A0A087XGJ7_POEFO Loading...

Exportin-5

Mediates the nuclear export of micro-RNA precursors, which form short hairpins. Also mediates the nuclear export of synthetic short hairpin RNAs used for RNA interference. In some circumstances can also mediate the nuclear export of deacylated and aminoacylated tRNAs. Specifically recognizes dsRNAs that lack a 5'-overhang in a sequence-independent manner, have only a short 3'-overhang, and that have a double-stranded length of at least 15 base-pairs. Binding is dependent on Ran-GTP.

AlphaFold DB , UniProt , Accession A0A087XGJ7, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 1,221 aa.

						>A0A087XGJ7_POEFO|A0A087XGJ7
MAEQVAAMCDQLIKAVMVMMDAETNQIYRLEALKFCEEFKETSTLCVPCGLRLADKSQPAVVRHFGLQILEQVIKFRWNNMQQQEKVQLKECAMQLLATGTHSILEEESHVKDALSRIVVEMIKREWPQHWPDMLKEMESLSSQGEAQTELVMLILLRLAEDVITFQTLPSQRRRDIQQTLTQNMDSIFSFLLTILHINVEDYRKLKEEPALELKAKAHCRVAVATLNTLAGYVDWVTLVHITSRNCQLLEMLCLLLSEPELQLEASECLLIALSRKGKLEERKPFMLLFNDVAIQYILSAAQSADGLAICPNSSKPQEVEVVERRYVFLKRLCQVLCALGFQLCSLVGPCSEVEVPPNLTKYTEALLAFTTHSSQFLKSCTVSTWASLFRHETLSKVPVVVEMALEYLKVSTTNLVRTGFPSKQDSPSCVYSRMDFDSDDDFNSFFSTYRSQHGDVLRTLSRILPVEAFHTAAEWLRFQVASPVDPGETTSKTAEGLCSLMSPSVLQWDALTVFMECVMHQIFKSMDEQKLPIDQSMELLQGVLNYETRDPLILSCVLSNISALFPFVTHRPQFVPQVLYKLFKAVTFHIDLENKAPRSRAVKNVRRHACSAIIKICRDYPQFILPCFDMFYNHVKELFANEALLTFLEKCSQMEALVLISNQFKDFDKQKAFLDELTAPIITQWTSEEMTSVLWDPVKFLSFVGADEVFTEQREERDTAGPNRGQLSFCLYAMLAVVKRARWPADLEEARAGGFVVGCTPAGAPIYRNPCAAQFLAFLPNLLALIRTQNSLFMPENVARLSETFSRAYDVMDGDKLVILGLPQPPLDIYDAPVHKSLLDRMQGFFNSLFENCFHILGNAGPALLQDFYTVESLAEGIIGSAFTSLDHVPDHRLRSMIRLFLKQLVISCPPEYHDSLLRPLLGPLFTYMQQRLNVKWQVINQRTSVNDEDEEEQAVYEDCAVTQEMLEEQLVRLLTREVLDLLNVSCISRKAPEPAAIKEEIDEEDVMMESVQVASSPQPTDELSELGKCLMKHESVYMSLLTLSFTSLSWKDTTNCHRTASMVCWNLLRPVVAGNLLPEAVTWFYTSVLRALQVHGQHEACNTPLCNLAMLIYENLRPRYMELRAVMTQVPNISIDALDLYDQRLVDSNAQKAGEKKRRDQFKKLLAGTIGKALCQQFRKEVHIRNLPSLFKKPKPDKDIVETEQLGLAALFSPESNAL
					

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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	61.5	Low	85.2	Confident	180 Å²	180	80.1 Å²	80.1	89%	0.887	44%	0.437	S	S	*	.				0	-49	0	-94.6	-154.6	-76.7	0	0	113.3	E3 Q4 V5	M1-E3 PolarHBondContact O-N 3.28Å; M1-Q4 PolarHBondContact O-N 3.45Å; M1-V5 WeakPolarHBondContact O-CG2 3.49Å; M1-V5 PolarHBondContact O-N 3.15Å
2	A	70.9	Confident	86	Confident	77 Å²	77	73.4 Å²	73.4	64%	0.636	40%	0.401	S	S	*	.	H	α-helix	trans	-59.5	-42	-175.1	0	0	0	0	0	115.2	V5 A6	A2-V5 PolarHBondContact O-N 3.01Å; A2-A6 PolarHBondContact O-N 2.96Å; A2-A6 VanDerWaalsContact O-N 3.1Å
3	E	78.4	Confident	86.7	Confident	176 Å²	176	70.5 Å²	70.5	82%	0.822	38%	0.384	S	S	*	.	H	α-helix	trans	-66.7	-38.5	176	-73.9	179	160.1	0	0	112.7	M1 A6 A7	M1-E3 PolarHBondContact O-N 3.28Å; E3-A6 PolarHBondContact O-N 3.49Å; E3-A7 PolarHBondContact O-N 3Å
4	Q	85.7	Confident	87.2	Confident	117 Å²	117	76 Å²	76	55%	0.547	40%	0.402	S	S	.	.	H	α-helix	trans	-65.9	-38.5	178	-170.3	-178.7	7.2	0	0	111.9	M1 M8 L45	M1-Q4 PolarHBondContact O-N 3.45Å; Q4-M8 WeakPolarHBondContact O-CB 3.21Å; Q4-M8 PolarHBondContact O-N 3.44Å; Q4-M8 VanDerWaalsContact O-N 3.14Å; Q4-L45 HydrophobicContact CG-CD1 4.13Å
5	V	88.3	Confident	87.6	Confident	13 Å²	13	71.6 Å²	71.6	8%	0.079	38%	0.381	C	S	.	.	H	α-helix	trans	-66.5	-42.4	174.4	172	0	0	0	0	110.8	M1 A2 M8 C9 L45 P48	M1-V5 WeakPolarHBondContact O-CG2 3.49Å; M1-V5 PolarHBondContact O-N 3.15Å; A2-V5 PolarHBondContact O-N 3.01Å; V5-M8 PolarHBondContact O-N 3.5Å; V5-C9 PolarHBondContact O-N 3.25Å; V5-C9 PolarHBondContact O-SG 3Å; V5-L45 HydrophobicContact CG2-CD2 4.27Å; V5-P48 HydrophobicContact CG1-CB 4.27Å; V5-P48 HydrophobicContact CG2-CB 4.17Å; V5-P48 HydrophobicContact CG2-CG 4.24Å
6	A	87.8	Confident	88.1	Confident	22 Å²	22	67.3 Å²	67.3	18%	0.182	36%	0.358	C	S	.	.	H	α-helix	trans	-61.8	-50.3	178.2	0	0	0	0	0	111.9	A2 E3 M8 C9 D10	A2-A6 PolarHBondContact O-N 2.96Å; A2-A6 VanDerWaalsContact O-N 3.1Å; E3-A6 PolarHBondContact O-N 3.49Å; A6-M8 VanDerWaalsContact C-N 3.28Å; A6-M8 PolarHBondContact O-N 3.38Å; A6-C9 WeakPolarHBondContact O-CB 3.37Å; A6-C9 PolarHBondContact O-N 3.48Å; A6-C9 VanDerWaalsContact O-N 3.13Å; A6-D10 PolarHBondContact O-N 2.64Å
7	A	90.4	Very high	88.3	Confident	53 Å²	53	68.1 Å²	68.1	44%	0.438	36%	0.36	S	S	.	.	H	α-helix	trans	-60.2	-38.3	178.6	0	0	0	0	0	112.6	E3 D10 Q11	E3-A7 PolarHBondContact O-N 3Å; A7-D10 PolarHBondContact O-N 2.85Å; A7-Q11 PolarHBondContact O-N 3.49Å
8	M	93.7	Very high	88.6	Confident	43 Å²	43	67.1 Å²	67.1	21%	0.212	36%	0.357	C	S	.	.	H	α-helix	trans	-68.6	-39.9	176.1	-172.8	58.6	61.7	0	0	112.1	Q4 V5 A6 D10 Q11 L12 F35 F39	Q4-M8 WeakPolarHBondContact O-CB 3.21Å; Q4-M8 PolarHBondContact O-N 3.44Å; Q4-M8 VanDerWaalsContact O-N 3.14Å; V5-M8 PolarHBondContact O-N 3.5Å; A6-M8 VanDerWaalsContact C-N 3.28Å; A6-M8 PolarHBondContact O-N 3.38Å; M8-D10 VanDerWaalsContact C-N 3.31Å; M8-D10 PolarHBondContact O-N 3.16Å; M8-Q11 PolarHBondContact O-N 3.49Å; M8-L12 HydrophobicContact CG-CD1 4.14Å; M8-L12 WeakPolarHBondContact O-CG 3.2Å; M8-L12 PolarHBondContact O-N 3.43Å; M8-F35 HydrophobicContact SD-CZ 4.11Å; M8-F39 HydrophobicContact CG-CD2 4.3Å; M8-F39 HydrophobicContact CG-CE2 3.6Å; M8-F39 HydrophobicContact CG-CZ 4.3Å; M8-F39 HydrophobicContact SD-CD2 4.03Å; M8-F39 HydrophobicContact SD-CE2 3.93Å
9	C	93.4	Very high	88.8	Confident	3 Å²	3	65.9 Å²	65.9	2%	0.02	35%	0.35	C	S	.	.	H	α-helix	trans	-60.5	-41.5	175	-68.6	0	0	0	0	111.5	V5 A6 Q11 L12 I13 L53	V5-C9 PolarHBondContact O-N 3.25Å; V5-C9 PolarHBondContact O-SG 3Å; A6-C9 WeakPolarHBondContact O-CB 3.37Å; A6-C9 PolarHBondContact O-N 3.48Å; A6-C9 VanDerWaalsContact O-N 3.13Å; C9-Q11 VanDerWaalsContact C-N 3.31Å; C9-Q11 PolarHBondContact O-N 3.32Å; C9-L12 PolarHBondContact O-N 3.34Å; C9-I13 VanDerWaalsContact O-CG1 3.23Å; C9-I13 WeakPolarHBondContact O-CG1 3.33Å; C9-I13 PolarHBondContact O-N 3.49Å; C9-L53 HydrophobicContact CB-CD2 3.93Å; C9-L53 HydrophobicContact CB-CG 4.49Å
10	D	92.9	Very high	89	Confident	95 Å²	95	69.1 Å²	69.1	51%	0.508	36%	0.364	S	S	.	.	H	α-helix	trans	-63.4	-37.2	177.8	-66.1	-22.4	0	0	0	112.3	A6 A7 M8 K14	A6-D10 PolarHBondContact O-N 2.64Å; A7-D10 PolarHBondContact O-N 2.85Å; M8-D10 VanDerWaalsContact C-N 3.31Å; M8-D10 PolarHBondContact O-N 3.16Å; D10-K14 WeakPolarHBondContact O-CG 3.1Å; D10-K14 PolarHBondContact O-N 3.48Å
11	Q	93.7	Very high	89.1	Confident	102 Å²	102	69.1 Å²	69.1	48%	0.477	37%	0.365	S	S	.	.	H	α-helix	trans	-67.6	-43.4	174.5	-71.1	178.7	-7.2	0	0	111.8	A7 M8 C9 K14 A15 F35	A7-Q11 PolarHBondContact O-N 3.49Å; M8-Q11 PolarHBondContact O-N 3.49Å; C9-Q11 VanDerWaalsContact C-N 3.31Å; C9-Q11 PolarHBondContact O-N 3.32Å; Q11-K14 PolarHBondContact O-N 3.1Å; Q11-A15 PolarHBondContact O-N 3Å; Q11-F35 HydrophobicContact CB-CE1 4.33Å; Q11-F35 HydrophobicContact CB-CZ 4.18Å
12	L	94.9	Very high	90.6	Very high	0 Å²	0	65.1 Å²	65.1	0%	0	36%	0.36	C	S	.	.	H	α-helix	trans	-64.4	-40.7	177.3	-69.2	167.1	0	0	0	111.7	M8 C9 K14 A15 V16 F35 F39 C49 L53 F65	M8-L12 HydrophobicContact CG-CD1 4.14Å; M8-L12 WeakPolarHBondContact O-CG 3.2Å; M8-L12 PolarHBondContact O-N 3.43Å; C9-L12 PolarHBondContact O-N 3.34Å; L12-K14 VanDerWaalsContact C-N 3.34Å; L12-K14 PolarHBondContact O-N 3.05Å; L12-A15 PolarHBondContact O-N 3.22Å; L12-V16 VanDerWaalsContact O-CG2 3.26Å; L12-V16 WeakPolarHBondContact O-CG2 3.2Å; L12-V16 PolarHBondContact O-N 2.96Å; L12-F35 HydrophobicContact CD2-CD1 4.37Å; L12-F35 HydrophobicContact CD2-CE1 3.72Å; L12-F35 HydrophobicContact CD2-CZ 4.4Å; L12-F35 HydrophobicContact CG-CE1 4.33Å; L12-F39 HydrophobicContact CD1-CD1 4.05Å; L12-F39 HydrophobicContact CD1-CD2 4.37Å; L12-F39 HydrophobicContact CD1-CE1 3.68Å; L12-F39 HydrophobicContact CD1-CE2 4.02Å; L12-F39 HydrophobicContact CD1-CG 4.39Å; L12-F39 HydrophobicContact CD1-CZ 3.68Å; L12-F39 HydrophobicContact CD2-CB 4.19Å; L12-F39 HydrophobicContact CD2-CD1 3.91Å; L12-F39 HydrophobicContact CD2-CD2 4.27Å; L12-F39 HydrophobicContact CD2-CE1 4.4Å; L12-F39 HydrophobicContact CD2-CG 3.85Å; L12-C49 HydrophobicContact CD1-CB 4.2Å; L12-L53 HydrophobicContact CB-CD1 4.13Å; L12-L53 HydrophobicContact CD1-CD1 3.95Å; L12-F65 HydrophobicContact CB-CE1 4.34Å; L12-F65 HydrophobicContact CD2-CE1 4.08Å; L12-F65 HydrophobicContact CD2-CZ 4.46Å
13	I	94.9	Very high	91.7	Very high	36 Å²	36	70.1 Å²	70.1	19%	0.185	37%	0.37	C	S	.	.	H	α-helix	trans	-58.7	-47.8	175	-70.2	165.5	0	0	0	110	C9 A15 V16 M17 L53 V62	C9-I13 VanDerWaalsContact O-CG1 3.23Å; C9-I13 WeakPolarHBondContact O-CG1 3.33Å; C9-I13 PolarHBondContact O-N 3.49Å; I13-A15 PolarHBondContact O-N 2.81Å; I13-V16 PolarHBondContact O-N 3.25Å; I13-M17 HydrophobicContact CG2-CG 4.41Å; I13-M17 VanDerWaalsContact O-CG 3.27Å; I13-M17 WeakPolarHBondContact O-CG 3.36Å; I13-M17 PolarHBondContact O-N 2.89Å; I13-L53 HydrophobicContact CD1-CD2 3.88Å; I13-L53 HydrophobicContact CG1-CD2 3.59Å; I13-V62 HydrophobicContact CD1-CG1 4.4Å; I13-V62 HydrophobicContact CG1-CG1 3.76Å; I13-V62 HydrophobicContact CG1-CG2 4.32Å; I13-V62 HydrophobicContact CG2-CG2 4.27Å
14	K	93.7	Very high	92.4	Very high	147 Å²	147	62.9 Å²	62.9	64%	0.639	34%	0.338	S	S	*	.	H	α-helix	trans	-59.7	-46.7	176.7	-72.2	174.1	-176.6	179.8	0	112	D10 Q11 L12 V16 M17 V18	D10-K14 WeakPolarHBondContact O-CG 3.1Å; D10-K14 PolarHBondContact O-N 3.48Å; Q11-K14 PolarHBondContact O-N 3.1Å; L12-K14 VanDerWaalsContact C-N 3.34Å; L12-K14 PolarHBondContact O-N 3.05Å; K14-V16 VanDerWaalsContact C-N 3.34Å; K14-V16 PolarHBondContact O-N 3.31Å; K14-M17 PolarHBondContact O-N 3.49Å; K14-V18 WeakPolarHBondContact O-CB 3.49Å; K14-V18 VanDerWaalsContact O-CG2 3.26Å; K14-V18 WeakPolarHBondContact O-CG2 3.29Å; K14-V18 PolarHBondContact O-N 3.26Å
15	A	94.4	Very high	92.7	Very high	10 Å²	10	61.7 Å²	61.7	8%	0.083	34%	0.336	C	S	.	.	H	α-helix	trans	-60.5	-43.5	179.5	0	0	0	0	0	111.9	Q11 L12 I13 V18 M19 A32 F35	Q11-A15 PolarHBondContact O-N 3Å; L12-A15 PolarHBondContact O-N 3.22Å; I13-A15 PolarHBondContact O-N 2.81Å; A15-V18 PolarHBondContact O-N 2.98Å; A15-M19 VanDerWaalsContact O-CB 3.29Å; A15-M19 WeakPolarHBondContact O-CB 3.25Å; A15-M19 PolarHBondContact O-N 2.96Å; A15-A32 HydrophobicContact CB-CB 4.25Å; A15-F35 HydrophobicContact CB-CD1 3.79Å; A15-F35 HydrophobicContact CB-CE1 4.26Å
16	V	94.4	Very high	92.9	Very high	3 Å²	3	66.3 Å²	66.3	2%	0.018	36%	0.356	C	S	.	.	H	α-helix	trans	-65.1	-42.1	177.2	174.2	0	0	0	0	111.5	L12 I13 K14 M19 M20 V61 F65	L12-V16 VanDerWaalsContact O-CG2 3.26Å; L12-V16 WeakPolarHBondContact O-CG2 3.2Å; L12-V16 PolarHBondContact O-N 2.96Å; I13-V16 PolarHBondContact O-N 3.25Å; K14-V16 VanDerWaalsContact C-N 3.34Å; K14-V16 PolarHBondContact O-N 3.31Å; V16-M19 PolarHBondContact O-N 3.43Å; V16-M20 HydrophobicContact CG1-CG 4.37Å; V16-M20 WeakPolarHBondContact O-CB 3.44Å; V16-M20 VanDerWaalsContact O-CG 3.26Å; V16-M20 WeakPolarHBondContact O-CG 3.15Å; V16-M20 PolarHBondContact O-N 2.92Å; V16-V61 HydrophobicContact CG1-CG1 3.73Å; V16-F65 HydrophobicContact CG1-CB 4.44Å; V16-F65 HydrophobicContact CG2-CB 3.98Å; V16-F65 HydrophobicContact CG2-CD1 3.36Å; V16-F65 HydrophobicContact CG2-CD2 3.98Å; V16-F65 HydrophobicContact CG2-CE1 3.7Å; V16-F65 HydrophobicContact CG2-CE2 4.29Å; V16-F65 HydrophobicContact CG2-CG 3.49Å; V16-F65 VanDerWaalsContact CG2-CG 3.49Å; V16-F65 HydrophobicContact CG2-CZ 4.17Å
17	M	92.6	Very high	93.1	Very high	80 Å²	80	70.3 Å²	70.3	39%	0.394	37%	0.374	S	S	.	.	H	α-helix	trans	-64.1	-43.2	177.5	-67.5	-62.6	111.7	0	0	111.7	I13 K14 M19 M20 D21 V61 V62	I13-M17 HydrophobicContact CG2-CG 4.41Å; I13-M17 VanDerWaalsContact O-CG 3.27Å; I13-M17 WeakPolarHBondContact O-CG 3.36Å; I13-M17 PolarHBondContact O-N 2.89Å; K14-M17 PolarHBondContact O-N 3.49Å; M17-M19 VanDerWaalsContact C-N 3.33Å; M17-M19 PolarHBondContact O-N 2.9Å; M17-M20 PolarHBondContact O-N 2.95Å; M17-D21 VanDerWaalsContact O-CB 3.31Å; M17-D21 WeakPolarHBondContact O-CB 3.4Å; M17-D21 PolarHBondContact O-N 2.96Å; M17-V61 HydrophobicContact CE-CB 4.25Å; M17-V61 HydrophobicContact CE-CG1 4.19Å; M17-V62 HydrophobicContact CE-CG2 3.49Å; M17-V62 VanDerWaalsContact CE-CG2 3.49Å
18	V	93.2	Very high	93.2	Very high	50 Å²	50	74.8 Å²	74.8	30%	0.303	38%	0.38	S	S	.	.	H	α-helix	trans	-62.9	-40.3	175.4	170	0	0	0	0	111.1	K14 A15 M20 T24 A32	K14-V18 WeakPolarHBondContact O-CB 3.49Å; K14-V18 VanDerWaalsContact O-CG2 3.26Å; K14-V18 WeakPolarHBondContact O-CG2 3.29Å; K14-V18 PolarHBondContact O-N 3.26Å; A15-V18 PolarHBondContact O-N 2.98Å; V18-M20 VanDerWaalsContact C-N 3.35Å; V18-M20 PolarHBondContact O-N 3.27Å; V18-T24 HydrophobicContact CG1-CG2 3.54Å; V18-T24 WeakPolarHBondContact O-CB 3.31Å; V18-T24 WeakPolarHBondContact O-CG2 3.16Å; V18-T24 PolarHBondContact O-OG1 3.24Å; V18-A32 HydrophobicContact CB-CB 4.35Å; V18-A32 HydrophobicContact CG1-CB 4.04Å
19	M	92.6	Very high	93.1	Very high	46 Å²	46	75.7 Å²	75.7	23%	0.227	38%	0.381	C	S	.	.	H	α-helix	trans	-66.2	-37.2	-179.8	-170.2	176	69.8	0	0	112.6	A15 V16 M17 A32 L33	A15-M19 VanDerWaalsContact O-CB 3.29Å; A15-M19 WeakPolarHBondContact O-CB 3.25Å; A15-M19 PolarHBondContact O-N 2.96Å; V16-M19 PolarHBondContact O-N 3.43Å; M17-M19 VanDerWaalsContact C-N 3.33Å; M17-M19 PolarHBondContact O-N 2.9Å; M19-A32 HydrophobicContact CB-CB 4.49Å; M19-L33 HydrophobicContact SD-CB 4.2Å; M19-L33 HydrophobicContact SD-CD1 3.67Å
20	M	91.6	Very high	93	Very high	128 Å²	128	80 Å²	80	63%	0.631	40%	0.404	S	S	*	.	H	α-helix	trans	-93	-6.5	-174.8	-60.5	-66.7	-99	0	0	113.8	V16 M17 V18 V61	V16-M20 HydrophobicContact CG1-CG 4.37Å; V16-M20 WeakPolarHBondContact O-CB 3.44Å; V16-M20 VanDerWaalsContact O-CG 3.26Å; V16-M20 WeakPolarHBondContact O-CG 3.15Å; V16-M20 PolarHBondContact O-N 2.92Å; M17-M20 PolarHBondContact O-N 2.95Å; V18-M20 VanDerWaalsContact C-N 3.35Å; V18-M20 PolarHBondContact O-N 3.27Å; M20-V61 HydrophobicContact CE-CG1 3.99Å; M20-V61 HydrophobicContact CG-CG1 3.9Å
21	D	92.9	Very high	93	Very high	71 Å²	71	80.9 Å²	80.9	38%	0.38	41%	0.405	S	S	.	.			trans	-81.3	124.9	176.2	175.4	18.5	0	0	0	110.9	M17 E23 T24 R29	M17-D21 VanDerWaalsContact O-CB 3.31Å; M17-D21 WeakPolarHBondContact O-CB 3.4Å; M17-D21 PolarHBondContact O-N 2.96Å; D21-E23 VanDerWaalsContact C-N 3.27Å; D21-E23 PolarHBondContact O-N 3.24Å; D21-E23 PolarHBondContact OD1-N 3.11Å; D21-T24 PolarHBondContact O-N 3.03Å; D21-T24 PolarHBondContact OD2-OG1 3.35Å; D21-R29 PolarHBondContact O-NH2 3.22Å
22	A	91.4	Very high	92.9	Very high	95 Å²	95	76.5 Å²	76.5	79%	0.785	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.5	-28.4	-180	0	0	0	0	0	112.5	T24 R29	A22-T24 VanDerWaalsContact C-N 3.31Å; A22-T24 PolarHBondContact O-N 3.28Å; A22-R29 PolarHBondContact O-NH2 2.74Å
23	E	94.4	Very high	92.8	Very high	182 Å²	182	80 Å²	80	85%	0.85	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.6	-10.6	-177.5	-60.6	-169.9	166.2	0	0	113.2	D21	D21-E23 VanDerWaalsContact C-N 3.27Å; D21-E23 PolarHBondContact O-N 3.24Å; D21-E23 PolarHBondContact OD1-N 3.11Å
24	T	92.9	Very high	92.7	Very high	24 Å²	24	84.6 Å²	84.6	15%	0.147	42%	0.423	C	S	.	.	S	Bend	trans	-67.9	135.3	-179	-73.3	0	0	0	0	111.8	V18 D21 A22 R29	V18-T24 HydrophobicContact CG1-CG2 3.54Å; V18-T24 WeakPolarHBondContact O-CB 3.31Å; V18-T24 WeakPolarHBondContact O-CG2 3.16Å; V18-T24 PolarHBondContact O-OG1 3.24Å; D21-T24 PolarHBondContact O-N 3.03Å; D21-T24 PolarHBondContact OD2-OG1 3.35Å; A22-T24 VanDerWaalsContact C-N 3.31Å; A22-T24 PolarHBondContact O-N 3.28Å; T24-R29 HydrophobicContact CG2-CB 4.16Å; T24-R29 VanDerWaalsContact O-CZ 3.23Å; T24-R29 PolarHBondContact O-NH1 3.35Å; T24-R29 PolarHBondContact O-NH2 2.69Å
25	N	92.7	Very high	92.7	Very high	93 Å²	93	80.8 Å²	80.8	50%	0.497	41%	0.406	S	S	.	.			trans	-64.2	142.8	175	-175.3	-55.5	0	0	0	111.4	I27 Y28 R29	N25-I27 PolarHBondContact O-N 2.65Å; N25-I27 VanDerWaalsContact O-N 3.13Å; N25-I27 PolarHBondContact OD1-N 2.97Å; N25-Y28 HydrophobicContact CB-CD2 4.09Å; N25-Y28 PolarHBondContact O-N 3.47Å; N25-Y28 VanDerWaalsContact O-N 3.1Å; N25-R29 PolarHBondContact O-N 3.02Å
26	Q	91.8	Very high	92.7	Very high	109 Å²	109	80.3 Å²	80.3	51%	0.509	40%	0.403	S	S	.	.	H	α-helix	trans	-52.8	-36.1	-178.6	-169.8	64.9	-6.5	0	0	114.1	R29 L30	Q26-R29 PolarHBondContact O-N 2.94Å; Q26-L30 HydrophobicContact CG-CD1 4.09Å; Q26-L30 HydrophobicContact CG-CG 4.4Å; Q26-L30 WeakPolarHBondContact O-CB 3.49Å; Q26-L30 VanDerWaalsContact O-CG 3.27Å; Q26-L30 WeakPolarHBondContact O-CG 3.43Å; Q26-L30 PolarHBondContact O-N 3.02Å
27	I	92.9	Very high	92.5	Very high	107 Å²	107	83.7 Å²	83.7	55%	0.549	42%	0.418	S	S	.	.	H	α-helix	trans	-61.7	-51.5	178.4	-61.5	173	0	0	0	110.5	N25 R29 L30 E31	N25-I27 PolarHBondContact O-N 2.65Å; N25-I27 VanDerWaalsContact O-N 3.13Å; N25-I27 PolarHBondContact OD1-N 2.97Å; I27-R29 VanDerWaalsContact C-N 3.33Å; I27-R29 PolarHBondContact O-N 2.78Å; I27-L30 PolarHBondContact O-N 2.93Å; I27-E31 WeakPolarHBondContact O-CG 3.46Å; I27-E31 PolarHBondContact O-N 3.29Å
28	Y	91.1	Very high	92.4	Very high	147 Å²	147	84.6 Å²	84.6	58%	0.576	42%	0.421	S	S	*	.	H	α-helix	trans	-68	-33.4	179.6	-66.6	-59.9	0	0	0	112.3	N25 E31 A32	N25-Y28 HydrophobicContact CB-CD2 4.09Å; N25-Y28 PolarHBondContact O-N 3.47Å; N25-Y28 VanDerWaalsContact O-N 3.1Å; Y28-E31 PolarHBondContact O-N 3.06Å; Y28-A32 VanDerWaalsContact O-CB 3.3Å; Y28-A32 WeakPolarHBondContact O-CB 3.35Å; Y28-A32 PolarHBondContact O-N 3.32Å
29	R	93.1	Very high	92.4	Very high	61 Å²	61	82.7 Å²	82.7	23%	0.23	41%	0.409	C	S	.	.	H	α-helix	trans	-62.9	-44.9	173.7	-172.5	176.3	-68.5	107.8	1.6	111.3	D21 A22 T24 N25 Q26 I27 A32 L33	D21-R29 PolarHBondContact O-NH2 3.22Å; A22-R29 PolarHBondContact O-NH2 2.74Å; T24-R29 HydrophobicContact CG2-CB 4.16Å; T24-R29 VanDerWaalsContact O-CZ 3.23Å; T24-R29 PolarHBondContact O-NH1 3.35Å; T24-R29 PolarHBondContact O-NH2 2.69Å; N25-R29 PolarHBondContact O-N 3.02Å; Q26-R29 PolarHBondContact O-N 2.94Å; I27-R29 VanDerWaalsContact C-N 3.33Å; I27-R29 PolarHBondContact O-N 2.78Å; R29-A32 PolarHBondContact O-N 2.8Å; R29-L33 WeakPolarHBondContact O-CB 3.35Å; R29-L33 PolarHBondContact O-N 3.25Å
30	L	91.3	Very high	92.3	Very high	93 Å²	93	80.9 Å²	80.9	49%	0.487	40%	0.4	S	S	.	.	H	α-helix	trans	-66.4	-40.4	176.8	-72.1	171.7	0	0	0	112.1	Q26 I27 L33 K34	Q26-L30 HydrophobicContact CG-CD1 4.09Å; Q26-L30 HydrophobicContact CG-CG 4.4Å; Q26-L30 WeakPolarHBondContact O-CB 3.49Å; Q26-L30 VanDerWaalsContact O-CG 3.27Å; Q26-L30 WeakPolarHBondContact O-CG 3.43Å; Q26-L30 PolarHBondContact O-N 3.02Å; I27-L30 PolarHBondContact O-N 2.93Å; L30-L33 PolarHBondContact O-N 2.89Å; L30-K34 VanDerWaalsContact O-CB 3.25Å; L30-K34 WeakPolarHBondContact O-CB 3.16Å; L30-K34 PolarHBondContact O-N 3.28Å
31	E	92.6	Very high	91.9	Very high	115 Å²	115	79.8 Å²	79.8	54%	0.537	39%	0.394	S	S	.	.	H	α-helix	trans	-62.5	-45.1	174.5	-74.8	-179	176.8	0	0	112	I27 Y28 K34 F35	I27-E31 WeakPolarHBondContact O-CG 3.46Å; I27-E31 PolarHBondContact O-N 3.29Å; Y28-E31 PolarHBondContact O-N 3.06Å; E31-K34 PolarHBondContact O-N 3.42Å; E31-F35 WeakPolarHBondContact O-CB 3.41Å; E31-F35 PolarHBondContact O-N 3.21Å
32	A	92.4	Very high	91.5	Very high	9 Å²	9	81.6 Å²	81.6	7%	0.074	41%	0.407	C	S	.	.	H	α-helix	trans	-63.9	-43.1	176.9	0	0	0	0	0	112.1	A15 V18 M19 Y28 R29 F35 C36	A15-A32 HydrophobicContact CB-CB 4.25Å; V18-A32 HydrophobicContact CB-CB 4.35Å; V18-A32 HydrophobicContact CG1-CB 4.04Å; M19-A32 HydrophobicContact CB-CB 4.49Å; Y28-A32 VanDerWaalsContact O-CB 3.3Å; Y28-A32 WeakPolarHBondContact O-CB 3.35Å; Y28-A32 PolarHBondContact O-N 3.32Å; R29-A32 PolarHBondContact O-N 2.8Å; A32-F35 PolarHBondContact O-N 3.1Å; A32-C36 WeakPolarHBondContact O-CB 3.49Å; A32-C36 PolarHBondContact O-N 3.17Å; A32-C36 PolarHBondContact O-SG 3.08Å; A32-C36 VanDerWaalsContact O-SG 3.33Å
33	L	91.9	Very high	91.3	Very high	75 Å²	75	78.1 Å²	78.1	39%	0.393	38%	0.377	S	S	.	.	H	α-helix	trans	-60.7	-49	175.2	178.3	67.2	0	0	0	111	M19 R29 L30 F35 C36 E37	M19-L33 HydrophobicContact SD-CB 4.2Å; M19-L33 HydrophobicContact SD-CD1 3.67Å; R29-L33 WeakPolarHBondContact O-CB 3.35Å; R29-L33 PolarHBondContact O-N 3.25Å; L30-L33 PolarHBondContact O-N 2.89Å; L33-F35 VanDerWaalsContact C-N 3.34Å; L33-F35 PolarHBondContact O-N 3.01Å; L33-C36 PolarHBondContact O-N 3.12Å; L33-E37 HydrophobicContact CD1-CG 4.44Å; L33-E37 PolarHBondContact O-N 3.17Å
34	K	92.6	Very high	90.9	Very high	131 Å²	131	75.7 Å²	75.7	57%	0.57	38%	0.375	S	S	*	.	H	α-helix	trans	-58.9	-45.4	178.6	-177.6	175.3	175.1	178.1	0	111.3	L30 E31 C36 E37 E38	L30-K34 VanDerWaalsContact O-CB 3.25Å; L30-K34 WeakPolarHBondContact O-CB 3.16Å; L30-K34 PolarHBondContact O-N 3.28Å; E31-K34 PolarHBondContact O-N 3.42Å; K34-C36 PolarHBondContact O-N 3.06Å; K34-E37 PolarHBondContact O-N 2.88Å; K34-E38 WeakPolarHBondContact CE-OE1 3.45Å; K34-E38 HydrophobicContact CG-CG 4.35Å; K34-E38 IonicContact NZ-OE1 3.6Å; K34-E38 WeakPolarHBondContact O-CB 3.3Å; K34-E38 WeakPolarHBondContact O-CG 3.3Å; K34-E38 PolarHBondContact O-N 3.47Å
35	F	94.4	Very high	90.7	Very high	67 Å²	67	75.4 Å²	75.4	29%	0.294	37%	0.372	S	S	.	.	H	α-helix	trans	-58.6	-45.4	175.6	175	-106.1	0	0	0	112.2	M8 Q11 L12 A15 E31 A32 L33 F39	M8-F35 HydrophobicContact SD-CZ 4.11Å; Q11-F35 HydrophobicContact CB-CE1 4.33Å; Q11-F35 HydrophobicContact CB-CZ 4.18Å; L12-F35 HydrophobicContact CD2-CD1 4.37Å; L12-F35 HydrophobicContact CD2-CE1 3.72Å; L12-F35 HydrophobicContact CD2-CZ 4.4Å; L12-F35 HydrophobicContact CG-CE1 4.33Å; A15-F35 HydrophobicContact CB-CD1 3.79Å; A15-F35 HydrophobicContact CB-CE1 4.26Å; E31-F35 WeakPolarHBondContact O-CB 3.41Å; E31-F35 PolarHBondContact O-N 3.21Å; A32-F35 PolarHBondContact O-N 3.1Å; L33-F35 VanDerWaalsContact C-N 3.34Å; L33-F35 PolarHBondContact O-N 3.01Å; F35-F39 WeakPolarHBondContact O-CB 3.46Å; F35-F39 PolarHBondContact O-N 2.99Å
36	C	93.3	Very high	90.6	Very high	1 Å²	1	71 Å²	71	1%	0.007	35%	0.349	C	S	.	.	H	α-helix	trans	-64	-42.5	177.9	-75	0	0	0	0	112.8	A32 L33 K34 K40 F65	A32-C36 WeakPolarHBondContact O-CB 3.49Å; A32-C36 PolarHBondContact O-N 3.17Å; A32-C36 PolarHBondContact O-SG 3.08Å; A32-C36 VanDerWaalsContact O-SG 3.33Å; L33-C36 PolarHBondContact O-N 3.12Å; K34-C36 PolarHBondContact O-N 3.06Å; C36-K40 WeakPolarHBondContact O-CE 3.47Å; C36-K40 WeakPolarHBondContact O-CG 3.38Å; C36-K40 PolarHBondContact O-N 3.23Å; C36-K40 VanDerWaalsContact O-N 3.13Å; C36-F65 HydrophobicContact CB-CE2 4.03Å; C36-F65 HydrophobicContact CB-CZ 3.77Å
37	E	90.8	Very high	90.6	Very high	74 Å²	74	67.6 Å²	67.6	35%	0.346	34%	0.335	S	S	.	.	H	α-helix	trans	-67.7	-47.1	176.7	-69.8	-56	150.1	0	0	112	L33 K34 F39 K40 E41	L33-E37 HydrophobicContact CD1-CG 4.44Å; L33-E37 PolarHBondContact O-N 3.17Å; K34-E37 PolarHBondContact O-N 2.88Å; E37-F39 VanDerWaalsContact C-N 3.26Å; E37-F39 PolarHBondContact O-N 3Å; E37-K40 VanDerWaalsContact CD-CE 3.44Å; E37-K40 PolarHBondContact O-N 2.72Å; E37-K40 VanDerWaalsContact O-N 3.12Å; E37-K40 WeakPolarHBondContact OE1-CE 3.48Å; E37-K40 IonicContact OE1-NZ 3.52Å; E37-K40 PolarHBondContact OE1-NZ 3.43Å; E37-K40 WeakPolarHBondContact OE2-CE 3.4Å; E37-K40 IonicContact OE2-NZ 3.73Å; E37-K40 PolarHBondContact OE2-NZ 2.91Å; E37-E41 WeakPolarHBondContact O-CG 3.32Å; E37-E41 PolarHBondContact O-N 3.24Å
38	E	91.2	Very high	90.5	Very high	98 Å²	98	65.1 Å²	65.1	46%	0.458	33%	0.326	S	S	.	.	H	α-helix	trans	-57.7	-40.4	176.2	-76.2	179.4	-179.3	0	0	111.5	K34 E41 T42	K34-E38 WeakPolarHBondContact CE-OE1 3.45Å; K34-E38 HydrophobicContact CG-CG 4.35Å; K34-E38 IonicContact NZ-OE1 3.6Å; K34-E38 WeakPolarHBondContact O-CB 3.3Å; K34-E38 WeakPolarHBondContact O-CG 3.3Å; K34-E38 PolarHBondContact O-N 3.47Å; E38-E41 PolarHBondContact O-N 2.96Å; E38-T42 WeakPolarHBondContact O-CB 3.41Å; E38-T42 PolarHBondContact O-N 3.39Å; E38-T42 PolarHBondContact O-OG1 3.27Å
39	F	93.3	Very high	90.6	Very high	10 Å²	10	58.1 Å²	58.1	4%	0.044	30%	0.299	C	S	.	.	H	α-helix	trans	-59.8	-51.6	174.8	179	-95	0	0	0	111.4	M8 L12 F35 E37 E41 S43 C46 C49 I69	M8-F39 HydrophobicContact CG-CD2 4.3Å; M8-F39 HydrophobicContact CG-CE2 3.6Å; M8-F39 HydrophobicContact CG-CZ 4.3Å; M8-F39 HydrophobicContact SD-CD2 4.03Å; M8-F39 HydrophobicContact SD-CE2 3.93Å; L12-F39 HydrophobicContact CD1-CD1 4.05Å; L12-F39 HydrophobicContact CD1-CD2 4.37Å; L12-F39 HydrophobicContact CD1-CE1 3.68Å; L12-F39 HydrophobicContact CD1-CE2 4.02Å; L12-F39 HydrophobicContact CD1-CG 4.39Å; L12-F39 HydrophobicContact CD1-CZ 3.68Å; L12-F39 HydrophobicContact CD2-CB 4.19Å; L12-F39 HydrophobicContact CD2-CD1 3.91Å; L12-F39 HydrophobicContact CD2-CD2 4.27Å; L12-F39 HydrophobicContact CD2-CE1 4.4Å; L12-F39 HydrophobicContact CD2-CG 3.85Å; F35-F39 WeakPolarHBondContact O-CB 3.46Å; F35-F39 PolarHBondContact O-N 2.99Å; E37-F39 VanDerWaalsContact C-N 3.26Å; E37-F39 PolarHBondContact O-N 3Å; F39-E41 VanDerWaalsContact C-N 3.25Å; F39-E41 PolarHBondContact O-N 3.43Å; F39-S43 WeakPolarHBondContact CE2-OG 3.29Å; F39-S43 WeakPolarHBondContact O-CB 3.47Å; F39-S43 PolarHBondContact O-N 2.88Å; F39-C46 PolarHBondContact O-SG 3.22Å; F39-C49 HydrophobicContact CE1-CB 4.41Å; F39-C49 HydrophobicContact CZ-CB 3.86Å; F39-I69 HydrophobicContact CD1-CD1 4.38Å; F39-I69 HydrophobicContact CE1-CD1 4.02Å; F39-I69 HydrophobicContact CE1-CG2 4.32Å
40	K	89.4	Confident	90.6	Very high	8 Å²	8	55.2 Å²	55.2	4%	0.035	29%	0.288	C	S	.	.	H	α-helix	trans	-62	-32.6	179.7	-70.5	-179.9	-57.6	166.7	0	112.4	C36 E37 F65 I69 Q72 R77	C36-K40 WeakPolarHBondContact O-CE 3.47Å; C36-K40 WeakPolarHBondContact O-CG 3.38Å; C36-K40 PolarHBondContact O-N 3.23Å; C36-K40 VanDerWaalsContact O-N 3.13Å; E37-K40 VanDerWaalsContact CD-CE 3.44Å; E37-K40 PolarHBondContact O-N 2.72Å; E37-K40 VanDerWaalsContact O-N 3.12Å; E37-K40 WeakPolarHBondContact OE1-CE 3.48Å; E37-K40 IonicContact OE1-NZ 3.52Å; E37-K40 PolarHBondContact OE1-NZ 3.43Å; E37-K40 WeakPolarHBondContact OE2-CE 3.4Å; E37-K40 IonicContact OE2-NZ 3.73Å; E37-K40 PolarHBondContact OE2-NZ 2.91Å; K40-F65 HydrophobicContact CD-CE2 4.3Å; K40-I69 HydrophobicContact CD-CG1 4.23Å; K40-I69 HydrophobicContact CG-CG1 3.93Å; K40-Q72 HydrophobicContact CB-CG 4.33Å; K40-Q72 VanDerWaalsContact CD-OE1 3.28Å; K40-R77 PolarHBondContact O-NH2 3.38Å; K40-R77 VanDerWaalsContact O-NH2 3.13Å
41	E	84.4	Confident	90.7	Very high	106 Å²	106	52.8 Å²	52.8	50%	0.495	28%	0.275	S	S	.	.	H	α-helix	trans	-84.5	-34.7	-178.1	-69.2	-148.4	134.2	0	0	114.7	E37 E38 F39 R77 K1182	E37-E41 WeakPolarHBondContact O-CG 3.32Å; E37-E41 PolarHBondContact O-N 3.24Å; E38-E41 PolarHBondContact O-N 2.96Å; F39-E41 VanDerWaalsContact C-N 3.25Å; F39-E41 PolarHBondContact O-N 3.43Å; E41-R77 PolarHBondContact O-NH2 3.39Å; E41-K1182 IonicContact OE1-NZ 2.81Å; E41-K1182 PolarHBondContact OE1-NZ 2.9Å
42	T	83.9	Confident	90.7	Very high	108 Å²	108	53.4 Å²	53.4	66%	0.663	27%	0.273	S	S	*	.	H	α-helix	trans	-117.4	-27.8	-169.2	66	0	0	0	0	115.6	E38 R77	E38-T42 WeakPolarHBondContact O-CB 3.41Å; E38-T42 PolarHBondContact O-N 3.39Å; E38-T42 PolarHBondContact O-OG1 3.27Å; T42-R77 VanDerWaalsContact C-NH2 3.33Å; T42-R77 VanDerWaalsContact N-NH2 3.11Å
43	S	87.9	Confident	90.8	Very high	22 Å²	22	53 Å²	53	15%	0.154	27%	0.269	C	S	.	.			trans	-74.8	135	-169.4	179.4	0	0	0	0	113.5	F39 L45 C46 R77	F39-S43 WeakPolarHBondContact CE2-OG 3.29Å; F39-S43 WeakPolarHBondContact O-CB 3.47Å; F39-S43 PolarHBondContact O-N 2.88Å; S43-L45 VanDerWaalsContact C-N 3.25Å; S43-L45 PolarHBondContact O-N 3.41Å; S43-L45 PolarHBondContact OG-N 3.2Å; S43-C46 PolarHBondContact O-SG 3.37Å; S43-R77 PolarHBondContact O-NH1 2.83Å; S43-R77 PolarHBondContact O-NH2 3.16Å
44	T	85.2	Confident	90.9	Very high	132 Å²	132	49.6 Å²	49.6	81%	0.81	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.3	-13.9	172.5	55	0	0	0	0	113.2	C46	T44-C46 VanDerWaalsContact C-N 3.3Å; T44-C46 PolarHBondContact O-N 3.14Å
45	L	89.6	Confident	90.9	Very high	17 Å²	17	47.3 Å²	47.3	9%	0.089	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.2	8.1	-177.9	-57.2	177.8	0	0	0	113.6	Q4 V5 S43 V47 P48 C49	Q4-L45 HydrophobicContact CG-CD1 4.13Å; V5-L45 HydrophobicContact CG2-CD2 4.27Å; S43-L45 VanDerWaalsContact C-N 3.25Å; S43-L45 PolarHBondContact O-N 3.41Å; S43-L45 PolarHBondContact OG-N 3.2Å; L45-V47 PolarHBondContact O-N 2.97Å; L45-P48 HydrophobicContact CB-CG 4.49Å; L45-P48 VanDerWaalsContact O-CD 3.29Å; L45-P48 WeakPolarHBondContact O-CD 3.4Å; L45-P48 WeakPolarHBondContact O-CG 3.41Å; L45-C49 VanDerWaalsContact O-CB 3.31Å; L45-C49 WeakPolarHBondContact O-CB 3.37Å; L45-C49 PolarHBondContact O-N 3.13Å; L45-C49 PolarHBondContact O-SG 3.28Å; L45-C49 VanDerWaalsContact O-SG 3.35Å
46	C	90.4	Very high	90.8	Very high	1 Å²	1	47.4 Å²	47.4	1%	0.007	25%	0.246	C	C	.	.	H	α-helix	trans	-57.2	-46.4	-175	-73.2	0	0	0	0	113.6	F39 S43 T44 G50 I69 V73 R77	F39-C46 PolarHBondContact O-SG 3.22Å; S43-C46 PolarHBondContact O-SG 3.37Å; T44-C46 VanDerWaalsContact C-N 3.3Å; T44-C46 PolarHBondContact O-N 3.14Å; C46-G50 WeakPolarHBondContact O-CA 3.44Å; C46-G50 PolarHBondContact O-N 2.97Å; C46-I69 HydrophobicContact CB-CG2 3.72Å; C46-I69 WeakPolarHBondContact O-CG2 3.42Å; C46-V73 HydrophobicContact CB-CG2 3.46Å; C46-V73 VanDerWaalsContact CB-CG2 3.46Å; C46-R77 PolarHBondContact SG-NH1 2.93Å; C46-R77 VanDerWaalsContact SG-NH1 3.39Å
47	V	90.6	Very high	90.6	Very high	37 Å²	37	51.8 Å²	51.8	22%	0.224	28%	0.277	C	S	.	.	H	α-helix	trans	-64.6	-54.6	-179.3	177.4	0	0	0	0	112.3	L45 C49 G50 L51 L70 V73 L89	L45-V47 PolarHBondContact O-N 2.97Å; V47-C49 PolarHBondContact O-N 3.06Å; V47-G50 PolarHBondContact O-N 3.1Å; V47-L51 HydrophobicContact CG1-CD1 4.06Å; V47-L51 WeakPolarHBondContact O-CG 3.26Å; V47-L51 PolarHBondContact O-N 3.15Å; V47-L70 HydrophobicContact CG1-CD2 4.43Å; V47-V73 HydrophobicContact CG2-CB 4.48Å; V47-V73 HydrophobicContact CG2-CG1 3.8Å; V47-V73 HydrophobicContact CG2-CG2 4.32Å; V47-L89 HydrophobicContact CG1-CD1 4.12Å
48	P	91.5	Very high	90.7	Very high	55 Å²	55	50.9 Å²	50.9	36%	0.357	27%	0.272	S	S	.	.	H	α-helix	trans	-66	-35.9	-179.6	23.6	-33.5	0	0	0	113.4	V5 L45 R52	V5-P48 HydrophobicContact CG1-CB 4.27Å; V5-P48 HydrophobicContact CG2-CB 4.17Å; V5-P48 HydrophobicContact CG2-CG 4.24Å; L45-P48 HydrophobicContact CB-CG 4.49Å; L45-P48 VanDerWaalsContact O-CD 3.29Å; L45-P48 WeakPolarHBondContact O-CD 3.4Å; L45-P48 WeakPolarHBondContact O-CG 3.41Å; P48-R52 WeakPolarHBondContact O-CB 3.27Å; P48-R52 PolarHBondContact O-N 3.2Å
49	C	93.2	Very high	90.8	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-68.1	-45.7	173.5	-67.9	0	0	0	0	111.4	L12 F39 L45 V47 L51 R52 L53	L12-C49 HydrophobicContact CD1-CB 4.2Å; F39-C49 HydrophobicContact CE1-CB 4.41Å; F39-C49 HydrophobicContact CZ-CB 3.86Å; L45-C49 VanDerWaalsContact O-CB 3.31Å; L45-C49 WeakPolarHBondContact O-CB 3.37Å; L45-C49 PolarHBondContact O-N 3.13Å; L45-C49 PolarHBondContact O-SG 3.28Å; L45-C49 VanDerWaalsContact O-SG 3.35Å; V47-C49 PolarHBondContact O-N 3.06Å; C49-L51 PolarHBondContact O-N 2.96Å; C49-R52 PolarHBondContact O-N 3.4Å; C49-L53 WeakPolarHBondContact O-CB 3.35Å; C49-L53 WeakPolarHBondContact O-CG 3.4Å; C49-L53 PolarHBondContact O-N 3.25Å
50	G	93.4	Very high	90.7	Very high	0 Å²	0	50.4 Å²	50.4	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-58	-45	179.6	0	0	0	0	0	112.6	C46 V47 R52 L53 A54	C46-G50 WeakPolarHBondContact O-CA 3.44Å; C46-G50 PolarHBondContact O-N 2.97Å; V47-G50 PolarHBondContact O-N 3.1Å; G50-R52 PolarHBondContact O-N 3.25Å; G50-L53 PolarHBondContact O-N 3.46Å; G50-A54 VanDerWaalsContact O-CB 3.29Å; G50-A54 WeakPolarHBondContact O-CB 3.42Å; G50-A54 PolarHBondContact O-N 3Å
51	L	92.9	Very high	90.9	Very high	43 Å²	43	52.7 Å²	52.7	23%	0.225	30%	0.296	C	S	.	.	H	α-helix	trans	-63.2	-41	176.1	-71.9	171.6	0	0	0	112.6	V47 C49 A54 L70 C92 L96	V47-L51 HydrophobicContact CG1-CD1 4.06Å; V47-L51 WeakPolarHBondContact O-CG 3.26Å; V47-L51 PolarHBondContact O-N 3.15Å; C49-L51 PolarHBondContact O-N 2.96Å; L51-A54 PolarHBondContact O-N 3.45Å; L51-L70 HydrophobicContact CD2-CD1 3.79Å; L51-L70 HydrophobicContact CG-CD1 4.24Å; L51-L70 HydrophobicContact CG-CD2 4.22Å; L51-C92 HydrophobicContact CD1-CB 4.02Å; L51-C92 HydrophobicContact CD2-CB 3.84Å; L51-L96 HydrophobicContact CD2-CD1 3.87Å
52	R	92.9	Very high	91.4	Very high	128 Å²	128	47.7 Å²	47.7	48%	0.483	27%	0.272	S	S	.	.	H	α-helix	trans	-70.3	-36.7	179.5	-173.8	170.5	-178	151.4	-0.4	112.6	P48 C49 G50 A54 D55	P48-R52 WeakPolarHBondContact O-CB 3.27Å; P48-R52 PolarHBondContact O-N 3.2Å; C49-R52 PolarHBondContact O-N 3.4Å; G50-R52 PolarHBondContact O-N 3.25Å; R52-A54 VanDerWaalsContact C-N 3.33Å; R52-D55 WeakPolarHBondContact O-CB 3.44Å
53	L	94.6	Very high	91.9	Very high	1 Å²	1	42.9 Å²	42.9	1%	0.005	24%	0.242	C	C	.	.	H	α-helix	trans	-71.8	-29.1	176.2	-66.3	173.6	0	0	0	111.9	C9 L12 I13 C49 G50 D55 V62 R63 F65 I69	C9-L53 HydrophobicContact CB-CD2 3.93Å; C9-L53 HydrophobicContact CB-CG 4.49Å; L12-L53 HydrophobicContact CB-CD1 4.13Å; L12-L53 HydrophobicContact CD1-CD1 3.95Å; I13-L53 HydrophobicContact CD1-CD2 3.88Å; I13-L53 HydrophobicContact CG1-CD2 3.59Å; C49-L53 WeakPolarHBondContact O-CB 3.35Å; C49-L53 WeakPolarHBondContact O-CG 3.4Å; C49-L53 PolarHBondContact O-N 3.25Å; G50-L53 PolarHBondContact O-N 3.46Å; L53-D55 VanDerWaalsContact C-N 3.25Å; L53-D55 PolarHBondContact O-N 3.49Å; L53-V62 HydrophobicContact CB-CG1 4.12Å; L53-V62 HydrophobicContact CD2-CG1 3.7Å; L53-V62 HydrophobicContact CG-CG1 4.45Å; L53-R63 VanDerWaalsContact O-CA 3.3Å; L53-R63 WeakPolarHBondContact O-CA 3.06Å; L53-F65 HydrophobicContact CD1-CD1 4.31Å; L53-I69 HydrophobicContact CD1-CD1 4Å
54	A	94.4	Very high	92.3	Very high	3 Å²	3	44 Å²	44	3%	0.025	25%	0.245	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.3	-6.1	177.5	0	0	0	0	0	114.7	G50 L51 R52 L67	G50-A54 VanDerWaalsContact O-CB 3.29Å; G50-A54 WeakPolarHBondContact O-CB 3.42Å; G50-A54 PolarHBondContact O-N 3Å; L51-A54 PolarHBondContact O-N 3.45Å; R52-A54 VanDerWaalsContact C-N 3.33Å; A54-L67 HydrophobicContact CB-CD2 3.79Å; A54-L67 HydrophobicContact CB-CG 4.02Å
55	D	92.8	Very high	92.7	Very high	82 Å²	82	38.1 Å²	38.1	44%	0.439	21%	0.208	S	C	.	.	S	Bend	trans	-61.3	144.6	-179.3	-167.5	-80.7	0	0	0	112.4	R52 L53 S57 Q58 R63	R52-D55 WeakPolarHBondContact O-CB 3.44Å; L53-D55 VanDerWaalsContact C-N 3.25Å; L53-D55 PolarHBondContact O-N 3.49Å; D55-S57 PolarHBondContact O-N 3.48Å; D55-S57 VanDerWaalsContact O-N 3.12Å; D55-S57 WeakPolarHBondContact OD1-CB 3.47Å; D55-S57 PolarHBondContact OD1-N 3.12Å; D55-S57 PolarHBondContact OD1-OG 3.48Å; D55-Q58 WeakPolarHBondContact O-CB 3.26Å; D55-Q58 PolarHBondContact O-N 2.87Å; D55-R63 VanDerWaalsContact O-CD 3.25Å; D55-R63 WeakPolarHBondContact O-CD 3.27Å; D55-R63 VanDerWaalsContact O-CG 3.26Å; D55-R63 WeakPolarHBondContact O-CG 3.42Å
56	K	91	Very high	93	Very high	70 Å²	70	37.3 Å²	37.3	30%	0.304	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.6	-23.8	179.3	-63.6	-178.6	-176.1	-176.7	0	114.1	Q58 T99 G100 T101	K56-Q58 PolarHBondContact O-N 2.95Å; K56-T99 WeakPolarHBondContact CE-O 3.19Å; K56-T99 PolarHBondContact NZ-O 3.35Å; K56-G100 VanDerWaalsContact CE-CA 3.45Å; K56-G100 VanDerWaalsContact CE-O 3.25Å; K56-G100 WeakPolarHBondContact CE-O 3.39Å; K56-G100 WeakPolarHBondContact CG-O 3.36Å; K56-T101 WeakPolarHBondContact CE-O 3.38Å; K56-T101 PolarHBondContact NZ-O 3.34Å
57	S	90.1	Very high	93.3	Very high	93 Å²	93	37.5 Å²	37.5	65%	0.65	21%	0.205	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70.1	-15.9	178.5	80.4	0	0	0	0	112.8	D55	D55-S57 PolarHBondContact O-N 3.48Å; D55-S57 VanDerWaalsContact O-N 3.12Å; D55-S57 WeakPolarHBondContact OD1-CB 3.47Å; D55-S57 PolarHBondContact OD1-N 3.12Å; D55-S57 PolarHBondContact OD1-OG 3.48Å
