low	217 Å²	217	119.4 Å²	119.4	82%	0.819	56%	0.564	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.5	15.9	173.5	-67.4	-173.7	-175.6	-169.4	3.1	115.4	E882 N884	E882-R886 PolarHBondContact O-N 3.15Å; N884-R886 VanDerWaalsContact C-N 3.3Å; N884-R886 PolarHBondContact O-N 3.17Å
887	K	43.1	Very low	46.7	Very low	145 Å²	145	123.9 Å²	123.9	63%	0.63	58%	0.576	S	S	*	*	S	Bend	trans	-131.7	132.6	165.2	-67	-170	176.5	-172.2	0	109.8	N884 S885 H889	N884-K887 PolarHBondContact O-N 3.13Å; S885-K887 PolarHBondContact O-N 2.95Å; K887-H889 PolarHBondContact O-N 3.19Å; K887-H889 PolarHBondContact O-ND1 3.44Å
888	P	38.6	Very low	45	Very low	132 Å²	132	128.3 Å²	128.3	86%	0.857	60%	0.595	S	S	*	*			trans	-63.5	107.5	-170.6	23.8	-33.9	0	0	0	112.5	R890	P888-R890 PolarHBondContact O-N 2.94Å
889	H	42.1	Very low	43.7	Very low	123 Å²	123	125.6 Å²	125.6	57%	0.569	59%	0.591	S	S	*	*			trans	-80.1	76.5	-177.3	-86.6	61.7	0	0	0	111.8	N884 K887	N884-H889 PolarHBondContact O-CE1 3.17Å; N884-H889 PolarHBondContact O-ND1 2.97Å; K887-H889 PolarHBondContact O-N 3.19Å; K887-H889 PolarHBondContact O-ND1 3.44Å
890	R	40.6	Very low	42.5	Very low	240 Å²	240	125.5 Å²	125.5	91%	0.906	59%	0.591	S	S	*	*	S	Bend	trans	-134.3	2	171.8	-135.4	178.9	-170.4	-172.1	2.9	116	P888	P888-R890 PolarHBondContact O-N 2.94Å
891	N	41.5	Very low	41.2	Very low	95 Å²	95	129.2 Å²	129.2	51%	0.508	61%	0.605	S	S	.	*	S	Bend	trans	-148.8	33.1	-168.4	-149.6	7.1	0	0	0	116.7	N895	N891-N895 VanDerWaalsContact CG-ND2 3.32Å; N891-N895 PolarHBondContact O-ND2 3.2Å; N891-N895 PolarHBondContact OD1-ND2 3.04Å
892	R	42.3	Very low	40.3	Very low	154 Å²	154	130.2 Å²	130.2	58%	0.581	61%	0.606	S	S	*	*	S	Bend	trans	-94.5	-62	175.2	-85.1	178.7	165.3	167.7	-9.1	113.1	F894 N895	R892-F894 VanDerWaalsContact C-N 3.26Å; R892-F894 PolarHBondContact O-N 3.32Å; R892-N895 PolarHBondContact O-N 3.4Å
893	N	35.5	Very low	39.5	Very low	150 Å²	150	131.1 Å²	131.1	80%	0.802	61%	0.614	S	S	*	*	H	α-helix	trans	-64.9	-31.2	-178.8	-64.2	7.4	0	0	0	112.4	N895	N893-N895 VanDerWaalsContact C-N 3.34Å; N893-N895 PolarHBondContact O-N 2.76Å
894	F	38.1	Very low	38.9	Very low	152 Å²	152	132.3 Å²	132.3	67%	0.667	62%	0.617	S	S	*	*	H	α-helix	trans	-65	-34.2	178	-141.4	-92.9	0	0	0	113	R892 K898	R892-F894 VanDerWaalsContact C-N 3.26Å; R892-F894 PolarHBondContact O-N 3.32Å; F894-K898 VanDerWaalsContact O-CB 3.3Å; F894-K898 WeakPolarHBondContact O-CB 3.35Å; F894-K898 PolarHBondContact O-N 3.06Å
895	N	32.9	Very low	38.5	Very low	62 Å²	62	133.7 Å²	133.7	33%	0.332	62%	0.62	S	S	.	*	H	α-helix	trans	-75.8	-32.6	-178	-87.4	-46	0	0	0	113.3	N891 R892 N893 K898 I899	N891-N895 VanDerWaalsContact CG-ND2 3.32Å; N891-N895 PolarHBondContact O-ND2 3.2Å; N891-N895 PolarHBondContact OD1-ND2 3.04Å; R892-N895 PolarHBondContact O-N 3.4Å; N893-N895 VanDerWaalsContact C-N 3.34Å; N893-N895 PolarHBondContact O-N 2.76Å; N895-K898 PolarHBondContact O-N 3.25Å; N895-I899 WeakPolarHBondContact O-CB 3.28Å; N895-I899 VanDerWaalsContact O-CG1 3.25Å; N895-I899 WeakPolarHBondContact O-CG1 3.38Å; N895-I899 PolarHBondContact O-N 3.03Å
896	Y	36.8	Very low	38.5	Very low	182 Å²	182	131.9 Å²	131.9	71%	0.714	61%	0.611	S	S	*	*	H	α-helix	trans	-60.1	-49.2	175.1	-125.8	-91.8	0	0	0	110.6	K898 I899 Q900	Y896-K898 PolarHBondContact O-N 3.44Å; Y896-I899 PolarHBondContact O-N 3.16Å; Y896-Q900 WeakPolarHBondContact O-CB 3.44Å; Y896-Q900 PolarHBondContact O-N 2.87Å
897	F	36.5	Very low	38.5	Very low	157 Å²	157	123.5 Å²	123.5	69%	0.689	59%	0.592	S	S	*	*	H	α-helix	trans	-65	-38	176.1	-126.2	-92	0	0	0	112.7	Q900 K901	F897-Q900 PolarHBondContact O-N 3.12Å; F897-K901 VanDerWaalsContact O-CB 3.26Å; F897-K901 WeakPolarHBondContact O-CB 3.48Å; F897-K901 PolarHBondContact O-N 2.78Å
898	K	32.8	Very low	38.4	Very low	117 Å²	117	123.2 Å²	123.2	51%	0.509	59%	0.592	S	S	.	*	H	α-helix	trans	-69.2	-37.1	179.8	-161.5	173.2	-174	-178.7	0	112.8	F894 N895 Y896 H902	F894-K898 VanDerWaalsContact O-CB 3.3Å; F894-K898 WeakPolarHBondContact O-CB 3.35Å; F894-K898 PolarHBondContact O-N 3.06Å; N895-K898 PolarHBondContact O-N 3.25Å; Y896-K898 PolarHBondContact O-N 3.44Å; K898-H902 PolarHBondContact O-N 3.3Å; K898-H902 PolarHBondContact O-ND1 3.04Å
899	I	39.9	Very low	38.4	Very low	107 Å²	107	122.4 Å²	122.4	55%	0.549	58%	0.577	S	S	.	*	H	α-helix	trans	-68.6	-47.1	173.7	-69.1	165.5	0	0	0	110.1	N895 Y896 K901 H902 L903	N895-I899 WeakPolarHBondContact O-CB 3.28Å; N895-I899 VanDerWaalsContact O-CG1 3.25Å; N895-I899 WeakPolarHBondContact O-CG1 3.38Å; N895-I899 PolarHBondContact O-N 3.03Å; Y896-I899 PolarHBondContact O-N 3.16Å; I899-K901 VanDerWaalsContact C-N 3.32Å; I899-K901 PolarHBondContact O-N 3.35Å; I899-H902 PolarHBondContact O-N 3.31Å; I899-H902 VanDerWaalsContact O-N 3.14Å; I899-L903 PolarHBondContact O-N 3.3Å
900	Q	39	Very low	38.3	Very low	111 Å²	111	120.1 Å²	120.1	52%	0.519	57%	0.574	S	S	.	*	H	α-helix	trans	-62.3	-39.6	179	-158.5	168.1	4.2	0	0	111.7	Y896 F897 L903 I904	Y896-Q900 WeakPolarHBondContact O-CB 3.44Å; Y896-Q900 PolarHBondContact O-N 2.87Å; F897-Q900 PolarHBondContact O-N 3.12Å; Q900-L903 PolarHBondContact O-N 3.47Å; Q900-I904 HydrophobicContact CG-CD1 4.42Å; Q900-I904 WeakPolarHBondContact O-CG1 3.39Å; Q900-I904 PolarHBondContact O-N 3.46Å
901	K	34.9	Very low	38.5	Very low	121 Å²	121	112.8 Å²	112.8	53%	0.526	56%	0.556	S	S	.	*	H	α-helix	trans	-65.4	-38.4	173	-168.1	165.6	-175.6	169.6	0	112.7	F897 I899 F905	F897-K901 VanDerWaalsContact O-CB 3.26Å; F897-K901 WeakPolarHBondContact O-CB 3.48Å; F897-K901 PolarHBondContact O-N 2.78Å; I899-K901 VanDerWaalsContact C-N 3.32Å; I899-K901 PolarHBondContact O-N 3.35Å; K901-F905 HydrophobicContact CG-CD2 4.13Å; K901-F905 HydrophobicContact CG-CE2 4.33Å; K901-F905 WeakPolarHBondContact O-CB 3.31Å; K901-F905 WeakPolarHBondContact O-CD2 3.23Å; K901-F905 PolarHBondContact O-N 3.14Å
902	H	35.5	Very low	38.6	Very low	121 Å²	121	112.9 Å²	112.9	56%	0.56	56%	0.559	S	S	*	*	H	α-helix	trans	-68	-41.5	174.5	-84.3	70.6	0	0	0	112.8	K898 I899 I904 F905 A906	K898-H902 PolarHBondContact O-N 3.3Å; K898-H902 PolarHBondContact O-ND1 3.04Å; I899-H902 PolarHBondContact O-N 3.31Å; I899-H902 VanDerWaalsContact O-N 3.14Å; H902-I904 VanDerWaalsContact C-N 3.32Å; H902-I904 PolarHBondContact O-N 3.06Å; H902-F905 PolarHBondContact O-N 3.11Å; H902-A906 VanDerWaalsContact O-CB 3.23Å; H902-A906 WeakPolarHBondContact O-CB 3.27Å; H902-A906 PolarHBondContact O-N 2.68Å
903	L	35.1	Very low	38.7	Very low	139 Å²	139	108.9 Å²	108.9	73%	0.728	55%	0.552	S	S	*	*	H	α-helix	trans	-64.2	-38.9	-178.2	-135.5	72.1	0	0	0	111.9	I899 Q900	I899-L903 PolarHBondContact O-N 3.3Å; Q900-L903 PolarHBondContact O-N 3.47Å
904	I	40.3	Very low	39.2	Very low	101 Å²	101	106.9 Å²	106.9	52%	0.518	54%	0.54	S	S	.	.	H	α-helix	trans	-73.5	-44.7	177.1	-64.1	168.2	0	0	0	111	Q900 H902 G907 H908	Q900-I904 HydrophobicContact CG-CD1 4.42Å; Q900-I904 WeakPolarHBondContact O-CG1 3.39Å; Q900-I904 PolarHBondContact O-N 3.46Å; H902-I904 VanDerWaalsContact C-N 3.32Å; H902-I904 PolarHBondContact O-N 3.06Å; I904-G907 PolarHBondContact O-N 2.91Å; I904-H908 PolarHBondContact O-CD2 3.3Å; I904-H908 PolarHBondContact O-N 3.39Å
905	F	41.6	Very low	39.5	Very low	88 Å²	88	104.2 Å²	104.2	39%	0.386	53%	0.532	S	S	.	.	H	α-helix	trans	-65.4	-40.5	178.1	-95.2	-109.8	0	0	0	113	K901 H902 G907 H908 H909	K901-F905 HydrophobicContact CG-CD2 4.13Å; K901-F905 HydrophobicContact CG-CE2 4.33Å; K901-F905 WeakPolarHBondContact O-CB 3.31Å; K901-F905 WeakPolarHBondContact O-CD2 3.23Å; K901-F905 PolarHBondContact O-N 3.14Å; H902-F905 PolarHBondContact O-N 3.11Å; F905-G907 VanDerWaalsContact C-N 3.32Å; F905-G907 PolarHBondContact O-N 3.11Å; F905-H908 PolarHBondContact O-N 3.31Å; F905-H909 VanDerWaalsContact O-CB 3.25Å; F905-H909 WeakPolarHBondContact O-CB 3.39Å; F905-H909 PolarHBondContact O-N 2.93Å
906	A	37.4	Very low	40	Very low	56 Å²	56	104.4 Å²	104.4	46%	0.463	54%	0.538	S	S	.	.	H	α-helix	trans	-61.2	-40.9	180	0	0	0	0	0	111.9	H902 C910	H902-A906 VanDerWaalsContact O-CB 3.23Å; H902-A906 WeakPolarHBondContact O-CB 3.27Å; H902-A906 PolarHBondContact O-N 2.68Å; A906-C910 WeakPolarHBondContact O-CB 3.31Å; A906-C910 PolarHBondContact O-N 3.09Å; A906-C910 VanDerWaalsContact O-N 3.07Å; A906-C910 PolarHBondContact O-SG 2.85Å
907	G	43.6	Very low	40.4	Very low	40 Å²	40	99 Å²	99	41%	0.412	53%	0.526	S	S	.	.	H	α-helix	trans	-59.8	-52.8	176.3	0	0	0	0	0	112.9	I904 F905 V911	I904-G907 PolarHBondContact O-N 2.91Å; F905-G907 VanDerWaalsContact C-N 3.32Å; F905-G907 PolarHBondContact O-N 3.11Å; G907-V911 WeakPolarHBondContact O-CG2 3.46Å; G907-V911 PolarHBondContact O-N 3.3Å
908	H	41.5	Very low	40.8	Very low	139 Å²	139	94.9 Å²	94.9	64%	0.644	52%	0.517	S	S	*	.	H	α-helix	trans	-67.9	-39.6	-179	-76.8	-112.4	0	0	0	112.4	I904 F905 C910 V911 V912	I904-H908 PolarHBondContact O-CD2 3.3Å; I904-H908 PolarHBondContact O-N 3.39Å; F905-H908 PolarHBondContact O-N 3.31Å; H908-C910 PolarHBondContact O-N 2.99Å; H908-V911 PolarHBondContact O-N 3.41Å; H908-V912 PolarHBondContact O-N 2.92Å; H908-V912 VanDerWaalsContact O-N 3.15Å
909	H	39.2	Very low	41.5	Very low	116 Å²	116	92.7 Å²	92.7	54%	0.537	51%	0.513	S	S	.	.	H	α-helix	trans	-71.1	-29.9	-177.6	-151.3	-49.9	0	0	0	112.8	F905 V913	F905-H909 VanDerWaalsContact O-CB 3.25Å; F905-H909 WeakPolarHBondContact O-CB 3.39Å; F905-H909 PolarHBondContact O-N 2.93Å; H909-V913 WeakPolarHBondContact O-CB 3.48Å; H909-V913 WeakPolarHBondContact O-CG2 3.47Å; H909-V913 PolarHBondContact O-N 3.18Å
910	C	40.4	Very low	41.7	Very low	74 Å²	74	93.9 Å²	93.9	50%	0.5	52%	0.516	S	S	.	.	H	α-helix	trans	-69.2	-45.5	170.8	-72.9	0	0	0	0	111.9	A906 H908 V912 V913 I914	A906-C910 WeakPolarHBondContact O-CB 3.31Å; A906-C910 PolarHBondContact O-N 3.09Å; A906-C910 VanDerWaalsContact O-N 3.07Å; A906-C910 PolarHBondContact O-SG 2.85Å; H908-C910 PolarHBondContact O-N 2.99Å; C910-V912 PolarHBondContact O-N 2.92Å; C910-V913 PolarHBondContact O-N 3.4Å; C910-I914 HydrophobicContact CB-CD1 4.47Å; C910-I914 WeakPolarHBondContact O-CB 3.44Å; C910-I914 WeakPolarHBondContact O-CD1 3.27Å; C910-I914 WeakPolarHBondContact O-CG1 3.43Å; C910-I914 PolarHBondContact O-N 2.87Å
911	V	43.4	Very low	42	Very low	87 Å²	87	90.3 Å²	90.3	53%	0.527	51%	0.509	S	S	.	.	H	α-helix	trans	-61.4	-47.6	-177.6	170.5	0	0	0	0	111.8	G907 H908 I914 L915	G907-V911 WeakPolarHBondContact O-CG2 3.46Å; G907-V911 PolarHBondContact O-N 3.3Å; H908-V911 PolarHBondContact O-N 3.41Å; V911-I914 PolarHBondContact O-N 2.85Å; V911-L915 HydrophobicContact CG1-CD1 3.86Å; V911-L915 WeakPolarHBondContact O-CB 3.38Å; V911-L915 PolarHBondContact O-N 2.86Å
912	V	43.5	Very low	42.6	Very low	97 Å²	97	90.5 Å²	90.5	59%	0.588	52%	0.515	S	S	*	.	H	α-helix	trans	-66.5	-41.8	-179.7	177.1	0	0	0	0	111.9	H908 C910 L915 C916	H908-V912 PolarHBondContact O-N 2.92Å; H908-V912 VanDerWaalsContact O-N 3.15Å; C910-V912 PolarHBondContact O-N 2.92Å; V912-L915 PolarHBondContact O-N 3.36Å; V912-C916 WeakPolarHBondContact O-CB 3.27Å; V912-C916 PolarHBondContact O-N 3.44Å
913	V	45.1	Very low	43	Very low	70 Å²	70	93.2 Å²	93.2	42%	0.424	53%	0.526	S	S	.	.	H	α-helix	trans	-66.4	-42.1	178	171.4	0	0	0	0	111.3	H909 C910 C916 S917	H909-V913 WeakPolarHBondContact O-CB 3.48Å; H909-V913 WeakPolarHBondContact O-CG2 3.47Å; H909-V913 PolarHBondContact O-N 3.18Å; C910-V913 PolarHBondContact O-N 3.4Å; V913-C916 PolarHBondContact O-N 3.17Å; V913-S917 WeakPolarHBondContact O-CB 3.48Å; V913-S917 PolarHBondContact O-N 2.95Å; V913-S917 PolarHBondContact O-OG 3.41Å
914	I	45.4	Very low	43.4	Very low	108 Å²	108	91.5 Å²	91.5	55%	0.554	53%	0.525	S	S	*	.	H	α-helix	trans	-63	-46.8	177.1	-70	165.8	0	0	0	110.8	C910 V911 C916 S917 C918	C910-I914 HydrophobicContact CB-CD1 4.47Å; C910-I914 WeakPolarHBondContact O-CB 3.44Å; C910-I914 WeakPolarHBondContact O-CD1 3.27Å; C910-I914 WeakPolarHBondContact O-CG1 3.43Å; C910-I914 PolarHBondContact O-N 2.87Å; V911-I914 PolarHBondContact O-N 2.85Å; I914-C916 PolarHBondContact O-N 2.74Å; I914-S917 PolarHBondContact O-N 3.42Å; I914-C918 PolarHBondContact O-N 3.1Å; I914-C918 PolarHBondContact O-SG 2.95Å
915	L	45.5	Very low	43.6	Very low	95 Å²	95	90.5 Å²	90.5	50%	0.497	53%	0.527	S	S	.	.	H	α-helix	trans	-60.2	-46.5	176.7	-85.2	159.1	0	0	0	112.1	V911 V912 S917 C918 V919	V911-L915 HydrophobicContact CG1-CD1 3.86Å; V911-L915 WeakPolarHBondContact O-CB 3.38Å; V911-L915 PolarHBondContact O-N 2.86Å; V912-L915 PolarHBondContact O-N 3.36Å; L915-S917 PolarHBondContact O-N 2.85Å; L915-C918 PolarHBondContact O-N 3.27Å; L915-V919 WeakPolarHBondContact O-CG2 3.48Å; L915-V919 PolarHBondContact O-N 3.38Å
916	C	43	Very low	43.8	Very low	67 Å²	67	92.2 Å²	92.2	45%	0.453	55%	0.55	S	S	.	.	H	α-helix	trans	-64	-40.4	178.4	-167.7	0	0	0	0	112	V912 V913 I914 V919 Q920	V912-C916 WeakPolarHBondContact O-CB 3.27Å; V912-C916 PolarHBondContact O-N 3.44Å; V913-C916 PolarHBondContact O-N 3.17Å; I914-C916 PolarHBondContact O-N 2.74Å; C916-V919 PolarHBondContact O-N 3.39Å; C916-Q920 WeakPolarHBondContact O-CG 3.39Å; C916-Q920 PolarHBondContact O-N 2.91Å
917	S	44.8	Very low	44	Very low	67 Å²	67	95.1 Å²	95.1	47%	0.469	56%	0.562	S	S	.	*	H	α-helix	trans	-63.5	-39.2	173.1	-64	0	0	0	0	112.9	V913 I914 L915 Q920 G921	V913-S917 WeakPolarHBondContact O-CB 3.48Å; V913-S917 PolarHBondContact O-N 2.95Å; V913-S917 PolarHBondContact O-OG 3.41Å; I914-S917 PolarHBondContact O-N 3.42Å; L915-S917 PolarHBondContact O-N 2.85Å; S917-Q920 PolarHBondContact O-N 3.34Å; S917-G921 PolarHBondContact O-N 2.85Å
918	C	45.1	Very low	44.1	Very low	72 Å²	72	99.1 Å²	99.1	49%	0.486	58%	0.58	S	S	.	*	H	α-helix	trans	-64.6	-42.2	174.7	-70.5	0	0	0	0	112.1	I914 L915 G921 L922	I914-C918 PolarHBondContact O-N 3.1Å; I914-C918 PolarHBondContact O-SG 2.95Å; L915-C918 PolarHBondContact O-N 3.27Å; C918-G921 PolarHBondContact O-N 3.38Å; C918-L922 WeakPolarHBondContact O-CG 3.13Å; C918-L922 PolarHBondContact O-N 3.32Å
919	V	46.6	Very low	44.4	Very low	70 Å²	70	101.2 Å²	101.2	42%	0.424	59%	0.59	S	S	.	*	H	α-helix	trans	-66.3	-35.9	176.6	172.1	0	0	0	0	111.9	L915 C916 K923	L915-V919 WeakPolarHBondContact O-CG2 3.48Å; L915-V919 PolarHBondContact O-N 3.38Å; C916-V919 PolarHBondContact O-N 3.39Å; V919-K923 WeakPolarHBondContact O-CG 3.34Å; V919-K923 PolarHBondContact O-N 3.14Å
920	Q	45.2	Very low	44.5	Very low	132 Å²	132	103.7 Å²	103.7	62%	0.617	61%	0.607	S	S	*	*	H	α-helix	trans	-69.9	-40.5	172.8	-73.1	-178.8	-8.6	0	0	112.2	C916 S917 L922 K923	C916-Q920 WeakPolarHBondContact O-CG 3.39Å; C916-Q920 PolarHBondContact O-N 2.91Å; S917-Q920 PolarHBondContact O-N 3.34Å; Q920-L922 PolarHBondContact O-N 3.01Å; Q920-K923 PolarHBondContact O-N 3.49Å
921	G	45	Very low	44.8	Very low	37 Å²	37	102.3 Å²	102.3	38%	0.381	60%	0.599	S	S	.	*	H	α-helix	trans	-59.2	-44.8	174.7	0	0	0	0	0	112.7	S917 C918 K923 S924	S917-G921 PolarHBondContact O-N 2.85Å; C918-G921 PolarHBondContact O-N 3.38Å; G921-K923 VanDerWaalsContact C-N 3.26Å; G921-K923 PolarHBondContact O-N 3.06Å; G921-S924 PolarHBondContact O-N 3.26Å; G921-S924 PolarHBondContact O-OG 3.37Å
922	L	47.1	Very low	45	Very low	124 Å²	124	103 Å²	103	65%	0.649	61%	0.605	S	S	*	*	H	α-helix	trans	-62.2	-29.5	177.3	-74.7	165.7	0	0	0	113.4	C918 Q920 S924	C918-L922 WeakPolarHBondContact O-CG 3.13Å; C918-L922 PolarHBondContact O-N 3.32Å; Q920-L922 PolarHBondContact O-N 3.01Å; L922-S924 PolarHBondContact O-N 3.48Å
923	K	44.3	Very low	45.4	Very low	179 Å²	179	102.8 Å²	102.8	78%	0.778	60%	0.604	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.8	-4.2	175.2	-71.5	178.9	-179.8	-177.9	0	114.4	V919 Q920 G921	V919-K923 WeakPolarHBondContact O-CG 3.34Å; V919-K923 PolarHBondContact O-N 3.14Å; Q920-K923 PolarHBondContact O-N 3.49Å; G921-K923 VanDerWaalsContact C-N 3.26Å; G921-K923 PolarHBondContact O-N 3.06Å
924	S	42.9	Very low	45.5	Very low	103 Å²	103	105.3 Å²	105.3	72%	0.72	61%	0.611	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.9	0.4	179	69.1	0	0	0	0	114.4	G921 L922	G921-S924 PolarHBondContact O-N 3.26Å; G921-S924 PolarHBondContact O-OG 3.37Å; L922-S924 PolarHBondContact O-N 3.48Å
925	S	44.3	Very low	45.7	Very low	80 Å²	80	104.1 Å²	104.1	56%	0.559	61%	0.609	S	S	*	*	S	Bend	trans	-108.8	108.9	-179.5	-176.3	0	0	0	0	111	V927	S925-V927 PolarHBondContact O-N 3.27Å
926	S	46.5	Very low	45.8	Very low	123 Å²	123	104.8 Å²	104.8	86%	0.86	61%	0.613	S	S	*	*			trans	-75.7	109.7	179.8	56.2	0	0	0	0	112.2
927	V	42.4	Very low	46.1	Very low	118 Å²	118	109.8 Å²	109.8	72%	0.715	62%	0.622	S	S	*	*			trans	-136	138.2	174.1	-178.9	0	0	0	0	107.7	S925	S925-V927 PolarHBondContact O-N 3.27Å
928	P	45.7	Very low	46.2	Very low	123 Å²	123	113.1 Å²	113.1	80%	0.799	63%	0.632	S	S	*	*			trans	-80.6	166.9	-163.4	31.7	-37.2	0	0	0	115.4
929	E	48	Very low	46.4	Very low	184 Å²	184	115.4 Å²	115.4	86%	0.86	64%	0.639	S	S	*	*			trans	-59.1	134.8	-178.9	-55.2	171.2	119.5	0	0	113.3
930	N	41.3	Very low	46.6	Very low	167 Å²	167	118.7 Å²	118.7	89%	0.893	65%	0.649	S	S	*	*			trans	177.7	70.4	144.4	-98.8	-53	0	0	0	114.8
931	S	44.8	Very low	46.5	Very low	45 Å²	45	117 Å²	117	32%	0.315	64%	0.644	S	S	.	*			trans	-169.2	143.3	141.7	86.3	0	0	0	0	112.8	V933 E934	S931-V933 VanDerWaalsContact C-N 3.27Å; S931-V933 PolarHBondContact OG-N 2.94Å; S931-E934 WeakPolarHBondContact OG-CG 3.44Å; S931-E934 PolarHBondContact OG-N 3.46Å; S931-E934 PolarHBondContact OG-OE2 3.29Å
932	P	49	Very low	46.4	Very low	102 Å²	102	117.8 Å²	117.8	66%	0.662	64%	0.644	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.4	4.1	170	34.3	-35.2	0	0	0	113.6	N936	P932-N936 PolarHBondContact O-ND2 2.97Å
933	V	50.7	Low	46.5	Very low	93 Å²	93	115.4 Å²	115.4	56%	0.564	64%	0.638	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.2	-34.2	-174.5	-179.6	0	0	0	0	111.5	S931 R937	S931-V933 VanDerWaalsContact C-N 3.27Å; S931-V933 PolarHBondContact OG-N 2.94Å; V933-R937 PolarHBondContact O-N 3.41Å
934	E	47.7	Very low	47.2	Very low	123 Å²	123	113 Å²	113	58%	0.575	62%	0.624	S	S	*	*	H	α-helix	trans	-78.4	-34.2	-177.5	-70.3	167.5	122.7	0	0	112.9	S931 N936 R937 M938	S931-E934 WeakPolarHBondContact OG-CG 3.44Å; S931-E934 PolarHBondContact OG-N 3.46Å; S931-E934 PolarHBondContact OG-OE2 3.29Å; E934-N936 VanDerWaalsContact C-N 3.34Å; E934-N936 PolarHBondContact O-N 3.24Å; E934-R937 PolarHBondContact O-N 3.06Å; E934-M938 PolarHBondContact O-N 2.92Å
935	T	49.2	Very low	47.3	Very low	83 Å²	83	112.3 Å²	112.3	51%	0.509	61%	0.612	S	S	.	*	H	α-helix	trans	-61.6	-40.9	174.6	47.9	0	0	0	0	112.2	M938 L939	T935-M938 PolarHBondContact O-N 3.43Å; T935-L939 WeakPolarHBondContact O-CG 3.27Å; T935-L939 PolarHBondContact O-N 3.09Å; T935-L939 VanDerWaalsContact O-N 3.12Å
936	N	48.6	Very low	47.6	Very low	108 Å²	108	114.5 Å²	114.5	58%	0.578	61%	0.613	S	S	*	*	H	α-helix	trans	-67.1	-33.2	175.5	-80.2	-67.4	0	0	0	112.9	P932 E934 H940	P932-N936 PolarHBondContact O-ND2 2.97Å; E934-N936 VanDerWaalsContact C-N 3.34Å; E934-N936 PolarHBondContact O-N 3.24Å; N936-H940 PolarHBondContact O-N 3.28Å
937	R	49.6	Very low	48.2	Very low	173 Å²	173	113.7 Å²	113.7	65%	0.653	60%	0.596	S	S	*	*	H	α-helix	trans	-66.1	-48.9	171	-80.4	-174.5	173.2	165.9	0	111.8	V933 E934 L939 H940 D941	V933-R937 PolarHBondContact O-N 3.41Å; E934-R937 PolarHBondContact O-N 3.06Å; R937-L939 VanDerWaalsContact C-N 3.25Å; R937-L939 PolarHBondContact O-N 3.35Å; R937-H940 PolarHBondContact O-N 3.45Å; R937-D941 PolarHBondContact O-N 3.41Å
938	M	45.5	Very low	48.9	Very low	137 Å²	137	111.6 Å²	111.6	68%	0.675	58%	0.578	S	S	*	*	H	α-helix	trans	-60	-33.7	180	-72.8	-167.3	172	0	0	113.3	E934 T935 S942	E934-M938 PolarHBondContact O-N 2.92Å; T935-M938 PolarHBondContact O-N 3.43Å; M938-S942 WeakPolarHBondContact O-CB 3.3Å; M938-S942 PolarHBondContact O-N 3.09Å
939	L	49.5	Very low	49.1	Very low	119 Å²	119	112 Å²	112	62%	0.623	57%	0.569	S	S	*	*	H	α-helix	trans	-68.4	-43	173.3	-72.9	168.1	0	0	0	112.3	T935 R937 S942 S943	T935-L939 WeakPolarHBondContact O-CG 3.27Å; T935-L939 PolarHBondContact O-N 3.09Å; T935-L939 VanDerWaalsContact O-N 3.12Å; R937-L939 VanDerWaalsContact C-N 3.25Å; R937-L939 PolarHBondContact O-N 3.35Å; L939-S942 PolarHBondContact O-N 2.99Å; L939-S943 PolarHBondContact O-N 3.18Å
940	H	51.1	Low	49.4	Very low	140 Å²	140	109.6 Å²	109.6	65%	0.648	56%	0.558	S	S	*	*	H	α-helix	trans	-66.6	-38.3	176.7	-166.8	-38.2	0	0	0	112.1	N936 R937 W944	N936-H940 PolarHBondContact O-N 3.28Å; R937-H940 PolarHBondContact O-N 3.45Å; H940-W944 WeakPolarHBondContact O-CB 3.1Å; H940-W944 PolarHBondContact O-N 3.43Å; H940-W944 VanDerWaalsContact O-N 3.08Å
941	D	44	Very low	50.4	Low	96 Å²	96	106.1 Å²	106.1	51%	0.513	53%	0.532	S	S	.	.	H	α-helix	trans	-68.3	-36.1	175.4	-68	-33	0	0	0	111.4	R937 L945	R937-D941 PolarHBondContact O-N 3.41Å; D941-L945 VanDerWaalsContact O-CG 3.29Å; D941-L945 WeakPolarHBondContact O-CG 3.25Å; D941-L945 PolarHBondContact O-N 2.93Å; D941-L945 VanDerWaalsContact O-N 3.09Å
942	S	43.4	Very low	50.7	Low	54 Å²	54	105.9 Å²	105.9	38%	0.378	53%	0.533	S	S	.	.	H	α-helix	trans	-66.8	-47.5	174.9	-161.2	0	0	0	0	112.2	M938 L939 W944 L945 E946	M938-S942 WeakPolarHBondContact O-CB 3.3Å; M938-S942 PolarHBondContact O-N 3.09Å; L939-S942 PolarHBondContact O-N 2.99Å; S942-W944 VanDerWaalsContact C-N 3.3Å; S942-W944 PolarHBondContact O-N 3.39Å; S942-L945 PolarHBondContact O-N 3.41Å; S942-L945 VanDerWaalsContact O-N 3.15Å; S942-E946 WeakPolarHBondContact O-CG 3.36Å; S942-E946 PolarHBondContact O-N 2.97Å; S942-E946 PolarHBondContact OG-OE1 2.99Å
943	S	47.6	Very low	51.1	Low	74 Å²	74	105.7 Å²	105.7	52%	0.517	53%	0.525	S	S	.	.	H	α-helix	trans	-62.1	-37.4	177.7	174.9	0	0	0	0	112.1	L939 E946 E947	L939-S943 PolarHBondContact O-N 3.18Å; S943-E946 PolarHBondContact O-N 2.97Å; S943-E947 WeakPolarHBondContact O-CB 3.45Å; S943-E947 PolarHBondContact O-N 2.93Å
944	W	59.3	Low	51.4	Low	128 Å²	128	107.5 Å²	107.5	49%	0.485	53%	0.528	S	S	.	.	H	α-helix	trans	-67.2	-36.8	174.9	-175.9	78.3	0	0	0	112.7	H940 S942 E948	H940-W944 WeakPolarHBondContact O-CB 3.1Å; H940-W944 PolarHBondContact O-N 3.43Å; H940-W944 VanDerWaalsContact O-N 3.08Å; S942-W944 VanDerWaalsContact C-N 3.3Å; S942-W944 PolarHBondContact O-N 3.39Å; W944-E948 HydrophobicContact CH2-CG 4.19Å; W944-E948 HydrophobicContact CZ2-CG 4.32Å; W944-E948 WeakPolarHBondContact O-CB 3.42Å; W944-E948 PolarHBondContact O-N 2.96Å
945	L	45.7	Very low	51.6	Low	89 Å²	89	107.2 Å²	107.2	47%	0.466	53%	0.526	S	S	.	.	H	α-helix	trans	-66.5	-40.2	175.1	-76.1	166.6	0	0	0	112.4	D941 S942 E948 E949	D941-L945 VanDerWaalsContact O-CG 3.29Å; D941-L945 WeakPolarHBondContact O-CG 3.25Å; D941-L945 PolarHBondContact O-N 2.93Å; D941-L945 VanDerWaalsContact O-N 3.09Å; S942-L945 PolarHBondContact O-N 3.41Å; S942-L945 VanDerWaalsContact O-N 3.15Å; L945-E948 PolarHBondContact O-N 2.87Å; L945-E949 WeakPolarHBondContact O-CB 3.44Å; L945-E949 PolarHBondContact O-N 2.9Å
946	E	51.2	Low	51.6	Low	125 Å²	125	110 Å²	110	58%	0.584	53%	0.527	S	S	*	.	H	α-helix	trans	-64	-44.4	175.6	-72	164.3	-158	0	0	111.3	S942 S943 E948 E949 E950	S942-E946 WeakPolarHBondContact O-CG 3.36Å; S942-E946 PolarHBondContact O-N 2.97Å; S942-E946 PolarHBondContact OG-OE1 2.99Å; S943-E946 PolarHBondContact O-N 2.97Å; E946-E948 PolarHBondContact O-N 2.8Å; E946-E949 PolarHBondContact O-N 3.34Å; E946-E950 PolarHBondContact O-N 3.31Å
947	E	59.1	Low	52.1	Low	106 Å²	106	107.4 Å²	107.4	50%	0.495	52%	0.521	S	S	.	.	H	α-helix	trans	-68.8	-30.6	177.7	-163.3	-164.3	-125.5	0	0	112.9	S943 R951	S943-E947 WeakPolarHBondContact O-CB 3.45Å; S943-E947 PolarHBondContact O-N 2.93Å; E947-R951 WeakPolarHBondContact O-CB 3.2Å; E947-R951 VanDerWaalsContact O-CG 3.27Å; E947-R951 WeakPolarHBondContact O-CG 3.45Å; E947-R951 PolarHBondContact O-N 3.5Å; E947-R951 VanDerWaalsContact O-N 3.15Å; E947-R951 PolarHBondContact O-NE 2.89Å; E947-R951 IonicContact OE2-CZ 3.64Å; E947-R951 IonicContact OE2-NE 3.91Å; E947-R951 IonicContact OE2-NH2 3.65Å; E947-R951 PolarHBondContact OE2-NH2 2.67Å