58	Q	92.9	Very high	93.4	Very high	54 Å²	54	38.9 Å²	38.9	25%	0.252	21%	0.209	S	C	.	.	S	Bend	trans	-90.3	155.9	-177.6	-62.2	-63.5	-18.3	0	0	111.9	D55 K56 V62 R63	D55-Q58 WeakPolarHBondContact O-CB 3.26Å; D55-Q58 PolarHBondContact O-N 2.87Å; K56-Q58 PolarHBondContact O-N 2.95Å; Q58-V62 HydrophobicContact CB-CB 4.25Å; Q58-V62 HydrophobicContact CB-CG1 4.13Å; Q58-V62 HydrophobicContact CG-CG1 4.39Å; Q58-R63 HydrophobicContact CB-CG 3.87Å; Q58-R63 WeakPolarHBondContact O-CD 3.46Å
59	P	92	Very high	93.6	Very high	71 Å²	71	36.3 Å²	36.3	46%	0.461	19%	0.192	S	C	.	.			trans	-59.1	147.7	171.9	-22.2	33	0	0	0	112.3	V61 V62 R63	P59-V61 PolarHBondContact O-N 2.96Å; P59-V61 VanDerWaalsContact O-N 3.15Å; P59-V62 HydrophobicContact CB-CG2 4.31Å; P59-V62 HydrophobicContact CG-CG2 4.28Å; P59-V62 WeakPolarHBondContact O-CB 3.41Å; P59-V62 PolarHBondContact O-N 3.49Å; P59-R63 WeakPolarHBondContact O-CG 3.32Å; P59-R63 PolarHBondContact O-N 3.37Å
60	A	92.2	Very high	93.7	Very high	27 Å²	27	36.5 Å²	36.5	22%	0.223	19%	0.193	C	C	.	.	H	α-helix	trans	-53.9	-38.3	-177.1	0	0	0	0	0	113.7	V62 R63 H64 E108 V111	A60-V62 PolarHBondContact O-N 3Å; A60-R63 PolarHBondContact O-N 2.65Å; A60-H64 WeakPolarHBondContact O-CB 3.13Å; A60-H64 PolarHBondContact O-N 3.21Å; A60-E108 HydrophobicContact CB-CG 3.96Å; A60-V111 HydrophobicContact CB-CG2 4.34Å
61	V	93.2	Very high	93.6	Very high	56 Å²	56	37 Å²	37	34%	0.339	20%	0.195	S	C	.	.	H	α-helix	trans	-60.9	-43.1	176.2	-179.3	0	0	0	0	111.8	V16 M17 M20 P59 F65	V16-V61 HydrophobicContact CG1-CG1 3.73Å; M17-V61 HydrophobicContact CE-CB 4.25Å; M17-V61 HydrophobicContact CE-CG1 4.19Å; M20-V61 HydrophobicContact CE-CG1 3.99Å; M20-V61 HydrophobicContact CG-CG1 3.9Å; P59-V61 PolarHBondContact O-N 2.96Å; P59-V61 VanDerWaalsContact O-N 3.15Å; V61-F65 PolarHBondContact O-N 3.05Å; V61-F65 VanDerWaalsContact O-N 3.11Å
62	V	94.6	Very high	93.5	Very high	1 Å²	1	36.4 Å²	36.4	1%	0.006	19%	0.191	C	C	.	.	H	α-helix	trans	-68.3	-43.1	176.9	178.1	0	0	0	0	110.4	I13 M17 L53 Q58 P59 A60 H64 F65 G66	I13-V62 HydrophobicContact CD1-CG1 4.4Å; I13-V62 HydrophobicContact CG1-CG1 3.76Å; I13-V62 HydrophobicContact CG1-CG2 4.32Å; I13-V62 HydrophobicContact CG2-CG2 4.27Å; M17-V62 HydrophobicContact CE-CG2 3.49Å; M17-V62 VanDerWaalsContact CE-CG2 3.49Å; L53-V62 HydrophobicContact CB-CG1 4.12Å; L53-V62 HydrophobicContact CD2-CG1 3.7Å; L53-V62 HydrophobicContact CG-CG1 4.45Å; Q58-V62 HydrophobicContact CB-CB 4.25Å; Q58-V62 HydrophobicContact CB-CG1 4.13Å; Q58-V62 HydrophobicContact CG-CG1 4.39Å; P59-V62 HydrophobicContact CB-CG2 4.31Å; P59-V62 HydrophobicContact CG-CG2 4.28Å; P59-V62 WeakPolarHBondContact O-CB 3.41Å; P59-V62 PolarHBondContact O-N 3.49Å; A60-V62 PolarHBondContact O-N 3Å; V62-H64 VanDerWaalsContact C-N 3.32Å; V62-H64 PolarHBondContact O-N 3.43Å; V62-F65 PolarHBondContact O-N 3.33Å; V62-G66 PolarHBondContact O-N 2.93Å
63	R	95.5	Very high	93.5	Very high	7 Å²	7	30.5 Å²	30.5	3%	0.026	17%	0.17	C	C	.	.	H	α-helix	trans	-58.8	-46.1	176.8	-67.1	172.2	62.6	-143	1.7	111.1	L53 D55 Q58 P59 A60 F65 G66 L67 H102 E107	L53-R63 VanDerWaalsContact O-CA 3.3Å; L53-R63 WeakPolarHBondContact O-CA 3.06Å; D55-R63 VanDerWaalsContact O-CD 3.25Å; D55-R63 WeakPolarHBondContact O-CD 3.27Å; D55-R63 VanDerWaalsContact O-CG 3.26Å; D55-R63 WeakPolarHBondContact O-CG 3.42Å; Q58-R63 HydrophobicContact CB-CG 3.87Å; Q58-R63 WeakPolarHBondContact O-CD 3.46Å; P59-R63 WeakPolarHBondContact O-CG 3.32Å; P59-R63 PolarHBondContact O-N 3.37Å; A60-R63 PolarHBondContact O-N 2.65Å; R63-F65 PolarHBondContact O-N 3.49Å; R63-G66 PolarHBondContact O-N 3.34Å; R63-L67 WeakPolarHBondContact O-CG 3.3Å; R63-L67 PolarHBondContact O-N 3.25Å; R63-H102 PolarHBondContact NH1-CD2 2.91Å; R63-E107 IonicContact CZ-OE1 2.77Å; R63-E107 IonicContact CZ-OE2 2.88Å; R63-E107 IonicContact NH1-OE1 3.33Å; R63-E107 PolarHBondContact NH1-OE1 2.97Å; R63-E107 IonicContact NH1-OE2 3.15Å; R63-E107 VanDerWaalsContact NH2-CD 3.31Å; R63-E107 IonicContact NH2-OE1 3.04Å; R63-E107 PolarHBondContact NH2-OE1 3.3Å; R63-E107 VanDerWaalsContact NH2-OE1 3.13Å; R63-E107 IonicContact NH2-OE2 3.99Å; R63-E107 PolarHBondContact NH2-OE2 3.15Å
64	H	94.8	Very high	93.3	Very high	46 Å²	46	30.5 Å²	30.5	21%	0.213	17%	0.169	C	C	.	.	H	α-helix	trans	-59.8	-45.1	177.1	-170.3	80.9	0	0	0	111.8	A60 V62 L67 Q68 H110 R117	A60-H64 WeakPolarHBondContact O-CB 3.13Å; A60-H64 PolarHBondContact O-N 3.21Å; V62-H64 VanDerWaalsContact C-N 3.32Å; V62-H64 PolarHBondContact O-N 3.43Å; H64-L67 PolarHBondContact O-N 3.38Å; H64-Q68 WeakPolarHBondContact O-CB 3.5Å; H64-Q68 PolarHBondContact O-N 3.27Å; H64-H110 PolarHBondContact CE1-O 2.89Å; H64-H110 AromaticContact CG-CD2 3.98Å; H64-H110 AromaticContact ND1-CD2 3.69Å; H64-H110 PolarHBondContact ND1-O 3.07Å; H64-R117 PolarHBondContact CE1-NH2 3.33Å
65	F	95.2	Very high	93	Very high	8 Å²	8	31.9 Å²	31.9	4%	0.035	18%	0.175	C	C	.	.	H	α-helix	trans	-63.7	-41	175.5	-178.2	-108.5	0	0	0	112.5	L12 V16 C36 K40 L53 V61 V62 R63 L67 Q68 I69	L12-F65 HydrophobicContact CB-CE1 4.34Å; L12-F65 HydrophobicContact CD2-CE1 4.08Å; L12-F65 HydrophobicContact CD2-CZ 4.46Å; V16-F65 HydrophobicContact CG1-CB 4.44Å; V16-F65 HydrophobicContact CG2-CB 3.98Å; V16-F65 HydrophobicContact CG2-CD1 3.36Å; V16-F65 HydrophobicContact CG2-CD2 3.98Å; V16-F65 HydrophobicContact CG2-CE1 3.7Å; V16-F65 HydrophobicContact CG2-CE2 4.29Å; V16-F65 HydrophobicContact CG2-CG 3.49Å; V16-F65 VanDerWaalsContact CG2-CG 3.49Å; V16-F65 HydrophobicContact CG2-CZ 4.17Å; C36-F65 HydrophobicContact CB-CE2 4.03Å; C36-F65 HydrophobicContact CB-CZ 3.77Å; K40-F65 HydrophobicContact CD-CE2 4.3Å; L53-F65 HydrophobicContact CD1-CD1 4.31Å; V61-F65 PolarHBondContact O-N 3.05Å; V61-F65 VanDerWaalsContact O-N 3.11Å; V62-F65 PolarHBondContact O-N 3.33Å; R63-F65 PolarHBondContact O-N 3.49Å; F65-L67 PolarHBondContact O-N 3.43Å; F65-Q68 WeakPolarHBondContact O-CB 3.49Å; F65-Q68 PolarHBondContact O-N 3.36Å; F65-I69 HydrophobicContact CD1-CD1 3.78Å; F65-I69 HydrophobicContact CD1-CG1 4.44Å; F65-I69 HydrophobicContact CE1-CD1 3.48Å; F65-I69 VanDerWaalsContact CE1-CD1 3.48Å; F65-I69 HydrophobicContact CE1-CG1 4.13Å; F65-I69 HydrophobicContact CZ-CD1 4.04Å; F65-I69 HydrophobicContact CZ-CG1 4.22Å; F65-I69 WeakPolarHBondContact O-CG1 3.37Å; F65-I69 PolarHBondContact O-N 3.49Å
66	G	95.4	Very high	92.8	Very high	0 Å²	0	31 Å²	31	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-56.6	-47.7	173.4	0	0	0	0	0	112.5	V62 R63 I69 L70	V62-G66 PolarHBondContact O-N 2.93Å; R63-G66 PolarHBondContact O-N 3.34Å; G66-I69 WeakPolarHBondContact O-CB 3.22Å; G66-I69 PolarHBondContact O-N 2.93Å; G66-L70 WeakPolarHBondContact O-CG 3.39Å; G66-L70 PolarHBondContact O-N 3.49Å
67	L	95.6	Very high	92.6	Very high	5 Å²	5	30.7 Å²	30.7	3%	0.026	16%	0.164	C	C	.	.	H	α-helix	trans	-64.4	-38.8	175.1	-65.6	172.5	0	0	0	111.9	A54 R63 H64 F65 I69 L70 E71 L96 V111 A114 L115 I118	A54-L67 HydrophobicContact CB-CD2 3.79Å; A54-L67 HydrophobicContact CB-CG 4.02Å; R63-L67 WeakPolarHBondContact O-CG 3.3Å; R63-L67 PolarHBondContact O-N 3.25Å; H64-L67 PolarHBondContact O-N 3.38Å; F65-L67 PolarHBondContact O-N 3.43Å; L67-I69 VanDerWaalsContact C-N 3.32Å; L67-I69 PolarHBondContact O-N 3.15Å; L67-L70 HydrophobicContact CD2-CD1 4.48Å; L67-L70 PolarHBondContact O-N 3.26Å; L67-L70 VanDerWaalsContact O-N 3.16Å; L67-E71 PolarHBondContact O-N 3.18Å; L67-L96 HydrophobicContact CD2-CD1 4.38Å; L67-V111 HydrophobicContact CD1-CG1 3.87Å; L67-A114 HydrophobicContact CB-CB 3.87Å; L67-A114 HydrophobicContact CD1-CB 3.9Å; L67-L115 HydrophobicContact CD1-CB 4.42Å; L67-L115 HydrophobicContact CD2-CD1 3.81Å; L67-I118 HydrophobicContact CB-CD1 3.82Å; L67-I118 HydrophobicContact CD2-CD1 3.55Å; L67-I118 HydrophobicContact CG-CD1 4.27Å; L67-I118 WeakPolarHBondContact O-CD1 3.33Å
68	Q	94.1	Very high	92.6	Very high	67 Å²	67	26.6 Å²	26.6	31%	0.313	14%	0.135	S	C	.	.	H	α-helix	trans	-62.2	-38.2	175.6	-169.1	-174.4	14.2	0	0	112.2	H64 F65 E71 Q72	H64-Q68 WeakPolarHBondContact O-CB 3.5Å; H64-Q68 PolarHBondContact O-N 3.27Å; F65-Q68 WeakPolarHBondContact O-CB 3.49Å; F65-Q68 PolarHBondContact O-N 3.36Å; Q68-E71 PolarHBondContact O-N 3.36Å; Q68-Q72 WeakPolarHBondContact O-CB 3.46Å; Q68-Q72 PolarHBondContact O-N 3.02Å
69	I	94.4	Very high	92.2	Very high	1 Å²	1	25.3 Å²	25.3	1%	0.005	13%	0.129	C	C	.	.	H	α-helix	trans	-60.2	-47.9	173	-66.9	160.5	0	0	0	110	F39 K40 C46 L53 F65 G66 L67 E71 Q72 V73	F39-I69 HydrophobicContact CD1-CD1 4.38Å; F39-I69 HydrophobicContact CE1-CD1 4.02Å; F39-I69 HydrophobicContact CE1-CG2 4.32Å; K40-I69 HydrophobicContact CD-CG1 4.23Å; K40-I69 HydrophobicContact CG-CG1 3.93Å; C46-I69 HydrophobicContact CB-CG2 3.72Å; C46-I69 WeakPolarHBondContact O-CG2 3.42Å; L53-I69 HydrophobicContact CD1-CD1 4Å; F65-I69 HydrophobicContact CD1-CD1 3.78Å; F65-I69 HydrophobicContact CD1-CG1 4.44Å; F65-I69 HydrophobicContact CE1-CD1 3.48Å; F65-I69 VanDerWaalsContact CE1-CD1 3.48Å; F65-I69 HydrophobicContact CE1-CG1 4.13Å; F65-I69 HydrophobicContact CZ-CD1 4.04Å; F65-I69 HydrophobicContact CZ-CG1 4.22Å; F65-I69 WeakPolarHBondContact O-CG1 3.37Å; F65-I69 PolarHBondContact O-N 3.49Å; G66-I69 WeakPolarHBondContact O-CB 3.22Å; G66-I69 PolarHBondContact O-N 2.93Å; L67-I69 VanDerWaalsContact C-N 3.32Å; L67-I69 PolarHBondContact O-N 3.15Å; I69-E71 PolarHBondContact O-N 3.48Å; I69-Q72 PolarHBondContact O-N 2.97Å; I69-V73 WeakPolarHBondContact O-CG2 3.42Å; I69-V73 PolarHBondContact O-N 2.85Å
70	L	94.6	Very high	91.9	Very high	3 Å²	3	28.7 Å²	28.7	2%	0.016	14%	0.143	C	C	.	.	H	α-helix	trans	-62	-44	179.4	-62.2	177.3	0	0	0	111.4	V47 L51 G66 L67 Q72 V73 I74 L89 I118	V47-L70 HydrophobicContact CG1-CD2 4.43Å; L51-L70 HydrophobicContact CD2-CD1 3.79Å; L51-L70 HydrophobicContact CG-CD1 4.24Å; L51-L70 HydrophobicContact CG-CD2 4.22Å; G66-L70 WeakPolarHBondContact O-CG 3.39Å; G66-L70 PolarHBondContact O-N 3.49Å; L67-L70 HydrophobicContact CD2-CD1 4.48Å; L67-L70 PolarHBondContact O-N 3.26Å; L67-L70 VanDerWaalsContact O-N 3.16Å; L70-Q72 VanDerWaalsContact C-N 3.3Å; L70-Q72 PolarHBondContact O-N 3.28Å; L70-V73 PolarHBondContact O-N 2.98Å; L70-I74 WeakPolarHBondContact O-CD1 3.34Å; L70-I74 VanDerWaalsContact O-CG1 3.28Å; L70-I74 WeakPolarHBondContact O-CG1 3.42Å; L70-I74 PolarHBondContact O-N 2.84Å; L70-L89 HydrophobicContact CD2-CD1 4.24Å; L70-I118 HydrophobicContact CB-CD1 3.9Å; L70-I118 HydrophobicContact CB-CG1 4.39Å; L70-I118 HydrophobicContact CD1-CD1 4.33Å
71	E	93.4	Very high	91.7	Very high	10 Å²	10	28.6 Å²	28.6	5%	0.047	14%	0.139	C	C	.	.	H	α-helix	trans	-56.9	-44.3	174.1	-170.5	-169.9	169	0	0	111.3	L67 Q68 I69 I74 K75 R117 I118 E121	L67-E71 PolarHBondContact O-N 3.18Å; Q68-E71 PolarHBondContact O-N 3.36Å; I69-E71 PolarHBondContact O-N 3.48Å; E71-I74 PolarHBondContact O-N 3.25Å; E71-K75 HydrophobicContact CG-CD 4.2Å; E71-K75 WeakPolarHBondContact O-CB 3.41Å; E71-K75 WeakPolarHBondContact O-CG 3.22Å; E71-K75 PolarHBondContact O-N 3.21Å; E71-K75 VanDerWaalsContact OE1-CE 3.28Å; E71-K75 WeakPolarHBondContact OE1-CE 3.39Å; E71-K75 IonicContact OE1-NZ 2.99Å; E71-K75 PolarHBondContact OE1-NZ 3.49Å; E71-R117 IonicContact OE1-NH1 2.78Å; E71-R117 IonicContact OE2-CZ 3.28Å; E71-R117 IonicContact OE2-NE 2.59Å; E71-R117 IonicContact OE2-NH1 2.67Å; E71-R117 PolarHBondContact OE2-NH1 2.88Å; E71-I118 HydrophobicContact CB-CG1 4.02Å; E71-E121 HydrophobicContact CG-CG 4.48Å
72	Q	90.2	Very high	91.5	Very high	31 Å²	31	32.1 Å²	32.1	15%	0.145	15%	0.152	C	C	.	.	H	α-helix	trans	-66.8	-37.1	178.4	-174.6	152	-13.9	0	0	112.5	K40 Q68 I69 L70 K75 F76	K40-Q72 HydrophobicContact CB-CG 4.33Å; K40-Q72 VanDerWaalsContact CD-OE1 3.28Å; Q68-Q72 WeakPolarHBondContact O-CB 3.46Å; Q68-Q72 PolarHBondContact O-N 3.02Å; I69-Q72 PolarHBondContact O-N 2.97Å; L70-Q72 VanDerWaalsContact C-N 3.3Å; L70-Q72 PolarHBondContact O-N 3.28Å; Q72-K75 PolarHBondContact O-N 3.01Å; Q72-F76 HydrophobicContact CG-CD2 3.96Å; Q72-F76 HydrophobicContact CG-CE2 4.06Å; Q72-F76 WeakPolarHBondContact O-CA 3.48Å; Q72-F76 PolarHBondContact O-N 3.12Å
73	V	91.8	Very high	91.1	Very high	5 Å²	5	37.2 Å²	37.2	3%	0.03	18%	0.175	C	C	.	.	H	α-helix	trans	-62.5	-45.8	172.9	171.9	0	0	0	0	110.6	C46 V47 I69 L70 R77 W78 M81	C46-V73 HydrophobicContact CB-CG2 3.46Å; C46-V73 VanDerWaalsContact CB-CG2 3.46Å; V47-V73 HydrophobicContact CG2-CB 4.48Å; V47-V73 HydrophobicContact CG2-CG1 3.8Å; V47-V73 HydrophobicContact CG2-CG2 4.32Å; I69-V73 WeakPolarHBondContact O-CG2 3.42Å; I69-V73 PolarHBondContact O-N 2.85Å; L70-V73 PolarHBondContact O-N 2.98Å; V73-R77 HydrophobicContact CG1-CB 4.42Å; V73-R77 WeakPolarHBondContact O-CA 3.35Å; V73-R77 WeakPolarHBondContact O-CB 3.47Å; V73-R77 PolarHBondContact O-N 2.89Å; V73-W78 PolarHBondContact O-N 3.38Å; V73-M81 HydrophobicContact CG1-SD 3.86Å
74	I	91.8	Very high	90.8	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-63.5	-47.8	178.4	-63.5	160.6	0	0	0	109.4	L70 E71 W78 L89 I118 E121 M122 R125	L70-I74 WeakPolarHBondContact O-CD1 3.34Å; L70-I74 VanDerWaalsContact O-CG1 3.28Å; L70-I74 WeakPolarHBondContact O-CG1 3.42Å; L70-I74 PolarHBondContact O-N 2.84Å; E71-I74 PolarHBondContact O-N 3.25Å; I74-W78 HydrophobicContact CB-CE3 4.15Å; I74-W78 HydrophobicContact CG1-CE3 3.87Å; I74-W78 HydrophobicContact CG1-CZ3 3.85Å; I74-W78 HydrophobicContact CG2-CD2 4.46Å; I74-W78 HydrophobicContact CG2-CE3 3.9Å; I74-W78 HydrophobicContact CG2-CZ3 4.26Å; I74-W78 WeakPolarHBondContact O-CB 3.45Å; I74-L89 HydrophobicContact CD1-CD2 4.34Å; I74-L89 HydrophobicContact CG1-CD2 3.87Å; I74-I118 HydrophobicContact CD1-CB 4.36Å; I74-I118 HydrophobicContact CD1-CG2 3.63Å; I74-E121 HydrophobicContact CG2-CB 3.75Å; I74-M122 HydrophobicContact CD1-CG 3.85Å; I74-M122 HydrophobicContact CD1-SD 4.24Å; I74-M122 HydrophobicContact CG1-CG 4.31Å; I74-M122 HydrophobicContact CG2-CG 4.02Å; I74-R125 PolarHBondContact O-NE 3.45Å; I74-R125 PolarHBondContact O-NH2 3.46Å
75	K	88.3	Confident	90.4	Very high	32 Å²	32	45.3 Å²	45.3	14%	0.139	21%	0.213	C	C	.	.	H	α-helix	trans	-57	-58.4	176.8	-78.5	178.5	172.6	172.2	0	112.8	E71 Q72 E121 R125 V1184	E71-K75 HydrophobicContact CG-CD 4.2Å; E71-K75 WeakPolarHBondContact O-CB 3.41Å; E71-K75 WeakPolarHBondContact O-CG 3.22Å; E71-K75 PolarHBondContact O-N 3.21Å; E71-K75 VanDerWaalsContact OE1-CE 3.28Å; E71-K75 WeakPolarHBondContact OE1-CE 3.39Å; E71-K75 IonicContact OE1-NZ 2.99Å; E71-K75 PolarHBondContact OE1-NZ 3.49Å; Q72-K75 PolarHBondContact O-N 3.01Å; K75-E121 WeakPolarHBondContact CE-OE1 3.33Å; K75-E121 HydrophobicContact CG-CG 4.2Å; K75-E121 IonicContact NZ-OE1 3.48Å; K75-R125 PolarHBondContact O-NH2 3.02Å; K75-V1184 HydrophobicContact CB-CG1 4.35Å; K75-V1184 HydrophobicContact CB-CG2 4.16Å; K75-V1184 HydrophobicContact CD-CG2 4.29Å; K75-V1184 HydrophobicContact CG-CG1 4.38Å; K75-V1184 HydrophobicContact CG-CG2 4.14Å
76	F	86.9	Confident	90.2	Very high	65 Å²	65	46.1 Å²	46.1	29%	0.285	22%	0.217	S	C	.	.	H	α-helix	trans	-67.1	-59	-173.9	28.9	-133.7	0	0	0	117	Q72 K1182 V1184	Q72-F76 HydrophobicContact CG-CD2 3.96Å; Q72-F76 HydrophobicContact CG-CE2 4.06Å; Q72-F76 WeakPolarHBondContact O-CA 3.48Å; Q72-F76 PolarHBondContact O-N 3.12Å; F76-K1182 HydrophobicContact CD1-CD 3.92Å; F76-K1182 HydrophobicContact CD1-CG 3.97Å; F76-K1182 HydrophobicContact CE1-CB 3.61Å; F76-K1182 HydrophobicContact CE1-CD 3.61Å; F76-K1182 HydrophobicContact CE1-CG 3.44Å; F76-K1182 VanDerWaalsContact CE1-CG 3.44Å; F76-K1182 HydrophobicContact CE2-CD 4.33Å; F76-K1182 HydrophobicContact CG-CD 4.42Å; F76-K1182 HydrophobicContact CZ-CB 3.83Å; F76-K1182 HydrophobicContact CZ-CD 3.83Å; F76-K1182 HydrophobicContact CZ-CG 4Å; F76-V1184 HydrophobicContact CD1-CG2 4.26Å; F76-V1184 HydrophobicContact CE1-CG2 3.7Å; F76-V1184 HydrophobicContact CZ-CG2 4.17Å
77	R	87.3	Confident	90	Very high	63 Å²	63	49 Å²	49	24%	0.238	24%	0.235	C	C	.	.	H	α-helix	trans	-116.1	-8.7	-153.6	-62.7	177.4	176.6	177	-1.2	113	K40 E41 T42 S43 C46 V73 N79 N80 M81	K40-R77 PolarHBondContact O-NH2 3.38Å; K40-R77 VanDerWaalsContact O-NH2 3.13Å; E41-R77 PolarHBondContact O-NH2 3.39Å; T42-R77 VanDerWaalsContact C-NH2 3.33Å; T42-R77 VanDerWaalsContact N-NH2 3.11Å; S43-R77 PolarHBondContact O-NH1 2.83Å; S43-R77 PolarHBondContact O-NH2 3.16Å; C46-R77 PolarHBondContact SG-NH1 2.93Å; C46-R77 VanDerWaalsContact SG-NH1 3.39Å; V73-R77 HydrophobicContact CG1-CB 4.42Å; V73-R77 WeakPolarHBondContact O-CA 3.35Å; V73-R77 WeakPolarHBondContact O-CB 3.47Å; V73-R77 PolarHBondContact O-N 2.89Å; R77-N79 VanDerWaalsContact C-N 3.25Å; R77-N79 PolarHBondContact O-N 2.96Å; R77-N79 VanDerWaalsContact O-N 3.11Å; R77-N80 PolarHBondContact O-N 3.43Å; R77-M81 PolarHBondContact O-N 2.82Å
78	W	89.6	Confident	89.7	Confident	7 Å²	7	53.4 Å²	53.4	3%	0.027	26%	0.255	C	S	.	.	G	3₁₀ helix	trans	-50.4	-40.6	-177.2	-169.3	-90.7	0	0	0	114.4	V73 I74 N80 M81 K86 L89 M122 R125 E126	V73-W78 PolarHBondContact O-N 3.38Å; I74-W78 HydrophobicContact CB-CE3 4.15Å; I74-W78 HydrophobicContact CG1-CE3 3.87Å; I74-W78 HydrophobicContact CG1-CZ3 3.85Å; I74-W78 HydrophobicContact CG2-CD2 4.46Å; I74-W78 HydrophobicContact CG2-CE3 3.9Å; I74-W78 HydrophobicContact CG2-CZ3 4.26Å; I74-W78 WeakPolarHBondContact O-CB 3.45Å; W78-N80 PolarHBondContact O-N 3.27Å; W78-M81 HydrophobicContact CE3-SD 4.2Å; W78-M81 PolarHBondContact O-N 3.46Å; W78-K86 HydrophobicContact CD2-CG 4.25Å; W78-K86 HydrophobicContact CH2-CB 4.12Å; W78-K86 HydrophobicContact CH2-CG 4.29Å; W78-K86 HydrophobicContact CZ2-CB 3.92Å; W78-K86 HydrophobicContact CZ2-CD 4.2Å; W78-K86 HydrophobicContact CZ2-CG 3.92Å; W78-K86 WeakPolarHBondContact O-CE 3.16Å; W78-K86 PolarHBondContact O-NZ 3.24Å; W78-L89 HydrophobicContact CE3-CD2 4.45Å; W78-L89 HydrophobicContact CZ3-CD2 3.87Å; W78-L89 HydrophobicContact CZ3-CG 4.4Å; W78-M122 HydrophobicContact CH2-CB 4.48Å; W78-M122 HydrophobicContact CH2-CG 3.83Å; W78-M122 HydrophobicContact CH2-SD 3.92Å; W78-M122 HydrophobicContact CZ3-CG 3.96Å; W78-M122 HydrophobicContact CZ3-SD 4.16Å; W78-R125 VanDerWaalsContact CG-CD 3.44Å; W78-R125 HydrophobicContact CG-CG 4.5Å; W78-E126 HydrophobicContact CZ2-CG 3.91Å; W78-E126 VanDerWaalsContact CZ2-OE1 3.29Å; W78-E126 WeakPolarHBondContact CZ2-OE1 3.49Å; W78-E126 PolarHBondContact NE1-OE1 3.02Å
79	N	85.3	Confident	89.6	Confident	27 Å²	27	50.4 Å²	50.4	14%	0.144	24%	0.241	C	C	.	.	G	3₁₀ helix	trans	-63.7	-25.4	-178.7	-68.2	-36.3	0	0	0	113.5	R77 H1185 R1187	R77-N79 VanDerWaalsContact C-N 3.25Å; R77-N79 PolarHBondContact O-N 2.96Å; R77-N79 VanDerWaalsContact O-N 3.11Å; N79-H1185 PolarHBondContact ND2-O 3.19Å; N79-R1187 PolarHBondContact O-NH1 2.88Å; N79-R1187 PolarHBondContact O-NH2 3.37Å
80	N	85.6	Confident	89.5	Confident	141 Å²	141	52 Å²	52	75%	0.754	25%	0.248	S	C	*	.	G	3₁₀ helix	trans	-98.6	-9.7	-177.8	-61.3	-14.7	0	0	0	112.5	R77 W78	R77-N80 PolarHBondContact O-N 3.43Å; W78-N80 PolarHBondContact O-N 3.27Å
81	M	87.8	Confident	89.4	Confident	26 Å²	26	57.6 Å²	57.6	13%	0.128	27%	0.274	C	S	.	.	S	Bend	trans	-71.5	145	176.7	-69.4	174.3	68.8	0	0	111.6	V73 R77 W78 E85 K86 L89	V73-M81 HydrophobicContact CG1-SD 3.86Å; R77-M81 PolarHBondContact O-N 2.82Å; W78-M81 HydrophobicContact CE3-SD 4.2Å; W78-M81 PolarHBondContact O-N 3.46Å; M81-E85 HydrophobicContact CE-CB 3.82Å; M81-K86 HydrophobicContact CB-CG 4Å; M81-K86 VanDerWaalsContact O-CE 3.26Å; M81-K86 WeakPolarHBondContact O-CE 3.28Å; M81-K86 PolarHBondContact O-NZ 3.02Å; M81-L89 HydrophobicContact CE-CD2 4.04Å
82	Q	89.1	Confident	89.4	Confident	130 Å²	130	59 Å²	59	61%	0.607	28%	0.284	S	S	*	.			trans	-69.2	154.3	173.5	-59.3	-172.2	2.9	0	0	110.6	Q84 E85 K86	Q82-Q84 PolarHBondContact O-N 3.29Å; Q82-E85 HydrophobicContact CB-CG 4.22Å; Q82-E85 PolarHBondContact N-OE2 3.28Å; Q82-E85 PolarHBondContact O-N 3.26Å; Q82-E85 VanDerWaalsContact O-N 3.15Å; Q82-K86 PolarHBondContact O-N 2.91Å; Q82-K86 VanDerWaalsContact O-N 3.14Å
83	Q	86.9	Confident	89.5	Confident	107 Å²	107	57.6 Å²	57.6	50%	0.5	28%	0.278	S	S	.	.	H	α-helix	trans	-60	-37	-177.6	-169.6	61.2	24.8	0	0	112.3	K86 V87	Q83-K86 PolarHBondContact O-N 3.45Å; Q83-V87 WeakPolarHBondContact O-CG2 3.47Å; Q83-V87 PolarHBondContact O-N 3.41Å; Q83-V87 VanDerWaalsContact O-N 3.08Å
84	Q	88.3	Confident	89.6	Confident	134 Å²	134	58.6 Å²	58.6	63%	0.626	28%	0.283	S	S	*	.	H	α-helix	trans	-64.5	-40.6	177.7	-170.9	172.6	3.1	0	0	112.3	Q82 K86 V87 Q88	Q82-Q84 PolarHBondContact O-N 3.29Å; Q84-K86 VanDerWaalsContact C-N 3.34Å; Q84-K86 PolarHBondContact O-N 3.38Å; Q84-V87 PolarHBondContact O-N 3.48Å; Q84-Q88 WeakPolarHBondContact O-CB 3.32Å; Q84-Q88 WeakPolarHBondContact O-CG 3.48Å; Q84-Q88 PolarHBondContact O-N 3.37Å
85	E	88.1	Confident	89.6	Confident	89 Å²	89	64.4 Å²	64.4	42%	0.416	31%	0.31	S	S	.	.	H	α-helix	trans	-66.6	-36	177.6	-61.8	174	139.9	0	0	111.8	M81 Q82 L89	M81-E85 HydrophobicContact CE-CB 3.82Å; Q82-E85 HydrophobicContact CB-CG 4.22Å; Q82-E85 PolarHBondContact N-OE2 3.28Å; Q82-E85 PolarHBondContact O-N 3.26Å; Q82-E85 VanDerWaalsContact O-N 3.15Å; E85-L89 WeakPolarHBondContact O-CB 3.45Å; E85-L89 PolarHBondContact O-N 3.11Å
86	K	90.6	Very high	89.9	Confident	25 Å²	25	64.1 Å²	64.1	11%	0.109	31%	0.31	C	S	.	.	H	α-helix	trans	-65.2	-46.5	175.2	-68.1	172.7	-179.5	168.4	0	111.9	W78 M81 Q82 Q83 Q84 L89 K90	W78-K86 HydrophobicContact CD2-CG 4.25Å; W78-K86 HydrophobicContact CH2-CB 4.12Å; W78-K86 HydrophobicContact CH2-CG 4.29Å; W78-K86 HydrophobicContact CZ2-CB 3.92Å; W78-K86 HydrophobicContact CZ2-CD 4.2Å; W78-K86 HydrophobicContact CZ2-CG 3.92Å; W78-K86 WeakPolarHBondContact O-CE 3.16Å; W78-K86 PolarHBondContact O-NZ 3.24Å; M81-K86 HydrophobicContact CB-CG 4Å; M81-K86 VanDerWaalsContact O-CE 3.26Å; M81-K86 WeakPolarHBondContact O-CE 3.28Å; M81-K86 PolarHBondContact O-NZ 3.02Å; Q82-K86 PolarHBondContact O-N 2.91Å; Q82-K86 VanDerWaalsContact O-N 3.14Å; Q83-K86 PolarHBondContact O-N 3.45Å; Q84-K86 VanDerWaalsContact C-N 3.34Å; Q84-K86 PolarHBondContact O-N 3.38Å; K86-L89 PolarHBondContact O-N 3.18Å; K86-K90 WeakPolarHBondContact O-CB 3.31Å; K86-K90 PolarHBondContact O-N 2.67Å
87	V	90.1	Very high	90.1	Very high	61 Å²	61	61.1 Å²	61.1	37%	0.37	30%	0.297	S	S	.	.	H	α-helix	trans	-61.6	-45.9	177.5	173.6	0	0	0	0	110.1	Q83 Q84 L89 K90 E91	Q83-V87 WeakPolarHBondContact O-CG2 3.47Å; Q83-V87 PolarHBondContact O-N 3.41Å; Q83-V87 VanDerWaalsContact O-N 3.08Å; Q84-V87 PolarHBondContact O-N 3.48Å; V87-L89 PolarHBondContact O-N 3.47Å; V87-K90 PolarHBondContact O-N 3.25Å; V87-E91 HydrophobicContact CG1-CG 4.46Å; V87-E91 WeakPolarHBondContact O-CG 3.37Å; V87-E91 PolarHBondContact O-N 2.88Å
88	Q	90.4	Very high	90.4	Very high	98 Å²	98	59 Å²	59	46%	0.458	29%	0.293	S	S	.	.	H	α-helix	trans	-60.1	-46	175.9	-75	176	-10.3	0	0	112.4	Q84 K90 E91 C92	Q84-Q88 WeakPolarHBondContact O-CB 3.32Å; Q84-Q88 WeakPolarHBondContact O-CG 3.48Å; Q84-Q88 PolarHBondContact O-N 3.37Å; Q88-K90 VanDerWaalsContact C-N 3.33Å; Q88-K90 PolarHBondContact O-N 2.59Å; Q88-E91 PolarHBondContact O-N 3.45Å; Q88-C92 WeakPolarHBondContact O-CB 3.35Å; Q88-C92 PolarHBondContact O-N 3.08Å; Q88-C92 PolarHBondContact O-SG 3.36Å
89	L	91.9	Very high	90.5	Very high	3 Å²	3	63.1 Å²	63.1	2%	0.016	32%	0.319	C	S	.	.	H	α-helix	trans	-64.2	-39	178.5	-179.2	54.2	0	0	0	111.7	V47 L70 I74 W78 M81 E85 K86 V87 C92 A93	V47-L89 HydrophobicContact CG1-CD1 4.12Å; L70-L89 HydrophobicContact CD2-CD1 4.24Å; I74-L89 HydrophobicContact CD1-CD2 4.34Å; I74-L89 HydrophobicContact CG1-CD2 3.87Å; W78-L89 HydrophobicContact CE3-CD2 4.45Å; W78-L89 HydrophobicContact CZ3-CD2 3.87Å; W78-L89 HydrophobicContact CZ3-CG 4.4Å; M81-L89 HydrophobicContact CE-CD2 4.04Å; E85-L89 WeakPolarHBondContact O-CB 3.45Å; E85-L89 PolarHBondContact O-N 3.11Å; K86-L89 PolarHBondContact O-N 3.18Å; V87-L89 PolarHBondContact O-N 3.47Å; L89-C92 PolarHBondContact O-N 3.23Å; L89-A93 WeakPolarHBondContact O-CB 3.38Å; L89-A93 PolarHBondContact O-N 3.02Å
90	K	92.1	Very high	90.7	Very high	35 Å²	35	62.4 Å²	62.4	15%	0.152	32%	0.318	C	S	.	.	H	α-helix	trans	-61.3	-49.4	172.7	179.1	-173.3	150.1	-178.9	0	110.9	K86 V87 Q88 C92 A93 M94 M122 W131 E137	K86-K90 WeakPolarHBondContact O-CB 3.31Å; K86-K90 PolarHBondContact O-N 2.67Å; V87-K90 PolarHBondContact O-N 3.25Å; Q88-K90 VanDerWaalsContact C-N 3.33Å; Q88-K90 PolarHBondContact O-N 2.59Å; K90-C92 PolarHBondContact O-N 2.94Å; K90-A93 PolarHBondContact O-N 3.24Å; K90-M94 HydrophobicContact CG-CG 4.45Å; K90-M94 VanDerWaalsContact O-CG 3.27Å; K90-M94 WeakPolarHBondContact O-CG 3.49Å; K90-M94 PolarHBondContact O-N 3.44Å; K90-M122 HydrophobicContact CB-SD 4.29Å; K90-W131 HydrophobicContact CD-CD2 4.03Å; K90-W131 HydrophobicContact CD-CE3 4.12Å; K90-W131 HydrophobicContact CD-CH2 4.08Å; K90-W131 HydrophobicContact CD-CZ2 4Å; K90-W131 HydrophobicContact CD-CZ3 4.15Å; K90-W131 HydrophobicContact CG-CH2 4Å; K90-W131 HydrophobicContact CG-CZ2 4.22Å; K90-W131 HydrophobicContact CG-CZ3 4.28Å; K90-E137 IonicContact NZ-OE1 3.05Å; K90-E137 PolarHBondContact NZ-OE1 3.07Å; K90-E137 IonicContact NZ-OE2 2.77Å
91	E	92.3	Very high	91	Very high	120 Å²	120	56.2 Å²	56.2	56%	0.561	29%	0.285	S	S	*	.	H	α-helix	trans	-58.4	-45.6	177.4	-74.6	173.1	177.4	0	0	111.7	V87 Q88 A93 M94 Q95	V87-E91 HydrophobicContact CG1-CG 4.46Å; V87-E91 WeakPolarHBondContact O-CG 3.37Å; V87-E91 PolarHBondContact O-N 2.88Å; Q88-E91 PolarHBondContact O-N 3.45Å; E91-A93 PolarHBondContact O-N 3.08Å; E91-M94 PolarHBondContact O-N 3.09Å; E91-Q95 WeakPolarHBondContact O-CB 3.33Å; E91-Q95 PolarHBondContact O-N 3.36Å
92	C	93	Very high	91.3	Very high	39 Å²	39	58.1 Å²	58.1	26%	0.264	29%	0.294	S	S	.	.	H	α-helix	trans	-62.3	-42.6	176	-69	0	0	0	0	112.3	L51 Q88 L89 K90 Q95 L96	L51-C92 HydrophobicContact CD1-CB 4.02Å; L51-C92 HydrophobicContact CD2-CB 3.84Å; Q88-C92 WeakPolarHBondContact O-CB 3.35Å; Q88-C92 PolarHBondContact O-N 3.08Å; Q88-C92 PolarHBondContact O-SG 3.36Å; L89-C92 PolarHBondContact O-N 3.23Å; K90-C92 PolarHBondContact O-N 2.94Å; C92-Q95 WeakPolarHBondContact O-CB 3.42Å; C92-Q95 PolarHBondContact O-N 2.91Å; C92-L96 WeakPolarHBondContact O-CG 3.45Å; C92-L96 PolarHBondContact O-N 3.1Å
93	A	92.4	Very high	91.4	Very high	2 Å²	2	54.6 Å²	54.6	2%	0.017	28%	0.283	C	S	.	.	H	α-helix	trans	-65	-39.8	176.9	0	0	0	0	0	112.1	L89 K90 E91 Q95 L96 L97 I118 M122	L89-A93 WeakPolarHBondContact O-CB 3.38Å; L89-A93 PolarHBondContact O-N 3.02Å; K90-A93 PolarHBondContact O-N 3.24Å; E91-A93 PolarHBondContact O-N 3.08Å; A93-Q95 VanDerWaalsContact C-N 3.33Å; A93-L96 WeakPolarHBondContact O-CB 3.49Å; A93-L96 PolarHBondContact O-N 3Å; A93-L97 PolarHBondContact O-N 2.78Å; A93-I118 HydrophobicContact CB-CG2 4.24Å; A93-M122 HydrophobicContact CB-CE 3.49Å; A93-M122 VanDerWaalsContact CB-CE 3.49Å; A93-M122 HydrophobicContact CB-SD 4.4Å
94	M	93.3	Very high	91.7	Very high	27 Å²	27	49.9 Å²	49.9	13%	0.133	26%	0.261	C	S	.	.	H	α-helix	trans	-65.8	-35.9	173.7	-65.5	-59.5	-73.2	0	0	111.8	K90 E91 L97 A98 W131 E137 M138 L141	K90-M94 HydrophobicContact CG-CG 4.45Å; K90-M94 VanDerWaalsContact O-CG 3.27Å; K90-M94 WeakPolarHBondContact O-CG 3.49Å; K90-M94 PolarHBondContact O-N 3.44Å; E91-M94 PolarHBondContact O-N 3.09Å; M94-L97 WeakPolarHBondContact O-CB 3.33Å; M94-L97 PolarHBondContact O-N 2.96Å; M94-L97 HydrophobicContact SD-CD1 3.87Å; M94-A98 PolarHBondContact O-N 3.48Å; M94-W131 HydrophobicContact SD-CH2 4.15Å; M94-W131 HydrophobicContact SD-CZ2 3.98Å; M94-E137 HydrophobicContact CE-CB 3.92Å; M94-M138 HydrophobicContact CE-CE 3.86Å; M94-M138 HydrophobicContact SD-CE 3.83Å; M94-L141 HydrophobicContact CE-CD1 3.38Å; M94-L141 HydrophobicContact CE-CG 4.12Å; M94-L141 HydrophobicContact SD-CD1 4.25Å
95	Q	93.1	Very high	91.9	Very high	122 Å²	122	46.7 Å²	46.7	57%	0.57	25%	0.248	S	C	*	.	H	α-helix	trans	-67.5	-36.9	172.8	-171	177.9	8.6	0	0	112.3	E91 C92 A93 L97 A98 T99 G100	E91-Q95 WeakPolarHBondContact O-CB 3.33Å; E91-Q95 PolarHBondContact O-N 3.36Å; C92-Q95 WeakPolarHBondContact O-CB 3.42Å; C92-Q95 PolarHBondContact O-N 2.91Å; A93-Q95 VanDerWaalsContact C-N 3.33Å; Q95-L97 VanDerWaalsContact C-N 3.33Å; Q95-A98 PolarHBondContact O-N 3.24Å; Q95-T99 PolarHBondContact O-N 3.39Å; Q95-T99 PolarHBondContact O-OG1 2.9Å; Q95-G100 PolarHBondContact O-N 3.03Å
96	L	93	Very high	92.1	Very high	25 Å²	25	48.9 Å²	48.9	13%	0.131	26%	0.259	C	S	.	.	H	α-helix	trans	-64.3	-38	173	-74.2	174.3	0	0	0	111.7	L51 L67 C92 A93 G100 L115	L51-L96 HydrophobicContact CD2-CD1 3.87Å; L67-L96 HydrophobicContact CD2-CD1 4.38Å; C92-L96 WeakPolarHBondContact O-CG 3.45Å; C92-L96 PolarHBondContact O-N 3.1Å; A93-L96 WeakPolarHBondContact O-CB 3.49Å; A93-L96 PolarHBondContact O-N 3Å; L96-G100 CarbonylContact O-C 3.59Å; L96-G100 WeakPolarHBondContact O-CA 3.41Å; L96-G100 PolarHBondContact O-N 3.1Å; L96-L115 HydrophobicContact CB-CD1 3.91Å; L96-L115 HydrophobicContact CD1-CD1 4.32Å
97	L	92.6	Very high	92.3	Very high	3 Å²	3	48 Å²	48	2%	0.016	26%	0.255	C	S	.	.	H	α-helix	trans	-64.6	-44.8	172.3	-71.8	171	0	0	0	112.1	A93 M94 Q95 L115 V119 L141 L151 I155	A93-L97 PolarHBondContact O-N 2.78Å; M94-L97 WeakPolarHBondContact O-CB 3.33Å; M94-L97 PolarHBondContact O-N 2.96Å; M94-L97 HydrophobicContact SD-CD1 3.87Å; Q95-L97 VanDerWaalsContact C-N 3.33Å; L97-L115 HydrophobicContact CD2-CD2 3.59Å; L97-L115 HydrophobicContact CD2-CG 3.86Å; L97-L115 HydrophobicContact CG-CD2 4.24Å; L97-L115 HydrophobicContact CG-CG 4.45Å; L97-V119 HydrophobicContact CD1-CG1 4.48Å; L97-V119 HydrophobicContact CD1-CG2 3.69Å; L97-V119 HydrophobicContact CD2-CG2 4.35Å; L97-V119 HydrophobicContact CG-CG2 4.2Å; L97-L141 HydrophobicContact CB-CD1 4.14Å; L97-L141 HydrophobicContact CB-CD2 4.42Å; L97-L141 HydrophobicContact CD1-CD1 3.8Å; L97-L151 HydrophobicContact CD2-CB 4.03Å; L97-L151 HydrophobicContact CD2-CD1 4.08Å; L97-L151 HydrophobicContact CD2-CG 4.46Å; L97-I155 HydrophobicContact CD1-CD1 4.06Å; L97-I155 HydrophobicContact CD2-CD1 3.94Å
98	A	93.3	Very high	92.4	Very high	19 Å²	19	49.7 Å²	49.7	16%	0.157	26%	0.259	C	S	.	.	H	α-helix	trans	-69	-48.4	-177.2	0	0	0	0	0	112.7	M94 Q95 L141 Q148	M94-A98 PolarHBondContact O-N 3.48Å; Q95-A98 PolarHBondContact O-N 3.24Å; A98-L141 HydrophobicContact CB-CD2 3.99Å; A98-Q148 PolarHBondContact O-NE2 3.49Å
99	T	92.1	Very high	92.5	Very high	93 Å²	93	48.8 Å²	48.8	57%	0.571	26%	0.263	S	S	*	.	H	α-helix	trans	-134.3	2.7	-169.9	58.3	0	0	0	0	114.5	K56 Q95	K56-T99 WeakPolarHBondContact CE-O 3.19Å; K56-T99 PolarHBondContact NZ-O 3.35Å; Q95-T99 PolarHBondContact O-N 3.39Å; Q95-T99 PolarHBondContact O-OG1 2.9Å
100	G	89.3	Confident	92.4	Very high	12 Å²	12	51.8 Å²	51.8	12%	0.124	28%	0.277	C	S	.	.	S	Bend	trans	-95.2	-1.8	-174.6	0	0	0	0	0	115.9	K56 Q95 L96	K56-G100 VanDerWaalsContact CE-CA 3.45Å; K56-G100 VanDerWaalsContact CE-O 3.25Å; K56-G100 WeakPolarHBondContact CE-O 3.39Å; K56-G100 WeakPolarHBondContact CG-O 3.36Å; Q95-G100 PolarHBondContact O-N 3.03Å; L96-G100 CarbonylContact O-C 3.59Å; L96-G100 WeakPolarHBondContact O-CA 3.41Å; L96-G100 PolarHBondContact O-N 3.1Å
101	T	92.3	Very high	92.5	Very high	10 Å²	10	50.2 Å²	50.2	6%	0.061	27%	0.27	C	S	.	.	S	Bend	trans	-113.2	147.4	174.6	52	0	0	0	0	113.9	K56 E107 L115 L151	K56-T101 WeakPolarHBondContact CE-O 3.38Å; K56-T101 PolarHBondContact NZ-O 3.34Å; T101-E107 WeakPolarHBondContact CA-OE2 3.5Å; T101-E107 VanDerWaalsContact CB-OE2 3.25Å; T101-E107 WeakPolarHBondContact CB-OE2 3.33Å; T101-E107 HydrophobicContact CG2-CG 4.48Å; T101-L115 HydrophobicContact CG2-CD2 3.69Å; T101-L151 HydrophobicContact CG2-CD1 3.96Å
102	H	93.1	Very high	92.6	Very high	67 Å²	67	44.8 Å²	44.8	31%	0.31	25%	0.245	S	C	.	.			trans	-62	175.7	170.6	-64.3	-80.3	0	0	0	111	R63 E106 E107	R63-H102 PolarHBondContact NH1-CD2 2.91Å; H102-E106 HydrophobicContact CB-CB 4.2Å; H102-E107 HydrophobicContact CB-CB 3.99Å; H102-E107 IonicContact CD2-OE1 2.77Å; H102-E107 IonicContact CD2-OE2 2.76Å; H102-E107 IonicContact CG-OE2 2.91Å; H102-E107 PolarHBondContact N-OE2 2.8Å
103	S	91.8	Very high	92.6	Very high	55 Å²	55	45.6 Å²	45.6	39%	0.385	25%	0.247	S	C	.	.			trans	-57.7	155.3	175.9	72.1	0	0	0	0	111.1	L105 E106 E107	S103-L105 PolarHBondContact O-N 2.99Å; S103-E106 PolarHBondContact O-N 3.4Å; S103-E106 WeakPolarHBondContact OG-CB 3.36Å; S103-E106 VanDerWaalsContact OG-CG 3.27Å; S103-E106 WeakPolarHBondContact OG-CG 3.34Å; S103-E106 PolarHBondContact OG-OE2 2.96Å; S103-E107 WeakPolarHBondContact O-CB 3.41Å; S103-E107 PolarHBondContact O-N 3.15Å
104	I	92.9	Very high	92.6	Very high	8 Å²	8	45.5 Å²	45.5	4%	0.041	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	-51.9	-35.4	-176	-177.4	167.3	0	0	0	113.4	K112 E146 A147 E150 A218 R221 V222	I104-K112 PolarHBondContact O-NZ 3.25Å; I104-E146 HydrophobicContact CD1-CB 4.05Å; I104-E146 HydrophobicContact CG2-CB 4.26Å; I104-A147 HydrophobicContact CB-CB 4.05Å; I104-E150 HydrophobicContact CD1-CB 4.07Å; I104-E150 WeakPolarHBondContact CG1-OE2 3.37Å; I104-A218 HydrophobicContact CG2-CB 3.51Å; I104-R221 HydrophobicContact CD1-CB 3.99Å; I104-R221 HydrophobicContact CD1-CG 4.03Å; I104-R221 HydrophobicContact CG1-CB 4.47Å; I104-R221 HydrophobicContact CG1-CG 4.2Å; I104-R221 VanDerWaalsContact O-CZ 3.31Å; I104-R221 PolarHBondContact O-NH1 2.94Å; I104-V222 HydrophobicContact CD1-CG2 3.62Å
105	L	91.8	Very high	92.7	Very high	67 Å²	67	44.4 Å²	44.4	35%	0.351	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.6	-24.5	-178.1	-60.8	-178.3	0	0	0	113.9	S103 L214 K217	S103-L105 PolarHBondContact O-N 2.99Å; L105-L214 HydrophobicContact CD1-CB 4.29Å; L105-L214 HydrophobicContact CD1-CD2 3.93Å; L105-L214 WeakPolarHBondContact CD1-O 3.45Å; L105-K217 HydrophobicContact CD1-CB 4.2Å; L105-K217 HydrophobicContact CD2-CB 4.25Å
106	E	93.1	Very high	92.7	Very high	136 Å²	136	38.8 Å²	38.8	64%	0.636	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	-95.4	-27.6	-177.4	-66.6	166.7	160.3	0	0	112.9	H102 S103	H102-E106 HydrophobicContact CB-CB 4.2Å; S103-E106 PolarHBondContact O-N 3.4Å; S103-E106 WeakPolarHBondContact OG-CB 3.36Å; S103-E106 VanDerWaalsContact OG-CG 3.27Å; S103-E106 WeakPolarHBondContact OG-CG 3.34Å; S103-E106 PolarHBondContact OG-OE2 2.96Å
107	E	94.4	Very high	92.7	Very high	7 Å²	7	39.8 Å²	39.8	3%	0.033	22%	0.216	C	C	.	.	S	Bend	trans	-73.5	133.4	-176.1	-174.3	69.7	-93.1	0	0	112.1	R63 T101 H102 S103 K112	R63-E107 IonicContact CZ-OE1 2.77Å; R63-E107 IonicContact CZ-OE2 2.88Å; R63-E107 IonicContact NH1-OE1 3.33Å; R63-E107 PolarHBondContact NH1-OE1 2.97Å; R63-E107 IonicContact NH1-OE2 3.15Å; R63-E107 VanDerWaalsContact NH2-CD 3.31Å; R63-E107 IonicContact NH2-OE1 3.04Å; R63-E107 PolarHBondContact NH2-OE1 3.3Å; R63-E107 VanDerWaalsContact NH2-OE1 3.13Å; R63-E107 IonicContact NH2-OE2 3.99Å; R63-E107 PolarHBondContact NH2-OE2 3.15Å; T101-E107 WeakPolarHBondContact CA-OE2 3.5Å; T101-E107 VanDerWaalsContact CB-OE2 3.25Å; T101-E107 WeakPolarHBondContact CB-OE2 3.33Å; T101-E107 HydrophobicContact CG2-CG 4.48Å; H102-E107 HydrophobicContact CB-CB 3.99Å; H102-E107 IonicContact CD2-OE1 2.77Å; H102-E107 IonicContact CD2-OE2 2.76Å; H102-E107 IonicContact CG-OE2 2.91Å; H102-E107 PolarHBondContact N-OE2 2.8Å; S103-E107 WeakPolarHBondContact O-CB 3.41Å; S103-E107 PolarHBondContact O-N 3.15Å; E107-K112 VanDerWaalsContact CB-CE 3.43Å; E107-K112 HydrophobicContact CG-CD 4.39Å; E107-K112 HydrophobicContact CG-CG 3.84Å; E107-K112 VanDerWaalsContact O-CE 3.25Å; E107-K112 WeakPolarHBondContact O-CE 3.38Å; E107-K112 PolarHBondContact O-NZ 2.87Å
108	E	93.3	Very high	92.8	Very high	96 Å²	96	39.7 Å²	39.7	45%	0.449	22%	0.216	S	C	.	.			trans	-68.5	138.2	-178.4	-68.7	-65	163.8	0	0	112.5	A60 H110 V111 K112	A60-E108 HydrophobicContact CB-CG 3.96Å; E108-H110 VanDerWaalsContact C-N 3.34Å; E108-H110 VanDerWaalsContact CB-CE1 3.46Å; E108-H110 WeakPolarHBondContact CB-CE1 3.33Å; E108-H110 PolarHBondContact O-N 3.4Å; E108-H110 IonicContact OE2-CE1 3.45Å; E108-V111 HydrophobicContact CB-CB 4.45Å; E108-V111 HydrophobicContact CB-CG2 4.02Å; E108-V111 PolarHBondContact O-N 3.25Å; E108-V111 VanDerWaalsContact O-N 3.15Å; E108-K112 PolarHBondContact O-N 3.49Å
109	S	90.8	Very high	92.9	Very high	79 Å²	79	38.8 Å²	38.8	55%	0.552	21%	0.208	S	C	*	.	H	α-helix	trans	-60	-40.9	-176.9	57	0	0	0	0	113	V111 K112 D113	S109-V111 VanDerWaalsContact C-N 3.26Å; S109-V111 PolarHBondContact O-N 2.88Å; S109-K112 PolarHBondContact O-N 3.21Å; S109-D113 PolarHBondContact O-N 3.31Å
110	H	90.9	Very high	93.1	Very high	66 Å²	66	34.3 Å²	34.3	31%	0.306	18%	0.181	S	C	.	.	H	α-helix	trans	-68.8	-23.1	-179.5	63.6	-94.4	0	0	0	113.2	H64 E108 A114	H64-H110 PolarHBondContact CE1-O 2.89Å; H64-H110 AromaticContact CG-CD2 3.98Å; H64-H110 AromaticContact ND1-CD2 3.69Å; H64-H110 PolarHBondContact ND1-O 3.07Å; E108-H110 VanDerWaalsContact C-N 3.34Å; E108-H110 VanDerWaalsContact CB-CE1 3.46Å; E108-H110 WeakPolarHBondContact CB-CE1 3.33Å; E108-H110 PolarHBondContact O-N 3.4Å; E108-H110 IonicContact OE2-CE1 3.45Å; H110-A114 WeakPolarHBondContact O-CB 3.46Å; H110-A114 PolarHBondContact O-N 3.2Å
111	V	94.4	Very high	93.2	Very high	2 Å²	2	34.2 Å²	34.2	1%	0.012	18%	0.177	C	C	.	.	H	α-helix	trans	-76.5	-44.8	172.8	177.5	0	0	0	0	110.1	A60 L67 E108 S109 D113 A114 L115	A60-V111 HydrophobicContact CB-CG2 4.34Å; L67-V111 HydrophobicContact CD1-CG1 3.87Å; E108-V111 HydrophobicContact CB-CB 4.45Å; E108-V111 HydrophobicContact CB-CG2 4.02Å; E108-V111 PolarHBondContact O-N 3.25Å; E108-V111 VanDerWaalsContact O-N 3.15Å; S109-V111 VanDerWaalsContact C-N 3.26Å; S109-V111 PolarHBondContact O-N 2.88Å; V111-D113 VanDerWaalsContact C-N 3.33Å; V111-D113 PolarHBondContact O-N 2.88Å; V111-A114 PolarHBondContact O-N 3.32Å; V111-L115 WeakPolarHBondContact O-CB 3.48Å; V111-L115 PolarHBondContact O-N 3.03Å
112	K	93.9	Very high	93.3	Very high	6 Å²	6	33.8 Å²	33.8	3%	0.026	18%	0.175	C	C	.	.	H	α-helix	trans	-58.4	-45.1	174.4	-60.6	177.6	-173.3	-177.8	0	111.4	I104 E107 E108 S109 L115 S116 E150 L151 L154 R221	I104-K112 PolarHBondContact O-NZ 3.25Å; E107-K112 VanDerWaalsContact CB-CE 3.43Å; E107-K112 HydrophobicContact CG-CD 4.39Å; E107-K112 HydrophobicContact CG-CG 3.84Å; E107-K112 VanDerWaalsContact O-CE 3.25Å; E107-K112 WeakPolarHBondContact O-CE 3.38Å; E107-K112 PolarHBondContact O-NZ 2.87Å; E108-K112 PolarHBondContact O-N 3.49Å; S109-K112 PolarHBondContact O-N 3.21Å; K112-L115 PolarHBondContact O-N 3.24Å; K112-S116 WeakPolarHBondContact O-CB 3.42Å; K112-S116 PolarHBondContact O-N 2.9Å; K112-E150 WeakPolarHBondContact CD-OE2 3.29Å; K112-E150 WeakPolarHBondContact CE-OE2 3.27Å; K112-E150 IonicContact NZ-OE1 2.7Å; K112-E150 IonicContact NZ-OE2 3.6Å; K112-E150 PolarHBondContact NZ-OE2 3.42Å; K112-L151 HydrophobicContact CB-CD2 3.8Å; K112-L151 HydrophobicContact CG-CD2 4.02Å; K112-L154 HydrophobicContact CB-CD1 3.84Å; K112-R221 VanDerWaalsContact NZ-CZ 3.26Å
113	D	92.6	Very high	93.4	Very high	56 Å²	56	30.6 Å²	30.6	30%	0.299	16%	0.16	S	C	.	.	H	α-helix	trans	-58.4	-51.6	175.1	171.7	69.9	0	0	0	111.7	S109 V111 L115 S116 R117	S109-D113 PolarHBondContact O-N 3.31Å; V111-D113 VanDerWaalsContact C-N 3.33Å; V111-D113 PolarHBondContact O-N 2.88Å; D113-L115 VanDerWaalsContact C-N 3.31Å; D113-L115 PolarHBondContact O-N 3.19Å; D113-S116 PolarHBondContact O-N 3.24Å; D113-S116 VanDerWaalsContact O-N 3.15Å; D113-S116 PolarHBondContact O-OG 2.72Å; D113-R117 PolarHBondContact O-N 3.36Å; D113-R117 IonicContact OD2-CZ 3.78Å; D113-R117 VanDerWaalsContact OD2-CZ 3.24Å; D113-R117 IonicContact OD2-NE 3.32Å; D113-R117 PolarHBondContact OD2-NE 3.47Å; D113-R117 IonicContact OD2-NH2 3.22Å; D113-R117 PolarHBondContact OD2-NH2 2.92Å
114	A	93.3	Very high	93.3	Very high	0 Å²	0	28.1 Å²	28.1	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-59.9	-40.4	179.6	0	0	0	0	0	112.6	L67 H110 V111 R117 I118	L67-A114 HydrophobicContact CB-CB 3.87Å; L67-A114 HydrophobicContact CD1-CB 3.9Å; H110-A114 WeakPolarHBondContact O-CB 3.46Å; H110-A114 PolarHBondContact O-N 3.2Å; V111-A114 PolarHBondContact O-N 3.32Å; A114-R117 PolarHBondContact O-N 3.25Å; A114-I118 WeakPolarHBondContact O-CG1 3.49Å; A114-I118 PolarHBondContact O-N 3.01Å; A114-I118 VanDerWaalsContact O-N 3.16Å
115	L	94.5	Very high	93.2	Very high	4 Å²	4	28.2 Å²	28.2	2%	0.021	14%	0.142	C	C	.	.	H	α-helix	trans	-66.7	-40.8	176.2	-166.8	68.1	0	0	0	111.7	L67 L96 L97 T101 V111 K112 D113 R117 I118 V119 L151	L67-L115 HydrophobicContact CD1-CB 4.42Å; L67-L115 HydrophobicContact CD2-CD1 3.81Å; L96-L115 HydrophobicContact CB-CD1 3.91Å; L96-L115 HydrophobicContact CD1-CD1 4.32Å; L97-L115 HydrophobicContact CD2-CD2 3.59Å; L97-L115 HydrophobicContact CD2-CG 3.86Å; L97-L115 HydrophobicContact CG-CD2 4.24Å; L97-L115 HydrophobicContact CG-CG 4.45Å; T101-L115 HydrophobicContact CG2-CD2 3.69Å; V111-L115 WeakPolarHBondContact O-CB 3.48Å; V111-L115 PolarHBondContact O-N 3.03Å; K112-L115 PolarHBondContact O-N 3.24Å; D113-L115 VanDerWaalsContact C-N 3.31Å; D113-L115 PolarHBondContact O-N 3.19Å; L115-R117 VanDerWaalsContact C-N 3.34Å; L115-R117 PolarHBondContact O-N 3.32Å; L115-I118 WeakPolarHBondContact O-CB 3.41Å; L115-I118 PolarHBondContact O-N 3.18Å; L115-V119 WeakPolarHBondContact O-CG2 3.42Å; L115-V119 PolarHBondContact O-N 2.98Å; L115-L151 HydrophobicContact CD2-CD1 4.22Å; L115-L151 HydrophobicContact CD2-CD2 4.25Å
116	S	94.6	Very high	93.1	Very high	3 Å²	3	25.4 Å²	25.4	2%	0.021	13%	0.127	C	C	.	.	H	α-helix	trans	-62.2	-40.8	174.9	79.7	0	0	0	0	111.9	K112 D113 I118 V119 V120	K112-S116 WeakPolarHBondContact O-CB 3.42Å; K112-S116 PolarHBondContact O-N 2.9Å; D113-S116 PolarHBondContact O-N 3.24Å; D113-S116 VanDerWaalsContact O-N 3.15Å; D113-S116 PolarHBondContact O-OG 2.72Å; S116-I118 PolarHBondContact O-N 3.22Å; S116-V119 PolarHBondContact O-N 3.43Å; S116-V120 WeakPolarHBondContact O-CG2 3.45Å; S116-V120 PolarHBondContact O-N 3.33Å
117	R	92.4	Very high	93	Very high	46 Å²	46	19.1 Å²	19.1	17%	0.174	10%	0.098	C	C	.	.	H	α-helix	trans	-59.2	-46.2	176.1	-79.1	-172.9	-86.3	151.8	-13.6	112.1	H64 E71 D113 A114 L115 V119 V120 E121	H64-R117 PolarHBondContact CE1-NH2 3.33Å; E71-R117 IonicContact OE1-NH1 2.78Å; E71-R117 IonicContact OE2-CZ 3.28Å; E71-R117 IonicContact OE2-NE 2.59Å; E71-R117 IonicContact OE2-NH1 2.67Å; E71-R117 PolarHBondContact OE2-NH1 2.88Å; D113-R117 PolarHBondContact O-N 3.36Å; D113-R117 IonicContact OD2-CZ 3.78Å; D113-R117 VanDerWaalsContact OD2-CZ 3.24Å; D113-R117 IonicContact OD2-NE 3.32Å; D113-R117 PolarHBondContact OD2-NE 3.47Å; D113-R117 IonicContact OD2-NH2 3.22Å; D113-R117 PolarHBondContact OD2-NH2 2.92Å; A114-R117 PolarHBondContact O-N 3.25Å; L115-R117 VanDerWaalsContact C-N 3.34Å; L115-R117 PolarHBondContact O-N 3.32Å; R117-V119 VanDerWaalsContact C-N 3.3Å; R117-V119 PolarHBondContact O-N 3.43Å; R117-V120 PolarHBondContact O-N 3.1Å; R117-E121 WeakPolarHBondContact O-CB 3.28Å; R117-E121 VanDerWaalsContact O-CG 3.24Å; R117-E121 WeakPolarHBondContact O-CG 3.48Å; R117-E121 PolarHBondContact O-N 3.48Å
118	I	95	Very high	92.6	Very high	1 Å²	1	19.1 Å²	19.1	1%	0.005	10%	0.098	C	C	.	.	H	α-helix	trans	-54.2	-49.5	176.6	-75	167.9	0	0	0	110.7	L67 L70 E71 I74 A93 A114 L115 S116 E121 M122	L67-I118 HydrophobicContact CB-CD1 3.82Å; L67-I118 HydrophobicContact CD2-CD1 3.55Å; L67-I118 HydrophobicContact CG-CD1 4.27Å; L67-I118 WeakPolarHBondContact O-CD1 3.33Å; L70-I118 HydrophobicContact CB-CD1 3.9Å; L70-I118 HydrophobicContact CB-CG1 4.39Å; L70-I118 HydrophobicContact CD1-CD1 4.33Å; E71-I118 HydrophobicContact CB-CG1 4.02Å; I74-I118 HydrophobicContact CD1-CB 4.36Å; I74-I118 HydrophobicContact CD1-CG2 3.63Å; A93-I118 HydrophobicContact CB-CG2 4.24Å; A114-I118 WeakPolarHBondContact O-CG1 3.49Å; A114-I118 PolarHBondContact O-N 3.01Å; A114-I118 VanDerWaalsContact O-N 3.16Å; L115-I118 WeakPolarHBondContact O-CB 3.41Å; L115-I118 PolarHBondContact O-N 3.18Å; S116-I118 PolarHBondContact O-N 3.22Å; I118-E121 PolarHBondContact O-N 2.94Å; I118-M122 HydrophobicContact CG2-CE 4.15Å; I118-M122 WeakPolarHBondContact O-CG 3.5Å; I118-M122 PolarHBondContact O-N 2.98Å; I118-M122 VanDerWaalsContact O-N 3.12Å
119	V	95.4	Very high	92.3	Very high	0 Å²	0	15.9 Å²	15.9	0%	0	8%	0.083	C	C	.	.	H	α-helix	trans	-69.7	-44.9	-175.2	-180	0	0	0	0	110.9	L97 L115 S116 R117 E121 M122 I123 M138 I155	L97-V119 HydrophobicContact CD1-CG1 4.48Å; L97-V119 HydrophobicContact CD1-CG2 3.69Å; L97-V119 HydrophobicContact CD2-CG2 4.35Å; L97-V119 HydrophobicContact CG-CG2 4.2Å; L115-V119 WeakPolarHBondContact O-CG2 3.42Å; L115-V119 PolarHBondContact O-N 2.98Å; S116-V119 PolarHBondContact O-N 3.43Å; R117-V119 VanDerWaalsContact C-N 3.3Å; R117-V119 PolarHBondContact O-N 3.43Å; V119-E121 VanDerWaalsContact C-N 3.3Å; V119-E121 PolarHBondContact O-N 3.27Å; V119-M122 HydrophobicContact CB-CE 4.46Å; V119-M122 HydrophobicContact CG2-CE 4.26Å; V119-M122 WeakPolarHBondContact O-CB 3.27Å; V119-M122 PolarHBondContact O-N 3.34Å; V119-M122 VanDerWaalsContact O-N 3.09Å; V119-I123 HydrophobicContact CG1-CD1 4.04Å; V119-I123 HydrophobicContact CG1-CG1 4.43Å; V119-I123 WeakPolarHBondContact O-CG1 3.41Å; V119-I123 PolarHBondContact O-N 3.25Å; V119-M138 HydrophobicContact CG1-CE 3.97Å; V119-I155 HydrophobicContact CB-CD1 3.94Å; V119-I155 HydrophobicContact CB-CG1 4.15Å; V119-I155 HydrophobicContact CG1-CD1 3.84Å; V119-I155 HydrophobicContact CG1-CG1 4.29Å; V119-I155 HydrophobicContact CG1-CG2 4.08Å; V119-I155 HydrophobicContact CG2-CD1 4.15Å
120	V	94.8	Very high	92.2	Very high	0 Å²	0	16.8 Å²	16.8	0%	0	8%	0.078	C	C	.	.	H	α-helix	trans	-60.4	-40.5	175.3	173.8	0	0	0	0	111.2	S116 R117 M122 I123 K124 I155 R158 L159	S116-V120 WeakPolarHBondContact O-CG2 3.45Å; S116-V120 PolarHBondContact O-N 3.33Å; R117-V120 PolarHBondContact O-N 3.1Å; V120-M122 VanDerWaalsContact C-N 3.3Å; V120-M122 PolarHBondContact O-N 3Å; V120-I123 PolarHBondContact O-N 2.86Å; V120-K124 HydrophobicContact CG1-CD 4.25Å; V120-K124 HydrophobicContact CG1-CG 4.31Å; V120-K124 VanDerWaalsContact O-CG 3.27Å; V120-K124 WeakPolarHBondContact O-CG 3.48Å; V120-K124 PolarHBondContact O-N 2.88Å; V120-I155 HydrophobicContact CG2-CB 4.38Å; V120-I155 HydrophobicContact CG2-CG2 3.88Å; V120-I155 VanDerWaalsContact CG2-O 3.31Å; V120-I155 WeakPolarHBondContact CG2-O 3.43Å; V120-R158 HydrophobicContact CG1-CG 4.42Å; V120-R158 HydrophobicContact CG2-CB 4.07Å; V120-R158 HydrophobicContact CG2-CG 4.2Å; V120-L159 HydrophobicContact CG1-CB 4.41Å; V120-L159 HydrophobicContact CG1-CD1 4.33Å; V120-L159 HydrophobicContact CG2-CB 4.36Å
121	E	92.7	Very high	92.2	Very high	9 Å²	9	13.8 Å²	13.8	4%	0.042	6%	0.064	C	C	.	.	H	α-helix	trans	-62.3	-34.3	175.1	-75	-65.7	161.3	0	0	113	E71 I74 K75 R117 I118 V119 K124 R125	E71-E121 HydrophobicContact CG-CG 4.48Å; I74-E121 HydrophobicContact CG2-CB 3.75Å; K75-E121 WeakPolarHBondContact CE-OE1 3.33Å; K75-E121 HydrophobicContact CG-CG 4.2Å; K75-E121 IonicContact NZ-OE1 3.48Å; R117-E121 WeakPolarHBondContact O-CB 3.28Å; R117-E121 VanDerWaalsContact O-CG 3.24Å; R117-E121 WeakPolarHBondContact O-CG 3.48Å; R117-E121 PolarHBondContact O-N 3.48Å; I118-E121 PolarHBondContact O-N 2.94Å; V119-E121 VanDerWaalsContact C-N 3.3Å; V119-E121 PolarHBondContact O-N 3.27Å; E121-K124 VanDerWaalsContact CD-NZ 3.25Å; E121-K124 WeakPolarHBondContact OE1-CE 3.42Å; E121-K124 IonicContact OE1-NZ 2.8Å; E121-K124 PolarHBondContact OE1-NZ 3.26Å; E121-K124 WeakPolarHBondContact OE2-CE 3.39Å; E121-K124 IonicContact OE2-NZ 2.78Å; E121-R125 WeakPolarHBondContact O-CD 3.44Å; E121-R125 WeakPolarHBondContact O-CG 3.49Å; E121-R125 PolarHBondContact O-NH1 3.07Å; E121-R125 IonicContact OE2-CZ 2.72Å; E121-R125 IonicContact OE2-NH1 2.69Å; E121-R125 PolarHBondContact OE2-NH1 3.34Å
122	M	94.1	Very high	91.9	Very high	1 Å²	1	18.2 Å²	18.2	1%	0.005	9%	0.093	C	C	.	.	H	α-helix	trans	-71.8	-42.7	171.8	-65.4	-172.9	-65.9	0	0	112.1	I74 W78 K90 A93 I118 V119 V120 K124 R125 E126 W131	I74-M122 HydrophobicContact CD1-CG 3.85Å; I74-M122 HydrophobicContact CD1-SD 4.24Å; I74-M122 HydrophobicContact CG1-CG 4.31Å; I74-M122 HydrophobicContact CG2-CG 4.02Å; W78-M122 HydrophobicContact CH2-CB 4.48Å; W78-M122 HydrophobicContact CH2-CG 3.83Å; W78-M122 HydrophobicContact CH2-SD 3.92Å; W78-M122 HydrophobicContact CZ3-CG 3.96Å; W78-M122 HydrophobicContact CZ3-SD 4.16Å; K90-M122 HydrophobicContact CB-SD 4.29Å; A93-M122 HydrophobicContact CB-CE 3.49Å; A93-M122 VanDerWaalsContact CB-CE 3.49Å; A93-M122 HydrophobicContact CB-SD 4.4Å; I118-M122 HydrophobicContact CG2-CE 4.15Å; I118-M122 WeakPolarHBondContact O-CG 3.5Å; I118-M122 PolarHBondContact O-N 2.98Å; I118-M122 VanDerWaalsContact O-N 3.12Å; V119-M122 HydrophobicContact CB-CE 4.46Å; V119-M122 HydrophobicContact CG2-CE 4.26Å; V119-M122 WeakPolarHBondContact O-CB 3.27Å; V119-M122 PolarHBondContact O-N 3.34Å; V119-M122 VanDerWaalsContact O-N 3.09Å; V120-M122 VanDerWaalsContact C-N 3.3Å; V120-M122 PolarHBondContact O-N 3Å; M122-K124 VanDerWaalsContact C-N 3.32Å; M122-K124 PolarHBondContact O-N 3.21Å; M122-R125 WeakPolarHBondContact O-CB 3.46Å; M122-R125 PolarHBondContact O-N 3.31Å; M122-E126 PolarHBondContact O-N 3.48Å; M122-W131 HydrophobicContact CB-CZ3 4.05Å
123	I	93.9	Very high	91.8	Very high	0 Å²	0	21.3 Å²	21.3	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-55.4	-49.4	175.4	-68.8	170.5	0	0	0	109.8	V119 V120 R125 E126 W127 W131 M134 I155 L159	V119-I123 HydrophobicContact CG1-CD1 4.04Å; V119-I123 HydrophobicContact CG1-CG1 4.43Å; V119-I123 WeakPolarHBondContact O-CG1 3.41Å; V119-I123 PolarHBondContact O-N 3.25Å; V120-I123 PolarHBondContact O-N 2.86Å; I123-R125 PolarHBondContact O-N 3.04Å; I123-E126 PolarHBondContact O-N 3.47Å; I123-W127 HydrophobicContact CB-CB 4.37Å; I123-W127 HydrophobicContact CG2-CB 3.69Å; I123-W127 HydrophobicContact CG2-CD2 4.15Å; I123-W127 HydrophobicContact CG2-CE3 3.74Å; I123-W127 HydrophobicContact CG2-CG 4.14Å; I123-W127 VanDerWaalsContact O-CB 3.29Å; I123-W127 WeakPolarHBondContact O-CB 3.38Å; I123-W127 PolarHBondContact O-N 3.46Å; I123-W131 HydrophobicContact CG1-CZ3 4.15Å; I123-M134 HydrophobicContact CD1-CE 4.31Å; I123-M134 HydrophobicContact CD1-CG 4.31Å; I123-M134 HydrophobicContact CD1-SD 3.88Å; I123-M134 HydrophobicContact CG1-CG 4.1Å; I123-M134 HydrophobicContact CG1-SD 4.29Å; I123-M134 HydrophobicContact CG2-CE 4.19Å; I123-I155 HydrophobicContact CD1-CG2 3.73Å; I123-L159 HydrophobicContact CG2-CD1 3.73Å; I123-L159 HydrophobicContact CG2-CD2 3.97Å
124	K	90.5	Very high	91.8	Very high	4 Å²	4	18.7 Å²	18.7	2%	0.017	10%	0.096	C	C	.	.	H	α-helix	trans	-55.5	-28.1	178.2	-71	-173.3	-63.3	-167.7	0	113.1	V120 E121 M122 D162 L169 R173 I1186	V120-K124 HydrophobicContact CG1-CD 4.25Å; V120-K124 HydrophobicContact CG1-CG 4.31Å; V120-K124 VanDerWaalsContact O-CG 3.27Å; V120-K124 WeakPolarHBondContact O-CG 3.48Å; V120-K124 PolarHBondContact O-N 2.88Å; E121-K124 VanDerWaalsContact CD-NZ 3.25Å; E121-K124 WeakPolarHBondContact OE1-CE 3.42Å; E121-K124 IonicContact OE1-NZ 2.8Å; E121-K124 PolarHBondContact OE1-NZ 3.26Å; E121-K124 WeakPolarHBondContact OE2-CE 3.39Å; E121-K124 IonicContact OE2-NZ 2.78Å; M122-K124 VanDerWaalsContact C-N 3.32Å; M122-K124 PolarHBondContact O-N 3.21Å; K124-D162 HydrophobicContact CD-CB 4.29Å; K124-D162 IonicContact NZ-OD2 2.73Å; K124-D162 PolarHBondContact NZ-OD2 2.89Å; K124-L169 HydrophobicContact CB-CD2 3.77Å; K124-L169 HydrophobicContact CB-CG 4.48Å; K124-L169 HydrophobicContact CD-CD1 3.73Å; K124-L169 HydrophobicContact CD-CD2 4.06Å; K124-L169 HydrophobicContact CD-CG 3.89Å; K124-L169 HydrophobicContact CG-CD1 4.15Å; K124-L169 HydrophobicContact CG-CD2 3.8Å; K124-L169 HydrophobicContact CG-CG 4.2Å; K124-R173 PolarHBondContact O-NE 3.38Å; K124-I1186 HydrophobicContact CB-CD1 4.18Å
125	R	90	Very high	91.8	Very high	9 Å²	9	20.5 Å²	20.5	3%	0.034	11%	0.105	C	C	.	.	H	α-helix	trans	-89.6	-37.3	-178.7	-72.9	165.6	167.3	67.6	18.8	114.5	I74 K75 W78 E121 M122 I123 R173 I1186	I74-R125 PolarHBondContact O-NE 3.45Å; I74-R125 PolarHBondContact O-NH2 3.46Å; K75-R125 PolarHBondContact O-NH2 3.02Å; W78-R125 VanDerWaalsContact CG-CD 3.44Å; W78-R125 HydrophobicContact CG-CG 4.5Å; E121-R125 WeakPolarHBondContact O-CD 3.44Å; E121-R125 WeakPolarHBondContact O-CG 3.49Å; E121-R125 PolarHBondContact O-NH1 3.07Å; E121-R125 IonicContact OE2-CZ 2.72Å; E121-R125 IonicContact OE2-NH1 2.69Å; E121-R125 PolarHBondContact OE2-NH1 3.34Å; M122-R125 WeakPolarHBondContact O-CB 3.46Å; M122-R125 PolarHBondContact O-N 3.31Å; I123-R125 PolarHBondContact O-N 3.04Å; R125-R173 PolarHBondContact O-NH2 3.32Å; R125-I1186 HydrophobicContact CG-CG2 4.35Å
126	E	90.2	Very high	91.7	Very high	9 Å²	9	26.9 Å²	26.9	4%	0.042	13%	0.133	C	C	.	.	H	α-helix	trans	-117.8	-30.7	-167.7	-60.4	-149.1	151.8	0	0	114.2	W78 M122 I123 Q129 H130 W131 R173	W78-E126 HydrophobicContact CZ2-CG 3.91Å; W78-E126 VanDerWaalsContact CZ2-OE1 3.29Å; W78-E126 WeakPolarHBondContact CZ2-OE1 3.49Å; W78-E126 PolarHBondContact NE1-OE1 3.02Å; M122-E126 PolarHBondContact O-N 3.48Å; I123-E126 PolarHBondContact O-N 3.47Å; E126-Q129 PolarHBondContact O-N 3Å; E126-H130 HydrophobicContact CB-CB 4.13Å; E126-H130 PolarHBondContact O-N 2.93Å; E126-W131 HydrophobicContact CB-CB 4.4Å; E126-R173 VanDerWaalsContact N-NH2 3.17Å; E126-R173 PolarHBondContact O-NH2 2.87Å
127	W	91.3	Very high	91.7	Very high	4 Å²	4	29.4 Å²	29.4	2%	0.015	15%	0.145	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.3	127.9	178.5	-173.2	69.4	0	0	0	111.8	I123 W131 M134 L135 L159 R173 I177 T180 L181	I123-W127 HydrophobicContact CB-CB 4.37Å; I123-W127 HydrophobicContact CG2-CB 3.69Å; I123-W127 HydrophobicContact CG2-CD2 4.15Å; I123-W127 HydrophobicContact CG2-CE3 3.74Å; I123-W127 HydrophobicContact CG2-CG 4.14Å; I123-W127 VanDerWaalsContact O-CB 3.29Å; I123-W127 WeakPolarHBondContact O-CB 3.38Å; I123-W127 PolarHBondContact O-N 3.46Å; W127-W131 VanDerWaalsContact CD1-O 3.26Å; W127-M134 HydrophobicContact CD2-CE 3.45Å; W127-M134 VanDerWaalsContact CD2-CE 3.45Å; W127-M134 VanDerWaalsContact CE2-CE 3.42Å; W127-M134 HydrophobicContact CE3-CE 3.91Å; W127-M134 HydrophobicContact CG-CB 4.29Å; W127-M134 HydrophobicContact CG-CE 3.71Å; W127-M134 HydrophobicContact CG-CG 4.48Å; W127-M134 HydrophobicContact CH2-CE 4.31Å; W127-M134 HydrophobicContact CZ2-CE 3.9Å; W127-M134 HydrophobicContact CZ3-CE 4.29Å; W127-L135 HydrophobicContact CZ2-CD1 4.25Å; W127-L135 HydrophobicContact CZ2-CG 4.37Å; W127-L159 HydrophobicContact CE3-CD2 4.47Å; W127-L159 HydrophobicContact CZ3-CD2 4.14Å; W127-R173 PolarHBondContact O-NH2 3.48Å; W127-I177 HydrophobicContact CE3-CG1 4.48Å; W127-I177 HydrophobicContact CE3-CG2 3.91Å; W127-I177 HydrophobicContact CZ3-CG2 3.63Å; W127-T180 HydrophobicContact CH2-CG2 4.14Å; W127-T180 HydrophobicContact CZ2-CG2 3.69Å; W127-L181 HydrophobicContact CH2-CD2 3.62Å; W127-L181 HydrophobicContact CH2-CG 3.73Å; W127-L181 HydrophobicContact CZ3-CD2 3.87Å; W127-L181 HydrophobicContact CZ3-CG 3.81Å
128	P	86.5	Confident	91.8	Very high	7 Å²	7	27.4 Å²	27.4	5%	0.045	14%	0.137	C	C	.	.	T	Hydrogen-bonded Turn	cis	-97.4	-23.7	15.5	35.8	-41.5	0	0	0	118	H130 W131 T180 L1192	P128-H130 PolarHBondContact O-N 3.26Å; P128-W131 CarbonylContact O-C 3.46Å; P128-T180 HydrophobicContact CB-CG2 3.81Å; P128-T180 HydrophobicContact CG-CG2 4.24Å; P128-T180 WeakPolarHBondContact CG-OG1 3.38Å; P128-L1192 HydrophobicContact CB-CD1 3.72Å; P128-L1192 HydrophobicContact CG-CD1 3.41Å; P128-L1192 VanDerWaalsContact CG-CD1 3.41Å; P128-L1192 HydrophobicContact CG-CG 4.44Å
129	Q	87.3	Confident	91.7	Very high	27 Å²	27	32.4 Å²	32.4	13%	0.126	16%	0.161	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64	-44.4	-165.7	-68.4	75.7	3.2	0	0	114.4	E126 L1189 P1190 L1192	E126-Q129 PolarHBondContact O-N 3Å; Q129-L1189 HydrophobicContact CB-CB 4.19Å; Q129-L1189 HydrophobicContact CB-CD1 3.86Å; Q129-L1189 HydrophobicContact CG-CB 3.85Å; Q129-L1189 HydrophobicContact CG-CD1 4.36Å; Q129-P1190 WeakPolarHBondContact CG-O 3.35Å; Q129-P1190 PolarHBondContact NE2-O 3.17Å; Q129-L1192 HydrophobicContact CB-CD2 4.46Å; Q129-L1192 HydrophobicContact CG-CD1 4.4Å; Q129-L1192 HydrophobicContact CG-CD2 3.88Å; Q129-L1192 HydrophobicContact CG-CG 3.82Å
130	H	87.1	Confident	91.6	Very high	98 Å²	98	35.7 Å²	35.7	45%	0.454	18%	0.183	S	C	.	.	T	Hydrogen-bonded Turn	trans	-101.2	-0.6	-173.1	-62.8	158.5	0	0	0	112.4	E126 P128 L1189	E126-H130 HydrophobicContact CB-CB 4.13Å; E126-H130 PolarHBondContact O-N 2.93Å; P128-H130 PolarHBondContact O-N 3.26Å; H130-L1189 HydrophobicContact CB-CD1 4.48Å; H130-L1189 WeakPolarHBondContact CE1-CD2 3.48Å; H130-L1189 WeakPolarHBondContact ND1-CD1 3.39Å
131	W	91.4	Very high	91.6	Very high	3 Å²	3	36.1 Å²	36.1	1%	0.011	19%	0.186	C	C	.	.			trans	-139.1	59.1	176.4	-163.8	-7.9	0	0	0	111.2	K90 M94 M122 I123 E126 W127 P128 D133 M134 E137 M138	K90-W131 HydrophobicContact CD-CD2 4.03Å; K90-W131 HydrophobicContact CD-CE3 4.12Å; K90-W131 HydrophobicContact CD-CH2 4.08Å; K90-W131 HydrophobicContact CD-CZ2 4Å; K90-W131 HydrophobicContact CD-CZ3 4.15Å; K90-W131 HydrophobicContact CG-CH2 4Å; K90-W131 HydrophobicContact CG-CZ2 4.22Å; K90-W131 HydrophobicContact CG-CZ3 4.28Å; M94-W131 HydrophobicContact SD-CH2 4.15Å; M94-W131 HydrophobicContact SD-CZ2 3.98Å; M122-W131 HydrophobicContact CB-CZ3 4.05Å; I123-W131 HydrophobicContact CG1-CZ3 4.15Å; E126-W131 HydrophobicContact CB-CB 4.4Å; W127-W131 VanDerWaalsContact CD1-O 3.26Å; P128-W131 CarbonylContact O-C 3.46Å; W131-D133 VanDerWaalsContact C-N 3.27Å; W131-D133 PolarHBondContact O-N 3.46Å; W131-M134 HydrophobicContact CB-CB 4.41Å; W131-M134 HydrophobicContact CD2-CB 3.9Å; W131-M134 HydrophobicContact CD2-CG 3.91Å; W131-M134 HydrophobicContact CE3-CG 4.33Å; W131-M134 HydrophobicContact CG-CB 3.73Å; W131-M134 HydrophobicContact CG-CG 4.28Å; W131-M134 HydrophobicContact CZ2-CG 4.17Å; W131-M134 WeakPolarHBondContact O-CB 3.43Å; W131-M134 PolarHBondContact O-N 3.48Å; W131-M134 VanDerWaalsContact O-N 3.15Å; W131-E137 WeakPolarHBondContact CZ2-OE2 3.46Å; W131-E137 PolarHBondContact NE1-OE1 3.01Å; W131-E137 PolarHBondContact NE1-OE2 2.97Å; W131-M138 HydrophobicContact CH2-CE 4.46Å; W131-M138 HydrophobicContact CZ2-CE 4.29Å
132	P	88.6	Confident	91.6	Very high	95 Å²	95	36.3 Å²	36.3	62%	0.617	19%	0.188	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.4	-34	-172.7	25.3	-35	0	0	0	113.3	M134	P132-M134 VanDerWaalsContact C-N 3.29Å; P132-M134 PolarHBondContact O-N 2.84Å
133	D	91.1	Very high	91.4	Very high	72 Å²	72	40.9 Å²	40.9	39%	0.385	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.6	11.8	-179.4	-63.1	-59.4	0	0	0	114	W131 L135 K136 E137	W131-D133 VanDerWaalsContact C-N 3.27Å; W131-D133 PolarHBondContact O-N 3.46Å; D133-L135 VanDerWaalsContact C-N 3.33Å; D133-L135 PolarHBondContact O-N 3.17Å; D133-K136 WeakPolarHBondContact O-CB 3.04Å; D133-K136 PolarHBondContact O-N 3.46Å; D133-K136 WeakPolarHBondContact OD1-CD 3.21Å; D133-K136 IonicContact OD1-NZ 2.81Å; D133-K136 PolarHBondContact OD1-NZ 2.89Å; D133-E137 PolarHBondContact O-N 3.11Å
134	M	93.9	Very high	91.4	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-50.9	-48.4	-178	-175.1	-82.5	-68.5	0	0	113.2	I123 W127 W131 P132 K136 E137 M138	I123-M134 HydrophobicContact CD1-CE 4.31Å; I123-M134 HydrophobicContact CD1-CG 4.31Å; I123-M134 HydrophobicContact CD1-SD 3.88Å; I123-M134 HydrophobicContact CG1-CG 4.1Å; I123-M134 HydrophobicContact CG1-SD 4.29Å; I123-M134 HydrophobicContact CG2-CE 4.19Å; W127-M134 HydrophobicContact CD2-CE 3.45Å; W127-M134 VanDerWaalsContact CD2-CE 3.45Å; W127-M134 VanDerWaalsContact CE2-CE 3.42Å; W127-M134 HydrophobicContact CE3-CE 3.91Å; W127-M134 HydrophobicContact CG-CB 4.29Å; W127-M134 HydrophobicContact CG-CE 3.71Å; W127-M134 HydrophobicContact CG-CG 4.48Å; W127-M134 HydrophobicContact CH2-CE 4.31Å; W127-M134 HydrophobicContact CZ2-CE 3.9Å; W127-M134 HydrophobicContact CZ3-CE 4.29Å; W131-M134 HydrophobicContact CB-CB 4.41Å; W131-M134 HydrophobicContact CD2-CB 3.9Å; W131-M134 HydrophobicContact CD2-CG 3.91Å; W131-M134 HydrophobicContact CE3-CG 4.33Å; W131-M134 HydrophobicContact CG-CB 3.73Å; W131-M134 HydrophobicContact CG-CG 4.28Å; W131-M134 HydrophobicContact CZ2-CG 4.17Å; W131-M134 WeakPolarHBondContact O-CB 3.43Å; W131-M134 PolarHBondContact O-N 3.48Å; W131-M134 VanDerWaalsContact O-N 3.15Å; P132-M134 VanDerWaalsContact C-N 3.29Å; P132-M134 PolarHBondContact O-N 2.84Å; M134-K136 VanDerWaalsContact C-N 3.32Å; M134-K136 PolarHBondContact O-N 3.07Å; M134-E137 PolarHBondContact O-N 3.45Å; M134-M138 WeakPolarHBondContact O-CG 3.47Å; M134-M138 PolarHBondContact O-N 3.07Å; M134-M138 HydrophobicContact SD-CG 3.8Å
135	L	92.8	Very high	91.5	Very high	38 Å²	38	46.5 Å²	46.5	20%	0.199	25%	0.252	C	S	.	.	H	α-helix	trans	-63.9	-37.8	179.9	-65.4	176	0	0	0	112	W127 D133 M138 E139 N184 I188	W127-L135 HydrophobicContact CZ2-CD1 4.25Å; W127-L135 HydrophobicContact CZ2-CG 4.37Å; D133-L135 VanDerWaalsContact C-N 3.33Å; D133-L135 PolarHBondContact O-N 3.17Å; L135-M138 PolarHBondContact O-N 2.68Å; L135-E139 WeakPolarHBondContact O-CB 3.02Å; L135-E139 PolarHBondContact O-N 3.06Å; L135-N184 HydrophobicContact CD1-CB 3.81Å; L135-I188 HydrophobicContact CD1-CD1 4.18Å; L135-I188 HydrophobicContact CD1-CG1 4.12Å; L135-I188 HydrophobicContact CD2-CD1 4.29Å; L135-I188 HydrophobicContact CD2-CG1 4.21Å
136	K	92.7	Very high	91.7	Very high	138 Å²	138	48.7 Å²	48.7	60%	0.6	26%	0.262	S	S	*	.	H	α-helix	trans	-69.3	-37.6	177	-60.6	-178.8	-168.2	154.4	0	111.9	D133 M134 E139 S140	D133-K136 WeakPolarHBondContact O-CB 3.04Å; D133-K136 PolarHBondContact O-N 3.46Å; D133-K136 WeakPolarHBondContact OD1-CD 3.21Å; D133-K136 IonicContact OD1-NZ 2.81Å; D133-K136 PolarHBondContact OD1-NZ 2.89Å; M134-K136 VanDerWaalsContact C-N 3.32Å; M134-K136 PolarHBondContact O-N 3.07Å; K136-E139 PolarHBondContact O-N 2.81Å; K136-S140 WeakPolarHBondContact O-CB 2.9Å; K136-S140 PolarHBondContact O-N 3.49Å
137	E	93.6	Very high	91.9	Very high	57 Å²	57	48.8 Å²	48.8	27%	0.266	27%	0.265	S	S	.	.	H	α-helix	trans	-64.3	-41.2	174.5	-72.3	176.9	-145.4	0	0	110.9	K90 M94 W131 D133 M134 S140 L141	K90-E137 IonicContact NZ-OE1 3.05Å; K90-E137 PolarHBondContact NZ-OE1 3.07Å; K90-E137 IonicContact NZ-OE2 2.77Å; M94-E137 HydrophobicContact CE-CB 3.92Å; W131-E137 WeakPolarHBondContact CZ2-OE2 3.46Å; W131-E137 PolarHBondContact NE1-OE1 3.01Å; W131-E137 PolarHBondContact NE1-OE2 2.97Å; D133-E137 PolarHBondContact O-N 3.11Å; M134-E137 PolarHBondContact O-N 3.45Å; E137-S140 PolarHBondContact O-N 2.7Å; E137-L141 WeakPolarHBondContact O-CG 3.27Å; E137-L141 PolarHBondContact O-N 2.75Å
138	M	94.3	Very high	92.1	Very high	4 Å²	4	50.1 Å²	50.1	2%	0.02	27%	0.271	C	S	.	.	H	α-helix	trans	-65.1	-41.6	174.6	-66	-60.1	136.1	0	0	112.2	M94 V119 W131 M134 L135 L141 S142 V152 I155	M94-M138 HydrophobicContact CE-CE 3.86Å; M94-M138 HydrophobicContact SD-CE 3.83Å; V119-M138 HydrophobicContact CG1-CE 3.97Å; W131-M138 HydrophobicContact CH2-CE 4.46Å; W131-M138 HydrophobicContact CZ2-CE 4.29Å; M134-M138 WeakPolarHBondContact O-CG 3.47Å; M134-M138 PolarHBondContact O-N 3.07Å; M134-M138 HydrophobicContact SD-CG 3.8Å; L135-M138 PolarHBondContact O-N 2.68Å; M138-L141 HydrophobicContact CE-CD1 4.43Å; M138-L141 PolarHBondContact O-N 3.09Å; M138-L141 HydrophobicContact SD-CD1 4.26Å; M138-S142 PolarHBondContact O-N 2.99Å; M138-V152 HydrophobicContact CB-CG1 3.97Å; M138-V152 HydrophobicContact CB-CG2 4.41Å; M138-V152 HydrophobicContact SD-CG2 4.18Å; M138-I155 HydrophobicContact SD-CD1 4.24Å
139	E	92.7	Very high	92.6	Very high	106 Å²	106	50.1 Å²	50.1	50%	0.495	27%	0.271	S	S	.	.	H	α-helix	trans	-61.6	-45.1	173.9	-174.3	176.3	-173	0	0	111.1	L135 K136 L141 S142 S143 F191	L135-E139 WeakPolarHBondContact O-CB 3.02Å; L135-E139 PolarHBondContact O-N 3.06Å; K136-E139 PolarHBondContact O-N 2.81Å; E139-L141 PolarHBondContact O-N 2.89Å; E139-S142 PolarHBondContact O-N 2.95Å; E139-S142 PolarHBondContact O-OG 3.03Å; E139-S143 PolarHBondContact O-N 3.04Å; E139-F191 HydrophobicContact CB-CE2 4.23Å; E139-F191 HydrophobicContact CG-CD2 4.08Å; E139-F191 HydrophobicContact CG-CE2 3.95Å
140	S	93.8	Very high	93	Very high	68 Å²	68	49.5 Å²	49.5	48%	0.476	27%	0.268	S	S	.	.	H	α-helix	trans	-62.1	-39.8	175.6	-178	0	0	0	0	112.6	K136 E137 S142 S143	K136-S140 WeakPolarHBondContact O-CB 2.9Å; K136-S140 PolarHBondContact O-N 3.49Å; E137-S140 PolarHBondContact O-N 2.7Å; S140-S142 PolarHBondContact O-N 3.19Å; S140-S143 PolarHBondContact O-N 2.67Å; S140-S143 PolarHBondContact O-OG 3.06Å
141	L	94.1	Very high	93.4	Very high	9 Å²	9	45 Å²	45	5%	0.047	25%	0.247	C	C	.	.	H	α-helix	trans	-61.3	-42.5	174.4	-81	173.3	0	0	0	112.1	M94 L97 A98 E137 M138 E139 S143 Q144 Q148 V152	M94-L141 HydrophobicContact CE-CD1 3.38Å; M94-L141 HydrophobicContact CE-CG 4.12Å; M94-L141 HydrophobicContact SD-CD1 4.25Å; L97-L141 HydrophobicContact CB-CD1 4.14Å; L97-L141 HydrophobicContact CB-CD2 4.42Å; L97-L141 HydrophobicContact CD1-CD1 3.8Å; A98-L141 HydrophobicContact CB-CD2 3.99Å; E137-L141 WeakPolarHBondContact O-CG 3.27Å; E137-L141 PolarHBondContact O-N 2.75Å; M138-L141 HydrophobicContact CE-CD1 4.43Å; M138-L141 PolarHBondContact O-N 3.09Å; M138-L141 HydrophobicContact SD-CD1 4.26Å; E139-L141 PolarHBondContact O-N 2.89Å; L141-S143 PolarHBondContact O-N 3.17Å; L141-Q144 WeakPolarHBondContact O-CB 3.5Å; L141-Q144 PolarHBondContact O-N 3.03Å; L141-Q148 VanDerWaalsContact O-CB 3.22Å; L141-Q148 WeakPolarHBondContact O-CB 3.43Å; L141-V152 HydrophobicContact CB-CG2 4.07Å
142	S	93.7	Very high	93.7	Very high	13 Å²	13	44.9 Å²	44.9	9%	0.091	25%	0.247	C	C	.	.	H	α-helix	trans	-60.5	-29	178.7	72.7	0	0	0	0	113	M138 E139 S140 Q144 T149	M138-S142 PolarHBondContact O-N 2.99Å; E139-S142 PolarHBondContact O-N 2.95Å; E139-S142 PolarHBondContact O-OG 3.03Å; S140-S142 PolarHBondContact O-N 3.19Å; S142-Q144 PolarHBondContact O-N 3.02Å; S142-T149 PolarHBondContact O-OG1 3.3Å
143	S	90.1	Very high	94.1	Very high	97 Å²	97	40.3 Å²	40.3	68%	0.678	22%	0.218	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71.9	-7.6	176.9	73.5	0	0	0	0	115	E139 S140 L141	E139-S143 PolarHBondContact O-N 3.04Å; S140-S143 PolarHBondContact O-N 2.67Å; S140-S143 PolarHBondContact O-OG 3.06Å; L141-S143 PolarHBondContact O-N 3.17Å
144	Q	92.9	Very high	94.3	Very high	102 Å²	102	39.3 Å²	39.3	48%	0.477	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.3	-24.2	-176.7	-60.7	179.9	13	0	0	113.9	L141 S142 Q148	L141-Q144 WeakPolarHBondContact O-CB 3.5Å; L141-Q144 PolarHBondContact O-N 3.03Å; S142-Q144 PolarHBondContact O-N 3.02Å; Q144-Q148 HydrophobicContact CB-CG 4.19Å
145	G	92.4	Very high	94.4	Very high	20 Å²	20	39.4 Å²	39.4	21%	0.206	21%	0.212	C	C	.	.			trans	163.9	174	-177.8	0	0	0	0	0	114.3	T149	G145-T149 PolarHBondContact O-N 3.4Å; G145-T149 VanDerWaalsContact O-N 3.07Å; G145-T149 PolarHBondContact O-OG1 3.37Å
146	E	94.9	Very high	94.6	Very high	55 Å²	55	37.7 Å²	37.7	26%	0.257	20%	0.204	S	C	.	.	H	α-helix	trans	-67.4	-40.8	-176	-56.5	85.1	173.5	0	0	111.5	I104 Q148 T149 E150 A218 H219 V222	I104-E146 HydrophobicContact CD1-CB 4.05Å; I104-E146 HydrophobicContact CG2-CB 4.26Å; E146-Q148 PolarHBondContact O-N 3.22Å; E146-T149 PolarHBondContact O-N 3.44Å; E146-E150 PolarHBondContact O-N 3.33Å; E146-A218 HydrophobicContact CB-CB 4.29Å; E146-A218 HydrophobicContact CG-CB 4.12Å; E146-H219 IonicContact OE1-CE1 3.58Å; E146-H219 IonicContact OE1-NE2 3.48Å; E146-V222 HydrophobicContact CB-CG2 3.76Å; E146-V222 HydrophobicContact CG-CG2 4.47Å; E146-V222 WeakPolarHBondContact O-CG2 3.47Å
147	A	93.9	Very high	94.6	Very high	12 Å²	12	32.4 Å²	32.4	10%	0.099	18%	0.182	C	C	.	.	H	α-helix	trans	-63.1	-42.1	179.2	0	0	0	0	0	112.1	I104 E150 L151	I104-A147 HydrophobicContact CB-CB 4.05Å; A147-E150 PolarHBondContact O-N 3.18Å; A147-L151 WeakPolarHBondContact O-CG 3.49Å; A147-L151 PolarHBondContact O-N 3Å; A147-L151 VanDerWaalsContact O-N 3.1Å
148	Q	95.8	Very high	94.4	Very high	31 Å²	31	33.2 Å²	33.2	15%	0.145	18%	0.182	C	C	.	.	H	α-helix	trans	-67.1	-40.4	176.9	-67	73.3	16.9	0	0	110.6	A98 L141 Q144 E146 L151 V152	A98-Q148 PolarHBondContact O-NE2 3.49Å; L141-Q148 VanDerWaalsContact O-CB 3.22Å; L141-Q148 WeakPolarHBondContact O-CB 3.43Å; Q144-Q148 HydrophobicContact CB-CG 4.19Å; E146-Q148 PolarHBondContact O-N 3.22Å; Q148-L151 PolarHBondContact O-N 3.26Å; Q148-V152 WeakPolarHBondContact O-CG2 3.17Å; Q148-V152 PolarHBondContact O-N 2.72Å
149	T	96.7	Very high	94.4	Very high	7 Å²	7	33 Å²	33	4%	0.043	18%	0.181	C	C	.	.	H	α-helix	trans	-62.1	-46	176.4	-54.1	0	0	0	0	111.6	S142 G145 E146 L151 V152 M153 I195 V222	S142-T149 PolarHBondContact O-OG1 3.3Å; G145-T149 PolarHBondContact O-N 3.4Å; G145-T149 VanDerWaalsContact O-N 3.07Å; G145-T149 PolarHBondContact O-OG1 3.37Å; E146-T149 PolarHBondContact O-N 3.44Å; T149-L151 VanDerWaalsContact C-N 3.34Å; T149-L151 PolarHBondContact O-N 3.26Å; T149-V152 PolarHBondContact O-N 3.32Å; T149-M153 HydrophobicContact CG2-CE 4.26Å; T149-M153 WeakPolarHBondContact O-CG 3.02Å; T149-M153 PolarHBondContact O-N 2.8Å; T149-I195 HydrophobicContact CG2-CD1 4.29Å; T149-I195 HydrophobicContact CG2-CG2 3.59Å; T149-V222 HydrophobicContact CG2-CG1 3.49Å; T149-V222 VanDerWaalsContact CG2-CG1 3.49Å
150	E	96.3	Very high	94.2	Very high	14 Å²	14	28 Å²	28	7%	0.065	16%	0.158	C	C	.	.	H	α-helix	trans	-58.4	-44.9	175.5	-173.1	-168.6	-153.1	0	0	111.5	I104 K112 E146 A147 V152 M153 L154 R221 A225	I104-E150 HydrophobicContact CD1-CB 4.07Å; I104-E150 WeakPolarHBondContact CG1-OE2 3.37Å; K112-E150 WeakPolarHBondContact CD-OE2 3.29Å; K112-E150 WeakPolarHBondContact CE-OE2 3.27Å; K112-E150 IonicContact NZ-OE1 2.7Å; K112-E150 IonicContact NZ-OE2 3.6Å; K112-E150 PolarHBondContact NZ-OE2 3.42Å; E146-E150 PolarHBondContact O-N 3.33Å; A147-E150 PolarHBondContact O-N 3.18Å; E150-V152 VanDerWaalsContact C-N 3.34Å; E150-V152 PolarHBondContact O-N 2.91Å; E150-M153 WeakPolarHBondContact O-CB 3.15Å; E150-M153 PolarHBondContact O-N 3.49Å; E150-L154 WeakPolarHBondContact O-CG 3.38Å; E150-L154 PolarHBondContact O-N 3.02Å; E150-R221 IonicContact OE1-CZ 3.72Å; E150-R221 IonicContact OE1-NE 3.65Å; E150-R221 PolarHBondContact OE1-NE 3.35Å; E150-R221 IonicContact OE1-NH2 3.54Å; E150-R221 IonicContact OE2-NE 3.79Å; E150-A225 HydrophobicContact CG-CB 3.98Å
151	L	96.2	Very high	93.6	Very high	3 Å²	3	27.2 Å²	27.2	2%	0.016	15%	0.147	C	C	.	.	H	α-helix	trans	-61.3	-41.1	177.2	-72.6	165.4	0	0	0	112.3	L97 T101 K112 L115 A147 Q148 T149 M153 L154 I155	L97-L151 HydrophobicContact CD2-CB 4.03Å; L97-L151 HydrophobicContact CD2-CD1 4.08Å; L97-L151 HydrophobicContact CD2-CG 4.46Å; T101-L151 HydrophobicContact CG2-CD1 3.96Å; K112-L151 HydrophobicContact CB-CD2 3.8Å; K112-L151 HydrophobicContact CG-CD2 4.02Å; L115-L151 HydrophobicContact CD2-CD1 4.22Å; L115-L151 HydrophobicContact CD2-CD2 4.25Å; A147-L151 WeakPolarHBondContact O-CG 3.49Å; A147-L151 PolarHBondContact O-N 3Å; A147-L151 VanDerWaalsContact O-N 3.1Å; Q148-L151 PolarHBondContact O-N 3.26Å; T149-L151 VanDerWaalsContact C-N 3.34Å; T149-L151 PolarHBondContact O-N 3.26Å; L151-M153 VanDerWaalsContact C-N 3.34Å; L151-L154 PolarHBondContact O-N 3.42Å; L151-I155 WeakPolarHBondContact O-CD1 3.43Å; L151-I155 VanDerWaalsContact O-CG1 3.25Å; L151-I155 WeakPolarHBondContact O-CG1 3.48Å; L151-I155 PolarHBondContact O-N 2.72Å