948	E	56.1	Low	52.6	Low	75 Å²	75	104.8 Å²	104.8	35%	0.35	52%	0.516	S	S	.	.	H	α-helix	trans	-76.4	-33.8	173.2	-165	71	-149.5	0	0	111.7	W944 L945 E946 R951 A952	W944-E948 HydrophobicContact CH2-CG 4.19Å; W944-E948 HydrophobicContact CZ2-CG 4.32Å; W944-E948 WeakPolarHBondContact O-CB 3.42Å; W944-E948 PolarHBondContact O-N 2.96Å; L945-E948 PolarHBondContact O-N 2.87Å; E946-E948 PolarHBondContact O-N 2.8Å; E948-R951 IonicContact OE1-NH1 2.63Å; E948-R951 IonicContact OE2-CZ 3.91Å; E948-R951 IonicContact OE2-NH1 2.79Å; E948-R951 PolarHBondContact OE2-NH1 2.92Å; E948-R951 IonicContact OE2-NH2 2.78Å; E948-R951 PolarHBondContact OE2-NH2 3.21Å; E948-R951 VanDerWaalsContact OE2-NH2 3.11Å; E948-A952 WeakPolarHBondContact O-CB 3.34Å; E948-A952 PolarHBondContact O-N 3.23Å
949	E	49.9	Very low	53	Low	130 Å²	130	103.6 Å²	103.6	61%	0.607	51%	0.512	S	S	*	.	H	α-helix	trans	-66.4	-45	171.8	179.2	160.8	-155.2	0	0	111.5	L945 E946 R951 A952 I953	L945-E949 WeakPolarHBondContact O-CB 3.44Å; L945-E949 PolarHBondContact O-N 2.9Å; E946-E949 PolarHBondContact O-N 3.34Å; E949-R951 PolarHBondContact O-N 2.87Å; E949-A952 CarbonylContact O-C 3.56Å; E949-A952 WeakPolarHBondContact O-CB 3.39Å; E949-A952 PolarHBondContact O-N 3.37Å; E949-A952 VanDerWaalsContact O-N 3.13Å; E949-I953 HydrophobicContact CG-CD1 3.95Å; E949-I953 HydrophobicContact CG-CG1 4.49Å; E949-I953 WeakPolarHBondContact O-CG1 3.16Å; E949-I953 PolarHBondContact O-N 2.66Å
950	E	55.2	Low	53.3	Low	134 Å²	134	104 Å²	104	63%	0.626	51%	0.511	S	S	*	.	H	α-helix	trans	-62.3	-42.1	176.3	-169.8	171	-133.5	0	0	111.5	E946 A952 I953 H954	E946-E950 PolarHBondContact O-N 3.31Å; E950-A952 VanDerWaalsContact C-N 3.34Å; E950-A952 PolarHBondContact O-N 3.11Å; E950-I953 PolarHBondContact O-N 2.9Å; E950-H954 PolarHBondContact O-N 3.42Å
951	R	61.1	Low	53.7	Low	94 Å²	94	103.9 Å²	103.9	36%	0.355	51%	0.51	S	S	.	.	H	α-helix	trans	-61.9	-38.7	172.3	-76.4	-179.4	-82.7	133	-3.3	112.4	E947 E948 E949 H954 Q955	E947-R951 WeakPolarHBondContact O-CB 3.2Å; E947-R951 VanDerWaalsContact O-CG 3.27Å; E947-R951 WeakPolarHBondContact O-CG 3.45Å; E947-R951 PolarHBondContact O-N 3.5Å; E947-R951 VanDerWaalsContact O-N 3.15Å; E947-R951 PolarHBondContact O-NE 2.89Å; E947-R951 IonicContact OE2-CZ 3.64Å; E947-R951 IonicContact OE2-NE 3.91Å; E947-R951 IonicContact OE2-NH2 3.65Å; E947-R951 PolarHBondContact OE2-NH2 2.67Å; E948-R951 IonicContact OE1-NH1 2.63Å; E948-R951 IonicContact OE2-CZ 3.91Å; E948-R951 IonicContact OE2-NH1 2.79Å; E948-R951 PolarHBondContact OE2-NH1 2.92Å; E948-R951 IonicContact OE2-NH2 2.78Å; E948-R951 PolarHBondContact OE2-NH2 3.21Å; E948-R951 VanDerWaalsContact OE2-NH2 3.11Å; E949-R951 PolarHBondContact O-N 2.87Å; R951-H954 PolarHBondContact O-N 2.88Å; R951-Q955 WeakPolarHBondContact O-CG 3.36Å; R951-Q955 PolarHBondContact O-N 3.16Å
952	A	51.7	Low	54.3	Low	40 Å²	40	104 Å²	104	33%	0.331	51%	0.511	S	S	.	.	H	α-helix	trans	-68.6	-31.4	174.6	0	0	0	0	0	113.2	E948 E949 E950 R956	E948-A952 WeakPolarHBondContact O-CB 3.34Å; E948-A952 PolarHBondContact O-N 3.23Å; E949-A952 CarbonylContact O-C 3.56Å; E949-A952 WeakPolarHBondContact O-CB 3.39Å; E949-A952 PolarHBondContact O-N 3.37Å; E949-A952 VanDerWaalsContact O-N 3.13Å; E950-A952 VanDerWaalsContact C-N 3.34Å; E950-A952 PolarHBondContact O-N 3.11Å; A952-R956 VanDerWaalsContact O-CG 3.27Å; A952-R956 WeakPolarHBondContact O-CG 3.28Å; A952-R956 PolarHBondContact O-N 2.82Å
953	I	57.1	Low	54.9	Low	98 Å²	98	103.3 Å²	103.3	50%	0.503	51%	0.512	S	S	.	.	H	α-helix	trans	-69.9	-45.5	172.6	-70	165.2	0	0	0	110.3	E949 E950 Q955 R956 A957	E949-I953 HydrophobicContact CG-CD1 3.95Å; E949-I953 HydrophobicContact CG-CG1 4.49Å; E949-I953 WeakPolarHBondContact O-CG1 3.16Å; E949-I953 PolarHBondContact O-N 2.66Å; E950-I953 PolarHBondContact O-N 2.9Å; I953-Q955 PolarHBondContact O-N 3.09Å; I953-R956 WeakPolarHBondContact O-CB 3.43Å; I953-R956 PolarHBondContact O-N 3.39Å; I953-R956 VanDerWaalsContact O-N 3.12Å; I953-A957 PolarHBondContact O-N 3.17Å; I953-A957 VanDerWaalsContact O-N 3.1Å
954	H	56.4	Low	55.6	Low	132 Å²	132	104 Å²	104	61%	0.611	51%	0.507	S	S	*	.	H	α-helix	trans	-59.7	-45.7	177.1	-114.2	-50.3	0	0	0	112.2	E950 R951 R956 A957 E958	E950-H954 PolarHBondContact O-N 3.42Å; R951-H954 PolarHBondContact O-N 2.88Å; H954-R956 VanDerWaalsContact C-N 3.28Å; H954-R956 PolarHBondContact O-N 3.01Å; H954-A957 WeakPolarHBondContact O-CB 3.23Å; H954-A957 PolarHBondContact O-N 2.8Å; H954-A957 VanDerWaalsContact O-N 3.1Å; H954-E958 PolarHBondContact O-N 2.89Å
955	Q	52.6	Low	55.3	Low	117 Å²	117	101.4 Å²	101.4	55%	0.547	50%	0.5	S	S	.	.	H	α-helix	trans	-62.5	-32.3	175.5	-71.6	178.7	16.2	0	0	113	R951 I953 L959	R951-Q955 WeakPolarHBondContact O-CG 3.36Å; R951-Q955 PolarHBondContact O-N 3.16Å; I953-Q955 PolarHBondContact O-N 3.09Å; Q955-L959 VanDerWaalsContact O-CB 3.32Å; Q955-L959 WeakPolarHBondContact O-CB 3.18Å; Q955-L959 WeakPolarHBondContact O-CD1 3.44Å; Q955-L959 VanDerWaalsContact O-CG 3.22Å; Q955-L959 WeakPolarHBondContact O-CG 3.35Å; Q955-L959 PolarHBondContact O-N 3.36Å; Q955-L959 VanDerWaalsContact O-N 3.1Å
956	R	50.1	Low	55.8	Low	140 Å²	140	102.3 Å²	102.3	53%	0.528	51%	0.505	S	S	.	.	H	α-helix	trans	-67.1	-36.9	173.5	-75.7	171.6	-175.2	-162.1	6.8	112	A952 I953 H954 Q960	A952-R956 VanDerWaalsContact O-CG 3.27Å; A952-R956 WeakPolarHBondContact O-CG 3.28Å; A952-R956 PolarHBondContact O-N 2.82Å; I953-R956 WeakPolarHBondContact O-CB 3.43Å; I953-R956 PolarHBondContact O-N 3.39Å; I953-R956 VanDerWaalsContact O-N 3.12Å; H954-R956 VanDerWaalsContact C-N 3.28Å; H954-R956 PolarHBondContact O-N 3.01Å; R956-Q960 PolarHBondContact O-N 2.8Å; R956-Q960 VanDerWaalsContact O-N 3.13Å
957	A	58.6	Low	56.5	Low	54 Å²	54	102.5 Å²	102.5	45%	0.446	50%	0.504	S	S	.	.	H	α-helix	trans	-67.1	-50.2	176.5	0	0	0	0	0	111.7	I953 H954 L959 Q960 E961	I953-A957 PolarHBondContact O-N 3.17Å; I953-A957 VanDerWaalsContact O-N 3.1Å; H954-A957 WeakPolarHBondContact O-CB 3.23Å; H954-A957 PolarHBondContact O-N 2.8Å; H954-A957 VanDerWaalsContact O-N 3.1Å; A957-L959 VanDerWaalsContact C-N 3.31Å; A957-L959 PolarHBondContact O-N 2.8Å; A957-Q960 WeakPolarHBondContact O-CB 3.45Å; A957-Q960 PolarHBondContact O-N 3.38Å; A957-E961 PolarHBondContact O-N 3.45Å
958	E	59.1	Low	56.9	Low	119 Å²	119	103.3 Å²	103.3	56%	0.556	50%	0.503	S	S	*	.	H	α-helix	trans	-57.5	-43.2	176.6	-67.7	-170.7	151.2	0	0	112.1	H954 Q960 E961 L962	H954-E958 PolarHBondContact O-N 2.89Å; E958-Q960 VanDerWaalsContact C-N 3.26Å; E958-Q960 PolarHBondContact O-N 2.82Å; E958-E961 PolarHBondContact O-N 3.27Å; E958-L962 WeakPolarHBondContact O-CB 3.49Å; E958-L962 WeakPolarHBondContact O-CG 3.47Å; E958-L962 PolarHBondContact O-N 2.88Å
959	L	54.2	Low	57	Low	111 Å²	111	104.3 Å²	104.3	58%	0.581	51%	0.506	S	S	*	.	H	α-helix	trans	-70.1	-18.6	177.7	-71.8	172.9	0	0	0	113.8	Q955 A957 G963	Q955-L959 VanDerWaalsContact O-CB 3.32Å; Q955-L959 WeakPolarHBondContact O-CB 3.18Å; Q955-L959 WeakPolarHBondContact O-CD1 3.44Å; Q955-L959 VanDerWaalsContact O-CG 3.22Å; Q955-L959 WeakPolarHBondContact O-CG 3.35Å; Q955-L959 PolarHBondContact O-N 3.36Å; Q955-L959 VanDerWaalsContact O-N 3.1Å; A957-L959 VanDerWaalsContact C-N 3.31Å; A957-L959 PolarHBondContact O-N 2.8Å; L959-G963 PolarHBondContact O-N 3.18Å
960	Q	55.5	Low	57.7	Low	129 Å²	129	101 Å²	101	60%	0.603	49%	0.494	S	S	*	.	H	α-helix	trans	-79.7	-46.5	169.7	-179.6	172.1	-32.6	0	0	110.7	R956 A957 E958 G963 E964	R956-Q960 PolarHBondContact O-N 2.8Å; R956-Q960 VanDerWaalsContact O-N 3.13Å; A957-Q960 WeakPolarHBondContact O-CB 3.45Å; A957-Q960 PolarHBondContact O-N 3.38Å; E958-Q960 VanDerWaalsContact C-N 3.26Å; E958-Q960 PolarHBondContact O-N 2.82Å; Q960-G963 WeakPolarHBondContact O-CA 3.29Å; Q960-G963 PolarHBondContact O-N 2.88Å; Q960-E964 PolarHBondContact O-N 3.39Å
961	E	60.4	Low	58.1	Low	136 Å²	136	99.2 Å²	99.2	64%	0.636	49%	0.486	S	S	*	.	H	α-helix	trans	-61.8	-45.9	178.8	-175.1	168.4	-156.1	0	0	112	A957 E958 G963 E964 E965	A957-E961 PolarHBondContact O-N 3.45Å; E958-E961 PolarHBondContact O-N 3.27Å; E961-G963 PolarHBondContact O-N 3.41Å; E961-E964 PolarHBondContact O-N 2.92Å; E961-E964 VanDerWaalsContact O-N 3.15Å; E961-E965 PolarHBondContact O-N 2.97Å
962	L	55.3	Low	58.1	Low	100 Å²	100	99.2 Å²	99.2	52%	0.524	50%	0.496	S	S	.	.	H	α-helix	trans	-60	-32.2	171.4	-72.7	167.6	0	0	0	112.6	E958 L966	E958-L962 WeakPolarHBondContact O-CB 3.49Å; E958-L962 WeakPolarHBondContact O-CG 3.47Å; E958-L962 PolarHBondContact O-N 2.88Å; L962-L966 VanDerWaalsContact O-CB 3.25Å; L962-L966 WeakPolarHBondContact O-CB 3.28Å; L962-L966 PolarHBondContact O-N 3.11Å
963	G	56.8	Low	58.1	Low	39 Å²	39	102.3 Å²	102.3	40%	0.402	51%	0.507	S	S	.	.	H	α-helix	trans	-68	-39.3	175	0	0	0	0	0	112.9	L959 Q960 E961 K967	L959-G963 PolarHBondContact O-N 3.18Å; Q960-G963 WeakPolarHBondContact O-CA 3.29Å; Q960-G963 PolarHBondContact O-N 2.88Å; E961-G963 PolarHBondContact O-N 3.41Å; G963-K967 PolarHBondContact O-N 3.47Å; G963-K967 VanDerWaalsContact O-N 3.14Å
964	E	62.3	Low	58.4	Low	89 Å²	89	103.4 Å²	103.4	42%	0.416	51%	0.51	S	S	.	.	H	α-helix	trans	-72.8	-40.2	173.8	-68.4	-169.9	-157.7	0	0	112.5	Q960 E961 L966 K967 R968	Q960-E964 PolarHBondContact O-N 3.39Å; E961-E964 PolarHBondContact O-N 2.92Å; E961-E964 VanDerWaalsContact O-N 3.15Å; E964-L966 VanDerWaalsContact C-N 3.33Å; E964-L966 PolarHBondContact O-N 2.92Å; E964-K967 WeakPolarHBondContact O-CB 3.26Å; E964-K967 PolarHBondContact O-N 3.03Å; E964-K967 VanDerWaalsContact O-N 3.15Å; E964-R968 WeakPolarHBondContact O-CG 3.46Å; E964-R968 PolarHBondContact O-N 3.04Å; E964-R968 IonicContact OE2-CZ 2.87Å; E964-R968 IonicContact OE2-NH2 3.64Å; E964-R968 PolarHBondContact OE2-NH2 2.82Å
965	E	51.9	Low	58.8	Low	73 Å²	73	104.2 Å²	104.2	34%	0.341	51%	0.513	S	S	.	.	H	α-helix	trans	-63.5	-40.8	176.7	-155.7	-146.6	-174.9	0	0	111.3	E961 K967 R968 K969	E961-E965 PolarHBondContact O-N 2.97Å; E965-K967 VanDerWaalsContact C-N 3.33Å; E965-K967 PolarHBondContact O-N 2.9Å; E965-R968 PolarHBondContact O-N 2.87Å; E965-K969 VanDerWaalsContact CD-CE 3.42Å; E965-K969 WeakPolarHBondContact O-CB 3.36Å; E965-K969 WeakPolarHBondContact O-CG 3.46Å; E965-K969 PolarHBondContact O-N 3.04Å; E965-K969 WeakPolarHBondContact OE1-CE 3.41Å; E965-K969 IonicContact OE1-NZ 2.82Å; E965-K969 PolarHBondContact OE1-NZ 3.47Å; E965-K969 IonicContact OE2-NZ 3.98Å; E965-K969 PolarHBondContact OE2-NZ 3.47Å
966	L	57.5	Low	59.3	Low	108 Å²	108	106.4 Å²	106.4	57%	0.565	52%	0.517	S	S	*	.	H	α-helix	trans	-61.6	-39.8	172	-178.7	61.6	0	0	0	111.9	L962 E964 K969 V970	L962-L966 VanDerWaalsContact O-CB 3.25Å; L962-L966 WeakPolarHBondContact O-CB 3.28Å; L962-L966 PolarHBondContact O-N 3.11Å; E964-L966 VanDerWaalsContact C-N 3.33Å; E964-L966 PolarHBondContact O-N 2.92Å; L966-K969 PolarHBondContact O-N 3.46Å; L966-V970 HydrophobicContact CD1-CG2 4.48Å; L966-V970 WeakPolarHBondContact O-CG2 3.34Å; L966-V970 PolarHBondContact O-N 2.93Å
967	K	66.1	Low	59.7	Low	129 Å²	129	105.2 Å²	105.2	56%	0.561	52%	0.517	S	S	*	.	H	α-helix	trans	-60.6	-49.1	175	-176.3	-170.9	164.8	-164.6	0	111.2	G963 E964 E965 K969 V970 E971	G963-K967 PolarHBondContact O-N 3.47Å; G963-K967 VanDerWaalsContact O-N 3.14Å; E964-K967 WeakPolarHBondContact O-CB 3.26Å; E964-K967 PolarHBondContact O-N 3.03Å; E964-K967 VanDerWaalsContact O-N 3.15Å; E965-K967 VanDerWaalsContact C-N 3.33Å; E965-K967 PolarHBondContact O-N 2.9Å; K967-K969 VanDerWaalsContact C-N 3.33Å; K967-K969 PolarHBondContact O-N 3.42Å; K967-V970 PolarHBondContact O-N 2.92Å; K967-V970 VanDerWaalsContact O-N 3.15Å; K967-E971 WeakPolarHBondContact CE-OE1 3.42Å; K967-E971 IonicContact NZ-OE1 3.97Å; K967-E971 WeakPolarHBondContact O-CG 3.41Å; K967-E971 PolarHBondContact O-N 2.76Å
968	R	67.5	Low	60.2	Low	123 Å²	123	105.2 Å²	105.2	46%	0.464	52%	0.517	S	S	.	.	H	α-helix	trans	-58.7	-43.2	176.8	-63.3	166.7	-156	149.4	4.8	111.1	E964 E965 V970 E971 V972	E964-R968 WeakPolarHBondContact O-CG 3.46Å; E964-R968 PolarHBondContact O-N 3.04Å; E964-R968 IonicContact OE2-CZ 2.87Å; E964-R968 IonicContact OE2-NH2 3.64Å; E964-R968 PolarHBondContact OE2-NH2 2.82Å; E965-R968 PolarHBondContact O-N 2.87Å; R968-V970 PolarHBondContact O-N 3.24Å; R968-E971 PolarHBondContact O-N 2.79Å; R968-V972 WeakPolarHBondContact O-CG2 3.43Å; R968-V972 PolarHBondContact O-N 3.31Å
969	K	57.5	Low	60.2	Low	95 Å²	95	103.2 Å²	103.2	41%	0.413	52%	0.515	S	S	.	.	H	α-helix	trans	-63.8	-37.5	175.9	-73.7	170.5	-179.9	169.4	0	112.8	E965 L966 K967 L973	E965-K969 VanDerWaalsContact CD-CE 3.42Å; E965-K969 WeakPolarHBondContact O-CB 3.36Å; E965-K969 WeakPolarHBondContact O-CG 3.46Å; E965-K969 PolarHBondContact O-N 3.04Å; E965-K969 WeakPolarHBondContact OE1-CE 3.41Å; E965-K969 IonicContact OE1-NZ 2.82Å; E965-K969 PolarHBondContact OE1-NZ 3.47Å; E965-K969 IonicContact OE2-NZ 3.98Å; E965-K969 PolarHBondContact OE2-NZ 3.47Å; L966-K969 PolarHBondContact O-N 3.46Å; K967-K969 VanDerWaalsContact C-N 3.33Å; K967-K969 PolarHBondContact O-N 3.42Å; K969-L973 WeakPolarHBondContact O-CB 3.38Å; K969-L973 VanDerWaalsContact O-CG 3.29Å; K969-L973 WeakPolarHBondContact O-CG 3.24Å; K969-L973 PolarHBondContact O-N 3.15Å
970	V	63.8	Low	60.3	Low	62 Å²	62	101.2 Å²	101.2	38%	0.376	51%	0.508	S	S	.	.	H	α-helix	trans	-67.1	-40.1	174.3	168	0	0	0	0	111.9	L966 K967 R968 L973 Q974	L966-V970 HydrophobicContact CD1-CG2 4.48Å; L966-V970 WeakPolarHBondContact O-CG2 3.34Å; L966-V970 PolarHBondContact O-N 2.93Å; K967-V970 PolarHBondContact O-N 2.92Å; K967-V970 VanDerWaalsContact O-N 3.15Å; R968-V970 PolarHBondContact O-N 3.24Å; V970-L973 PolarHBondContact O-N 3.39Å; V970-Q974 WeakPolarHBondContact O-CG 3.4Å; V970-Q974 PolarHBondContact O-N 3.43Å
971	E	64.8	Low	60.7	Low	95 Å²	95	100.4 Å²	100.4	44%	0.444	50%	0.504	S	S	.	.	H	α-helix	trans	-65	-42.5	177.1	-71.3	166.4	168.9	0	0	111.5	K967 R968 L973 Q974 H975	K967-E971 WeakPolarHBondContact CE-OE1 3.42Å; K967-E971 IonicContact NZ-OE1 3.97Å; K967-E971 WeakPolarHBondContact O-CG 3.41Å; K967-E971 PolarHBondContact O-N 2.76Å; R968-E971 PolarHBondContact O-N 2.79Å; E971-L973 PolarHBondContact O-N 2.83Å; E971-Q974 PolarHBondContact O-N 3.47Å; E971-H975 PolarHBondContact O-N 3.02Å; E971-H975 VanDerWaalsContact O-N 3.11Å
972	V	61.8	Low	61.3	Low	95 Å²	95	100.1 Å²	100.1	58%	0.576	50%	0.502	S	S	*	.	H	α-helix	trans	-62.1	-41.8	172.7	171.1	0	0	0	0	112	R968 H975 R976	R968-V972 WeakPolarHBondContact O-CG2 3.43Å; R968-V972 PolarHBondContact O-N 3.31Å; V972-H975 PolarHBondContact O-N 3.17Å; V972-R976 WeakPolarHBondContact O-CB 3.42Å; V972-R976 PolarHBondContact O-N 3.5Å
973	L	51.8	Low	61.7	Low	105 Å²	105	102.8 Å²	102.8	55%	0.55	51%	0.51	S	S	.	.	H	α-helix	trans	-64.5	-39.2	177.2	-76.1	169.6	0	0	0	112.4	K969 V970 E971 R976 E977	K969-L973 WeakPolarHBondContact O-CB 3.38Å; K969-L973 VanDerWaalsContact O-CG 3.29Å; K969-L973 WeakPolarHBondContact O-CG 3.24Å; K969-L973 PolarHBondContact O-N 3.15Å; V970-L973 PolarHBondContact O-N 3.39Å; E971-L973 PolarHBondContact O-N 2.83Å; L973-R976 PolarHBondContact O-N 2.68Å; L973-E977 WeakPolarHBondContact O-CB 3.44Å; L973-E977 PolarHBondContact O-N 3.13Å
974	Q	61.7	Low	62.2	Low	121 Å²	121	105 Å²	105	57%	0.565	51%	0.513	S	S	*	.	H	α-helix	trans	-63.7	-40.7	174.8	-73.4	174.7	8.3	0	0	112	V970 E971 E977 A978	V970-Q974 WeakPolarHBondContact O-CG 3.4Å; V970-Q974 PolarHBondContact O-N 3.43Å; E971-Q974 PolarHBondContact O-N 3.47Å; Q974-E977 PolarHBondContact O-N 2.68Å; Q974-A978 PolarHBondContact O-N 3.39Å
975	H	65.9	Low	62.6	Low	149 Å²	149	107.8 Å²	107.8	69%	0.69	52%	0.523	S	S	*	.	H	α-helix	trans	-66.1	-42.2	175.7	-167.3	75	0	0	0	112	E971 V972 E977 A978 C979	E971-H975 PolarHBondContact O-N 3.02Å; E971-H975 VanDerWaalsContact O-N 3.11Å; V972-H975 PolarHBondContact O-N 3.17Å; H975-E977 PolarHBondContact O-N 3.33Å; H975-A978 PolarHBondContact O-N 2.93Å; H975-C979 WeakPolarHBondContact O-CB 3.28Å; H975-C979 PolarHBondContact O-N 2.63Å
976	R	62.2	Low	63.3	Low	162 Å²	162	109.4 Å²	109.4	61%	0.611	53%	0.534	S	S	*	.	H	α-helix	trans	-60.5	-42.7	173.7	-174.1	178.4	-179	178.4	1.9	111.8	V972 L973 C979 V980	V972-R976 WeakPolarHBondContact O-CB 3.42Å; V972-R976 PolarHBondContact O-N 3.5Å; L973-R976 PolarHBondContact O-N 2.68Å; R976-C979 PolarHBondContact O-N 3.26Å; R976-V980 WeakPolarHBondContact O-CG2 3.47Å; R976-V980 PolarHBondContact O-N 3.13Å
977	E	60	Low	63.5	Low	116 Å²	116	109.3 Å²	109.3	54%	0.542	53%	0.53	S	S	.	.	H	α-helix	trans	-64.7	-45.3	178.2	-165	-175.3	160.7	0	0	111.7	L973 Q974 H975 C979 V980 Q981	L973-E977 WeakPolarHBondContact O-CB 3.44Å; L973-E977 PolarHBondContact O-N 3.13Å; Q974-E977 PolarHBondContact O-N 2.68Å; H975-E977 PolarHBondContact O-N 3.33Å; E977-C979 VanDerWaalsContact C-N 3.33Å; E977-C979 PolarHBondContact O-N 3.06Å; E977-V980 PolarHBondContact O-N 3.3Å; E977-Q981 WeakPolarHBondContact O-CG 3.16Å; E977-Q981 PolarHBondContact O-N 3.19Å; E977-Q981 PolarHBondContact OE1-NE2 2.96Å; E977-Q981 VanDerWaalsContact OE1-NE2 3.1Å
978	A	68.8	Low	63.9	Low	53 Å²	53	107.8 Å²	107.8	44%	0.438	53%	0.527	S	S	.	.	H	α-helix	trans	-58.7	-43.1	175.5	0	0	0	0	0	112.2	Q974 H975 Q981 Q982	Q974-A978 PolarHBondContact O-N 3.39Å; H975-A978 PolarHBondContact O-N 2.93Å; A978-Q981 PolarHBondContact O-N 3.08Å; A978-Q982 PolarHBondContact O-N 3.38Å
979	C	58.5	Low	64.4	Low	77 Å²	77	108.2 Å²	108.2	52%	0.52	53%	0.532	S	S	.	.	H	α-helix	trans	-62.9	-42.3	175.7	-171.2	0	0	0	0	112.2	H975 R976 E977 Q982 K983	H975-C979 WeakPolarHBondContact O-CB 3.28Å; H975-C979 PolarHBondContact O-N 2.63Å; R976-C979 PolarHBondContact O-N 3.26Å; E977-C979 VanDerWaalsContact C-N 3.33Å; E977-C979 PolarHBondContact O-N 3.06Å; C979-Q982 PolarHBondContact O-N 2.93Å; C979-K983 PolarHBondContact O-N 3.35Å
980	V	57.2	Low	65.3	Low	70 Å²	70	108.8 Å²	108.8	42%	0.424	54%	0.538	S	S	.	.	H	α-helix	trans	-64.2	-40.7	174.5	169	0	0	0	0	111.7	R976 E977 Q982 K983 N984	R976-V980 WeakPolarHBondContact O-CG2 3.47Å; R976-V980 PolarHBondContact O-N 3.13Å; E977-V980 PolarHBondContact O-N 3.3Å; V980-Q982 VanDerWaalsContact C-N 3.34Å; V980-Q982 PolarHBondContact O-N 3.45Å; V980-K983 PolarHBondContact O-N 2.85Å; V980-N984 WeakPolarHBondContact O-CB 3.28Å; V980-N984 PolarHBondContact O-N 2.89Å; V980-N984 PolarHBondContact O-ND2 2.9Å
981	Q	63.7	Low	65.3	Low	111 Å²	111	109.8 Å²	109.8	52%	0.519	54%	0.541	S	S	.	.	H	α-helix	trans	-62.7	-39.8	174.5	-69.6	178.2	18.3	0	0	111.6	E977 A978 N984 K985	E977-Q981 WeakPolarHBondContact O-CG 3.16Å; E977-Q981 PolarHBondContact O-N 3.19Å; E977-Q981 PolarHBondContact OE1-NE2 2.96Å; E977-Q981 VanDerWaalsContact OE1-NE2 3.1Å; A978-Q981 PolarHBondContact O-N 3.08Å; Q981-N984 PolarHBondContact O-N 3.37Å; Q981-K985 WeakPolarHBondContact O-CB 3.17Å; Q981-K985 PolarHBondContact O-N 2.95Å
982	Q	71.6	Confident	65.4	Low	130 Å²	130	110.8 Å²	110.8	61%	0.607	55%	0.545	S	S	*	.	H	α-helix	trans	-65.7	-45	174.3	-175.7	171.7	-10.8	0	0	112.3	A978 C979 V980 N984 K985 L986	A978-Q982 PolarHBondContact O-N 3.38Å; C979-Q982 PolarHBondContact O-N 2.93Å; V980-Q982 VanDerWaalsContact C-N 3.34Å; V980-Q982 PolarHBondContact O-N 3.45Å; Q982-N984 VanDerWaalsContact C-N 3.33Å; Q982-N984 PolarHBondContact O-N 2.94Å; Q982-K985 PolarHBondContact O-N 3.32Å; Q982-L986 WeakPolarHBondContact O-CG 3.19Å; Q982-L986 PolarHBondContact O-N 2.91Å
983	K	65.3	Low	65.8	Low	156 Å²	156	109.7 Å²	109.7	68%	0.678	54%	0.542	S	S	*	.	H	α-helix	trans	-58.4	-44.2	173.9	-176	171.7	-177.9	171	0	111.5	C979 V980 K985 L986 H987	C979-K983 PolarHBondContact O-N 3.35Å; V980-K983 PolarHBondContact O-N 2.85Å; K983-K985 PolarHBondContact O-N 3.38Å; K983-L986 PolarHBondContact O-N 3.2Å; K983-H987 WeakPolarHBondContact O-CB 3.34Å; K983-H987 PolarHBondContact O-N 2.83Å
984	N	65.8	Low	66.4	Low	87 Å²	87	107.7 Å²	107.7	47%	0.465	54%	0.537	S	S	.	.	H	α-helix	trans	-64.1	-39.8	176.5	-71	-19.9	0	0	0	112.1	V980 Q981 Q982 H987 I988	V980-N984 WeakPolarHBondContact O-CB 3.28Å; V980-N984 PolarHBondContact O-N 2.89Å; V980-N984 PolarHBondContact O-ND2 2.9Å; Q981-N984 PolarHBondContact O-N 3.37Å; Q982-N984 VanDerWaalsContact C-N 3.33Å; Q982-N984 PolarHBondContact O-N 2.94Å; N984-H987 PolarHBondContact O-N 3.14Å; N984-I988 WeakPolarHBondContact O-CB 3.43Å; N984-I988 VanDerWaalsContact O-CG1 3.27Å; N984-I988 WeakPolarHBondContact O-CG1 3.4Å; N984-I988 PolarHBondContact O-N 3.34Å
985	K	71.3	Confident	66.8	Low	147 Å²	147	106.8 Å²	106.8	64%	0.639	53%	0.533	S	S	*	.	H	α-helix	trans	-63.8	-39.8	175.8	-171.1	176.2	-177.2	178.7	0	112.2	Q981 Q982 K983 K989	Q981-K985 WeakPolarHBondContact O-CB 3.17Å; Q981-K985 PolarHBondContact O-N 2.95Å; Q982-K985 PolarHBondContact O-N 3.32Å; K983-K985 PolarHBondContact O-N 3.38Å; K985-K989 PolarHBondContact O-N 3.12Å; K985-K989 VanDerWaalsContact O-N 3.13Å
986	L	66.9	Low	67.1	Low	107 Å²	107	101.1 Å²	101.1	56%	0.56	51%	0.511	S	S	*	.	H	α-helix	trans	-68.4	-43.1	174	-69.5	171.8	0	0	0	111.8	Q982 K983 I988 K989 M990	Q982-L986 WeakPolarHBondContact O-CG 3.19Å; Q982-L986 PolarHBondContact O-N 2.91Å; K983-L986 PolarHBondContact O-N 3.2Å; L986-I988 VanDerWaalsContact C-N 3.32Å; L986-I988 PolarHBondContact O-N 2.93Å; L986-K989 WeakPolarHBondContact O-CB 3.42Å; L986-K989 PolarHBondContact O-N 2.85Å; L986-M990 PolarHBondContact O-N 2.92Å
987	H	62.5	Low	67.5	Low	106 Å²	106	99 Å²	99	49%	0.491	51%	0.511	S	S	.	.	H	α-helix	trans	-63.9	-36.4	177.1	-167.8	-93.3	0	0	0	112.3	K983 N984 M990 L991	K983-H987 WeakPolarHBondContact O-CB 3.34Å; K983-H987 PolarHBondContact O-N 2.83Å; N984-H987 PolarHBondContact O-N 3.14Å; H987-M990 PolarHBondContact O-N 3.33Å; H987-L991 WeakPolarHBondContact O-CB 3.24Å; H987-L991 PolarHBondContact O-N 2.86Å
988	I	74.2	Confident	67.9	Low	97 Å²	97	96.5 Å²	96.5	50%	0.497	51%	0.507	S	S	.	.	H	α-helix	trans	-64.4	-44.9	172	-71.1	164.4	0	0	0	110.9	N984 L986 M990 L991 Q992	N984-I988 WeakPolarHBondContact O-CB 3.43Å; N984-I988 VanDerWaalsContact O-CG1 3.27Å; N984-I988 WeakPolarHBondContact O-CG1 3.4Å; N984-I988 PolarHBondContact O-N 3.34Å; L986-I988 VanDerWaalsContact C-N 3.32Å; L986-I988 PolarHBondContact O-N 2.93Å; I988-M990 PolarHBondContact O-N 3.45Å; I988-L991 PolarHBondContact O-N 3.41Å; I988-Q992 HydrophobicContact CG2-CG 4.41Å; I988-Q992 WeakPolarHBondContact O-CB 3.45Å; I988-Q992 VanDerWaalsContact O-CG 3.27Å; I988-Q992 WeakPolarHBondContact O-CG 3.4Å; I988-Q992 PolarHBondContact O-N 2.91Å
989	K	77.9	Confident	68.3	Low	132 Å²	132	100.7 Å²	100.7	57%	0.574	51%	0.511	S	S	*	.	H	α-helix	trans	-58.7	-44.9	174.4	-79.4	-171.7	167.3	-160	0	112.3	K985 L986 Q992 S993	K985-K989 PolarHBondContact O-N 3.12Å; K985-K989 VanDerWaalsContact O-N 3.13Å; L986-K989 WeakPolarHBondContact O-CB 3.42Å; L986-K989 PolarHBondContact O-N 2.85Å; K989-Q992 PolarHBondContact O-N 3.43Å; K989-S993 PolarHBondContact O-N 3.37Å; K989-S993 PolarHBondContact O-OG 2.85Å
990	M	75.1	Confident	68.9	Low	107 Å²	107	100.8 Å²	100.8	53%	0.527	51%	0.506	S	S	.	.	H	α-helix	trans	-63.1	-40	177.3	-172.8	-170.1	79.8	0	0	111.9	L986 H987 I988 Q992 S993 S994	L986-M990 PolarHBondContact O-N 2.92Å; H987-M990 PolarHBondContact O-N 3.33Å; I988-M990 PolarHBondContact O-N 3.45Å; M990-Q992 VanDerWaalsContact C-N 3.32Å; M990-S993 PolarHBondContact O-OG 3.28Å; M990-S993 VanDerWaalsContact O-OG 3.13Å; M990-S994 WeakPolarHBondContact O-CB 3.3Å; M990-S994 PolarHBondContact O-N 2.97Å
991	L	64.8	Low	69.7	Low	83 Å²	83	102.7 Å²	102.7	44%	0.435	51%	0.514	S	S	.	.	H	α-helix	trans	-66.1	-37.4	174.2	-151.7	84.3	0	0	0	111.2	H987 I988 Q995	H987-L991 WeakPolarHBondContact O-CB 3.24Å; H987-L991 PolarHBondContact O-N 2.86Å; I988-L991 PolarHBondContact O-N 3.41Å; L991-Q995 WeakPolarHBondContact O-CB 3.24Å; L991-Q995 WeakPolarHBondContact O-CG 3.38Å; L991-Q995 PolarHBondContact O-N 3.49Å
992	Q	67.3	Low	70.1	Confident	115 Å²	115	102.7 Å²	102.7	54%	0.537	52%	0.517	S	S	.	.	H	α-helix	trans	-69.8	-40.9	178.1	-75.1	172.1	-36.7	0	0	112.7	I988 K989 M990 Q995 A996	I988-Q992 HydrophobicContact CG2-CG 4.41Å; I988-Q992 WeakPolarHBondContact O-CB 3.45Å; I988-Q992 VanDerWaalsContact O-CG 3.27Å; I988-Q992 WeakPolarHBondContact O-CG 3.4Å; I988-Q992 PolarHBondContact O-N 2.91Å; K989-Q992 PolarHBondContact O-N 3.43Å; M990-Q992 VanDerWaalsContact C-N 3.32Å; Q992-Q995 PolarHBondContact O-N 3.43Å; Q992-A996 WeakPolarHBondContact O-CB 3.48Å; Q992-A996 PolarHBondContact O-N 3.27Å