152	V	97.3	Very high	93.1	Very high	1 Å²	1	27.2 Å²	27.2	1%	0.006	15%	0.147	C	C	.	.	H	α-helix	trans	-62.3	-41.8	175.1	171.6	0	0	0	0	110.9	M138 L141 Q148 T149 E150 L154 I155 L156 F191	M138-V152 HydrophobicContact CB-CG1 3.97Å; M138-V152 HydrophobicContact CB-CG2 4.41Å; M138-V152 HydrophobicContact SD-CG2 4.18Å; L141-V152 HydrophobicContact CB-CG2 4.07Å; Q148-V152 WeakPolarHBondContact O-CG2 3.17Å; Q148-V152 PolarHBondContact O-N 2.72Å; T149-V152 PolarHBondContact O-N 3.32Å; E150-V152 VanDerWaalsContact C-N 3.34Å; E150-V152 PolarHBondContact O-N 2.91Å; V152-L154 PolarHBondContact O-N 3.44Å; V152-I155 PolarHBondContact O-N 3.3Å; V152-L156 HydrophobicContact CG1-CD1 4.13Å; V152-L156 HydrophobicContact CG1-CG 4.4Å; V152-L156 WeakPolarHBondContact O-CG 3.43Å; V152-L156 PolarHBondContact O-N 2.95Å; V152-F191 HydrophobicContact CG1-CE1 4.24Å; V152-F191 HydrophobicContact CG1-CZ 4.32Å
153	M	97.1	Very high	92.7	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-60.8	-44.1	175.9	-66.4	-52.3	122.1	0	0	112	T149 E150 L151 L156 L157 F191 L192 I195 A225 T226 T229	T149-M153 HydrophobicContact CG2-CE 4.26Å; T149-M153 WeakPolarHBondContact O-CG 3.02Å; T149-M153 PolarHBondContact O-N 2.8Å; E150-M153 WeakPolarHBondContact O-CB 3.15Å; E150-M153 PolarHBondContact O-N 3.49Å; L151-M153 VanDerWaalsContact C-N 3.34Å; M153-L156 PolarHBondContact O-N 3.16Å; M153-L157 WeakPolarHBondContact O-CB 3.43Å; M153-L157 PolarHBondContact O-N 3.15Å; M153-F191 HydrophobicContact CE-CE1 3.62Å; M153-F191 HydrophobicContact CE-CZ 3.96Å; M153-L192 HydrophobicContact CE-CD2 4.07Å; M153-L192 HydrophobicContact SD-CD2 3.48Å; M153-L192 WeakPolarHBondContact SD-CD2 3.34Å; M153-I195 HydrophobicContact CE-CB 4.41Å; M153-I195 HydrophobicContact CE-CG1 4.23Å; M153-I195 HydrophobicContact CE-CG2 4.06Å; M153-A225 HydrophobicContact CB-CB 4.02Å; M153-A225 HydrophobicContact CG-CB 4.42Å; M153-T226 HydrophobicContact SD-CG2 3.94Å; M153-T229 WeakPolarHBondContact CB-OG1 3.35Å; M153-T229 PolarHBondContact O-OG1 3.2Å
154	L	95	Very high	92.2	Very high	51 Å²	51	23.3 Å²	23.3	27%	0.267	12%	0.117	S	C	.	.	H	α-helix	trans	-62.2	-41.8	175.9	-67.6	173.9	0	0	0	112.1	K112 E150 L151 V152 R158	K112-L154 HydrophobicContact CB-CD1 3.84Å; E150-L154 WeakPolarHBondContact O-CG 3.38Å; E150-L154 PolarHBondContact O-N 3.02Å; L151-L154 PolarHBondContact O-N 3.42Å; V152-L154 PolarHBondContact O-N 3.44Å; L154-R158 VanDerWaalsContact O-CB 3.24Å; L154-R158 WeakPolarHBondContact O-CB 3.43Å; L154-R158 PolarHBondContact O-N 3.29Å
155	I	96.6	Very high	91.2	Very high	1 Å²	1	22.5 Å²	22.5	1%	0.005	12%	0.119	C	C	.	.	H	α-helix	trans	-62.2	-48.1	176.3	-70.1	160.8	0	0	0	110.8	L97 V119 V120 I123 M138 L151 V152 R158 L159	L97-I155 HydrophobicContact CD1-CD1 4.06Å; L97-I155 HydrophobicContact CD2-CD1 3.94Å; V119-I155 HydrophobicContact CB-CD1 3.94Å; V119-I155 HydrophobicContact CB-CG1 4.15Å; V119-I155 HydrophobicContact CG1-CD1 3.84Å; V119-I155 HydrophobicContact CG1-CG1 4.29Å; V119-I155 HydrophobicContact CG1-CG2 4.08Å; V119-I155 HydrophobicContact CG2-CD1 4.15Å; V120-I155 HydrophobicContact CG2-CB 4.38Å; V120-I155 HydrophobicContact CG2-CG2 3.88Å; V120-I155 VanDerWaalsContact CG2-O 3.31Å; V120-I155 WeakPolarHBondContact CG2-O 3.43Å; I123-I155 HydrophobicContact CD1-CG2 3.73Å; M138-I155 HydrophobicContact SD-CD1 4.24Å; L151-I155 WeakPolarHBondContact O-CD1 3.43Å; L151-I155 VanDerWaalsContact O-CG1 3.25Å; L151-I155 WeakPolarHBondContact O-CG1 3.48Å; L151-I155 PolarHBondContact O-N 2.72Å; V152-I155 PolarHBondContact O-N 3.3Å; I155-R158 PolarHBondContact O-N 3.43Å; I155-L159 VanDerWaalsContact O-CB 3.28Å; I155-L159 WeakPolarHBondContact O-CB 3.39Å; I155-L159 PolarHBondContact O-N 3.14Å
156	L	95.8	Very high	90.3	Very high	3 Å²	3	26.8 Å²	26.8	2%	0.016	13%	0.132	C	C	.	.	H	α-helix	trans	-65.2	-41.6	-179.2	-71.7	177.7	0	0	0	112.1	V152 M153 A160 F191 L192 T229 Y233	V152-L156 HydrophobicContact CG1-CD1 4.13Å; V152-L156 HydrophobicContact CG1-CG 4.4Å; V152-L156 WeakPolarHBondContact O-CG 3.43Å; V152-L156 PolarHBondContact O-N 2.95Å; M153-L156 PolarHBondContact O-N 3.16Å; L156-A160 PolarHBondContact O-N 3.49Å; L156-F191 HydrophobicContact CD1-CD1 4.35Å; L156-F191 HydrophobicContact CD1-CE1 4.02Å; L156-L192 HydrophobicContact CD1-CD2 4.02Å; L156-T229 HydrophobicContact CB-CG2 3.93Å; L156-Y233 HydrophobicContact CB-CE2 4.4Å; L156-Y233 VanDerWaalsContact O-CE2 3.29Å; L156-Y233 WeakPolarHBondContact O-CE2 3.41Å; L156-Y233 PolarHBondContact O-OH 3.41Å
157	L	92.6	Very high	89.3	Confident	27 Å²	27	29 Å²	29	14%	0.141	14%	0.143	C	C	.	.	H	α-helix	trans	-61.4	-53.7	176.1	174	55.6	0	0	0	110.3	M153 L159 A160 E161 N228 T229	M153-L157 WeakPolarHBondContact O-CB 3.43Å; M153-L157 PolarHBondContact O-N 3.15Å; L157-L159 VanDerWaalsContact C-N 3.27Å; L157-L159 PolarHBondContact O-N 3.34Å; L157-A160 WeakPolarHBondContact O-CB 3.49Å; L157-A160 PolarHBondContact O-N 3.08Å; L157-E161 HydrophobicContact CD1-CG 4.22Å; L157-E161 WeakPolarHBondContact O-CG 3.37Å; L157-E161 PolarHBondContact O-N 3.27Å; L157-N228 HydrophobicContact CD2-CB 4.42Å; L157-T229 HydrophobicContact CB-CG2 4.17Å
158	R	91.4	Very high	88.3	Confident	73 Å²	73	30.8 Å²	30.8	28%	0.275	15%	0.153	S	C	.	.	H	α-helix	trans	-62.8	-34.2	-178.2	-175	58.9	170.6	-141.6	-7.6	112.6	V120 L154 I155 E161 D162	V120-R158 HydrophobicContact CG1-CG 4.42Å; V120-R158 HydrophobicContact CG2-CB 4.07Å; V120-R158 HydrophobicContact CG2-CG 4.2Å; L154-R158 VanDerWaalsContact O-CB 3.24Å; L154-R158 WeakPolarHBondContact O-CB 3.43Å; L154-R158 PolarHBondContact O-N 3.29Å; I155-R158 PolarHBondContact O-N 3.43Å; R158-E161 VanDerWaalsContact CD-OE2 3.28Å; R158-E161 WeakPolarHBondContact CD-OE2 3.27Å; R158-E161 IonicContact NH1-OE2 3.84Å; R158-E161 PolarHBondContact O-N 3.04Å; R158-D162 IonicContact NE-OD1 3.31Å; R158-D162 WeakPolarHBondContact O-CB 3.29Å; R158-D162 PolarHBondContact O-N 3.3Å
159	L	93.1	Very high	87.2	Confident	1 Å²	1	29.8 Å²	29.8	1%	0.005	15%	0.148	C	C	.	.	H	α-helix	trans	-61.7	-45.8	173.1	178	63.8	0	0	0	111.7	V120 I123 W127 I155 L157 V163 L181	V120-L159 HydrophobicContact CG1-CB 4.41Å; V120-L159 HydrophobicContact CG1-CD1 4.33Å; V120-L159 HydrophobicContact CG2-CB 4.36Å; I123-L159 HydrophobicContact CG2-CD1 3.73Å; I123-L159 HydrophobicContact CG2-CD2 3.97Å; W127-L159 HydrophobicContact CE3-CD2 4.47Å; W127-L159 HydrophobicContact CZ3-CD2 4.14Å; I155-L159 VanDerWaalsContact O-CB 3.28Å; I155-L159 WeakPolarHBondContact O-CB 3.39Å; I155-L159 PolarHBondContact O-N 3.14Å; L157-L159 VanDerWaalsContact C-N 3.27Å; L157-L159 PolarHBondContact O-N 3.34Å; L159-V163 HydrophobicContact CD1-CG2 3.85Å; L159-V163 HydrophobicContact CG-CG2 4.45Å; L159-V163 WeakPolarHBondContact O-CB 3.36Å; L159-V163 WeakPolarHBondContact O-CG2 3.36Å; L159-V163 PolarHBondContact O-N 3.11Å; L159-V163 VanDerWaalsContact O-N 3.1Å; L159-L181 HydrophobicContact CD2-CD2 4.35Å
160	A	87.6	Confident	86.2	Confident	0 Å²	0	31.7 Å²	31.7	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-63.4	-45.8	177.6	0	0	0	0	0	111.2	L156 L157 D162 V163 I164 Y233 W236	L156-A160 PolarHBondContact O-N 3.49Å; L157-A160 WeakPolarHBondContact O-CB 3.49Å; L157-A160 PolarHBondContact O-N 3.08Å; A160-D162 PolarHBondContact O-N 3.02Å; A160-V163 PolarHBondContact O-N 3.02Å; A160-I164 VanDerWaalsContact O-CB 3.26Å; A160-I164 WeakPolarHBondContact O-CB 3.42Å; A160-I164 WeakPolarHBondContact O-CG1 3.43Å; A160-I164 PolarHBondContact O-N 2.89Å; A160-Y233 HydrophobicContact CB-CD2 4.02Å; A160-Y233 HydrophobicContact CB-CE1 4.37Å; A160-Y233 HydrophobicContact CB-CE2 3.57Å; A160-W236 HydrophobicContact CB-CZ2 4.42Å
161	E	82.4	Confident	85	Confident	52 Å²	52	34.2 Å²	34.2	24%	0.243	18%	0.18	C	C	.	.	I	π-helix	trans	-56.8	-50.5	176	-70	177.1	161.4	0	0	112.2	L157 R158 V163 T165 F166	L157-E161 HydrophobicContact CD1-CG 4.22Å; L157-E161 WeakPolarHBondContact O-CG 3.37Å; L157-E161 PolarHBondContact O-N 3.27Å; R158-E161 VanDerWaalsContact CD-OE2 3.28Å; R158-E161 WeakPolarHBondContact CD-OE2 3.27Å; R158-E161 IonicContact NH1-OE2 3.84Å; R158-E161 PolarHBondContact O-N 3.04Å; E161-V163 VanDerWaalsContact C-N 3.32Å; E161-V163 PolarHBondContact O-N 3.06Å; E161-T165 WeakPolarHBondContact O-CB 3.45Å; E161-T165 PolarHBondContact O-N 3.36Å; E161-T165 VanDerWaalsContact O-N 3.08Å; E161-F166 HydrophobicContact CB-CD2 3.86Å; E161-F166 HydrophobicContact CB-CE2 3.7Å; E161-F166 HydrophobicContact CG-CE2 4.36Å; E161-F166 WeakPolarHBondContact O-CD2 3.26Å; E161-F166 PolarHBondContact O-N 3.08Å
162	D	84.2	Confident	84	Confident	8 Å²	8	37.3 Å²	37.3	4%	0.043	19%	0.194	C	C	.	.	I	π-helix	trans	-65.8	-34	-177	-86.4	-1.6	0	0	0	112.8	K124 R158 A160 Q167 T168	K124-D162 HydrophobicContact CD-CB 4.29Å; K124-D162 IonicContact NZ-OD2 2.73Å; K124-D162 PolarHBondContact NZ-OD2 2.89Å; R158-D162 IonicContact NE-OD1 3.31Å; R158-D162 WeakPolarHBondContact O-CB 3.29Å; R158-D162 PolarHBondContact O-N 3.3Å; A160-D162 PolarHBondContact O-N 3.02Å; D162-Q167 CarbonylContact O-C 3.42Å; D162-Q167 WeakPolarHBondContact O-CA 3.36Å; D162-Q167 PolarHBondContact O-N 3.17Å; D162-Q167 VanDerWaalsContact O-N 3.13Å; D162-T168 PolarHBondContact O-N 3.05Å; D162-T168 PolarHBondContact O-OG1 3.48Å
163	V	84.7	Confident	83.3	Confident	1 Å²	1	37.3 Å²	37.3	1%	0.006	19%	0.194	C	C	.	.	I	π-helix	trans	-87.2	-41.4	-175.4	176	0	0	0	0	111.9	L159 A160 E161 L169 R174 I177 Q178 L181	L159-V163 HydrophobicContact CD1-CG2 3.85Å; L159-V163 HydrophobicContact CG-CG2 4.45Å; L159-V163 WeakPolarHBondContact O-CB 3.36Å; L159-V163 WeakPolarHBondContact O-CG2 3.36Å; L159-V163 PolarHBondContact O-N 3.11Å; L159-V163 VanDerWaalsContact O-N 3.1Å; A160-V163 PolarHBondContact O-N 3.02Å; E161-V163 VanDerWaalsContact C-N 3.32Å; E161-V163 PolarHBondContact O-N 3.06Å; V163-L169 HydrophobicContact CB-CD1 4.33Å; V163-L169 HydrophobicContact CG2-CD1 3.68Å; V163-R174 HydrophobicContact CG1-CG 4.03Å; V163-R174 WeakPolarHBondContact O-CD 3.42Å; V163-R174 WeakPolarHBondContact O-CG 3.26Å; V163-I177 HydrophobicContact CG1-CG2 4.09Å; V163-I177 HydrophobicContact CG2-CG2 3.75Å; V163-Q178 HydrophobicContact CG1-CB 4.3Å; V163-L181 HydrophobicContact CG1-CD1 4.46Å
164	I	79.6	Confident	82.6	Confident	27 Å²	27	39.9 Å²	39.9	14%	0.138	20%	0.204	C	C	.	.	I	π-helix	trans	-99.2	-56.3	-170.8	-53.6	-64.1	0	0	0	111.3	A160 Q167 Q178 W236	A160-I164 VanDerWaalsContact O-CB 3.26Å; A160-I164 WeakPolarHBondContact O-CB 3.42Å; A160-I164 WeakPolarHBondContact O-CG1 3.43Å; A160-I164 PolarHBondContact O-N 2.89Å; I164-Q167 VanDerWaalsContact O-CG 3.25Å; I164-Q167 WeakPolarHBondContact O-CG 3.32Å; I164-Q167 PolarHBondContact O-NE2 3.26Å; I164-Q178 HydrophobicContact CD1-CG 3.91Å; I164-W236 HydrophobicContact CB-CG 4.4Å; I164-W236 HydrophobicContact CD1-CD2 4.1Å; I164-W236 HydrophobicContact CD1-CE3 4.03Å; I164-W236 HydrophobicContact CD1-CH2 4.24Å; I164-W236 HydrophobicContact CD1-CZ2 4.34Å; I164-W236 HydrophobicContact CD1-CZ3 4.11Å; I164-W236 HydrophobicContact CG1-CD2 3.86Å; I164-W236 HydrophobicContact CG1-CE3 4.31Å; I164-W236 HydrophobicContact CG1-CG 4.23Å; I164-W236 HydrophobicContact CG1-CH2 4.36Å; I164-W236 HydrophobicContact CG1-CZ2 3.96Å; I164-W236 HydrophobicContact CG2-CB 3.85Å; I164-W236 HydrophobicContact CG2-CD2 4.15Å; I164-W236 HydrophobicContact CG2-CG 3.69Å
165	T	71.8	Confident	82.1	Confident	86 Å²	86	42.6 Å²	42.6	53%	0.528	21%	0.21	S	C	.	.	I	π-helix	trans	-77.8	-58.8	-172.3	-47	0	0	0	0	111.4	E161	E161-T165 WeakPolarHBondContact O-CB 3.45Å; E161-T165 PolarHBondContact O-N 3.36Å; E161-T165 VanDerWaalsContact O-N 3.08Å
166	F	73.1	Confident	81.5	Confident	109 Å²	109	42.9 Å²	42.9	48%	0.478	21%	0.212	S	C	.	.	S	Bend	trans	-86.2	-19.6	-175.1	-58	-53	0	0	0	113.4	E161 T168	E161-F166 HydrophobicContact CB-CD2 3.86Å; E161-F166 HydrophobicContact CB-CE2 3.7Å; E161-F166 HydrophobicContact CG-CE2 4.36Å; E161-F166 WeakPolarHBondContact O-CD2 3.26Å; E161-F166 PolarHBondContact O-N 3.08Å; F166-T168 HydrophobicContact CB-CG2 3.72Å; F166-T168 PolarHBondContact O-N 3.47Å
167	Q	74.3	Confident	81.3	Confident	103 Å²	103	42.7 Å²	42.7	48%	0.481	21%	0.211	S	C	.	.			trans	50	42.3	177.7	-57.6	-176.8	17.1	0	0	113.5	D162 I164 L169	D162-Q167 CarbonylContact O-C 3.42Å; D162-Q167 WeakPolarHBondContact O-CA 3.36Å; D162-Q167 PolarHBondContact O-N 3.17Å; D162-Q167 VanDerWaalsContact O-N 3.13Å; I164-Q167 VanDerWaalsContact O-CG 3.25Å; I164-Q167 WeakPolarHBondContact O-CG 3.32Å; I164-Q167 PolarHBondContact O-NE2 3.26Å; Q167-L169 PolarHBondContact O-N 3.03Å
168	T	71.9	Confident	81.1	Confident	49 Å²	49	44.8 Å²	44.8	30%	0.301	22%	0.22	S	C	.	.			trans	-70.3	-1.1	-173	61.6	0	0	0	0	114.5	D162 F166	D162-T168 PolarHBondContact O-N 3.05Å; D162-T168 PolarHBondContact O-OG1 3.48Å; F166-T168 HydrophobicContact CB-CG2 3.72Å; F166-T168 PolarHBondContact O-N 3.47Å
169	L	74.1	Confident	81	Confident	10 Å²	10	45.1 Å²	45.1	5%	0.052	23%	0.225	C	C	.	.	S	Bend	trans	-104.1	154	-176.6	-67	101.8	0	0	0	113.3	K124 V163 Q167 R173 R174 I177 I1186	K124-L169 HydrophobicContact CB-CD2 3.77Å; K124-L169 HydrophobicContact CB-CG 4.48Å; K124-L169 HydrophobicContact CD-CD1 3.73Å; K124-L169 HydrophobicContact CD-CD2 4.06Å; K124-L169 HydrophobicContact CD-CG 3.89Å; K124-L169 HydrophobicContact CG-CD1 4.15Å; K124-L169 HydrophobicContact CG-CD2 3.8Å; K124-L169 HydrophobicContact CG-CG 4.2Å; V163-L169 HydrophobicContact CB-CD1 4.33Å; V163-L169 HydrophobicContact CG2-CD1 3.68Å; Q167-L169 PolarHBondContact O-N 3.03Å; L169-R173 HydrophobicContact CD2-CB 4.46Å; L169-R173 HydrophobicContact CD2-CG 3.77Å; L169-R174 HydrophobicContact CB-CB 4.01Å; L169-I177 HydrophobicContact CD2-CD1 3.58Å; L169-I1186 HydrophobicContact CD2-CD1 4.32Å
170	P	74.5	Confident	80.9	Confident	46 Å²	46	45.4 Å²	45.4	30%	0.299	23%	0.227	S	C	.	.			trans	-52.8	140.9	166	-25	34.3	0	0	0	112.3	Q172 R173 R174 I1186	P170-Q172 VanDerWaalsContact C-N 3.29Å; P170-Q172 PolarHBondContact O-N 2.94Å; P170-Q172 VanDerWaalsContact O-N 3.12Å; P170-R173 HydrophobicContact CB-CB 4.47Å; P170-R173 PolarHBondContact O-N 3.35Å; P170-R173 VanDerWaalsContact O-N 3.13Å; P170-R174 WeakPolarHBondContact O-CB 3.49Å; P170-R174 PolarHBondContact O-N 3.19Å; P170-I1186 HydrophobicContact CG-CB 4.24Å
171	S	72	Confident	81.1	Confident	68 Å²	68	45.5 Å²	45.5	48%	0.476	23%	0.227	S	C	.	.	H	α-helix	trans	-52.8	-39.7	-172.2	-74.6	0	0	0	0	114.7	R175	S171-R175 WeakPolarHBondContact O-CG 3.27Å; S171-R175 PolarHBondContact O-N 3.1Å; S171-R175 VanDerWaalsContact O-N 3.1Å
172	Q	75.7	Confident	81.5	Confident	68 Å²	68	46.2 Å²	46.2	32%	0.318	24%	0.235	S	C	.	.	H	α-helix	trans	-69.9	-51.5	179.2	-176.9	60.7	30.8	0	0	111	P170 R174 R175 D176	P170-Q172 VanDerWaalsContact C-N 3.29Å; P170-Q172 PolarHBondContact O-N 2.94Å; P170-Q172 VanDerWaalsContact O-N 3.12Å; Q172-R174 VanDerWaalsContact C-N 3.3Å; Q172-R174 PolarHBondContact O-N 2.9Å; Q172-R175 WeakPolarHBondContact O-CB 3.44Å; Q172-R175 PolarHBondContact O-N 3.35Å; Q172-R175 VanDerWaalsContact O-N 3.1Å; Q172-D176 PolarHBondContact NE2-OD1 3.3Å; Q172-D176 VanDerWaalsContact O-CG 3.32Å; Q172-D176 PolarHBondContact O-N 3.25Å
173	R	81.6	Confident	81.8	Confident	0 Å²	0	50.1 Å²	50.1	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-57.5	-43.7	177.1	-173.3	58.3	173.7	174.4	-2.2	112.3	K124 R125 E126 W127 L169 P170 R175 D176 I177 I1186	K124-R173 PolarHBondContact O-NE 3.38Å; R125-R173 PolarHBondContact O-NH2 3.32Å; E126-R173 VanDerWaalsContact N-NH2 3.17Å; E126-R173 PolarHBondContact O-NH2 2.87Å; W127-R173 PolarHBondContact O-NH2 3.48Å; L169-R173 HydrophobicContact CD2-CB 4.46Å; L169-R173 HydrophobicContact CD2-CG 3.77Å; P170-R173 HydrophobicContact CB-CB 4.47Å; P170-R173 PolarHBondContact O-N 3.35Å; P170-R173 VanDerWaalsContact O-N 3.13Å; R173-R175 PolarHBondContact O-N 3Å; R173-D176 PolarHBondContact O-N 3.25Å; R173-I177 HydrophobicContact CG-CD1 4.18Å; R173-I177 WeakPolarHBondContact O-CG1 3.33Å; R173-I177 PolarHBondContact O-N 2.99Å; R173-I1186 HydrophobicContact CG-CG2 4.16Å
174	R	83.9	Confident	82.2	Confident	54 Å²	54	53 Å²	53	20%	0.204	27%	0.268	C	S	.	.	H	α-helix	trans	-56.8	-47.4	174.6	-168.8	-175.4	71.3	-167.1	13.6	111.6	V163 L169 P170 Q172 D176 I177 Q178	V163-R174 HydrophobicContact CG1-CG 4.03Å; V163-R174 WeakPolarHBondContact O-CD 3.42Å; V163-R174 WeakPolarHBondContact O-CG 3.26Å; L169-R174 HydrophobicContact CB-CB 4.01Å; P170-R174 WeakPolarHBondContact O-CB 3.49Å; P170-R174 PolarHBondContact O-N 3.19Å; Q172-R174 VanDerWaalsContact C-N 3.3Å; Q172-R174 PolarHBondContact O-N 2.9Å; R174-D176 PolarHBondContact O-N 2.83Å; R174-I177 PolarHBondContact O-N 3.08Å; R174-Q178 WeakPolarHBondContact O-CB 3.34Å; R174-Q178 PolarHBondContact O-N 3.17Å
175	R	82.8	Confident	82.8	Confident	109 Å²	109	51.8 Å²	51.8	41%	0.411	26%	0.262	S	S	.	.	H	α-helix	trans	-61.3	-42.9	176.9	-79.5	-170.6	-64	-118.2	2.9	112.1	S171 Q172 R173 Q178 Q179	S171-R175 WeakPolarHBondContact O-CG 3.27Å; S171-R175 PolarHBondContact O-N 3.1Å; S171-R175 VanDerWaalsContact O-N 3.1Å; Q172-R175 WeakPolarHBondContact O-CB 3.44Å; Q172-R175 PolarHBondContact O-N 3.35Å; Q172-R175 VanDerWaalsContact O-N 3.1Å; R173-R175 PolarHBondContact O-N 3Å; R175-Q178 PolarHBondContact O-N 3.28Å; R175-Q179 WeakPolarHBondContact O-CB 3.4Å; R175-Q179 PolarHBondContact O-N 2.9Å
176	D	85.8	Confident	83.7	Confident	6 Å²	6	52.4 Å²	52.4	3%	0.032	26%	0.262	C	S	.	.	H	α-helix	trans	-63.1	-44.8	179.9	-61.5	-25.7	0	0	0	111	Q172 R173 R174 T180	Q172-D176 PolarHBondContact NE2-OD1 3.3Å; Q172-D176 VanDerWaalsContact O-CG 3.32Å; Q172-D176 PolarHBondContact O-N 3.25Å; R173-D176 PolarHBondContact O-N 3.25Å; R174-D176 PolarHBondContact O-N 2.83Å; D176-T180 WeakPolarHBondContact O-CB 3.32Å; D176-T180 PolarHBondContact O-N 3.45Å; D176-T180 PolarHBondContact O-OG1 2.98Å
177	I	89.9	Confident	84.6	Confident	0 Å²	0	50.7 Å²	50.7	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-65.8	-48.2	176.6	-66.6	179.9	0	0	0	110.7	W127 V163 L169 R173 R174 Q179 T180 L181	W127-I177 HydrophobicContact CE3-CG1 4.48Å; W127-I177 HydrophobicContact CE3-CG2 3.91Å; W127-I177 HydrophobicContact CZ3-CG2 3.63Å; V163-I177 HydrophobicContact CG1-CG2 4.09Å; V163-I177 HydrophobicContact CG2-CG2 3.75Å; L169-I177 HydrophobicContact CD2-CD1 3.58Å; R173-I177 HydrophobicContact CG-CD1 4.18Å; R173-I177 WeakPolarHBondContact O-CG1 3.33Å; R173-I177 PolarHBondContact O-N 2.99Å; R174-I177 PolarHBondContact O-N 3.08Å; I177-Q179 VanDerWaalsContact C-N 3.35Å; I177-Q179 PolarHBondContact O-N 2.87Å; I177-T180 PolarHBondContact O-N 2.87Å; I177-T180 VanDerWaalsContact O-N 3.16Å; I177-L181 HydrophobicContact CG2-CD1 4.11Å; I177-L181 HydrophobicContact CG2-CG 4.45Å; I177-L181 WeakPolarHBondContact O-CG 3.29Å; I177-L181 PolarHBondContact O-N 3.41Å
178	Q	88.4	Confident	85.5	Confident	70 Å²	70	46.1 Å²	46.1	33%	0.327	24%	0.242	S	C	.	.	H	α-helix	trans	-61.1	-42.1	178.7	-176.3	178.6	11.9	0	0	112	V163 I164 R174 R175 T180 L181 T182	V163-Q178 HydrophobicContact CG1-CB 4.3Å; I164-Q178 HydrophobicContact CD1-CG 3.91Å; R174-Q178 WeakPolarHBondContact O-CB 3.34Å; R174-Q178 PolarHBondContact O-N 3.17Å; R175-Q178 PolarHBondContact O-N 3.28Å; Q178-T180 VanDerWaalsContact C-N 3.31Å; Q178-T180 PolarHBondContact O-N 3.48Å; Q178-L181 PolarHBondContact O-N 3.49Å; Q178-T182 WeakPolarHBondContact O-CB 3.44Å; Q178-T182 PolarHBondContact O-N 3.47Å; Q178-T182 PolarHBondContact O-OG1 2.86Å
179	Q	89.7	Confident	86.5	Confident	80 Å²	80	44 Å²	44	37%	0.374	23%	0.229	S	C	.	.	H	α-helix	trans	-63	-41.5	175.9	-177	176.4	-5.5	0	0	110.8	R175 I177 T182 Q183 F1193	R175-Q179 WeakPolarHBondContact O-CB 3.4Å; R175-Q179 PolarHBondContact O-N 2.9Å; I177-Q179 VanDerWaalsContact C-N 3.35Å; I177-Q179 PolarHBondContact O-N 2.87Å; Q179-T182 PolarHBondContact O-N 3.08Å; Q179-Q183 VanDerWaalsContact O-CG 3.28Å; Q179-Q183 WeakPolarHBondContact O-CG 3.4Å; Q179-Q183 PolarHBondContact O-N 3.45Å; Q179-F1193 HydrophobicContact CG-CD2 4.48Å
180	T	91.2	Very high	87.3	Confident	8 Å²	8	45.2 Å²	45.2	5%	0.049	24%	0.239	C	C	.	.	H	α-helix	trans	-71.7	-36.6	179.3	-50.1	0	0	0	0	112.4	W127 P128 D176 I177 Q178 T182 Q183 N184	W127-T180 HydrophobicContact CH2-CG2 4.14Å; W127-T180 HydrophobicContact CZ2-CG2 3.69Å; P128-T180 HydrophobicContact CB-CG2 3.81Å; P128-T180 HydrophobicContact CG-CG2 4.24Å; P128-T180 WeakPolarHBondContact CG-OG1 3.38Å; D176-T180 WeakPolarHBondContact O-CB 3.32Å; D176-T180 PolarHBondContact O-N 3.45Å; D176-T180 PolarHBondContact O-OG1 2.98Å; I177-T180 PolarHBondContact O-N 2.87Å; I177-T180 VanDerWaalsContact O-N 3.16Å; Q178-T180 VanDerWaalsContact C-N 3.31Å; Q178-T180 PolarHBondContact O-N 3.48Å; T180-T182 VanDerWaalsContact C-N 3.35Å; T180-Q183 PolarHBondContact O-N 2.97Å; T180-N184 VanDerWaalsContact CG2-ND2 3.31Å; T180-N184 WeakPolarHBondContact CG2-ND2 3.47Å; T180-N184 WeakPolarHBondContact O-CB 3.49Å; T180-N184 PolarHBondContact O-N 2.83Å; T180-N184 PolarHBondContact O-ND2 3.35Å
181	L	92.3	Very high	88.3	Confident	1 Å²	1	44.5 Å²	44.5	1%	0.005	23%	0.231	C	C	.	.	H	α-helix	trans	-58.5	-49.2	169	-76.4	169.2	0	0	0	110.1	W127 L159 V163 I177 Q178 Q183 N184 M185 I188 W236	W127-L181 HydrophobicContact CH2-CD2 3.62Å; W127-L181 HydrophobicContact CH2-CG 3.73Å; W127-L181 HydrophobicContact CZ3-CD2 3.87Å; W127-L181 HydrophobicContact CZ3-CG 3.81Å; L159-L181 HydrophobicContact CD2-CD2 4.35Å; V163-L181 HydrophobicContact CG1-CD1 4.46Å; I177-L181 HydrophobicContact CG2-CD1 4.11Å; I177-L181 HydrophobicContact CG2-CG 4.45Å; I177-L181 WeakPolarHBondContact O-CG 3.29Å; I177-L181 PolarHBondContact O-N 3.41Å; Q178-L181 PolarHBondContact O-N 3.49Å; L181-Q183 VanDerWaalsContact C-N 3.33Å; L181-Q183 PolarHBondContact O-N 3.3Å; L181-N184 CarbonylContact O-C 3.6Å; L181-N184 PolarHBondContact O-N 2.95Å; L181-M185 HydrophobicContact CB-CE 4.23Å; L181-M185 WeakPolarHBondContact O-CA 3.35Å; L181-M185 WeakPolarHBondContact O-CB 3.38Å; L181-M185 WeakPolarHBondContact O-CE 3.2Å; L181-M185 PolarHBondContact O-N 3.08Å; L181-I188 HydrophobicContact CD2-CD1 3.84Å; L181-W236 HydrophobicContact CB-CH2 4.2Å; L181-W236 HydrophobicContact CD1-CH2 4.32Å
182	T	90.9	Very high	89.4	Confident	67 Å²	67	41.2 Å²	41.2	41%	0.411	21%	0.208	S	C	.	.	H	α-helix	trans	-60.9	-41.4	-179.9	-51.9	0	0	0	0	111.7	Q178 Q179 T180 M185	Q178-T182 WeakPolarHBondContact O-CB 3.44Å; Q178-T182 PolarHBondContact O-N 3.47Å; Q178-T182 PolarHBondContact O-OG1 2.86Å; Q179-T182 PolarHBondContact O-N 3.08Å; T180-T182 VanDerWaalsContact C-N 3.35Å; T182-M185 VanDerWaalsContact O-CB 3.32Å; T182-M185 WeakPolarHBondContact O-CB 3.03Å; T182-M185 PolarHBondContact O-N 2.94Å
183	Q	90.8	Very high	90.2	Very high	90 Å²	90	38.7 Å²	38.7	42%	0.421	20%	0.197	S	C	.	.	H	α-helix	trans	-67.4	-36.6	177.9	-75.2	167.1	-15.3	0	0	113.3	Q179 T180 L181 M185 F1193	Q179-Q183 VanDerWaalsContact O-CG 3.28Å; Q179-Q183 WeakPolarHBondContact O-CG 3.4Å; Q179-Q183 PolarHBondContact O-N 3.45Å; T180-Q183 PolarHBondContact O-N 2.97Å; L181-Q183 VanDerWaalsContact C-N 3.33Å; L181-Q183 PolarHBondContact O-N 3.3Å; Q183-M185 VanDerWaalsContact C-N 3.32Å; Q183-F1193 VanDerWaalsContact CD-CZ 3.42Å; Q183-F1193 VanDerWaalsContact NE2-CE1 3.29Å; Q183-F1193 VanDerWaalsContact OE1-CE2 3.23Å
184	N	92.6	Very high	90.8	Very high	61 Å²	61	42 Å²	42	33%	0.326	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93	8.9	178.3	-64.5	-60.8	0	0	0	112.6	L135 T180 L181 D186 S187 I188	L135-N184 HydrophobicContact CD1-CB 3.81Å; T180-N184 VanDerWaalsContact CG2-ND2 3.31Å; T180-N184 WeakPolarHBondContact CG2-ND2 3.47Å; T180-N184 WeakPolarHBondContact O-CB 3.49Å; T180-N184 PolarHBondContact O-N 2.83Å; T180-N184 PolarHBondContact O-ND2 3.35Å; L181-N184 CarbonylContact O-C 3.6Å; L181-N184 PolarHBondContact O-N 2.95Å; N184-D186 VanDerWaalsContact C-N 3.33Å; N184-D186 PolarHBondContact O-N 3.4Å; N184-S187 WeakPolarHBondContact O-CB 3.26Å; N184-S187 PolarHBondContact O-N 3.02Å; N184-I188 HydrophobicContact CB-CD1 4.12Å; N184-I188 HydrophobicContact CB-CG1 4.43Å; N184-I188 WeakPolarHBondContact O-CG1 3.48Å; N184-I188 PolarHBondContact O-N 2.86Å
185	M	92.8	Very high	91.4	Very high	3 Å²	3	40.2 Å²	40.2	2%	0.015	21%	0.212	C	C	.	.	H	α-helix	trans	-64.3	-38.4	-169	-168.5	56.3	63.2	0	0	112	L181 T182 Q183 S187 I188 F189 Y233 W236 V237 H241	L181-M185 HydrophobicContact CB-CE 4.23Å; L181-M185 WeakPolarHBondContact O-CA 3.35Å; L181-M185 WeakPolarHBondContact O-CB 3.38Å; L181-M185 WeakPolarHBondContact O-CE 3.2Å; L181-M185 PolarHBondContact O-N 3.08Å; T182-M185 VanDerWaalsContact O-CB 3.32Å; T182-M185 WeakPolarHBondContact O-CB 3.03Å; T182-M185 PolarHBondContact O-N 2.94Å; Q183-M185 VanDerWaalsContact C-N 3.32Å; M185-S187 VanDerWaalsContact C-N 3.26Å; M185-S187 PolarHBondContact O-N 3.22Å; M185-I188 PolarHBondContact O-N 3.4Å; M185-F189 WeakPolarHBondContact O-CB 3.49Å; M185-F189 PolarHBondContact O-N 2.87Å; M185-Y233 HydrophobicContact CE-CD1 4.06Å; M185-Y233 HydrophobicContact CE-CE1 4.22Å; M185-Y233 HydrophobicContact SD-CD1 4Å; M185-Y233 HydrophobicContact SD-CE1 4.45Å; M185-W236 HydrophobicContact CE-CH2 3.27Å; M185-W236 HydrophobicContact CE-CZ2 3.97Å; M185-W236 HydrophobicContact CE-CZ3 3.86Å; M185-V237 HydrophobicContact CE-CG1 3.79Å; M185-V237 HydrophobicContact CG-CG1 4.08Å; M185-V237 HydrophobicContact SD-CG1 3.57Å; M185-V237 VanDerWaalsContact SD-CG1 3.57Å; M185-H241 VanDerWaalsContact CG-CD2 3.45Å; M185-H241 WeakPolarHBondContact CG-CD2 3.43Å
186	D	89.9	Confident	92	Very high	98 Å²	98	35 Å²	35	52%	0.524	19%	0.192	S	C	.	.	H	α-helix	trans	-58.2	-40.1	174.8	-72.9	-44.1	0	0	0	112.2	N184 S190 H241	N184-D186 VanDerWaalsContact C-N 3.33Å; N184-D186 PolarHBondContact O-N 3.4Å; D186-S190 WeakPolarHBondContact O-CB 3.43Å; D186-S190 PolarHBondContact O-N 3.36Å; D186-S190 PolarHBondContact O-OG 3.33Å; D186-H241 IonicContact OD1-CE1 3.9Å; D186-H241 PolarHBondContact OD1-CE1 3.38Å; D186-H241 IonicContact OD1-ND1 3.9Å; D186-H241 PolarHBondContact OD1-ND1 3.45Å; D186-H241 IonicContact OD2-CE1 2.78Å
187	S	92.1	Very high	92.4	Very high	74 Å²	74	38.7 Å²	38.7	52%	0.517	21%	0.209	S	C	.	.	H	α-helix	trans	-70.8	-46.7	177.6	-170.2	0	0	0	0	111.5	N184 M185 S190 F191	N184-S187 WeakPolarHBondContact O-CB 3.26Å; N184-S187 PolarHBondContact O-N 3.02Å; M185-S187 VanDerWaalsContact C-N 3.26Å; M185-S187 PolarHBondContact O-N 3.22Å; S187-S190 PolarHBondContact O-N 2.87Å; S187-F191 VanDerWaalsContact O-CB 3.32Å; S187-F191 WeakPolarHBondContact O-CB 3.25Å; S187-F191 PolarHBondContact O-N 3.19Å
188	I	93.4	Very high	92.7	Very high	6 Å²	6	42.4 Å²	42.4	3%	0.031	23%	0.228	C	C	.	.	H	α-helix	trans	-62.8	-47.5	-179.7	-65.4	166.8	0	0	0	110	L135 L181 N184 M185 F191 L192 Y233	L135-I188 HydrophobicContact CD1-CD1 4.18Å; L135-I188 HydrophobicContact CD1-CG1 4.12Å; L135-I188 HydrophobicContact CD2-CD1 4.29Å; L135-I188 HydrophobicContact CD2-CG1 4.21Å; L181-I188 HydrophobicContact CD2-CD1 3.84Å; N184-I188 HydrophobicContact CB-CD1 4.12Å; N184-I188 HydrophobicContact CB-CG1 4.43Å; N184-I188 WeakPolarHBondContact O-CG1 3.48Å; N184-I188 PolarHBondContact O-N 2.86Å; M185-I188 PolarHBondContact O-N 3.4Å; I188-F191 WeakPolarHBondContact O-CB 3.31Å; I188-F191 PolarHBondContact O-N 3.14Å; I188-L192 HydrophobicContact CG2-CD1 4.22Å; I188-L192 WeakPolarHBondContact O-CG 3.5Å; I188-L192 PolarHBondContact O-N 3.43Å; I188-Y233 HydrophobicContact CG2-CE1 4.14Å
189	F	91.8	Very high	93	Very high	4 Å²	4	39.6 Å²	39.6	2%	0.018	22%	0.215	C	C	.	.	H	α-helix	trans	-66.9	-41.3	-179	-149.2	-102.4	0	0	0	111.4	M185 F191 L192 L193 L230 V234 V237 H241 I242 L249	M185-F189 WeakPolarHBondContact O-CB 3.49Å; M185-F189 PolarHBondContact O-N 2.87Å; F189-F191 VanDerWaalsContact C-N 3.31Å; F189-F191 PolarHBondContact O-N 3Å; F189-L192 PolarHBondContact O-N 3.47Å; F189-L193 HydrophobicContact CD1-CD1 3.81Å; F189-L193 HydrophobicContact CD1-CG 4.27Å; F189-L193 HydrophobicContact CE1-CD1 4.07Å; F189-L193 HydrophobicContact CE1-CG 4.47Å; F189-L193 WeakPolarHBondContact O-CB 3.43Å; F189-L193 VanDerWaalsContact O-CG 3.29Å; F189-L193 WeakPolarHBondContact O-CG 3.32Å; F189-L193 PolarHBondContact O-N 2.93Å; F189-L230 HydrophobicContact CD2-CD2 4.44Å; F189-L230 HydrophobicContact CE2-CD2 4.07Å; F189-L230 HydrophobicContact CZ-CD2 4.35Å; F189-V234 HydrophobicContact CE2-CG2 4.32Å; F189-V234 HydrophobicContact CZ-CG2 4.3Å; F189-V237 HydrophobicContact CE2-CG2 4.46Å; F189-H241 HydrophobicContact CD1-CB 4.38Å; F189-H241 WeakPolarHBondContact CE1-O 3.26Å; F189-H241 HydrophobicContact CG-CB 4.4Å; F189-I242 HydrophobicContact CZ-CG1 4.46Å; F189-L249 HydrophobicContact CE1-CD2 3.86Å; F189-L249 HydrophobicContact CZ-CD2 3.48Å; F189-L249 VanDerWaalsContact CZ-CD2 3.48Å
190	S	92	Very high	93.2	Very high	37 Å²	37	36 Å²	36	26%	0.259	20%	0.198	S	C	.	.	H	α-helix	trans	-61.4	-39.5	173.2	-63.4	0	0	0	0	112.1	D186 S187 T194 R245	D186-S190 WeakPolarHBondContact O-CB 3.43Å; D186-S190 PolarHBondContact O-N 3.36Å; D186-S190 PolarHBondContact O-OG 3.33Å; S187-S190 PolarHBondContact O-N 2.87Å; S190-T194 WeakPolarHBondContact O-CB 3.35Å; S190-T194 PolarHBondContact O-N 3.42Å; S190-T194 PolarHBondContact O-OG1 3.35Å; S190-R245 PolarHBondContact OG-NH2 2.89Å
191	F	94.8	Very high	93.4	Very high	30 Å²	30	39.3 Å²	39.3	13%	0.132	21%	0.213	C	C	.	.	H	α-helix	trans	-62.6	-51.2	175.4	168.3	-105.8	0	0	0	111.5	E139 V152 M153 L156 S187 I188 F189 L193 T194 I195	E139-F191 HydrophobicContact CB-CE2 4.23Å; E139-F191 HydrophobicContact CG-CD2 4.08Å; E139-F191 HydrophobicContact CG-CE2 3.95Å; V152-F191 HydrophobicContact CG1-CE1 4.24Å; V152-F191 HydrophobicContact CG1-CZ 4.32Å; M153-F191 HydrophobicContact CE-CE1 3.62Å; M153-F191 HydrophobicContact CE-CZ 3.96Å; L156-F191 HydrophobicContact CD1-CD1 4.35Å; L156-F191 HydrophobicContact CD1-CE1 4.02Å; S187-F191 VanDerWaalsContact O-CB 3.32Å; S187-F191 WeakPolarHBondContact O-CB 3.25Å; S187-F191 PolarHBondContact O-N 3.19Å; I188-F191 WeakPolarHBondContact O-CB 3.31Å; I188-F191 PolarHBondContact O-N 3.14Å; F189-F191 VanDerWaalsContact C-N 3.31Å; F189-F191 PolarHBondContact O-N 3Å; F191-L193 VanDerWaalsContact C-N 3.33Å; F191-L193 PolarHBondContact O-N 3.24Å; F191-T194 PolarHBondContact O-N 2.93Å; F191-T194 VanDerWaalsContact O-N 3.12Å; F191-I195 HydrophobicContact CD2-CG1 4.09Å; F191-I195 HydrophobicContact CE1-CG1 4.32Å; F191-I195 HydrophobicContact CE2-CD1 3.87Å; F191-I195 HydrophobicContact CE2-CG1 3.65Å; F191-I195 HydrophobicContact CZ-CD1 4.22Å; F191-I195 HydrophobicContact CZ-CG1 3.78Å; F191-I195 WeakPolarHBondContact O-CG1 3.4Å; F191-I195 PolarHBondContact O-N 2.98Å
192	L	94.9	Very high	93.4	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-58.2	-43.9	178.2	-67.3	175	0	0	0	112	M153 L156 I188 F189 T194 I195 L196 T226 T229 L230	M153-L192 HydrophobicContact CE-CD2 4.07Å; M153-L192 HydrophobicContact SD-CD2 3.48Å; M153-L192 WeakPolarHBondContact SD-CD2 3.34Å; L156-L192 HydrophobicContact CD1-CD2 4.02Å; I188-L192 HydrophobicContact CG2-CD1 4.22Å; I188-L192 WeakPolarHBondContact O-CG 3.5Å; I188-L192 PolarHBondContact O-N 3.43Å; F189-L192 PolarHBondContact O-N 3.47Å; L192-T194 VanDerWaalsContact C-N 3.34Å; L192-T194 PolarHBondContact O-N 3.37Å; L192-I195 PolarHBondContact O-N 3.48Å; L192-L196 WeakPolarHBondContact O-CB 3.42Å; L192-L196 PolarHBondContact O-N 2.84Å; L192-T226 WeakPolarHBondContact O-CG2 3.4Å; L192-T229 HydrophobicContact CD1-CG2 4.27Å; L192-T229 HydrophobicContact CD2-CG2 3.85Å; L192-L230 HydrophobicContact CB-CD2 3.78Å; L192-L230 HydrophobicContact CB-CG 4.18Å; L192-L230 HydrophobicContact CD1-CD2 3.92Å; L192-L230 HydrophobicContact CD1-CG 4.41Å; L192-L230 HydrophobicContact CG-CD2 4.5Å
193	L	93.2	Very high	93.6	Very high	14 Å²	14	39 Å²	39	7%	0.073	21%	0.209	C	C	.	.	H	α-helix	trans	-63.5	-39.5	176.6	-71.3	175.2	0	0	0	112.4	F189 F191 L196 H197 L249 M252	F189-L193 HydrophobicContact CD1-CD1 3.81Å; F189-L193 HydrophobicContact CD1-CG 4.27Å; F189-L193 HydrophobicContact CE1-CD1 4.07Å; F189-L193 HydrophobicContact CE1-CG 4.47Å; F189-L193 WeakPolarHBondContact O-CB 3.43Å; F189-L193 VanDerWaalsContact O-CG 3.29Å; F189-L193 WeakPolarHBondContact O-CG 3.32Å; F189-L193 PolarHBondContact O-N 2.93Å; F191-L193 VanDerWaalsContact C-N 3.33Å; F191-L193 PolarHBondContact O-N 3.24Å; L193-L196 PolarHBondContact O-N 2.84Å; L193-H197 WeakPolarHBondContact O-CB 3.47Å; L193-H197 PolarHBondContact O-N 2.98Å; L193-L249 HydrophobicContact CD2-CB 3.96Å; L193-L249 HydrophobicContact CD2-CD1 3.65Å; L193-L249 HydrophobicContact CD2-CG 4.31Å; L193-M252 HydrophobicContact CD2-CE 3.57Å
194	T	94.6	Very high	93.5	Very high	71 Å²	71	38.9 Å²	38.9	44%	0.436	20%	0.204	S	C	.	.	H	α-helix	trans	-66.9	-45.3	179.2	-57.9	0	0	0	0	111.1	S190 F191 L192 L196 H197 I198	S190-T194 WeakPolarHBondContact O-CB 3.35Å; S190-T194 PolarHBondContact O-N 3.42Å; S190-T194 PolarHBondContact O-OG1 3.35Å; F191-T194 PolarHBondContact O-N 2.93Å; F191-T194 VanDerWaalsContact O-N 3.12Å; L192-T194 VanDerWaalsContact C-N 3.34Å; L192-T194 PolarHBondContact O-N 3.37Å; T194-L196 VanDerWaalsContact C-N 3.35Å; T194-L196 PolarHBondContact O-N 2.95Å; T194-H197 PolarHBondContact O-N 3.5Å; T194-I198 HydrophobicContact CG2-CD1 3.81Å; T194-I198 HydrophobicContact CG2-CG1 4.47Å; T194-I198 WeakPolarHBondContact O-CG1 3.33Å; T194-I198 PolarHBondContact O-N 3.29Å
195	I	95.9	Very high	93.4	Very high	16 Å²	16	41.7 Å²	41.7	8%	0.082	21%	0.213	C	C	.	.	H	α-helix	trans	-61	-44.9	176.3	-67.2	-61.8	0	0	0	111	T149 M153 F191 L192 N199 V222 T226	T149-I195 HydrophobicContact CG2-CD1 4.29Å; T149-I195 HydrophobicContact CG2-CG2 3.59Å; M153-I195 HydrophobicContact CE-CB 4.41Å; M153-I195 HydrophobicContact CE-CG1 4.23Å; M153-I195 HydrophobicContact CE-CG2 4.06Å; F191-I195 HydrophobicContact CD2-CG1 4.09Å; F191-I195 HydrophobicContact CE1-CG1 4.32Å; F191-I195 HydrophobicContact CE2-CD1 3.87Å; F191-I195 HydrophobicContact CE2-CG1 3.65Å; F191-I195 HydrophobicContact CZ-CD1 4.22Å; F191-I195 HydrophobicContact CZ-CG1 3.78Å; F191-I195 WeakPolarHBondContact O-CG1 3.4Å; F191-I195 PolarHBondContact O-N 2.98Å; L192-I195 PolarHBondContact O-N 3.48Å; I195-N199 WeakPolarHBondContact O-CB 3.39Å; I195-N199 PolarHBondContact O-N 3.49Å; I195-N199 VanDerWaalsContact O-N 3.1Å; I195-N199 PolarHBondContact O-ND2 2.91Å; I195-V222 HydrophobicContact CG2-CG1 4.15Å; I195-T226 HydrophobicContact CG2-CG2 4.32Å
196	L	95.8	Very high	93.4	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-60.4	-48.1	177.6	-178	54.3	0	0	0	111	L192 L193 T194 N199 V200 A223 T226 L227 L230 M252 L256	L192-L196 WeakPolarHBondContact O-CB 3.42Å; L192-L196 PolarHBondContact O-N 2.84Å; L193-L196 PolarHBondContact O-N 2.84Å; T194-L196 VanDerWaalsContact C-N 3.35Å; T194-L196 PolarHBondContact O-N 2.95Å; L196-N199 PolarHBondContact O-N 2.87Å; L196-V200 HydrophobicContact CD1-CG2 3.72Å; L196-V200 HydrophobicContact CG-CG2 4.32Å; L196-V200 VanDerWaalsContact O-CB 3.3Å; L196-V200 WeakPolarHBondContact O-CB 3.37Å; L196-V200 WeakPolarHBondContact O-CG2 3.31Å; L196-V200 PolarHBondContact O-N 3.24Å; L196-A223 HydrophobicContact CD1-CB 4.04Å; L196-T226 HydrophobicContact CB-CG2 3.79Å; L196-L227 HydrophobicContact CD1-CD2 4.21Å; L196-L227 HydrophobicContact CD1-CG 3.95Å; L196-L227 HydrophobicContact CD2-CD2 3.6Å; L196-L227 HydrophobicContact CD2-CG 4.18Å; L196-L230 HydrophobicContact CD2-CD1 3.56Å; L196-M252 HydrophobicContact CB-CE 4.13Å; L196-M252 HydrophobicContact CD2-CE 3.34Å; L196-M252 HydrophobicContact CD2-SD 4.2Å; L196-M252 HydrophobicContact CG-CE 3.78Å; L196-M252 HydrophobicContact CG-SD 4.07Å; L196-L256 HydrophobicContact CD1-CD1 4.38Å; L196-L256 HydrophobicContact CD2-CD1 4.33Å
197	H	94.5	Very high	93.2	Very high	83 Å²	83	42.9 Å²	42.9	38%	0.384	22%	0.215	S	C	.	.	H	α-helix	trans	-58.8	-50.7	179.7	-177.1	-81.3	0	0	0	112.5	L193 T194 N199 V200 E201 M252	L193-H197 WeakPolarHBondContact O-CB 3.47Å; L193-H197 PolarHBondContact O-N 2.98Å; T194-H197 PolarHBondContact O-N 3.5Å; H197-N199 PolarHBondContact O-N 3.28Å; H197-V200 PolarHBondContact O-N 2.92Å; H197-E201 VanDerWaalsContact CE1-CD 3.49Å; H197-E201 IonicContact CE1-OE1 2.64Å; H197-E201 PolarHBondContact CE1-OE1 2.88Å; H197-E201 IonicContact ND1-OE1 3.81Å; H197-E201 IonicContact NE2-OE1 3.63Å; H197-E201 PolarHBondContact O-N 3.45Å; H197-M252 HydrophobicContact CB-SD 4.36Å
198	I	94.8	Very high	92.7	Very high	77 Å²	77	47.7 Å²	47.7	40%	0.395	23%	0.229	S	C	.	.	H	α-helix	trans	-59.1	-50.9	-179.2	-68.5	168.2	0	0	0	110.7	T194 V200 E201 D202	T194-I198 HydrophobicContact CG2-CD1 3.81Å; T194-I198 HydrophobicContact CG2-CG1 4.47Å; T194-I198 WeakPolarHBondContact O-CG1 3.33Å; T194-I198 PolarHBondContact O-N 3.29Å; I198-V200 VanDerWaalsContact C-N 3.35Å; I198-V200 PolarHBondContact O-N 3.37Å; I198-E201 PolarHBondContact O-N 3.07Å; I198-D202 PolarHBondContact O-N 2.93Å
199	N	95.2	Very high	92.5	Very high	11 Å²	11	52.4 Å²	52.4	6%	0.059	25%	0.251	C	S	.	.	H	α-helix	trans	-70.2	-31.6	-175.5	-74.8	-81.5	0	0	0	112.8	I195 L196 H197 Y203 H219 V222	I195-N199 WeakPolarHBondContact O-CB 3.39Å; I195-N199 PolarHBondContact O-N 3.49Å; I195-N199 VanDerWaalsContact O-N 3.1Å; I195-N199 PolarHBondContact O-ND2 2.91Å; L196-N199 PolarHBondContact O-N 2.87Å; H197-N199 PolarHBondContact O-N 3.28Å; N199-Y203 WeakPolarHBondContact O-CB 3.28Å; N199-Y203 PolarHBondContact O-N 3.28Å; N199-H219 PolarHBondContact OD1-ND1 2.81Å; N199-V222 HydrophobicContact CB-CB 4.41Å; N199-V222 HydrophobicContact CB-CG1 4.27Å; N199-V222 WeakPolarHBondContact ND2-CG1 3.36Å
200	V	94.7	Very high	91.9	Very high	5 Å²	5	57.8 Å²	57.8	3%	0.03	29%	0.286	C	S	.	.	H	α-helix	trans	-68.2	-43.9	173.5	167.7	0	0	0	0	111	L196 H197 I198 R204 A223 L256 L262	L196-V200 HydrophobicContact CD1-CG2 3.72Å; L196-V200 HydrophobicContact CG-CG2 4.32Å; L196-V200 VanDerWaalsContact O-CB 3.3Å; L196-V200 WeakPolarHBondContact O-CB 3.37Å; L196-V200 WeakPolarHBondContact O-CG2 3.31Å; L196-V200 PolarHBondContact O-N 3.24Å; H197-V200 PolarHBondContact O-N 2.92Å; I198-V200 VanDerWaalsContact C-N 3.35Å; I198-V200 PolarHBondContact O-N 3.37Å; V200-R204 WeakPolarHBondContact O-CB 3.43Å; V200-R204 WeakPolarHBondContact O-CG 3.34Å; V200-R204 PolarHBondContact O-N 3.32Å; V200-A223 HydrophobicContact CG2-CB 4.03Å; V200-L256 HydrophobicContact CB-CD2 4.42Å; V200-L256 HydrophobicContact CG1-CD2 3.68Å; V200-L256 HydrophobicContact CG2-CD1 4.46Å; V200-L256 HydrophobicContact CG2-CD2 3.79Å; V200-L262 HydrophobicContact CG2-CD1 4.01Å
201	E	93.8	Very high	91.5	Very high	77 Å²	77	60.7 Å²	60.7	36%	0.36	31%	0.313	S	S	.	.	H	α-helix	trans	-62.2	-46.9	176.2	-80.2	-159.3	175.8	0	0	112.2	H197 I198 R204 K205	H197-E201 VanDerWaalsContact CE1-CD 3.49Å; H197-E201 IonicContact CE1-OE1 2.64Å; H197-E201 PolarHBondContact CE1-OE1 2.88Å; H197-E201 IonicContact ND1-OE1 3.81Å; H197-E201 IonicContact NE2-OE1 3.63Å; H197-E201 PolarHBondContact O-N 3.45Å; I198-E201 PolarHBondContact O-N 3.07Å; E201-R204 PolarHBondContact O-N 3.17Å; E201-K205 VanDerWaalsContact O-CG 3.31Å; E201-K205 WeakPolarHBondContact O-CG 3.49Å; E201-K205 PolarHBondContact O-N 3.27Å; E201-K205 IonicContact OE2-NZ 2.82Å; E201-K205 PolarHBondContact OE2-NZ 3.42Å
202	D	93.3	Very high	91.2	Very high	50 Å²	50	62.3 Å²	62.3	27%	0.267	32%	0.322	S	S	.	.	H	α-helix	trans	-67.5	-38.4	-179	-71.1	-15.9	0	0	0	111.1	I198 R204 K205 L206 H219	I198-D202 PolarHBondContact O-N 2.93Å; D202-R204 PolarHBondContact O-N 3.04Å; D202-K205 PolarHBondContact O-N 3.23Å; D202-K205 IonicContact OD1-NZ 3.6Å; D202-L206 VanDerWaalsContact O-CB 3.29Å; D202-L206 WeakPolarHBondContact O-CB 3.28Å; D202-L206 WeakPolarHBondContact O-CD1 3.48Å; D202-L206 WeakPolarHBondContact O-CG 3.4Å; D202-L206 PolarHBondContact O-N 3.1Å; D202-H219 IonicContact OD2-CE1 2.85Å
203	Y	94.1	Very high	90.8	Very high	13 Å²	13	67.1 Å²	67.1	5%	0.051	35%	0.345	C	S	.	.	H	α-helix	trans	-56	-50.7	169.6	168.3	-111.1	0	0	0	111.7	N199 K205 L206 K207 A216 C220 E261	N199-Y203 WeakPolarHBondContact O-CB 3.28Å; N199-Y203 PolarHBondContact O-N 3.28Å; Y203-K205 PolarHBondContact O-N 3.43Å; Y203-L206 PolarHBondContact O-N 2.94Å; Y203-K207 HydrophobicContact CE1-CD 4.07Å; Y203-K207 HydrophobicContact CE2-CB 4.43Å; Y203-K207 HydrophobicContact CE2-CD 4.31Å; Y203-K207 VanDerWaalsContact O-CB 3.25Å; Y203-K207 WeakPolarHBondContact O-CB 3.32Å; Y203-K207 PolarHBondContact O-N 3.48Å; Y203-K207 WeakPolarHBondContact OH-CE 3.46Å; Y203-K207 PolarHBondContact OH-NZ 3.27Å; Y203-A216 HydrophobicContact CD2-CB 4.2Å; Y203-A216 WeakPolarHBondContact CD2-O 3.25Å; Y203-C220 HydrophobicContact CD2-CB 3.68Å; Y203-C220 HydrophobicContact CE2-CB 3.78Å; Y203-C220 HydrophobicContact CG-CB 4.28Å; Y203-E261 WeakPolarHBondContact OH-CG 3.48Å
204	R	90.4	Very high	90.6	Very high	86 Å²	86	72.4 Å²	72.4	33%	0.325	37%	0.373	S	S	.	.	H	α-helix	trans	-60.7	-44.1	-179.4	-77.7	175.9	173	155.9	2.4	112.4	V200 E201 D202 E259	V200-R204 WeakPolarHBondContact O-CB 3.43Å; V200-R204 WeakPolarHBondContact O-CG 3.34Å; V200-R204 PolarHBondContact O-N 3.32Å; E201-R204 PolarHBondContact O-N 3.17Å; D202-R204 PolarHBondContact O-N 3.04Å; R204-E259 IonicContact CZ-OE1 3.93Å; R204-E259 IonicContact NE-OE1 3.7Å; R204-E259 PolarHBondContact NE-OE1 3.27Å; R204-E259 IonicContact NH2-OE1 2.96Å; R204-E259 PolarHBondContact NH2-OE1 3.48Å
205	K	90	Very high	90.4	Very high	120 Å²	120	74 Å²	74	52%	0.522	37%	0.374	S	S	.	.	H	α-helix	trans	-62.5	-41.7	177.8	-69.7	166.2	-165.7	155	0	111.8	E201 D202 Y203	E201-K205 VanDerWaalsContact O-CG 3.31Å; E201-K205 WeakPolarHBondContact O-CG 3.49Å; E201-K205 PolarHBondContact O-N 3.27Å; E201-K205 IonicContact OE2-NZ 2.82Å; E201-K205 PolarHBondContact OE2-NZ 3.42Å; D202-K205 PolarHBondContact O-N 3.23Å; D202-K205 IonicContact OD1-NZ 3.6Å; Y203-K205 PolarHBondContact O-N 3.43Å
206	L	91.4	Very high	90.1	Very high	29 Å²	29	73.4 Å²	73.4	15%	0.152	37%	0.371	C	S	.	.	H	α-helix	trans	-86.3	-22.1	-172.6	-64.3	171.9	0	0	0	113.8	D202 Y203 E208 E209 L212 K215 A216	D202-L206 VanDerWaalsContact O-CB 3.29Å; D202-L206 WeakPolarHBondContact O-CB 3.28Å; D202-L206 WeakPolarHBondContact O-CD1 3.48Å; D202-L206 WeakPolarHBondContact O-CG 3.4Å; D202-L206 PolarHBondContact O-N 3.1Å; Y203-L206 PolarHBondContact O-N 2.94Å; L206-E208 PolarHBondContact O-N 3.07Å; L206-E209 PolarHBondContact O-N 2.93Å; L206-E209 VanDerWaalsContact O-N 3.15Å; L206-L212 HydrophobicContact CD2-CB 4.25Å; L206-L212 HydrophobicContact CD2-CD1 3.53Å; L206-K215 HydrophobicContact CD1-CB 4.41Å; L206-K215 HydrophobicContact CD1-CD 4.08Å; L206-K215 HydrophobicContact CD1-CG 4Å; L206-A216 HydrophobicContact CB-CB 3.94Å
207	K	86.2	Confident	90	Very high	97 Å²	97	78.3 Å²	78.3	42%	0.422	39%	0.392	S	S	.	.	H	α-helix	trans	-60.9	-28.5	-178	179.8	-177.2	-177.5	170.4	0	113.4	Y203 E209 E259	Y203-K207 HydrophobicContact CE1-CD 4.07Å; Y203-K207 HydrophobicContact CE2-CB 4.43Å; Y203-K207 HydrophobicContact CE2-CD 4.31Å; Y203-K207 VanDerWaalsContact O-CB 3.25Å; Y203-K207 WeakPolarHBondContact O-CB 3.32Å; Y203-K207 PolarHBondContact O-N 3.48Å; Y203-K207 WeakPolarHBondContact OH-CE 3.46Å; Y203-K207 PolarHBondContact OH-NZ 3.27Å; K207-E209 VanDerWaalsContact C-N 3.29Å; K207-E209 PolarHBondContact O-N 3.35Å; K207-E259 IonicContact NZ-OE2 3.88Å; K207-E259 PolarHBondContact NZ-OE2 3.1Å
208	E	83	Confident	89.9	Confident	175 Å²	175	74.7 Å²	74.7	82%	0.818	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.4	-12.3	-179.3	-61.5	-173.4	168.4	0	0	113.1	L206 P210	L206-E208 PolarHBondContact O-N 3.07Å; E208-P210 WeakPolarHBondContact O-CD 3.48Å
209	E	87.8	Confident	90	Very high	105 Å²	105	71.6 Å²	71.6	49%	0.491	36%	0.361	S	S	.	.			trans	-106.4	107.9	-177.5	-66.1	-171.8	-171.9	0	0	112.1	L206 K207 A211 L212	L206-E209 PolarHBondContact O-N 2.93Å; L206-E209 VanDerWaalsContact O-N 3.15Å; K207-E209 VanDerWaalsContact C-N 3.29Å; K207-E209 PolarHBondContact O-N 3.35Å; E209-A211 PolarHBondContact O-N 3Å; E209-A211 VanDerWaalsContact O-N 3.11Å; E209-L212 HydrophobicContact CB-CB 4.48Å; E209-L212 PolarHBondContact O-N 2.94Å; E209-L212 WeakPolarHBondContact OE2-CD1 3.33Å
210	P	79.6	Confident	89.9	Confident	117 Å²	117	71.6 Å²	71.6	76%	0.76	36%	0.362	S	S	*	.	G	3₁₀ helix	trans	-59.7	-28.8	-176.8	-24.1	33	0	0	0	114.2	E208 L212	E208-P210 WeakPolarHBondContact O-CD 3.48Å; P210-L212 PolarHBondContact O-N 3.43Å
211	A	82.9	Confident	89.9	Confident	98 Å²	98	75 Å²	75	81%	0.81	37%	0.374	S	S	*	.	G	3₁₀ helix	trans	-70.3	-18.8	179.5	0	0	0	0	0	113.5	E209	E209-A211 PolarHBondContact O-N 3Å; E209-A211 VanDerWaalsContact O-N 3.11Å
212	L	88.4	Confident	90.1	Very high	64 Å²	64	71.3 Å²	71.3	34%	0.335	36%	0.357	S	S	.	.	G	3₁₀ helix	trans	-112.6	16.4	-177.6	-61.7	179.5	0	0	0	112.7	L206 E209 P210 L214 K215 A216	L206-L212 HydrophobicContact CD2-CB 4.25Å; L206-L212 HydrophobicContact CD2-CD1 3.53Å; E209-L212 HydrophobicContact CB-CB 4.48Å; E209-L212 PolarHBondContact O-N 2.94Å; E209-L212 WeakPolarHBondContact OE2-CD1 3.33Å; P210-L212 PolarHBondContact O-N 3.43Å; L212-L214 VanDerWaalsContact C-N 3.31Å; L212-L214 PolarHBondContact O-N 3.01Å; L212-K215 WeakPolarHBondContact O-CA 3.4Å; L212-K215 WeakPolarHBondContact O-CB 3.4Å; L212-K215 PolarHBondContact O-N 3.47Å; L212-A216 PolarHBondContact O-N 2.93Å
213	E	87.6	Confident	90.2	Very high	101 Å²	101	69 Å²	69	47%	0.472	34%	0.344	S	S	.	.	H	α-helix	trans	-54.2	-43.1	-176.6	-170	-167.4	155.3	0	0	113.1	K215 A216 K217	E213-K215 VanDerWaalsContact C-N 3.28Å; E213-K215 PolarHBondContact O-N 3.01Å; E213-A216 PolarHBondContact O-N 3.48Å; E213-K217 HydrophobicContact CG-CD 4.44Å; E213-K217 WeakPolarHBondContact O-CG 3.08Å; E213-K217 PolarHBondContact O-N 3.37Å; E213-K217 VanDerWaalsContact OE1-CE 3.29Å; E213-K217 WeakPolarHBondContact OE1-CE 3.21Å; E213-K217 IonicContact OE1-NZ 2.78Å; E213-K217 PolarHBondContact OE1-NZ 3.33Å
214	L	88.2	Confident	90.2	Very high	126 Å²	126	69.9 Å²	69.9	66%	0.66	35%	0.351	S	S	*	.	H	α-helix	trans	-62.3	-37	178	-68.6	174.4	0	0	0	111.9	L105 L212 K217 A218	L105-L214 HydrophobicContact CD1-CB 4.29Å; L105-L214 HydrophobicContact CD1-CD2 3.93Å; L105-L214 WeakPolarHBondContact CD1-O 3.45Å; L212-L214 VanDerWaalsContact C-N 3.31Å; L212-L214 PolarHBondContact O-N 3.01Å; L214-K217 PolarHBondContact O-N 3.35Å; L214-A218 PolarHBondContact O-N 3.29Å
215	K	89.9	Confident	90.4	Very high	104 Å²	104	66.3 Å²	66.3	45%	0.452	34%	0.34	S	S	.	.	H	α-helix	trans	-73.4	-38.9	177.5	-165.3	175.4	-178.6	-179.9	0	111.4	L206 L212 E213 K217 A218 H219	L206-K215 HydrophobicContact CD1-CB 4.41Å; L206-K215 HydrophobicContact CD1-CD 4.08Å; L206-K215 HydrophobicContact CD1-CG 4Å; L212-K215 WeakPolarHBondContact O-CA 3.4Å; L212-K215 WeakPolarHBondContact O-CB 3.4Å; L212-K215 PolarHBondContact O-N 3.47Å; E213-K215 VanDerWaalsContact C-N 3.28Å; E213-K215 PolarHBondContact O-N 3.01Å; K215-K217 VanDerWaalsContact C-N 3.34Å; K215-K217 PolarHBondContact O-N 2.74Å; K215-A218 WeakPolarHBondContact O-CB 3.25Å; K215-A218 PolarHBondContact O-N 2.83Å; K215-H219 PolarHBondContact O-CD2 3.3Å; K215-H219 VanDerWaalsContact O-CD2 3.26Å; K215-H219 PolarHBondContact O-N 3.08Å; K215-H219 VanDerWaalsContact O-N 3.11Å
216	A	91.2	Very high	90.8	Very high	4 Å²	4	60.6 Å²	60.6	3%	0.033	32%	0.315	C	S	.	.	H	α-helix	trans	-59	-46	171.2	0	0	0	0	0	111.1	Y203 L206 L212 E213 A218 H219 C220	Y203-A216 HydrophobicContact CD2-CB 4.2Å; Y203-A216 WeakPolarHBondContact CD2-O 3.25Å; L206-A216 HydrophobicContact CB-CB 3.94Å; L212-A216 PolarHBondContact O-N 2.93Å; E213-A216 PolarHBondContact O-N 3.48Å; A216-A218 VanDerWaalsContact C-N 3.31Å; A216-A218 PolarHBondContact O-N 3.33Å; A216-H219 PolarHBondContact O-N 3.3Å; A216-C220 WeakPolarHBondContact O-CB 3.43Å; A216-C220 PolarHBondContact O-N 2.76Å
217	K	92.2	Very high	91	Very high	102 Å²	102	59.2 Å²	59.2	44%	0.443	31%	0.307	S	S	.	.	H	α-helix	trans	-60	-38.1	175.6	-78.9	174.7	168.4	166.1	0	112.9	L105 E213 L214 K215 C220 R221	L105-K217 HydrophobicContact CD1-CB 4.2Å; L105-K217 HydrophobicContact CD2-CB 4.25Å; E213-K217 HydrophobicContact CG-CD 4.44Å; E213-K217 WeakPolarHBondContact O-CG 3.08Å; E213-K217 PolarHBondContact O-N 3.37Å; E213-K217 VanDerWaalsContact OE1-CE 3.29Å; E213-K217 WeakPolarHBondContact OE1-CE 3.21Å; E213-K217 IonicContact OE1-NZ 2.78Å; E213-K217 PolarHBondContact OE1-NZ 3.33Å; L214-K217 PolarHBondContact O-N 3.35Å; K215-K217 VanDerWaalsContact C-N 3.34Å; K215-K217 PolarHBondContact O-N 2.74Å; K217-C220 PolarHBondContact O-N 2.67Å; K217-R221 WeakPolarHBondContact O-CB 3.25Å; K217-R221 PolarHBondContact O-N 3.26Å
218	A	93.5	Very high	91.2	Very high	7 Å²	7	57.4 Å²	57.4	6%	0.058	30%	0.303	C	S	.	.	H	α-helix	trans	-60.5	-52.5	174.4	0	0	0	0	0	111.9	I104 E146 L214 K215 A216 C220 R221 V222	I104-A218 HydrophobicContact CG2-CB 3.51Å; E146-A218 HydrophobicContact CB-CB 4.29Å; E146-A218 HydrophobicContact CG-CB 4.12Å; L214-A218 PolarHBondContact O-N 3.29Å; K215-A218 WeakPolarHBondContact O-CB 3.25Å; K215-A218 PolarHBondContact O-N 2.83Å; A216-A218 VanDerWaalsContact C-N 3.31Å; A216-A218 PolarHBondContact O-N 3.33Å; A218-C220 VanDerWaalsContact C-N 3.32Å; A218-C220 PolarHBondContact O-N 2.94Å; A218-R221 PolarHBondContact O-N 3.4Å; A218-V222 PolarHBondContact O-N 3.42Å; A218-V222 VanDerWaalsContact O-N 3.11Å
219	H	95.8	Very high	91.8	Very high	13 Å²	13	49.1 Å²	49.1	6%	0.06	26%	0.264	C	S	.	.	H	α-helix	trans	-61.2	-39.4	176.6	-74.1	-67.2	0	0	0	112.6	E146 N199 D202 K215 A216 R221 V222 A223	E146-H219 IonicContact OE1-CE1 3.58Å; E146-H219 IonicContact OE1-NE2 3.48Å; N199-H219 PolarHBondContact OD1-ND1 2.81Å; D202-H219 IonicContact OD2-CE1 2.85Å; K215-H219 PolarHBondContact O-CD2 3.3Å; K215-H219 VanDerWaalsContact O-CD2 3.26Å; K215-H219 PolarHBondContact O-N 3.08Å; K215-H219 VanDerWaalsContact O-N 3.11Å; A216-H219 PolarHBondContact O-N 3.3Å; H219-R221 VanDerWaalsContact C-N 3.33Å; H219-R221 PolarHBondContact O-N 3.36Å; H219-V222 PolarHBondContact O-N 2.67Å; H219-A223 PolarHBondContact O-N 3.3Å
220	C	94.9	Very high	92.1	Very high	11 Å²	11	44.1 Å²	44.1	7%	0.074	24%	0.241	C	C	.	.	H	α-helix	trans	-59	-44.4	174.9	-168.7	0	0	0	0	111.7	Y203 A216 K217 A218 V222 A223 V224 E261	Y203-C220 HydrophobicContact CD2-CB 3.68Å; Y203-C220 HydrophobicContact CE2-CB 3.78Å; Y203-C220 HydrophobicContact CG-CB 4.28Å; A216-C220 WeakPolarHBondContact O-CB 3.43Å; A216-C220 PolarHBondContact O-N 2.76Å; K217-C220 PolarHBondContact O-N 2.67Å; A218-C220 VanDerWaalsContact C-N 3.32Å; A218-C220 PolarHBondContact O-N 2.94Å; C220-V222 VanDerWaalsContact C-N 3.34Å; C220-V222 PolarHBondContact O-N 3.04Å; C220-A223 WeakPolarHBondContact O-CB 3.26Å; C220-A223 PolarHBondContact O-N 3.19Å; C220-V224 WeakPolarHBondContact O-CG2 3.21Å; C220-V224 PolarHBondContact O-N 3.32Å; C220-E261 VanDerWaalsContact SG-CB 3.53Å
221	R	94.3	Very high	92.5	Very high	76 Å²	76	39.2 Å²	39.2	29%	0.287	21%	0.21	S	C	.	.	H	α-helix	trans	-65.1	-37	178.8	-174.4	163.8	172.8	170.7	11.1	112.4	I104 K112 E150 K217 A218 H219 V224 A225	I104-R221 HydrophobicContact CD1-CB 3.99Å; I104-R221 HydrophobicContact CD1-CG 4.03Å; I104-R221 HydrophobicContact CG1-CB 4.47Å; I104-R221 HydrophobicContact CG1-CG 4.2Å; I104-R221 VanDerWaalsContact O-CZ 3.31Å; I104-R221 PolarHBondContact O-NH1 2.94Å; K112-R221 VanDerWaalsContact NZ-CZ 3.26Å; E150-R221 IonicContact OE1-CZ 3.72Å; E150-R221 IonicContact OE1-NE 3.65Å; E150-R221 PolarHBondContact OE1-NE 3.35Å; E150-R221 IonicContact OE1-NH2 3.54Å; E150-R221 IonicContact OE2-NE 3.79Å; K217-R221 WeakPolarHBondContact O-CB 3.25Å; K217-R221 PolarHBondContact O-N 3.26Å; A218-R221 PolarHBondContact O-N 3.4Å; H219-R221 VanDerWaalsContact C-N 3.33Å; H219-R221 PolarHBondContact O-N 3.36Å; R221-V224 PolarHBondContact O-N 3.48Å; R221-A225 PolarHBondContact O-N 3.13Å
222	V	96.7	Very high	92.6	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-64.2	-42.4	171.8	177.4	0	0	0	0	111.3	I104 E146 T149 I195 N199 A218 H219 C220 A225 T226	I104-V222 HydrophobicContact CD1-CG2 3.62Å; E146-V222 HydrophobicContact CB-CG2 3.76Å; E146-V222 HydrophobicContact CG-CG2 4.47Å; E146-V222 WeakPolarHBondContact O-CG2 3.47Å; T149-V222 HydrophobicContact CG2-CG1 3.49Å; T149-V222 VanDerWaalsContact CG2-CG1 3.49Å; I195-V222 HydrophobicContact CG2-CG1 4.15Å; N199-V222 HydrophobicContact CB-CB 4.41Å; N199-V222 HydrophobicContact CB-CG1 4.27Å; N199-V222 WeakPolarHBondContact ND2-CG1 3.36Å; A218-V222 PolarHBondContact O-N 3.42Å; A218-V222 VanDerWaalsContact O-N 3.11Å; H219-V222 PolarHBondContact O-N 2.67Å; C220-V222 VanDerWaalsContact C-N 3.34Å; C220-V222 PolarHBondContact O-N 3.04Å; V222-A225 PolarHBondContact O-N 2.96Å; V222-T226 WeakPolarHBondContact O-CB 3.21Å; V222-T226 PolarHBondContact O-N 2.74Å; V222-T226 PolarHBondContact O-OG1 3.26Å
223	A	96.9	Very high	92.7	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-62	-43.5	176.8	0	0	0	0	0	111.9	L196 V200 H219 C220 T226 L227 L262	L196-A223 HydrophobicContact CD1-CB 4.04Å; V200-A223 HydrophobicContact CG2-CB 4.03Å; H219-A223 PolarHBondContact O-N 3.3Å; C220-A223 WeakPolarHBondContact O-CB 3.26Å; C220-A223 PolarHBondContact O-N 3.19Å; A223-T226 PolarHBondContact O-N 3.39Å; A223-L227 WeakPolarHBondContact O-CG 3.38Å; A223-L227 PolarHBondContact O-N 3.18Å; A223-L262 HydrophobicContact CB-CD1 4.08Å; A223-L262 HydrophobicContact CB-CD2 3.83Å
224	V	94	Very high	92.8	Very high	33 Å²	33	27.7 Å²	27.7	20%	0.2	14%	0.143	C	C	.	.	H	α-helix	trans	-57.3	-51.3	172.9	169	0	0	0	0	111.2	C220 R221 T226 L227 N228 L262 E265	C220-V224 WeakPolarHBondContact O-CG2 3.21Å; C220-V224 PolarHBondContact O-N 3.32Å; R221-V224 PolarHBondContact O-N 3.48Å; V224-T226 VanDerWaalsContact C-N 3.26Å; V224-T226 PolarHBondContact O-N 2.84Å; V224-L227 PolarHBondContact O-N 3.08Å; V224-N228 PolarHBondContact O-N 3.5Å; V224-N228 PolarHBondContact O-ND2 2.77Å; V224-L262 HydrophobicContact CG2-CD2 3.58Å; V224-E265 HydrophobicContact CG1-CG 4.18Å
225	A	94.6	Very high	92.7	Very high	10 Å²	10	25.7 Å²	25.7	8%	0.083	13%	0.133	C	C	.	.	H	α-helix	trans	-59.2	-40.1	178.4	0	0	0	0	0	111.8	E150 M153 R221 V222 N228 T229	E150-A225 HydrophobicContact CG-CB 3.98Å; M153-A225 HydrophobicContact CB-CB 4.02Å; M153-A225 HydrophobicContact CG-CB 4.42Å; R221-A225 PolarHBondContact O-N 3.13Å; V222-A225 PolarHBondContact O-N 2.96Å; A225-N228 PolarHBondContact O-N 3.28Å; A225-T229 PolarHBondContact O-N 2.95Å; A225-T229 PolarHBondContact O-OG1 3.01Å
226	T	97.3	Very high	92.5	Very high	0 Å²	0	22.7 Å²	22.7	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-67.7	-39.9	178.8	-50.8	0	0	0	0	112.2	M153 L192 I195 L196 V222 A223 V224 T229 L230	M153-T226 HydrophobicContact SD-CG2 3.94Å; L192-T226 WeakPolarHBondContact O-CG2 3.4Å; I195-T226 HydrophobicContact CG2-CG2 4.32Å; L196-T226 HydrophobicContact CB-CG2 3.79Å; V222-T226 WeakPolarHBondContact O-CB 3.21Å; V222-T226 PolarHBondContact O-N 2.74Å; V222-T226 PolarHBondContact O-OG1 3.26Å; A223-T226 PolarHBondContact O-N 3.39Å; V224-T226 VanDerWaalsContact C-N 3.26Å; V224-T226 PolarHBondContact O-N 2.84Å; T226-T229 PolarHBondContact O-N 3.12Å; T226-L230 HydrophobicContact CG2-CD1 4.4Å; T226-L230 WeakPolarHBondContact O-CB 3.5Å; T226-L230 WeakPolarHBondContact O-CG 3.13Å; T226-L230 PolarHBondContact O-N 3.34Å
227	L	95.3	Very high	92.5	Very high	0 Å²	0	22.6 Å²	22.6	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-63.8	-42.9	174.9	-75	167.8	0	0	0	111.7	L196 A223 V224 T229 L230 A231 L253 L256 L262 E265 A266	L196-L227 HydrophobicContact CD1-CD2 4.21Å; L196-L227 HydrophobicContact CD1-CG 3.95Å; L196-L227 HydrophobicContact CD2-CD2 3.6Å; L196-L227 HydrophobicContact CD2-CG 4.18Å; A223-L227 WeakPolarHBondContact O-CG 3.38Å; A223-L227 PolarHBondContact O-N 3.18Å; V224-L227 PolarHBondContact O-N 3.08Å; L227-T229 VanDerWaalsContact C-N 3.35Å; L227-L230 WeakPolarHBondContact O-CB 3.32Å; L227-L230 PolarHBondContact O-N 3.45Å; L227-A231 PolarHBondContact O-N 2.91Å; L227-L253 HydrophobicContact CD2-CD2 3.63Å; L227-L256 HydrophobicContact CD1-CD1 4.3Å; L227-L256 HydrophobicContact CD2-CD1 4.07Å; L227-L262 HydrophobicContact CD1-CB 4.25Å; L227-L262 HydrophobicContact CD1-CD2 4.33Å; L227-E265 HydrophobicContact CB-CB 3.81Å; L227-E265 HydrophobicContact CD1-CB 3.87Å; L227-E265 HydrophobicContact CG-CB 4.47Å; L227-A266 HydrophobicContact CD1-CB 4.46Å
228	N	91.9	Very high	92.3	Very high	60 Å²	60	21.1 Å²	21.1	32%	0.321	12%	0.118	S	C	.	.	H	α-helix	trans	-63.2	-41.8	175.1	-69.4	-19.5	0	0	0	111.5	L157 V224 A225 A231 G232	L157-N228 HydrophobicContact CD2-CB 4.42Å; V224-N228 PolarHBondContact O-N 3.5Å; V224-N228 PolarHBondContact O-ND2 2.77Å; A225-N228 PolarHBondContact O-N 3.28Å; N228-A231 WeakPolarHBondContact O-CB 3.35Å; N228-A231 PolarHBondContact O-N 3.35Å; N228-G232 PolarHBondContact O-N 3.02Å; N228-G232 VanDerWaalsContact O-N 3.14Å
229	T	94.6	Very high	91.9	Very high	1 Å²	1	21 Å²	21	1%	0.006	12%	0.116	C	C	.	.	H	α-helix	trans	-61.7	-46	172.9	-57.8	0	0	0	0	111.1	M153 L156 L157 L192 A225 T226 L227 A231 G232 Y233	M153-T229 WeakPolarHBondContact CB-OG1 3.35Å; M153-T229 PolarHBondContact O-OG1 3.2Å; L156-T229 HydrophobicContact CB-CG2 3.93Å; L157-T229 HydrophobicContact CB-CG2 4.17Å; L192-T229 HydrophobicContact CD1-CG2 4.27Å; L192-T229 HydrophobicContact CD2-CG2 3.85Å; A225-T229 PolarHBondContact O-N 2.95Å; A225-T229 PolarHBondContact O-OG1 3.01Å; T226-T229 PolarHBondContact O-N 3.12Å; L227-T229 VanDerWaalsContact C-N 3.35Å; T229-A231 VanDerWaalsContact C-N 3.34Å; T229-A231 PolarHBondContact O-N 3.33Å; T229-G232 PolarHBondContact O-N 2.91Å; T229-Y233 HydrophobicContact CG2-CD2 4.18Å; T229-Y233 HydrophobicContact CG2-CE2 4.01Å; T229-Y233 VanDerWaalsContact O-CD2 3.27Å; T229-Y233 WeakPolarHBondContact O-CD2 3.32Å; T229-Y233 PolarHBondContact O-N 2.68Å
230	L	94.4	Very high	91.5	Very high	0 Å²	0	24.7 Å²	24.7	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-58.6	-44.3	175.9	-79.9	165.7	0	0	0	111.8	F189 L192 L196 T226 L227 G232 Y233 V234 L249	F189-L230 HydrophobicContact CD2-CD2 4.44Å; F189-L230 HydrophobicContact CE2-CD2 4.07Å; F189-L230 HydrophobicContact CZ-CD2 4.35Å; L192-L230 HydrophobicContact CB-CD2 3.78Å; L192-L230 HydrophobicContact CB-CG 4.18Å; L192-L230 HydrophobicContact CD1-CD2 3.92Å; L192-L230 HydrophobicContact CD1-CG 4.41Å; L192-L230 HydrophobicContact CG-CD2 4.5Å; L196-L230 HydrophobicContact CD2-CD1 3.56Å; T226-L230 HydrophobicContact CG2-CD1 4.4Å; T226-L230 WeakPolarHBondContact O-CB 3.5Å; T226-L230 WeakPolarHBondContact O-CG 3.13Å; T226-L230 PolarHBondContact O-N 3.34Å; L227-L230 WeakPolarHBondContact O-CB 3.32Å; L227-L230 PolarHBondContact O-N 3.45Å; L230-G232 VanDerWaalsContact C-N 3.29Å; L230-G232 PolarHBondContact O-N 2.81Å; L230-Y233 PolarHBondContact O-N 3.28Å; L230-V234 WeakPolarHBondContact O-CB 3.26Å; L230-V234 VanDerWaalsContact O-CG2 3.26Å; L230-V234 WeakPolarHBondContact O-CG2 3.12Å; L230-V234 PolarHBondContact O-N 3.5Å; L230-L249 HydrophobicContact CD1-CD1 4.27Å
231	A	88.4	Confident	91.2	Very high	13 Å²	13	25 Å²	25	11%	0.107	14%	0.14	C	C	.	.	H	α-helix	trans	-55.4	-43.5	176.1	0	0	0	0	0	112	L227 N228 T229 Y233 C269 I272	L227-A231 PolarHBondContact O-N 2.91Å; N228-A231 WeakPolarHBondContact O-CB 3.35Å; N228-A231 PolarHBondContact O-N 3.35Å; T229-A231 VanDerWaalsContact C-N 3.34Å; T229-A231 PolarHBondContact O-N 3.33Å; A231-Y233 VanDerWaalsContact C-N 3.26Å; A231-Y233 PolarHBondContact O-N 2.82Å; A231-C269 HydrophobicContact CB-CB 4.43Å; A231-I272 HydrophobicContact CB-CD1 3.76Å
232	G	84.9	Confident	90.9	Very high	22 Å²	22	21.4 Å²	21.4	23%	0.227	13%	0.126	C	C	.	.	H	α-helix	trans	-67.1	-17.9	175.8	0	0	0	0	0	115.4	N228 T229 L230 W236	N228-G232 PolarHBondContact O-N 3.02Å; N228-G232 VanDerWaalsContact O-N 3.14Å; T229-G232 PolarHBondContact O-N 2.91Å; L230-G232 VanDerWaalsContact C-N 3.29Å; L230-G232 PolarHBondContact O-N 2.81Å; G232-W236 VanDerWaalsContact O-CD1 3.22Å; G232-W236 PolarHBondContact O-NE1 3.24Å
233	Y	91	Very high	90.3	Very high	0 Å²	0	22.6 Å²	22.6	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-96.4	-43.8	174.8	-81.9	-106.3	0	0	0	112.4	L156 A160 M185 I188 T229 L230 A231 D235 W236 V237	L156-Y233 HydrophobicContact CB-CE2 4.4Å; L156-Y233 VanDerWaalsContact O-CE2 3.29Å; L156-Y233 WeakPolarHBondContact O-CE2 3.41Å; L156-Y233 PolarHBondContact O-OH 3.41Å; A160-Y233 HydrophobicContact CB-CD2 4.02Å; A160-Y233 HydrophobicContact CB-CE1 4.37Å; A160-Y233 HydrophobicContact CB-CE2 3.57Å; M185-Y233 HydrophobicContact CE-CD1 4.06Å; M185-Y233 HydrophobicContact CE-CE1 4.22Å; M185-Y233 HydrophobicContact SD-CD1 4Å; M185-Y233 HydrophobicContact SD-CE1 4.45Å; I188-Y233 HydrophobicContact CG2-CE1 4.14Å; T229-Y233 HydrophobicContact CG2-CD2 4.18Å; T229-Y233 HydrophobicContact CG2-CE2 4.01Å; T229-Y233 VanDerWaalsContact O-CD2 3.27Å; T229-Y233 WeakPolarHBondContact O-CD2 3.32Å; T229-Y233 PolarHBondContact O-N 2.68Å; L230-Y233 PolarHBondContact O-N 3.28Å; A231-Y233 VanDerWaalsContact C-N 3.26Å; A231-Y233 PolarHBondContact O-N 2.82Å; Y233-D235 PolarHBondContact O-N 3.45Å; Y233-D235 VanDerWaalsContact O-N 3.1Å; Y233-W236 HydrophobicContact CD1-CH2 4.45Å; Y233-W236 AromaticContact CD1-CZ2 3.67Å; Y233-W236 HydrophobicContact CD1-CZ2 3.67Å; Y233-W236 AromaticContact CE1-CZ2 3.88Å; Y233-W236 HydrophobicContact CE1-CZ2 3.88Å; Y233-W236 HydrophobicContact CG-CZ2 4.4Å; Y233-W236 PolarHBondContact O-N 2.83Å; Y233-W236 VanDerWaalsContact O-N 3.08Å; Y233-V237 HydrophobicContact CD1-CG1 4.37Å; Y233-V237 VanDerWaalsContact O-CG1 3.27Å; Y233-V237 WeakPolarHBondContact O-CG1 3.44Å; Y233-V237 WeakPolarHBondContact O-CG2 3.29Å; Y233-V237 PolarHBondContact O-N 3.46Å
234	V	89.7	Confident	89.7	Confident	0 Å²	0	24.3 Å²	24.3	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-54	-33.2	-178.6	167.3	0	0	0	0	112	F189 L230 W236 I242 L249 I272 A273 R276	F189-V234 HydrophobicContact CE2-CG2 4.32Å; F189-V234 HydrophobicContact CZ-CG2 4.3Å; L230-V234 WeakPolarHBondContact O-CB 3.26Å; L230-V234 VanDerWaalsContact O-CG2 3.26Å; L230-V234 WeakPolarHBondContact O-CG2 3.12Å; L230-V234 PolarHBondContact O-N 3.5Å; V234-W236 PolarHBondContact O-N 3Å; V234-I242 HydrophobicContact CG1-CD1 3.91Å; V234-I242 HydrophobicContact CG1-CG1 4.45Å; V234-L249 HydrophobicContact CG2-CD2 4.04Å; V234-I272 HydrophobicContact CB-CG2 4.49Å; V234-I272 HydrophobicContact CG1-CG2 4.07Å; V234-A273 HydrophobicContact CG1-CB 3.64Å; V234-R276 WeakPolarHBondContact O-CD 3.33Å; V234-R276 PolarHBondContact O-NE 2.82Å
235	D	85.2	Confident	89.1	Confident	84 Å²	84	30.4 Å²	30.4	45%	0.449	17%	0.165	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.1	-25.7	179.6	-175.9	53.6	0	0	0	114.4	Y233 I272 R276	Y233-D235 PolarHBondContact O-N 3.45Å; Y233-D235 VanDerWaalsContact O-N 3.1Å; D235-I272 HydrophobicContact CB-CG2 3.78Å; D235-R276 WeakPolarHBondContact O-CD 3.35Å; D235-R276 PolarHBondContact O-NE 3.39Å; D235-R276 PolarHBondContact O-NH1 2.88Å
236	W	86.9	Confident	88.3	Confident	40 Å²	40	36.4 Å²	36.4	15%	0.152	20%	0.196	C	C	.	.	T	Hydrogen-bonded Turn	trans	-133.4	-17.7	-172.3	63.8	-93.1	0	0	0	115.2	A160 I164 L181 M185 G232 Y233 V234 R276	A160-W236 HydrophobicContact CB-CZ2 4.42Å; I164-W236 HydrophobicContact CB-CG 4.4Å; I164-W236 HydrophobicContact CD1-CD2 4.1Å; I164-W236 HydrophobicContact CD1-CE3 4.03Å; I164-W236 HydrophobicContact CD1-CH2 4.24Å; I164-W236 HydrophobicContact CD1-CZ2 4.34Å; I164-W236 HydrophobicContact CD1-CZ3 4.11Å; I164-W236 HydrophobicContact CG1-CD2 3.86Å; I164-W236 HydrophobicContact CG1-CE3 4.31Å; I164-W236 HydrophobicContact CG1-CG 4.23Å; I164-W236 HydrophobicContact CG1-CH2 4.36Å; I164-W236 HydrophobicContact CG1-CZ2 3.96Å; I164-W236 HydrophobicContact CG2-CB 3.85Å; I164-W236 HydrophobicContact CG2-CD2 4.15Å; I164-W236 HydrophobicContact CG2-CG 3.69Å; L181-W236 HydrophobicContact CB-CH2 4.2Å; L181-W236 HydrophobicContact CD1-CH2 4.32Å; M185-W236 HydrophobicContact CE-CH2 3.27Å; M185-W236 HydrophobicContact CE-CZ2 3.97Å; M185-W236 HydrophobicContact CE-CZ3 3.86Å; G232-W236 VanDerWaalsContact O-CD1 3.22Å; G232-W236 PolarHBondContact O-NE1 3.24Å; Y233-W236 HydrophobicContact CD1-CH2 4.45Å; Y233-W236 AromaticContact CD1-CZ2 3.67Å; Y233-W236 HydrophobicContact CD1-CZ2 3.67Å; Y233-W236 AromaticContact CE1-CZ2 3.88Å; Y233-W236 HydrophobicContact CE1-CZ2 3.88Å; Y233-W236 HydrophobicContact CG-CZ2 4.4Å; Y233-W236 PolarHBondContact O-N 2.83Å; Y233-W236 VanDerWaalsContact O-N 3.08Å; V234-W236 PolarHBondContact O-N 3Å; W236-R276 PolarHBondContact O-NH2 3.35Å
237	V	89.6	Confident	87.7	Confident	3 Å²	3	36.5 Å²	36.5	2%	0.018	20%	0.196	C	C	.	.	S	Bend	trans	-60.3	158.7	176.1	-65.6	0	0	0	0	111.6	M185 F189 Y233 I242 R276	M185-V237 HydrophobicContact CE-CG1 3.79Å; M185-V237 HydrophobicContact CG-CG1 4.08Å; M185-V237 HydrophobicContact SD-CG1 3.57Å; M185-V237 VanDerWaalsContact SD-CG1 3.57Å; F189-V237 HydrophobicContact CE2-CG2 4.46Å; Y233-V237 HydrophobicContact CD1-CG1 4.37Å; Y233-V237 VanDerWaalsContact O-CG1 3.27Å; Y233-V237 WeakPolarHBondContact O-CG1 3.44Å; Y233-V237 WeakPolarHBondContact O-CG2 3.29Å; Y233-V237 PolarHBondContact O-N 3.46Å; V237-I242 HydrophobicContact CG2-CD1 4.04Å; V237-I242 HydrophobicContact CG2-CG1 3.92Å; V237-R276 PolarHBondContact O-NH2 2.7Å
238	T	87.9	Confident	87.3	Confident	70 Å²	70	40 Å²	40	43%	0.429	21%	0.212	S	C	.	.			trans	-64.4	142.2	173.5	56.8	0	0	0	0	109.8	V240 H241	T238-V240 PolarHBondContact O-N 3.19Å; T238-V240 VanDerWaalsContact O-N 3.08Å; T238-H241 PolarHBondContact O-N 2.61Å; T238-H241 VanDerWaalsContact O-N 3.1Å; T238-H241 PolarHBondContact OG1-CD2 3.03Å; T238-H241 PolarHBondContact OG1-NE2 3.16Å
239	L	86.3	Confident	87.2	Confident	4 Å²	4	37.2 Å²	37.2	2%	0.021	20%	0.198	C	C	.	.	H	α-helix	trans	-59.1	-24.2	-177.5	-80.7	158.1	0	0	0	112.9	H241 I242 T243 R276 E282 R283 F286	L239-H241 VanDerWaalsContact C-N 3.29Å; L239-H241 PolarHBondContact O-N 2.83Å; L239-I242 HydrophobicContact CD2-CD1 4.28Å; L239-I242 PolarHBondContact O-N 3.13Å; L239-T243 WeakPolarHBondContact O-CB 3.49Å; L239-T243 WeakPolarHBondContact O-CG2 3.43Å; L239-T243 PolarHBondContact O-N 3.3Å; L239-T243 PolarHBondContact O-OG1 3.32Å; L239-R276 HydrophobicContact CD2-CB 4.25Å; L239-E282 HydrophobicContact CB-CB 3.99Å; L239-E282 HydrophobicContact CD1-CB 3.76Å; L239-R283 HydrophobicContact CD1-CG 3.99Å; L239-F286 HydrophobicContact CD2-CE2 3.83Å; L239-F286 HydrophobicContact CD2-CZ 3.49Å; L239-F286 VanDerWaalsContact CD2-CZ 3.49Å
240	V	86.6	Confident	87.1	Confident	91 Å²	91	37.3 Å²	37.3	55%	0.552	20%	0.198	S	C	*	.	H	α-helix	trans	-60.1	-36.1	177.1	-178.7	0	0	0	0	112.1	T238 T243 S244	T238-V240 PolarHBondContact O-N 3.19Å; T238-V240 VanDerWaalsContact O-N 3.08Å; V240-T243 CarbonylContact O-C 3.34Å; V240-S244 WeakPolarHBondContact O-CA 3.36Å; V240-S244 WeakPolarHBondContact O-CB 2.85Å; V240-S244 PolarHBondContact O-N 2.61Å
241	H	88.4	Confident	86.8	Confident	19 Å²	19	42.6 Å²	42.6	9%	0.088	22%	0.223	C	C	.	.	H	α-helix	trans	-73.4	-37.3	178.2	-59.4	-60.2	0	0	0	111.8	M185 D186 F189 T238 L239 T243 S244	M185-H241 VanDerWaalsContact CG-CD2 3.45Å; M185-H241 WeakPolarHBondContact CG-CD2 3.43Å; D186-H241 IonicContact OD1-CE1 3.9Å; D186-H241 PolarHBondContact OD1-CE1 3.38Å; D186-H241 IonicContact OD1-ND1 3.9Å; D186-H241 PolarHBondContact OD1-ND1 3.45Å; D186-H241 IonicContact OD2-CE1 2.78Å; F189-H241 HydrophobicContact CD1-CB 4.38Å; F189-H241 WeakPolarHBondContact CE1-O 3.26Å; F189-H241 HydrophobicContact CG-CB 4.4Å; T238-H241 PolarHBondContact O-N 2.61Å; T238-H241 VanDerWaalsContact O-N 3.1Å; T238-H241 PolarHBondContact OG1-CD2 3.03Å; T238-H241 PolarHBondContact OG1-NE2 3.16Å; L239-H241 VanDerWaalsContact C-N 3.29Å; L239-H241 PolarHBondContact O-N 2.83Å; H241-T243 VanDerWaalsContact C-N 3.31Å; H241-T243 PolarHBondContact O-N 2.75Å; H241-S244 WeakPolarHBondContact O-CB 3.27Å; H241-S244 PolarHBondContact O-N 3.18Å; H241-S244 PolarHBondContact O-OG 3.04Å
242	I	87.9	Confident	86.9	Confident	0 Å²	0	42.9 Å²	42.9	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-64.7	-39.7	176.2	-59.5	168.1	0	0	0	110.5	F189 V234 V237 L239 L249 L250 A273 F286	F189-I242 HydrophobicContact CZ-CG1 4.46Å; V234-I242 HydrophobicContact CG1-CD1 3.91Å; V234-I242 HydrophobicContact CG1-CG1 4.45Å; V237-I242 HydrophobicContact CG2-CD1 4.04Å; V237-I242 HydrophobicContact CG2-CG1 3.92Å; L239-I242 HydrophobicContact CD2-CD1 4.28Å; L239-I242 PolarHBondContact O-N 3.13Å; I242-L249 HydrophobicContact CG2-CD2 4.49Å; I242-L250 HydrophobicContact CG2-CD2 4.17Å; I242-A273 HydrophobicContact CG2-CB 4.33Å; I242-F286 HydrophobicContact CG2-CE1 4.23Å
243	T	85.6	Confident	87.3	Confident	25 Å²	25	41.9 Å²	41.9	15%	0.153	21%	0.211	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.4	4.4	-178	59.3	0	0	0	0	113.4	L239 V240 H241 C247 P285	L239-T243 WeakPolarHBondContact O-CB 3.49Å; L239-T243 WeakPolarHBondContact O-CG2 3.43Å; L239-T243 PolarHBondContact O-N 3.3Å; L239-T243 PolarHBondContact O-OG1 3.32Å; V240-T243 CarbonylContact O-C 3.34Å; H241-T243 VanDerWaalsContact C-N 3.31Å; H241-T243 PolarHBondContact O-N 2.75Å; T243-C247 PolarHBondContact O-N 2.98Å; T243-P285 HydrophobicContact CG2-CB 3.63Å; T243-P285 HydrophobicContact CG2-CG 3.84Å
244	S	84.1	Confident	87.4	Confident	35 Å²	35	41.9 Å²	41.9	25%	0.245	21%	0.212	C	C	.	.	H	α-helix	trans	-64	156	-179.6	70.2	0	0	0	0	112	V240 H241 N246 C247 Q248	V240-S244 WeakPolarHBondContact O-CA 3.36Å; V240-S244 WeakPolarHBondContact O-CB 2.85Å; V240-S244 PolarHBondContact O-N 2.61Å; H241-S244 WeakPolarHBondContact O-CB 3.27Å; H241-S244 PolarHBondContact O-N 3.18Å; H241-S244 PolarHBondContact O-OG 3.04Å; S244-N246 VanDerWaalsContact C-N 3.28Å; S244-N246 PolarHBondContact O-N 3.39Å; S244-C247 PolarHBondContact O-N 3.41Å; S244-Q248 PolarHBondContact O-N 3.27Å
245	R	80.1	Confident	87.4	Confident	161 Å²	161	44.9 Å²	44.9	61%	0.608	23%	0.227	S	C	*	.	H	α-helix	trans	49.3	46.3	179.8	-56.7	-178.1	-177.7	-173.1	2.9	112.8	S190 Q248	S190-R245 PolarHBondContact OG-NH2 2.89Å; R245-Q248 HydrophobicContact CB-CB 4.21Å; R245-Q248 PolarHBondContact O-N 3.02Å
246	N	78.2	Confident	87.8	Confident	137 Å²	137	40.9 Å²	40.9	73%	0.733	21%	0.206	S	C	*	.	H	α-helix	trans	57.3	44.7	-175.6	-62.9	-15.4	0	0	0	113.7	S244 Q248	S244-N246 VanDerWaalsContact C-N 3.28Å; S244-N246 PolarHBondContact O-N 3.39Å; N246-Q248 VanDerWaalsContact C-N 3.32Å; N246-Q248 PolarHBondContact O-N 3.26Å
247	C	84.4	Confident	88	Confident	2 Å²	2	39 Å²	39	1%	0.014	20%	0.199	C	C	.	.	H	α-helix	trans	60.8	33.8	179.1	-62.2	0	0	0	0	114.7	T243 S244 L249 L250 E251 P285 L288	T243-C247 PolarHBondContact O-N 2.98Å; S244-C247 PolarHBondContact O-N 3.41Å; C247-L249 PolarHBondContact O-N 3.27Å; C247-L249 VanDerWaalsContact O-N 3.08Å; C247-L250 HydrophobicContact CB-CB 4.21Å; C247-L250 HydrophobicContact CB-CD1 3.92Å; C247-L250 HydrophobicContact CB-CG 4.15Å; C247-L250 WeakPolarHBondContact O-CB 3.21Å; C247-L250 PolarHBondContact O-N 2.97Å; C247-E251 PolarHBondContact O-N 3.39Å; C247-E251 VanDerWaalsContact O-N 3.17Å; C247-P285 VanDerWaalsContact SG-CB 3.51Å; C247-L288 HydrophobicContact CB-CD1 3.99Å