993	S	69.9	Low	70.3	Confident	73 Å²	73	102.2 Å²	102.2	51%	0.51	52%	0.515	S	S	.	.	H	α-helix	trans	-69.6	-40.8	174.1	59.8	0	0	0	0	111.8	K989 M990 Q995 A996 L997	K989-S993 PolarHBondContact O-N 3.37Å; K989-S993 PolarHBondContact O-OG 2.85Å; M990-S993 PolarHBondContact O-OG 3.28Å; M990-S993 VanDerWaalsContact O-OG 3.13Å; S993-Q995 VanDerWaalsContact C-N 3.32Å; S993-Q995 PolarHBondContact O-N 3.06Å; S993-A996 WeakPolarHBondContact O-CB 3.41Å; S993-A996 PolarHBondContact O-N 2.92Å; S993-L997 WeakPolarHBondContact O-CB 3.22Å; S993-L997 PolarHBondContact O-N 2.94Å
994	S	63.7	Low	70.5	Confident	63 Å²	63	98.5 Å²	98.5	44%	0.441	51%	0.505	S	S	.	.	H	α-helix	trans	-61.2	-39.3	172.5	176.5	0	0	0	0	112.2	M990 S998	M990-S994 WeakPolarHBondContact O-CB 3.3Å; M990-S994 PolarHBondContact O-N 2.97Å; S994-S998 VanDerWaalsContact O-CB 3.31Å; S994-S998 WeakPolarHBondContact O-CB 3.34Å; S994-S998 PolarHBondContact O-N 2.94Å; S994-S998 PolarHBondContact O-OG 2.97Å
995	Q	70.5	Confident	70.8	Confident	102 Å²	102	96.3 Å²	96.3	48%	0.477	50%	0.496	S	S	.	.	H	α-helix	trans	-76.7	-21	175.2	-75.5	175.4	-0.2	0	0	114.1	L991 Q992 S993 R999	L991-Q995 WeakPolarHBondContact O-CB 3.24Å; L991-Q995 WeakPolarHBondContact O-CG 3.38Å; L991-Q995 PolarHBondContact O-N 3.49Å; Q992-Q995 PolarHBondContact O-N 3.43Å; S993-Q995 VanDerWaalsContact C-N 3.32Å; S993-Q995 PolarHBondContact O-N 3.06Å; Q995-R999 PolarHBondContact O-N 3.27Å; Q995-R999 PolarHBondContact O-NE 3Å; Q995-R999 PolarHBondContact O-NH2 3.45Å; Q995-R999 VanDerWaalsContact O-NH2 3.07Å
996	A	72.9	Confident	71	Confident	29 Å²	29	93.6 Å²	93.6	24%	0.24	49%	0.492	C	S	.	.	H	α-helix	trans	-70.9	-61.3	167	0	0	0	0	0	108.5	Q992 S993 S998 R999 D1000	Q992-A996 WeakPolarHBondContact O-CB 3.48Å; Q992-A996 PolarHBondContact O-N 3.27Å; S993-A996 WeakPolarHBondContact O-CB 3.41Å; S993-A996 PolarHBondContact O-N 2.92Å; A996-S998 PolarHBondContact O-N 3.26Å; A996-R999 CarbonylContact O-C 3.59Å; A996-R999 WeakPolarHBondContact O-CA 3.47Å; A996-R999 WeakPolarHBondContact O-CB 3.31Å; A996-R999 PolarHBondContact O-N 2.95Å; A996-D1000 PolarHBondContact O-N 2.67Å
997	L	70.4	Confident	71.3	Confident	117 Å²	117	93.9 Å²	93.9	61%	0.613	49%	0.49	S	S	*	.	H	α-helix	trans	-50.8	-38.8	178.2	-171.9	70.8	0	0	0	112.8	S993 D1000 L1001	S993-L997 WeakPolarHBondContact O-CB 3.22Å; S993-L997 PolarHBondContact O-N 2.94Å; L997-D1000 PolarHBondContact N-OD2 3.25Å; L997-D1000 PolarHBondContact O-N 2.71Å; L997-L1001 WeakPolarHBondContact O-CB 3.36Å; L997-L1001 PolarHBondContact O-N 3.11Å
998	S	68.3	Low	71.7	Confident	64 Å²	64	94 Å²	94	45%	0.448	49%	0.494	S	S	.	.	H	α-helix	trans	-68.5	-32.3	176	-57.2	0	0	0	0	113.7	S994 A996 L1002	S994-S998 VanDerWaalsContact O-CB 3.31Å; S994-S998 WeakPolarHBondContact O-CB 3.34Å; S994-S998 PolarHBondContact O-N 2.94Å; S994-S998 PolarHBondContact O-OG 2.97Å; A996-S998 PolarHBondContact O-N 3.26Å; S998-L1002 WeakPolarHBondContact O-CB 3.37Å; S998-L1002 WeakPolarHBondContact O-CD1 3.25Å; S998-L1002 VanDerWaalsContact O-CG 3.22Å; S998-L1002 WeakPolarHBondContact O-CG 3.47Å; S998-L1002 PolarHBondContact O-N 3.49Å
999	R	76.4	Confident	71.6	Confident	142 Å²	142	95.3 Å²	95.3	54%	0.536	50%	0.498	S	S	.	.	H	α-helix	trans	-75.4	-41.1	171.9	-88.2	177.3	-75.3	110.8	-2.4	111.4	Q995 A996 L1001 L1002 Q1003	Q995-R999 PolarHBondContact O-N 3.27Å; Q995-R999 PolarHBondContact O-NE 3Å; Q995-R999 PolarHBondContact O-NH2 3.45Å; Q995-R999 VanDerWaalsContact O-NH2 3.07Å; A996-R999 CarbonylContact O-C 3.59Å; A996-R999 WeakPolarHBondContact O-CA 3.47Å; A996-R999 WeakPolarHBondContact O-CB 3.31Å; A996-R999 PolarHBondContact O-N 2.95Å; R999-L1001 VanDerWaalsContact C-N 3.34Å; R999-L1002 PolarHBondContact O-N 3.44Å; R999-Q1003 VanDerWaalsContact O-CB 3.3Å; R999-Q1003 WeakPolarHBondContact O-CB 3.47Å; R999-Q1003 PolarHBondContact O-N 3.48Å
1000	D	72.4	Confident	71.3	Confident	78 Å²	78	91.2 Å²	91.2	42%	0.417	49%	0.486	S	S	.	.	H	α-helix	trans	-66.3	-41	-179.6	-48.6	-31.4	0	0	0	109.8	A996 L997 Q1003 V1004	A996-D1000 PolarHBondContact O-N 2.67Å; L997-D1000 PolarHBondContact N-OD2 3.25Å; L997-D1000 PolarHBondContact O-N 2.71Å; D1000-Q1003 PolarHBondContact O-N 3.03Å; D1000-V1004 WeakPolarHBondContact O-CG2 3.12Å; D1000-V1004 PolarHBondContact O-N 2.83Å
1001	L	72.3	Confident	70.8	Confident	110 Å²	110	89.6 Å²	89.6	58%	0.576	48%	0.482	S	S	*	.	H	α-helix	trans	-67.4	-40.2	174.2	-161.3	158.6	0	0	0	111.8	L997 R999 Q1003 V1004 S1005	L997-L1001 WeakPolarHBondContact O-CB 3.36Å; L997-L1001 PolarHBondContact O-N 3.11Å; R999-L1001 VanDerWaalsContact C-N 3.34Å; L1001-Q1003 VanDerWaalsContact C-N 3.33Å; L1001-Q1003 PolarHBondContact O-N 3.09Å; L1001-V1004 PolarHBondContact O-N 3.46Å; L1001-S1005 PolarHBondContact O-N 3.26Å; L1001-S1005 PolarHBondContact O-OG 2.94Å
1002	L	71.9	Confident	70.6	Confident	112 Å²	112	91 Å²	91	59%	0.586	49%	0.487	S	S	*	.	H	α-helix	trans	-63.2	-37.7	170.2	-79.6	168.9	0	0	0	112.5	S998 R999 S1005 V1006	S998-L1002 WeakPolarHBondContact O-CB 3.37Å; S998-L1002 WeakPolarHBondContact O-CD1 3.25Å; S998-L1002 VanDerWaalsContact O-CG 3.22Å; S998-L1002 WeakPolarHBondContact O-CG 3.47Å; S998-L1002 PolarHBondContact O-N 3.49Å; R999-L1002 PolarHBondContact O-N 3.44Å; L1002-S1005 PolarHBondContact O-N 3.04Å; L1002-V1006 WeakPolarHBondContact O-CG2 3.39Å; L1002-V1006 PolarHBondContact O-N 2.92Å
1003	Q	76.2	Confident	70.6	Confident	120 Å²	120	92.1 Å²	92.1	56%	0.561	49%	0.491	S	S	*	.	H	α-helix	trans	-69.2	-38.3	177.6	-175.9	171.5	-34.3	0	0	111.2	R999 D1000 L1001 Q1007	R999-Q1003 VanDerWaalsContact O-CB 3.3Å; R999-Q1003 WeakPolarHBondContact O-CB 3.47Å; R999-Q1003 PolarHBondContact O-N 3.48Å; D1000-Q1003 PolarHBondContact O-N 3.03Å; L1001-Q1003 VanDerWaalsContact C-N 3.33Å; L1001-Q1003 PolarHBondContact O-N 3.09Å; Q1003-Q1007 WeakPolarHBondContact O-CB 3.32Å; Q1003-Q1007 VanDerWaalsContact O-CG 3.31Å; Q1003-Q1007 WeakPolarHBondContact O-CG 3.19Å; Q1003-Q1007 PolarHBondContact O-N 2.69Å
1004	V	70.9	Confident	70.3	Confident	77 Å²	77	93 Å²	93	47%	0.467	49%	0.488	S	S	.	.	H	α-helix	trans	-66.2	-38.6	170	169.1	0	0	0	0	111.3	D1000 L1001 Q1007 L1008	D1000-V1004 WeakPolarHBondContact O-CG2 3.12Å; D1000-V1004 PolarHBondContact O-N 2.83Å; L1001-V1004 PolarHBondContact O-N 3.46Å; V1004-Q1007 PolarHBondContact O-N 3.23Å; V1004-L1008 HydrophobicContact CG1-CD1 3.94Å; V1004-L1008 HydrophobicContact CG1-CG 4.44Å; V1004-L1008 WeakPolarHBondContact O-CB 3.42Å; V1004-L1008 WeakPolarHBondContact O-CG 3.33Å; V1004-L1008 PolarHBondContact O-N 3.24Å
1005	S	70.9	Confident	69.9	Low	42 Å²	42	95.7 Å²	95.7	29%	0.294	50%	0.497	S	S	.	.	H	α-helix	trans	-62.2	-47.7	173.3	-62.6	0	0	0	0	111.9	L1001 L1002 Q1007 L1008 E1009	L1001-S1005 PolarHBondContact O-N 3.26Å; L1001-S1005 PolarHBondContact O-OG 2.94Å; L1002-S1005 PolarHBondContact O-N 3.04Å; S1005-Q1007 VanDerWaalsContact C-N 3.3Å; S1005-Q1007 PolarHBondContact O-N 3.33Å; S1005-L1008 PolarHBondContact O-N 3.37Å; S1005-L1008 VanDerWaalsContact O-N 3.15Å; S1005-E1009 WeakPolarHBondContact O-CG 3.45Å; S1005-E1009 PolarHBondContact O-N 3.49Å
1006	V	75.7	Confident	69.1	Low	90 Å²	90	96.8 Å²	96.8	55%	0.545	50%	0.502	S	S	.	.	H	α-helix	trans	-66.3	-32.5	176.8	171.1	0	0	0	0	111.8	L1002 S1010	L1002-V1006 WeakPolarHBondContact O-CG2 3.39Å; L1002-V1006 PolarHBondContact O-N 2.92Å; V1006-S1010 VanDerWaalsContact O-CB 3.26Å; V1006-S1010 WeakPolarHBondContact O-CB 3.26Å; V1006-S1010 PolarHBondContact O-N 3.33Å
1007	Q	74.1	Confident	67.8	Low	113 Å²	113	99 Å²	99	53%	0.528	52%	0.515	S	S	.	.	H	α-helix	trans	-70.7	-36.7	171.4	-78.1	-178.3	-17.5	0	0	112.4	Q1003 V1004 S1005 S1010 V1011	Q1003-Q1007 WeakPolarHBondContact O-CB 3.32Å; Q1003-Q1007 VanDerWaalsContact O-CG 3.31Å; Q1003-Q1007 WeakPolarHBondContact O-CG 3.19Å; Q1003-Q1007 PolarHBondContact O-N 2.69Å; V1004-Q1007 PolarHBondContact O-N 3.23Å; S1005-Q1007 VanDerWaalsContact C-N 3.3Å; S1005-Q1007 PolarHBondContact O-N 3.33Å; Q1007-S1010 PolarHBondContact O-N 3.26Å; Q1007-V1011 VanDerWaalsContact O-CB 3.28Å; Q1007-V1011 WeakPolarHBondContact O-CB 3.42Å; Q1007-V1011 WeakPolarHBondContact O-CG2 3.48Å; Q1007-V1011 PolarHBondContact O-N 2.66Å
1008	L	70.1	Confident	66.6	Low	108 Å²	108	99.4 Å²	99.4	57%	0.565	51%	0.514	S	S	*	.	H	α-helix	trans	-66.8	-45.5	173.3	-79.8	165.5	0	0	0	111.4	V1004 S1005 S1010 V1011 E1012	V1004-L1008 HydrophobicContact CG1-CD1 3.94Å; V1004-L1008 HydrophobicContact CG1-CG 4.44Å; V1004-L1008 WeakPolarHBondContact O-CB 3.42Å; V1004-L1008 WeakPolarHBondContact O-CG 3.33Å; V1004-L1008 PolarHBondContact O-N 3.24Å; S1005-L1008 PolarHBondContact O-N 3.37Å; S1005-L1008 VanDerWaalsContact O-N 3.15Å; L1008-S1010 VanDerWaalsContact C-N 3.34Å; L1008-S1010 PolarHBondContact O-N 2.98Å; L1008-V1011 CarbonylContact O-C 3.59Å; L1008-V1011 PolarHBondContact O-N 2.94Å; L1008-E1012 VanDerWaalsContact O-CB 3.3Å; L1008-E1012 WeakPolarHBondContact O-CB 3.25Å; L1008-E1012 PolarHBondContact O-N 2.72Å
1009	E	71.6	Confident	65.3	Low	124 Å²	124	101.2 Å²	101.2	58%	0.579	53%	0.527	S	S	*	.	H	α-helix	trans	-59.4	-43.7	173.3	-72.4	173.1	163	0	0	111	S1005 E1012 E1013	S1005-E1009 WeakPolarHBondContact O-CG 3.45Å; S1005-E1009 PolarHBondContact O-N 3.49Å; E1009-E1012 PolarHBondContact O-N 3.28Å; E1009-E1013 PolarHBondContact O-N 2.83Å
1010	S	72.1	Confident	63.6	Low	47 Å²	47	98.9 Å²	98.9	33%	0.329	53%	0.532	S	S	.	.	H	α-helix	trans	-69.1	-33.8	176.2	-169.5	0	0	0	0	113.3	V1006 Q1007 L1008 Q1014	V1006-S1010 VanDerWaalsContact O-CB 3.26Å; V1006-S1010 WeakPolarHBondContact O-CB 3.26Å; V1006-S1010 PolarHBondContact O-N 3.33Å; Q1007-S1010 PolarHBondContact O-N 3.26Å; L1008-S1010 VanDerWaalsContact C-N 3.34Å; L1008-S1010 PolarHBondContact O-N 2.98Å; S1010-Q1014 VanDerWaalsContact O-CB 3.25Å; S1010-Q1014 WeakPolarHBondContact O-CB 3.22Å; S1010-Q1014 WeakPolarHBondContact O-CG 3.39Å; S1010-Q1014 PolarHBondContact O-N 3.28Å; S1010-Q1014 PolarHBondContact O-NE2 3.49Å; S1010-Q1014 PolarHBondContact OG-NE2 3.41Å
1011	V	64.8	Low	62.2	Low	72 Å²	72	100.3 Å²	100.3	44%	0.436	54%	0.543	S	S	.	.	H	α-helix	trans	-70.8	-34.4	172.5	165	0	0	0	0	110.7	Q1007 L1008 Q1014 L1015	Q1007-V1011 VanDerWaalsContact O-CB 3.28Å; Q1007-V1011 WeakPolarHBondContact O-CB 3.42Å; Q1007-V1011 WeakPolarHBondContact O-CG2 3.48Å; Q1007-V1011 PolarHBondContact O-N 2.66Å; L1008-V1011 CarbonylContact O-C 3.59Å; L1008-V1011 PolarHBondContact O-N 2.94Å; V1011-Q1014 CarbonylContact O-C 3.57Å; V1011-Q1014 PolarHBondContact O-N 3.27Å; V1011-L1015 HydrophobicContact CG1-CD1 3.95Å; V1011-L1015 HydrophobicContact CG1-CG 4.43Å; V1011-L1015 WeakPolarHBondContact O-CB 3.5Å; V1011-L1015 VanDerWaalsContact O-CG 3.24Å; V1011-L1015 WeakPolarHBondContact O-CG 3.36Å; V1011-L1015 PolarHBondContact O-N 3.5Å
1012	E	60.6	Low	60.5	Low	114 Å²	114	106.5 Å²	106.5	53%	0.533	56%	0.559	S	S	.	*	H	α-helix	trans	-70.5	-45.2	175	-176.9	162.9	-168	0	0	111.4	L1008 E1009 Q1014 L1015 Q1016	L1008-E1012 VanDerWaalsContact O-CB 3.3Å; L1008-E1012 WeakPolarHBondContact O-CB 3.25Å; L1008-E1012 PolarHBondContact O-N 2.72Å; E1009-E1012 PolarHBondContact O-N 3.28Å; E1012-Q1014 VanDerWaalsContact C-N 3.28Å; E1012-Q1014 PolarHBondContact O-N 2.92Å; E1012-L1015 PolarHBondContact O-N 2.94Å; E1012-Q1016 HydrophobicContact CG-CG 4.4Å; E1012-Q1016 WeakPolarHBondContact O-CB 3.45Å; E1012-Q1016 VanDerWaalsContact O-CG 3.27Å; E1012-Q1016 WeakPolarHBondContact O-CG 3.4Å; E1012-Q1016 PolarHBondContact O-N 3.31Å; E1012-Q1016 PolarHBondContact OE1-NE2 3.36Å
1013	E	67.1	Low	59.1	Low	137 Å²	137	110.3 Å²	110.3	64%	0.64	57%	0.571	S	S	*	*	H	α-helix	trans	-58.2	-39.5	168.8	-76.3	-166.3	136.9	0	0	111.8	E1009 S1017	E1009-E1013 PolarHBondContact O-N 2.83Å; E1013-S1017 VanDerWaalsContact O-CB 3.28Å; E1013-S1017 WeakPolarHBondContact O-CB 3.35Å; E1013-S1017 PolarHBondContact O-N 2.82Å; E1013-S1017 PolarHBondContact O-OG 3.46Å
1014	Q	63.8	Low	57.7	Low	93 Å²	93	111.2 Å²	111.2	44%	0.435	59%	0.585	S	S	.	*	H	α-helix	trans	-67.7	-38	175.3	-78.2	174.2	57.1	0	0	112.4	S1010 V1011 E1012 S1017 Q1018	S1010-Q1014 VanDerWaalsContact O-CB 3.25Å; S1010-Q1014 WeakPolarHBondContact O-CB 3.22Å; S1010-Q1014 WeakPolarHBondContact O-CG 3.39Å; S1010-Q1014 PolarHBondContact O-N 3.28Å; S1010-Q1014 PolarHBondContact O-NE2 3.49Å; S1010-Q1014 PolarHBondContact OG-NE2 3.41Å; V1011-Q1014 CarbonylContact O-C 3.57Å; V1011-Q1014 PolarHBondContact O-N 3.27Å; E1012-Q1014 VanDerWaalsContact C-N 3.28Å; E1012-Q1014 PolarHBondContact O-N 2.92Å; Q1014-S1017 WeakPolarHBondContact CA-OG 3.41Å; Q1014-S1017 PolarHBondContact O-OG 3.24Å; Q1014-Q1018 WeakPolarHBondContact O-CB 3.38Å; Q1014-Q1018 WeakPolarHBondContact O-CG 3.5Å; Q1014-Q1018 PolarHBondContact O-N 2.79Å
1015	L	55.8	Low	56.3	Low	119 Å²	119	119.4 Å²	119.4	62%	0.623	61%	0.607	S	S	*	*	H	α-helix	trans	-69.7	-43.9	175.1	-76.3	166.3	0	0	0	111.5	V1011 E1012 S1019	V1011-L1015 HydrophobicContact CG1-CD1 3.95Å; V1011-L1015 HydrophobicContact CG1-CG 4.43Å; V1011-L1015 WeakPolarHBondContact O-CB 3.5Å; V1011-L1015 VanDerWaalsContact O-CG 3.24Å; V1011-L1015 WeakPolarHBondContact O-CG 3.36Å; V1011-L1015 PolarHBondContact O-N 3.5Å; E1012-L1015 PolarHBondContact O-N 2.94Å; L1015-S1019 WeakPolarHBondContact O-CB 3.49Å; L1015-S1019 PolarHBondContact O-N 2.83Å
1016	Q	52.1	Low	55.3	Low	125 Å²	125	120.3 Å²	120.3	58%	0.584	62%	0.624	S	S	*	*	H	α-helix	trans	-62.9	-44.7	176.8	-70.2	-179	20.9	0	0	111	E1012 S1019	E1012-Q1016 HydrophobicContact CG-CG 4.4Å; E1012-Q1016 WeakPolarHBondContact O-CB 3.45Å; E1012-Q1016 VanDerWaalsContact O-CG 3.27Å; E1012-Q1016 WeakPolarHBondContact O-CG 3.4Å; E1012-Q1016 PolarHBondContact O-N 3.31Å; E1012-Q1016 PolarHBondContact OE1-NE2 3.36Å; Q1016-S1019 WeakPolarHBondContact O-CB 3.24Å; Q1016-S1019 PolarHBondContact O-OG 2.89Å
1017	S	46.8	Very low	54.4	Low	74 Å²	74	119.9 Å²	119.9	52%	0.517	62%	0.621	S	S	.	*	H	α-helix	trans	-71.1	-43.1	177.1	57.3	0	0	0	0	113.5	E1013 Q1014 S1019 S1020	E1013-S1017 VanDerWaalsContact O-CB 3.28Å; E1013-S1017 WeakPolarHBondContact O-CB 3.35Å; E1013-S1017 PolarHBondContact O-N 2.82Å; E1013-S1017 PolarHBondContact O-OG 3.46Å; Q1014-S1017 WeakPolarHBondContact CA-OG 3.41Å; Q1014-S1017 PolarHBondContact O-OG 3.24Å; S1017-S1019 VanDerWaalsContact C-N 3.28Å; S1017-S1019 PolarHBondContact O-N 2.76Å; S1017-S1020 PolarHBondContact O-OG 2.84Å
1018	Q	45.8	Very low	54	Low	127 Å²	127	117.9 Å²	117.9	59%	0.593	62%	0.617	S	S	*	*	H	α-helix	trans	-71.3	-19.1	178.9	-68.8	178.4	46.8	0	0	113.7	Q1014 S1020 V1021	Q1014-Q1018 WeakPolarHBondContact O-CB 3.38Å; Q1014-Q1018 WeakPolarHBondContact O-CG 3.5Å; Q1014-Q1018 PolarHBondContact O-N 2.79Å; Q1018-S1020 PolarHBondContact O-N 3.44Å; Q1018-V1021 PolarHBondContact O-N 3.16Å
1019	S	40.4	Very low	54.1	Low	102 Å²	102	114.1 Å²	114.1	71%	0.713	60%	0.598	S	S	*	*	T	Hydrogen-bonded Turn	trans	-52.6	-26.8	176.1	73.5	0	0	0	0	113.8	L1015 Q1016 S1017	L1015-S1019 WeakPolarHBondContact O-CB 3.49Å; L1015-S1019 PolarHBondContact O-N 2.83Å; Q1016-S1019 WeakPolarHBondContact O-CB 3.24Å; Q1016-S1019 PolarHBondContact O-OG 2.89Å; S1017-S1019 VanDerWaalsContact C-N 3.28Å; S1017-S1019 PolarHBondContact O-N 2.76Å
1020	S	39.9	Very low	54	Low	93 Å²	93	117.4 Å²	117.4	65%	0.65	61%	0.605	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.4	-30.6	-177.2	64.8	0	0	0	0	114.8	S1017 Q1018	S1017-S1020 PolarHBondContact O-OG 2.84Å; Q1018-S1020 PolarHBondContact O-N 3.44Å
1021	V	43.7	Very low	54.2	Low	107 Å²	107	120 Å²	120	65%	0.648	61%	0.612	S	S	*	*	S	Bend	trans	-146.3	83.6	-170.7	-168.2	0	0	0	0	113.7	Q1018	Q1018-V1021 PolarHBondContact O-N 3.16Å
1022	R	37.3	Very low	54.8	Low	240 Å²	240	117.7 Å²	117.7	91%	0.906	60%	0.597	S	S	*	*				-172.9	125.6	129.5	-104.2	158	-172	-171	3	113.5
1023	K	41.2	Very low	55.7	Low	193 Å²	193	115.6 Å²	115.6	84%	0.839	59%	0.587	S	S	*	*			trans	-75.4	134.8	165.8	-73	-178.8	176.5	177.1	0	110.7
1024	T	46.3	Very low	56.6	Low	139 Å²	139	116.5 Å²	116.5	85%	0.853	59%	0.589	S	S	*	*			trans	40.6	85.4	147.3	58.6	0	0	0	0	118.1
1025	R	42.9	Very low	57.5	Low	248 Å²	248	116.7 Å²	116.7	94%	0.936	59%	0.59	S	S	*	*			trans	-141.1	79	140.6	-160.6	173.3	-172.7	174.9	1.6	109.7
1026	G	48.8	Very low	59.1	Low	62 Å²	62	113.1 Å²	113.1	64%	0.639	57%	0.568	S	S	*	*	P	Polyproline II helix	trans	-72	127.3	178.6	0	0	0	0	0	110.9	T1028	G1026-T1028 PolarHBondContact O-N 3.04Å
1027	V	57.1	Low	60.8	Low	80 Å²	80	110.9 Å²	110.9	49%	0.485	56%	0.56	S	S	.	*	P	Polyproline II helix	trans	-54.4	132.7	171.2	-174.4	0	0	0	0	109.2	E1031 L1032	V1027-E1031 HydrophobicContact CG1-CB 3.84Å; V1027-L1032 HydrophobicContact CG1-CD2 4.11Å; V1027-L1032 HydrophobicContact CG1-CG 3.96Å
1028	T	65.5	Low	62.7	Low	72 Å²	72	111.5 Å²	111.5	44%	0.442	56%	0.556	S	S	.	*	P	Polyproline II helix	trans	-83.6	153.2	-178.1	68.6	0	0	0	0	111.1	G1026 R1030 E1031 L1032	G1026-T1028 PolarHBondContact O-N 3.04Å; T1028-R1030 PolarHBondContact O-N 2.88Å; T1028-E1031 VanDerWaalsContact CB-OE2 3.31Å; T1028-E1031 WeakPolarHBondContact CB-OE2 3.37Å; T1028-E1031 WeakPolarHBondContact CG2-OE2 3.37Å; T1028-E1031 PolarHBondContact N-OE2 2.87Å; T1028-E1031 PolarHBondContact O-N 3.45Å; T1028-E1031 VanDerWaalsContact OG1-CD 3.24Å; T1028-E1031 WeakPolarHBondContact OG1-CG 3.35Å; T1028-E1031 PolarHBondContact OG1-OE2 3.07Å; T1028-L1032 PolarHBondContact O-N 3.43Å
1029	V	71.9	Confident	64.7	Low	29 Å²	29	106.9 Å²	106.9	18%	0.176	54%	0.535	C	S	.	.	H	α-helix	trans	-54.3	-40	178.8	-179.1	0	0	0	0	111	E1031 L1032 E1033 L1078 K1081 I1085	V1029-E1031 VanDerWaalsContact C-N 3.26Å; V1029-E1031 PolarHBondContact O-N 2.92Å; V1029-L1032 PolarHBondContact O-N 2.84Å; V1029-E1033 HydrophobicContact CG1-CG 4.27Å; V1029-E1033 WeakPolarHBondContact O-CG 3.13Å; V1029-E1033 PolarHBondContact O-N 3.03Å; V1029-L1078 HydrophobicContact CG1-CD2 3.67Å; V1029-K1081 HydrophobicContact CG2-CB 4.15Å; V1029-I1085 HydrophobicContact CG2-CD1 3.84Å
1030	R	70.4	Confident	67	Low	193 Å²	193	104.6 Å²	104.6	73%	0.728	51%	0.512	S	S	*	.	H	α-helix	trans	-67.4	-15.9	178	-67.4	-178.4	178	174.9	-1	115.6	T1028 E1033 K1034	T1028-R1030 PolarHBondContact O-N 2.88Å; R1030-E1033 WeakPolarHBondContact CA-OE2 3.49Å; R1030-K1034 WeakPolarHBondContact O-CD 3.39Å; R1030-K1034 VanDerWaalsContact O-CG 3.28Å; R1030-K1034 WeakPolarHBondContact O-CG 3.47Å
1031	E	75.6	Confident	69.3	Low	102 Å²	102	106.5 Å²	106.5	48%	0.477	51%	0.513	S	S	.	.	H	α-helix	trans	-84.7	-45.1	173.1	-72.9	158.1	139.7	0	0	109.6	V1027 T1028 V1029 E1033 K1034 E1035	V1027-E1031 HydrophobicContact CG1-CB 3.84Å; T1028-E1031 VanDerWaalsContact CB-OE2 3.31Å; T1028-E1031 WeakPolarHBondContact CB-OE2 3.37Å; T1028-E1031 WeakPolarHBondContact CG2-OE2 3.37Å; T1028-E1031 PolarHBondContact N-OE2 2.87Å; T1028-E1031 PolarHBondContact O-N 3.45Å; T1028-E1031 VanDerWaalsContact OG1-CD 3.24Å; T1028-E1031 WeakPolarHBondContact OG1-CG 3.35Å; T1028-E1031 PolarHBondContact OG1-OE2 3.07Å; V1029-E1031 VanDerWaalsContact C-N 3.26Å; V1029-E1031 PolarHBondContact O-N 2.92Å; E1031-E1033 PolarHBondContact O-N 2.88Å; E1031-K1034 PolarHBondContact O-N 3.37Å; E1031-E1035 WeakPolarHBondContact O-CB 3.4Å; E1031-E1035 PolarHBondContact O-N 3.19Å
1032	L	78.3	Confident	71.3	Confident	22 Å²	22	106.5 Å²	106.5	12%	0.115	50%	0.504	C	S	.	.	H	α-helix	trans	-63.3	-39.3	174.7	-64.3	172.5	0	0	0	112.6	V1027 T1028 V1029 E1035 R1036 L1074 L1078 K1081	V1027-L1032 HydrophobicContact CG1-CD2 4.11Å; V1027-L1032 HydrophobicContact CG1-CG 3.96Å; T1028-L1032 PolarHBondContact O-N 3.43Å; V1029-L1032 PolarHBondContact O-N 2.84Å; L1032-E1035 PolarHBondContact O-N 3.3Å; L1032-R1036 VanDerWaalsContact O-CB 3.29Å; L1032-R1036 WeakPolarHBondContact O-CB 3.45Å; L1032-R1036 PolarHBondContact O-N 3.49Å; L1032-L1074 HydrophobicContact CD2-CD2 3.85Å; L1032-L1078 HydrophobicContact CB-CD2 3.62Å; L1032-L1078 HydrophobicContact CB-CG 4.06Å; L1032-L1078 HydrophobicContact CD1-CD2 4.39Å; L1032-K1081 HydrophobicContact CD1-CG 4.36Å
1033	E	80	Confident	73.8	Confident	71 Å²	71	97.9 Å²	97.9	33%	0.332	47%	0.471	S	S	.	.	H	α-helix	trans	-58.4	-48.4	173.5	-74.3	170.1	146.5	0	0	111.4	V1029 R1030 E1031 R1036 D1037 L1078	V1029-E1033 HydrophobicContact CG1-CG 4.27Å; V1029-E1033 WeakPolarHBondContact O-CG 3.13Å; V1029-E1033 PolarHBondContact O-N 3.03Å; R1030-E1033 WeakPolarHBondContact CA-OE2 3.49Å; E1031-E1033 PolarHBondContact O-N 2.88Å; E1033-R1036 PolarHBondContact O-N 2.92Å; E1033-D1037 WeakPolarHBondContact O-CB 3.45Å; E1033-D1037 PolarHBondContact O-N 3.29Å; E1033-L1078 HydrophobicContact CG-CD1 4.12Å; E1033-L1078 HydrophobicContact CG-CD2 3.81Å
1034	K	85.2	Confident	76	Confident	156 Å²	156	92 Å²	92	68%	0.678	45%	0.449	S	S	*	.	H	α-helix	trans	-65.1	-40.2	178.7	-74.9	175.5	179.3	-176.2	0	112.9	R1030 E1031 D1037 M1038	R1030-K1034 WeakPolarHBondContact O-CD 3.39Å; R1030-K1034 VanDerWaalsContact O-CG 3.28Å; R1030-K1034 WeakPolarHBondContact O-CG 3.47Å; E1031-K1034 PolarHBondContact O-N 3.37Å; K1034-D1037 PolarHBondContact O-N 3.28Å; K1034-M1038 WeakPolarHBondContact O-CB 3.36Å; K1034-M1038 PolarHBondContact O-N 3Å
1035	E	82.9	Confident	77.9	Confident	97 Å²	97	88.8 Å²	88.8	45%	0.453	43%	0.429	S	S	.	.	H	α-helix	trans	-67.2	-44.6	-179.9	-171	154.9	-136.9	0	0	110.7	E1031 L1032 D1037 M1038 L1039 L1074	E1031-E1035 WeakPolarHBondContact O-CB 3.4Å; E1031-E1035 PolarHBondContact O-N 3.19Å; L1032-E1035 PolarHBondContact O-N 3.3Å; E1035-D1037 PolarHBondContact O-N 3.49Å; E1035-M1038 HydrophobicContact CG-CE 4.22Å; E1035-M1038 PolarHBondContact O-N 2.99Å; E1035-L1039 WeakPolarHBondContact O-CG 3.41Å; E1035-L1039 PolarHBondContact O-N 3.38Å; E1035-L1074 HydrophobicContact CG-CD1 4.27Å
1036	R	88.6	Confident	79.7	Confident	43 Å²	43	78.1 Å²	78.1	16%	0.162	39%	0.391	C	S	.	.	H	α-helix	trans	-56.8	-49.1	170.7	-179.5	-158.1	67.4	-159.5	-13.6	112	L1032 E1033 M1038 L1039 K1040 L1074 D1075	L1032-R1036 VanDerWaalsContact O-CB 3.29Å; L1032-R1036 WeakPolarHBondContact O-CB 3.45Å; L1032-R1036 PolarHBondContact O-N 3.49Å; E1033-R1036 PolarHBondContact O-N 2.92Å; R1036-M1038 VanDerWaalsContact C-N 3.3Å; R1036-M1038 PolarHBondContact O-N 3.29Å; R1036-L1039 PolarHBondContact O-N 2.89Å; R1036-L1039 VanDerWaalsContact O-N 3.07Å; R1036-K1040 HydrophobicContact CG-CD 4.16Å; R1036-K1040 HydrophobicContact CG-CG 4.45Å; R1036-K1040 WeakPolarHBondContact O-CG 3.37Å; R1036-K1040 PolarHBondContact O-N 2.96Å; R1036-L1074 HydrophobicContact CB-CB 4.07Å; R1036-L1074 HydrophobicContact CB-CD1 4.04Å; R1036-L1074 HydrophobicContact CG-CB 4.32Å; R1036-D1075 WeakPolarHBondContact CD-OD1 3.32Å; R1036-D1075 WeakPolarHBondContact CD-OD2 3.49Å; R1036-D1075 IonicContact CZ-OD1 3.07Å; R1036-D1075 IonicContact NE-OD1 3.81Å; R1036-D1075 IonicContact NH1-OD1 3.92Å; R1036-D1075 PolarHBondContact NH1-OD1 3.44Å
1037	D	87.9	Confident	81.3	Confident	78 Å²	78	77.1 Å²	77.1	42%	0.417	37%	0.37	S	S	.	.	H	α-helix	trans	-67.8	-32.4	-175.3	-65.2	-14.1	0	0	0	111.6	E1033 K1034 E1035 M1041	E1033-D1037 WeakPolarHBondContact O-CB 3.45Å; E1033-D1037 PolarHBondContact O-N 3.29Å; K1034-D1037 PolarHBondContact O-N 3.28Å; E1035-D1037 PolarHBondContact O-N 3.49Å; D1037-M1041 WeakPolarHBondContact O-CB 3.42Å; D1037-M1041 PolarHBondContact O-N 3.36Å
1038	M	87.9	Confident	82.5	Confident	88 Å²	88	75.3 Å²	75.3	43%	0.433	36%	0.363	S	S	.	.	H	α-helix	trans	-64	-41	168.3	174.3	-175.4	57.4	0	0	112.6	K1034 E1035 R1036 K1042	K1034-M1038 WeakPolarHBondContact O-CB 3.36Å; K1034-M1038 PolarHBondContact O-N 3Å; E1035-M1038 HydrophobicContact CG-CE 4.22Å; E1035-M1038 PolarHBondContact O-N 2.99Å; R1036-M1038 VanDerWaalsContact C-N 3.3Å; R1036-M1038 PolarHBondContact O-N 3.29Å; M1038-K1042 WeakPolarHBondContact O-CG 3.44Å; M1038-K1042 PolarHBondContact O-N 3.4Å