248	Q	87.2	Confident	88	Confident	72 Å²	72	41.4 Å²	41.4	34%	0.336	22%	0.216	S	C	.	.	H	α-helix	trans	-50.1	-37.5	179.6	-174.7	-178.9	12.7	0	0	113.3	S244 R245 N246 E251 M252	S244-Q248 PolarHBondContact O-N 3.27Å; R245-Q248 HydrophobicContact CB-CB 4.21Å; R245-Q248 PolarHBondContact O-N 3.02Å; N246-Q248 VanDerWaalsContact C-N 3.32Å; N246-Q248 PolarHBondContact O-N 3.26Å; Q248-E251 PolarHBondContact O-N 3.03Å; Q248-M252 WeakPolarHBondContact O-CB 3.48Å; Q248-M252 PolarHBondContact O-N 3.22Å
249	L	90.4	Very high	88.1	Confident	2 Å²	2	39.4 Å²	39.4	1%	0.01	20%	0.201	C	C	.	.	H	α-helix	trans	-59	-49	175	171.6	60	0	0	0	111.3	F189 L193 L230 V234 I242 C247 E251 M252 L253	F189-L249 HydrophobicContact CE1-CD2 3.86Å; F189-L249 HydrophobicContact CZ-CD2 3.48Å; F189-L249 VanDerWaalsContact CZ-CD2 3.48Å; L193-L249 HydrophobicContact CD2-CB 3.96Å; L193-L249 HydrophobicContact CD2-CD1 3.65Å; L193-L249 HydrophobicContact CD2-CG 4.31Å; L230-L249 HydrophobicContact CD1-CD1 4.27Å; V234-L249 HydrophobicContact CG2-CD2 4.04Å; I242-L249 HydrophobicContact CG2-CD2 4.49Å; C247-L249 PolarHBondContact O-N 3.27Å; C247-L249 VanDerWaalsContact O-N 3.08Å; L249-E251 VanDerWaalsContact C-N 3.33Å; L249-E251 PolarHBondContact O-N 3.5Å; L249-M252 HydrophobicContact CD1-CE 4.45Å; L249-M252 PolarHBondContact O-N 2.96Å; L249-L253 HydrophobicContact CD1-CD1 3.86Å; L249-L253 HydrophobicContact CD1-CD2 4.25Å; L249-L253 HydrophobicContact CD1-CG 3.82Å; L249-L253 HydrophobicContact CG-CD1 3.92Å; L249-L253 HydrophobicContact CG-CG 4.29Å; L249-L253 VanDerWaalsContact O-CG 3.26Å; L249-L253 WeakPolarHBondContact O-CG 3.48Å; L249-L253 PolarHBondContact O-N 3.4Å
250	L	91	Very high	88.1	Confident	3 Å²	3	42 Å²	42	2%	0.016	22%	0.218	C	C	.	.	H	α-helix	trans	-64.4	-40.1	-176.9	-57.7	-176.5	0	0	0	111.3	I242 C247 L253 C254 L270 A273 F286 L289	I242-L250 HydrophobicContact CG2-CD2 4.17Å; C247-L250 HydrophobicContact CB-CB 4.21Å; C247-L250 HydrophobicContact CB-CD1 3.92Å; C247-L250 HydrophobicContact CB-CG 4.15Å; C247-L250 WeakPolarHBondContact O-CB 3.21Å; C247-L250 PolarHBondContact O-N 2.97Å; L250-L253 PolarHBondContact O-N 3.14Å; L250-C254 PolarHBondContact O-N 3.15Å; L250-C254 PolarHBondContact O-SG 3.37Å; L250-L270 HydrophobicContact CD2-CD1 3.92Å; L250-A273 HydrophobicContact CD2-CB 4.27Å; L250-F286 HydrophobicContact CD1-CD1 3.69Å; L250-F286 HydrophobicContact CD1-CE1 4.03Å; L250-L289 HydrophobicContact CB-CD2 4.09Å; L250-L289 HydrophobicContact CD1-CD1 4.43Å; L250-L289 HydrophobicContact CD1-CG 4.46Å
251	E	89.8	Confident	88.2	Confident	111 Å²	111	42.3 Å²	42.3	52%	0.519	21%	0.214	S	C	.	.	H	α-helix	trans	-61.3	-46.3	174.2	-67.7	-176.4	166	0	0	111.6	C247 Q248 L249 L253 C254 L255	C247-E251 PolarHBondContact O-N 3.39Å; C247-E251 VanDerWaalsContact O-N 3.17Å; Q248-E251 PolarHBondContact O-N 3.03Å; L249-E251 VanDerWaalsContact C-N 3.33Å; L249-E251 PolarHBondContact O-N 3.5Å; E251-L253 PolarHBondContact O-N 3.5Å; E251-C254 PolarHBondContact O-N 3.28Å; E251-L255 WeakPolarHBondContact O-CG 3.49Å; E251-L255 PolarHBondContact O-N 3.48Å
252	M	90.5	Very high	88.4	Confident	20 Å²	20	41.4 Å²	41.4	10%	0.099	21%	0.21	C	C	.	.	H	α-helix	trans	-63.2	-41.7	177.4	-172.6	170.8	57.7	0	0	111.9	L193 L196 H197 Q248 L249 C254 L255 L256	L193-M252 HydrophobicContact CD2-CE 3.57Å; L196-M252 HydrophobicContact CB-CE 4.13Å; L196-M252 HydrophobicContact CD2-CE 3.34Å; L196-M252 HydrophobicContact CD2-SD 4.2Å; L196-M252 HydrophobicContact CG-CE 3.78Å; L196-M252 HydrophobicContact CG-SD 4.07Å; H197-M252 HydrophobicContact CB-SD 4.36Å; Q248-M252 WeakPolarHBondContact O-CB 3.48Å; Q248-M252 PolarHBondContact O-N 3.22Å; L249-M252 HydrophobicContact CD1-CE 4.45Å; L249-M252 PolarHBondContact O-N 2.96Å; M252-C254 VanDerWaalsContact C-N 3.34Å; M252-C254 PolarHBondContact O-N 3Å; M252-L255 WeakPolarHBondContact O-CB 3.27Å; M252-L255 PolarHBondContact O-N 3.31Å; M252-L256 HydrophobicContact CG-CD1 4.31Å; M252-L256 VanDerWaalsContact O-CG 3.27Å; M252-L256 WeakPolarHBondContact O-CG 3.35Å; M252-L256 PolarHBondContact O-N 3.36Å
253	L	93.3	Very high	88.6	Confident	0 Å²	0	42.1 Å²	42.1	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-61.6	-42	175	-68.2	174.4	0	0	0	111.5	L227 L249 L250 E251 L255 L256 L257 A266 C269 L270	L227-L253 HydrophobicContact CD2-CD2 3.63Å; L249-L253 HydrophobicContact CD1-CD1 3.86Å; L249-L253 HydrophobicContact CD1-CD2 4.25Å; L249-L253 HydrophobicContact CD1-CG 3.82Å; L249-L253 HydrophobicContact CG-CD1 3.92Å; L249-L253 HydrophobicContact CG-CG 4.29Å; L249-L253 VanDerWaalsContact O-CG 3.26Å; L249-L253 WeakPolarHBondContact O-CG 3.48Å; L249-L253 PolarHBondContact O-N 3.4Å; L250-L253 PolarHBondContact O-N 3.14Å; E251-L253 PolarHBondContact O-N 3.5Å; L253-L255 PolarHBondContact O-N 2.89Å; L253-L256 PolarHBondContact O-N 3.22Å; L253-L257 WeakPolarHBondContact O-CG 3.28Å; L253-L257 PolarHBondContact O-N 2.94Å; L253-A266 HydrophobicContact CD2-CB 4.12Å; L253-C269 HydrophobicContact CD1-CB 4.11Å; L253-C269 HydrophobicContact CD2-CB 3.96Å; L253-L270 HydrophobicContact CD1-CB 4.28Å
254	C	92.1	Very high	88.7	Confident	1 Å²	1	41.9 Å²	41.9	1%	0.007	21%	0.211	C	C	.	.	H	α-helix	trans	-62	-42.9	175.7	-67.1	0	0	0	0	111.8	L250 E251 M252 L256 L257 L289 Y297	L250-C254 PolarHBondContact O-N 3.15Å; L250-C254 PolarHBondContact O-SG 3.37Å; E251-C254 PolarHBondContact O-N 3.28Å; M252-C254 VanDerWaalsContact C-N 3.34Å; M252-C254 PolarHBondContact O-N 3Å; C254-L256 VanDerWaalsContact C-N 3.26Å; C254-L256 PolarHBondContact O-N 3.48Å; C254-L257 WeakPolarHBondContact O-CB 3.32Å; C254-L257 PolarHBondContact O-N 2.72Å; C254-L289 VanDerWaalsContact SG-CD2 3.5Å; C254-Y297 WeakPolarHBondContact O-CB 3.29Å
255	L	90.9	Very high	89	Confident	62 Å²	62	41 Å²	41	33%	0.325	20%	0.203	S	C	.	.	H	α-helix	trans	-60	-37	175.1	-73.8	165	0	0	0	112.3	E251 M252 L253 L257 S258 Y297	E251-L255 WeakPolarHBondContact O-CG 3.49Å; E251-L255 PolarHBondContact O-N 3.48Å; M252-L255 WeakPolarHBondContact O-CB 3.27Å; M252-L255 PolarHBondContact O-N 3.31Å; L253-L255 PolarHBondContact O-N 2.89Å; L255-L257 VanDerWaalsContact C-N 3.28Å; L255-L257 PolarHBondContact O-N 3.18Å; L255-S258 PolarHBondContact O-N 2.98Å; L255-Y297 HydrophobicContact CD2-CD2 4.2Å; L255-Y297 HydrophobicContact CD2-CE1 4.08Å; L255-Y297 HydrophobicContact CD2-CE2 3.35Å; L255-Y297 WeakPolarHBondContact CD2-OH 3.47Å; L255-Y297 HydrophobicContact CG-CE2 4.1Å
256	L	93.3	Very high	89.7	Confident	1 Å²	1	33.3 Å²	33.3	1%	0.005	17%	0.174	C	C	.	.	H	α-helix	trans	-73.7	-16.4	179.8	-70.2	174.1	0	0	0	113.5	L196 V200 L227 M252 L253 C254 S258 E259 L262 A266	L196-L256 HydrophobicContact CD1-CD1 4.38Å; L196-L256 HydrophobicContact CD2-CD1 4.33Å; V200-L256 HydrophobicContact CB-CD2 4.42Å; V200-L256 HydrophobicContact CG1-CD2 3.68Å; V200-L256 HydrophobicContact CG2-CD1 4.46Å; V200-L256 HydrophobicContact CG2-CD2 3.79Å; L227-L256 HydrophobicContact CD1-CD1 4.3Å; L227-L256 HydrophobicContact CD2-CD1 4.07Å; M252-L256 HydrophobicContact CG-CD1 4.31Å; M252-L256 VanDerWaalsContact O-CG 3.27Å; M252-L256 WeakPolarHBondContact O-CG 3.35Å; M252-L256 PolarHBondContact O-N 3.36Å; L253-L256 PolarHBondContact O-N 3.22Å; C254-L256 VanDerWaalsContact C-N 3.26Å; C254-L256 PolarHBondContact O-N 3.48Å; L256-S258 PolarHBondContact O-N 3.37Å; L256-S258 VanDerWaalsContact O-N 3.16Å; L256-E259 HydrophobicContact CD2-CG 4.42Å; L256-E259 PolarHBondContact O-N 3Å; L256-L262 HydrophobicContact CD2-CB 4.43Å; L256-L262 HydrophobicContact CD2-CD1 3.79Å; L256-A266 HydrophobicContact CB-CB 3.69Å; L256-A266 HydrophobicContact CD1-CB 4.5Å
257	L	91.3	Very high	90.3	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	14%	0.139	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.1	-19.3	171.9	-59.6	177.9	0	0	0	112.7	L253 C254 L255 Q263 A266 I298 A301 F329 L333	L253-L257 WeakPolarHBondContact O-CG 3.28Å; L253-L257 PolarHBondContact O-N 2.94Å; C254-L257 WeakPolarHBondContact O-CB 3.32Å; C254-L257 PolarHBondContact O-N 2.72Å; L255-L257 VanDerWaalsContact C-N 3.28Å; L255-L257 PolarHBondContact O-N 3.18Å; L257-Q263 PolarHBondContact O-OE1 3.49Å; L257-A266 HydrophobicContact CD2-CB 4.48Å; L257-I298 HydrophobicContact CD1-CG1 3.76Å; L257-A301 HydrophobicContact CB-CB 3.89Å; L257-F329 HydrophobicContact CD2-CE2 4.04Å; L257-F329 HydrophobicContact CD2-CZ 4.4Å; L257-L333 HydrophobicContact CD1-CD1 4.12Å
258	S	88.7	Confident	90.5	Very high	53 Å²	53	29.9 Å²	29.9	37%	0.371	15%	0.153	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.8	-4.6	175.8	-57.5	0	0	0	0	113.6	L255 L256 P260 Y297	L255-S258 PolarHBondContact O-N 2.98Å; L256-S258 PolarHBondContact O-N 3.37Å; L256-S258 VanDerWaalsContact O-N 3.16Å; S258-P260 WeakPolarHBondContact O-CD 3.36Å; S258-Y297 WeakPolarHBondContact OG-CD1 3.36Å
259	E	90.1	Very high	90.6	Very high	28 Å²	28	26.4 Å²	26.4	13%	0.131	14%	0.137	C	C	.	.			trans	-102.3	108.7	180	-68	-64.5	169	0	0	110.8	R204 K207 L256 E261 L262 Q263	R204-E259 IonicContact CZ-OE1 3.93Å; R204-E259 IonicContact NE-OE1 3.7Å; R204-E259 PolarHBondContact NE-OE1 3.27Å; R204-E259 IonicContact NH2-OE1 2.96Å; R204-E259 PolarHBondContact NH2-OE1 3.48Å; K207-E259 IonicContact NZ-OE2 3.88Å; K207-E259 PolarHBondContact NZ-OE2 3.1Å; L256-E259 HydrophobicContact CD2-CG 4.42Å; L256-E259 PolarHBondContact O-N 3Å; E259-E261 PolarHBondContact O-N 3.48Å; E259-L262 HydrophobicContact CB-CB 4.26Å; E259-L262 PolarHBondContact O-N 3.05Å; E259-Q263 WeakPolarHBondContact O-CB 3.49Å; E259-Q263 PolarHBondContact O-N 2.89Å
260	P	86.8	Confident	90.7	Very high	58 Å²	58	26.3 Å²	26.3	38%	0.377	14%	0.137	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.4	-31.4	-170.9	-28.6	35.5	0	0	0	115.8	S258	S258-P260 WeakPolarHBondContact O-CD 3.36Å
261	E	88.8	Confident	90.7	Very high	99 Å²	99	27.6 Å²	27.6	46%	0.463	14%	0.143	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.9	-23.4	-179.9	-63.2	-59.5	147.8	0	0	113	Y203 C220 E259 R325	Y203-E261 WeakPolarHBondContact OH-CG 3.48Å; C220-E261 VanDerWaalsContact SG-CB 3.53Å; E259-E261 PolarHBondContact O-N 3.48Å; E261-R325 PolarHBondContact O-NH2 2.93Å; E261-R325 VanDerWaalsContact O-NH2 3.09Å
262	L	92.4	Very high	90.6	Very high	0 Å²	0	24.6 Å²	24.6	0%	0	13%	0.13	C	C	.	.	T	Hydrogen-bonded Turn	trans	-116.9	-12.8	-171.6	-59.2	176.9	0	0	0	114	V200 A223 V224 L227 L256 E259 L264 E265 A266	V200-L262 HydrophobicContact CG2-CD1 4.01Å; A223-L262 HydrophobicContact CB-CD1 4.08Å; A223-L262 HydrophobicContact CB-CD2 3.83Å; V224-L262 HydrophobicContact CG2-CD2 3.58Å; L227-L262 HydrophobicContact CD1-CB 4.25Å; L227-L262 HydrophobicContact CD1-CD2 4.33Å; L256-L262 HydrophobicContact CD2-CB 4.43Å; L256-L262 HydrophobicContact CD2-CD1 3.79Å; E259-L262 HydrophobicContact CB-CB 4.26Å; E259-L262 PolarHBondContact O-N 3.05Å; L262-L264 VanDerWaalsContact C-N 3.27Å; L262-L264 PolarHBondContact O-N 3.28Å; L262-E265 PolarHBondContact O-N 3.22Å; L262-A266 WeakPolarHBondContact O-CB 3.38Å; L262-A266 PolarHBondContact O-N 3.12Å
263	Q	92.3	Very high	90.6	Very high	15 Å²	15	23.6 Å²	23.6	7%	0.07	13%	0.125	C	C	.	.	H	α-helix	trans	-60.7	-33.1	-172.7	65	-176.6	2.7	0	0	113.3	L257 E259 S267 F329	L257-Q263 PolarHBondContact O-OE1 3.49Å; E259-Q263 WeakPolarHBondContact O-CB 3.49Å; E259-Q263 PolarHBondContact O-N 2.89Å; Q263-S267 VanDerWaalsContact O-CB 3.28Å; Q263-S267 WeakPolarHBondContact O-CB 3.19Å; Q263-S267 PolarHBondContact O-N 3.39Å; Q263-S267 PolarHBondContact O-OG 3.38Å; Q263-F329 HydrophobicContact CB-CD2 3.97Å; Q263-F329 HydrophobicContact CB-CE1 4.44Å; Q263-F329 HydrophobicContact CB-CE2 3.57Å; Q263-F329 HydrophobicContact CB-CZ 3.82Å; Q263-F329 HydrophobicContact CG-CD1 4.12Å; Q263-F329 HydrophobicContact CG-CD2 3.7Å; Q263-F329 HydrophobicContact CG-CE1 4.21Å; Q263-F329 HydrophobicContact CG-CE2 3.8Å; Q263-F329 HydrophobicContact CG-CG 3.85Å; Q263-F329 HydrophobicContact CG-CZ 4.04Å; Q263-F329 WeakPolarHBondContact O-CD2 3.39Å; Q263-F329 VanDerWaalsContact O-CE2 3.28Å; Q263-F329 WeakPolarHBondContact O-CE2 3.25Å
264	L	86.9	Confident	90.4	Very high	20 Å²	20	23.7 Å²	23.7	11%	0.105	13%	0.126	C	C	.	.	H	α-helix	trans	-67.8	-55.7	-178.7	176.3	61.2	0	0	0	110.3	L262 A266 S267 E268 V328 F329 R332	L262-L264 VanDerWaalsContact C-N 3.27Å; L262-L264 PolarHBondContact O-N 3.28Å; L264-A266 VanDerWaalsContact C-N 3.27Å; L264-A266 PolarHBondContact O-N 2.82Å; L264-S267 PolarHBondContact O-N 2.88Å; L264-S267 VanDerWaalsContact O-N 3.07Å; L264-S267 PolarHBondContact O-OG 2.93Å; L264-E268 PolarHBondContact O-N 2.83Å; L264-V328 HydrophobicContact CD1-CG1 3.92Å; L264-V328 HydrophobicContact CD2-CG1 4.49Å; L264-F329 HydrophobicContact CD1-CB 4.4Å; L264-R332 HydrophobicContact CD1-CG 3.88Å
265	E	91.5	Very high	90.2	Very high	16 Å²	16	26.8 Å²	26.8	8%	0.075	15%	0.147	C	C	.	.	H	α-helix	trans	-63.8	-35.6	-179	-61.8	80.8	-179.9	0	0	111	V224 L227 L262 C269 R325	V224-E265 HydrophobicContact CG1-CG 4.18Å; L227-E265 HydrophobicContact CB-CB 3.81Å; L227-E265 HydrophobicContact CD1-CB 3.87Å; L227-E265 HydrophobicContact CG-CB 4.47Å; L262-E265 PolarHBondContact O-N 3.22Å; E265-C269 WeakPolarHBondContact O-CB 3.36Å; E265-C269 PolarHBondContact O-N 3.24Å; E265-C269 VanDerWaalsContact O-N 3.1Å; E265-R325 IonicContact OE1-CZ 3.35Å; E265-R325 IonicContact OE1-NH1 2.66Å; E265-R325 IonicContact OE1-NH2 3.7Å; E265-R325 PolarHBondContact OE1-NH2 3.38Å; E265-R325 IonicContact OE2-NH2 2.68Å; E265-R325 PolarHBondContact OE2-NH2 3.09Å
266	A	93.2	Very high	89.9	Confident	0 Å²	0	26.3 Å²	26.3	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-64.7	-43.2	172.3	0	0	0	0	0	112.4	L227 L253 L256 L257 L262 L264 C269 L270	L227-A266 HydrophobicContact CD1-CB 4.46Å; L253-A266 HydrophobicContact CD2-CB 4.12Å; L256-A266 HydrophobicContact CB-CB 3.69Å; L256-A266 HydrophobicContact CD1-CB 4.5Å; L257-A266 HydrophobicContact CD2-CB 4.48Å; L262-A266 WeakPolarHBondContact O-CB 3.38Å; L262-A266 PolarHBondContact O-N 3.12Å; L264-A266 VanDerWaalsContact C-N 3.27Å; L264-A266 PolarHBondContact O-N 2.82Å; A266-C269 PolarHBondContact O-N 3.34Å; A266-L270 WeakPolarHBondContact O-CB 3.1Å; A266-L270 PolarHBondContact O-N 3.12Å
267	S	91.4	Very high	89.1	Confident	0 Å²	0	34.4 Å²	34.4	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-66.2	-36.1	177.6	73.3	0	0	0	0	112.8	Q263 L264 L270 L271 R332 V336	Q263-S267 VanDerWaalsContact O-CB 3.28Å; Q263-S267 WeakPolarHBondContact O-CB 3.19Å; Q263-S267 PolarHBondContact O-N 3.39Å; Q263-S267 PolarHBondContact O-OG 3.38Å; L264-S267 PolarHBondContact O-N 2.88Å; L264-S267 VanDerWaalsContact O-N 3.07Å; L264-S267 PolarHBondContact O-OG 2.93Å; S267-L270 PolarHBondContact O-N 3.47Å; S267-L271 VanDerWaalsContact O-CB 3.31Å; S267-L271 WeakPolarHBondContact O-CB 3.36Å; S267-L271 PolarHBondContact O-N 2.74Å; S267-R332 WeakPolarHBondContact OG-CB 3.46Å; S267-V336 WeakPolarHBondContact O-CG2 3.43Å
268	E	88.4	Confident	88.5	Confident	66 Å²	66	36.1 Å²	36.1	31%	0.308	19%	0.194	S	C	.	.	H	α-helix	trans	-65.3	-46.6	175.1	-72.9	-176.9	174	0	0	111.3	L264 L270 L271 I272 R332	L264-E268 PolarHBondContact O-N 2.83Å; E268-L270 VanDerWaalsContact C-N 3.31Å; E268-L270 PolarHBondContact O-N 3.4Å; E268-L271 PolarHBondContact O-N 2.95Å; E268-I272 VanDerWaalsContact O-CG1 3.26Å; E268-I272 WeakPolarHBondContact O-CG1 3.22Å; E268-I272 PolarHBondContact O-N 2.94Å; E268-R332 HydrophobicContact CG-CG 4.22Å
269	C	89.6	Confident	88.3	Confident	0 Å²	0	40.5 Å²	40.5	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-60.4	-41.7	176.3	-168.3	0	0	0	0	111.7	A231 L253 E265 A266 I272 A273	A231-C269 HydrophobicContact CB-CB 4.43Å; L253-C269 HydrophobicContact CD1-CB 4.11Å; L253-C269 HydrophobicContact CD2-CB 3.96Å; E265-C269 WeakPolarHBondContact O-CB 3.36Å; E265-C269 PolarHBondContact O-N 3.24Å; E265-C269 VanDerWaalsContact O-N 3.1Å; A266-C269 PolarHBondContact O-N 3.34Å; C269-I272 PolarHBondContact O-N 3.08Å; C269-A273 WeakPolarHBondContact O-CB 3.36Å; C269-A273 PolarHBondContact O-N 3.44Å
270	L	92.6	Very high	88.1	Confident	0 Å²	0	42.1 Å²	42.1	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-65.4	-41.3	176.1	-173.8	59.9	0	0	0	112.2	L250 L253 A266 S267 E268 A273 L274 L289 V336	L250-L270 HydrophobicContact CD2-CD1 3.92Å; L253-L270 HydrophobicContact CD1-CB 4.28Å; A266-L270 WeakPolarHBondContact O-CB 3.1Å; A266-L270 PolarHBondContact O-N 3.12Å; S267-L270 PolarHBondContact O-N 3.47Å; E268-L270 VanDerWaalsContact C-N 3.31Å; E268-L270 PolarHBondContact O-N 3.4Å; L270-A273 PolarHBondContact O-N 2.84Å; L270-L274 HydrophobicContact CD1-CD1 4.3Å; L270-L274 HydrophobicContact CG-CD1 4.14Å; L270-L274 WeakPolarHBondContact O-CB 3.24Å; L270-L274 WeakPolarHBondContact O-CG 3.35Å; L270-L274 PolarHBondContact O-N 3.24Å; L270-L289 HydrophobicContact CD1-CD1 4.07Å; L270-L289 HydrophobicContact CD1-CD2 4.44Å; L270-V336 HydrophobicContact CB-CG2 4.36Å; L270-V336 HydrophobicContact CD2-CG1 3.64Å; L270-V336 HydrophobicContact CD2-CG2 4.5Å; L270-V336 HydrophobicContact CG-CG1 3.94Å; L270-V336 HydrophobicContact CG-CG2 4.39Å
271	L	91.2	Very high	88.1	Confident	30 Å²	30	44.5 Å²	44.5	16%	0.157	22%	0.222	C	C	.	.	H	α-helix	trans	-62	-46	176.5	177.1	57.8	0	0	0	111.5	S267 E268 L274 S275 Q335 V336 A339	S267-L271 VanDerWaalsContact O-CB 3.31Å; S267-L271 WeakPolarHBondContact O-CB 3.36Å; S267-L271 PolarHBondContact O-N 2.74Å; E268-L271 PolarHBondContact O-N 2.95Å; L271-L274 PolarHBondContact O-N 3.28Å; L271-S275 VanDerWaalsContact O-CB 3.27Å; L271-S275 WeakPolarHBondContact O-CB 3.24Å; L271-S275 PolarHBondContact O-N 3.36Å; L271-S275 PolarHBondContact O-OG 3.47Å; L271-Q335 HydrophobicContact CD1-CB 3.87Å; L271-Q335 HydrophobicContact CD2-CB 3.82Å; L271-V336 HydrophobicContact CB-CG2 3.75Å; L271-A339 HydrophobicContact CD1-CB 3.97Å
272	I	88.1	Confident	87.9	Confident	47 Å²	47	43.2 Å²	43.2	24%	0.241	22%	0.216	C	C	.	.	H	α-helix	trans	-61.2	-47.3	177.9	-66	162.9	0	0	0	109.5	A231 V234 D235 E268 C269 L274 S275 R276	A231-I272 HydrophobicContact CB-CD1 3.76Å; V234-I272 HydrophobicContact CB-CG2 4.49Å; V234-I272 HydrophobicContact CG1-CG2 4.07Å; D235-I272 HydrophobicContact CB-CG2 3.78Å; E268-I272 VanDerWaalsContact O-CG1 3.26Å; E268-I272 WeakPolarHBondContact O-CG1 3.22Å; E268-I272 PolarHBondContact O-N 2.94Å; C269-I272 PolarHBondContact O-N 3.08Å; I272-L274 VanDerWaalsContact C-N 3.34Å; I272-L274 PolarHBondContact O-N 3.46Å; I272-S275 PolarHBondContact O-N 3.16Å; I272-R276 WeakPolarHBondContact O-CG 3.46Å; I272-R276 PolarHBondContact O-N 3.47Å
273	A	89.6	Confident	87.8	Confident	0 Å²	0	44.7 Å²	44.7	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-55.5	-47.8	177.5	0	0	0	0	0	112.1	V234 I242 L250 C269 L270 S275 R276 F286	V234-A273 HydrophobicContact CG1-CB 3.64Å; I242-A273 HydrophobicContact CG2-CB 4.33Å; L250-A273 HydrophobicContact CD2-CB 4.27Å; C269-A273 WeakPolarHBondContact O-CB 3.36Å; C269-A273 PolarHBondContact O-N 3.44Å; L270-A273 PolarHBondContact O-N 2.84Å; A273-S275 VanDerWaalsContact C-N 3.33Å; A273-S275 PolarHBondContact O-N 2.93Å; A273-R276 VanDerWaalsContact O-CB 3.32Å; A273-R276 WeakPolarHBondContact O-CB 3.49Å; A273-R276 WeakPolarHBondContact O-CG 3.45Å; A273-R276 PolarHBondContact O-N 3.39Å; A273-F286 WeakPolarHBondContact O-CZ 3.49Å
274	L	89.6	Confident	87.7	Confident	2 Å²	2	45.6 Å²	45.6	1%	0.01	23%	0.225	C	C	.	.	H	α-helix	trans	-72.8	-23.9	-179.3	-71.8	171.4	0	0	0	113.7	L270 L271 I272 R276 F286 L289 V336 A339 L340 Q343	L270-L274 HydrophobicContact CD1-CD1 4.3Å; L270-L274 HydrophobicContact CG-CD1 4.14Å; L270-L274 WeakPolarHBondContact O-CB 3.24Å; L270-L274 WeakPolarHBondContact O-CG 3.35Å; L270-L274 PolarHBondContact O-N 3.24Å; L271-L274 PolarHBondContact O-N 3.28Å; I272-L274 VanDerWaalsContact C-N 3.34Å; I272-L274 PolarHBondContact O-N 3.46Å; L274-R276 PolarHBondContact O-N 3.02Å; L274-F286 HydrophobicContact CD2-CB 4.17Å; L274-F286 HydrophobicContact CD2-CD1 4.18Å; L274-F286 HydrophobicContact CD2-CD2 4.42Å; L274-F286 HydrophobicContact CD2-CG 4.04Å; L274-L289 HydrophobicContact CD1-CD1 4.17Å; L274-L289 HydrophobicContact CD2-CD1 3.77Å; L274-L289 HydrophobicContact CG-CD1 4.31Å; L274-V336 HydrophobicContact CD1-CG1 3.88Å; L274-A339 HydrophobicContact CB-CB 3.87Å; L274-L340 HydrophobicContact CD1-CB 4.13Å; L274-L340 HydrophobicContact CD2-CD1 3.98Å; L274-Q343 HydrophobicContact CD2-CG 4.44Å; L274-Q343 PolarHBondContact O-NE2 2.72Å
275	S	88.1	Confident	87.8	Confident	65 Å²	65	46.6 Å²	46.6	46%	0.455	23%	0.232	S	C	.	.	H	α-helix	trans	-81.7	-6	177.2	-58.7	0	0	0	0	112.6	L271 I272 A273 K277	L271-S275 VanDerWaalsContact O-CB 3.27Å; L271-S275 WeakPolarHBondContact O-CB 3.24Å; L271-S275 PolarHBondContact O-N 3.36Å; L271-S275 PolarHBondContact O-OG 3.47Å; I272-S275 PolarHBondContact O-N 3.16Å; A273-S275 VanDerWaalsContact C-N 3.33Å; A273-S275 PolarHBondContact O-N 2.93Å; S275-K277 PolarHBondContact O-N 3.19Å
276	R	85.1	Confident	87.8	Confident	53 Å²	53	45.8 Å²	45.8	20%	0.2	23%	0.229	C	C	.	.			trans	-60.6	127.6	179.2	-70.3	-71.8	-76.7	147	-2.8	111.5	V234 D235 W236 V237 L239 I272 A273 L274	V234-R276 WeakPolarHBondContact O-CD 3.33Å; V234-R276 PolarHBondContact O-NE 2.82Å; D235-R276 WeakPolarHBondContact O-CD 3.35Å; D235-R276 PolarHBondContact O-NE 3.39Å; D235-R276 PolarHBondContact O-NH1 2.88Å; W236-R276 PolarHBondContact O-NH2 3.35Å; V237-R276 PolarHBondContact O-NH2 2.7Å; L239-R276 HydrophobicContact CD2-CB 4.25Å; I272-R276 WeakPolarHBondContact O-CG 3.46Å; I272-R276 PolarHBondContact O-N 3.47Å; A273-R276 VanDerWaalsContact O-CB 3.32Å; A273-R276 WeakPolarHBondContact O-CB 3.49Å; A273-R276 WeakPolarHBondContact O-CG 3.45Å; A273-R276 PolarHBondContact O-N 3.39Å; L274-R276 PolarHBondContact O-N 3.02Å
277	K	75.8	Confident	87.7	Confident	170 Å²	170	47.1 Å²	47.1	74%	0.739	24%	0.235	S	C	*	.			trans	-91.1	140	168.5	-58.9	-177.3	-177.3	179.8	0	108.7	S275	S275-K277 PolarHBondContact O-N 3.19Å
278	G	79.1	Confident	87.5	Confident	36 Å²	36	50.1 Å²	50.1	37%	0.371	25%	0.251	S	S	.	.			trans	-177.3	-169.5	-174.3	0	0	0	0	0	112.6	R283	G278-R283 PolarHBondContact O-NE 3.31Å; G278-R283 PolarHBondContact O-NH2 2.97Å
279	K	84.8	Confident	87.6	Confident	145 Å²	145	47.2 Å²	47.2	63%	0.63	24%	0.237	S	C	*	.			trans	-67.6	142.6	171.6	-65.9	178.5	-174	166.7	0	109.9	E281 E282 R283	K279-E281 VanDerWaalsContact C-N 3.27Å; K279-E281 PolarHBondContact O-N 2.87Å; K279-E282 HydrophobicContact CB-CG 4.42Å; K279-E282 PolarHBondContact O-N 3.38Å; K279-R283 WeakPolarHBondContact O-CG 3.43Å
280	L	85.8	Confident	87.7	Confident	62 Å²	62	47.2 Å²	47.2	33%	0.325	24%	0.238	S	C	.	.	H	α-helix	trans	-60	-39	-179.3	-65.3	175	0	0	0	112	E282 R283 K284 L347	L280-E282 VanDerWaalsContact C-N 3.29Å; L280-E282 PolarHBondContact O-N 3.1Å; L280-R283 PolarHBondContact O-N 3.17Å; L280-K284 PolarHBondContact O-N 3.46Å; L280-L347 HydrophobicContact CB-CD2 4.15Å; L280-L347 HydrophobicContact CD2-CD2 4.25Å; L280-L347 WeakPolarHBondContact O-CD2 3.25Å
281	E	85	Confident	87.5	Confident	109 Å²	109	50.8 Å²	50.8	51%	0.509	26%	0.257	S	S	.	.	H	α-helix	trans	-53	-41.8	176.9	-63.4	-57.1	134	0	0	113.8	K279 R283 K284	K279-E281 VanDerWaalsContact C-N 3.27Å; K279-E281 PolarHBondContact O-N 2.87Å; E281-R283 PolarHBondContact O-N 3.47Å; E281-K284 WeakPolarHBondContact O-CG 3.48Å; E281-K284 IonicContact OE1-NZ 2.6Å; E281-K284 PolarHBondContact OE1-NZ 2.7Å; E281-K284 WeakPolarHBondContact OE2-CE 3.48Å; E281-K284 IonicContact OE2-NZ 3.76Å; E281-K284 PolarHBondContact OE2-NZ 3.47Å
282	E	86.1	Confident	87.1	Confident	71 Å²	71	53.7 Å²	53.7	33%	0.332	27%	0.272	S	S	.	.	H	α-helix	trans	-76.4	-13.1	-178.3	-66	172	-160.2	0	0	112.7	L239 K279 L280 P285	L239-E282 HydrophobicContact CB-CB 3.99Å; L239-E282 HydrophobicContact CD1-CB 3.76Å; K279-E282 HydrophobicContact CB-CG 4.42Å; K279-E282 PolarHBondContact O-N 3.38Å; L280-E282 VanDerWaalsContact C-N 3.29Å; L280-E282 PolarHBondContact O-N 3.1Å; E282-P285 WeakPolarHBondContact O-CD 3.45Å
283	R	89.5	Confident	86.9	Confident	31 Å²	31	56.3 Å²	56.3	12%	0.117	29%	0.29	C	S	.	.	H	α-helix	trans	-96.8	-11.5	-178.6	-58.4	-173.5	-144.4	177.4	4	113.4	L239 G278 K279 L280 E281 P285 F286 L347	L239-R283 HydrophobicContact CD1-CG 3.99Å; G278-R283 PolarHBondContact O-NE 3.31Å; G278-R283 PolarHBondContact O-NH2 2.97Å; K279-R283 WeakPolarHBondContact O-CG 3.43Å; L280-R283 PolarHBondContact O-N 3.17Å; E281-R283 PolarHBondContact O-N 3.47Å; R283-P285 VanDerWaalsContact C-N 3.26Å; R283-F286 HydrophobicContact CB-CD2 3.88Å; R283-F286 HydrophobicContact CB-CE2 4.13Å; R283-F286 HydrophobicContact CG-CD2 4.39Å; R283-F286 HydrophobicContact CG-CE2 4.16Å; R283-F286 WeakPolarHBondContact O-CB 3.29Å; R283-F286 WeakPolarHBondContact O-CD2 3.43Å; R283-F286 PolarHBondContact O-N 2.91Å; R283-L347 HydrophobicContact CB-CD1 4.38Å; R283-L347 HydrophobicContact CB-CD2 4.3Å
284	K	89.6	Confident	86.7	Confident	35 Å²	35	56.7 Å²	56.7	15%	0.152	29%	0.294	C	S	.	.	G	3₁₀ helix	trans	-47.2	-41.3	176.1	-67.4	178.4	169.2	172	0	113.4	L280 E281 F286 M287 E353 V354	L280-K284 PolarHBondContact O-N 3.46Å; E281-K284 WeakPolarHBondContact O-CG 3.48Å; E281-K284 IonicContact OE1-NZ 2.6Å; E281-K284 PolarHBondContact OE1-NZ 2.7Å; E281-K284 WeakPolarHBondContact OE2-CE 3.48Å; E281-K284 IonicContact OE2-NZ 3.76Å; E281-K284 PolarHBondContact OE2-NZ 3.47Å; K284-F286 PolarHBondContact O-N 3.15Å; K284-F286 VanDerWaalsContact O-N 3.1Å; K284-M287 WeakPolarHBondContact O-CB 3.45Å; K284-M287 WeakPolarHBondContact O-CG 3.46Å; K284-M287 PolarHBondContact O-N 2.91Å; K284-E353 IonicContact NZ-OE2 3.97Å; K284-E353 PolarHBondContact NZ-OE2 2.84Å; K284-V354 HydrophobicContact CD-CG2 4.21Å; K284-V354 HydrophobicContact CG-CG2 3.8Å
285	P	90.2	Very high	86.4	Confident	40 Å²	40	56.6 Å²	56.6	26%	0.26	29%	0.293	S	S	.	.	G	3₁₀ helix	trans	-64.8	-15.3	-179	-22.1	35	0	0	0	114.9	T243 C247 E282 R283 M287 L288	T243-P285 HydrophobicContact CG2-CB 3.63Å; T243-P285 HydrophobicContact CG2-CG 3.84Å; C247-P285 VanDerWaalsContact SG-CB 3.51Å; E282-P285 WeakPolarHBondContact O-CD 3.45Å; R283-P285 VanDerWaalsContact C-N 3.26Å; P285-M287 PolarHBondContact O-N 3.34Å; P285-L288 VanDerWaalsContact O-CB 3.3Å; P285-L288 WeakPolarHBondContact O-CB 3.46Å; P285-L288 VanDerWaalsContact O-CG 3.3Å; P285-L288 WeakPolarHBondContact O-CG 3.41Å; P285-L288 PolarHBondContact O-N 2.97Å; P285-L288 VanDerWaalsContact O-N 3.12Å
286	F	90.5	Very high	86.3	Confident	0 Å²	0	57.8 Å²	57.8	0%	0	29%	0.292	C	S	.	.	G	3₁₀ helix	trans	-64.4	-19.3	172.2	-64.5	-40.6	0	0	0	112.9	L239 I242 L250 A273 L274 R283 K284 L288 L289 Q343	L239-F286 HydrophobicContact CD2-CE2 3.83Å; L239-F286 HydrophobicContact CD2-CZ 3.49Å; L239-F286 VanDerWaalsContact CD2-CZ 3.49Å; I242-F286 HydrophobicContact CG2-CE1 4.23Å; L250-F286 HydrophobicContact CD1-CD1 3.69Å; L250-F286 HydrophobicContact CD1-CE1 4.03Å; A273-F286 WeakPolarHBondContact O-CZ 3.49Å; L274-F286 HydrophobicContact CD2-CB 4.17Å; L274-F286 HydrophobicContact CD2-CD1 4.18Å; L274-F286 HydrophobicContact CD2-CD2 4.42Å; L274-F286 HydrophobicContact CD2-CG 4.04Å; R283-F286 HydrophobicContact CB-CD2 3.88Å; R283-F286 HydrophobicContact CB-CE2 4.13Å; R283-F286 HydrophobicContact CG-CD2 4.39Å; R283-F286 HydrophobicContact CG-CE2 4.16Å; R283-F286 WeakPolarHBondContact O-CB 3.29Å; R283-F286 WeakPolarHBondContact O-CD2 3.43Å; R283-F286 PolarHBondContact O-N 2.91Å; K284-F286 PolarHBondContact O-N 3.15Å; K284-F286 VanDerWaalsContact O-N 3.1Å; F286-L288 PolarHBondContact O-N 3.18Å; F286-L289 WeakPolarHBondContact O-CB 3.41Å; F286-L289 PolarHBondContact O-N 3.29Å; F286-L289 VanDerWaalsContact O-N 3.1Å; F286-Q343 HydrophobicContact CD2-CG 4.49Å
287	M	90.7	Very high	86.3	Confident	27 Å²	27	59 Å²	59	13%	0.133	30%	0.296	C	S	.	.	G	3₁₀ helix	trans	-63.7	-17.5	173.7	-59.8	-60	89.5	0	0	112.8	K284 P285 L289 F290 Q343 L344 L347 V354	K284-M287 WeakPolarHBondContact O-CB 3.45Å; K284-M287 WeakPolarHBondContact O-CG 3.46Å; K284-M287 PolarHBondContact O-N 2.91Å; P285-M287 PolarHBondContact O-N 3.34Å; M287-L289 PolarHBondContact O-N 3.02Å; M287-F290 HydrophobicContact CE-CD2 4.37Å; M287-F290 HydrophobicContact CE-CE2 3.86Å; M287-F290 WeakPolarHBondContact O-CB 3.42Å; M287-F290 PolarHBondContact O-N 3.39Å; M287-F290 HydrophobicContact SD-CD2 4.31Å; M287-F290 HydrophobicContact SD-CE2 4.09Å; M287-Q343 HydrophobicContact CE-CB 4.31Å; M287-L344 HydrophobicContact SD-CD1 4.24Å; M287-L347 HydrophobicContact CE-CD1 3.58Å; M287-L347 HydrophobicContact CG-CD1 4.27Å; M287-L347 HydrophobicContact SD-CD1 4.08Å; M287-V354 HydrophobicContact CG-CG1 3.94Å; M287-V354 HydrophobicContact SD-CG1 4.23Å
288	L	88.6	Confident	86.6	Confident	64 Å²	64	50.9 Å²	50.9	34%	0.335	26%	0.262	S	S	.	.	G	3₁₀ helix	trans	-62.5	-21.5	172.7	-65.5	173.3	0	0	0	113.1	C247 P285 F286 F290 N291	C247-L288 HydrophobicContact CB-CD1 3.99Å; P285-L288 VanDerWaalsContact O-CB 3.3Å; P285-L288 WeakPolarHBondContact O-CB 3.46Å; P285-L288 VanDerWaalsContact O-CG 3.3Å; P285-L288 WeakPolarHBondContact O-CG 3.41Å; P285-L288 PolarHBondContact O-N 2.97Å; P285-L288 VanDerWaalsContact O-N 3.12Å; F286-L288 PolarHBondContact O-N 3.18Å; L288-F290 PolarHBondContact O-N 3.24Å; L288-N291 WeakPolarHBondContact CD2-ND2 3.41Å; L288-N291 WeakPolarHBondContact O-CB 3.41Å; L288-N291 VanDerWaalsContact O-CG 3.29Å; L288-N291 PolarHBondContact O-N 3.34Å
289	L	91.1	Very high	86.7	Confident	4 Å²	4	50.1 Å²	50.1	2%	0.021	25%	0.249	C	C	.	.	G	3₁₀ helix	trans	-68.8	-13.5	174.9	-68.4	172.1	0	0	0	113.2	L250 C254 L270 L274 F286 M287 N291 A294 I295 L340	L250-L289 HydrophobicContact CB-CD2 4.09Å; L250-L289 HydrophobicContact CD1-CD1 4.43Å; L250-L289 HydrophobicContact CD1-CG 4.46Å; C254-L289 VanDerWaalsContact SG-CD2 3.5Å; L270-L289 HydrophobicContact CD1-CD1 4.07Å; L270-L289 HydrophobicContact CD1-CD2 4.44Å; L274-L289 HydrophobicContact CD1-CD1 4.17Å; L274-L289 HydrophobicContact CD2-CD1 3.77Å; L274-L289 HydrophobicContact CG-CD1 4.31Å; F286-L289 WeakPolarHBondContact O-CB 3.41Å; F286-L289 PolarHBondContact O-N 3.29Å; F286-L289 VanDerWaalsContact O-N 3.1Å; M287-L289 PolarHBondContact O-N 3.02Å; L289-N291 VanDerWaalsContact C-N 3.34Å; L289-A294 HydrophobicContact CD2-CB 4.12Å; L289-I295 PolarHBondContact O-N 3.4Å; L289-L340 HydrophobicContact CB-CD1 4.15Å; L289-L340 HydrophobicContact CB-CD2 4.28Å; L289-L340 HydrophobicContact CD1-CD1 4.11Å
290	F	90.7	Very high	86.6	Confident	1 Å²	1	44.8 Å²	44.8	0%	0.004	23%	0.23	C	C	.	.	G	3₁₀ helix	trans	-86.5	-1.8	169.5	-66	-89.3	0	0	0	112.8	M287 L288 L340 L344 P357 N359 Y363	M287-F290 HydrophobicContact CE-CD2 4.37Å; M287-F290 HydrophobicContact CE-CE2 3.86Å; M287-F290 WeakPolarHBondContact O-CB 3.42Å; M287-F290 PolarHBondContact O-N 3.39Å; M287-F290 HydrophobicContact SD-CD2 4.31Å; M287-F290 HydrophobicContact SD-CE2 4.09Å; L288-F290 PolarHBondContact O-N 3.24Å; F290-L340 HydrophobicContact CD2-CD1 4.35Å; F290-L340 HydrophobicContact CE1-CD2 4.35Å; F290-L340 HydrophobicContact CE2-CD1 3.62Å; F290-L340 HydrophobicContact CE2-CD2 4.12Å; F290-L340 HydrophobicContact CE2-CG 3.76Å; F290-L340 HydrophobicContact CZ-CD1 4.09Å; F290-L340 HydrophobicContact CZ-CD2 3.97Å; F290-L340 HydrophobicContact CZ-CG 3.67Å; F290-L344 HydrophobicContact CE1-CD2 4.34Å; F290-L344 HydrophobicContact CE2-CB 4.41Å; F290-L344 HydrophobicContact CE2-CD1 4.33Å; F290-L344 HydrophobicContact CZ-CB 4.01Å; F290-L344 HydrophobicContact CZ-CD1 4.15Å; F290-L344 HydrophobicContact CZ-CD2 4.04Å; F290-L344 HydrophobicContact CZ-CG 4.3Å; F290-P357 HydrophobicContact CB-CB 3.58Å; F290-P357 HydrophobicContact CB-CG 4.19Å; F290-P357 HydrophobicContact CD1-CB 3.96Å; F290-P357 HydrophobicContact CD1-CG 4.11Å; F290-P357 HydrophobicContact CD2-CB 4.29Å; F290-P357 HydrophobicContact CD2-CG 3.94Å; F290-P357 HydrophobicContact CE1-CG 4.47Å; F290-P357 HydrophobicContact CE2-CG 4.32Å; F290-P357 HydrophobicContact CG-CB 3.7Å; F290-P357 HydrophobicContact CG-CG 3.82Å; F290-N359 VanDerWaalsContact O-CB 3.27Å; F290-N359 WeakPolarHBondContact O-CB 3.4Å; F290-N359 PolarHBondContact O-ND2 2.59Å; F290-Y363 HydrophobicContact CD1-CG 4.38Å; F290-Y363 HydrophobicContact CE1-CD1 4.06Å; F290-Y363 AromaticContact CE1-CD2 3.87Å; F290-Y363 HydrophobicContact CE1-CD2 3.87Å; F290-Y363 AromaticContact CE1-CG 3.61Å; F290-Y363 HydrophobicContact CE1-CG 3.61Å; F290-Y363 HydrophobicContact CZ-CD2 4.45Å; F290-Y363 HydrophobicContact CZ-CG 4.48Å
291	N	88.1	Confident	86.2	Confident	75 Å²	75	41.9 Å²	41.9	40%	0.401	21%	0.214	S	C	.	.	S	Bend	trans	-68	155.5	173.5	-67.7	-13.5	0	0	0	110.7	L288 L289 V293 A294 I295	L288-N291 WeakPolarHBondContact CD2-ND2 3.41Å; L288-N291 WeakPolarHBondContact O-CB 3.41Å; L288-N291 VanDerWaalsContact O-CG 3.29Å; L288-N291 PolarHBondContact O-N 3.34Å; L289-N291 VanDerWaalsContact C-N 3.34Å; N291-V293 VanDerWaalsContact C-N 3.27Å; N291-V293 PolarHBondContact O-N 3.46Å; N291-V293 VanDerWaalsContact O-N 3.13Å; N291-A294 PolarHBondContact O-N 3.15Å; N291-I295 WeakPolarHBondContact O-CG2 3.33Å; N291-I295 PolarHBondContact O-N 3.12Å; N291-I295 VanDerWaalsContact O-N 3.1Å
292	D	83.5	Confident	85.7	Confident	90 Å²	90	37.3 Å²	37.3	48%	0.481	20%	0.195	S	C	.	.	H	α-helix	trans	-51.6	-42.6	-171.7	-75.2	-62.7	0	0	0	114	Q296 N359 K362	D292-Q296 WeakPolarHBondContact O-CB 3.33Å; D292-Q296 PolarHBondContact O-N 3.25Å; D292-Q296 VanDerWaalsContact O-N 3.16Å; D292-N359 PolarHBondContact N-ND2 2.97Å; D292-N359 PolarHBondContact OD1-ND2 3.31Å; D292-N359 PolarHBondContact OD1-OD1 3.42Å; D292-N359 VanDerWaalsContact OD1-OD1 3.14Å; D292-K362 IonicContact OD1-NZ 3.01Å; D292-K362 PolarHBondContact OD1-NZ 3.43Å
293	V	83.1	Confident	85.2	Confident	102 Å²	102	40.1 Å²	40.1	62%	0.618	21%	0.208	S	C	*	.	H	α-helix	trans	-66.4	-51.3	-177.1	-179.2	0	0	0	0	111.1	N291 Q296 Y297	N291-V293 VanDerWaalsContact C-N 3.27Å; N291-V293 PolarHBondContact O-N 3.46Å; N291-V293 VanDerWaalsContact O-N 3.13Å; V293-Q296 PolarHBondContact O-N 3.23Å; V293-Y297 HydrophobicContact CG1-CD2 4.01Å; V293-Y297 HydrophobicContact CG1-CE2 3.54Å; V293-Y297 WeakPolarHBondContact O-CD2 3.37Å; V293-Y297 PolarHBondContact O-N 3.36Å
294	A	85	Confident	84.3	Confident	9 Å²	9	41.4 Å²	41.4	7%	0.074	22%	0.222	C	C	.	.	H	α-helix	trans	-67.4	-47.7	-175.3	0	0	0	0	0	112	L289 N291 Q296 Y297 I298	L289-A294 HydrophobicContact CD2-CB 4.12Å; N291-A294 PolarHBondContact O-N 3.15Å; A294-Q296 VanDerWaalsContact C-N 3.28Å; A294-Q296 PolarHBondContact O-N 3.39Å; A294-Y297 PolarHBondContact O-N 2.68Å; A294-I298 WeakPolarHBondContact O-CG1 3.41Å; A294-I298 PolarHBondContact O-N 3.1Å; A294-I298 VanDerWaalsContact O-N 3.15Å
295	I	84.9	Confident	82.9	Confident	0 Å²	0	39.9 Å²	39.9	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-66.5	-32.5	-178.7	-161.7	62.5	0	0	0	111.8	L289 N291 I298 L299 N359 K362 Y363	L289-I295 PolarHBondContact O-N 3.4Å; N291-I295 WeakPolarHBondContact O-CG2 3.33Å; N291-I295 PolarHBondContact O-N 3.12Å; N291-I295 VanDerWaalsContact O-N 3.1Å; I295-I298 PolarHBondContact O-N 2.86Å; I295-L299 VanDerWaalsContact O-CB 3.26Å; I295-L299 WeakPolarHBondContact O-CB 3.45Å; I295-L299 PolarHBondContact O-N 3.14Å; I295-N359 HydrophobicContact CG2-CB 4.14Å; I295-K362 HydrophobicContact CG1-CB 4.03Å; I295-K362 HydrophobicContact CG2-CB 4.37Å; I295-K362 HydrophobicContact CG2-CD 3.84Å; I295-Y363 HydrophobicContact CD1-CD2 4.45Å