1039	L	87.6	Confident	83.1	Confident	29 Å²	29	74.8 Å²	74.8	15%	0.152	36%	0.355	C	S	.	.	H	α-helix	trans	-72.4	-39.6	178.5	-64	-177.6	0	0	0	111.9	E1035 R1036 M1041 K1042 R1043 L1067 A1070 V1071 L1074	E1035-L1039 WeakPolarHBondContact O-CG 3.41Å; E1035-L1039 PolarHBondContact O-N 3.38Å; R1036-L1039 PolarHBondContact O-N 2.89Å; R1036-L1039 VanDerWaalsContact O-N 3.07Å; L1039-M1041 PolarHBondContact O-N 3.34Å; L1039-K1042 HydrophobicContact CD2-CD 4.37Å; L1039-K1042 PolarHBondContact O-N 2.92Å; L1039-K1042 VanDerWaalsContact O-N 3.16Å; L1039-R1043 PolarHBondContact O-N 2.89Å; L1039-L1067 HydrophobicContact CB-CD2 4.22Å; L1039-L1067 HydrophobicContact CD2-CD2 3.78Å; L1039-L1067 HydrophobicContact CG-CD2 4.5Å; L1039-A1070 HydrophobicContact CD1-CB 3.99Å; L1039-V1071 HydrophobicContact CB-CG2 3.75Å; L1039-L1074 HydrophobicContact CD1-CD1 3.83Å
1040	K	89.1	Confident	83.1	Confident	54 Å²	54	77 Å²	77	24%	0.235	37%	0.366	C	S	.	.	H	α-helix	trans	-56.6	-48.7	170.3	-72.9	-178.7	179.6	178.6	0	110.9	R1036 K1042 R1043 D1044 V1071 D1075	R1036-K1040 HydrophobicContact CG-CD 4.16Å; R1036-K1040 HydrophobicContact CG-CG 4.45Å; R1036-K1040 WeakPolarHBondContact O-CG 3.37Å; R1036-K1040 PolarHBondContact O-N 2.96Å; K1040-K1042 VanDerWaalsContact C-N 3.27Å; K1040-K1042 PolarHBondContact O-N 3.27Å; K1040-R1043 WeakPolarHBondContact O-CB 3.14Å; K1040-R1043 PolarHBondContact O-N 3.42Å; K1040-R1043 VanDerWaalsContact O-N 3.16Å; K1040-D1044 WeakPolarHBondContact O-CB 3.22Å; K1040-D1044 PolarHBondContact O-N 2.93Å; K1040-V1071 HydrophobicContact CD-CG1 4.2Å; K1040-V1071 HydrophobicContact CG-CB 4.45Å; K1040-V1071 HydrophobicContact CG-CG1 3.81Å; K1040-V1071 HydrophobicContact CG-CG2 3.71Å; K1040-D1075 WeakPolarHBondContact CE-OD2 3.27Å; K1040-D1075 IonicContact NZ-OD1 3.7Å; K1040-D1075 IonicContact NZ-OD2 3.5Å; K1040-D1075 PolarHBondContact NZ-OD2 2.9Å
1041	M	88.4	Confident	83.3	Confident	134 Å²	134	76 Å²	76	66%	0.66	36%	0.362	S	S	*	.	H	α-helix	trans	-58.2	-35.5	176.4	-174.3	-179	177.2	0	0	113.3	D1037 L1039 T1045	D1037-M1041 WeakPolarHBondContact O-CB 3.42Å; D1037-M1041 PolarHBondContact O-N 3.36Å; L1039-M1041 PolarHBondContact O-N 3.34Å; M1041-T1045 WeakPolarHBondContact O-CB 3.26Å; M1041-T1045 PolarHBondContact O-N 2.9Å; M1041-T1045 VanDerWaalsContact O-N 3.15Å; M1041-T1045 PolarHBondContact O-OG1 3.35Å
1042	K	85.1	Confident	83.2	Confident	106 Å²	106	77.6 Å²	77.6	46%	0.461	37%	0.374	S	S	.	.	H	α-helix	trans	-70.3	-44.9	175	-73	174	-177.3	175.1	0	112.4	M1038 L1039 K1040 T1045 L1046 L1067	M1038-K1042 WeakPolarHBondContact O-CG 3.44Å; M1038-K1042 PolarHBondContact O-N 3.4Å; L1039-K1042 HydrophobicContact CD2-CD 4.37Å; L1039-K1042 PolarHBondContact O-N 2.92Å; L1039-K1042 VanDerWaalsContact O-N 3.16Å; K1040-K1042 VanDerWaalsContact C-N 3.27Å; K1040-K1042 PolarHBondContact O-N 3.27Å; K1042-T1045 WeakPolarHBondContact O-CB 3.27Å; K1042-T1045 PolarHBondContact O-N 3.45Å; K1042-L1046 PolarHBondContact O-N 3.46Å; K1042-L1067 HydrophobicContact CB-CD1 4.06Å; K1042-L1067 HydrophobicContact CB-CD2 4.24Å
1043	R	90.3	Very high	82.1	Confident	59 Å²	59	83.6 Å²	83.6	22%	0.223	41%	0.406	C	S	.	.	H	α-helix	trans	-57.5	-51.2	173.7	-178.3	-156.6	61.6	175	1.5	110.4	L1039 K1040 T1045 L1046 E1047 L1064 L1067 E1068	L1039-R1043 PolarHBondContact O-N 2.89Å; K1040-R1043 WeakPolarHBondContact O-CB 3.14Å; K1040-R1043 PolarHBondContact O-N 3.42Å; K1040-R1043 VanDerWaalsContact O-N 3.16Å; R1043-T1045 PolarHBondContact O-N 2.97Å; R1043-T1045 VanDerWaalsContact O-N 3.16Å; R1043-L1046 PolarHBondContact O-N 2.89Å; R1043-E1047 WeakPolarHBondContact CD-OE1 3.25Å; R1043-E1047 HydrophobicContact CG-CG 4.47Å; R1043-E1047 IonicContact CZ-OE1 3.69Å; R1043-E1047 IonicContact NE-OE1 3.47Å; R1043-E1047 PolarHBondContact NE-OE1 3.13Å; R1043-E1047 VanDerWaalsContact NE-OE1 3.07Å; R1043-E1047 IonicContact NH2-OE1 3.49Å; R1043-E1047 PolarHBondContact O-N 3.18Å; R1043-L1064 HydrophobicContact CB-CD1 4.45Å; R1043-L1064 HydrophobicContact CG-CD1 3.6Å; R1043-L1067 HydrophobicContact CB-CB 4.17Å; R1043-E1068 HydrophobicContact CG-CG 4.22Å
1044	D	86.9	Confident	81.6	Confident	70 Å²	70	85.6 Å²	85.6	37%	0.374	41%	0.411	S	S	.	.	H	α-helix	trans	-60.5	-29.3	-178.8	-62.5	-6.3	0	0	0	112	K1040 A1048	K1040-D1044 WeakPolarHBondContact O-CB 3.22Å; K1040-D1044 PolarHBondContact O-N 2.93Å; D1044-A1048 WeakPolarHBondContact O-CB 3.12Å; D1044-A1048 PolarHBondContact O-N 2.89Å
1045	T	86.1	Confident	80.7	Confident	71 Å²	71	84.3 Å²	84.3	44%	0.436	42%	0.416	S	S	.	.	H	α-helix	trans	-71.9	-37.1	173.7	-57.8	0	0	0	0	112.6	M1041 K1042 R1043 Q1049	M1041-T1045 WeakPolarHBondContact O-CB 3.26Å; M1041-T1045 PolarHBondContact O-N 2.9Å; M1041-T1045 VanDerWaalsContact O-N 3.15Å; M1041-T1045 PolarHBondContact O-OG1 3.35Å; K1042-T1045 WeakPolarHBondContact O-CB 3.27Å; K1042-T1045 PolarHBondContact O-N 3.45Å; R1043-T1045 PolarHBondContact O-N 2.97Å; R1043-T1045 VanDerWaalsContact O-N 3.16Å; T1045-Q1049 WeakPolarHBondContact O-CG 3.13Å; T1045-Q1049 PolarHBondContact O-N 3.31Å
1046	L	81	Confident	80.1	Confident	25 Å²	25	80.1 Å²	80.1	13%	0.131	40%	0.396	C	S	.	.	H	α-helix	trans	-74.4	-38.8	174.1	-71.1	173.1	0	0	0	111.5	K1042 R1043 A1048 Q1049 L1050 L1056 E1060 L1064 L1067	K1042-L1046 PolarHBondContact O-N 3.46Å; R1043-L1046 PolarHBondContact O-N 2.89Å; L1046-A1048 VanDerWaalsContact C-N 3.33Å; L1046-A1048 PolarHBondContact O-N 2.99Å; L1046-Q1049 PolarHBondContact O-N 3.02Å; L1046-L1050 PolarHBondContact O-N 2.89Å; L1046-L1056 HydrophobicContact CD2-CD2 4.46Å; L1046-E1060 HydrophobicContact CD2-CB 4.45Å; L1046-E1060 HydrophobicContact CD2-CG 4.48Å; L1046-L1064 HydrophobicContact CB-CD1 3.92Å; L1046-L1067 HydrophobicContact CD1-CD1 3.94Å
1047	E	81.4	Confident	79.4	Confident	41 Å²	41	81.5 Å²	81.5	19%	0.192	41%	0.41	C	S	.	.	H	α-helix	trans	-59.8	-40.6	170.1	-76.2	-171.9	-127.2	0	0	112.2	R1043 Q1049 L1050 R1051 L1064	R1043-E1047 WeakPolarHBondContact CD-OE1 3.25Å; R1043-E1047 HydrophobicContact CG-CG 4.47Å; R1043-E1047 IonicContact CZ-OE1 3.69Å; R1043-E1047 IonicContact NE-OE1 3.47Å; R1043-E1047 PolarHBondContact NE-OE1 3.13Å; R1043-E1047 VanDerWaalsContact NE-OE1 3.07Å; R1043-E1047 IonicContact NH2-OE1 3.49Å; R1043-E1047 PolarHBondContact O-N 3.18Å; E1047-Q1049 VanDerWaalsContact C-N 3.31Å; E1047-Q1049 PolarHBondContact O-N 3.29Å; E1047-L1050 WeakPolarHBondContact O-CB 3.27Å; E1047-L1050 PolarHBondContact O-N 3.31Å; E1047-R1051 VanDerWaalsContact O-CG 3.25Å; E1047-R1051 WeakPolarHBondContact O-CG 3.49Å; E1047-R1051 PolarHBondContact O-N 3.11Å; E1047-R1051 IonicContact OE2-CZ 2.69Å; E1047-R1051 IonicContact OE2-NE 2.64Å; E1047-R1051 IonicContact OE2-NH2 3.33Å; E1047-R1051 PolarHBondContact OE2-NH2 2.89Å; E1047-L1064 HydrophobicContact CG-CD1 4.22Å
1048	A	82.5	Confident	78.4	Confident	42 Å²	42	83.2 Å²	83.2	35%	0.347	42%	0.423	S	S	.	.	H	α-helix	trans	-60.6	-41.9	175.7	0	0	0	0	0	111.6	D1044 L1046 L1050 R1051 D1052	D1044-A1048 WeakPolarHBondContact O-CB 3.12Å; D1044-A1048 PolarHBondContact O-N 2.89Å; L1046-A1048 VanDerWaalsContact C-N 3.33Å; L1046-A1048 PolarHBondContact O-N 2.99Å; A1048-L1050 PolarHBondContact O-N 2.89Å; A1048-R1051 PolarHBondContact O-N 3.08Å; A1048-R1051 VanDerWaalsContact O-N 3.16Å; A1048-D1052 PolarHBondContact O-N 3.32Å
1049	Q	78.3	Confident	77.5	Confident	60 Å²	60	86.6 Å²	86.6	28%	0.28	44%	0.438	S	S	.	.	H	α-helix	trans	-65.2	-36.4	176.4	-67.8	176.5	40.7	0	0	112.7	T1045 L1046 E1047 D1052 R1054 L1056	T1045-Q1049 WeakPolarHBondContact O-CG 3.13Å; T1045-Q1049 PolarHBondContact O-N 3.31Å; L1046-Q1049 PolarHBondContact O-N 3.02Å; E1047-Q1049 VanDerWaalsContact C-N 3.31Å; E1047-Q1049 PolarHBondContact O-N 3.29Å; Q1049-D1052 PolarHBondContact O-N 3.36Å; Q1049-R1054 VanDerWaalsContact O-CB 3.31Å; Q1049-R1054 WeakPolarHBondContact O-CB 3.4Å; Q1049-R1054 PolarHBondContact O-N 2.89Å; Q1049-R1054 VanDerWaalsContact O-N 3.09Å; Q1049-L1056 HydrophobicContact CB-CD2 4.4Å
1050	L	71.7	Confident	77.1	Confident	75 Å²	75	87.2 Å²	87.2	39%	0.393	44%	0.44	S	S	.	.	H	α-helix	trans	-62.4	-43.6	170.1	-79.7	166	0	0	0	112.1	L1046 E1047 A1048 D1052 N1053 L1056 L1064	L1046-L1050 PolarHBondContact O-N 2.89Å; E1047-L1050 WeakPolarHBondContact O-CB 3.27Å; E1047-L1050 PolarHBondContact O-N 3.31Å; A1048-L1050 PolarHBondContact O-N 2.89Å; L1050-D1052 VanDerWaalsContact C-N 3.29Å; L1050-D1052 PolarHBondContact O-N 3.32Å; L1050-N1053 WeakPolarHBondContact O-CA 3.39Å; L1050-N1053 PolarHBondContact O-N 3.23Å; L1050-L1056 HydrophobicContact CD1-CD1 3.73Å; L1050-L1056 HydrophobicContact CD1-CG 4.44Å; L1050-L1056 HydrophobicContact CD2-CD1 3.92Å; L1050-L1056 HydrophobicContact CD2-CG 3.76Å; L1050-L1056 HydrophobicContact CG-CD1 3.64Å; L1050-L1056 HydrophobicContact CG-CG 3.82Å; L1050-L1064 HydrophobicContact CD1-CD2 3.79Å
1051	R	75.5	Confident	76.3	Confident	172 Å²	172	89.2 Å²	89.2	65%	0.649	45%	0.45	S	S	*	.	H	α-helix	trans	-65.3	-31.8	178.8	-66.5	169.1	-156.6	-173.6	8.1	112.4	E1047 A1048 N1053	E1047-R1051 VanDerWaalsContact O-CG 3.25Å; E1047-R1051 WeakPolarHBondContact O-CG 3.49Å; E1047-R1051 PolarHBondContact O-N 3.11Å; E1047-R1051 IonicContact OE2-CZ 2.69Å; E1047-R1051 IonicContact OE2-NE 2.64Å; E1047-R1051 IonicContact OE2-NH2 3.33Å; E1047-R1051 PolarHBondContact OE2-NH2 2.89Å; A1048-R1051 PolarHBondContact O-N 3.08Å; A1048-R1051 VanDerWaalsContact O-N 3.16Å; R1051-N1053 PolarHBondContact O-N 3.33Å
1052	D	73	Confident	75.6	Confident	137 Å²	137	88 Å²	88	73%	0.733	44%	0.442	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.4	11.4	171.1	-72.3	-18.6	0	0	0	113.5	A1048 Q1049 L1050 R1054	A1048-D1052 PolarHBondContact O-N 3.32Å; Q1049-D1052 PolarHBondContact O-N 3.36Å; L1050-D1052 VanDerWaalsContact C-N 3.29Å; L1050-D1052 PolarHBondContact O-N 3.32Å; D1052-R1054 PolarHBondContact O-N 3.48Å
1053	N	54.9	Low	75.4	Confident	148 Å²	148	85.2 Å²	85.2	79%	0.791	44%	0.436	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.4	22.7	-178.8	-63.2	-84	0	0	0	114.8	L1050 R1051 V1055	L1050-N1053 WeakPolarHBondContact O-CA 3.39Å; L1050-N1053 PolarHBondContact O-N 3.23Å; R1051-N1053 PolarHBondContact O-N 3.33Å; N1053-V1055 PolarHBondContact O-N 3.36Å
1054	R	68.7	Low	75	Confident	112 Å²	112	83.6 Å²	83.6	42%	0.423	43%	0.432	S	S	.	.	P	Polyproline II helix	trans	-75.8	117.6	167.5	-174.1	179.2	175.3	-104.6	-15.4	108.5	Q1049 D1052 L1056 E1060	Q1049-R1054 VanDerWaalsContact O-CB 3.31Å; Q1049-R1054 WeakPolarHBondContact O-CB 3.4Å; Q1049-R1054 PolarHBondContact O-N 2.89Å; Q1049-R1054 VanDerWaalsContact O-N 3.09Å; D1052-R1054 PolarHBondContact O-N 3.48Å; R1054-L1056 PolarHBondContact O-N 2.89Å; R1054-E1060 IonicContact CZ-OE1 3.5Å; R1054-E1060 IonicContact NH1-OE1 2.73Å; R1054-E1060 PolarHBondContact NH1-OE1 3.19Å; R1054-E1060 IonicContact NH1-OE2 3.78Å; R1054-E1060 IonicContact NH2-OE1 3.29Å; R1054-E1060 PolarHBondContact NH2-OE1 3.28Å; R1054-E1060 IonicContact NH2-OE2 3.71Å
1055	V	66.7	Low	74.6	Confident	130 Å²	130	84.5 Å²	84.5	79%	0.788	44%	0.436	S	S	*	.	P	Polyproline II helix	trans	-63.9	116.8	170.1	-178.2	0	0	0	0	108.1	N1053	N1053-V1055 PolarHBondContact O-N 3.36Å
1056	L	71.6	Confident	74.3	Confident	9 Å²	9	86 Å²	86	5%	0.047	44%	0.438	C	S	.	.	P	Polyproline II helix	trans	-67.8	149.9	173.3	-68.5	-172.5	0	0	0	110.5	L1046 Q1049 L1050 R1054 E1060 E1061	L1046-L1056 HydrophobicContact CD2-CD2 4.46Å; Q1049-L1056 HydrophobicContact CB-CD2 4.4Å; L1050-L1056 HydrophobicContact CD1-CD1 3.73Å; L1050-L1056 HydrophobicContact CD1-CG 4.44Å; L1050-L1056 HydrophobicContact CD2-CD1 3.92Å; L1050-L1056 HydrophobicContact CD2-CG 3.76Å; L1050-L1056 HydrophobicContact CG-CD1 3.64Å; L1050-L1056 HydrophobicContact CG-CG 3.82Å; R1054-L1056 PolarHBondContact O-N 2.89Å; L1056-E1060 HydrophobicContact CB-CB 3.97Å; L1056-E1060 HydrophobicContact CD1-CB 4.23Å; L1056-E1060 HydrophobicContact CD2-CB 4.02Å; L1056-E1060 HydrophobicContact CG-CB 4.28Å; L1056-E1061 HydrophobicContact CB-CG 3.77Å; L1056-E1061 HydrophobicContact CD1-CG 4.44Å
1057	T	73.6	Confident	74.7	Confident	71 Å²	71	86.1 Å²	86.1	44%	0.436	44%	0.438	S	S	.	.	P	Polyproline II helix	trans	-73.6	156.5	165.3	60.2	0	0	0	0	110.3	E1059 E1060 E1061	T1057-E1059 PolarHBondContact O-N 2.88Å; T1057-E1060 WeakPolarHBondContact CB-OE2 3.31Å; T1057-E1060 WeakPolarHBondContact CG2-OE2 3.37Å; T1057-E1060 PolarHBondContact N-OE2 3.44Å; T1057-E1060 CarbonylContact O-C 3.47Å; T1057-E1060 WeakPolarHBondContact O-CA 3.21Å; T1057-E1060 WeakPolarHBondContact O-CB 3.28Å; T1057-E1060 PolarHBondContact O-N 2.95Å; T1057-E1060 VanDerWaalsContact OG1-CD 3.31Å; T1057-E1060 WeakPolarHBondContact OG1-CG 3.34Å; T1057-E1060 PolarHBondContact OG1-N 3.41Å; T1057-E1060 PolarHBondContact OG1-OE2 3.33Å; T1057-E1061 PolarHBondContact O-N 3.45Å
1058	V	66.3	Low	74.7	Confident	114 Å²	114	88.4 Å²	88.4	69%	0.691	45%	0.449	S	S	*	.	H	α-helix	trans	-56.6	-28	179.1	-176.7	0	0	0	0	112.2	H1062	V1058-H1062 VanDerWaalsContact O-CB 3.28Å; V1058-H1062 WeakPolarHBondContact O-CB 3.35Å; V1058-H1062 PolarHBondContact O-N 3.5Å
1059	E	69.8	Low	74.5	Confident	160 Å²	160	92.4 Å²	92.4	75%	0.748	46%	0.461	S	S	*	.	H	α-helix	trans	-74.5	-38.1	175.6	-65.4	171.1	-168.9	0	0	111.9	T1057 S1063	T1057-E1059 PolarHBondContact O-N 2.88Å; E1059-S1063 VanDerWaalsContact O-CB 3.3Å; E1059-S1063 WeakPolarHBondContact O-CB 3.4Å; E1059-S1063 PolarHBondContact O-N 3.33Å; E1059-S1063 PolarHBondContact O-OG 3.11Å
1060	E	78.2	Confident	74.7	Confident	42 Å²	42	91.3 Å²	91.3	20%	0.196	46%	0.462	C	S	.	.	H	α-helix	trans	-70.4	-38.9	172.4	-70.9	160.9	132.7	0	0	111.6	L1046 R1054 L1056 T1057 S1063 L1064	L1046-E1060 HydrophobicContact CD2-CB 4.45Å; L1046-E1060 HydrophobicContact CD2-CG 4.48Å; R1054-E1060 IonicContact CZ-OE1 3.5Å; R1054-E1060 IonicContact NH1-OE1 2.73Å; R1054-E1060 PolarHBondContact NH1-OE1 3.19Å; R1054-E1060 IonicContact NH1-OE2 3.78Å; R1054-E1060 IonicContact NH2-OE1 3.29Å; R1054-E1060 PolarHBondContact NH2-OE1 3.28Å; R1054-E1060 IonicContact NH2-OE2 3.71Å; L1056-E1060 HydrophobicContact CB-CB 3.97Å; L1056-E1060 HydrophobicContact CD1-CB 4.23Å; L1056-E1060 HydrophobicContact CD2-CB 4.02Å; L1056-E1060 HydrophobicContact CG-CB 4.28Å; T1057-E1060 WeakPolarHBondContact CB-OE2 3.31Å; T1057-E1060 WeakPolarHBondContact CG2-OE2 3.37Å; T1057-E1060 PolarHBondContact N-OE2 3.44Å; T1057-E1060 CarbonylContact O-C 3.47Å; T1057-E1060 WeakPolarHBondContact O-CA 3.21Å; T1057-E1060 WeakPolarHBondContact O-CB 3.28Å; T1057-E1060 PolarHBondContact O-N 2.95Å; T1057-E1060 VanDerWaalsContact OG1-CD 3.31Å; T1057-E1060 WeakPolarHBondContact OG1-CG 3.34Å; T1057-E1060 PolarHBondContact OG1-N 3.41Å; T1057-E1060 PolarHBondContact OG1-OE2 3.33Å; E1060-S1063 PolarHBondContact O-N 3.33Å; E1060-L1064 PolarHBondContact O-N 2.98Å
1061	E	73.2	Confident	75.4	Confident	95 Å²	95	88.2 Å²	88.2	44%	0.444	45%	0.446	S	S	.	.	H	α-helix	trans	-62.8	-46.7	173.9	-67.9	-177.4	142.3	0	0	111.8	L1056 T1057 S1063 L1064 I1065	L1056-E1061 HydrophobicContact CB-CG 3.77Å; L1056-E1061 HydrophobicContact CD1-CG 4.44Å; T1057-E1061 PolarHBondContact O-N 3.45Å; E1061-S1063 VanDerWaalsContact C-N 3.3Å; E1061-S1063 PolarHBondContact O-N 2.94Å; E1061-L1064 WeakPolarHBondContact O-CB 3.3Å; E1061-L1064 PolarHBondContact O-N 2.89Å; E1061-I1065 PolarHBondContact O-N 3.02Å
1062	H	72.9	Confident	75.8	Confident	108 Å²	108	87.1 Å²	87.1	50%	0.5	45%	0.448	S	S	.	.	H	α-helix	trans	-65.4	-35.6	176.2	-166.4	-86.7	0	0	0	111.8	V1058 L1064 Q1066	V1058-H1062 VanDerWaalsContact O-CB 3.28Å; V1058-H1062 WeakPolarHBondContact O-CB 3.35Å; V1058-H1062 PolarHBondContact O-N 3.5Å; H1062-L1064 VanDerWaalsContact C-N 3.33Å; H1062-Q1066 PolarHBondContact CE1-NE2 3.35Å; H1062-Q1066 VanDerWaalsContact CE1-NE2 3.35Å; H1062-Q1066 WeakPolarHBondContact O-CG 3.44Å; H1062-Q1066 PolarHBondContact O-N 3.5Å; H1062-Q1066 VanDerWaalsContact O-N 3.13Å
1063	S	80.6	Confident	76.2	Confident	49 Å²	49	83.6 Å²	83.6	34%	0.343	44%	0.438	S	S	.	.	H	α-helix	trans	-65.5	-34.2	173.8	-61.5	0	0	0	0	112.5	E1059 E1060 E1061 L1067	E1059-S1063 VanDerWaalsContact O-CB 3.3Å; E1059-S1063 WeakPolarHBondContact O-CB 3.4Å; E1059-S1063 PolarHBondContact O-N 3.33Å; E1059-S1063 PolarHBondContact O-OG 3.11Å; E1060-S1063 PolarHBondContact O-N 3.33Å; E1061-S1063 VanDerWaalsContact C-N 3.3Å; E1061-S1063 PolarHBondContact O-N 2.94Å; S1063-L1067 WeakPolarHBondContact O-CB 3.35Å; S1063-L1067 WeakPolarHBondContact O-CD1 3.21Å; S1063-L1067 WeakPolarHBondContact O-CG 3.17Å; S1063-L1067 PolarHBondContact O-N 3.31Å
1064	L	82.3	Confident	77.6	Confident	24 Å²	24	77.8 Å²	77.8	13%	0.126	41%	0.407	C	S	.	.	H	α-helix	trans	-63.9	-48.7	176.9	-174.8	69.6	0	0	0	111.1	R1043 L1046 E1047 L1050 E1060 E1061 H1062 Q1066 L1067 E1068	R1043-L1064 HydrophobicContact CB-CD1 4.45Å; R1043-L1064 HydrophobicContact CG-CD1 3.6Å; L1046-L1064 HydrophobicContact CB-CD1 3.92Å; E1047-L1064 HydrophobicContact CG-CD1 4.22Å; L1050-L1064 HydrophobicContact CD1-CD2 3.79Å; E1060-L1064 PolarHBondContact O-N 2.98Å; E1061-L1064 WeakPolarHBondContact O-CB 3.3Å; E1061-L1064 PolarHBondContact O-N 2.89Å; H1062-L1064 VanDerWaalsContact C-N 3.33Å; L1064-Q1066 PolarHBondContact O-N 2.67Å; L1064-L1067 WeakPolarHBondContact O-CB 3.34Å; L1064-L1067 PolarHBondContact O-N 2.93Å; L1064-L1067 VanDerWaalsContact O-N 3.12Å; L1064-E1068 PolarHBondContact O-N 2.97Å
1065	I	78.1	Confident	78.1	Confident	90 Å²	90	75.2 Å²	75.2	46%	0.462	40%	0.401	S	S	.	.	H	α-helix	trans	-60.2	-46	177.9	-61.6	169	0	0	0	110.5	E1061 L1067 E1068 E1069	E1061-I1065 PolarHBondContact O-N 3.02Å; I1065-L1067 VanDerWaalsContact C-N 3.26Å; I1065-L1067 PolarHBondContact O-N 3.48Å; I1065-E1068 PolarHBondContact O-N 3.33Å; I1065-E1068 VanDerWaalsContact O-N 3.12Å; I1065-E1069 PolarHBondContact O-N 2.94Å
1066	Q	81.1	Confident	78.6	Confident	103 Å²	103	71.7 Å²	71.7	48%	0.481	39%	0.386	S	S	.	.	H	α-helix	trans	-63.2	-30.2	177	-72.4	-176.1	-37.7	0	0	113.3	H1062 L1064 A1070	H1062-Q1066 PolarHBondContact CE1-NE2 3.35Å; H1062-Q1066 VanDerWaalsContact CE1-NE2 3.35Å; H1062-Q1066 WeakPolarHBondContact O-CG 3.44Å; H1062-Q1066 PolarHBondContact O-N 3.5Å; H1062-Q1066 VanDerWaalsContact O-N 3.13Å; L1064-Q1066 PolarHBondContact O-N 2.67Å; Q1066-A1070 WeakPolarHBondContact O-CB 3.27Å; Q1066-A1070 PolarHBondContact O-N 3.06Å; Q1066-A1070 VanDerWaalsContact O-N 3.08Å
1067	L	87.6	Confident	78.8	Confident	26 Å²	26	73.1 Å²	73.1	14%	0.136	40%	0.399	C	S	.	.	H	α-helix	trans	-74.1	-33.4	173.9	-74.8	165.9	0	0	0	112.3	L1039 K1042 R1043 L1046 S1063 L1064 I1065 V1071	L1039-L1067 HydrophobicContact CB-CD2 4.22Å; L1039-L1067 HydrophobicContact CD2-CD2 3.78Å; L1039-L1067 HydrophobicContact CG-CD2 4.5Å; K1042-L1067 HydrophobicContact CB-CD1 4.06Å; K1042-L1067 HydrophobicContact CB-CD2 4.24Å; R1043-L1067 HydrophobicContact CB-CB 4.17Å; L1046-L1067 HydrophobicContact CD1-CD1 3.94Å; S1063-L1067 WeakPolarHBondContact O-CB 3.35Å; S1063-L1067 WeakPolarHBondContact O-CD1 3.21Å; S1063-L1067 WeakPolarHBondContact O-CG 3.17Å; S1063-L1067 PolarHBondContact O-N 3.31Å; L1064-L1067 WeakPolarHBondContact O-CB 3.34Å; L1064-L1067 PolarHBondContact O-N 2.93Å; L1064-L1067 VanDerWaalsContact O-N 3.12Å; I1065-L1067 VanDerWaalsContact C-N 3.26Å; I1065-L1067 PolarHBondContact O-N 3.48Å; L1067-V1071 VanDerWaalsContact O-CB 3.28Å; L1067-V1071 WeakPolarHBondContact O-CB 3.45Å; L1067-V1071 WeakPolarHBondContact O-CG2 3.42Å; L1067-V1071 PolarHBondContact O-N 2.96Å; L1067-V1071 VanDerWaalsContact O-N 3.1Å
1068	E	81.4	Confident	79.1	Confident	90 Å²	90	70 Å²	70	42%	0.421	38%	0.38	S	S	.	.	H	α-helix	trans	-67.2	-50.8	173	-69.2	-175.6	142.5	0	0	111.4	R1043 L1064 I1065 A1070 V1071 E1072	R1043-E1068 HydrophobicContact CG-CG 4.22Å; L1064-E1068 PolarHBondContact O-N 2.97Å; I1065-E1068 PolarHBondContact O-N 3.33Å; I1065-E1068 VanDerWaalsContact O-N 3.12Å; E1068-A1070 PolarHBondContact O-N 2.85Å; E1068-V1071 PolarHBondContact O-N 3Å; E1068-V1071 VanDerWaalsContact O-N 3.14Å; E1068-E1072 PolarHBondContact O-N 3.48Å
1069	E	80.1	Confident	79.6	Confident	126 Å²	126	70.4 Å²	70.4	59%	0.589	37%	0.374	S	S	*	.	H	α-helix	trans	-58.5	-44.2	177.2	-68.9	178.6	162.6	0	0	112	I1065 V1071 E1072 A1073	I1065-E1069 PolarHBondContact O-N 2.94Å; E1069-V1071 VanDerWaalsContact C-N 3.32Å; E1069-V1071 PolarHBondContact O-N 3.43Å; E1069-E1072 PolarHBondContact O-N 3.24Å; E1069-A1073 WeakPolarHBondContact O-CB 3.49Å; E1069-A1073 PolarHBondContact O-N 3.15Å
1070	A	81.6	Confident	80	Confident	36 Å²	36	69.7 Å²	69.7	30%	0.298	37%	0.369	S	S	.	.	H	α-helix	trans	-66.9	-32.1	177.7	0	0	0	0	0	112.9	L1039 Q1066 E1068 L1074	L1039-A1070 HydrophobicContact CD1-CB 3.99Å; Q1066-A1070 WeakPolarHBondContact O-CB 3.27Å; Q1066-A1070 PolarHBondContact O-N 3.06Å; Q1066-A1070 VanDerWaalsContact O-N 3.08Å; E1068-A1070 PolarHBondContact O-N 2.85Å; A1070-L1074 WeakPolarHBondContact O-CG 3.26Å; A1070-L1074 PolarHBondContact O-N 3.08Å
1071	V	85.4	Confident	79.9	Confident	10 Å²	10	71.6 Å²	71.6	6%	0.061	38%	0.376	C	S	.	.	H	α-helix	trans	-71.3	-44.2	175	157.6	0	0	0	0	111.4	L1039 K1040 L1067 E1068 E1069 L1074 D1075	L1039-V1071 HydrophobicContact CB-CG2 3.75Å; K1040-V1071 HydrophobicContact CD-CG1 4.2Å; K1040-V1071 HydrophobicContact CG-CB 4.45Å; K1040-V1071 HydrophobicContact CG-CG1 3.81Å; K1040-V1071 HydrophobicContact CG-CG2 3.71Å; L1067-V1071 VanDerWaalsContact O-CB 3.28Å; L1067-V1071 WeakPolarHBondContact O-CB 3.45Å; L1067-V1071 WeakPolarHBondContact O-CG2 3.42Å; L1067-V1071 PolarHBondContact O-N 2.96Å; L1067-V1071 VanDerWaalsContact O-N 3.1Å; E1068-V1071 PolarHBondContact O-N 3Å; E1068-V1071 VanDerWaalsContact O-N 3.14Å; E1069-V1071 VanDerWaalsContact C-N 3.32Å; E1069-V1071 PolarHBondContact O-N 3.43Å; V1071-L1074 PolarHBondContact O-N 3.43Å; V1071-D1075 PolarHBondContact O-N 3.45Å
1072	E	84.7	Confident	79.9	Confident	150 Å²	150	70.5 Å²	70.5	70%	0.701	37%	0.373	S	S	*	.	H	α-helix	trans	-62.9	-43.8	177.1	-174.3	170.9	-158.6	0	0	111.2	E1068 E1069 L1074 D1075 A1076	E1068-E1072 PolarHBondContact O-N 3.48Å; E1069-E1072 PolarHBondContact O-N 3.24Å; E1072-L1074 VanDerWaalsContact C-N 3.3Å; E1072-L1074 PolarHBondContact O-N 3.03Å; E1072-D1075 PolarHBondContact O-N 3.19Å; E1072-A1076 WeakPolarHBondContact O-CB 3.49Å; E1072-A1076 PolarHBondContact O-N 3.45Å
1073	A	80.8	Confident	79.8	Confident	63 Å²	63	68.5 Å²	68.5	52%	0.521	37%	0.367	S	S	.	.	H	α-helix	trans	-59.7	-37.1	174.9	0	0	0	0	0	113	E1069 A1077	E1069-A1073 WeakPolarHBondContact O-CB 3.49Å; E1069-A1073 PolarHBondContact O-N 3.15Å; A1073-A1077 WeakPolarHBondContact O-CB 3.43Å; A1073-A1077 PolarHBondContact O-N 3.33Å
1074	L	84.6	Confident	79.1	Confident	26 Å²	26	67.6 Å²	67.6	14%	0.136	36%	0.36	C	S	.	.	H	α-helix	trans	-74.1	-40	177	-76.7	172.4	0	0	0	113.1	L1032 E1035 R1036 L1039 A1070 V1071 E1072 A1076 A1077 L1078	L1032-L1074 HydrophobicContact CD2-CD2 3.85Å; E1035-L1074 HydrophobicContact CG-CD1 4.27Å; R1036-L1074 HydrophobicContact CB-CB 4.07Å; R1036-L1074 HydrophobicContact CB-CD1 4.04Å; R1036-L1074 HydrophobicContact CG-CB 4.32Å; L1039-L1074 HydrophobicContact CD1-CD1 3.83Å; A1070-L1074 WeakPolarHBondContact O-CG 3.26Å; A1070-L1074 PolarHBondContact O-N 3.08Å; V1071-L1074 PolarHBondContact O-N 3.43Å; E1072-L1074 VanDerWaalsContact C-N 3.3Å; E1072-L1074 PolarHBondContact O-N 3.03Å; L1074-A1076 VanDerWaalsContact C-N 3.35Å; L1074-A1077 PolarHBondContact O-N 3.1Å; L1074-L1078 WeakPolarHBondContact O-CB 3.42Å; L1074-L1078 VanDerWaalsContact O-CG 3.29Å; L1074-L1078 WeakPolarHBondContact O-CG 3.41Å; L1074-L1078 PolarHBondContact O-N 3.07Å
1075	D	79.4	Confident	78.3	Confident	57 Å²	57	69.8 Å²	69.8	31%	0.305	37%	0.371	S	S	.	.	H	α-helix	trans	-65.7	-38	174.2	-87.6	-40.3	0	0	0	111.3	R1036 K1040 V1071 E1072 L1078 E1079	R1036-D1075 WeakPolarHBondContact CD-OD1 3.32Å; R1036-D1075 WeakPolarHBondContact CD-OD2 3.49Å; R1036-D1075 IonicContact CZ-OD1 3.07Å; R1036-D1075 IonicContact NE-OD1 3.81Å; R1036-D1075 IonicContact NH1-OD1 3.92Å; R1036-D1075 PolarHBondContact NH1-OD1 3.44Å; K1040-D1075 WeakPolarHBondContact CE-OD2 3.27Å; K1040-D1075 IonicContact NZ-OD1 3.7Å; K1040-D1075 IonicContact NZ-OD2 3.5Å; K1040-D1075 PolarHBondContact NZ-OD2 2.9Å; V1071-D1075 PolarHBondContact O-N 3.45Å; E1072-D1075 PolarHBondContact O-N 3.19Å; D1075-L1078 WeakPolarHBondContact O-CB 3.34Å; D1075-L1078 PolarHBondContact O-N 3.47Å; D1075-E1079 PolarHBondContact O-N 3.29Å
1076	A	78.4	Confident	77.6	Confident	57 Å²	57	69.7 Å²	69.7	47%	0.471	37%	0.369	S	S	.	.	H	α-helix	trans	-63.7	-40.6	171.7	0	0	0	0	0	112.7	E1072 L1074 L1078 E1079 F1080	E1072-A1076 WeakPolarHBondContact O-CB 3.49Å; E1072-A1076 PolarHBondContact O-N 3.45Å; L1074-A1076 VanDerWaalsContact C-N 3.35Å; A1076-L1078 VanDerWaalsContact C-N 3.35Å; A1076-E1079 PolarHBondContact O-N 3.42Å; A1076-F1080 PolarHBondContact O-N 3.38Å
1077	A	75.8	Confident	76.5	Confident	38 Å²	38	70.4 Å²	70.4	31%	0.314	37%	0.372	S	S	.	.	H	α-helix	trans	-65.8	-36.2	174.9	0	0	0	0	0	112.5	A1073 L1074 K1081	A1073-A1077 WeakPolarHBondContact O-CB 3.43Å; A1073-A1077 PolarHBondContact O-N 3.33Å; L1074-A1077 PolarHBondContact O-N 3.1Å; A1077-K1081 VanDerWaalsContact O-CG 3.26Å; A1077-K1081 WeakPolarHBondContact O-CG 3.36Å; A1077-K1081 PolarHBondContact O-N 3Å
1078	L	80.1	Confident	75.2	Confident	6 Å²	6	77.6 Å²	77.6	3%	0.031	40%	0.397	C	S	.	.	H	α-helix	trans	-66.3	-43.5	172.9	-76.1	168	0	0	0	111.6	V1029 L1032 E1033 L1074 D1075 A1076 K1081 N1082	V1029-L1078 HydrophobicContact CG1-CD2 3.67Å; L1032-L1078 HydrophobicContact CB-CD2 3.62Å; L1032-L1078 HydrophobicContact CB-CG 4.06Å; L1032-L1078 HydrophobicContact CD1-CD2 4.39Å; E1033-L1078 HydrophobicContact CG-CD1 4.12Å; E1033-L1078 HydrophobicContact CG-CD2 3.81Å; L1074-L1078 WeakPolarHBondContact O-CB 3.42Å; L1074-L1078 VanDerWaalsContact O-CG 3.29Å; L1074-L1078 WeakPolarHBondContact O-CG 3.41Å; L1074-L1078 PolarHBondContact O-N 3.07Å; D1075-L1078 WeakPolarHBondContact O-CB 3.34Å; D1075-L1078 PolarHBondContact O-N 3.47Å; A1076-L1078 VanDerWaalsContact C-N 3.35Å; L1078-K1081 PolarHBondContact O-N 3.35Å; L1078-N1082 WeakPolarHBondContact O-CB 3.43Å; L1078-N1082 PolarHBondContact O-N 3.46Å; L1078-N1082 PolarHBondContact O-ND2 3.45Å
1079	E	75.9	Confident	73.8	Confident	123 Å²	123	78.5 Å²	78.5	58%	0.575	40%	0.402	S	S	*	.	H	α-helix	trans	-61.4	-46.4	175.3	-158.3	-162.1	149.7	0	0	111.2	D1075 A1076 K1081 N1082 N1083	D1075-E1079 PolarHBondContact O-N 3.29Å; A1076-E1079 PolarHBondContact O-N 3.42Å; E1079-K1081 VanDerWaalsContact C-N 3.33Å; E1079-K1081 PolarHBondContact O-N 2.92Å; E1079-N1082 PolarHBondContact O-N 3.2Å; E1079-N1083 WeakPolarHBondContact O-CB 3.41Å; E1079-N1083 PolarHBondContact O-N 3.22Å; E1079-N1083 PolarHBondContact O-ND2 3.12Å; E1079-N1083 PolarHBondContact OE1-ND2 3.46Å
1080	F	77.8	Confident	72.7	Confident	144 Å²	144	77.7 Å²	77.7	63%	0.632	40%	0.396	S	S	*	.	H	α-helix	trans	-58.3	-42.6	175.5	-179.6	-98.8	0	0	0	112.4	A1076 S1084	A1076-F1080 PolarHBondContact O-N 3.38Å; F1080-S1084 WeakPolarHBondContact O-CB 3.41Å; F1080-S1084 PolarHBondContact O-N 2.99Å
1081	K	76.3	Confident	71.1	Confident	82 Å²	82	82.9 Å²	82.9	36%	0.357	41%	0.414	S	S	.	.	H	α-helix	trans	-64.6	-43.9	175.3	-72.5	-72.8	-179	176.5	0	112.1	V1029 L1032 A1077 L1078 E1079 S1084 I1085	V1029-K1081 HydrophobicContact CG2-CB 4.15Å; L1032-K1081 HydrophobicContact CD1-CG 4.36Å; A1077-K1081 VanDerWaalsContact O-CG 3.26Å; A1077-K1081 WeakPolarHBondContact O-CG 3.36Å; A1077-K1081 PolarHBondContact O-N 3Å; L1078-K1081 PolarHBondContact O-N 3.35Å; E1079-K1081 VanDerWaalsContact C-N 3.33Å; E1079-K1081 PolarHBondContact O-N 2.92Å; K1081-S1084 PolarHBondContact O-N 3.34Å; K1081-I1085 WeakPolarHBondContact O-CB 3.32Å; K1081-I1085 VanDerWaalsContact O-CG1 3.25Å; K1081-I1085 WeakPolarHBondContact O-CG1 3.43Å; K1081-I1085 PolarHBondContact O-N 3.39Å
1082	N	73.6	Confident	69.3	Low	72 Å²	72	89.5 Å²	89.5	39%	0.385	45%	0.448	S	S	.	.	H	α-helix	trans	-66.1	-41.1	179.2	-75	-27.2	0	0	0	111.8	L1078 E1079 I1085 Q1086	L1078-N1082 WeakPolarHBondContact O-CB 3.43Å; L1078-N1082 PolarHBondContact O-N 3.46Å; L1078-N1082 PolarHBondContact O-ND2 3.45Å; E1079-N1082 PolarHBondContact O-N 3.2Å; N1082-I1085 PolarHBondContact O-N 3.07Å; N1082-Q1086 PolarHBondContact O-N 3.38Å
1083	N	70.2	Confident	67.5	Low	67 Å²	67	91.5 Å²	91.5	36%	0.358	46%	0.455	S	S	.	.	H	α-helix	trans	-63	-45.7	173.2	-74.8	-30.4	0	0	0	111.3	E1079 I1085 Q1086 E1087	E1079-N1083 WeakPolarHBondContact O-CB 3.41Å; E1079-N1083 PolarHBondContact O-N 3.22Å; E1079-N1083 PolarHBondContact O-ND2 3.12Å; E1079-N1083 PolarHBondContact OE1-ND2 3.46Å; N1083-I1085 VanDerWaalsContact C-N 3.3Å; N1083-I1085 PolarHBondContact O-N 2.9Å; N1083-Q1086 WeakPolarHBondContact O-CB 3.39Å; N1083-Q1086 PolarHBondContact O-N 3.18Å; N1083-Q1086 VanDerWaalsContact O-N 3.14Å; N1083-E1087 WeakPolarHBondContact O-CG 3.49Å; N1083-E1087 PolarHBondContact O-N 3.38Å
1084	S	67	Low	66	Low	29 Å²	29	94.8 Å²	94.8	20%	0.203	46%	0.463	C	S	.	.	H	α-helix	trans	-65	-30.2	176.3	-165.1	0	0	0	0	113.3	F1080 K1081 R1088	F1080-S1084 WeakPolarHBondContact O-CB 3.41Å; F1080-S1084 PolarHBondContact O-N 2.99Å; K1081-S1084 PolarHBondContact O-N 3.34Å; S1084-R1088 WeakPolarHBondContact O-CD 3.37Å; S1084-R1088 VanDerWaalsContact O-CG 3.25Å; S1084-R1088 WeakPolarHBondContact O-CG 3.5Å; S1084-R1088 PolarHBondContact O-N 2.97Å; S1084-R1088 VanDerWaalsContact O-N 3.13Å
1085	I	65.1	Low	63.8	Low	71 Å²	71	96.7 Å²	96.7	36%	0.364	49%	0.488	S	S	.	.	H	α-helix	trans	-69.4	-45.8	170.8	-71.4	163.9	0	0	0	110.6	V1029 K1081 N1082 N1083 E1087 R1088 Q1089	V1029-I1085 HydrophobicContact CG2-CD1 3.84Å; K1081-I1085 WeakPolarHBondContact O-CB 3.32Å; K1081-I1085 VanDerWaalsContact O-CG1 3.25Å; K1081-I1085 WeakPolarHBondContact O-CG1 3.43Å; K1081-I1085 PolarHBondContact O-N 3.39Å; N1082-I1085 PolarHBondContact O-N 3.07Å; N1083-I1085 VanDerWaalsContact C-N 3.3Å; N1083-I1085 PolarHBondContact O-N 2.9Å; I1085-E1087 VanDerWaalsContact C-N 3.32Å; I1085-E1087 PolarHBondContact O-N 2.92Å; I1085-R1088 PolarHBondContact O-N 3.34Å; I1085-Q1089 WeakPolarHBondContact O-CG 3.46Å; I1085-Q1089 PolarHBondContact O-N 3.39Å
1086	Q	62.9	Low	61.6	Low	88 Å²	88	101.4 Å²	101.4	41%	0.411	51%	0.513	S	S	.	.	H	α-helix	trans	-60.6	-39.1	175	-75.7	-164.9	19.6	0	0	112.5	N1082 N1083 Q1089 K1090	N1082-Q1086 PolarHBondContact O-N 3.38Å; N1083-Q1086 WeakPolarHBondContact O-CB 3.39Å; N1083-Q1086 PolarHBondContact O-N 3.18Å; N1083-Q1086 VanDerWaalsContact O-N 3.14Å; Q1086-Q1089 PolarHBondContact O-N 3.28Å; Q1086-K1090 WeakPolarHBondContact O-CB 3.29Å; Q1086-K1090 WeakPolarHBondContact O-CD 3.36Å; Q1086-K1090 WeakPolarHBondContact O-CG 3.48Å; Q1086-K1090 PolarHBondContact O-N 3.45Å
1087	E	58.5	Low	59.2	Low	117 Å²	117	104.4 Å²	104.4	55%	0.547	53%	0.531	S	S	.	.	H	α-helix	trans	-64.7	-44.5	176.8	-74.2	178.2	151.6	0	0	111.4	N1083 I1085 Q1089 K1090 H1091	N1083-E1087 WeakPolarHBondContact O-CG 3.49Å; N1083-E1087 PolarHBondContact O-N 3.38Å; I1085-E1087 VanDerWaalsContact C-N 3.32Å; I1085-E1087 PolarHBondContact O-N 2.92Å; E1087-Q1089 VanDerWaalsContact C-N 3.31Å; E1087-Q1089 PolarHBondContact O-N 3.01Å; E1087-K1090 PolarHBondContact O-N 3.16Å; E1087-H1091 PolarHBondContact O-CD2 3.41Å; E1087-H1091 PolarHBondContact O-N 3.06Å
1088	R	59	Low	57.6	Low	177 Å²	177	107.9 Å²	107.9	67%	0.668	55%	0.55	S	S	*	*	H	α-helix	trans	-61.5	-39.1	173.9	-70.1	168.8	-170.5	-147.9	-2.4	112.1	S1084 I1085 H1091 L1092	S1084-R1088 WeakPolarHBondContact O-CD 3.37Å; S1084-R1088 VanDerWaalsContact O-CG 3.25Å; S1084-R1088 WeakPolarHBondContact O-CG 3.5Å; S1084-R1088 PolarHBondContact O-N 2.97Å; S1084-R1088 VanDerWaalsContact O-N 3.13Å; I1085-R1088 PolarHBondContact O-N 3.34Å; R1088-H1091 PolarHBondContact O-N 3.26Å; R1088-L1092 WeakPolarHBondContact O-CG 3.49Å; R1088-L1092 PolarHBondContact O-N 3.24Å
1089	Q	53.3	Low	55.3	Low	110 Å²	110	115.2 Å²	115.2	51%	0.514	59%	0.589	S	S	.	*	H	α-helix	trans	-65.1	-41.7	173.5	-72.8	171.6	-19.2	0	0	112.1	I1085 Q1086 E1087 L1092 F1093	I1085-Q1089 WeakPolarHBondContact O-CG 3.46Å; I1085-Q1089 PolarHBondContact O-N 3.39Å; Q1086-Q1089 PolarHBondContact O-N 3.28Å; E1087-Q1089 VanDerWaalsContact C-N 3.31Å; E1087-Q1089 PolarHBondContact O-N 3.01Å; Q1089-L1092 PolarHBondContact O-N 2.92Å; Q1089-F1093 PolarHBondContact O-N 3.16Å
1090	K	56.3	Low	53.3	Low	108 Å²	108	116.5 Å²	116.5	47%	0.47	60%	0.599	S	S	.	*	H	α-helix	trans	-64.2	-41.3	175	-70.7	158.3	-166.7	162.5	0	111.7	Q1086 E1087 L1092 F1093 I1094	Q1086-K1090 WeakPolarHBondContact O-CB 3.29Å; Q1086-K1090 WeakPolarHBondContact O-CD 3.36Å; Q1086-K1090 WeakPolarHBondContact O-CG 3.48Å; Q1086-K1090 PolarHBondContact O-N 3.45Å; E1087-K1090 PolarHBondContact O-N 3.16Å; K1090-L1092 PolarHBondContact O-N 3.44Å; K1090-F1093 PolarHBondContact O-N 2.96Å; K1090-F1093 VanDerWaalsContact O-N 3.13Å; K1090-I1094 WeakPolarHBondContact O-CD1 3.34Å; K1090-I1094 WeakPolarHBondContact O-CG1 3.38Å; K1090-I1094 PolarHBondContact O-N 2.91Å
1091	H	49.1	Very low	51.4	Low	146 Å²	146	117.2 Å²	117.2	68%	0.676	60%	0.604	S	S	*	*	H	α-helix	trans	-61.9	-39.7	173.9	-89.4	-81.4	0	0	0	112.8	E1087 R1088 F1093 I1094 G1095	E1087-H1091 PolarHBondContact O-CD2 3.41Å; E1087-H1091 PolarHBondContact O-N 3.06Å; R1088-H1091 PolarHBondContact O-N 3.26Å; H1091-F1093 PolarHBondContact O-N 2.89Å; H1091-I1094 PolarHBondContact O-N 3Å; H1091-G1095 PolarHBondContact O-N 2.92Å
1092	L	47.2	Very low	49.3	Very low	149 Å²	149	119.2 Å²	119.2	78%	0.78	63%	0.628	S	S	*	*	H	α-helix	trans	-64.8	-21	174.9	-73.8	166.7	0	0	0	113.6	R1088 Q1089 K1090	R1088-L1092 WeakPolarHBondContact O-CG 3.49Å; R1088-L1092 PolarHBondContact O-N 3.24Å; Q1089-L1092 PolarHBondContact O-N 2.92Å; K1090-L1092 PolarHBondContact O-N 3.44Å
1093	F	47.3	Very low	47.7	Very low	191 Å²	191	123.9 Å²	123.9	84%	0.838	65%	0.645	S	S	*	*	H	α-helix	trans	-89.7	-11.1	175.3	-96.3	-83	0	0	0	114.7	Q1089 K1090 H1091	Q1089-F1093 PolarHBondContact O-N 3.16Å; K1090-F1093 PolarHBondContact O-N 2.96Å; K1090-F1093 VanDerWaalsContact O-N 3.13Å; H1091-F1093 PolarHBondContact O-N 2.89Å
1094	I	48.7	Very low	45.9	Very low	133 Å²	133	128.7 Å²	128.7	68%	0.682	67%	0.671	S	S	*	*	H	α-helix	trans	-110.6	-18.3	-171.3	-67.8	169.6	0	0	0	112.6	K1090 H1091 N1096	K1090-I1094 WeakPolarHBondContact O-CD1 3.34Å; K1090-I1094 WeakPolarHBondContact O-CG1 3.38Å; K1090-I1094 PolarHBondContact O-N 2.91Å; H1091-I1094 PolarHBondContact O-N 3Å; I1094-N1096 PolarHBondContact O-N 2.96Å
1095	G	37.3	Very low	44.6	Very low	65 Å²	65	133.9 Å²	133.9	67%	0.67	70%	0.702	S	S	*	*			trans	-74.1	75.8	-177.3	0	0	0	0	0	114.9	H1091	H1091-G1095 PolarHBondContact O-N 2.92Å
1096	N	33.5	Very low	43.2	Very low	156 Å²	156	138 Å²	138	83%	0.834	72%	0.72	S	S	*	*	S	Bend	trans	-156.1	43.6	168.6	-117.4	-12.3	0	0	0	116.4	I1094	I1094-N1096 PolarHBondContact O-N 2.96Å
1097	S	28.5	Very low	42.2	Very low	120 Å²	120	138.7 Å²	138.7	84%	0.839	73%	0.731	S	S	*	*			trans	-164.4	146.2	153.6	-83.6	0	0	0	0	111.4
1098	P	42.2	Very low	41.6	Very low	111 Å²	111	136.8 Å²	136.8	72%	0.721	74%	0.736	S	S	*	*			trans	-108.7	154	-171.1	39.7	-33.7	0	0	0	115.7
1099	L	31	Very low	41.1	Very low	160 Å²	160	136.6 Å²	136.6	84%	0.838	74%	0.742	S	S	*	*			trans	70.2	151.2	162.5	-60.2	157.3	0	0	0	116.3
1100	L	35	Very low	40.4	Very low	151 Å²	151	139 Å²	139	79%	0.791	75%	0.753	S	S	*	*			cis	-137.2	159.2	7.9	-146.1	140.5	0	0	0	111.3
1101	E	37.8	Very low	39.9	Very low	159 Å²	159	135.8 Å²	135.8	74%	0.743	74%	0.744	S	S	*	*			trans	-77.1	149.8	-173.5	-59.1	176.4	102.6	0	0	115.3
1102	S	30.8	Very low	40	Very low	123 Å²	123	131.4 Å²	131.4	86%	0.86	73%	0.726	S	S	*	*			trans	-142.8	153.5	133.8	60.9	0	0	0	0	109.6
1103	K	41.9	Very low	40.4	Very low	170 Å²	170	128.7 Å²	128.7	74%	0.739	72%	0.715	S	S	*	*			trans	-104.6	134.7	-174	-64.5	170.4	-178.1	169.1	0	110.4
1104	D	32.5	Very low	40.8	Very low	168 Å²	168	123.4 Å²	123.4	90%	0.898	70%	0.698	S	S	*	*			trans	-148.2	147.9	144.1	-98	-44.6	0	0	0	109.5
1105	T	39.5	Very low	41.4	Very low	139 Å²	139	123.1 Å²	123.1	85%	0.853	69%	0.689	S	S	*	*			trans	-121.3	87.6	-165.8	-50.5	0	0	0	0	111.5
1106	E	35.4	Very low	42.3	Very low	158 Å²	158	126.2 Å²	126.2	74%	0.738	68%	0.684	S	S	*	*			trans	-93.1	150.7	171	-75.6	-158.7	147.4	0	0	112.8	A1108	E1106-A1108 PolarHBondContact O-N 2.97Å
1107	P	42.3	Very low	43.5	Very low	102 Å²	102	123.1 Å²	123.1	66%	0.662	67%	0.667	S	S	*	*			trans	-68.8	116.2	-179.5	27.4	-34.3	0	0	0	112.1	Q1109	P1107-Q1109 PolarHBondContact O-N 3.28Å
1108	A	45.2	Very low	45.3	Very low	77 Å²	77	126.5 Å²	126.5	64%	0.636	67%	0.666	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.9	-6.3	-163.4	0	0	0	0	0	117.9	E1106	E1106-A1108 PolarHBondContact O-N 2.97Å
1109	Q	48.8	Very low	46.7	Very low	172 Å²	172	129.4 Å²	129.4	80%	0.804	67%	0.667	S	S	*	*	H	α-helix	trans	-73.6	-40.7	-175	-67.7	-177.6	-9.8	0	0	113.3	P1107 C1111 D1112	P1107-Q1109 PolarHBondContact O-N 3.28Å; Q1109-C1111 PolarHBondContact O-N 2.95Å; Q1109-D1112 PolarHBondContact O-N 2.95Å
1110	H	37.7	Very low	48.6	Very low	160 Å²	160	124.9 Å²	124.9	74%	0.741	64%	0.644	S	S	*	*	H	α-helix	trans	-69.7	-32.2	-179.9	-81.3	-84.5	0	0	0	113.1	D1112 T1114	H1110-D1112 PolarHBondContact O-N 3.5Å; H1110-T1114 PolarHBondContact O-OG1 3.44Å; H1110-T1114 VanDerWaalsContact O-OG1 3.13Å
1111	C	46.5	Very low	50.8	Low	42 Å²	42	120.1 Å²	120.1	28%	0.284	62%	0.623	S	S	.	*	H	α-helix	trans	-61.8	-31.1	178.6	-54.9	0	0	0	0	112.5	Q1109 T1114 R1115	Q1109-C1111 PolarHBondContact O-N 2.95Å; C1111-T1114 WeakPolarHBondContact CA-OG1 3.39Å; C1111-T1114 PolarHBondContact O-OG1 2.83Å; C1111-R1115 WeakPolarHBondContact O-CB 3.42Å; C1111-R1115 PolarHBondContact O-N 2.81Å
1112	D	50.8	Low	52.5	Low	54 Å²	54	119 Å²	119	29%	0.289	62%	0.622	S	S	.	*	H	α-helix	trans	-80.1	-32.7	-171.6	-157.1	56.8	0	0	0	113.4	Q1109 H1110 R1115 K1116	Q1109-D1112 PolarHBondContact O-N 2.95Å; H1110-D1112 PolarHBondContact O-N 3.5Å; D1112-R1115 PolarHBondContact O-N 3.21Å; D1112-R1115 IonicContact OD1-CZ 3.56Å; D1112-R1115 IonicContact OD1-NH1 3.28Å; D1112-R1115 PolarHBondContact OD1-NH1 3.11Å; D1112-K1116 WeakPolarHBondContact O-CB 3.43Å; D1112-K1116 WeakPolarHBondContact O-CD 3.27Å; D1112-K1116 VanDerWaalsContact O-CG 3.32Å; D1112-K1116 WeakPolarHBondContact O-CG 3.33Å; D1112-K1116 PolarHBondContact O-N 3.28Å; D1112-K1116 WeakPolarHBondContact OD2-CE 3.4Å; D1112-K1116 IonicContact OD2-NZ 2.72Å; D1112-K1116 PolarHBondContact OD2-NZ 2.97Å
1113	V	55.3	Low	54.7	Low	92 Å²	92	117.5 Å²	117.5	56%	0.558	61%	0.609	S	S	*	*	H	α-helix	trans	-65.5	-45.9	171.3	-178.8	0	0	0	0	110.4	R1115 K1116 L1117	V1113-R1115 VanDerWaalsContact C-N 3.33Å; V1113-R1115 PolarHBondContact O-N 3.37Å; V1113-K1116 PolarHBondContact O-N 3.04Å; V1113-L1117 HydrophobicContact CG1-CD1 4.07Å; V1113-L1117 HydrophobicContact CG1-CG 4.47Å; V1113-L1117 WeakPolarHBondContact O-CB 3.45Å; V1113-L1117 WeakPolarHBondContact O-CG 3.47Å; V1113-L1117 PolarHBondContact O-N 3.33Å
1114	T	56.4	Low	56.4	Low	79 Å²	79	114 Å²	114	49%	0.485	60%	0.595	S	S	.	*	H	α-helix	trans	-65.6	-34.3	175.8	45	0	0	0	0	112.7	H1110 C1111 K1118	H1110-T1114 PolarHBondContact O-OG1 3.44Å; H1110-T1114 VanDerWaalsContact O-OG1 3.13Å; C1111-T1114 WeakPolarHBondContact CA-OG1 3.39Å; C1111-T1114 PolarHBondContact O-OG1 2.83Å; T1114-K1118 WeakPolarHBondContact O-CB 3.41Å; T1114-K1118 WeakPolarHBondContact O-CG 3.37Å; T1114-K1118 PolarHBondContact O-N 2.99Å
1115	R	60.3	Low	58.5	Low	128 Å²	128	107.4 Å²	107.4	48%	0.483	56%	0.564	S	S	.	*	H	α-helix	trans	-70.1	-28.7	173.7	-172.9	-171.5	-61.6	127	-3.6	113.3	C1111 D1112 V1113	C1111-R1115 WeakPolarHBondContact O-CB 3.42Å; C1111-R1115 PolarHBondContact O-N 2.81Å; D1112-R1115 PolarHBondContact O-N 3.21Å; D1112-R1115 IonicContact OD1-CZ 3.56Å; D1112-R1115 IonicContact OD1-NH1 3.28Å; D1112-R1115 PolarHBondContact OD1-NH1 3.11Å; V1113-R1115 VanDerWaalsContact C-N 3.33Å; V1113-R1115 PolarHBondContact O-N 3.37Å
1116	K	58.2	Low	60.4	Low	129 Å²	129	104.8 Å²	104.8	56%	0.561	54%	0.544	S	S	*	.	H	α-helix	trans	-78.2	-43.5	171.9	-77	163.1	172.2	159	0	111.6	D1112 V1113 K1118 K1119	D1112-K1116 WeakPolarHBondContact O-CB 3.43Å; D1112-K1116 WeakPolarHBondContact O-CD 3.27Å; D1112-K1116 VanDerWaalsContact O-CG 3.32Å; D1112-K1116 WeakPolarHBondContact O-CG 3.33Å; D1112-K1116 PolarHBondContact O-N 3.28Å; D1112-K1116 WeakPolarHBondContact OD2-CE 3.4Å; D1112-K1116 IonicContact OD2-NZ 2.72Å; D1112-K1116 PolarHBondContact OD2-NZ 2.97Å; V1113-K1116 PolarHBondContact O-N 3.04Å; K1116-K1118 VanDerWaalsContact C-N 3.32Å; K1116-K1118 PolarHBondContact O-N 3.44Å; K1116-K1119 WeakPolarHBondContact O-CB 3.46Å; K1116-K1119 PolarHBondContact O-N 3.28Å
1117	L	58.4	Low	62.7	Low	91 Å²	91	102.4 Å²	102.4	48%	0.476	53%	0.532	S	S	.	.	H	α-helix	trans	-59	-40.3	174.2	-72.6	168.5	0	0	0	112.2	V1113 K1119 L1120 L1128	V1113-L1117 HydrophobicContact CG1-CD1 4.07Å; V1113-L1117 HydrophobicContact CG1-CG 4.47Å; V1113-L1117 WeakPolarHBondContact O-CB 3.45Å; V1113-L1117 WeakPolarHBondContact O-CG 3.47Å; V1113-L1117 PolarHBondContact O-N 3.33Å; L1117-K1119 PolarHBondContact O-N 2.99Å; L1117-L1120 HydrophobicContact CD2-CD1 4.2Å; L1117-L1120 PolarHBondContact O-N 3.13Å; L1117-L1128 HydrophobicContact CD2-CD2 4.38Å
1118	K	66.1	Low	64.6	Low	191 Å²	191	101.8 Å²	101.8	83%	0.83	52%	0.523	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.3	0.9	173.7	-78.4	-176.6	175.6	-176.2	0	115.4	T1114 K1116	T1114-K1118 WeakPolarHBondContact O-CB 3.41Å; T1114-K1118 WeakPolarHBondContact O-CG 3.37Å; T1114-K1118 PolarHBondContact O-N 2.99Å; K1116-K1118 VanDerWaalsContact C-N 3.32Å; K1116-K1118 PolarHBondContact O-N 3.44Å
1119	K	70.8	Confident	66.2	Low	172 Å²	172	103.7 Å²	103.7	75%	0.748	52%	0.522	S	S	*	.	T	Hydrogen-bonded Turn	trans	-113.5	-7.8	177.1	-68.3	-179.9	178.5	-173.8	0	114.4	K1116 L1117	K1116-K1119 WeakPolarHBondContact O-CB 3.46Å; K1116-K1119 PolarHBondContact O-N 3.28Å; L1117-K1119 PolarHBondContact O-N 2.99Å
1120	L	72.1	Confident	67.9	Low	65 Å²	65	99.9 Å²	99.9	34%	0.34	51%	0.506	S	S	.	.	S	Bend	trans	-79.6	143.8	175.8	-65.7	171.1	0	0	0	109.9	L1117 E1124 A1125 L1128	L1117-L1120 HydrophobicContact CD2-CD1 4.2Å; L1117-L1120 PolarHBondContact O-N 3.13Å; L1120-E1124 HydrophobicContact CB-CB 4.38Å; L1120-E1124 HydrophobicContact CD2-CB 4.28Å; L1120-A1125 HydrophobicContact CB-CB 4.34Å; L1120-L1128 HydrophobicContact CD1-CD2 3.69Å
1121	S	80	Confident	70.1	Confident	52 Å²	52	97.9 Å²	97.9	36%	0.364	50%	0.496	S	S	.	.			trans	-70.9	158.2	167.4	69.9	0	0	0	0	110.8	E1124 A1125	S1121-E1124 VanDerWaalsContact CB-OE2 3.24Å; S1121-E1124 WeakPolarHBondContact CB-OE2 3.44Å; S1121-E1124 PolarHBondContact N-OE2 3.34Å; S1121-E1124 PolarHBondContact O-N 3.13Å; S1121-E1124 VanDerWaalsContact O-N 3.14Å; S1121-E1124 VanDerWaalsContact OG-CD 3.24Å; S1121-E1124 WeakPolarHBondContact OG-CG 3.38Å; S1121-E1124 PolarHBondContact OG-OE2 3.17Å; S1121-A1125 PolarHBondContact O-N 2.99Å
1122	L	73.4	Confident	71.9	Confident	136 Å²	136	103.6 Å²	103.6	71%	0.712	51%	0.512	S	S	*	.	H	α-helix	trans	-50.4	-46.8	179.6	-174.6	61.9	0	0	0	114.2	A1125 I1126	L1122-A1125 PolarHBondContact O-N 3.45Å; L1122-I1126 HydrophobicContact CD1-CD1 4.18Å; L1122-I1126 HydrophobicContact CG-CD1 4.07Å; L1122-I1126 WeakPolarHBondContact O-CD1 3.45Å; L1122-I1126 VanDerWaalsContact O-CG1 3.29Å; L1122-I1126 WeakPolarHBondContact O-CG1 3.33Å; L1122-I1126 PolarHBondContact O-N 3.1Å; L1122-I1126 VanDerWaalsContact O-N 3.09Å
1123	P	77.3	Confident	73.6	Confident	90 Å²	90	107.6 Å²	107.6	58%	0.584	53%	0.527	S	S	*	.	H	α-helix	trans	-66.6	-38.6	177.2	25.5	-34.5	0	0	0	113.4	A1125 I1126 E1127	P1123-A1125 VanDerWaalsContact C-N 3.35Å; P1123-I1126 PolarHBondContact O-N 3.14Å; P1123-E1127 PolarHBondContact O-N 3.41Å
1124	E	78.3	Confident	75	Confident	98 Å²	98	107.4 Å²	107.4	46%	0.458	52%	0.523	S	S	.	.	H	α-helix	trans	-65.7	-39.1	177.5	-65.8	166.7	126.1	0	0	111.5	L1120 S1121 E1127 L1128	L1120-E1124 HydrophobicContact CB-CB 4.38Å; L1120-E1124 HydrophobicContact CD2-CB 4.28Å; S1121-E1124 VanDerWaalsContact CB-OE2 3.24Å; S1121-E1124 WeakPolarHBondContact CB-OE2 3.44Å; S1121-E1124 PolarHBondContact N-OE2 3.34Å; S1121-E1124 PolarHBondContact O-N 3.13Å; S1121-E1124 VanDerWaalsContact O-N 3.14Å; S1121-E1124 VanDerWaalsContact OG-CD 3.24Å; S1121-E1124 WeakPolarHBondContact OG-CG 3.38Å; S1121-E1124 PolarHBondContact OG-OE2 3.17Å; E1124-E1127 PolarHBondContact O-N 3.08Å; E1124-L1128 VanDerWaalsContact O-CB 3.29Å; E1124-L1128 WeakPolarHBondContact O-CB 3.44Å; E1124-L1128 PolarHBondContact O-N 2.98Å
1125	A	77	Confident	76.5	Confident	28 Å²	28	109.9 Å²	109.9	23%	0.231	53%	0.527	C	S	.	.	H	α-helix	trans	-64.2	-39.8	175	0	0	0	0	0	112	L1120 S1121 L1122 P1123 L1129	L1120-A1125 HydrophobicContact CB-CB 4.34Å; S1121-A1125 PolarHBondContact O-N 2.99Å; L1122-A1125 PolarHBondContact O-N 3.45Å; P1123-A1125 VanDerWaalsContact C-N 3.35Å; A1125-L1129 WeakPolarHBondContact O-CB 3.34Å; A1125-L1129 WeakPolarHBondContact O-CG 3.48Å; A1125-L1129 PolarHBondContact O-N 3.35Å
1126	I	77.8	Confident	77.6	Confident	85 Å²	85	106 Å²	106	44%	0.436	52%	0.517	S	S	.	.	H	α-helix	trans	-65.7	-45.7	174.7	-69.9	165.2	0	0	0	110.9	L1122 P1123 L1128 L1129 I1130	L1122-I1126 HydrophobicContact CD1-CD1 4.18Å; L1122-I1126 HydrophobicContact CG-CD1 4.07Å; L1122-I1126 WeakPolarHBondContact O-CD1 3.45Å; L1122-I1126 VanDerWaalsContact O-CG1 3.29Å; L1122-I1126 WeakPolarHBondContact O-CG1 3.33Å; L1122-I1126 PolarHBondContact O-N 3.1Å; L1122-I1126 VanDerWaalsContact O-N 3.09Å; P1123-I1126 PolarHBondContact O-N 3.14Å; I1126-L1128 VanDerWaalsContact C-N 3.34Å; I1126-L1128 PolarHBondContact O-N 3.2Å; I1126-L1129 PolarHBondContact O-N 2.9Å; I1126-I1130 HydrophobicContact CG2-CD1 3.81Å; I1126-I1130 WeakPolarHBondContact O-CG1 3.46Å; I1126-I1130 PolarHBondContact O-N 3.15Å
1127	E	85.1	Confident	79	Confident	107 Å²	107	102.4 Å²	102.4	50%	0.5	51%	0.506	S	S	.	.	H	α-helix	trans	-64.1	-39.5	178.3	-160.9	-166.8	167.6	0	0	111.8	P1123 E1124 I1130 K1131	P1123-E1127 PolarHBondContact O-N 3.41Å; E1124-E1127 PolarHBondContact O-N 3.08Å; E1127-I1130 PolarHBondContact O-N 3.1Å; E1127-K1131 HydrophobicContact CG-CD 4.45Å; E1127-K1131 WeakPolarHBondContact O-CB 3.48Å; E1127-K1131 WeakPolarHBondContact O-CG 3.27Å; E1127-K1131 PolarHBondContact O-N 3.3Å; E1127-K1131 WeakPolarHBondContact OE1-CE 3.33Å; E1127-K1131 IonicContact OE1-NZ 3.16Å; E1127-K1131 PolarHBondContact OE1-NZ 3.41Å; E1127-K1131 IonicContact OE2-NZ 3.53Å
1128	L	82.5	Confident	80.3	Confident	90 Å²	90	101.4 Å²	101.4	47%	0.471	51%	0.506	S	S	.	.	H	α-helix	trans	-64.7	-41.6	174.9	-172.6	66.3	0	0	0	111.8	L1117 L1120 E1124 I1126 K1131 Y1132	L1117-L1128 HydrophobicContact CD2-CD2 4.38Å; L1120-L1128 HydrophobicContact CD1-CD2 3.69Å; E1124-L1128 VanDerWaalsContact O-CB 3.29Å; E1124-L1128 WeakPolarHBondContact O-CB 3.44Å; E1124-L1128 PolarHBondContact O-N 2.98Å; I1126-L1128 VanDerWaalsContact C-N 3.34Å; I1126-L1128 PolarHBondContact O-N 3.2Å; L1128-K1131 PolarHBondContact O-N 3.33Å; L1128-Y1132 VanDerWaalsContact O-CB 3.32Å; L1128-Y1132 WeakPolarHBondContact O-CB 3.44Å; L1128-Y1132 PolarHBondContact O-N 3.25Å
1129	L	78	Confident	81	Confident	117 Å²	117	96.8 Å²	96.8	61%	0.613	49%	0.49	S	S	*	.	H	α-helix	trans	-62.3	-43.2	174.1	-86.3	163.1	0	0	0	112.1	A1125 I1126 Y1132 F1133	A1125-L1129 WeakPolarHBondContact O-CB 3.34Å; A1125-L1129 WeakPolarHBondContact O-CG 3.48Å; A1125-L1129 PolarHBondContact O-N 3.35Å; I1126-L1129 PolarHBondContact O-N 2.9Å; L1129-Y1132 PolarHBondContact O-N 2.86Å; L1129-F1133 VanDerWaalsContact O-CB 3.3Å; L1129-F1133 WeakPolarHBondContact O-CB 3.49Å; L1129-F1133 PolarHBondContact O-N 2.93Å
1130	I	84.8	Confident	81.4	Confident	91 Å²	91	96.9 Å²	96.9	47%	0.467	49%	0.486	S	S	.	.	H	α-helix	trans	-64.2	-45.2	176.6	-68.7	165.5	0	0	0	110.7	I1126 E1127 Y1132 F1133 N1134	I1126-I1130 HydrophobicContact CG2-CD1 3.81Å; I1126-I1130 WeakPolarHBondContact O-CG1 3.46Å; I1126-I1130 PolarHBondContact O-N 3.15Å; E1127-I1130 PolarHBondContact O-N 3.1Å; I1130-Y1132 VanDerWaalsContact C-N 3.35Å; I1130-Y1132 PolarHBondContact O-N 2.98Å; I1130-F1133 PolarHBondContact O-N 2.69Å; I1130-N1134 WeakPolarHBondContact O-CB 3.41Å; I1130-N1134 VanDerWaalsContact O-CG 3.26Å; I1130-N1134 PolarHBondContact O-N 3.35Å; I1130-N1134 PolarHBondContact O-ND2 2.94Å