296	Q	85.8	Confident	81.6	Confident	90 Å²	90	41.5 Å²	41.5	42%	0.421	22%	0.223	S	C	.	.	H	α-helix	trans	-65.2	-41.8	176.4	-173.6	64.5	36.5	0	0	111.7	D292 V293 A294 L299 S300	D292-Q296 WeakPolarHBondContact O-CB 3.33Å; D292-Q296 PolarHBondContact O-N 3.25Å; D292-Q296 VanDerWaalsContact O-N 3.16Å; V293-Q296 PolarHBondContact O-N 3.23Å; A294-Q296 VanDerWaalsContact C-N 3.28Å; A294-Q296 PolarHBondContact O-N 3.39Å; Q296-L299 PolarHBondContact O-N 3.38Å; Q296-S300 WeakPolarHBondContact O-CB 2.74Å; Q296-S300 PolarHBondContact O-N 3.11Å; Q296-S300 PolarHBondContact O-OG 3.18Å; Q296-S300 VanDerWaalsContact O-OG 3.12Å
297	Y	84.9	Confident	80.2	Confident	77 Å²	77	44.6 Å²	44.6	30%	0.302	26%	0.255	S	S	.	.	H	α-helix	trans	-65.3	-41.5	176.3	-76	-59.7	0	0	0	112.5	C254 L255 S258 V293 A294 L299 S300 A301	C254-Y297 WeakPolarHBondContact O-CB 3.29Å; L255-Y297 HydrophobicContact CD2-CD2 4.2Å; L255-Y297 HydrophobicContact CD2-CE1 4.08Å; L255-Y297 HydrophobicContact CD2-CE2 3.35Å; L255-Y297 WeakPolarHBondContact CD2-OH 3.47Å; L255-Y297 HydrophobicContact CG-CE2 4.1Å; S258-Y297 WeakPolarHBondContact OG-CD1 3.36Å; V293-Y297 HydrophobicContact CG1-CD2 4.01Å; V293-Y297 HydrophobicContact CG1-CE2 3.54Å; V293-Y297 WeakPolarHBondContact O-CD2 3.37Å; V293-Y297 PolarHBondContact O-N 3.36Å; A294-Y297 PolarHBondContact O-N 2.68Å; Y297-L299 VanDerWaalsContact C-N 3.33Å; Y297-S300 WeakPolarHBondContact CA-OG 3.45Å; Y297-S300 PolarHBondContact O-OG 2.76Å; Y297-A301 WeakPolarHBondContact O-CB 3.47Å; Y297-A301 PolarHBondContact O-N 2.86Å
298	I	81.6	Confident	78.7	Confident	1 Å²	1	47.5 Å²	47.5	1%	0.005	27%	0.27	C	S	.	.	H	α-helix	trans	-61.3	-45.3	176.1	-66.6	168.3	0	0	0	110.1	L257 A294 I295 A301 A302 L333 L337	L257-I298 HydrophobicContact CD1-CG1 3.76Å; A294-I298 WeakPolarHBondContact O-CG1 3.41Å; A294-I298 PolarHBondContact O-N 3.1Å; A294-I298 VanDerWaalsContact O-N 3.15Å; I295-I298 PolarHBondContact O-N 2.86Å; I298-A301 PolarHBondContact O-N 3.45Å; I298-A302 PolarHBondContact O-N 3.48Å; I298-L333 HydrophobicContact CG2-CD1 4.14Å; I298-L337 HydrophobicContact CG2-CD2 3.6Å; I298-L337 HydrophobicContact CG2-CG 4.11Å
299	L	81.5	Confident	77.2	Confident	19 Å²	19	44.4 Å²	44.4	10%	0.099	25%	0.254	C	S	.	.	H	α-helix	trans	-68.2	-43.7	-180	-175.3	139.9	0	0	0	112.3	I295 Q296 Y297 A301 A302 Q303 K362 A366	I295-L299 VanDerWaalsContact O-CB 3.26Å; I295-L299 WeakPolarHBondContact O-CB 3.45Å; I295-L299 PolarHBondContact O-N 3.14Å; Q296-L299 PolarHBondContact O-N 3.38Å; Y297-L299 VanDerWaalsContact C-N 3.33Å; L299-A301 VanDerWaalsContact C-N 3.32Å; L299-A301 PolarHBondContact O-N 3.46Å; L299-A302 PolarHBondContact O-N 3.02Å; L299-Q303 WeakPolarHBondContact O-CG 3.48Å; L299-Q303 PolarHBondContact O-N 2.99Å; L299-K362 HydrophobicContact CD1-CB 4.46Å; L299-A366 HydrophobicContact CD1-CB 4.3Å
300	S	82.7	Confident	75.9	Confident	34 Å²	34	47.6 Å²	47.6	24%	0.238	27%	0.271	C	S	.	.	H	α-helix	trans	-64	-38.4	176.1	62.3	0	0	0	0	111.9	Q296 Y297 Q303 S304	Q296-S300 WeakPolarHBondContact O-CB 2.74Å; Q296-S300 PolarHBondContact O-N 3.11Å; Q296-S300 PolarHBondContact O-OG 3.18Å; Q296-S300 VanDerWaalsContact O-OG 3.12Å; Y297-S300 WeakPolarHBondContact CA-OG 3.45Å; Y297-S300 PolarHBondContact O-OG 2.76Å; S300-Q303 PolarHBondContact O-N 2.97Å; S300-S304 WeakPolarHBondContact O-CB 3.34Å; S300-S304 PolarHBondContact O-N 3.49Å; S300-S304 PolarHBondContact O-OG 2.9Å
301	A	78	Confident	74.3	Confident	0 Å²	0	49.9 Å²	49.9	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-64.2	-43.7	176.6	0	0	0	0	0	111.3	L257 Y297 I298 L299 S304 A305 F329 L333	L257-A301 HydrophobicContact CB-CB 3.89Å; Y297-A301 WeakPolarHBondContact O-CB 3.47Å; Y297-A301 PolarHBondContact O-N 2.86Å; I298-A301 PolarHBondContact O-N 3.45Å; L299-A301 VanDerWaalsContact C-N 3.32Å; L299-A301 PolarHBondContact O-N 3.46Å; A301-S304 PolarHBondContact O-N 2.92Å; A301-S304 PolarHBondContact O-OG 2.91Å; A301-S304 VanDerWaalsContact O-OG 3.07Å; A301-A305 VanDerWaalsContact O-CB 3.27Å; A301-A305 WeakPolarHBondContact O-CB 3.45Å; A301-A305 PolarHBondContact O-N 3.46Å; A301-F329 HydrophobicContact CB-CE1 4.4Å; A301-F329 HydrophobicContact CB-CZ 4.05Å; A301-L333 HydrophobicContact CB-CD2 3.95Å
302	A	73.9	Confident	72.9	Confident	13 Å²	13	51.2 Å²	51.2	11%	0.107	30%	0.299	C	S	.	.	H	α-helix	trans	-60.8	-46	176	0	0	0	0	0	112.5	I298 L299 D306 L333 F370	I298-A302 PolarHBondContact O-N 3.48Å; L299-A302 PolarHBondContact O-N 3.02Å; A302-D306 PolarHBondContact O-N 3.21Å; A302-L333 HydrophobicContact CB-CD2 3.87Å; A302-F370 HydrophobicContact CB-CE2 3.8Å; A302-F370 HydrophobicContact CB-CZ 3.89Å
303	Q	75.7	Confident	71.4	Confident	130 Å²	130	48.3 Å²	48.3	61%	0.607	28%	0.283	S	S	*	.	H	α-helix	trans	-68.8	-40.5	179.8	-70.3	175.6	-15.3	0	0	112.8	L299 S300	L299-Q303 WeakPolarHBondContact O-CG 3.48Å; L299-Q303 PolarHBondContact O-N 2.99Å; S300-Q303 PolarHBondContact O-N 2.97Å
304	S	69.9	Low	70	Confident	58 Å²	58	49.6 Å²	49.6	41%	0.406	30%	0.297	S	S	.	.	H	α-helix	trans	-69.7	-36.4	-178.4	68.5	0	0	0	0	112.7	S300 A301 L308	S300-S304 WeakPolarHBondContact O-CB 3.34Å; S300-S304 PolarHBondContact O-N 3.49Å; S300-S304 PolarHBondContact O-OG 2.9Å; A301-S304 PolarHBondContact O-N 2.92Å; A301-S304 PolarHBondContact O-OG 2.91Å; A301-S304 VanDerWaalsContact O-OG 3.07Å; S304-L308 WeakPolarHBondContact O-CB 3.46Å; S304-L308 WeakPolarHBondContact O-CD1 3.25Å; S304-L308 WeakPolarHBondContact O-CG 3.1Å
305	A	60.7	Low	68.4	Low	4 Å²	4	53.4 Å²	53.4	3%	0.033	32%	0.323	C	S	.	.	H	α-helix	trans	-76.5	-27.5	-177.4	0	0	0	0	0	113.2	A301 L308 A309 F329 L330	A301-A305 VanDerWaalsContact O-CB 3.27Å; A301-A305 WeakPolarHBondContact O-CB 3.45Å; A301-A305 PolarHBondContact O-N 3.46Å; A305-L308 PolarHBondContact O-N 3.15Å; A305-A309 VanDerWaalsContact O-CB 3.26Å; A305-A309 WeakPolarHBondContact O-CB 3.47Å; A305-A309 PolarHBondContact O-N 3.26Å; A305-F329 HydrophobicContact CB-CD1 3.94Å; A305-F329 HydrophobicContact CB-CE1 3.93Å; A305-L330 HydrophobicContact CB-CD1 4.32Å; A305-L330 HydrophobicContact CB-CD2 3.52Å; A305-L330 HydrophobicContact CB-CG 3.78Å
306	D	62.7	Low	66.8	Low	74 Å²	74	58.6 Å²	58.6	40%	0.396	35%	0.346	S	S	.	.	H	α-helix	trans	-63.4	-54.7	175.8	-172.9	24	0	0	0	111.8	A302 L308 A309 H373	A302-D306 PolarHBondContact O-N 3.21Å; D306-L308 PolarHBondContact O-N 3.39Å; D306-L308 VanDerWaalsContact O-N 3.08Å; D306-A309 PolarHBondContact O-N 3.34Å; D306-H373 IonicContact OD1-CD2 2.97Å; D306-H373 PolarHBondContact OD1-CD2 2.86Å; D306-H373 IonicContact OD1-NE2 3.87Å; D306-H373 PolarHBondContact OD1-NE2 3.24Å
307	G	61.8	Low	65	Low	65 Å²	65	60 Å²	60	67%	0.67	36%	0.362	S	S	*	.	H	α-helix	trans	-66.7	-13.5	179.7	0	0	0	0	0	115.2
308	L	58	Low	63.4	Low	87 Å²	87	65.7 Å²	65.7	46%	0.455	39%	0.392	S	S	.	.	H	α-helix	trans	-111.4	-7.3	-176.7	-78.8	-178.9	0	0	0	113.4	S304 A305 D306 I310 R326	S304-L308 WeakPolarHBondContact O-CB 3.46Å; S304-L308 WeakPolarHBondContact O-CD1 3.25Å; S304-L308 WeakPolarHBondContact O-CG 3.1Å; A305-L308 PolarHBondContact O-N 3.15Å; D306-L308 PolarHBondContact O-N 3.39Å; D306-L308 VanDerWaalsContact O-N 3.08Å; L308-I310 PolarHBondContact O-N 3.41Å; L308-R326 WeakPolarHBondContact O-CD 3.43Å; L308-R326 PolarHBondContact O-NH1 3.05Å
309	A	58.9	Low	62	Low	0 Å²	0	69 Å²	69	0%	0	41%	0.407	C	S	.	.	S	Bend	trans	-72.9	-17.1	176.6	0	0	0	0	0	112.1	A305 D306 V322 V323 L330	A305-A309 VanDerWaalsContact O-CB 3.26Å; A305-A309 WeakPolarHBondContact O-CB 3.47Å; A305-A309 PolarHBondContact O-N 3.26Å; D306-A309 PolarHBondContact O-N 3.34Å; A309-V322 CarbonylContact O-C 3.6Å; A309-V322 VanDerWaalsContact O-CA 3.24Å; A309-V322 WeakPolarHBondContact O-CA 3.46Å; A309-V323 PolarHBondContact O-N 3.1Å; A309-L330 HydrophobicContact CB-CD1 4.06Å
310	I	61.8	Low	61	Low	71 Å²	71	71.1 Å²	71.1	36%	0.364	42%	0.421	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	122.4	-177	-82.5	169.2	0	0	0	109	L308 V320 Y432	L308-I310 PolarHBondContact O-N 3.41Å; I310-V320 HydrophobicContact CB-CG1 3.76Å; I310-V320 HydrophobicContact CD1-CG1 4.26Å; I310-V320 HydrophobicContact CG1-CG1 3.62Å; I310-V320 HydrophobicContact CG2-CB 4.34Å; I310-V320 HydrophobicContact CG2-CG1 3.22Å; I310-V320 HydrophobicContact CG2-CG2 4.22Å; I310-Y432 HydrophobicContact CD1-CE2 4.33Å; I310-Y432 WeakPolarHBondContact CD1-OH 3.41Å
311	C	58.6	Low	60.1	Low	48 Å²	48	75.2 Å²	75.2	32%	0.324	44%	0.436	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	139.5	172.8	-74	0	0	0	0	110.3	N313 E321 V323	C311-N313 PolarHBondContact O-N 3.44Å; C311-E321 PolarHBondContact N-O 3Å; C311-E321 PolarHBondContact O-N 3.44Å; C311-V323 HydrophobicContact CB-CG2 4.38Å; C311-V323 VanDerWaalsContact SG-CG2 3.54Å
312	P	58.3	Low	59.8	Low	104 Å²	104	75.6 Å²	75.6	68%	0.675	44%	0.439	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-66.5	127.9	169.7	26.3	-30.9	0	0	0	109.7	S314	P312-S314 PolarHBondContact O-N 3.5Å
313	N	52.5	Low	60.1	Low	29 Å²	29	77.2 Å²	77.2	16%	0.155	45%	0.447	C	S	.	.			trans	-64.4	126.3	-178	-176.6	-15.1	0	0	0	110.1	C311 S315 K316 E319	C311-N313 PolarHBondContact O-N 3.44Å; N313-S315 PolarHBondContact O-N 2.9Å; N313-S315 PolarHBondContact OD1-N 3.39Å; N313-S315 PolarHBondContact OD1-OG 3.18Å; N313-K316 CarbonylContact O-C 3.56Å; N313-K316 VanDerWaalsContact O-C 3.31Å; N313-K316 PolarHBondContact O-N 3.47Å; N313-E319 HydrophobicContact CB-CB 4.08Å; N313-E319 WeakPolarHBondContact CB-O 3.3Å; N313-E319 PolarHBondContact N-O 3.16Å
314	S	53.2	Low	60.3	Low	129 Å²	129	77.4 Å²	77.4	90%	0.902	45%	0.448	S	S	*	.	S	Bend	trans	-66.1	-22.4	-176.7	61.6	0	0	0	0	113.5	P312	P312-S314 PolarHBondContact O-N 3.5Å
315	S	50.7	Low	60.9	Low	89 Å²	89	79.8 Å²	79.8	62%	0.622	45%	0.448	S	S	*	.	S	Bend	trans	-94	-23.6	179.8	65.9	0	0	0	0	114	N313	N313-S315 PolarHBondContact O-N 2.9Å; N313-S315 PolarHBondContact OD1-N 3.39Å; N313-S315 PolarHBondContact OD1-OG 3.18Å
316	K	52.8	Low	61.9	Low	109 Å²	109	83.1 Å²	83.1	47%	0.474	46%	0.46	S	S	.	.			trans	-145.4	101.3	178.7	-71.2	175.8	-178.1	169.9	0	109.9	N313 Q318 E319	N313-K316 CarbonylContact O-C 3.56Å; N313-K316 VanDerWaalsContact O-C 3.31Å; N313-K316 PolarHBondContact O-N 3.47Å; K316-Q318 PolarHBondContact O-N 2.92Å; K316-E319 HydrophobicContact CB-CB 4.32Å; K316-E319 HydrophobicContact CB-CG 4.47Å; K316-E319 VanDerWaalsContact CD-CD 3.4Å; K316-E319 HydrophobicContact CD-CG 4.28Å; K316-E319 VanDerWaalsContact CD-OE1 3.28Å; K316-E319 WeakPolarHBondContact CD-OE1 3.26Å; K316-E319 WeakPolarHBondContact CD-OE2 3.43Å; K316-E319 IonicContact NZ-OE1 2.96Å; K316-E319 PolarHBondContact NZ-OE1 3.36Å; K316-E319 IonicContact NZ-OE2 3.69Å; K316-E319 PolarHBondContact NZ-OE2 3.38Å; K316-E319 PolarHBondContact O-N 3.1Å
317	P	47.3	Very low	63	Low	119 Å²	119	79.8 Å²	79.8	77%	0.773	44%	0.441	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.7	-11.7	-173.4	-23.3	31.8	0	0	0	116.2
318	Q	50.3	Low	64.2	Low	196 Å²	196	78.3 Å²	78.3	92%	0.916	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.5	-13.2	177.9	-72.6	175.5	-24.9	0	0	113.6	K316	K316-Q318 PolarHBondContact O-N 2.92Å
319	E	52.7	Low	65.7	Low	71 Å²	71	74.2 Å²	74.2	33%	0.332	40%	0.398	S	S	.	.			trans	-95.4	131.9	176.3	-77.1	175.7	-166	0	0	109.9	N313 K316	N313-E319 HydrophobicContact CB-CB 4.08Å; N313-E319 WeakPolarHBondContact CB-O 3.3Å; N313-E319 PolarHBondContact N-O 3.16Å; K316-E319 HydrophobicContact CB-CB 4.32Å; K316-E319 HydrophobicContact CB-CG 4.47Å; K316-E319 VanDerWaalsContact CD-CD 3.4Å; K316-E319 HydrophobicContact CD-CG 4.28Å; K316-E319 VanDerWaalsContact CD-OE1 3.28Å; K316-E319 WeakPolarHBondContact CD-OE1 3.26Å; K316-E319 WeakPolarHBondContact CD-OE2 3.43Å; K316-E319 IonicContact NZ-OE1 2.96Å; K316-E319 PolarHBondContact NZ-OE1 3.36Å; K316-E319 IonicContact NZ-OE2 3.69Å; K316-E319 PolarHBondContact NZ-OE2 3.38Å; K316-E319 PolarHBondContact O-N 3.1Å
320	V	60.7	Low	67.1	Low	63 Å²	63	74.3 Å²	74.3	38%	0.382	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	129.1	175.6	165.2	0	0	0	0	108.9	I310 V431	I310-V320 HydrophobicContact CB-CG1 3.76Å; I310-V320 HydrophobicContact CD1-CG1 4.26Å; I310-V320 HydrophobicContact CG1-CG1 3.62Å; I310-V320 HydrophobicContact CG2-CB 4.34Å; I310-V320 HydrophobicContact CG2-CG1 3.22Å; I310-V320 HydrophobicContact CG2-CG2 4.22Å; V320-V431 WeakPolarHBondContact O-CG1 3.41Å
321	E	64.4	Low	68.5	Low	120 Å²	120	72.5 Å²	72.5	56%	0.561	39%	0.388	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-104.3	137.2	177.2	-168.3	175.1	-176.3	0	0	110.6	C311	C311-E321 PolarHBondContact N-O 3Å; C311-E321 PolarHBondContact O-N 3.44Å
322	V	71.6	Confident	70	Confident	9 Å²	9	73.8 Å²	73.8	6%	0.055	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	124	175.7	171.6	0	0	0	0	109.3	A309 E324 Y327 V431 Y432 M435	A309-V322 CarbonylContact O-C 3.6Å; A309-V322 VanDerWaalsContact O-CA 3.24Å; A309-V322 WeakPolarHBondContact O-CA 3.46Å; V322-E324 PolarHBondContact O-N 3.34Å; V322-E324 VanDerWaalsContact O-N 3.09Å; V322-Y327 HydrophobicContact CG1-CD1 4.01Å; V322-Y327 HydrophobicContact CG1-CG 3.91Å; V322-V431 HydrophobicContact CG2-CB 4.29Å; V322-V431 HydrophobicContact CG2-CG1 3.54Å; V322-Y432 HydrophobicContact CG1-CD1 4.48Å; V322-Y432 HydrophobicContact CG1-CE1 4.36Å; V322-Y432 HydrophobicContact CG2-CD1 4.15Å; V322-Y432 HydrophobicContact CG2-CE1 4.07Å; V322-M435 HydrophobicContact CB-CG 4.31Å
323	V	79.6	Confident	71.6	Confident	47 Å²	47	68.8 Å²	68.8	29%	0.285	35%	0.354	S	S	.	.			trans	-73.3	103.1	175.2	-177.7	0	0	0	0	109.2	A309 C311 R325 R326 Y327	A309-V323 PolarHBondContact O-N 3.1Å; C311-V323 HydrophobicContact CB-CG2 4.38Å; C311-V323 VanDerWaalsContact SG-CG2 3.54Å; V323-R325 PolarHBondContact O-N 2.87Å; V323-R326 HydrophobicContact CB-CB 4.19Å; V323-R326 HydrophobicContact CB-CG 4.27Å; V323-R326 HydrophobicContact CG1-CB 4.2Å; V323-R326 HydrophobicContact CG1-CG 3.87Å; V323-R326 PolarHBondContact O-N 2.95Å; V323-Y327 PolarHBondContact O-N 2.98Å
324	E	80.1	Confident	73.5	Confident	133 Å²	133	67.4 Å²	67.4	62%	0.621	35%	0.346	S	S	*	.	H	α-helix	trans	-48.5	-54.6	-172.2	-172	-174.1	172.9	0	0	113.2	V322 R326 Y327 V328 M435	V322-E324 PolarHBondContact O-N 3.34Å; V322-E324 VanDerWaalsContact O-N 3.09Å; E324-R326 VanDerWaalsContact C-N 3.26Å; E324-R326 PolarHBondContact O-N 2.95Å; E324-Y327 PolarHBondContact O-N 3.13Å; E324-Y327 VanDerWaalsContact O-N 3.13Å; E324-V328 HydrophobicContact CG-CG2 4.4Å; E324-V328 WeakPolarHBondContact O-CG2 3.45Å; E324-V328 PolarHBondContact O-N 3.09Å; E324-M435 HydrophobicContact CB-CE 4.32Å; E324-M435 HydrophobicContact CG-CE 4.19Å
325	R	81.6	Confident	75.4	Confident	109 Å²	109	63.8 Å²	63.8	41%	0.411	32%	0.315	S	S	.	.	H	α-helix	trans	-57.8	-36.3	-179	-171.9	176	175.3	92.8	1.7	112.6	E261 E265 V323 F329	E261-R325 PolarHBondContact O-NH2 2.93Å; E261-R325 VanDerWaalsContact O-NH2 3.09Å; E265-R325 IonicContact OE1-CZ 3.35Å; E265-R325 IonicContact OE1-NH1 2.66Å; E265-R325 IonicContact OE1-NH2 3.7Å; E265-R325 PolarHBondContact OE1-NH2 3.38Å; E265-R325 IonicContact OE2-NH2 2.68Å; E265-R325 PolarHBondContact OE2-NH2 3.09Å; V323-R325 PolarHBondContact O-N 2.87Å; R325-F329 PolarHBondContact O-N 2.86Å; R325-F329 VanDerWaalsContact O-N 3.1Å
326	R	82.9	Confident	77.4	Confident	74 Å²	74	59.6 Å²	59.6	28%	0.279	29%	0.286	S	S	.	.	H	α-helix	trans	-75.1	-39.1	178.7	-68.6	-177.4	175	167	-2.5	111.8	L308 V323 E324 F329 L330	L308-R326 WeakPolarHBondContact O-CD 3.43Å; L308-R326 PolarHBondContact O-NH1 3.05Å; V323-R326 HydrophobicContact CB-CB 4.19Å; V323-R326 HydrophobicContact CB-CG 4.27Å; V323-R326 HydrophobicContact CG1-CB 4.2Å; V323-R326 HydrophobicContact CG1-CG 3.87Å; V323-R326 PolarHBondContact O-N 2.95Å; E324-R326 VanDerWaalsContact C-N 3.26Å; E324-R326 PolarHBondContact O-N 2.95Å; R326-F329 WeakPolarHBondContact O-CB 3.45Å; R326-F329 PolarHBondContact O-N 3.15Å; R326-L330 PolarHBondContact O-N 2.98Å
327	Y	86.1	Confident	79.4	Confident	3 Å²	3	54.4 Å²	54.4	1%	0.012	26%	0.263	C	S	.	.	H	α-helix	trans	-66.9	-40.9	175.7	-178.3	-139.1	0	0	0	111.9	V322 V323 E324 F329 L330 K331 S375 L378 Y432 M435 D436	V322-Y327 HydrophobicContact CG1-CD1 4.01Å; V322-Y327 HydrophobicContact CG1-CG 3.91Å; V323-Y327 PolarHBondContact O-N 2.98Å; E324-Y327 PolarHBondContact O-N 3.13Å; E324-Y327 VanDerWaalsContact O-N 3.13Å; Y327-F329 VanDerWaalsContact C-N 3.31Å; Y327-F329 PolarHBondContact O-N 2.86Å; Y327-L330 WeakPolarHBondContact O-CB 3.35Å; Y327-L330 PolarHBondContact O-N 3.36Å; Y327-K331 HydrophobicContact CE2-CG 4.19Å; Y327-K331 WeakPolarHBondContact O-CG 3.24Å; Y327-K331 PolarHBondContact O-N 3.04Å; Y327-K331 WeakPolarHBondContact OH-CE 3.06Å; Y327-S375 WeakPolarHBondContact OH-CB 3.47Å; Y327-S375 PolarHBondContact OH-OG 3.41Å; Y327-L378 HydrophobicContact CE2-CD1 4.12Å; Y327-L378 HydrophobicContact CE2-CG 4.24Å; Y327-Y432 HydrophobicContact CD1-CD1 4.36Å; Y327-Y432 AromaticContact CD2-CD1 3.83Å; Y327-Y432 HydrophobicContact CD2-CD1 3.83Å; Y327-Y432 AromaticContact CD2-CE1 3.92Å; Y327-Y432 HydrophobicContact CD2-CE1 3.92Å; Y327-Y432 HydrophobicContact CE1-CD1 4.08Å; Y327-Y432 AromaticContact CE2-CD1 3.57Å; Y327-Y432 HydrophobicContact CE2-CD1 3.57Å; Y327-Y432 HydrophobicContact CE2-CE1 4.02Å; Y327-Y432 HydrophobicContact CG-CD1 4.25Å; Y327-Y432 HydrophobicContact CG-CE1 4.43Å; Y327-Y432 AromaticContact CZ-CD1 3.7Å; Y327-M435 HydrophobicContact CD1-CB 4.44Å; Y327-M435 HydrophobicContact CE1-CB 4.24Å; Y327-D436 VanDerWaalsContact CE1-OD1 3.26Å; Y327-D436 WeakPolarHBondContact CE1-OD1 3.19Å; Y327-D436 VanDerWaalsContact OH-CG 3.27Å; Y327-D436 PolarHBondContact OH-OD1 3.29Å; Y327-D436 PolarHBondContact OH-OD2 2.76Å
328	V	86.7	Confident	81.6	Confident	35 Å²	35	49.1 Å²	49.1	21%	0.212	23%	0.229	C	C	.	.	H	α-helix	trans	-60.2	-42.8	172.6	175.2	0	0	0	0	110.8	L264 E324 L330 K331 R332	L264-V328 HydrophobicContact CD1-CG1 3.92Å; L264-V328 HydrophobicContact CD2-CG1 4.49Å; E324-V328 HydrophobicContact CG-CG2 4.4Å; E324-V328 WeakPolarHBondContact O-CG2 3.45Å; E324-V328 PolarHBondContact O-N 3.09Å; V328-L330 PolarHBondContact O-N 2.86Å; V328-K331 WeakPolarHBondContact O-CB 3.37Å; V328-K331 PolarHBondContact O-N 2.77Å; V328-R332 WeakPolarHBondContact O-CG 3.34Å; V328-R332 PolarHBondContact O-N 3.37Å
329	F	88.6	Confident	83.7	Confident	0 Å²	0	40.4 Å²	40.4	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-58.2	-46.6	173	168.2	-111.6	0	0	0	112.5	L257 Q263 L264 A301 A305 R325 R326 Y327 K331 R332 L333	L257-F329 HydrophobicContact CD2-CE2 4.04Å; L257-F329 HydrophobicContact CD2-CZ 4.4Å; Q263-F329 HydrophobicContact CB-CD2 3.97Å; Q263-F329 HydrophobicContact CB-CE1 4.44Å; Q263-F329 HydrophobicContact CB-CE2 3.57Å; Q263-F329 HydrophobicContact CB-CZ 3.82Å; Q263-F329 HydrophobicContact CG-CD1 4.12Å; Q263-F329 HydrophobicContact CG-CD2 3.7Å; Q263-F329 HydrophobicContact CG-CE1 4.21Å; Q263-F329 HydrophobicContact CG-CE2 3.8Å; Q263-F329 HydrophobicContact CG-CG 3.85Å; Q263-F329 HydrophobicContact CG-CZ 4.04Å; Q263-F329 WeakPolarHBondContact O-CD2 3.39Å; Q263-F329 VanDerWaalsContact O-CE2 3.28Å; Q263-F329 WeakPolarHBondContact O-CE2 3.25Å; L264-F329 HydrophobicContact CD1-CB 4.4Å; A301-F329 HydrophobicContact CB-CE1 4.4Å; A301-F329 HydrophobicContact CB-CZ 4.05Å; A305-F329 HydrophobicContact CB-CD1 3.94Å; A305-F329 HydrophobicContact CB-CE1 3.93Å; R325-F329 PolarHBondContact O-N 2.86Å; R325-F329 VanDerWaalsContact O-N 3.1Å; R326-F329 WeakPolarHBondContact O-CB 3.45Å; R326-F329 PolarHBondContact O-N 3.15Å; Y327-F329 VanDerWaalsContact C-N 3.31Å; Y327-F329 PolarHBondContact O-N 2.86Å; F329-K331 VanDerWaalsContact C-N 3.3Å; F329-K331 PolarHBondContact O-N 3.4Å; F329-R332 PolarHBondContact O-N 2.9Å; F329-R332 VanDerWaalsContact O-N 3.08Å; F329-L333 HydrophobicContact CE1-CD2 4.23Å; F329-L333 HydrophobicContact CZ-CD2 4.02Å; F329-L333 WeakPolarHBondContact O-CB 3.28Å; F329-L333 PolarHBondContact O-N 3.1Å
330	L	89.4	Confident	85.6	Confident	2 Å²	2	37 Å²	37	1%	0.01	18%	0.175	C	C	.	.	H	α-helix	trans	-57.8	-41.2	175.1	-78.1	171.8	0	0	0	112.3	A305 A309 R326 Y327 V328 R332 L333 C334 F370 L378	A305-L330 HydrophobicContact CB-CD1 4.32Å; A305-L330 HydrophobicContact CB-CD2 3.52Å; A305-L330 HydrophobicContact CB-CG 3.78Å; A309-L330 HydrophobicContact CB-CD1 4.06Å; R326-L330 PolarHBondContact O-N 2.98Å; Y327-L330 WeakPolarHBondContact O-CB 3.35Å; Y327-L330 PolarHBondContact O-N 3.36Å; V328-L330 PolarHBondContact O-N 2.86Å; L330-R332 VanDerWaalsContact C-N 3.34Å; L330-R332 PolarHBondContact O-N 3.26Å; L330-L333 PolarHBondContact O-N 3.12Å; L330-C334 WeakPolarHBondContact O-CB 3.27Å; L330-C334 PolarHBondContact O-N 2.84Å; L330-F370 HydrophobicContact CD2-CE1 4.03Å; L330-F370 HydrophobicContact CD2-CZ 4.24Å; L330-L378 HydrophobicContact CB-CD1 4.18Å
331	K	89.5	Confident	87.2	Confident	33 Å²	33	34 Å²	34	14%	0.143	16%	0.157	C	C	.	.	H	α-helix	trans	-58.9	-45.4	174	-67.4	-178.7	-178.8	178.5	0	111.4	Y327 V328 F329 Q335 F377 L378 D436	Y327-K331 HydrophobicContact CE2-CG 4.19Å; Y327-K331 WeakPolarHBondContact O-CG 3.24Å; Y327-K331 PolarHBondContact O-N 3.04Å; Y327-K331 WeakPolarHBondContact OH-CE 3.06Å; V328-K331 WeakPolarHBondContact O-CB 3.37Å; V328-K331 PolarHBondContact O-N 2.77Å; F329-K331 VanDerWaalsContact C-N 3.3Å; F329-K331 PolarHBondContact O-N 3.4Å; K331-Q335 VanDerWaalsContact O-CG 3.29Å; K331-Q335 WeakPolarHBondContact O-CG 3.42Å; K331-Q335 PolarHBondContact O-N 3.44Å; K331-Q335 VanDerWaalsContact O-N 3.1Å; K331-F377 HydrophobicContact CB-CD1 4.49Å; K331-F377 HydrophobicContact CB-CE1 3.96Å; K331-F377 HydrophobicContact CD-CD1 3.84Å; K331-F377 HydrophobicContact CD-CE1 3.71Å; K331-F377 HydrophobicContact CD-CZ 4.43Å; K331-F377 HydrophobicContact CG-CD1 3.73Å; K331-F377 HydrophobicContact CG-CE1 3.65Å; K331-L378 HydrophobicContact CB-CD2 4.29Å; K331-L378 HydrophobicContact CG-CD2 3.9Å; K331-D436 VanDerWaalsContact CE-OD1 3.26Å; K331-D436 WeakPolarHBondContact CE-OD1 3.43Å; K331-D436 IonicContact NZ-OD1 2.62Å; K331-D436 PolarHBondContact NZ-OD1 2.98Å
332	R	90.6	Very high	88.6	Confident	75 Å²	75	32.2 Å²	32.2	28%	0.283	15%	0.147	S	C	.	.	H	α-helix	trans	-68	-41.3	178.6	-59.3	-38	165.3	-164	-5.2	112.4	L264 S267 E268 V328 F329 L330 C334 Q335 V336	L264-R332 HydrophobicContact CD1-CG 3.88Å; S267-R332 WeakPolarHBondContact OG-CB 3.46Å; E268-R332 HydrophobicContact CG-CG 4.22Å; V328-R332 WeakPolarHBondContact O-CG 3.34Å; V328-R332 PolarHBondContact O-N 3.37Å; F329-R332 PolarHBondContact O-N 2.9Å; F329-R332 VanDerWaalsContact O-N 3.08Å; L330-R332 VanDerWaalsContact C-N 3.34Å; L330-R332 PolarHBondContact O-N 3.26Å; R332-C334 PolarHBondContact O-N 2.97Å; R332-Q335 VanDerWaalsContact CD-OE1 3.25Å; R332-Q335 WeakPolarHBondContact O-CB 3.45Å; R332-Q335 PolarHBondContact O-N 2.79Å; R332-Q335 VanDerWaalsContact O-N 3.17Å; R332-V336 WeakPolarHBondContact O-CG2 3.43Å; R332-V336 PolarHBondContact O-N 3.36Å
333	L	91.6	Very high	89.6	Confident	0 Å²	0	32.3 Å²	32.3	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-64.1	-39.9	177.2	-171	61.5	0	0	0	112.3	L257 I298 A301 A302 F329 L330 Q335 V336 L337 F370	L257-L333 HydrophobicContact CD1-CD1 4.12Å; I298-L333 HydrophobicContact CG2-CD1 4.14Å; A301-L333 HydrophobicContact CB-CD2 3.95Å; A302-L333 HydrophobicContact CB-CD2 3.87Å; F329-L333 HydrophobicContact CE1-CD2 4.23Å; F329-L333 HydrophobicContact CZ-CD2 4.02Å; F329-L333 WeakPolarHBondContact O-CB 3.28Å; F329-L333 PolarHBondContact O-N 3.1Å; L330-L333 PolarHBondContact O-N 3.12Å; L333-Q335 VanDerWaalsContact C-N 3.33Å; L333-Q335 PolarHBondContact O-N 3.44Å; L333-V336 WeakPolarHBondContact O-CB 3.21Å; L333-V336 PolarHBondContact O-N 3.1Å; L333-L337 PolarHBondContact O-N 2.94Å; L333-F370 HydrophobicContact CB-CZ 4.45Å; L333-F370 HydrophobicContact CD2-CZ 4.35Å; L333-F370 HydrophobicContact CG-CZ 4.35Å
334	C	92.8	Very high	90.3	Very high	0 Å²	0	30 Å²	30	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-60.7	-43.3	172.6	-177	0	0	0	0	111.3	L330 R332 V336 L337 C338 F370 L378	L330-C334 WeakPolarHBondContact O-CB 3.27Å; L330-C334 PolarHBondContact O-N 2.84Å; R332-C334 PolarHBondContact O-N 2.97Å; C334-V336 VanDerWaalsContact C-N 3.35Å; C334-V336 PolarHBondContact O-N 3.13Å; C334-L337 PolarHBondContact O-N 3.11Å; C334-C338 PolarHBondContact O-N 3.23Å; C334-C338 PolarHBondContact O-SG 3.27Å; C334-F370 HydrophobicContact CB-CD1 3.74Å; C334-F370 HydrophobicContact CB-CD2 4.47Å; C334-F370 HydrophobicContact CB-CE1 3.79Å; C334-F370 HydrophobicContact CB-CG 4.1Å; C334-F370 HydrophobicContact CB-CZ 4.2Å; C334-L378 HydrophobicContact CB-CD2 3.88Å
335	Q	93.6	Very high	90.9	Very high	52 Å²	52	24.6 Å²	24.6	24%	0.243	11%	0.109	C	C	.	.	H	α-helix	trans	-63.2	-38.1	175	-70.3	173.3	-30.9	0	0	112.4	L271 K331 R332 L333 C338 A339	L271-Q335 HydrophobicContact CD1-CB 3.87Å; L271-Q335 HydrophobicContact CD2-CB 3.82Å; K331-Q335 VanDerWaalsContact O-CG 3.29Å; K331-Q335 WeakPolarHBondContact O-CG 3.42Å; K331-Q335 PolarHBondContact O-N 3.44Å; K331-Q335 VanDerWaalsContact O-N 3.1Å; R332-Q335 VanDerWaalsContact CD-OE1 3.25Å; R332-Q335 WeakPolarHBondContact O-CB 3.45Å; R332-Q335 PolarHBondContact O-N 2.79Å; R332-Q335 VanDerWaalsContact O-N 3.17Å; L333-Q335 VanDerWaalsContact C-N 3.33Å; L333-Q335 PolarHBondContact O-N 3.44Å; Q335-C338 PolarHBondContact O-N 2.91Å; Q335-A339 WeakPolarHBondContact O-CB 3.35Å; Q335-A339 PolarHBondContact O-N 3.35Å
336	V	93.3	Very high	91.3	Very high	1 Å²	1	21.7 Å²	21.7	1%	0.006	11%	0.106	C	C	.	.	H	α-helix	trans	-58.7	-48.4	173.2	165.3	0	0	0	0	110.7	S267 L270 L271 L274 R332 L333 C334 C338 A339 L340	S267-V336 WeakPolarHBondContact O-CG2 3.43Å; L270-V336 HydrophobicContact CB-CG2 4.36Å; L270-V336 HydrophobicContact CD2-CG1 3.64Å; L270-V336 HydrophobicContact CD2-CG2 4.5Å; L270-V336 HydrophobicContact CG-CG1 3.94Å; L270-V336 HydrophobicContact CG-CG2 4.39Å; L271-V336 HydrophobicContact CB-CG2 3.75Å; L274-V336 HydrophobicContact CD1-CG1 3.88Å; R332-V336 WeakPolarHBondContact O-CG2 3.43Å; R332-V336 PolarHBondContact O-N 3.36Å; L333-V336 WeakPolarHBondContact O-CB 3.21Å; L333-V336 PolarHBondContact O-N 3.1Å; C334-V336 VanDerWaalsContact C-N 3.35Å; C334-V336 PolarHBondContact O-N 3.13Å; V336-C338 VanDerWaalsContact C-N 3.33Å; V336-C338 PolarHBondContact O-N 2.84Å; V336-A339 PolarHBondContact O-N 3.2Å; V336-L340 WeakPolarHBondContact O-CB 3.32Å; V336-L340 PolarHBondContact O-N 3.02Å
337	L	93.2	Very high	91.8	Very high	0 Å²	0	18.1 Å²	18.1	0%	0	9%	0.092	C	C	.	.	H	α-helix	trans	-63	-38.6	177.7	-75.4	176	0	0	0	112.5	I298 L333 C334 G341 Y363 A366 F370	I298-L337 HydrophobicContact CG2-CD2 3.6Å; I298-L337 HydrophobicContact CG2-CG 4.11Å; L333-L337 PolarHBondContact O-N 2.94Å; C334-L337 PolarHBondContact O-N 3.11Å; L337-G341 PolarHBondContact O-N 2.81Å; L337-Y363 HydrophobicContact CB-CE2 4.38Å; L337-Y363 HydrophobicContact CD2-CD2 3.9Å; L337-Y363 HydrophobicContact CD2-CE2 3.88Å; L337-Y363 WeakPolarHBondContact O-CE2 3.42Å; L337-Y363 PolarHBondContact O-OH 2.92Å; L337-A366 HydrophobicContact CD1-CB 4.07Å; L337-F370 HydrophobicContact CD1-CD2 3.62Å; L337-F370 HydrophobicContact CD1-CE2 3.43Å; L337-F370 VanDerWaalsContact CD1-CE2 3.43Å
338	C	94.9	Very high	92	Very high	9 Å²	9	18.1 Å²	18.1	6%	0.061	9%	0.093	C	C	.	.	H	α-helix	trans	-65.8	-47.9	175.7	-66.1	0	0	0	0	111.3	C334 Q335 V336 L340 G341 F342 C381 T385	C334-C338 PolarHBondContact O-N 3.23Å; C334-C338 PolarHBondContact O-SG 3.27Å; Q335-C338 PolarHBondContact O-N 2.91Å; V336-C338 VanDerWaalsContact C-N 3.33Å; V336-C338 PolarHBondContact O-N 2.84Å; C338-L340 VanDerWaalsContact C-N 3.31Å; C338-L340 PolarHBondContact O-N 2.84Å; C338-G341 WeakPolarHBondContact O-CA 3.32Å; C338-G341 PolarHBondContact O-N 3.38Å; C338-G341 VanDerWaalsContact O-N 3.08Å; C338-F342 HydrophobicContact CB-CE2 4.48Å; C338-F342 WeakPolarHBondContact O-CD2 2.97Å; C338-F342 PolarHBondContact O-N 3.13Å; C338-C381 PolarHBondContact SG-O 2.93Å; C338-C381 VanDerWaalsContact SG-O 3.35Å; C338-T385 WeakPolarHBondContact CA-OG1 3.43Å; C338-T385 VanDerWaalsContact CB-OG1 3.22Å; C338-T385 WeakPolarHBondContact CB-OG1 3.38Å; C338-T385 PolarHBondContact SG-OG1 3.24Å; C338-T385 VanDerWaalsContact SG-OG1 3.4Å
339	A	93	Very high	91.9	Very high	12 Å²	12	18.6 Å²	18.6	10%	0.099	10%	0.104	C	C	.	.	H	α-helix	trans	-59.2	-42.2	176.1	0	0	0	0	0	111.8	L271 L274 Q335 V336 G341 F342 Q343	L271-A339 HydrophobicContact CD1-CB 3.97Å; L274-A339 HydrophobicContact CB-CB 3.87Å; Q335-A339 WeakPolarHBondContact O-CB 3.35Å; Q335-A339 PolarHBondContact O-N 3.35Å; V336-A339 PolarHBondContact O-N 3.2Å; A339-G341 VanDerWaalsContact C-N 3.33Å; A339-G341 PolarHBondContact O-N 3.22Å; A339-F342 PolarHBondContact O-N 3.3Å; A339-Q343 WeakPolarHBondContact O-CG 3.49Å; A339-Q343 PolarHBondContact O-N 2.94Å
340	L	93.8	Very high	91.5	Very high	1 Å²	1	23 Å²	23	1%	0.005	13%	0.133	C	C	.	.	H	α-helix	trans	-61.6	-40.7	174	-174.5	60.8	0	0	0	111.8	L274 L289 F290 V336 C338 Q343 L344 Y363	L274-L340 HydrophobicContact CD1-CB 4.13Å; L274-L340 HydrophobicContact CD2-CD1 3.98Å; L289-L340 HydrophobicContact CB-CD1 4.15Å; L289-L340 HydrophobicContact CB-CD2 4.28Å; L289-L340 HydrophobicContact CD1-CD1 4.11Å; F290-L340 HydrophobicContact CD2-CD1 4.35Å; F290-L340 HydrophobicContact CE1-CD2 4.35Å; F290-L340 HydrophobicContact CE2-CD1 3.62Å; F290-L340 HydrophobicContact CE2-CD2 4.12Å; F290-L340 HydrophobicContact CE2-CG 3.76Å; F290-L340 HydrophobicContact CZ-CD1 4.09Å; F290-L340 HydrophobicContact CZ-CD2 3.97Å; F290-L340 HydrophobicContact CZ-CG 3.67Å; V336-L340 WeakPolarHBondContact O-CB 3.32Å; V336-L340 PolarHBondContact O-N 3.02Å; C338-L340 VanDerWaalsContact C-N 3.31Å; C338-L340 PolarHBondContact O-N 2.84Å; L340-Q343 PolarHBondContact O-N 3.08Å; L340-L344 PolarHBondContact O-N 2.98Å; L340-Y363 HydrophobicContact CB-CE2 4.48Å; L340-Y363 HydrophobicContact CD2-CD2 4.24Å; L340-Y363 HydrophobicContact CD2-CE2 4.29Å; L340-Y363 HydrophobicContact CG-CE2 4.47Å
341	G	94.3	Very high	91.1	Very high	0 Å²	0	23.2 Å²	23.2	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-62.6	-39.7	174.6	0	0	0	0	0	113.5	L337 C338 A339 L344 C345 Y363	L337-G341 PolarHBondContact O-N 2.81Å; C338-G341 WeakPolarHBondContact O-CA 3.32Å; C338-G341 PolarHBondContact O-N 3.38Å; C338-G341 VanDerWaalsContact O-N 3.08Å; A339-G341 VanDerWaalsContact C-N 3.33Å; A339-G341 PolarHBondContact O-N 3.22Å; G341-L344 WeakPolarHBondContact O-CB 3.44Å; G341-L344 PolarHBondContact O-N 2.97Å; G341-C345 PolarHBondContact O-N 2.83Å; G341-C345 PolarHBondContact O-SG 3.23Å; G341-Y363 WeakPolarHBondContact CA-OH 3.44Å; G341-Y363 PolarHBondContact N-OH 2.97Å
342	F	93.9	Very high	90.2	Very high	81 Å²	81	27.4 Å²	27.4	36%	0.355	17%	0.168	S	C	.	.	H	α-helix	trans	-66.4	-38.2	173.2	-70.6	-60.5	0	0	0	112.5	C338 A339 C345 S346 S388	C338-F342 HydrophobicContact CB-CE2 4.48Å; C338-F342 WeakPolarHBondContact O-CD2 2.97Å; C338-F342 PolarHBondContact O-N 3.13Å; A339-F342 PolarHBondContact O-N 3.3Å; F342-C345 PolarHBondContact O-N 3.46Å; F342-S346 WeakPolarHBondContact O-CB 3.23Å; F342-S346 PolarHBondContact O-N 2.82Å; F342-S346 PolarHBondContact O-OG 3.36Å; F342-S388 WeakPolarHBondContact CE1-OG 3.36Å
343	Q	92.1	Very high	89.6	Confident	11 Å²	11	30.8 Å²	30.8	5%	0.051	19%	0.187	C	C	.	.	H	α-helix	trans	-63.2	-44.3	172.9	-66.7	-63.9	-20.4	0	0	110.8	L274 F286 M287 A339 L340 C345 S346 L347	L274-Q343 HydrophobicContact CD2-CG 4.44Å; L274-Q343 PolarHBondContact O-NE2 2.72Å; F286-Q343 HydrophobicContact CD2-CG 4.49Å; M287-Q343 HydrophobicContact CE-CB 4.31Å; A339-Q343 WeakPolarHBondContact O-CG 3.49Å; A339-Q343 PolarHBondContact O-N 2.94Å; L340-Q343 PolarHBondContact O-N 3.08Å; Q343-C345 PolarHBondContact O-N 2.71Å; Q343-S346 PolarHBondContact O-N 2.69Å; Q343-S346 VanDerWaalsContact O-N 3.17Å; Q343-L347 WeakPolarHBondContact O-CB 3.33Å; Q343-L347 WeakPolarHBondContact O-CD1 3.13Å; Q343-L347 VanDerWaalsContact O-CG 3.26Å; Q343-L347 WeakPolarHBondContact O-CG 3.33Å; Q343-L347 PolarHBondContact O-N 2.91Å
344	L	93.8	Very high	89.4	Confident	0 Å²	0	31.7 Å²	31.7	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-55.6	-51.7	174.7	178.3	69.2	0	0	0	111.6	M287 F290 L340 G341 S346 L347 V348 P357 L360 L389 L395	M287-L344 HydrophobicContact SD-CD1 4.24Å; F290-L344 HydrophobicContact CE1-CD2 4.34Å; F290-L344 HydrophobicContact CE2-CB 4.41Å; F290-L344 HydrophobicContact CE2-CD1 4.33Å; F290-L344 HydrophobicContact CZ-CB 4.01Å; F290-L344 HydrophobicContact CZ-CD1 4.15Å; F290-L344 HydrophobicContact CZ-CD2 4.04Å; F290-L344 HydrophobicContact CZ-CG 4.3Å; L340-L344 PolarHBondContact O-N 2.98Å; G341-L344 WeakPolarHBondContact O-CB 3.44Å; G341-L344 PolarHBondContact O-N 2.97Å; L344-S346 PolarHBondContact O-N 2.77Å; L344-L347 PolarHBondContact O-N 3.43Å; L344-V348 HydrophobicContact CD1-CG2 3.59Å; L344-V348 HydrophobicContact CG-CG2 4.41Å; L344-V348 PolarHBondContact O-N 3.29Å; L344-P357 HydrophobicContact CD1-CG 3.64Å; L344-L360 HydrophobicContact CD2-CD1 3.67Å; L344-L389 HydrophobicContact CD2-CD2 4.17Å; L344-L395 HydrophobicContact CD2-CD1 4.22Å; L344-L395 HydrophobicContact CG-CD1 3.99Å
345	C	93.2	Very high	89.2	Confident	18 Å²	18	39.7 Å²	39.7	12%	0.122	23%	0.23	C	C	.	.	H	α-helix	trans	-64.9	-25.5	179	-65.3	0	0	0	0	113.4	G341 F342 Q343 H392	G341-C345 PolarHBondContact O-N 2.83Å; G341-C345 PolarHBondContact O-SG 3.23Å; F342-C345 PolarHBondContact O-N 3.46Å; Q343-C345 PolarHBondContact O-N 2.71Å; C345-H392 PolarHBondContact O-CD2 3.14Å; C345-H392 VanDerWaalsContact O-CD2 3.3Å; C345-H392 PolarHBondContact O-NE2 2.88Å; C345-H392 VanDerWaalsContact O-NE2 3.16Å
346	S	90.9	Very high	89.1	Confident	48 Å²	48	39.8 Å²	39.8	34%	0.336	23%	0.234	S	C	.	.	H	α-helix	trans	-83.7	-25.8	178.9	-59.4	0	0	0	0	112.8	F342 Q343 L344	F342-S346 WeakPolarHBondContact O-CB 3.23Å; F342-S346 PolarHBondContact O-N 2.82Å; F342-S346 PolarHBondContact O-OG 3.36Å; Q343-S346 PolarHBondContact O-N 2.69Å; Q343-S346 VanDerWaalsContact O-N 3.17Å; L344-S346 PolarHBondContact O-N 2.77Å
347	L	91.9	Very high	89	Confident	0 Å²	0	40.4 Å²	40.4	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-98.6	-44.4	-172.5	-69.3	168.8	0	0	0	112.6	L280 R283 M287 Q343 L344 G349 C351 V354	L280-L347 HydrophobicContact CB-CD2 4.15Å; L280-L347 HydrophobicContact CD2-CD2 4.25Å; L280-L347 WeakPolarHBondContact O-CD2 3.25Å; R283-L347 HydrophobicContact CB-CD1 4.38Å; R283-L347 HydrophobicContact CB-CD2 4.3Å; M287-L347 HydrophobicContact CE-CD1 3.58Å; M287-L347 HydrophobicContact CG-CD1 4.27Å; M287-L347 HydrophobicContact SD-CD1 4.08Å; Q343-L347 WeakPolarHBondContact O-CB 3.33Å; Q343-L347 WeakPolarHBondContact O-CD1 3.13Å; Q343-L347 VanDerWaalsContact O-CG 3.26Å; Q343-L347 WeakPolarHBondContact O-CG 3.33Å; Q343-L347 PolarHBondContact O-N 2.91Å; L344-L347 PolarHBondContact O-N 3.43Å; L347-G349 PolarHBondContact O-N 3.21Å; L347-C351 WeakPolarHBondContact O-CB 3.46Å; L347-C351 PolarHBondContact O-N 2.88Å; L347-V354 HydrophobicContact CB-CG1 4.18Å; L347-V354 HydrophobicContact CB-CG2 4.48Å
348	V	90.9	Very high	88.7	Confident	3 Å²	3	45.7 Å²	45.7	2%	0.018	27%	0.272	C	S	.	.	B	Isolated β-bridge	trans	-71.8	119.9	-177.1	174.6	0	0	0	0	110.3	L344 P350 V354 V356 H392 T394 L395	L344-V348 HydrophobicContact CD1-CG2 3.59Å; L344-V348 HydrophobicContact CG-CG2 4.41Å; L344-V348 PolarHBondContact O-N 3.29Å; V348-P350 WeakPolarHBondContact O-CD 3.17Å; V348-V354 HydrophobicContact CG2-CG1 4.09Å; V348-V356 HydrophobicContact CG1-CG2 4.11Å; V348-H392 PolarHBondContact O-CE1 3.16Å; V348-H392 PolarHBondContact O-NE2 3.16Å; V348-T394 HydrophobicContact CG1-CG2 4.37Å; V348-L395 HydrophobicContact CB-CD2 4.34Å; V348-L395 HydrophobicContact CB-CG 4.48Å; V348-L395 HydrophobicContact CG1-CD2 3.91Å; V348-L395 HydrophobicContact CG1-CG 4.2Å