1131	K	84.1	Confident	82.1	Confident	119 Å²	119	98.6 Å²	98.6	52%	0.517	49%	0.492	S	S	.	.	H	α-helix	trans	-61.6	-41.6	175.6	-74.3	171.2	-176.5	167.6	0	111.9	E1127 L1128 K1135	E1127-K1131 HydrophobicContact CG-CD 4.45Å; E1127-K1131 WeakPolarHBondContact O-CB 3.48Å; E1127-K1131 WeakPolarHBondContact O-CG 3.27Å; E1127-K1131 PolarHBondContact O-N 3.3Å; E1127-K1131 WeakPolarHBondContact OE1-CE 3.33Å; E1127-K1131 IonicContact OE1-NZ 3.16Å; E1127-K1131 PolarHBondContact OE1-NZ 3.41Å; E1127-K1131 IonicContact OE2-NZ 3.53Å; L1128-K1131 PolarHBondContact O-N 3.33Å; K1131-K1135 VanDerWaalsContact O-CB 3.31Å; K1131-K1135 WeakPolarHBondContact O-CB 3.25Å; K1131-K1135 PolarHBondContact O-N 3Å
1132	Y	83.9	Confident	82.1	Confident	161 Å²	161	98 Å²	98	63%	0.631	49%	0.49	S	S	*	.	H	α-helix	trans	-66	-47.4	176.5	-175.9	-97.4	0	0	0	111.9	L1128 L1129 I1130 N1134 K1135 V1136	L1128-Y1132 VanDerWaalsContact O-CB 3.32Å; L1128-Y1132 WeakPolarHBondContact O-CB 3.44Å; L1128-Y1132 PolarHBondContact O-N 3.25Å; L1129-Y1132 PolarHBondContact O-N 2.86Å; I1130-Y1132 VanDerWaalsContact C-N 3.35Å; I1130-Y1132 PolarHBondContact O-N 2.98Å; Y1132-N1134 PolarHBondContact O-N 3.2Å; Y1132-K1135 PolarHBondContact O-N 2.99Å; Y1132-V1136 HydrophobicContact CD1-CG2 4.11Å; Y1132-V1136 HydrophobicContact CE1-CG2 3.7Å; Y1132-V1136 HydrophobicContact CE2-CG2 4.37Å; Y1132-V1136 WeakPolarHBondContact O-CG2 3.4Å; Y1132-V1136 PolarHBondContact O-N 3.37Å
1133	F	85.9	Confident	82.4	Confident	139 Å²	139	97.7 Å²	97.7	61%	0.61	49%	0.485	S	S	*	.	H	α-helix	trans	-58.7	-50.2	177.8	-172.3	-92.9	0	0	0	111.2	L1129 I1130 K1135 V1136 V1137	L1129-F1133 VanDerWaalsContact O-CB 3.3Å; L1129-F1133 WeakPolarHBondContact O-CB 3.49Å; L1129-F1133 PolarHBondContact O-N 2.93Å; I1130-F1133 PolarHBondContact O-N 2.69Å; F1133-K1135 VanDerWaalsContact C-N 3.3Å; F1133-K1135 PolarHBondContact O-N 2.8Å; F1133-V1136 PolarHBondContact O-N 2.89Å; F1133-V1136 VanDerWaalsContact O-N 3.13Å; F1133-V1137 HydrophobicContact CD1-CG2 4Å; F1133-V1137 HydrophobicContact CE1-CG2 3.74Å; F1133-V1137 HydrophobicContact CZ-CG2 4.24Å; F1133-V1137 WeakPolarHBondContact O-CG2 3.43Å; F1133-V1137 PolarHBondContact O-N 3.39Å
1134	N	85.3	Confident	82.7	Confident	88 Å²	88	102.4 Å²	102.4	47%	0.471	49%	0.492	S	S	.	.	H	α-helix	trans	-59.9	-39.6	176	-70.4	-15.8	0	0	0	111.9	I1130 Y1132 V1137 C1138	I1130-N1134 WeakPolarHBondContact O-CB 3.41Å; I1130-N1134 VanDerWaalsContact O-CG 3.26Å; I1130-N1134 PolarHBondContact O-N 3.35Å; I1130-N1134 PolarHBondContact O-ND2 2.94Å; Y1132-N1134 PolarHBondContact O-N 3.2Å; N1134-V1137 PolarHBondContact O-N 3.4Å; N1134-C1138 WeakPolarHBondContact O-CB 3.38Å; N1134-C1138 PolarHBondContact O-N 3.39Å; N1134-C1138 PolarHBondContact O-SG 3.48Å
1135	K	86.9	Confident	83	Confident	130 Å²	130	104.8 Å²	104.8	57%	0.565	50%	0.496	S	S	*	.	H	α-helix	trans	-64.8	-40.1	175.5	-175.2	60	174.7	-178.6	0	112.1	K1131 Y1132 F1133 L1139	K1131-K1135 VanDerWaalsContact O-CB 3.31Å; K1131-K1135 WeakPolarHBondContact O-CB 3.25Å; K1131-K1135 PolarHBondContact O-N 3Å; Y1132-K1135 PolarHBondContact O-N 2.99Å; F1133-K1135 VanDerWaalsContact C-N 3.3Å; F1133-K1135 PolarHBondContact O-N 2.8Å; K1135-L1139 HydrophobicContact CD-CD1 4.37Å; K1135-L1139 HydrophobicContact CD-CG 4.41Å; K1135-L1139 HydrophobicContact CG-CD1 4.1Å; K1135-L1139 WeakPolarHBondContact O-CB 3.33Å; K1135-L1139 WeakPolarHBondContact O-CG 3.29Å; K1135-L1139 PolarHBondContact O-N 2.95Å
1136	V	84.2	Confident	83.2	Confident	46 Å²	46	108.6 Å²	108.6	28%	0.279	51%	0.512	S	S	.	.	H	α-helix	trans	-66.7	-41.1	175.7	170.7	0	0	0	0	111.5	Y1132 F1133 L1139 R1140	Y1132-V1136 HydrophobicContact CD1-CG2 4.11Å; Y1132-V1136 HydrophobicContact CE1-CG2 3.7Å; Y1132-V1136 HydrophobicContact CE2-CG2 4.37Å; Y1132-V1136 WeakPolarHBondContact O-CG2 3.4Å; Y1132-V1136 PolarHBondContact O-N 3.37Å; F1133-V1136 PolarHBondContact O-N 2.89Å; F1133-V1136 VanDerWaalsContact O-N 3.13Å; V1136-L1139 PolarHBondContact O-N 3.01Å; V1136-R1140 PolarHBondContact O-N 3.14Å
1137	V	87.7	Confident	83.2	Confident	54 Å²	54	110 Å²	110	33%	0.327	52%	0.517	S	S	.	.	H	α-helix	trans	-60.9	-53.5	173.8	175.1	0	0	0	0	110.6	F1133 N1134 L1139 R1140 E1141	F1133-V1137 HydrophobicContact CD1-CG2 4Å; F1133-V1137 HydrophobicContact CE1-CG2 3.74Å; F1133-V1137 HydrophobicContact CZ-CG2 4.24Å; F1133-V1137 WeakPolarHBondContact O-CG2 3.43Å; F1133-V1137 PolarHBondContact O-N 3.39Å; N1134-V1137 PolarHBondContact O-N 3.4Å; V1137-L1139 VanDerWaalsContact C-N 3.26Å; V1137-L1139 PolarHBondContact O-N 3.03Å; V1137-R1140 PolarHBondContact O-N 3.47Å; V1137-R1140 VanDerWaalsContact O-N 3.11Å; V1137-E1141 HydrophobicContact CG1-CG 4.46Å; V1137-E1141 WeakPolarHBondContact O-CG 3.44Å; V1137-E1141 PolarHBondContact O-N 3.37Å
1138	C	84.4	Confident	83	Confident	71 Å²	71	109.6 Å²	109.6	48%	0.48	52%	0.517	S	S	.	.	H	α-helix	trans	-59.9	-34.1	178.5	-68.3	0	0	0	0	113.2	N1134 A1142	N1134-C1138 WeakPolarHBondContact O-CB 3.38Å; N1134-C1138 PolarHBondContact O-N 3.39Å; N1134-C1138 PolarHBondContact O-SG 3.48Å; C1138-A1142 WeakPolarHBondContact O-CB 3.5Å; C1138-A1142 PolarHBondContact O-N 2.92Å
1139	L	81.4	Confident	82.9	Confident	94 Å²	94	110.7 Å²	110.7	49%	0.492	52%	0.52	S	S	.	.	H	α-helix	trans	-68.5	-43.6	174.6	-76.6	169.8	0	0	0	111.8	K1135 V1136 V1137 E1141 A1142 E1143	K1135-L1139 HydrophobicContact CD-CD1 4.37Å; K1135-L1139 HydrophobicContact CD-CG 4.41Å; K1135-L1139 HydrophobicContact CG-CD1 4.1Å; K1135-L1139 WeakPolarHBondContact O-CB 3.33Å; K1135-L1139 WeakPolarHBondContact O-CG 3.29Å; K1135-L1139 PolarHBondContact O-N 2.95Å; V1136-L1139 PolarHBondContact O-N 3.01Å; V1137-L1139 VanDerWaalsContact C-N 3.26Å; V1137-L1139 PolarHBondContact O-N 3.03Å; L1139-E1141 VanDerWaalsContact C-N 3.33Å; L1139-E1141 PolarHBondContact O-N 3.49Å; L1139-A1142 PolarHBondContact O-N 3.15Å; L1139-E1143 WeakPolarHBondContact O-CB 3.33Å; L1139-E1143 PolarHBondContact O-N 3.31Å
1140	R	80.1	Confident	82.4	Confident	174 Å²	174	108.1 Å²	108.1	66%	0.657	51%	0.511	S	S	*	.	H	α-helix	trans	-65.8	-33.6	174.9	-75.9	-177.4	169.7	-169	-2.9	112.9	V1136 V1137 R1144	V1136-R1140 PolarHBondContact O-N 3.14Å; V1137-R1140 PolarHBondContact O-N 3.47Å; V1137-R1140 VanDerWaalsContact O-N 3.11Å; R1140-R1144 VanDerWaalsContact O-CB 3.28Å; R1140-R1144 WeakPolarHBondContact O-CB 3.35Å; R1140-R1144 PolarHBondContact O-N 3.49Å
1141	E	85.8	Confident	82	Confident	100 Å²	100	108.1 Å²	108.1	47%	0.467	51%	0.509	S	S	.	.	H	α-helix	trans	-69.8	-30.7	172	-71.7	-177.3	172.9	0	0	113.3	V1137 L1139 R1145	V1137-E1141 HydrophobicContact CG1-CG 4.46Å; V1137-E1141 WeakPolarHBondContact O-CG 3.44Å; V1137-E1141 PolarHBondContact O-N 3.37Å; L1139-E1141 VanDerWaalsContact C-N 3.33Å; L1139-E1141 PolarHBondContact O-N 3.49Å; E1141-R1145 WeakPolarHBondContact O-CB 3.43Å; E1141-R1145 WeakPolarHBondContact O-CG 3.41Å; E1141-R1145 PolarHBondContact O-N 3.03Å; E1141-R1145 PolarHBondContact O-NE 3.11Å; E1141-R1145 IonicContact OE2-NH2 3.96Å
1142	A	80.9	Confident	81.9	Confident	40 Å²	40	108 Å²	108	33%	0.331	51%	0.51	S	S	.	.	H	α-helix	trans	-75.2	-45	174.1	0	0	0	0	0	111.1	C1138 L1139 R1144 R1145 L1146	C1138-A1142 WeakPolarHBondContact O-CB 3.5Å; C1138-A1142 PolarHBondContact O-N 2.92Å; L1139-A1142 PolarHBondContact O-N 3.15Å; A1142-R1144 PolarHBondContact O-N 3.41Å; A1142-R1145 PolarHBondContact O-N 3Å; A1142-L1146 PolarHBondContact O-N 3.1Å
1143	E	78.9	Confident	81.7	Confident	129 Å²	129	106.2 Å²	106.2	60%	0.603	51%	0.511	S	S	*	.	H	α-helix	trans	-54.4	-49.7	172.3	179	177.9	-145.7	0	0	111.3	L1139 R1145 L1146 H1147	L1139-E1143 WeakPolarHBondContact O-CB 3.33Å; L1139-E1143 PolarHBondContact O-N 3.31Å; E1143-R1145 VanDerWaalsContact C-N 3.34Å; E1143-R1145 PolarHBondContact O-N 3.15Å; E1143-L1146 PolarHBondContact O-N 3.02Å; E1143-H1147 WeakPolarHBondContact O-CB 3.43Å; E1143-H1147 PolarHBondContact O-N 3.42Å
1144	R	82.6	Confident	81.1	Confident	190 Å²	190	105.9 Å²	105.9	72%	0.717	51%	0.512	S	S	*	.	H	α-helix	trans	-64	-35	177.7	-169.3	176.7	-175.7	-166.7	1.2	113.2	R1140 A1142 L1148	R1140-R1144 VanDerWaalsContact O-CB 3.28Å; R1140-R1144 WeakPolarHBondContact O-CB 3.35Å; R1140-R1144 PolarHBondContact O-N 3.49Å; A1142-R1144 PolarHBondContact O-N 3.41Å; R1144-L1148 WeakPolarHBondContact O-CG 2.95Å; R1144-L1148 PolarHBondContact O-N 3.02Å
1145	R	86.4	Confident	80.9	Confident	148 Å²	148	107.6 Å²	107.6	56%	0.558	52%	0.52	S	S	*	.	H	α-helix	trans	-68.2	-43.2	174.4	-85.2	177.1	-81.9	-175	-12.7	112	E1141 A1142 E1143 H1147 L1148 Q1149	E1141-R1145 WeakPolarHBondContact O-CB 3.43Å; E1141-R1145 WeakPolarHBondContact O-CG 3.41Å; E1141-R1145 PolarHBondContact O-N 3.03Å; E1141-R1145 PolarHBondContact O-NE 3.11Å; E1141-R1145 IonicContact OE2-NH2 3.96Å; A1142-R1145 PolarHBondContact O-N 3Å; E1143-R1145 VanDerWaalsContact C-N 3.34Å; E1143-R1145 PolarHBondContact O-N 3.15Å; R1145-H1147 VanDerWaalsContact C-N 3.32Å; R1145-H1147 PolarHBondContact O-N 3.34Å; R1145-L1148 PolarHBondContact O-N 2.87Å; R1145-Q1149 WeakPolarHBondContact O-CG 3.48Å; R1145-Q1149 PolarHBondContact O-N 3.15Å; R1145-Q1149 VanDerWaalsContact O-N 3.12Å
1146	L	80.2	Confident	80.5	Confident	107 Å²	107	105.8 Å²	105.8	56%	0.56	51%	0.513	S	S	*	.	H	α-helix	trans	-62.8	-38.8	174.2	-80	160	0	0	0	111.6	A1142 E1143 Q1149 C1150	A1142-L1146 PolarHBondContact O-N 3.1Å; E1143-L1146 PolarHBondContact O-N 3.02Å; L1146-Q1149 PolarHBondContact O-N 3.13Å; L1146-C1150 PolarHBondContact O-N 2.98Å; L1146-C1150 PolarHBondContact O-SG 2.77Å
1147	H	77.3	Confident	79.8	Confident	116 Å²	116	106 Å²	106	54%	0.537	52%	0.52	S	S	.	.	H	α-helix	trans	-62.5	-48.3	177.5	-158.8	56	0	0	0	112.1	E1143 R1145 Q1149 C1150 E1151	E1143-H1147 WeakPolarHBondContact O-CB 3.43Å; E1143-H1147 PolarHBondContact O-N 3.42Å; R1145-H1147 VanDerWaalsContact C-N 3.32Å; R1145-H1147 PolarHBondContact O-N 3.34Å; H1147-Q1149 VanDerWaalsContact C-N 3.28Å; H1147-Q1149 PolarHBondContact O-N 3.3Å; H1147-C1150 WeakPolarHBondContact O-CA 3.34Å; H1147-C1150 WeakPolarHBondContact O-CB 3.25Å; H1147-C1150 PolarHBondContact O-N 2.96Å; H1147-E1151 PolarHBondContact O-N 3.09Å
1148	L	82.4	Confident	79.1	Confident	98 Å²	98	105.1 Å²	105.1	51%	0.513	52%	0.522	S	S	.	.	H	α-helix	trans	-59	-37.7	175.1	-70.9	164.2	0	0	0	112.4	R1144 R1145 C1150 E1151 E1152	R1144-L1148 WeakPolarHBondContact O-CG 2.95Å; R1144-L1148 PolarHBondContact O-N 3.02Å; R1145-L1148 PolarHBondContact O-N 2.87Å; L1148-C1150 VanDerWaalsContact C-N 3.35Å; L1148-E1151 PolarHBondContact O-N 3.15Å; L1148-E1152 WeakPolarHBondContact O-CB 3.47Å; L1148-E1152 PolarHBondContact O-N 2.9Å
1149	Q	79.9	Confident	79	Confident	112 Å²	112	108.1 Å²	108.1	52%	0.523	53%	0.529	S	S	.	.	H	α-helix	trans	-68.4	-31.6	174.8	-73.3	-179.9	-34.1	0	0	112.8	R1145 L1146 H1147 L1153	R1145-Q1149 WeakPolarHBondContact O-CG 3.48Å; R1145-Q1149 PolarHBondContact O-N 3.15Å; R1145-Q1149 VanDerWaalsContact O-N 3.12Å; L1146-Q1149 PolarHBondContact O-N 3.13Å; H1147-Q1149 VanDerWaalsContact C-N 3.28Å; H1147-Q1149 PolarHBondContact O-N 3.3Å; Q1149-L1153 WeakPolarHBondContact O-CB 3.38Å; Q1149-L1153 WeakPolarHBondContact O-CD1 3.46Å; Q1149-L1153 VanDerWaalsContact O-CG 3.23Å; Q1149-L1153 WeakPolarHBondContact O-CG 3.4Å; Q1149-L1153 PolarHBondContact O-N 2.86Å; Q1149-L1153 VanDerWaalsContact O-N 3.16Å
1150	C	67.2	Low	78.7	Confident	63 Å²	63	109.8 Å²	109.8	43%	0.426	53%	0.534	S	S	.	.	H	α-helix	trans	-68.9	-46.5	171.3	-66.6	0	0	0	0	111.4	L1146 H1147 L1148 E1152 L1153 E1154	L1146-C1150 PolarHBondContact O-N 2.98Å; L1146-C1150 PolarHBondContact O-SG 2.77Å; H1147-C1150 WeakPolarHBondContact O-CA 3.34Å; H1147-C1150 WeakPolarHBondContact O-CB 3.25Å; H1147-C1150 PolarHBondContact O-N 2.96Å; L1148-C1150 VanDerWaalsContact C-N 3.35Å; C1150-E1152 VanDerWaalsContact C-N 3.33Å; C1150-E1152 PolarHBondContact O-N 3.3Å; C1150-L1153 PolarHBondContact O-N 3.13Å; C1150-E1154 WeakPolarHBondContact O-CB 3.49Å; C1150-E1154 WeakPolarHBondContact O-CG 3.33Å; C1150-E1154 PolarHBondContact O-N 2.94Å
1151	E	76.7	Confident	78.1	Confident	92 Å²	92	106.7 Å²	106.7	43%	0.43	53%	0.527	S	S	.	.	H	α-helix	trans	-58.5	-42.6	176.7	-67.6	176.7	144.1	0	0	111.9	H1147 L1148 E1154 L1155	H1147-E1151 PolarHBondContact O-N 3.09Å; L1148-E1151 PolarHBondContact O-N 3.15Å; E1151-E1154 PolarHBondContact O-N 3.12Å; E1151-L1155 PolarHBondContact O-N 3.22Å
1152	E	81.4	Confident	77.4	Confident	115 Å²	115	104.5 Å²	104.5	54%	0.537	53%	0.527	S	S	.	.	H	α-helix	trans	-62.9	-42.7	175.6	-176.8	174.8	-159	0	0	112.2	L1148 C1150 H1156	L1148-E1152 WeakPolarHBondContact O-CB 3.47Å; L1148-E1152 PolarHBondContact O-N 2.9Å; C1150-E1152 VanDerWaalsContact C-N 3.33Å; C1150-E1152 PolarHBondContact O-N 3.3Å; E1152-H1156 PolarHBondContact O-N 3.1Å; E1152-H1156 VanDerWaalsContact O-N 3.13Å; E1152-H1156 PolarHBondContact O-ND1 2.91Å
1153	L	79.6	Confident	77.3	Confident	125 Å²	125	105.5 Å²	105.5	65%	0.654	53%	0.534	S	S	*	.	H	α-helix	trans	-69.7	-34.4	177.5	-73.3	170.1	0	0	0	112.7	Q1149 C1150 H1156 A1157	Q1149-L1153 WeakPolarHBondContact O-CB 3.38Å; Q1149-L1153 WeakPolarHBondContact O-CD1 3.46Å; Q1149-L1153 VanDerWaalsContact O-CG 3.23Å; Q1149-L1153 WeakPolarHBondContact O-CG 3.4Å; Q1149-L1153 PolarHBondContact O-N 2.86Å; Q1149-L1153 VanDerWaalsContact O-N 3.16Å; C1150-L1153 PolarHBondContact O-N 3.13Å; L1153-H1156 PolarHBondContact O-N 3Å; L1153-A1157 WeakPolarHBondContact O-CB 3.27Å; L1153-A1157 PolarHBondContact O-N 2.78Å
1154	E	73.3	Confident	76.9	Confident	132 Å²	132	104.7 Å²	104.7	62%	0.617	53%	0.534	S	S	*	.	H	α-helix	trans	-68.7	-38.7	175.6	-75.2	-179.7	-173.5	0	0	111.9	C1150 E1151 A1157 G1158	C1150-E1154 WeakPolarHBondContact O-CB 3.49Å; C1150-E1154 WeakPolarHBondContact O-CG 3.33Å; C1150-E1154 PolarHBondContact O-N 2.94Å; E1151-E1154 PolarHBondContact O-N 3.12Å; E1154-A1157 PolarHBondContact O-N 3Å; E1154-G1158 PolarHBondContact O-N 3.4Å
1155	L	80.6	Confident	76.4	Confident	124 Å²	124	102.7 Å²	102.7	65%	0.649	53%	0.526	S	S	*	.	H	α-helix	trans	-60.5	-50.5	170.8	-78.4	169.1	0	0	0	111.7	E1151 A1157 G1158 E1159	E1151-L1155 PolarHBondContact O-N 3.22Å; L1155-A1157 VanDerWaalsContact C-N 3.26Å; L1155-A1157 PolarHBondContact O-N 3.44Å; L1155-G1158 PolarHBondContact O-N 2.79Å; L1155-G1158 VanDerWaalsContact O-N 3.09Å; L1155-E1159 PolarHBondContact O-N 2.63Å
1156	H	79.4	Confident	75.9	Confident	91 Å²	91	102.5 Å²	102.5	42%	0.421	53%	0.532	S	S	.	.	H	α-helix	trans	-59.9	-34.3	177	-77.5	89.8	0	0	0	112.8	E1152 L1153 Q1160	E1152-H1156 PolarHBondContact O-N 3.1Å; E1152-H1156 VanDerWaalsContact O-N 3.13Å; E1152-H1156 PolarHBondContact O-ND1 2.91Å; L1153-H1156 PolarHBondContact O-N 3Å; H1156-Q1160 VanDerWaalsContact O-CG 3.31Å; H1156-Q1160 WeakPolarHBondContact O-CG 3.48Å; H1156-Q1160 PolarHBondContact O-N 3.45Å; H1156-Q1160 VanDerWaalsContact O-N 3.17Å
1157	A	69.4	Low	75.5	Confident	51 Å²	51	103.1 Å²	103.1	42%	0.421	53%	0.533	S	S	.	.	H	α-helix	trans	-67.9	-43.7	173.8	0	0	0	0	0	111.8	L1153 E1154 L1155 E1159 Q1160 E1161	L1153-A1157 WeakPolarHBondContact O-CB 3.27Å; L1153-A1157 PolarHBondContact O-N 2.78Å; E1154-A1157 PolarHBondContact O-N 3Å; L1155-A1157 VanDerWaalsContact C-N 3.26Å; L1155-A1157 PolarHBondContact O-N 3.44Å; A1157-E1159 PolarHBondContact O-N 3Å; A1157-Q1160 PolarHBondContact O-N 3.02Å; A1157-E1161 PolarHBondContact O-N 3.36Å
1158	G	73.5	Confident	75.2	Confident	36 Å²	36	103.2 Å²	103.2	37%	0.371	53%	0.534	S	S	.	.	H	α-helix	trans	-60.4	-42.6	176.2	0	0	0	0	0	113.2	E1154 L1155 E1161 A1162	E1154-G1158 PolarHBondContact O-N 3.4Å; L1155-G1158 PolarHBondContact O-N 2.79Å; L1155-G1158 VanDerWaalsContact O-N 3.09Å; G1158-E1161 PolarHBondContact O-N 3.26Å; G1158-A1162 PolarHBondContact O-N 3.12Å
1159	E	81.3	Confident	74.5	Confident	134 Å²	134	100 Å²	100	63%	0.626	52%	0.522	S	S	*	.	H	α-helix	trans	-62.2	-43	174.1	-70.6	-174.6	167.2	0	0	112.1	L1155 A1157 A1162 A1163	L1155-E1159 PolarHBondContact O-N 2.63Å; A1157-E1159 PolarHBondContact O-N 3Å; E1159-A1162 WeakPolarHBondContact O-CB 3.22Å; E1159-A1162 PolarHBondContact O-N 3.17Å; E1159-A1163 PolarHBondContact O-N 2.98Å
1160	Q	75.1	Confident	74.3	Confident	129 Å²	129	96.3 Å²	96.3	60%	0.603	51%	0.51	S	S	*	.	H	α-helix	trans	-64.4	-39.6	176.1	-73.3	176.4	35.5	0	0	112.3	H1156 A1157 A1162 A1163 L1164	H1156-Q1160 VanDerWaalsContact O-CG 3.31Å; H1156-Q1160 WeakPolarHBondContact O-CG 3.48Å; H1156-Q1160 PolarHBondContact O-N 3.45Å; H1156-Q1160 VanDerWaalsContact O-N 3.17Å; A1157-Q1160 PolarHBondContact O-N 3.02Å; Q1160-A1162 VanDerWaalsContact C-N 3.34Å; Q1160-A1163 PolarHBondContact O-N 2.84Å; Q1160-L1164 WeakPolarHBondContact O-CB 3.32Å; Q1160-L1164 VanDerWaalsContact O-CG 3.26Å; Q1160-L1164 WeakPolarHBondContact O-CG 3.38Å; Q1160-L1164 PolarHBondContact O-N 2.9Å
1161	E	68.9	Low	74.6	Confident	108 Å²	108	98.8 Å²	98.8	51%	0.505	52%	0.517	S	S	.	.	H	α-helix	trans	-67.7	-31.9	173.3	-67.1	-163.2	165	0	0	113.2	A1157 G1158 R1165	A1157-E1161 PolarHBondContact O-N 3.36Å; G1158-E1161 PolarHBondContact O-N 3.26Å; E1161-R1165 WeakPolarHBondContact O-CB 3.39Å; E1161-R1165 WeakPolarHBondContact O-CG 3.34Å; E1161-R1165 PolarHBondContact O-N 3.22Å; E1161-R1165 VanDerWaalsContact O-N 3.08Å; E1161-R1165 PolarHBondContact O-NE 3.43Å; E1161-R1165 VanDerWaalsContact O-NE 3.09Å; E1161-R1165 IonicContact OE2-CZ 3.06Å; E1161-R1165 IonicContact OE2-NH1 3.7Å; E1161-R1165 IonicContact OE2-NH2 2.67Å; E1161-R1165 PolarHBondContact OE2-NH2 3.01Å
1162	A	71.4	Confident	74.3	Confident	55 Å²	55	99.8 Å²	99.8	46%	0.455	52%	0.521	S	S	.	.	H	α-helix	trans	-66.3	-48.6	174.5	0	0	0	0	0	110.8	G1158 E1159 Q1160 L1164 R1165 E1166	G1158-A1162 PolarHBondContact O-N 3.12Å; E1159-A1162 WeakPolarHBondContact O-CB 3.22Å; E1159-A1162 PolarHBondContact O-N 3.17Å; Q1160-A1162 VanDerWaalsContact C-N 3.34Å; A1162-L1164 VanDerWaalsContact C-N 3.34Å; A1162-L1164 PolarHBondContact O-N 3.03Å; A1162-R1165 PolarHBondContact O-N 2.92Å; A1162-E1166 PolarHBondContact O-N 3.19Å
1163	A	77.2	Confident	74	Confident	60 Å²	60	102.3 Å²	102.3	50%	0.496	53%	0.526	S	S	.	.	H	α-helix	trans	-61	-39.4	176.4	0	0	0	0	0	112.6	E1159 Q1160 E1166 M1167	E1159-A1163 PolarHBondContact O-N 2.98Å; Q1160-A1163 PolarHBondContact O-N 2.84Å; A1163-E1166 PolarHBondContact O-N 3.37Å; A1163-M1167 WeakPolarHBondContact O-CB 3.29Å; A1163-M1167 PolarHBondContact O-N 2.93Å
1164	L	71.3	Confident	73.9	Confident	112 Å²	112	103.4 Å²	103.4	59%	0.586	53%	0.526	S	S	*	.	H	α-helix	trans	-63.7	-41.9	174.5	-76.4	169.6	0	0	0	112.3	Q1160 A1162 M1167 E1168	Q1160-L1164 WeakPolarHBondContact O-CB 3.32Å; Q1160-L1164 VanDerWaalsContact O-CG 3.26Å; Q1160-L1164 WeakPolarHBondContact O-CG 3.38Å; Q1160-L1164 PolarHBondContact O-N 2.9Å; A1162-L1164 VanDerWaalsContact C-N 3.34Å; A1162-L1164 PolarHBondContact O-N 3.03Å; L1164-M1167 PolarHBondContact O-N 3.18Å; L1164-E1168 WeakPolarHBondContact O-CB 3.47Å; L1164-E1168 PolarHBondContact O-N 2.98Å
1165	R	72.7	Confident	74	Confident	148 Å²	148	100 Å²	100	56%	0.558	52%	0.52	S	S	*	.	H	α-helix	trans	-65.3	-41.1	176.6	-79.9	178	-84.7	-134.6	-2.6	112.3	E1161 A1162 E1168 A1169	E1161-R1165 WeakPolarHBondContact O-CB 3.39Å; E1161-R1165 WeakPolarHBondContact O-CG 3.34Å; E1161-R1165 PolarHBondContact O-N 3.22Å; E1161-R1165 VanDerWaalsContact O-N 3.08Å; E1161-R1165 PolarHBondContact O-NE 3.43Å; E1161-R1165 VanDerWaalsContact O-NE 3.09Å; E1161-R1165 IonicContact OE2-CZ 3.06Å; E1161-R1165 IonicContact OE2-NH1 3.7Å; E1161-R1165 IonicContact OE2-NH2 2.67Å; E1161-R1165 PolarHBondContact OE2-NH2 3.01Å; A1162-R1165 PolarHBondContact O-N 2.92Å; R1165-E1168 PolarHBondContact O-N 3.31Å; R1165-A1169 WeakPolarHBondContact O-CB 3.34Å; R1165-A1169 PolarHBondContact O-N 2.96Å
1166	E	75.5	Confident	73.7	Confident	144 Å²	144	97.4 Å²	97.4	67%	0.673	51%	0.507	S	S	*	.	H	α-helix	trans	-65.6	-42.3	174.6	-174.5	171	-156.5	0	0	111.8	A1162 A1163 E1168 A1169 A1170	A1162-E1166 PolarHBondContact O-N 3.19Å; A1163-E1166 PolarHBondContact O-N 3.37Å; E1166-E1168 PolarHBondContact O-N 3.49Å; E1166-A1169 PolarHBondContact O-N 3.04Å; E1166-A1170 WeakPolarHBondContact O-CB 3.44Å; E1166-A1170 PolarHBondContact O-N 3.4Å
1167	M	71.6	Confident	73.6	Confident	120 Å²	120	96.7 Å²	96.7	59%	0.591	51%	0.506	S	S	*	.	H	α-helix	trans	-63.7	-38.8	177.2	-170.3	179.2	-174.5	0	0	112.4	A1163 L1164 A1170 M1171	A1163-M1167 WeakPolarHBondContact O-CB 3.29Å; A1163-M1167 PolarHBondContact O-N 2.93Å; L1164-M1167 PolarHBondContact O-N 3.18Å; M1167-A1170 PolarHBondContact O-N 3.22Å; M1167-M1171 WeakPolarHBondContact O-CG 3.45Å; M1167-M1171 PolarHBondContact O-N 2.78Å
1168	E	70.5	Confident	73.8	Confident	118 Å²	118	96.9 Å²	96.9	55%	0.551	51%	0.507	S	S	*	.	H	α-helix	trans	-66	-45.9	174.5	-179.4	161.8	-151.4	0	0	111.8	L1164 R1165 E1166 A1170 M1171 Q1172	L1164-E1168 WeakPolarHBondContact O-CB 3.47Å; L1164-E1168 PolarHBondContact O-N 2.98Å; R1165-E1168 PolarHBondContact O-N 3.31Å; E1166-E1168 PolarHBondContact O-N 3.49Å; E1168-A1170 VanDerWaalsContact C-N 3.3Å; E1168-A1170 PolarHBondContact O-N 2.64Å; E1168-M1171 PolarHBondContact O-N 2.87Å; E1168-Q1172 WeakPolarHBondContact O-CG 3.38Å; E1168-Q1172 PolarHBondContact O-N 3.11Å
1169	A	67.8	Low	74	Confident	32 Å²	32	97.3 Å²	97.3	26%	0.264	50%	0.501	S	S	.	.	H	α-helix	trans	-61	-38	174.7	0	0	0	0	0	112.3	R1165 E1166 Q1172 R1173	R1165-A1169 WeakPolarHBondContact O-CB 3.34Å; R1165-A1169 PolarHBondContact O-N 2.96Å; E1166-A1169 PolarHBondContact O-N 3.04Å; A1169-Q1172 PolarHBondContact O-N 3.2Å; A1169-R1173 WeakPolarHBondContact O-CG 3.5Å; A1169-R1173 PolarHBondContact O-N 2.98Å; A1169-R1173 VanDerWaalsContact O-N 3.09Å
1170	A	75.9	Confident	73.8	Confident	33 Å²	33	98.6 Å²	98.6	27%	0.273	50%	0.5	S	S	.	.	H	α-helix	trans	-64	-44.8	173.5	0	0	0	0	0	111.9	E1166 M1167 E1168 Q1172 R1173 F1174	E1166-A1170 WeakPolarHBondContact O-CB 3.44Å; E1166-A1170 PolarHBondContact O-N 3.4Å; M1167-A1170 PolarHBondContact O-N 3.22Å; E1168-A1170 VanDerWaalsContact C-N 3.3Å; E1168-A1170 PolarHBondContact O-N 2.64Å; A1170-Q1172 VanDerWaalsContact C-N 3.32Å; A1170-Q1172 PolarHBondContact O-N 3.45Å; A1170-R1173 PolarHBondContact O-N 3.29Å; A1170-F1174 VanDerWaalsContact O-CD2 3.28Å; A1170-F1174 WeakPolarHBondContact O-CD2 3.43Å; A1170-F1174 PolarHBondContact O-N 3.25Å
1171	M	72.8	Confident	74	Confident	115 Å²	115	101.1 Å²	101.1	57%	0.567	50%	0.504	S	S	*	.	H	α-helix	trans	-59.7	-40.1	175.5	-77.1	-176	59.8	0	0	112.6	M1167 E1168 F1174 A1175	M1167-M1171 WeakPolarHBondContact O-CG 3.45Å; M1167-M1171 PolarHBondContact O-N 2.78Å; E1168-M1171 PolarHBondContact O-N 2.87Å; M1171-F1174 PolarHBondContact O-N 3.43Å; M1171-A1175 PolarHBondContact O-N 3Å
1172	Q	71.8	Confident	74.5	Confident	113 Å²	113	99.1 Å²	99.1	53%	0.528	50%	0.497	S	S	.	.	H	α-helix	trans	-64.5	-43.4	176.3	-68.4	173.5	10.3	0	0	111.9	E1168 A1169 A1170 A1175 L1176	E1168-Q1172 WeakPolarHBondContact O-CG 3.38Å; E1168-Q1172 PolarHBondContact O-N 3.11Å; A1169-Q1172 PolarHBondContact O-N 3.2Å; A1170-Q1172 VanDerWaalsContact C-N 3.32Å; A1170-Q1172 PolarHBondContact O-N 3.45Å; Q1172-A1175 PolarHBondContact O-N 3.35Å; Q1172-L1176 WeakPolarHBondContact O-CG 3.01Å; Q1172-L1176 PolarHBondContact O-N 3.25Å; Q1172-L1176 VanDerWaalsContact O-N 3.1Å
1173	R	74.4	Confident	74.8	Confident	169 Å²	169	97.3 Å²	97.3	64%	0.638	48%	0.48	S	S	*	.	H	α-helix	trans	-59.8	-47	174.3	-68.7	169.2	-171.5	162.2	4.3	111.9	A1169 A1170 A1175 L1176 D1177	A1169-R1173 WeakPolarHBondContact O-CG 3.5Å; A1169-R1173 PolarHBondContact O-N 2.98Å; A1169-R1173 VanDerWaalsContact O-N 3.09Å; A1170-R1173 PolarHBondContact O-N 3.29Å; R1173-A1175 VanDerWaalsContact C-N 3.3Å; R1173-A1175 PolarHBondContact O-N 2.82Å; R1173-L1176 PolarHBondContact O-N 3Å; R1173-D1177 PolarHBondContact O-N 3.49Å
1174	F	78	Confident	75	Confident	148 Å²	148	99.2 Å²	99.2	65%	0.649	48%	0.482	S	S	*	.	H	α-helix	trans	-60.6	-35.8	176.8	-86.3	-67.4	0	0	0	113.1	A1170 M1171 A1178	A1170-F1174 VanDerWaalsContact O-CD2 3.28Å; A1170-F1174 WeakPolarHBondContact O-CD2 3.43Å; A1170-F1174 PolarHBondContact O-N 3.25Å; M1171-F1174 PolarHBondContact O-N 3.43Å; F1174-A1178 WeakPolarHBondContact O-CB 3.25Å; F1174-A1178 PolarHBondContact O-N 3.31Å; F1174-A1178 VanDerWaalsContact O-N 3.09Å
1175	A	73.9	Confident	75.4	Confident	61 Å²	61	99.8 Å²	99.8	50%	0.504	48%	0.481	S	S	.	.	H	α-helix	trans	-66.9	-44.3	175.6	0	0	0	0	0	112.2	M1171 Q1172 R1173 A1178 D1179	M1171-A1175 PolarHBondContact O-N 3Å; Q1172-A1175 PolarHBondContact O-N 3.35Å; R1173-A1175 VanDerWaalsContact C-N 3.3Å; R1173-A1175 PolarHBondContact O-N 2.82Å; A1175-A1178 PolarHBondContact O-N 3.13Å; A1175-D1179 PolarHBondContact O-N 3.46Å; A1175-D1179 VanDerWaalsContact O-N 3.09Å
1176	L	76.3	Confident	75.7	Confident	69 Å²	69	94.3 Å²	94.3	36%	0.361	46%	0.462	S	S	.	.	H	α-helix	trans	-64.1	-41	177.5	-69.8	170.4	0	0	0	112.2	Q1172 R1173 A1178 D1179 R1180 L1253	Q1172-L1176 WeakPolarHBondContact O-CG 3.01Å; Q1172-L1176 PolarHBondContact O-N 3.25Å; Q1172-L1176 VanDerWaalsContact O-N 3.1Å; R1173-L1176 PolarHBondContact O-N 3Å; L1176-A1178 VanDerWaalsContact C-N 3.34Å; L1176-D1179 PolarHBondContact O-N 3.49Å; L1176-R1180 WeakPolarHBondContact O-CB 3.27Å; L1176-R1180 PolarHBondContact O-N 2.95Å; L1176-L1253 HydrophobicContact CD2-CB 4.18Å; L1176-L1253 HydrophobicContact CD2-CD1 4.05Å
1177	D	75.4	Confident	75.9	Confident	76 Å²	76	95.2 Å²	95.2	41%	0.406	46%	0.459	S	S	.	.	H	α-helix	trans	-68	-32	175.7	-90.4	-26.3	0	0	0	112.8	R1173 R1180 R1181	R1173-D1177 PolarHBondContact O-N 3.49Å; D1177-R1180 PolarHBondContact O-N 3.04Å; D1177-R1181 WeakPolarHBondContact O-CB 3.47Å; D1177-R1181 VanDerWaalsContact O-CG 3.29Å; D1177-R1181 WeakPolarHBondContact O-CG 3.5Å; D1177-R1181 PolarHBondContact O-N 3.48Å
1178	A	75.2	Confident	76.3	Confident	54 Å²	54	95.2 Å²	95.2	45%	0.446	46%	0.458	S	S	.	.	H	α-helix	trans	-65.3	-47.8	173	0	0	0	0	0	111.8	F1174 A1175 L1176 R1180 R1181 L1182	F1174-A1178 WeakPolarHBondContact O-CB 3.25Å; F1174-A1178 PolarHBondContact O-N 3.31Å; F1174-A1178 VanDerWaalsContact O-N 3.09Å; A1175-A1178 PolarHBondContact O-N 3.13Å; L1176-A1178 VanDerWaalsContact C-N 3.34Å; A1178-R1180 VanDerWaalsContact C-N 3.29Å; A1178-R1180 PolarHBondContact O-N 3.38Å; A1178-R1181 PolarHBondContact O-N 3.12Å; A1178-L1182 WeakPolarHBondContact O-CB 3.31Å; A1178-L1182 PolarHBondContact O-N 2.93Å
1179	D	77.6	Confident	76.8	Confident	46 Å²	46	93.1 Å²	93.1	25%	0.246	45%	0.448	C	S	.	.	H	α-helix	trans	-64.6	-33.4	175.8	-92	-7.5	0	0	0	112.1	A1175 L1176 T1183 L1250	A1175-D1179 PolarHBondContact O-N 3.46Å; A1175-D1179 VanDerWaalsContact O-N 3.09Å; L1176-D1179 PolarHBondContact O-N 3.49Å; D1179-T1183 VanDerWaalsContact O-CB 3.28Å; D1179-T1183 WeakPolarHBondContact O-CB 3.49Å; D1179-T1183 PolarHBondContact O-N 3.43Å; D1179-T1183 PolarHBondContact O-OG1 3.49Å; D1179-L1250 HydrophobicContact CB-CD1 4.49Å; D1179-L1250 HydrophobicContact CB-CG 4.49Å
1180	R	77.4	Confident	77.4	Confident	161 Å²	161	92.8 Å²	92.8	61%	0.608	44%	0.441	S	S	*	.	H	α-helix	trans	-64.4	-48.4	172.6	-172.1	179.7	-176.3	-179.9	3.2	111.7	L1176 D1177 A1178 T1183 L1184	L1176-R1180 WeakPolarHBondContact O-CB 3.27Å; L1176-R1180 PolarHBondContact O-N 2.95Å; D1177-R1180 PolarHBondContact O-N 3.04Å; A1178-R1180 VanDerWaalsContact C-N 3.29Å; A1178-R1180 PolarHBondContact O-N 3.38Å; R1180-T1183 PolarHBondContact O-N 3.42Å; R1180-L1184 WeakPolarHBondContact O-CG 3.44Å; R1180-L1184 PolarHBondContact O-N 3.47Å
1181	R	79.3	Confident	77.6	Confident	181 Å²	181	94.4 Å²	94.4	68%	0.683	45%	0.45	S	S	*	.	H	α-helix	trans	-61.2	-45.7	176.3	-74	173.6	-174.7	-116.1	3.9	111.7	D1177 A1178 T1183 L1184 Q1185	D1177-R1181 WeakPolarHBondContact O-CB 3.47Å; D1177-R1181 VanDerWaalsContact O-CG 3.29Å; D1177-R1181 WeakPolarHBondContact O-CG 3.5Å; D1177-R1181 PolarHBondContact O-N 3.48Å; A1178-R1181 PolarHBondContact O-N 3.12Å; R1181-T1183 VanDerWaalsContact C-N 3.29Å; R1181-T1183 PolarHBondContact O-N 3.01Å; R1181-L1184 WeakPolarHBondContact O-CB 3.47Å; R1181-L1184 PolarHBondContact O-N 3.48Å; R1181-L1184 VanDerWaalsContact O-N 3.14Å; R1181-Q1185 PolarHBondContact O-N 3.21Å
1182	L	77.8	Confident	78	Confident	66 Å²	66	92.8 Å²	92.8	35%	0.346	44%	0.443	S	S	.	.	H	α-helix	trans	-60.1	-39.4	175.8	-174.2	69	0	0	0	111.9	A1178 L1184 Q1185 H1186 L1246	A1178-L1182 WeakPolarHBondContact O-CB 3.31Å; A1178-L1182 PolarHBondContact O-N 2.93Å; L1182-L1184 VanDerWaalsContact C-N 3.34Å; L1182-L1184 PolarHBondContact O-N 3.29Å; L1182-Q1185 PolarHBondContact O-N 3.31Å; L1182-H1186 WeakPolarHBondContact O-CB 3.44Å; L1182-H1186 PolarHBondContact O-N 3.12Å; L1182-H1186 PolarHBondContact O-ND1 2.84Å; L1182-L1246 HydrophobicContact CD2-CD1 3.96Å; L1182-L1246 HydrophobicContact CD2-CD2 4.09Å; L1182-L1246 HydrophobicContact CG-CD1 4.22Å
1183	T	78.4	Confident	78.4	Confident	17 Å²	17	87.6 Å²	87.6	10%	0.104	42%	0.42	C	S	.	.	H	α-helix	trans	-68	-31.5	177.4	-61.4	0	0	0	0	112.7	D1179 R1180 R1181 R1187 K1247	D1179-T1183 VanDerWaalsContact O-CB 3.28Å; D1179-T1183 WeakPolarHBondContact O-CB 3.49Å; D1179-T1183 PolarHBondContact O-N 3.43Å; D1179-T1183 PolarHBondContact O-OG1 3.49Å; R1180-T1183 PolarHBondContact O-N 3.42Å; R1181-T1183 VanDerWaalsContact C-N 3.29Å; R1181-T1183 PolarHBondContact O-N 3.01Å; T1183-R1187 PolarHBondContact O-N 3.41Å; T1183-K1247 HydrophobicContact CG2-CG 4.21Å
1184	L	81	Confident	78.6	Confident	101 Å²	101	85.7 Å²	85.7	53%	0.529	41%	0.412	S	S	.	.	H	α-helix	trans	-70.5	-49.9	172.6	-70.4	169.6	0	0	0	111.5	R1180 R1181 L1182 H1186 R1187 E1188	R1180-L1184 WeakPolarHBondContact O-CG 3.44Å; R1180-L1184 PolarHBondContact O-N 3.47Å; R1181-L1184 WeakPolarHBondContact O-CB 3.47Å; R1181-L1184 PolarHBondContact O-N 3.48Å; R1181-L1184 VanDerWaalsContact O-N 3.14Å; L1182-L1184 VanDerWaalsContact C-N 3.34Å; L1182-L1184 PolarHBondContact O-N 3.29Å; L1184-H1186 VanDerWaalsContact C-N 3.3Å; L1184-H1186 PolarHBondContact O-N 3.43Å; L1184-R1187 WeakPolarHBondContact O-CA 3.48Å; L1184-R1187 WeakPolarHBondContact O-CB 3.33Å; L1184-R1187 PolarHBondContact O-N 3.49Å; L1184-E1188 PolarHBondContact O-N 3.22Å
1185	Q	79.4	Confident	78.7	Confident	123 Å²	123	82.8 Å²	82.8	58%	0.575	40%	0.403	S	S	*	.	H	α-helix	trans	-57.1	-41.9	176.7	-72	178.4	-26.8	0	0	112.1	R1181 L1182 R1187 E1188 H1189	R1181-Q1185 PolarHBondContact O-N 3.21Å; L1182-Q1185 PolarHBondContact O-N 3.31Å; Q1185-R1187 VanDerWaalsContact C-N 3.3Å; Q1185-R1187 PolarHBondContact O-N 3.43Å; Q1185-E1188 PolarHBondContact O-N 3.45Å; Q1185-H1189 WeakPolarHBondContact O-CB 3.45Å; Q1185-H1189 PolarHBondContact O-N 2.9Å
1186	H	79.2	Confident	78.9	Confident	33 Å²	33	84.1 Å²	84.1	15%	0.153	40%	0.401	C	S	.	.	H	α-helix	trans	-63.5	-31	173.2	-74.9	157.2	0	0	0	113.6	L1182 L1184 Q1190 Y1239 L1246	L1182-H1186 WeakPolarHBondContact O-CB 3.44Å; L1182-H1186 PolarHBondContact O-N 3.12Å; L1182-H1186 PolarHBondContact O-ND1 2.84Å; L1184-H1186 VanDerWaalsContact C-N 3.3Å; L1184-H1186 PolarHBondContact O-N 3.43Å; H1186-Q1190 WeakPolarHBondContact O-CB 3.31Å; H1186-Q1190 PolarHBondContact O-N 3.02Å; H1186-Y1239 AromaticContact CD2-CD1 3.49Å; H1186-Y1239 VanDerWaalsContact CD2-CD1 3.49Å; H1186-Y1239 WeakPolarHBondContact CD2-CD1 3.41Å; H1186-Y1239 AromaticContact CD2-CE1 3.5Å; H1186-Y1239 VanDerWaalsContact CD2-CE1 3.5Å; H1186-Y1239 WeakPolarHBondContact CD2-CE1 3.25Å; H1186-Y1239 AromaticContact NE2-CD1 3.98Å; H1186-Y1239 AromaticContact NE2-CE1 3.75Å; H1186-L1246 WeakPolarHBondContact ND1-CD1 3.36Å
1187	R	79.3	Confident	79.1	Confident	163 Å²	163	81.4 Å²	81.4	62%	0.615	39%	0.387	S	S	*	.	H	α-helix	trans	-75	-40	176.8	-175.8	-179.1	-178.7	166.8	-0.6	111.7	T1183 L1184 Q1185 S1191	T1183-R1187 PolarHBondContact O-N 3.41Å; L1184-R1187 WeakPolarHBondContact O-CA 3.48Å; L1184-R1187 WeakPolarHBondContact O-CB 3.33Å; L1184-R1187 PolarHBondContact O-N 3.49Å; Q1185-R1187 VanDerWaalsContact C-N 3.3Å; Q1185-R1187 PolarHBondContact O-N 3.43Å; R1187-S1191 PolarHBondContact O-N 3.06Å; R1187-S1191 VanDerWaalsContact O-N 3.1Å
1188	E	81.8	Confident	79.2	Confident	121 Å²	121	84.6 Å²	84.6	57%	0.565	40%	0.4	S	S	*	.	H	α-helix	trans	-65.2	-52.2	176.3	-175.3	-175.5	175.8	0	0	111.3	L1184 Q1185 Q1190 S1191 N1192	L1184-E1188 PolarHBondContact O-N 3.22Å; Q1185-E1188 PolarHBondContact O-N 3.45Å; E1188-Q1190 VanDerWaalsContact C-N 3.26Å; E1188-Q1190 PolarHBondContact O-N 3.14Å; E1188-S1191 WeakPolarHBondContact O-CA 3.48Å; E1188-S1191 WeakPolarHBondContact O-CB 3.47Å; E1188-S1191 PolarHBondContact O-N 3.41Å; E1188-N1192 PolarHBondContact O-N 3.34Å
1189	H	79.1	Confident	79.4	Confident	73 Å²	73	88.9 Å²	88.9	34%	0.338	41%	0.408	S	S	.	.	H	α-helix	trans	-58.2	-39.2	176.1	-173.1	84.3	0	0	0	111.9	Q1185 S1191 N1192 V1193 Y1239	Q1185-H1189 WeakPolarHBondContact O-CB 3.45Å; Q1185-H1189 PolarHBondContact O-N 2.9Å; H1189-S1191 VanDerWaalsContact C-N 3.26Å; H1189-S1191 PolarHBondContact O-N 2.88Å; H1189-N1192 PolarHBondContact O-N 3.28Å; H1189-V1193 WeakPolarHBondContact O-CG2 3.34Å; H1189-V1193 PolarHBondContact O-N 2.91Å; H1189-Y1239 AromaticContact CD2-CD2 3.57Å; H1189-Y1239 AromaticContact CD2-CE2 3.37Å; H1189-Y1239 WeakPolarHBondContact CD2-CE2 3.45Å; H1189-Y1239 AromaticContact CD2-CZ 3.72Å; H1189-Y1239 AromaticContact NE2-CD2 3.91Å; H1189-Y1239 AromaticContact NE2-CE2 3.36Å; H1189-Y1239 WeakPolarHBondContact NE2-CE2 3.41Å; H1189-Y1239 AromaticContact NE2-CZ 3.86Å
1190	Q	81.5	Confident	79.3	Confident	26 Å²	26	88.9 Å²	88.9	12%	0.121	41%	0.408	C	S	.	.	H	α-helix	trans	-64.2	-26.6	172.8	-167.7	-153.5	44.4	0	0	113.4	H1186 E1188 R1194 L1236	H1186-Q1190 WeakPolarHBondContact O-CB 3.31Å; H1186-Q1190 PolarHBondContact O-N 3.02Å; E1188-Q1190 VanDerWaalsContact C-N 3.26Å; E1188-Q1190 PolarHBondContact O-N 3.14Å; Q1190-R1194 WeakPolarHBondContact O-CG 3.38Å; Q1190-R1194 PolarHBondContact O-N 3.05Å; Q1190-R1194 PolarHBondContact O-NE 3.42Å; Q1190-L1236 HydrophobicContact CG-CD1 3.55Å
1191	S	79.9	Confident	79.2	Confident	67 Å²	67	85.4 Å²	85.4	47%	0.469	40%	0.397	S	S	.	.	H	α-helix	trans	-73.8	-47.7	172.2	-156.6	0	0	0	0	110.6	R1187 E1188 H1189 V1193 R1194 L1195	R1187-S1191 PolarHBondContact O-N 3.06Å; R1187-S1191 VanDerWaalsContact O-N 3.1Å; E1188-S1191 WeakPolarHBondContact O-CA 3.48Å; E1188-S1191 WeakPolarHBondContact O-CB 3.47Å; E1188-S1191 PolarHBondContact O-N 3.41Å; H1189-S1191 VanDerWaalsContact C-N 3.26Å; H1189-S1191 PolarHBondContact O-N 2.88Å; S1191-V1193 PolarHBondContact O-N 3.02Å; S1191-R1194 WeakPolarHBondContact O-CB 3.3Å; S1191-R1194 PolarHBondContact O-N 3.47Å; S1191-L1195 PolarHBondContact O-N 3.07Å
1192	N	81.4	Confident	78.8	Confident	80 Å²	80	78.4 Å²	78.4	43%	0.428	38%	0.381	S	S	.	.	H	α-helix	trans	-63.8	-41.5	-177.6	-62.7	-8.3	0	0	0	111.5	E1188 H1189 R1194 L1195 L1196	E1188-N1192 PolarHBondContact O-N 3.34Å; H1189-N1192 PolarHBondContact O-N 3.28Å; N1192-R1194 VanDerWaalsContact C-N 3.33Å; N1192-R1194 PolarHBondContact O-N 3.15Å; N1192-L1195 PolarHBondContact O-N 3.24Å; N1192-L1196 WeakPolarHBondContact O-CG 3.43Å; N1192-L1196 PolarHBondContact O-N 3.48Å
1193	V	80.4	Confident	78.4	Confident	5 Å²	5	80.4 Å²	80.4	3%	0.03	39%	0.387	C	S	.	.	H	α-helix	trans	-63.5	-35.5	173.1	173.2	0	0	0	0	112.2	H1189 S1191 L1197 L1232 L1236	H1189-V1193 WeakPolarHBondContact O-CG2 3.34Å; H1189-V1193 PolarHBondContact O-N 2.91Å; S1191-V1193 PolarHBondContact O-N 3.02Å; V1193-L1197 HydrophobicContact CG1-CD1 4.07Å; V1193-L1197 WeakPolarHBondContact O-CB 3.28Å; V1193-L1197 WeakPolarHBondContact O-CG 3.18Å; V1193-L1197 PolarHBondContact O-N 2.95Å; V1193-L1232 HydrophobicContact CG1-CB 4.27Å; V1193-L1232 HydrophobicContact CG1-CD2 4.22Å; V1193-L1232 WeakPolarHBondContact CG1-O 3.42Å; V1193-L1236 HydrophobicContact CB-CD1 4.45Å; V1193-L1236 HydrophobicContact CG1-CB 3.92Å; V1193-L1236 HydrophobicContact CG1-CD1 4.19Å
1194	R	77.8	Confident	77.8	Confident	128 Å²	128	81.8 Å²	81.8	48%	0.483	39%	0.394	S	S	.	.	H	α-helix	trans	-66.3	-43.8	172.8	-77.7	-175.1	-119.8	-178.7	-1.7	112.1	Q1190 S1191 N1192 L1196 L1197 Q1198 L1236	Q1190-R1194 WeakPolarHBondContact O-CG 3.38Å; Q1190-R1194 PolarHBondContact O-N 3.05Å; Q1190-R1194 PolarHBondContact O-NE 3.42Å; S1191-R1194 WeakPolarHBondContact O-CB 3.3Å; S1191-R1194 PolarHBondContact O-N 3.47Å; N1192-R1194 VanDerWaalsContact C-N 3.33Å; N1192-R1194 PolarHBondContact O-N 3.15Å; R1194-L1196 VanDerWaalsContact C-N 3.33Å; R1194-L1196 PolarHBondContact O-N 3.41Å; R1194-L1197 PolarHBondContact O-N 3.42Å; R1194-Q1198 WeakPolarHBondContact O-CB 3.39Å; R1194-Q1198 PolarHBondContact O-N 3.5Å; R1194-L1236 HydrophobicContact CG-CD1 3.93Å; R1194-L1236 HydrophobicContact CG-CD2 4.09Å
1195	L	80	Confident	76.9	Confident	87 Å²	87	82.4 Å²	82.4	46%	0.455	40%	0.397	S	S	.	.	H	α-helix	trans	-63.5	-40.6	178.8	-175.2	64.2	0	0	0	111.3	S1191 N1192 Q1198 K1199	S1191-L1195 PolarHBondContact O-N 3.07Å; N1192-L1195 PolarHBondContact O-N 3.24Å; L1195-Q1198 PolarHBondContact O-N 3.49Å; L1195-K1199 WeakPolarHBondContact O-CG 3.39Å; L1195-K1199 PolarHBondContact O-N 3.47Å
1196	L	79.1	Confident	76.2	Confident	89 Å²	89	84.6 Å²	84.6	47%	0.466	40%	0.402	S	S	.	.	H	α-helix	trans	-62.9	-46	172.9	-71.4	169.2	0	0	0	112	N1192 R1194 Q1198 K1199 L1200	N1192-L1196 WeakPolarHBondContact O-CG 3.43Å; N1192-L1196 PolarHBondContact O-N 3.48Å; R1194-L1196 VanDerWaalsContact C-N 3.33Å; R1194-L1196 PolarHBondContact O-N 3.41Å; L1196-Q1198 VanDerWaalsContact C-N 3.33Å; L1196-Q1198 PolarHBondContact O-N 3Å; L1196-K1199 PolarHBondContact O-N 2.99Å; L1196-L1200 WeakPolarHBondContact O-CB 3.33Å; L1196-L1200 VanDerWaalsContact O-CG 3.32Å; L1196-L1200 WeakPolarHBondContact O-CG 3.4Å; L1196-L1200 PolarHBondContact O-N 3.43Å
1197	L	79.8	Confident	75.2	Confident	12 Å²	12	87.7 Å²	87.7	6%	0.063	41%	0.412	C	S	.	.	H	α-helix	trans	-61.1	-39.2	174.6	-79.4	166.7	0	0	0	112.5	V1193 R1194 K1201 V1229 L1232 E1233 L1236	V1193-L1197 HydrophobicContact CG1-CD1 4.07Å; V1193-L1197 WeakPolarHBondContact O-CB 3.28Å; V1193-L1197 WeakPolarHBondContact O-CG 3.18Å; V1193-L1197 PolarHBondContact O-N 2.95Å; R1194-L1197 PolarHBondContact O-N 3.42Å; L1197-K1201 WeakPolarHBondContact O-CB 3.28Å; L1197-K1201 WeakPolarHBondContact O-CG 3.37Å; L1197-K1201 PolarHBondContact O-N 3.3Å; L1197-V1229 HydrophobicContact CD2-CB 4.4Å; L1197-V1229 HydrophobicContact CD2-CG1 3.91Å; L1197-L1232 HydrophobicContact CD1-CB 4.26Å; L1197-L1232 HydrophobicContact CD2-CB 3.75Å; L1197-L1232 HydrophobicContact CD2-CD1 4.47Å; L1197-L1232 HydrophobicContact CG-CB 3.93Å; L1197-E1233 HydrophobicContact CD1-CG 4Å; L1197-E1233 HydrophobicContact CD2-CG 3.85Å; L1197-L1236 HydrophobicContact CD1-CB 4.47Å; L1197-L1236 HydrophobicContact CD1-CD2 3.85Å
1198	Q	78.1	Confident	74.2	Confident	144 Å²	144	83.9 Å²	83.9	67%	0.673	41%	0.41	S	S	*	.	H	α-helix	trans	-67	-43.2	176.4	-173.6	175.9	-2.1	0	0	111.6	R1194 L1195 L1196 G1202	R1194-Q1198 WeakPolarHBondContact O-CB 3.39Å; R1194-Q1198 PolarHBondContact O-N 3.5Å; L1195-Q1198 PolarHBondContact O-N 3.49Å; L1196-Q1198 VanDerWaalsContact C-N 3.33Å; L1196-Q1198 PolarHBondContact O-N 3Å; Q1198-G1202 PolarHBondContact O-N 2.76Å
1199	K	79.1	Confident	72.8	Confident	143 Å²	143	83.2 Å²	83.2	62%	0.622	42%	0.418	S	S	*	.	H	α-helix	trans	-62.8	-45.4	174.8	-74.1	-178.7	177.4	-173.4	0	111.8	L1195 L1196 G1202 F1203	L1195-K1199 WeakPolarHBondContact O-CG 3.39Å; L1195-K1199 PolarHBondContact O-N 3.47Å; L1196-K1199 PolarHBondContact O-N 2.99Å; K1199-G1202 PolarHBondContact O-N 3.04Å; K1199-F1203 WeakPolarHBondContact O-CB 3.29Å; K1199-F1203 PolarHBondContact O-N 3.48Å
1200	L	75.7	Confident	71.6	Confident	46 Å²	46	83.4 Å²	83.4	24%	0.241	42%	0.424	C	S	.	.	H	α-helix	trans	-66.7	-44.5	179.1	-70.8	170.4	0	0	0	112.6	L1196 F1203 L1204 V1229 L1232	L1196-L1200 WeakPolarHBondContact O-CB 3.33Å; L1196-L1200 VanDerWaalsContact O-CG 3.32Å; L1196-L1200 WeakPolarHBondContact O-CG 3.4Å; L1196-L1200 PolarHBondContact O-N 3.43Å; L1200-F1203 PolarHBondContact O-N 3.16Å; L1200-L1204 WeakPolarHBondContact O-CG 3.47Å; L1200-L1204 PolarHBondContact O-N 3.17Å; L1200-L1204 VanDerWaalsContact O-N 3.08Å; L1200-V1229 HydrophobicContact CB-CG2 3.93Å; L1200-V1229 HydrophobicContact CD1-CG2 4.19Å; L1200-L1232 HydrophobicContact CD1-CD1 3.64Å
1201	K	75.5	Confident	70	Confident	88 Å²	88	87.7 Å²	87.7	38%	0.383	46%	0.457	S	S	.	.	H	α-helix	trans	-68.5	-35.5	175.9	-69.7	-173.8	-179.5	-165.9	0	112.2	L1197 L1204 L1205 E1233	L1197-K1201 WeakPolarHBondContact O-CB 3.28Å; L1197-K1201 WeakPolarHBondContact O-CG 3.37Å; L1197-K1201 PolarHBondContact O-N 3.3Å; K1201-L1204 PolarHBondContact O-N 3.44Å; K1201-L1205 WeakPolarHBondContact O-CB 3.2Å; K1201-L1205 WeakPolarHBondContact O-CG 3.28Å; K1201-L1205 PolarHBondContact O-N 3.42Å; K1201-E1233 WeakPolarHBondContact CE-OE1 3.43Å; K1201-E1233 IonicContact NZ-OE1 3.22Å; K1201-E1233 PolarHBondContact NZ-OE1 3.16Å
1202	G	70.9	Confident	68.7	Low	34 Å²	34	87.3 Å²	87.3	35%	0.351	46%	0.463	S	S	.	.	H	α-helix	trans	-62	-41.7	171.4	0	0	0	0	0	112.6	Q1198 K1199 L1205 Y1206	Q1198-G1202 PolarHBondContact O-N 2.76Å; K1199-G1202 PolarHBondContact O-N 3.04Å; G1202-L1205 PolarHBondContact O-N 2.78Å; G1202-Y1206 VanDerWaalsContact O-CB 3.24Å; G1202-Y1206 WeakPolarHBondContact O-CB 3.49Å; G1202-Y1206 PolarHBondContact O-N 2.76Å
1203	F	68.6	Low	67.1	Low	108 Å²	108	93.8 Å²	93.8	47%	0.474	48%	0.483	S	S	.	.	H	α-helix	trans	-63.3	-42.3	175.7	-172.5	-101.3	0	0	0	112.3	K1199 L1200 R1207	K1199-F1203 WeakPolarHBondContact O-CB 3.29Å; K1199-F1203 PolarHBondContact O-N 3.48Å; L1200-F1203 PolarHBondContact O-N 3.16Å; F1203-R1207 WeakPolarHBondContact O-CB 3.37Å; F1203-R1207 PolarHBondContact O-N 2.96Å; F1203-R1207 VanDerWaalsContact O-N 3.11Å
1204	L	65.6	Low	65.3	Low	47 Å²	47	100.6 Å²	100.6	25%	0.246	52%	0.519	C	S	.	.	H	α-helix	trans	-64.2	-45.6	174	-69.1	170.2	0	0	0	112.2	L1200 K1201 R1207 S1208 I1225	L1200-L1204 WeakPolarHBondContact O-CG 3.47Å; L1200-L1204 PolarHBondContact O-N 3.17Å; L1200-L1204 VanDerWaalsContact O-N 3.08Å; K1201-L1204 PolarHBondContact O-N 3.44Å; L1204-R1207 PolarHBondContact O-N 3.06Å; L1204-S1208 PolarHBondContact O-N 3.02Å; L1204-I1225 HydrophobicContact CD1-CG2 4.19Å; L1204-I1225 HydrophobicContact CD2-CG2 4.05Å; L1204-I1225 HydrophobicContact CG-CG2 4.24Å
1205	L	63.7	Low	64	Low	113 Å²	113	104.1 Å²	104.1	59%	0.592	54%	0.54	S	S	*	.	H	α-helix	trans	-63.5	-50	177.8	-82.3	163.4	0	0	0	112.1	K1201 G1202 R1207 S1208 C1209	K1201-L1205 WeakPolarHBondContact O-CB 3.2Å; K1201-L1205 WeakPolarHBondContact O-CG 3.28Å; K1201-L1205 PolarHBondContact O-N 3.42Å; G1202-L1205 PolarHBondContact O-N 2.78Å; L1205-R1207 VanDerWaalsContact C-N 3.29Å; L1205-R1207 PolarHBondContact O-N 3.41Å; L1205-S1208 PolarHBondContact O-N 3.12Å; L1205-S1208 PolarHBondContact O-OG 2.99Å; L1205-C1209 PolarHBondContact O-N 3.35Å; L1205-C1209 VanDerWaalsContact O-N 3.13Å; L1205-C1209 PolarHBondContact O-SG 2.92Å
1206	Y	63	Low	62.7	Low	170 Å²	170	103.4 Å²	103.4	67%	0.667	55%	0.554	S	S	*	*	H	α-helix	trans	-56	-44.5	178.2	-176.4	-99.3	0	0	0	111.4	G1202 S1208 C1209 V1210	G1202-Y1206 VanDerWaalsContact O-CB 3.24Å; G1202-Y1206 WeakPolarHBondContact O-CB 3.49Å; G1202-Y1206 PolarHBondContact O-N 2.76Å; Y1206-S1208 PolarHBondContact O-N 2.67Å; Y1206-C1209 PolarHBondContact O-N 3.46Å; Y1206-V1210 HydrophobicContact CE1-CG2 4.32Å; Y1206-V1210 WeakPolarHBondContact O-CG2 3.44Å; Y1206-V1210 PolarHBondContact O-N 3.3Å; Y1206-V1210 VanDerWaalsContact O-N 3.12Å
1207	R	59.7	Low	61.2	Low	98 Å²	98	104.2 Å²	104.2	37%	0.37	56%	0.556	S	S	.	*	H	α-helix	trans	-69.2	-30.8	176.9	-162.9	173.7	-172.5	172.8	4.3	113.4	F1203 L1204 L1205 C1209 V1210 M1217	F1203-R1207 WeakPolarHBondContact O-CB 3.37Å; F1203-R1207 PolarHBondContact O-N 2.96Å; F1203-R1207 VanDerWaalsContact O-N 3.11Å; L1204-R1207 PolarHBondContact O-N 3.06Å; L1205-R1207 VanDerWaalsContact C-N 3.29Å; L1205-R1207 PolarHBondContact O-N 3.41Å; R1207-C1209 VanDerWaalsContact C-N 3.29Å; R1207-C1209 PolarHBondContact O-N 3.41Å; R1207-V1210 CarbonylContact O-C 3.56Å; R1207-V1210 PolarHBondContact O-N 2.79Å; R1207-M1217 PolarHBondContact NH1-SD 3.06Å
1208	S	56.6	Low	60.2	Low	82 Å²	82	106.6 Å²	106.6	57%	0.573	57%	0.574	S	S	*	*	H	α-helix	trans	-67.2	-28.8	173.4	73.8	0	0	0	0	113.3	L1204 L1205 Y1206	L1204-S1208 PolarHBondContact O-N 3.02Å; L1205-S1208 PolarHBondContact O-N 3.12Å; L1205-S1208 PolarHBondContact O-OG 2.99Å; Y1206-S1208 PolarHBondContact O-N 2.67Å
1209	C	52.9	Low	59.3	Low	108 Å²	108	102.3 Å²	102.3	73%	0.73	57%	0.568	S	S	*	*	H	α-helix	trans	-80.8	-30.4	174.7	-60.7	0	0	0	0	112.7	L1205 Y1206 R1207 S1211	L1205-C1209 PolarHBondContact O-N 3.35Å; L1205-C1209 VanDerWaalsContact O-N 3.13Å; L1205-C1209 PolarHBondContact O-SG 2.92Å; Y1206-C1209 PolarHBondContact O-N 3.46Å; R1207-C1209 VanDerWaalsContact C-N 3.29Å; R1207-C1209 PolarHBondContact O-N 3.41Å; C1209-S1211 PolarHBondContact O-N 3.07Å
1210	V	53.4	Low	58.3	Low	77 Å²	77	102.7 Å²	102.7	47%	0.467	57%	0.573	S	S	.	*			trans	-95.6	62.8	179.8	-171.5	0	0	0	0	110.4	Y1206 R1207 G1212	Y1206-V1210 HydrophobicContact CE1-CG2 4.32Å; Y1206-V1210 WeakPolarHBondContact O-CG2 3.44Å; Y1206-V1210 PolarHBondContact O-N 3.3Å; Y1206-V1210 VanDerWaalsContact O-N 3.12Å; R1207-V1210 CarbonylContact O-C 3.56Å; R1207-V1210 PolarHBondContact O-N 2.79Å; V1210-G1212 PolarHBondContact O-N 3.18Å
1211	S	49.2	Very low	57.4	Low	116 Å²	116	101.9 Å²	101.9	81%	0.811	57%	0.572	S	S	*	*			trans	-79.6	13	179.6	-169.6	0	0	0	0	114.3	C1209	C1209-S1211 PolarHBondContact O-N 3.07Å
1212	G	53.2	Low	56.8	Low	58 Å²	58	103.5 Å²	103.5	60%	0.598	58%	0.581	S	S	*	*	S	Bend	trans	-93.8	-34	-167.8	0	0	0	0	0	116.4	V1210	V1210-G1212 PolarHBondContact O-N 3.18Å
1213	Y	46.1	Very low	56.8	Low	217 Å²	217	106.5 Å²	106.5	85%	0.851	59%	0.586	S	S	*	*	S	Bend	trans	-147.8	152.8	-172.8	-80.9	-86.7	0	0	0	112
1214	L	44.1	Very low	56.9	Low	148 Å²	148	104.1 Å²	104.1	78%	0.775	59%	0.586	S	S	*	*			trans	74.2	68.9	178.6	-58	166.9	0	0	0	116.1
1215	E	50.2	Low	57.2	Low	202 Å²	202	103.7 Å²	103.7	94%	0.944	58%	0.584	S	S	*	*			trans	-55	133	140.6	-63.9	-175.2	122.4	0	0	108.9
1216	G	52.1	Low	57.7	Low	71 Å²	71	102.5 Å²	102.5	73%	0.732	58%	0.575	S	S	*	*			trans	164.4	17.4	-173.9	0	0	0	0	0	117.3
1217	M	47.7	Very low	58.3	Low	106 Å²	106	98.1 Å²	98.1	52%	0.522	56%	0.563	S	S	.	*	S	Bend	trans	-142.1	138.8	169.4	-64.3	-172.5	80.2	0	0	108.9	R1207 A1221	R1207-M1217 PolarHBondContact NH1-SD 3.06Å; M1217-A1221 HydrophobicContact CE-CB 3.86Å
1218	S	57.8	Low	59.3	Low	62 Å²	62	100.2 Å²	100.2	43%	0.434	57%	0.571	S	S	.	*			trans	-68.2	153	175.9	66.8	0	0	0	0	111.1	E1220 A1221	S1218-E1220 PolarHBondContact O-N 3.19Å; S1218-E1220 VanDerWaalsContact O-N 3.11Å; S1218-E1220 PolarHBondContact OG-OE2 2.98Å; S1218-A1221 PolarHBondContact O-N 3.41Å
1219	G	59.5	Low	60.3	Low	54 Å²	54	96.6 Å²	96.6	56%	0.557	55%	0.546	S	S	*	.	H	α-helix	trans	-57.3	-25.3	175.6	0	0	0	0	0	113.2	A1221 Q1222 Q1223	G1219-A1221 VanDerWaalsContact C-N 3.34Å; G1219-A1221 PolarHBondContact O-N 2.89Å; G1219-Q1222 WeakPolarHBondContact O-CB 3.26Å; G1219-Q1222 PolarHBondContact O-N 3.29Å; G1219-Q1223 PolarHBondContact O-N 2.87Å
1220	E	58.2	Low	61.5	Low	152 Å²	152	95.4 Å²	95.4	71%	0.71	53%	0.53	S	S	*	.	H	α-helix	trans	-60.1	-40.2	173.6	-53.5	165.8	126.4	0	0	112.3	S1218 Q1222 Q1223 A1224	S1218-E1220 PolarHBondContact O-N 3.19Å; S1218-E1220 VanDerWaalsContact O-N 3.11Å; S1218-E1220 PolarHBondContact OG-OE2 2.98Å; E1220-Q1222 VanDerWaalsContact C-N 3.32Å; E1220-Q1223 PolarHBondContact O-N 2.97Å; E1220-A1224 VanDerWaalsContact O-CB 3.3Å; E1220-A1224 WeakPolarHBondContact O-CB 3.4Å; E1220-A1224 PolarHBondContact O-N 2.83Å
1221	A	57.6	Low	62.8	Low	28 Å²	28	96 Å²	96	23%	0.231	53%	0.527	C	S	.	.	H	α-helix	trans	-70	-33.3	177.7	0	0	0	0	0	111.7	M1217 S1218 G1219 I1225	M1217-A1221 HydrophobicContact CE-CB 3.86Å; S1218-A1221 PolarHBondContact O-N 3.41Å; G1219-A1221 VanDerWaalsContact C-N 3.34Å; G1219-A1221 PolarHBondContact O-N 2.89Å; A1221-I1225 WeakPolarHBondContact O-CG1 3.41Å; A1221-I1225 PolarHBondContact O-N 3.27Å; A1221-I1225 VanDerWaalsContact O-N 3.13Å
1222	Q	62.6	Low	64.2	Low	122 Å²	122	91.1 Å²	91.1	57%	0.57	49%	0.492	S	S	*	.	H	α-helix	trans	-70.4	-41.4	175.4	-153.4	167.9	-3.6	0	0	110.9	G1219 E1220 I1225 Q1226	G1219-Q1222 WeakPolarHBondContact O-CB 3.26Å; G1219-Q1222 PolarHBondContact O-N 3.29Å; E1220-Q1222 VanDerWaalsContact C-N 3.32Å; Q1222-I1225 PolarHBondContact O-N 3.23Å; Q1222-Q1226 PolarHBondContact O-N 2.98Å; Q1222-Q1226 VanDerWaalsContact O-N 3.11Å
1223	Q	71.1	Confident	65.5	Low	98 Å²	98	92.2 Å²	92.2	46%	0.458	48%	0.481	S	S	.	.	H	α-helix	trans	-63	-44.2	171.3	-174.3	61.3	41.4	0	0	111.8	G1219 E1220 I1225 Q1226 D1227	G1219-Q1223 PolarHBondContact O-N 2.87Å; E1220-Q1223 PolarHBondContact O-N 2.97Å; Q1223-I1225 VanDerWaalsContact C-N 3.3Å; Q1223-I1225 PolarHBondContact O-N 3.16Å; Q1223-Q1226 CarbonylContact O-C 3.58Å; Q1223-Q1226 WeakPolarHBondContact O-CA 3.25Å; Q1223-Q1226 WeakPolarHBondContact O-CB 3.42Å; Q1223-Q1226 PolarHBondContact O-N 2.96Å; Q1223-D1227 PolarHBondContact NE2-OD1 3.49Å; Q1223-D1227 PolarHBondContact O-N 2.84Å
1224	A	71.3	Confident	67.2	Low	57 Å²	57	88.2 Å²	88.2	47%	0.471	47%	0.468	S	S	.	.	H	α-helix	trans	-61.2	-36.5	178.5	0	0	0	0	0	112.7	E1220 R1228	E1220-A1224 VanDerWaalsContact O-CB 3.3Å; E1220-A1224 WeakPolarHBondContact O-CB 3.4Å; E1220-A1224 PolarHBondContact O-N 2.83Å; A1224-R1228 VanDerWaalsContact O-CB 3.25Å; A1224-R1228 WeakPolarHBondContact O-CB 3.46Å; A1224-R1228 PolarHBondContact O-N 2.99Å
1225	I	71.4	Confident	68.8	Low	39 Å²	39	84.2 Å²	84.2	20%	0.2	45%	0.446	C	S	.	.	H	α-helix	trans	-66.3	-43.2	172	-68.4	165.7	0	0	0	110.6	L1204 A1221 Q1222 Q1223 R1228 V1229	L1204-I1225 HydrophobicContact CD1-CG2 4.19Å; L1204-I1225 HydrophobicContact CD2-CG2 4.05Å; L1204-I1225 HydrophobicContact CG-CG2 4.24Å; A1221-I1225 WeakPolarHBondContact O-CG1 3.41Å; A1221-I1225 PolarHBondContact O-N 3.27Å; A1221-I1225 VanDerWaalsContact O-N 3.13Å; Q1222-I1225 PolarHBondContact O-N 3.23Å; Q1223-I1225 VanDerWaalsContact C-N 3.3Å; Q1223-I1225 PolarHBondContact O-N 3.16Å; I1225-R1228 PolarHBondContact O-N 2.87Å; I1225-V1229 WeakPolarHBondContact O-CG2 2.95Å; I1225-V1229 PolarHBondContact O-N 3.42Å
1226	Q	74.2	Confident	70.2	Confident	88 Å²	88	75.3 Å²	75.3	41%	0.411	40%	0.404	S	S	.	.	H	α-helix	trans	-63.8	-43.4	178.7	-168	71.8	-18.5	0	0	112.1	Q1222 Q1223 R1228 V1229 Q1230	Q1222-Q1226 PolarHBondContact O-N 2.98Å; Q1222-Q1226 VanDerWaalsContact O-N 3.11Å; Q1223-Q1226 CarbonylContact O-C 3.58Å; Q1223-Q1226 WeakPolarHBondContact O-CA 3.25Å; Q1223-Q1226 WeakPolarHBondContact O-CB 3.42Å; Q1223-Q1226 PolarHBondContact O-N 2.96Å; Q1226-R1228 VanDerWaalsContact C-N 3.34Å; Q1226-R1228 PolarHBondContact O-N 3.2Å; Q1226-V1229 PolarHBondContact O-N 3.23Å; Q1226-Q1230 PolarHBondContact O-N 3.16Å
1227	D	75.8	Confident	71.7	Confident	78 Å²	78	79 Å²	79	42%	0.417	40%	0.401	S	S	.	.	H	α-helix	trans	-64.7	-38.2	175.1	-68.3	-21	0	0	0	111.4	Q1223 Q1230 H1231	Q1223-D1227 PolarHBondContact NE2-OD1 3.49Å; Q1223-D1227 PolarHBondContact O-N 2.84Å; D1227-Q1230 PolarHBondContact O-N 2.85Å; D1227-H1231 WeakPolarHBondContact O-CB 3.34Å; D1227-H1231 PolarHBondContact O-N 3.16Å
1228	R	79.6	Confident	73.4	Confident	141 Å²	141	79.6 Å²	79.6	53%	0.532	40%	0.401	S	S	.	.	H	α-helix	trans	-65.7	-38	174.8	-168.2	59.8	161.1	163.1	-2.2	112.1	A1224 I1225 Q1226 H1231 L1232	A1224-R1228 VanDerWaalsContact O-CB 3.25Å; A1224-R1228 WeakPolarHBondContact O-CB 3.46Å; A1224-R1228 PolarHBondContact O-N 2.99Å; I1225-R1228 PolarHBondContact O-N 2.87Å; Q1226-R1228 VanDerWaalsContact C-N 3.34Å; Q1226-R1228 PolarHBondContact O-N 3.2Å; R1228-H1231 PolarHBondContact O-N 2.93Å; R1228-L1232 HydrophobicContact CG-CD1 4.34Å; R1228-L1232 WeakPolarHBondContact O-CB 3.43Å; R1228-L1232 WeakPolarHBondContact O-CG 3.32Å; R1228-L1232 PolarHBondContact O-N 3.29Å
1229	V	78.8	Confident	74.3	Confident	6 Å²	6	79.2 Å²	79.2	4%	0.036	39%	0.39	C	S	.	.	H	α-helix	trans	-62.9	-49.2	171.7	167.7	0	0	0	0	110.5	L1197 L1200 I1225 Q1226 H1231 L1232 E1233	L1197-V1229 HydrophobicContact CD2-CB 4.4Å; L1197-V1229 HydrophobicContact CD2-CG1 3.91Å; L1200-V1229 HydrophobicContact CB-CG2 3.93Å; L1200-V1229 HydrophobicContact CD1-CG2 4.19Å; I1225-V1229 WeakPolarHBondContact O-CG2 2.95Å; I1225-V1229 PolarHBondContact O-N 3.42Å; Q1226-V1229 PolarHBondContact O-N 3.23Å; V1229-H1231 VanDerWaalsContact C-N 3.26Å; V1229-H1231 PolarHBondContact O-N 3.45Å; V1229-L1232 PolarHBondContact O-N 3.07Å; V1229-E1233 WeakPolarHBondContact O-CG 3.46Å; V1229-E1233 PolarHBondContact O-N 2.66Å
1230	Q	77.7	Confident	75.3	Confident	84 Å²	84	80.9 Å²	80.9	39%	0.393	38%	0.382	S	S	.	.	H	α-helix	trans	-59.9	-35.3	176.2	-70.3	-169.4	27.9	0	0	113.1	Q1226 D1227 K1234	Q1226-Q1230 PolarHBondContact O-N 3.16Å; D1227-Q1230 PolarHBondContact O-N 2.85Å; Q1230-K1234 WeakPolarHBondContact O-CD 3.25Å; Q1230-K1234 VanDerWaalsContact O-CG 3.27Å; Q1230-K1234 WeakPolarHBondContact O-CG 3.48Å; Q1230-K1234 PolarHBondContact O-N 2.85Å; Q1230-K1234 VanDerWaalsContact O-N 3.16Å
1231	H	80.8	Confident	76.2	Confident	89 Å²	89	75.7 Å²	75.7	41%	0.412	36%	0.362	S	S	.	.	H	α-helix	trans	-66.3	-50.8	176.7	-170.4	91	0	0	0	111.2	D1227 R1228 V1229 E1233 K1234 E1235	D1227-H1231 WeakPolarHBondContact O-CB 3.34Å; D1227-H1231 PolarHBondContact O-N 3.16Å; R1228-H1231 PolarHBondContact O-N 2.93Å; V1229-H1231 VanDerWaalsContact C-N 3.26Å; V1229-H1231 PolarHBondContact O-N 3.45Å; H1231-E1233 PolarHBondContact O-N 3.26Å; H1231-K1234 WeakPolarHBondContact O-CB 3.29Å; H1231-K1234 PolarHBondContact O-N 2.9Å; H1231-E1235 IonicContact CD2-OE2 2.7Å; H1231-E1235 PolarHBondContact CD2-OE2 3.5Å; H1231-E1235 IonicContact NE2-OE1 2.62Å; H1231-E1235 IonicContact NE2-OE2 2.78Å; H1231-E1235 PolarHBondContact O-N 3.42Å
1232	L	77.5	Confident	77.1	Confident	13 Å²	13	75.4 Å²	75.4	7%	0.068	36%	0.358	C	S	.	.	H	α-helix	trans	-61.5	-31.3	177.4	-72	167.5	0	0	0	112.3	V1193 L1197 L1200 R1228 V1229 L1236	V1193-L1232 HydrophobicContact CG1-CB 4.27Å; V1193-L1232 HydrophobicContact CG1-CD2 4.22Å; V1193-L1232 WeakPolarHBondContact CG1-O 3.42Å; L1197-L1232 HydrophobicContact CD1-CB 4.26Å; L1197-L1232 HydrophobicContact CD2-CB 3.75Å; L1197-L1232 HydrophobicContact CD2-CD1 4.47Å; L1197-L1232 HydrophobicContact CG-CB 3.93Å; L1200-L1232 HydrophobicContact CD1-CD1 3.64Å; R1228-L1232 HydrophobicContact CG-CD1 4.34Å; R1228-L1232 WeakPolarHBondContact O-CB 3.43Å; R1228-L1232 WeakPolarHBondContact O-CG 3.32Å; R1228-L1232 PolarHBondContact O-N 3.29Å; V1229-L1232 PolarHBondContact O-N 3.07Å; L1232-L1236 WeakPolarHBondContact O-CB 3.45Å; L1232-L1236 PolarHBondContact O-N 2.9Å
1233	E	80.6	Confident	77.7	Confident	82 Å²	82	70 Å²	70	38%	0.383	33%	0.334	S	S	.	.	H	α-helix	trans	-69.5	-37.5	172.5	-73.2	-176.8	151.3	0	0	113	L1197 K1201 V1229 H1231 L1236 F1237	L1197-E1233 HydrophobicContact CD1-CG 4Å; L1197-E1233 HydrophobicContact CD2-CG 3.85Å; K1201-E1233 WeakPolarHBondContact CE-OE1 3.43Å; K1201-E1233 IonicContact NZ-OE1 3.22Å; K1201-E1233 PolarHBondContact NZ-OE1 3.16Å; V1229-E1233 WeakPolarHBondContact O-CG 3.46Å; V1229-E1233 PolarHBondContact O-N 2.66Å; H1231-E1233 PolarHBondContact O-N 3.26Å; E1233-L1236 PolarHBondContact O-N 3.34Å; E1233-F1237 WeakPolarHBondContact O-CB 3.21Å; E1233-F1237 PolarHBondContact O-N 2.89Å
1234	K	83.3	Confident	78	Confident	133 Å²	133	74.8 Å²	74.8	58%	0.578	35%	0.348	S	S	*	.	H	α-helix	trans	-67.2	-41.6	173.8	-70.1	159.9	-171.4	162	0	111.2	Q1230 H1231 F1237 F1238	Q1230-K1234 WeakPolarHBondContact O-CD 3.25Å; Q1230-K1234 VanDerWaalsContact O-CG 3.27Å; Q1230-K1234 WeakPolarHBondContact O-CG 3.48Å; Q1230-K1234 PolarHBondContact O-N 2.85Å; Q1230-K1234 VanDerWaalsContact O-N 3.16Å; H1231-K1234 WeakPolarHBondContact O-CB 3.29Å; H1231-K1234 PolarHBondContact O-N 2.9Å; K1234-F1237 PolarHBondContact O-N 3Å; K1234-F1238 PolarHBondContact O-N 3.32Å
1235	E	77.4	Confident	78.2	Confident	64 Å²	64	78 Å²	78	30%	0.299	35%	0.353	S	S	.	.	H	α-helix	trans	-64	-45.2	172.2	-68.1	-175.3	118.3	0	0	111.6	H1231 F1237 F1238 Y1239	H1231-E1235 IonicContact CD2-OE2 2.7Å; H1231-E1235 PolarHBondContact CD2-OE2 3.5Å; H1231-E1235 IonicContact NE2-OE1 2.62Å; H1231-E1235 IonicContact NE2-OE2 2.78Å; H1231-E1235 PolarHBondContact O-N 3.42Å; E1235-F1237 VanDerWaalsContact C-N 3.26Å; E1235-F1237 PolarHBondContact O-N 3.34Å; E1235-F1238 WeakPolarHBondContact O-CB 3.43Å; E1235-F1238 PolarHBondContact O-N 3.31Å; E1235-F1238 VanDerWaalsContact O-N 3.08Å; E1235-Y1239 VanDerWaalsContact O-CD2 3.26Å; E1235-Y1239 WeakPolarHBondContact O-CD2 3.3Å; E1235-Y1239 PolarHBondContact O-N 3.4Å
1236	L	80.1	Confident	78.4	Confident	15 Å²	15	77.2 Å²	77.2	8%	0.079	35%	0.349	C	S	.	.	H	α-helix	trans	-59.4	-36.9	175.8	-174.9	67.4	0	0	0	111.9	Q1190 V1193 R1194 L1197 L1232 E1233 K1240	Q1190-L1236 HydrophobicContact CG-CD1 3.55Å; V1193-L1236 HydrophobicContact CB-CD1 4.45Å; V1193-L1236 HydrophobicContact CG1-CB 3.92Å; V1193-L1236 HydrophobicContact CG1-CD1 4.19Å; R1194-L1236 HydrophobicContact CG-CD1 3.93Å; R1194-L1236 HydrophobicContact CG-CD2 4.09Å; L1197-L1236 HydrophobicContact CD1-CB 4.47Å; L1197-L1236 HydrophobicContact CD1-CD2 3.85Å; L1232-L1236 WeakPolarHBondContact O-CB 3.45Å; L1232-L1236 PolarHBondContact O-N 2.9Å; E1233-L1236 PolarHBondContact O-N 3.34Å; L1236-K1240 HydrophobicContact CG-CD 4.26Å; L1236-K1240 VanDerWaalsContact O-CB 3.27Å; L1236-K1240 WeakPolarHBondContact O-CB 3.48Å; L1236-K1240 WeakPolarHBondContact O-CD 3.45Å; L1236-K1240 WeakPolarHBondContact O-CG 3.5Å; L1236-K1240 PolarHBondContact O-N 3.48Å
1237	F	82.8	Confident	78.5	Confident	149 Å²	149	78.2 Å²	78.2	65%	0.654	35%	0.352	S	S	*	.	H	α-helix	trans	-67.1	-44.4	172.7	179.9	-93	0	0	0	112	E1233 K1234 E1235 K1240 S1241	E1233-F1237 WeakPolarHBondContact O-CB 3.21Å; E1233-F1237 PolarHBondContact O-N 2.89Å; K1234-F1237 PolarHBondContact O-N 3Å; E1235-F1237 VanDerWaalsContact C-N 3.26Å; E1235-F1237 PolarHBondContact O-N 3.34Å; F1237-K1240 WeakPolarHBondContact O-CB 3.46Å; F1237-K1240 PolarHBondContact O-N 2.99Å; F1237-S1241 WeakPolarHBondContact O-CB 3.4Å; F1237-S1241 PolarHBondContact O-N 3.35Å
1238	F	83.6	Confident	78.7	Confident	118 Å²	118	80.6 Å²	80.6	52%	0.518	36%	0.359	S	S	.	.	H	α-helix	trans	-57.8	-53	175.5	175.9	-100.3	0	0	0	111.5	K1234 E1235 K1240 S1241 S1242	K1234-F1238 PolarHBondContact O-N 3.32Å; E1235-F1238 WeakPolarHBondContact O-CB 3.43Å; E1235-F1238 PolarHBondContact O-N 3.31Å; E1235-F1238 VanDerWaalsContact O-N 3.08Å; F1238-K1240 VanDerWaalsContact C-N 3.34Å; F1238-K1240 PolarHBondContact O-N 3.33Å; F1238-S1241 WeakPolarHBondContact O-CB 3.39Å; F1238-S1241 PolarHBondContact O-N 3.4Å; F1238-S1242 PolarHBondContact O-N 3.18Å; F1238-S1242 PolarHBondContact O-OG 3.22Å
1239	Y	77.2	Confident	78.5	Confident	53 Å²	53	79.7 Å²	79.7	21%	0.208	36%	0.359	C	S	.	.	H	α-helix	trans	-65.7	-32.6	178.5	-72.9	-70.6	0	0	0	113	H1186 H1189 E1235 S1243	H1186-Y1239 AromaticContact CD2-CD1 3.49Å; H1186-Y1239 VanDerWaalsContact CD2-CD1 3.49Å; H1186-Y1239 WeakPolarHBondContact CD2-CD1 3.41Å; H1186-Y1239 AromaticContact CD2-CE1 3.5Å; H1186-Y1239 VanDerWaalsContact CD2-CE1 3.5Å; H1186-Y1239 WeakPolarHBondContact CD2-CE1 3.25Å; H1186-Y1239 AromaticContact NE2-CD1 3.98Å; H1186-Y1239 AromaticContact NE2-CE1 3.75Å; H1189-Y1239 AromaticContact CD2-CD2 3.57Å; H1189-Y1239 AromaticContact CD2-CE2 3.37Å; H1189-Y1239 WeakPolarHBondContact CD2-CE2 3.45Å; H1189-Y1239 AromaticContact CD2-CZ 3.72Å; H1189-Y1239 AromaticContact NE2-CD2 3.91Å; H1189-Y1239 AromaticContact NE2-CE2 3.36Å; H1189-Y1239 WeakPolarHBondContact NE2-CE2 3.41Å; H1189-Y1239 AromaticContact NE2-CZ 3.86Å; E1235-Y1239 VanDerWaalsContact O-CD2 3.26Å; E1235-Y1239 WeakPolarHBondContact O-CD2 3.3Å; E1235-Y1239 PolarHBondContact O-N 3.4Å; Y1239-S1243 WeakPolarHBondContact O-CB 3.44Å; Y1239-S1243 PolarHBondContact O-N 3.3Å
1240	K	79.3	Confident	78.2	Confident	89 Å²	89	80.9 Å²	80.9	39%	0.387	37%	0.365	S	S	.	.	H	α-helix	trans	-59.6	-44.7	168.3	-82	167.5	-180	172.9	0	111.9	L1236 F1237 F1238 R1244	L1236-K1240 HydrophobicContact CG-CD 4.26Å; L1236-K1240 VanDerWaalsContact O-CB 3.27Å; L1236-K1240 WeakPolarHBondContact O-CB 3.48Å; L1236-K1240 WeakPolarHBondContact O-CD 3.45Å; L1236-K1240 WeakPolarHBondContact O-CG 3.5Å; L1236-K1240 PolarHBondContact O-N 3.48Å; F1237-K1240 WeakPolarHBondContact O-CB 3.46Å; F1237-K1240 PolarHBondContact O-N 2.99Å; F1238-K1240 VanDerWaalsContact C-N 3.34Å; F1238-K1240 PolarHBondContact O-N 3.33Å; K1240-R1244 WeakPolarHBondContact O-CG 3.42Å; K1240-R1244 PolarHBondContact O-N 2.96Å; K1240-R1244 VanDerWaalsContact O-N 3.11Å
1241	S	77.3	Confident	78	Confident	44 Å²	44	84.4 Å²	84.4	31%	0.308	38%	0.379	S	S	.	.	H	α-helix	trans	-69.5	-50.7	-179.2	-165.3	0	0	0	0	111.6	F1237 F1238 S1243 R1244 Q1245	F1237-S1241 WeakPolarHBondContact O-CB 3.4Å; F1237-S1241 PolarHBondContact O-N 3.35Å; F1238-S1241 WeakPolarHBondContact O-CB 3.39Å; F1238-S1241 PolarHBondContact O-N 3.4Å; S1241-S1243 VanDerWaalsContact C-N 3.35Å; S1241-S1243 PolarHBondContact O-N 3.47Å; S1241-R1244 WeakPolarHBondContact O-CB 3.2Å; S1241-R1244 PolarHBondContact O-N 3.21Å; S1241-R1244 VanDerWaalsContact O-N 3.09Å; S1241-Q1245 PolarHBondContact O-N 2.85Å
1242	S	76.6	Confident	77.5	Confident	21 Å²	21	84 Å²	84	15%	0.147	38%	0.377	C	S	.	.	H	α-helix	trans	-61.8	-38.9	178	-59.5	0	0	0	0	112.3	F1238 Q1245 L1246	F1238-S1242 PolarHBondContact O-N 3.18Å; F1238-S1242 PolarHBondContact O-OG 3.22Å; S1242-Q1245 PolarHBondContact O-N 2.66Å; S1242-L1246 WeakPolarHBondContact O-CB 3.23Å; S1242-L1246 PolarHBondContact O-N 3.15Å
1243	S	75.1	Confident	76.6	Confident	8 Å²	8	87.2 Å²	87.2	6%	0.056	39%	0.394	C	S	.	.	H	α-helix	trans	-66.5	-36.6	173.3	-173.6	0	0	0	0	112.4	Y1239 S1241 K1247	Y1239-S1243 WeakPolarHBondContact O-CB 3.44Å; Y1239-S1243 PolarHBondContact O-N 3.3Å; S1241-S1243 VanDerWaalsContact C-N 3.35Å; S1241-S1243 PolarHBondContact O-N 3.47Å; S1243-K1247 VanDerWaalsContact O-CB 3.3Å; S1243-K1247 WeakPolarHBondContact O-CB 3.3Å; S1243-K1247 VanDerWaalsContact O-CG 3.25Å; S1243-K1247 WeakPolarHBondContact O-CG 3.43Å; S1243-K1247 PolarHBondContact O-N 3.34Å
1244	R	77.5	Confident	75.5	Confident	199 Å²	199	87.3 Å²	87.3	75%	0.751	40%	0.397	S	S	*	.	H	α-helix	trans	-64.5	-40.5	171.8	-77.6	172.8	173.3	-173	-3	111.8	K1240 S1241 K1248	K1240-R1244 WeakPolarHBondContact O-CG 3.42Å; K1240-R1244 PolarHBondContact O-N 2.96Å; K1240-R1244 VanDerWaalsContact O-N 3.11Å; S1241-R1244 WeakPolarHBondContact O-CB 3.2Å; S1241-R1244 PolarHBondContact O-N 3.21Å; S1241-R1244 VanDerWaalsContact O-N 3.09Å; R1244-K1248 VanDerWaalsContact O-CB 3.3Å; R1244-K1248 WeakPolarHBondContact O-CB 3.35Å; R1244-K1248 PolarHBondContact O-N 3Å
1245	Q	76.1	Confident	73.9	Confident	125 Å²	125	84.8 Å²	84.8	58%	0.584	40%	0.396	S	S	*	.	H	α-helix	trans	-68.4	-43	177	-69	-179.3	4.4	0	0	112.5	S1241 S1242 K1248 K1249	S1241-Q1245 PolarHBondContact O-N 2.85Å; S1242-Q1245 PolarHBondContact O-N 2.66Å; Q1245-K1248 PolarHBondContact O-N 2.73Å; Q1245-K1249 PolarHBondContact O-N 3.39Å
1246	L	74.9	Confident	72.2	Confident	22 Å²	22	88 Å²	88	12%	0.115	42%	0.415	C	S	.	.	H	α-helix	trans	-64.1	-43.5	174.5	-81.6	161.7	0	0	0	112	L1182 H1186 S1242 K1248 K1249 L1250	L1182-L1246 HydrophobicContact CD2-CD1 3.96Å; L1182-L1246 HydrophobicContact CD2-CD2 4.09Å; L1182-L1246 HydrophobicContact CG-CD1 4.22Å; H1186-L1246 WeakPolarHBondContact ND1-CD1 3.36Å; S1242-L1246 WeakPolarHBondContact O-CB 3.23Å; S1242-L1246 PolarHBondContact O-N 3.15Å; L1246-K1248 VanDerWaalsContact C-N 3.3Å; L1246-K1248 PolarHBondContact O-N 2.96Å; L1246-K1249 PolarHBondContact O-N 3.09Å; L1246-L1250 WeakPolarHBondContact O-CB 3.44Å; L1246-L1250 PolarHBondContact O-N 2.8Å
1247	K	77.1	Confident	70.2	Confident	110 Å²	110	89.2 Å²	89.2	48%	0.478	43%	0.427	S	S	.	.	H	α-helix	trans	-64	-34.8	173	-74.2	179.5	-179.6	-169	0	112.8	T1183 S1243 K1251	T1183-K1247 HydrophobicContact CG2-CG 4.21Å; S1243-K1247 VanDerWaalsContact O-CB 3.3Å; S1243-K1247 WeakPolarHBondContact O-CB 3.3Å; S1243-K1247 VanDerWaalsContact O-CG 3.25Å; S1243-K1247 WeakPolarHBondContact O-CG 3.43Å; S1243-K1247 PolarHBondContact O-N 3.34Å; K1247-K1251 WeakPolarHBondContact O-CB 3.37Å; K1247-K1251 PolarHBondContact O-N 3.29Å
1248	K	79.8	Confident	68	Low	127 Å²	127	87.6 Å²	87.6	55%	0.552	43%	0.432	S	S	*	.	H	α-helix	trans	-64.6	-49	172.9	179	173.3	165.7	173.2	0	110.4	R1244 Q1245 L1246 L1250 K1251 E1252	R1244-K1248 VanDerWaalsContact O-CB 3.3Å; R1244-K1248 WeakPolarHBondContact O-CB 3.35Å; R1244-K1248 PolarHBondContact O-N 3Å; Q1245-K1248 PolarHBondContact O-N 2.73Å; L1246-K1248 VanDerWaalsContact C-N 3.3Å; L1246-K1248 PolarHBondContact O-N 2.96Å; K1248-L1250 PolarHBondContact O-N 2.73Å; K1248-K1251 CarbonylContact O-C 3.58Å; K1248-K1251 PolarHBondContact O-N 3.15Å; K1248-K1251 VanDerWaalsContact O-N 3.11Å; K1248-E1252 WeakPolarHBondContact CE-OE1 3.21Å; K1248-E1252 WeakPolarHBondContact CE-OE2 3.39Å; K1248-E1252 HydrophobicContact CG-CG 4.33Å; K1248-E1252 IonicContact NZ-OE1 2.71Å; K1248-E1252 PolarHBondContact NZ-OE1 3.18Å; K1248-E1252 WeakPolarHBondContact O-CG 3.38Å; K1248-E1252 PolarHBondContact O-N 3.26Å
1249	K	74.6	Confident	65.5	Low	123 Å²	123	90 Å²	90	54%	0.535	44%	0.438	S	S	.	.	H	α-helix	trans	-58.7	-45.5	174.6	-77.5	-172.7	170.1	-165.8	0	113.4	Q1245 L1246 K1251 E1252 L1253	Q1245-K1249 PolarHBondContact O-N 3.39Å; L1246-K1249 PolarHBondContact O-N 3.09Å; K1249-K1251 VanDerWaalsContact C-N 3.28Å; K1249-K1251 PolarHBondContact O-N 3.44Å; K1249-E1252 PolarHBondContact O-N 3.24Å; K1249-L1253 WeakPolarHBondContact O-CB 3.34Å; K1249-L1253 WeakPolarHBondContact O-CG 3.49Å; K1249-L1253 PolarHBondContact O-N 2.93Å
1250	L	72.4	Confident	63.5	Low	30 Å²	30	92.7 Å²	92.7	16%	0.157	46%	0.457	C	S	.	.	H	α-helix	trans	-61.6	-37.2	175	-92.5	157.4	0	0	0	111.4	D1179 L1246 K1248 L1254	D1179-L1250 HydrophobicContact CB-CD1 4.49Å; D1179-L1250 HydrophobicContact CB-CG 4.49Å; L1246-L1250 WeakPolarHBondContact O-CB 3.44Å; L1246-L1250 PolarHBondContact O-N 2.8Å; K1248-L1250 PolarHBondContact O-N 2.73Å; L1250-L1254 VanDerWaalsContact O-CB 3.22Å; L1250-L1254 WeakPolarHBondContact O-CB 3.49Å; L1250-L1254 WeakPolarHBondContact O-CD1 3.31Å; L1250-L1254 WeakPolarHBondContact O-CG 3.45Å; L1250-L1254 PolarHBondContact O-N 3Å
1251	K	73.8	Confident	61.1	Low	158 Å²	158	95.7 Å²	95.7	69%	0.687	48%	0.477	S	S	*	.	H	α-helix	trans	-71.2	-37.4	174	-170.1	173.6	-178.3	-179.5	0	112.6	K1247 K1248 K1249 L1254 S1255	K1247-K1251 WeakPolarHBondContact O-CB 3.37Å; K1247-K1251 PolarHBondContact O-N 3.29Å; K1248-K1251 CarbonylContact O-C 3.58Å; K1248-K1251 PolarHBondContact O-N 3.15Å; K1248-K1251 VanDerWaalsContact O-N 3.11Å; K1249-K1251 VanDerWaalsContact C-N 3.28Å; K1249-K1251 PolarHBondContact O-N 3.44Å; K1251-L1254 CarbonylContact O-C 3.55Å; K1251-L1254 PolarHBondContact O-N 3.06Å; K1251-S1255 PolarHBondContact O-N 3.46Å; K1251-S1255 PolarHBondContact O-OG 3.42Å
1252	E	69.7	Low	58.9	Low	80 Å²	80	100.7 Å²	100.7	37%	0.374	50%	0.5	S	S	.	.	H	α-helix	trans	-65.6	-47.5	175.2	-73.7	170.6	143.4	0	0	110.6	K1248 K1249 L1254 S1255 D1256	K1248-E1252 WeakPolarHBondContact CE-OE1 3.21Å; K1248-E1252 WeakPolarHBondContact CE-OE2 3.39Å; K1248-E1252 HydrophobicContact CG-CG 4.33Å; K1248-E1252 IonicContact NZ-OE1 2.71Å; K1248-E1252 PolarHBondContact NZ-OE1 3.18Å; K1248-E1252 WeakPolarHBondContact O-CG 3.38Å; K1248-E1252 PolarHBondContact O-N 3.26Å; K1249-E1252 PolarHBondContact O-N 3.24Å; E1252-L1254 VanDerWaalsContact C-N 3.26Å; E1252-L1254 PolarHBondContact O-N 3.32Å; E1252-S1255 WeakPolarHBondContact CA-OG 3.42Å; E1252-S1255 CarbonylContact O-C 3.41Å; E1252-S1255 PolarHBondContact O-N 3.45Å; E1252-S1255 PolarHBondContact O-OG 2.97Å; E1252-D1256 WeakPolarHBondContact O-CB 3.41Å; E1252-D1256 VanDerWaalsContact O-CG 3.27Å; E1252-D1256 PolarHBondContact O-N 3.47Å
1253	L	60.6	Low	56.6	Low	82 Å²	82	108.5 Å²	108.5	43%	0.429	54%	0.535	S	S	.	.	H	α-helix	trans	-65.5	-26.2	173.9	-69.1	171.6	0	0	0	113.4	L1176 K1249 A1257	L1176-L1253 HydrophobicContact CD2-CB 4.18Å; L1176-L1253 HydrophobicContact CD2-CD1 4.05Å; K1249-L1253 WeakPolarHBondContact O-CB 3.34Å; K1249-L1253 WeakPolarHBondContact O-CG 3.49Å; K1249-L1253 PolarHBondContact O-N 2.93Å; L1253-A1257 VanDerWaalsContact O-CB 3.31Å; L1253-A1257 WeakPolarHBondContact O-CB 3.33Å; L1253-A1257 PolarHBondContact O-N 3.16Å; L1253-A1257 VanDerWaalsContact O-N 3.1Å
1254	L	57	Low	54.6	Low	83 Å²	83	113.5 Å²	113.5	44%	0.435	57%	0.569	S	S	.	*	H	α-helix	trans	-82.7	-19.1	171.5	-76.5	168.1	0	0	0	113.3	L1250 K1251 E1252 Y1259	L1250-L1254 VanDerWaalsContact O-CB 3.22Å; L1250-L1254 WeakPolarHBondContact O-CB 3.49Å; L1250-L1254 WeakPolarHBondContact O-CD1 3.31Å; L1250-L1254 WeakPolarHBondContact O-CG 3.45Å; L1250-L1254 PolarHBondContact O-N 3Å; K1251-L1254 CarbonylContact O-C 3.55Å; K1251-L1254 PolarHBondContact O-N 3.06Å; E1252-L1254 VanDerWaalsContact C-N 3.26Å; E1252-L1254 PolarHBondContact O-N 3.32Å; L1254-Y1259 HydrophobicContact CB-CE2 4.44Å; L1254-Y1259 WeakPolarHBondContact O-CD2 3.46Å; L1254-Y1259 VanDerWaalsContact O-CE2 3.23Å; L1254-Y1259 WeakPolarHBondContact O-CE2 3.25Å
1255	S	50.1	Low	52.2	Low	81 Å²	81	109.5 Å²	109.5	57%	0.566	57%	0.572	S	S	*	*	H	α-helix	trans	-91.5	-25	171.4	58.9	0	0	0	0	113.3	K1251 E1252	K1251-S1255 PolarHBondContact O-N 3.46Å; K1251-S1255 PolarHBondContact O-OG 3.42Å; E1252-S1255 WeakPolarHBondContact CA-OG 3.42Å; E1252-S1255 CarbonylContact O-C 3.41Å; E1252-S1255 PolarHBondContact O-N 3.45Å; E1252-S1255 PolarHBondContact O-OG 2.97Å
1256	D	40.1	Very low	50.1	Low	132 Å²	132	112.3 Å²	112.3	71%	0.706	59%	0.585	S	S	*	*	H	α-helix	trans	-83.5	-18	171.5	-65.3	-10.7	0	0	0	111.3	E1252	E1252-D1256 WeakPolarHBondContact O-CB 3.41Å; E1252-D1256 VanDerWaalsContact O-CG 3.27Å; E1252-D1256 PolarHBondContact O-N 3.47Å
1257	A	38.7	Very low	48	Very low	40 Å²	40	117.6 Å²	117.6	33%	0.331	62%	0.618	S	S	.	*	S	Bend	trans	-71.4	131.1	159.9	0	0	0	0	0	109.2	L1253 Y1259	L1253-A1257 VanDerWaalsContact O-CB 3.31Å; L1253-A1257 WeakPolarHBondContact O-CB 3.33Å; L1253-A1257 PolarHBondContact O-N 3.16Å; L1253-A1257 VanDerWaalsContact O-N 3.1Å; A1257-Y1259 PolarHBondContact O-N 2.94Å
1258	P	35.8	Very low	45.7	Very low	115 Å²	115	122 Å²	122	75%	0.747	64%	0.64	S	S	*	*			trans	-64.9	111.5	179.4	26.3	-33.4	0	0	0	109.8	N1260	P1258-N1260 PolarHBondContact O-N 3.05Å
1259	Y	31.6	Very low	43.2	Very low	167 Å²	167	128 Å²	128	66%	0.655	67%	0.67	S	S	*	*			trans	-73.1	120.1	-177.7	-121.6	-100	0	0	0	110.9	L1254 A1257 D1261	L1254-Y1259 HydrophobicContact CB-CE2 4.44Å; L1254-Y1259 WeakPolarHBondContact O-CD2 3.46Å; L1254-Y1259 VanDerWaalsContact O-CE2 3.23Å; L1254-Y1259 WeakPolarHBondContact O-CE2 3.25Å; A1257-Y1259 PolarHBondContact O-N 2.94Å; Y1259-D1261 PolarHBondContact O-N 2.72Å; Y1259-D1261 VanDerWaalsContact O-N 3.16Å
1260	N	35.7	Very low	41.7	Very low	110 Å²	110	128.3 Å²	128.3	59%	0.588	68%	0.677	S	S	*	*			trans	-67.7	102.2	158.7	-78.2	-70.8	0	0	0	108.1	Q23 P1258 N1262	Q23-N1260 PolarHBondContact NE2-OD1 3.25Å; P1258-N1260 PolarHBondContact O-N 3.05Å; N1260-N1262 PolarHBondContact O-N 3.18Å
1261	D	29.2	Very low	40	Very low	152 Å²	152	133.4 Å²	133.4	81%	0.813	70%	0.704	S	S	*	*			trans	-85.1	103.8	160.8	-91	-18.4	0	0	0	108.7	Y1259	Y1259-D1261 PolarHBondContact O-N 2.72Å; Y1259-D1261 VanDerWaalsContact O-N 3.16Å
1262	N	29.8	Very low	38.2	Very low	149 Å²	149	132.1 Å²	132.1	80%	0.797	71%	0.705	S	S	*	*			trans	-152.8	132.9	167.6	-133.9	-12.3	0	0	0	108.1	N1260	N1260-N1262 PolarHBondContact O-N 3.18Å
1263	Q	30.1	Very low	36.3	Very low	186 Å²	186	135.1 Å²	135.1	87%	0.869	73%	0.725	S	S	*	*			trans	67.3	140.4	-168.2	-50.8	177.1	-13.4	0	0	115.8
1264	S	33.1	Very low	34.8	Very low	113 Å²	113	138.4 Å²	138.4	79%	0.79	74%	0.743	S	S	*	*			cis	-169.3	147.3	-30.4	43.9	0	0	0	0	108.2
1265	S	25.9	Very low	33.3	Very low	115 Å²	115	142.1 Å²	142.1	80%	0.804	76%	0.764	S	S	*	*			trans	-135.8	81.3	171.3	63.6	0	0	0	0	111.2
1266	H	31.4	Very low	32.1	Very low	184 Å²	184	146.5 Å²	146.5	85%	0.852	78%	0.778	S	S	*	*			trans	-135.5	98.1	169.1	-91.2	-61.9	0	0	0	110.9
1267	T	30.7	Very low	31.5	Very low	133 Å²	133	147.6 Å²	147.6	82%	0.816	78%	0.784	S	S	*	*			trans	-156.9	104.1	145.6	8.6	0	0	0	0	108.4
1268	Q	29.7	Very low	30.9	Very low	202 Å²	202	156.6 Å²	156.6	94%	0.944	82%	0.821	S	S	*	*			trans	-115.7	73.8	149.8	-90.8	-162.3	-83.4	0	0	106.7
1269	E	27.8	Very low	30.4	Very low	253 Å²	253	160.4 Å²	160.4	100%	1.182	83%	0.828	S	S	*	*			trans	-169.3	0	147.3	-104.4	172	-171.8	0	0	107.6

Retrieved 1,269 of 1,269 residues in 874.1 ms (Link to these results)

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