349	G	84.9	Confident	88.4	Confident	44 Å²	44	46.3 Å²	46.3	45%	0.454	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	105.3	-67.4	-177.9	0	0	0	0	0	112.3	L347 C351	L347-G349 PolarHBondContact O-N 3.21Å; G349-C351 VanDerWaalsContact C-N 3.3Å; G349-C351 PolarHBondContact O-N 3.5Å
350	P	80.5	Confident	88.3	Confident	93 Å²	93	46 Å²	46	60%	0.604	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.8	-34.4	177.3	-25.3	35.2	0	0	0	114	V348	V348-P350 WeakPolarHBondContact O-CD 3.17Å
351	C	79.5	Confident	88.2	Confident	7 Å²	7	48.3 Å²	48.3	5%	0.047	29%	0.286	C	S	.	.	B	Isolated β-bridge	trans	-99.5	109.1	173.4	-70.6	0	0	0	0	110	L347 G349 E353 V354	L347-C351 WeakPolarHBondContact O-CB 3.46Å; L347-C351 PolarHBondContact O-N 2.88Å; G349-C351 VanDerWaalsContact C-N 3.3Å; G349-C351 PolarHBondContact O-N 3.5Å; C351-E353 PolarHBondContact O-N 3.34Å; C351-E353 VanDerWaalsContact O-N 3.09Å; C351-V354 HydrophobicContact CB-CB 4.35Å; C351-V354 HydrophobicContact CB-CG2 3.91Å; C351-V354 PolarHBondContact O-N 3.04Å; C351-V354 VanDerWaalsContact O-N 3.08Å
352	S	72.1	Confident	88	Confident	120 Å²	120	51 Å²	51	84%	0.839	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.2	-20.3	-176.8	56.3	0	0	0	0	115.1
353	E	78.3	Confident	87.9	Confident	146 Å²	146	47.1 Å²	47.1	68%	0.682	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.8	-7.6	180	-64.4	176	-171.8	0	0	113.5	K284 C351	K284-E353 IonicContact NZ-OE2 3.97Å; K284-E353 PolarHBondContact NZ-OE2 2.84Å; C351-E353 PolarHBondContact O-N 3.34Å; C351-E353 VanDerWaalsContact O-N 3.09Å
354	V	86.6	Confident	87.9	Confident	19 Å²	19	46.6 Å²	46.6	12%	0.115	28%	0.278	C	S	.	.			trans	-102	108.7	-178.7	-176.7	0	0	0	0	109.5	K284 M287 L347 V348 C351	K284-V354 HydrophobicContact CD-CG2 4.21Å; K284-V354 HydrophobicContact CG-CG2 3.8Å; M287-V354 HydrophobicContact CG-CG1 3.94Å; M287-V354 HydrophobicContact SD-CG1 4.23Å; L347-V354 HydrophobicContact CB-CG1 4.18Å; L347-V354 HydrophobicContact CB-CG2 4.48Å; V348-V354 HydrophobicContact CG2-CG1 4.09Å; C351-V354 HydrophobicContact CB-CB 4.35Å; C351-V354 HydrophobicContact CB-CG2 3.91Å; C351-V354 PolarHBondContact O-N 3.04Å; C351-V354 VanDerWaalsContact O-N 3.08Å
355	E	88.5	Confident	87.7	Confident	169 Å²	169	51 Å²	51	79%	0.79	30%	0.299	S	S	*	.	P	Polyproline II helix	trans	-84.1	168.4	174.6	-63.3	-173.6	174.2	0	0	112
356	V	90.6	Very high	87.5	Confident	54 Å²	54	50.4 Å²	50.4	33%	0.327	29%	0.294	S	S	.	.	P	Polyproline II helix	trans	-66.1	127.4	174	-179.4	0	0	0	0	109.1	V348 L360 L395 V398	V348-V356 HydrophobicContact CG1-CG2 4.11Å; V356-L360 HydrophobicContact CG1-CD2 3.78Å; V356-L395 HydrophobicContact CG1-CD2 4.43Å; V356-L395 HydrophobicContact CG2-CD2 4.24Å; V356-V398 HydrophobicContact CG1-CG1 4.32Å; V356-V398 HydrophobicContact CG1-CG2 4.33Å; V356-V398 HydrophobicContact CG2-CG2 4.09Å
357	P	91.4	Very high	87.6	Confident	13 Å²	13	48.1 Å²	48.1	8%	0.084	28%	0.278	C	S	.	.	P	Polyproline II helix	trans	-63.2	143.1	-177.5	-22.6	32.3	0	0	0	113.2	F290 L344 N359 L360	F290-P357 HydrophobicContact CB-CB 3.58Å; F290-P357 HydrophobicContact CB-CG 4.19Å; F290-P357 HydrophobicContact CD1-CB 3.96Å; F290-P357 HydrophobicContact CD1-CG 4.11Å; F290-P357 HydrophobicContact CD2-CB 4.29Å; F290-P357 HydrophobicContact CD2-CG 3.94Å; F290-P357 HydrophobicContact CE1-CG 4.47Å; F290-P357 HydrophobicContact CE2-CG 4.32Å; F290-P357 HydrophobicContact CG-CB 3.7Å; F290-P357 HydrophobicContact CG-CG 3.82Å; L344-P357 HydrophobicContact CD1-CG 3.64Å; P357-N359 PolarHBondContact O-N 3.4Å; P357-L360 WeakPolarHBondContact O-CB 3.4Å; P357-L360 PolarHBondContact O-N 3.06Å
358	P	86.9	Confident	87.6	Confident	112 Å²	112	49.3 Å²	49.3	73%	0.727	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.3	-34.3	-177.1	26.1	-34.2	0	0	0	113.1	L360	P358-L360 VanDerWaalsContact C-N 3.27Å; P358-L360 PolarHBondContact O-N 2.88Å
359	N	89.1	Confident	87.6	Confident	22 Å²	22	51.5 Å²	51.5	12%	0.118	30%	0.304	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.1	28.5	177.7	-65.8	-54.3	0	0	0	113.2	F290 D292 I295 P357 T361 K362 Y363	F290-N359 VanDerWaalsContact O-CB 3.27Å; F290-N359 WeakPolarHBondContact O-CB 3.4Å; F290-N359 PolarHBondContact O-ND2 2.59Å; D292-N359 PolarHBondContact N-ND2 2.97Å; D292-N359 PolarHBondContact OD1-ND2 3.31Å; D292-N359 PolarHBondContact OD1-OD1 3.42Å; D292-N359 VanDerWaalsContact OD1-OD1 3.14Å; I295-N359 HydrophobicContact CG2-CB 4.14Å; P357-N359 PolarHBondContact O-N 3.4Å; N359-T361 PolarHBondContact O-N 2.88Å; N359-K362 HydrophobicContact CB-CD 4.3Å; N359-K362 PolarHBondContact O-N 3.43Å; N359-Y363 PolarHBondContact O-N 3.23Å
360	L	91.6	Very high	88	Confident	5 Å²	5	49.8 Å²	49.8	3%	0.026	28%	0.284	C	S	.	.	H	α-helix	trans	-55.2	-35.4	175.6	-176.5	62.1	0	0	0	111.4	L344 V356 P357 P358 Y363 T364 V398 V400 V401	L344-L360 HydrophobicContact CD2-CD1 3.67Å; V356-L360 HydrophobicContact CG1-CD2 3.78Å; P357-L360 WeakPolarHBondContact O-CB 3.4Å; P357-L360 PolarHBondContact O-N 3.06Å; P358-L360 VanDerWaalsContact C-N 3.27Å; P358-L360 PolarHBondContact O-N 2.88Å; L360-Y363 HydrophobicContact CD1-CD1 4.03Å; L360-Y363 WeakPolarHBondContact O-CB 3.42Å; L360-Y363 PolarHBondContact O-N 3.48Å; L360-T364 HydrophobicContact CD1-CG2 4.2Å; L360-T364 HydrophobicContact CG-CG2 4.27Å; L360-T364 PolarHBondContact O-N 2.97Å; L360-T364 PolarHBondContact O-OG1 3.23Å; L360-T364 VanDerWaalsContact O-OG1 3.07Å; L360-V398 HydrophobicContact CD2-CG1 4.06Å; L360-V400 HydrophobicContact CG-CG1 4.48Å; L360-V401 HydrophobicContact CD2-CG2 3.88Å
361	T	91	Very high	88.6	Confident	49 Å²	49	45.4 Å²	45.4	30%	0.301	26%	0.255	S	S	.	.	H	α-helix	trans	-56.9	-51.7	176.9	-47.8	0	0	0	0	112.5	N359 Y363 T364 E365 V400	N359-T361 PolarHBondContact O-N 2.88Å; T361-Y363 VanDerWaalsContact C-N 3.27Å; T361-Y363 PolarHBondContact O-N 3.36Å; T361-T364 WeakPolarHBondContact CA-OG1 3.23Å; T361-T364 PolarHBondContact O-N 3.43Å; T361-T364 PolarHBondContact O-OG1 3.23Å; T361-E365 HydrophobicContact CG2-CG 4.49Å; T361-E365 WeakPolarHBondContact O-CB 3.28Å; T361-E365 VanDerWaalsContact O-CG 3.28Å; T361-E365 WeakPolarHBondContact O-CG 3.28Å; T361-E365 PolarHBondContact O-N 3.18Å; T361-V400 HydrophobicContact CG2-CG1 4.31Å; T361-V400 WeakPolarHBondContact OG1-CG2 3.28Å
362	K	89.4	Confident	89.2	Confident	56 Å²	56	48.5 Å²	48.5	24%	0.243	27%	0.274	C	S	.	.	H	α-helix	trans	-60.7	-38.7	178.8	-65.4	179	-176.8	168.5	0	111.7	D292 I295 L299 N359 A366	D292-K362 IonicContact OD1-NZ 3.01Å; D292-K362 PolarHBondContact OD1-NZ 3.43Å; I295-K362 HydrophobicContact CG1-CB 4.03Å; I295-K362 HydrophobicContact CG2-CB 4.37Å; I295-K362 HydrophobicContact CG2-CD 3.84Å; L299-K362 HydrophobicContact CD1-CB 4.46Å; N359-K362 HydrophobicContact CB-CD 4.3Å; N359-K362 PolarHBondContact O-N 3.43Å; K362-A366 WeakPolarHBondContact O-CB 3.4Å; K362-A366 PolarHBondContact O-N 3.4Å
363	Y	92.8	Very high	90.1	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-64.4	-48.6	175.9	167.5	-97.7	0	0	0	111.9	F290 I295 L337 L340 G341 N359 L360 T361 E365 A366 L367 L389	F290-Y363 HydrophobicContact CD1-CG 4.38Å; F290-Y363 HydrophobicContact CE1-CD1 4.06Å; F290-Y363 AromaticContact CE1-CD2 3.87Å; F290-Y363 HydrophobicContact CE1-CD2 3.87Å; F290-Y363 AromaticContact CE1-CG 3.61Å; F290-Y363 HydrophobicContact CE1-CG 3.61Å; F290-Y363 HydrophobicContact CZ-CD2 4.45Å; F290-Y363 HydrophobicContact CZ-CG 4.48Å; I295-Y363 HydrophobicContact CD1-CD2 4.45Å; L337-Y363 HydrophobicContact CB-CE2 4.38Å; L337-Y363 HydrophobicContact CD2-CD2 3.9Å; L337-Y363 HydrophobicContact CD2-CE2 3.88Å; L337-Y363 WeakPolarHBondContact O-CE2 3.42Å; L337-Y363 PolarHBondContact O-OH 2.92Å; L340-Y363 HydrophobicContact CB-CE2 4.48Å; L340-Y363 HydrophobicContact CD2-CD2 4.24Å; L340-Y363 HydrophobicContact CD2-CE2 4.29Å; L340-Y363 HydrophobicContact CG-CE2 4.47Å; G341-Y363 WeakPolarHBondContact CA-OH 3.44Å; G341-Y363 PolarHBondContact N-OH 2.97Å; N359-Y363 PolarHBondContact O-N 3.23Å; L360-Y363 HydrophobicContact CD1-CD1 4.03Å; L360-Y363 WeakPolarHBondContact O-CB 3.42Å; L360-Y363 PolarHBondContact O-N 3.48Å; T361-Y363 VanDerWaalsContact C-N 3.27Å; T361-Y363 PolarHBondContact O-N 3.36Å; Y363-E365 VanDerWaalsContact C-N 3.32Å; Y363-E365 PolarHBondContact O-N 3.16Å; Y363-A366 PolarHBondContact O-N 3.08Å; Y363-L367 HydrophobicContact CE1-CD2 4.34Å; Y363-L367 PolarHBondContact O-N 2.8Å; Y363-L389 HydrophobicContact CE1-CD1 4.42Å
364	T	92.5	Very high	90.6	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-67.7	-33.6	-179.3	50	0	0	0	0	112.3	L360 T361 L367 L368 W386 M404	L360-T364 HydrophobicContact CD1-CG2 4.2Å; L360-T364 HydrophobicContact CG-CG2 4.27Å; L360-T364 PolarHBondContact O-N 2.97Å; L360-T364 PolarHBondContact O-OG1 3.23Å; L360-T364 VanDerWaalsContact O-OG1 3.07Å; T361-T364 WeakPolarHBondContact CA-OG1 3.23Å; T361-T364 PolarHBondContact O-N 3.43Å; T361-T364 PolarHBondContact O-OG1 3.23Å; T364-L367 PolarHBondContact O-N 3.23Å; T364-L368 WeakPolarHBondContact O-CB 3.41Å; T364-L368 PolarHBondContact O-N 3.37Å; T364-W386 HydrophobicContact CG2-CH2 4.47Å; T364-M404 HydrophobicContact CG2-CG 4.44Å
365	E	89.8	Confident	90.9	Very high	94 Å²	94	37.3 Å²	37.3	44%	0.439	21%	0.211	S	C	.	.	H	α-helix	trans	-63.8	-45	171.8	-74.7	171.3	176.1	0	0	111.5	T361 Y363 L367 L368 A369 M404	T361-E365 HydrophobicContact CG2-CG 4.49Å; T361-E365 WeakPolarHBondContact O-CB 3.28Å; T361-E365 VanDerWaalsContact O-CG 3.28Å; T361-E365 WeakPolarHBondContact O-CG 3.28Å; T361-E365 PolarHBondContact O-N 3.18Å; Y363-E365 VanDerWaalsContact C-N 3.32Å; Y363-E365 PolarHBondContact O-N 3.16Å; E365-L367 VanDerWaalsContact C-N 3.34Å; E365-L367 PolarHBondContact O-N 2.82Å; E365-L368 PolarHBondContact O-N 3.41Å; E365-A369 PolarHBondContact O-N 3.18Å; E365-M404 HydrophobicContact CG-CE 3.95Å
366	A	88.9	Confident	91.2	Very high	4 Å²	4	29.5 Å²	29.5	3%	0.033	17%	0.174	C	C	.	.	H	α-helix	trans	-62.1	-42.6	175.4	0	0	0	0	0	111.7	L299 L337 K362 Y363 A369 F370	L299-A366 HydrophobicContact CD1-CB 4.3Å; L337-A366 HydrophobicContact CD1-CB 4.07Å; K362-A366 WeakPolarHBondContact O-CB 3.4Å; K362-A366 PolarHBondContact O-N 3.4Å; Y363-A366 PolarHBondContact O-N 3.08Å; A366-A369 WeakPolarHBondContact O-CB 3.45Å; A366-A369 PolarHBondContact O-N 3.16Å; A366-F370 WeakPolarHBondContact O-CD2 3.35Å; A366-F370 PolarHBondContact O-N 2.94Å
367	L	93.1	Very high	91.3	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-63.6	-42	176.7	-171.6	65	0	0	0	111.3	Y363 T364 E365 A369 F370 T371 T382 T385 W386 L389	Y363-L367 HydrophobicContact CE1-CD2 4.34Å; Y363-L367 PolarHBondContact O-N 2.8Å; T364-L367 PolarHBondContact O-N 3.23Å; E365-L367 VanDerWaalsContact C-N 3.34Å; E365-L367 PolarHBondContact O-N 2.82Å; L367-A369 VanDerWaalsContact C-N 3.33Å; L367-A369 PolarHBondContact O-N 3.42Å; L367-F370 PolarHBondContact O-N 2.83Å; L367-T371 PolarHBondContact O-N 3.48Å; L367-T371 VanDerWaalsContact O-N 3.11Å; L367-T371 PolarHBondContact O-OG1 3.18Å; L367-T371 VanDerWaalsContact O-OG1 3.1Å; L367-T382 HydrophobicContact CD1-CG2 3.75Å; L367-T385 HydrophobicContact CD2-CG2 3.97Å; L367-W386 HydrophobicContact CB-CZ2 3.97Å; L367-W386 HydrophobicContact CD2-CD2 3.84Å; L367-W386 HydrophobicContact CD2-CE3 4.28Å; L367-W386 HydrophobicContact CD2-CG 4.34Å; L367-W386 HydrophobicContact CD2-CH2 4.18Å; L367-W386 HydrophobicContact CD2-CZ2 3.72Å; L367-W386 HydrophobicContact CD2-CZ3 4.43Å; L367-W386 HydrophobicContact CG-CD2 4.48Å; L367-W386 HydrophobicContact CG-CZ2 3.77Å; L367-L389 HydrophobicContact CD2-CD1 4.02Å
368	L	92.3	Very high	91.3	Very high	25 Å²	25	28.7 Å²	28.7	13%	0.131	17%	0.166	C	C	.	.	H	α-helix	trans	-63.7	-38.3	176.8	-174.8	64.9	0	0	0	111.7	T364 E365 F370 T371 T372 W386 M404 E407 V411	T364-L368 WeakPolarHBondContact O-CB 3.41Å; T364-L368 PolarHBondContact O-N 3.37Å; E365-L368 PolarHBondContact O-N 3.41Å; L368-F370 VanDerWaalsContact C-N 3.3Å; L368-F370 PolarHBondContact O-N 3.01Å; L368-T371 CarbonylContact O-C 3.58Å; L368-T371 WeakPolarHBondContact O-CA 3.46Å; L368-T371 WeakPolarHBondContact O-CB 3.47Å; L368-T371 PolarHBondContact O-N 2.9Å; L368-T372 HydrophobicContact CD1-CG2 4.5Å; L368-T372 HydrophobicContact CG-CG2 4.49Å; L368-T372 PolarHBondContact O-N 2.72Å; L368-T372 PolarHBondContact O-OG1 2.86Å; L368-W386 HydrophobicContact CB-CZ2 4.17Å; L368-M404 HydrophobicContact CD2-SD 3.98Å; L368-E407 HydrophobicContact CD2-CB 3.99Å; L368-V411 HydrophobicContact CD1-CG2 4.28Å
369	A	90.3	Very high	91.6	Very high	50 Å²	50	24.3 Å²	24.3	41%	0.413	14%	0.135	S	C	.	.	H	α-helix	trans	-56.8	-43.2	175.9	0	0	0	0	0	111.8	E365 A366 L367 T372 H373	E365-A369 PolarHBondContact O-N 3.18Å; A366-A369 WeakPolarHBondContact O-CB 3.45Å; A366-A369 PolarHBondContact O-N 3.16Å; L367-A369 VanDerWaalsContact C-N 3.33Å; L367-A369 PolarHBondContact O-N 3.42Å; A369-T372 WeakPolarHBondContact CA-OG1 3.48Å; A369-T372 PolarHBondContact O-N 3.23Å; A369-T372 PolarHBondContact O-OG1 3.38Å; A369-H373 PolarHBondContact O-N 3.3Å
370	F	91.8	Very high	91.9	Very high	8 Å²	8	24.2 Å²	24.2	4%	0.035	14%	0.136	C	C	.	.	H	α-helix	trans	-67.1	-34.2	173.2	-77.8	-72.9	0	0	0	113	A302 L330 L333 C334 L337 A366 L367 L368 T372 H373 L378 T382	A302-F370 HydrophobicContact CB-CE2 3.8Å; A302-F370 HydrophobicContact CB-CZ 3.89Å; L330-F370 HydrophobicContact CD2-CE1 4.03Å; L330-F370 HydrophobicContact CD2-CZ 4.24Å; L333-F370 HydrophobicContact CB-CZ 4.45Å; L333-F370 HydrophobicContact CD2-CZ 4.35Å; L333-F370 HydrophobicContact CG-CZ 4.35Å; C334-F370 HydrophobicContact CB-CD1 3.74Å; C334-F370 HydrophobicContact CB-CD2 4.47Å; C334-F370 HydrophobicContact CB-CE1 3.79Å; C334-F370 HydrophobicContact CB-CG 4.1Å; C334-F370 HydrophobicContact CB-CZ 4.2Å; L337-F370 HydrophobicContact CD1-CD2 3.62Å; L337-F370 HydrophobicContact CD1-CE2 3.43Å; L337-F370 VanDerWaalsContact CD1-CE2 3.43Å; A366-F370 WeakPolarHBondContact O-CD2 3.35Å; A366-F370 PolarHBondContact O-N 2.94Å; L367-F370 PolarHBondContact O-N 2.83Å; L368-F370 VanDerWaalsContact C-N 3.3Å; L368-F370 PolarHBondContact O-N 3.01Å; F370-T372 VanDerWaalsContact C-N 3.28Å; F370-T372 PolarHBondContact O-N 3.38Å; F370-H373 PolarHBondContact O-N 3.35Å; F370-L378 HydrophobicContact CD1-CB 4.37Å; F370-L378 HydrophobicContact CD1-CD1 4.06Å; F370-L378 HydrophobicContact CD1-CD2 4.46Å; F370-L378 HydrophobicContact CE1-CD1 4.22Å; F370-T382 HydrophobicContact CB-CG2 3.72Å
371	T	93.3	Very high	92	Very high	0 Å²	0	25.2 Å²	25.2	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-67.4	-27.5	174	-54.9	0	0	0	0	112.8	L367 L368 K379 T382 W386 Y408 V411 N415	L367-T371 PolarHBondContact O-N 3.48Å; L367-T371 VanDerWaalsContact O-N 3.11Å; L367-T371 PolarHBondContact O-OG1 3.18Å; L367-T371 VanDerWaalsContact O-OG1 3.1Å; L368-T371 CarbonylContact O-C 3.58Å; L368-T371 WeakPolarHBondContact O-CA 3.46Å; L368-T371 WeakPolarHBondContact O-CB 3.47Å; L368-T371 PolarHBondContact O-N 2.9Å; T371-K379 WeakPolarHBondContact O-CG 3.29Å; T371-T382 WeakPolarHBondContact OG1-CB 3.39Å; T371-T382 PolarHBondContact OG1-OG1 2.91Å; T371-W386 PolarHBondContact OG1-NE1 3.3Å; T371-Y408 HydrophobicContact CG2-CD2 3.99Å; T371-Y408 HydrophobicContact CG2-CE2 3.57Å; T371-V411 HydrophobicContact CG2-CG1 4.2Å; T371-N415 PolarHBondContact O-ND2 3.27Å
372	T	92	Very high	92.2	Very high	73 Å²	73	22.9 Å²	22.9	45%	0.448	13%	0.129	S	C	.	.	H	α-helix	trans	-93.7	-10.9	177.4	54.5	0	0	0	0	114.3	L368 A369 F370 V411	L368-T372 HydrophobicContact CD1-CG2 4.5Å; L368-T372 HydrophobicContact CG-CG2 4.49Å; L368-T372 PolarHBondContact O-N 2.72Å; L368-T372 PolarHBondContact O-OG1 2.86Å; A369-T372 WeakPolarHBondContact CA-OG1 3.48Å; A369-T372 PolarHBondContact O-N 3.23Å; A369-T372 PolarHBondContact O-OG1 3.38Å; F370-T372 VanDerWaalsContact C-N 3.28Å; F370-T372 PolarHBondContact O-N 3.38Å; T372-V411 HydrophobicContact CG2-CB 4.37Å; T372-V411 HydrophobicContact CG2-CG1 3.78Å; T372-V411 HydrophobicContact CG2-CG2 3.58Å
373	H	90.9	Very high	92.5	Very high	13 Å²	13	20.3 Å²	20.3	6%	0.06	12%	0.118	C	C	.	.	S	Bend	trans	-64.6	150.9	-175.6	178.8	-83.2	0	0	0	112.7	D306 A369 F370 S375 K379 Y432	D306-H373 IonicContact OD1-CD2 2.97Å; D306-H373 PolarHBondContact OD1-CD2 2.86Å; D306-H373 IonicContact OD1-NE2 3.87Å; D306-H373 PolarHBondContact OD1-NE2 3.24Å; A369-H373 PolarHBondContact O-N 3.3Å; F370-H373 PolarHBondContact O-N 3.35Å; H373-S375 PolarHBondContact CE1-N 3.13Å; H373-S375 WeakPolarHBondContact ND1-CB 3.43Å; H373-S375 PolarHBondContact ND1-N 3.26Å; H373-S375 PolarHBondContact O-N 3.32Å; H373-K379 WeakPolarHBondContact O-CE 3.37Å; H373-K379 WeakPolarHBondContact O-CG 3.31Å; H373-Y432 AromaticContact CE1-CE1 3.78Å; H373-Y432 AromaticContact CE1-CZ 3.61Å; H373-Y432 AromaticContact NE2-CZ 3.92Å
374	S	90.6	Very high	92.6	Very high	37 Å²	37	22.9 Å²	22.9	26%	0.259	14%	0.136	S	C	.	.	S	Bend	trans	-65.2	-31.7	-174.8	-56	0	0	0	0	115.2	Q376 S429	S374-Q376 PolarHBondContact O-N 3.32Å; S374-S429 WeakPolarHBondContact O-CA 3.26Å; S374-S429 WeakPolarHBondContact O-CB 3.45Å; S374-S429 PolarHBondContact O-OG 3.19Å
375	S	92.2	Very high	92.7	Very high	0 Å²	0	22.9 Å²	22.9	0%	0	14%	0.136	C	C	.	.			trans	-60.8	122.4	174.5	163.8	0	0	0	0	112.9	Y327 H373 F377 L378 K379	Y327-S375 WeakPolarHBondContact OH-CB 3.47Å; Y327-S375 PolarHBondContact OH-OG 3.41Å; H373-S375 PolarHBondContact CE1-N 3.13Å; H373-S375 WeakPolarHBondContact ND1-CB 3.43Å; H373-S375 PolarHBondContact ND1-N 3.26Å; H373-S375 PolarHBondContact O-N 3.32Å; S375-F377 VanDerWaalsContact C-N 3.31Å; S375-F377 PolarHBondContact O-N 2.81Å; S375-F377 PolarHBondContact OG-N 3.24Å; S375-L378 PolarHBondContact O-N 3.33Å; S375-L378 PolarHBondContact OG-N 2.89Å; S375-L378 VanDerWaalsContact OG-N 3.17Å; S375-K379 WeakPolarHBondContact O-CG 3.43Å; S375-K379 PolarHBondContact O-N 3.38Å
376	Q	93.7	Very high	93	Very high	4 Å²	4	18.4 Å²	18.4	2%	0.019	12%	0.115	C	C	.	.	H	α-helix	trans	-65.2	-33.3	176.1	-168.8	58.3	31.4	0	0	112.7	S374 S380 F443 F446 F447	S374-Q376 PolarHBondContact O-N 3.32Å; Q376-S380 WeakPolarHBondContact O-CB 3.28Å; Q376-S380 PolarHBondContact O-N 3.36Å; Q376-S380 VanDerWaalsContact O-N 3.1Å; Q376-F443 HydrophobicContact CB-CE2 4.19Å; Q376-F443 HydrophobicContact CG-CE2 3.99Å; Q376-F446 HydrophobicContact CG-CD1 4.26Å; Q376-F446 HydrophobicContact CG-CE1 4.08Å; Q376-F447 HydrophobicContact CG-CD2 4.24Å
377	F	92.9	Very high	93.4	Very high	51 Å²	51	18.7 Å²	18.7	22%	0.224	12%	0.117	C	C	.	.	H	α-helix	trans	-64.7	-45.6	175.9	178.5	-90	0	0	0	111.9	K331 S375 S380 C381 D436 F446	K331-F377 HydrophobicContact CB-CD1 4.49Å; K331-F377 HydrophobicContact CB-CE1 3.96Å; K331-F377 HydrophobicContact CD-CD1 3.84Å; K331-F377 HydrophobicContact CD-CE1 3.71Å; K331-F377 HydrophobicContact CD-CZ 4.43Å; K331-F377 HydrophobicContact CG-CD1 3.73Å; K331-F377 HydrophobicContact CG-CE1 3.65Å; S375-F377 VanDerWaalsContact C-N 3.31Å; S375-F377 PolarHBondContact O-N 2.81Å; S375-F377 PolarHBondContact OG-N 3.24Å; F377-S380 PolarHBondContact O-N 3.01Å; F377-C381 WeakPolarHBondContact CE1-SG 3.29Å; F377-C381 PolarHBondContact O-N 3.1Å; F377-C381 PolarHBondContact O-SG 3.24Å; F377-D436 WeakPolarHBondContact CB-OD2 3.33Å; F377-F446 HydrophobicContact CD2-CZ 4.47Å
378	L	92.4	Very high	93.5	Very high	0 Å²	0	20 Å²	20	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-64.6	-42	-179.9	-65.8	-176.6	0	0	0	111.6	Y327 L330 K331 C334 F370 S375 S380 C381	Y327-L378 HydrophobicContact CE2-CD1 4.12Å; Y327-L378 HydrophobicContact CE2-CG 4.24Å; L330-L378 HydrophobicContact CB-CD1 4.18Å; K331-L378 HydrophobicContact CB-CD2 4.29Å; K331-L378 HydrophobicContact CG-CD2 3.9Å; C334-L378 HydrophobicContact CB-CD2 3.88Å; F370-L378 HydrophobicContact CD1-CB 4.37Å; F370-L378 HydrophobicContact CD1-CD1 4.06Å; F370-L378 HydrophobicContact CD1-CD2 4.46Å; F370-L378 HydrophobicContact CE1-CD1 4.22Å; S375-L378 PolarHBondContact O-N 3.33Å; S375-L378 PolarHBondContact OG-N 2.89Å; S375-L378 VanDerWaalsContact OG-N 3.17Å; L378-S380 VanDerWaalsContact C-N 3.33Å; L378-S380 PolarHBondContact O-N 3.44Å; L378-C381 PolarHBondContact O-N 3.25Å
379	K	93.6	Very high	93.6	Very high	19 Å²	19	18.9 Å²	18.9	8%	0.083	12%	0.121	C	C	.	.	H	α-helix	trans	-55	-51.1	172.6	-63.7	-179.1	-175	-168.3	0	111	T371 H373 S375 C381 T382 N415 Y450	T371-K379 WeakPolarHBondContact O-CG 3.29Å; H373-K379 WeakPolarHBondContact O-CE 3.37Å; H373-K379 WeakPolarHBondContact O-CG 3.31Å; S375-K379 WeakPolarHBondContact O-CG 3.43Å; S375-K379 PolarHBondContact O-N 3.38Å; K379-C381 VanDerWaalsContact C-N 3.34Å; K379-C381 PolarHBondContact O-N 3.23Å; K379-T382 PolarHBondContact O-N 3.17Å; K379-T382 VanDerWaalsContact O-N 3.16Å; K379-T382 PolarHBondContact O-OG1 3.35Å; K379-N415 WeakPolarHBondContact CD-OD1 3.17Å; K379-N415 WeakPolarHBondContact CE-OD1 3.36Å; K379-N415 PolarHBondContact NZ-OD1 3.23Å; K379-Y450 HydrophobicContact CB-CE2 4.14Å
380	S	94.8	Very high	93.9	Very high	20 Å²	20	16.5 Å²	16.5	14%	0.14	10%	0.101	C	C	.	.	H	α-helix	trans	-59.3	-40.8	-178	-172.2	0	0	0	0	113.2	Q376 F377 L378 T382 V383 F446 Y450	Q376-S380 WeakPolarHBondContact O-CB 3.28Å; Q376-S380 PolarHBondContact O-N 3.36Å; Q376-S380 VanDerWaalsContact O-N 3.1Å; F377-S380 PolarHBondContact O-N 3.01Å; L378-S380 VanDerWaalsContact C-N 3.33Å; L378-S380 PolarHBondContact O-N 3.44Å; S380-T382 PolarHBondContact O-N 3.36Å; S380-V383 PolarHBondContact O-N 3.02Å; S380-F446 WeakPolarHBondContact OG-CZ 3.39Å; S380-Y450 VanDerWaalsContact CA-CD2 3.49Å
381	C	93.5	Very high	94	Very high	26 Å²	26	23.4 Å²	23.4	18%	0.176	13%	0.127	C	C	.	.	H	α-helix	trans	-56.6	-35.4	177.5	-70.3	0	0	0	0	113.2	C338 F377 L378 K379	C338-C381 PolarHBondContact SG-O 2.93Å; C338-C381 VanDerWaalsContact SG-O 3.35Å; F377-C381 WeakPolarHBondContact CE1-SG 3.29Å; F377-C381 PolarHBondContact O-N 3.1Å; F377-C381 PolarHBondContact O-SG 3.24Å; L378-C381 PolarHBondContact O-N 3.25Å; K379-C381 VanDerWaalsContact C-N 3.34Å; K379-C381 PolarHBondContact O-N 3.23Å
382	T	95.4	Very high	94.1	Very high	0 Å²	0	24.7 Å²	24.7	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-77.5	-20.5	-175.6	66.4	0	0	0	0	114.4	L367 F370 T371 K379 S380 S384 T385 W386	L367-T382 HydrophobicContact CD1-CG2 3.75Å; F370-T382 HydrophobicContact CB-CG2 3.72Å; T371-T382 WeakPolarHBondContact OG1-CB 3.39Å; T371-T382 PolarHBondContact OG1-OG1 2.91Å; K379-T382 PolarHBondContact O-N 3.17Å; K379-T382 VanDerWaalsContact O-N 3.16Å; K379-T382 PolarHBondContact O-OG1 3.35Å; S380-T382 PolarHBondContact O-N 3.36Å; T382-S384 PolarHBondContact O-N 2.94Å; T382-T385 PolarHBondContact O-N 3.46Å; T382-W386 VanDerWaalsContact O-CD1 3.24Å; T382-W386 PolarHBondContact O-N 3.21Å; T382-W386 VanDerWaalsContact O-N 3.08Å
383	V	95.5	Very high	94	Very high	2 Å²	2	28.8 Å²	28.8	1%	0.012	15%	0.147	C	C	.	.	H	α-helix	trans	-60.2	-45.9	-169.1	177.7	0	0	0	0	112.3	S380 T385 W386 A387 Y450 Q453 V457	S380-V383 PolarHBondContact O-N 3.02Å; V383-T385 VanDerWaalsContact C-N 3.33Å; V383-T385 PolarHBondContact O-N 3.33Å; V383-W386 PolarHBondContact O-N 2.87Å; V383-A387 WeakPolarHBondContact O-CB 3.44Å; V383-A387 PolarHBondContact O-N 3.41Å; V383-Y450 HydrophobicContact CG2-CD2 3.94Å; V383-Y450 HydrophobicContact CG2-CE2 3.49Å; V383-Y450 VanDerWaalsContact CG2-CE2 3.49Å; V383-Q453 HydrophobicContact CG1-CB 4.02Å; V383-V457 HydrophobicContact CG1-CG2 3.66Å
384	S	94	Very high	94	Very high	55 Å²	55	31.2 Å²	31.2	39%	0.385	16%	0.162	S	C	.	.	H	α-helix	trans	-66.7	-33.7	-178.4	59.7	0	0	0	0	113.1	T382 S388	T382-S384 PolarHBondContact O-N 2.94Å; S384-S388 PolarHBondContact O-N 2.93Å; S384-S388 PolarHBondContact O-OG 3.22Å
385	T	95.8	Very high	94.2	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-68	-47.1	175	-52.7	0	0	0	0	110.6	C338 L367 T382 V383 A387 S388 L389	C338-T385 WeakPolarHBondContact CA-OG1 3.43Å; C338-T385 VanDerWaalsContact CB-OG1 3.22Å; C338-T385 WeakPolarHBondContact CB-OG1 3.38Å; C338-T385 PolarHBondContact SG-OG1 3.24Å; C338-T385 VanDerWaalsContact SG-OG1 3.4Å; L367-T385 HydrophobicContact CD2-CG2 3.97Å; T382-T385 PolarHBondContact O-N 3.46Å; V383-T385 VanDerWaalsContact C-N 3.33Å; V383-T385 PolarHBondContact O-N 3.33Å; T385-A387 PolarHBondContact O-N 3.46Å; T385-S388 WeakPolarHBondContact O-CB 3.22Å; T385-S388 PolarHBondContact O-N 3.11Å; T385-S388 VanDerWaalsContact O-N 3.12Å; T385-L389 HydrophobicContact CG2-CD1 4.35Å; T385-L389 WeakPolarHBondContact O-CG 3.44Å; T385-L389 PolarHBondContact O-N 2.99Å
386	W	96.9	Very high	94.2	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-60	-44.2	173.7	-76.5	119.2	0	0	0	112.3	T364 L367 L368 T371 T382 V383 S388 L389 F390 M404 Y408 V457	T364-W386 HydrophobicContact CG2-CH2 4.47Å; L367-W386 HydrophobicContact CB-CZ2 3.97Å; L367-W386 HydrophobicContact CD2-CD2 3.84Å; L367-W386 HydrophobicContact CD2-CE3 4.28Å; L367-W386 HydrophobicContact CD2-CG 4.34Å; L367-W386 HydrophobicContact CD2-CH2 4.18Å; L367-W386 HydrophobicContact CD2-CZ2 3.72Å; L367-W386 HydrophobicContact CD2-CZ3 4.43Å; L367-W386 HydrophobicContact CG-CD2 4.48Å; L367-W386 HydrophobicContact CG-CZ2 3.77Å; L368-W386 HydrophobicContact CB-CZ2 4.17Å; T371-W386 PolarHBondContact OG1-NE1 3.3Å; T382-W386 VanDerWaalsContact O-CD1 3.24Å; T382-W386 PolarHBondContact O-N 3.21Å; T382-W386 VanDerWaalsContact O-N 3.08Å; V383-W386 PolarHBondContact O-N 2.87Å; W386-S388 PolarHBondContact O-N 3.12Å; W386-L389 HydrophobicContact CE3-CD1 3.94Å; W386-L389 HydrophobicContact CZ3-CD1 4.17Å; W386-L389 PolarHBondContact O-N 3.05Å; W386-F390 HydrophobicContact CB-CD2 4.27Å; W386-F390 HydrophobicContact CB-CE2 3.86Å; W386-F390 HydrophobicContact CD2-CE2 4.17Å; W386-F390 HydrophobicContact CD2-CZ 4.04Å; W386-F390 AromaticContact CE3-CE1 3.79Å; W386-F390 HydrophobicContact CE3-CE1 3.79Å; W386-F390 AromaticContact CE3-CE2 3.72Å; W386-F390 HydrophobicContact CE3-CE2 3.72Å; W386-F390 AromaticContact CE3-CZ 3.23Å; W386-F390 HydrophobicContact CE3-CZ 3.23Å; W386-F390 HydrophobicContact CG-CE2 4.29Å; W386-F390 HydrophobicContact CZ3-CE1 4Å; W386-F390 AromaticContact CZ3-CZ 3.7Å; W386-F390 HydrophobicContact CZ3-CZ 3.7Å; W386-F390 WeakPolarHBondContact O-CD2 3.37Å; W386-F390 WeakPolarHBondContact O-CG 3.46Å; W386-F390 PolarHBondContact O-N 3.08Å; W386-M404 HydrophobicContact CH2-CB 4.05Å; W386-M404 HydrophobicContact CZ3-CB 4.15Å; W386-Y408 HydrophobicContact CB-CE2 4.11Å; W386-Y408 AromaticContact CD1-CD2 3.88Å; W386-Y408 AromaticContact CD1-CE2 3.34Å; W386-Y408 AromaticContact CD2-CD2 3.96Å; W386-Y408 HydrophobicContact CD2-CD2 3.96Å; W386-Y408 HydrophobicContact CD2-CE2 4.13Å; W386-Y408 AromaticContact CE2-CD2 3.88Å; W386-Y408 AromaticContact CG-CD2 3.94Å; W386-Y408 HydrophobicContact CG-CD2 3.94Å; W386-Y408 AromaticContact CG-CE2 3.61Å; W386-Y408 HydrophobicContact CG-CE2 3.61Å; W386-Y408 AromaticContact NE1-CD2 3.8Å; W386-Y408 AromaticContact NE1-CE2 3.65Å; W386-V457 HydrophobicContact CB-CG1 4.39Å
387	A	95.6	Very high	94.1	Very high	10 Å²	10	37.8 Å²	37.8	8%	0.083	19%	0.188	C	C	.	.	H	α-helix	trans	-56	-37.5	174.7	0	0	0	0	0	112.1	V383 T385 R391 V457	V383-A387 WeakPolarHBondContact O-CB 3.44Å; V383-A387 PolarHBondContact O-N 3.41Å; T385-A387 PolarHBondContact O-N 3.46Å; A387-R391 VanDerWaalsContact O-CB 3.27Å; A387-R391 WeakPolarHBondContact O-CB 3.45Å; A387-R391 WeakPolarHBondContact O-CG 3.4Å; A387-R391 PolarHBondContact O-N 3.18Å; A387-R391 PolarHBondContact O-NE 3.04Å; A387-V457 HydrophobicContact CB-CG2 3.7Å
388	S	95.2	Very high	94.2	Very high	28 Å²	28	36.5 Å²	36.5	20%	0.196	19%	0.185	C	C	.	.	H	α-helix	trans	-73.1	-45.8	179	-58.4	0	0	0	0	111.2	F342 S384 T385 W386 F390 R391 H392	F342-S388 WeakPolarHBondContact CE1-OG 3.36Å; S384-S388 PolarHBondContact O-N 2.93Å; S384-S388 PolarHBondContact O-OG 3.22Å; T385-S388 WeakPolarHBondContact O-CB 3.22Å; T385-S388 PolarHBondContact O-N 3.11Å; T385-S388 VanDerWaalsContact O-N 3.12Å; W386-S388 PolarHBondContact O-N 3.12Å; S388-F390 PolarHBondContact O-N 3.04Å; S388-R391 PolarHBondContact O-N 3.14Å; S388-H392 WeakPolarHBondContact O-CB 3.4Å; S388-H392 PolarHBondContact O-N 2.9Å
389	L	95.6	Very high	94.3	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-59.3	-47.9	177.4	-72.4	168.1	0	0	0	112.3	L344 Y363 L367 T385 W386 R391 H392 L395	L344-L389 HydrophobicContact CD2-CD2 4.17Å; Y363-L389 HydrophobicContact CE1-CD1 4.42Å; L367-L389 HydrophobicContact CD2-CD1 4.02Å; T385-L389 HydrophobicContact CG2-CD1 4.35Å; T385-L389 WeakPolarHBondContact O-CG 3.44Å; T385-L389 PolarHBondContact O-N 2.99Å; W386-L389 HydrophobicContact CE3-CD1 3.94Å; W386-L389 HydrophobicContact CZ3-CD1 4.17Å; W386-L389 PolarHBondContact O-N 3.05Å; L389-R391 PolarHBondContact O-N 2.67Å; L389-H392 WeakPolarHBondContact O-CB 3.39Å; L389-H392 PolarHBondContact O-N 3.19Å; L389-L395 HydrophobicContact CD2-CD1 3.96Å
390	F	95.7	Very high	94.3	Very high	0 Å²	0	42 Å²	42	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-74.2	-24.3	-178.1	-59.1	-38.7	0	0	0	113.4	W386 S388 S396 V401 A405 Y408 V457 T460 L461 I464	W386-F390 HydrophobicContact CB-CD2 4.27Å; W386-F390 HydrophobicContact CB-CE2 3.86Å; W386-F390 HydrophobicContact CD2-CE2 4.17Å; W386-F390 HydrophobicContact CD2-CZ 4.04Å; W386-F390 AromaticContact CE3-CE1 3.79Å; W386-F390 HydrophobicContact CE3-CE1 3.79Å; W386-F390 AromaticContact CE3-CE2 3.72Å; W386-F390 HydrophobicContact CE3-CE2 3.72Å; W386-F390 AromaticContact CE3-CZ 3.23Å; W386-F390 HydrophobicContact CE3-CZ 3.23Å; W386-F390 HydrophobicContact CG-CE2 4.29Å; W386-F390 HydrophobicContact CZ3-CE1 4Å; W386-F390 AromaticContact CZ3-CZ 3.7Å; W386-F390 HydrophobicContact CZ3-CZ 3.7Å; W386-F390 WeakPolarHBondContact O-CD2 3.37Å; W386-F390 WeakPolarHBondContact O-CG 3.46Å; W386-F390 PolarHBondContact O-N 3.08Å; S388-F390 PolarHBondContact O-N 3.04Å; F390-S396 WeakPolarHBondContact O-CB 3.26Å; F390-V401 HydrophobicContact CD1-CG1 3.96Å; F390-V401 HydrophobicContact CE1-CG1 4.06Å; F390-A405 HydrophobicContact CD1-CB 4.27Å; F390-A405 HydrophobicContact CE1-CB 3.76Å; F390-A405 HydrophobicContact CZ-CB 4.23Å; F390-Y408 HydrophobicContact CE2-CD1 4.42Å; F390-Y408 HydrophobicContact CE2-CD2 4.47Å; F390-Y408 HydrophobicContact CE2-CG 4.22Å; F390-Y408 HydrophobicContact CZ-CG 4.38Å; F390-V457 HydrophobicContact CD2-CG1 3.79Å; F390-V457 HydrophobicContact CE2-CG1 3.96Å; F390-T460 HydrophobicContact CB-CG2 3.67Å; F390-T460 WeakPolarHBondContact O-CG2 3.46Å; F390-L461 HydrophobicContact CD1-CD2 4.16Å; F390-L461 HydrophobicContact CD2-CD1 4.45Å; F390-L461 HydrophobicContact CD2-CD2 3.61Å; F390-L461 HydrophobicContact CD2-CG 3.89Å; F390-L461 HydrophobicContact CE1-CD2 4.03Å; F390-L461 HydrophobicContact CE2-CD1 4.13Å; F390-L461 HydrophobicContact CE2-CD2 3.48Å; F390-L461 VanDerWaalsContact CE2-CD2 3.48Å; F390-L461 HydrophobicContact CE2-CG 3.95Å; F390-L461 HydrophobicContact CG-CD2 3.97Å; F390-L461 HydrophobicContact CZ-CD2 3.69Å; F390-I464 HydrophobicContact CB-CD1 3.87Å; F390-I464 HydrophobicContact CD1-CD1 4.3Å; F390-I464 HydrophobicContact CG-CD1 4.36Å
391	R	94.3	Very high	94.3	Very high	153 Å²	153	41.1 Å²	41.1	58%	0.577	22%	0.216	S	C	*	.	H	α-helix	trans	-83.3	-20.1	173.8	-73.5	-174.2	-69.8	178.7	-2.9	113.2	A387 S388 L389 T460	A387-R391 VanDerWaalsContact O-CB 3.27Å; A387-R391 WeakPolarHBondContact O-CB 3.45Å; A387-R391 WeakPolarHBondContact O-CG 3.4Å; A387-R391 PolarHBondContact O-N 3.18Å; A387-R391 PolarHBondContact O-NE 3.04Å; S388-R391 PolarHBondContact O-N 3.14Å; L389-R391 PolarHBondContact O-N 2.67Å; R391-T460 HydrophobicContact CG-CG2 3.61Å
392	H	94.6	Very high	94.3	Very high	28 Å²	28	42.1 Å²	42.1	13%	0.13	22%	0.221	C	C	.	.			trans	-65	133	-174.1	-169.6	-70.5	0	0	0	112.8	C345 V348 S388 L389 T394 L395 S396	C345-H392 PolarHBondContact O-CD2 3.14Å; C345-H392 VanDerWaalsContact O-CD2 3.3Å; C345-H392 PolarHBondContact O-NE2 2.88Å; C345-H392 VanDerWaalsContact O-NE2 3.16Å; V348-H392 PolarHBondContact O-CE1 3.16Å; V348-H392 PolarHBondContact O-NE2 3.16Å; S388-H392 WeakPolarHBondContact O-CB 3.4Å; S388-H392 PolarHBondContact O-N 2.9Å; L389-H392 WeakPolarHBondContact O-CB 3.39Å; L389-H392 PolarHBondContact O-N 3.19Å; H392-T394 PolarHBondContact ND1-N 3.42Å; H392-T394 VanDerWaalsContact ND1-N 3.11Å; H392-T394 PolarHBondContact O-N 3.33Å; H392-L395 HydrophobicContact CB-CB 4.07Å; H392-L395 HydrophobicContact CB-CD1 4.46Å; H392-L395 PolarHBondContact ND1-N 2.64Å; H392-L395 VanDerWaalsContact ND1-N 3.15Å; H392-S396 WeakPolarHBondContact O-CB 3.46Å; H392-S396 PolarHBondContact O-N 3.38Å; H392-S396 PolarHBondContact O-OG 3.39Å
393	E	90.7	Very high	94.2	Very high	159 Å²	159	47.6 Å²	47.6	74%	0.743	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.1	-37	-171.6	-63	-174	168	0	0	114.8	K397	E393-K397 WeakPolarHBondContact O-CE 3.48Å; E393-K397 PolarHBondContact O-NZ 2.61Å; E393-K397 VanDerWaalsContact O-NZ 3.13Å
394	T	91.8	Very high	94.1	Very high	63 Å²	63	48.1 Å²	48.1	39%	0.387	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.4	-58.2	177.8	-45.9	0	0	0	0	112.4	V348 H392 S396 K397	V348-T394 HydrophobicContact CG1-CG2 4.37Å; H392-T394 PolarHBondContact ND1-N 3.42Å; H392-T394 VanDerWaalsContact ND1-N 3.11Å; H392-T394 PolarHBondContact O-N 3.33Å; T394-S396 VanDerWaalsContact C-N 3.32Å; T394-S396 PolarHBondContact O-N 2.54Å; T394-K397 PolarHBondContact O-N 3.28Å; T394-K397 VanDerWaalsContact O-N 3.14Å
395	L	93.8	Very high	94.2	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	23%	0.231	C	C	.	.	G	3₁₀ helix	trans	-60.3	-34.8	-174	-64	170.9	0	0	0	113.8	L344 V348 V356 L389 H392 K397 V398 V401	L344-L395 HydrophobicContact CD2-CD1 4.22Å; L344-L395 HydrophobicContact CG-CD1 3.99Å; V348-L395 HydrophobicContact CB-CD2 4.34Å; V348-L395 HydrophobicContact CB-CG 4.48Å; V348-L395 HydrophobicContact CG1-CD2 3.91Å; V348-L395 HydrophobicContact CG1-CG 4.2Å; V356-L395 HydrophobicContact CG1-CD2 4.43Å; V356-L395 HydrophobicContact CG2-CD2 4.24Å; L389-L395 HydrophobicContact CD2-CD1 3.96Å; H392-L395 HydrophobicContact CB-CB 4.07Å; H392-L395 HydrophobicContact CB-CD1 4.46Å; H392-L395 PolarHBondContact ND1-N 2.64Å; H392-L395 VanDerWaalsContact ND1-N 3.15Å; L395-K397 PolarHBondContact O-N 3.22Å; L395-V398 HydrophobicContact CD2-CG2 4.5Å; L395-V398 WeakPolarHBondContact O-CB 3.19Å; L395-V398 PolarHBondContact O-N 2.82Å; L395-V401 WeakPolarHBondContact O-CB 3.36Å; L395-V401 WeakPolarHBondContact O-CG2 3.26Å
396	S	93	Very high	94.1	Very high	17 Å²	17	48 Å²	48	12%	0.119	24%	0.244	C	C	.	.	G	3₁₀ helix	trans	-61.8	-16.6	178.5	61.4	0	0	0	0	114.6	F390 H392 T394 V402	F390-S396 WeakPolarHBondContact O-CB 3.26Å; H392-S396 WeakPolarHBondContact O-CB 3.46Å; H392-S396 PolarHBondContact O-N 3.38Å; H392-S396 PolarHBondContact O-OG 3.39Å; T394-S396 VanDerWaalsContact C-N 3.32Å; T394-S396 PolarHBondContact O-N 2.54Å; S396-V402 WeakPolarHBondContact O-CG2 3.23Å
397	K	92.1	Very high	94	Very high	162 Å²	162	51.2 Å²	51.2	70%	0.704	26%	0.259	S	S	*	.	G	3₁₀ helix	trans	-99.2	-6.1	178.9	-60.3	169.8	-174.1	154.8	0	112.8	E393 T394 L395	E393-K397 WeakPolarHBondContact O-CE 3.48Å; E393-K397 PolarHBondContact O-NZ 2.61Å; E393-K397 VanDerWaalsContact O-NZ 3.13Å; T394-K397 PolarHBondContact O-N 3.28Å; T394-K397 VanDerWaalsContact O-N 3.14Å; L395-K397 PolarHBondContact O-N 3.22Å
398	V	94.1	Very high	94	Very high	25 Å²	25	50.8 Å²	50.8	15%	0.152	26%	0.255	C	S	.	.	S	Bend	trans	-71.8	131.1	-180	176.2	0	0	0	0	108.7	V356 L360 L395 V400 V401 V402	V356-V398 HydrophobicContact CG1-CG1 4.32Å; V356-V398 HydrophobicContact CG1-CG2 4.33Å; V356-V398 HydrophobicContact CG2-CG2 4.09Å; L360-V398 HydrophobicContact CD2-CG1 4.06Å; L395-V398 HydrophobicContact CD2-CG2 4.5Å; L395-V398 WeakPolarHBondContact O-CB 3.19Å; L395-V398 PolarHBondContact O-N 2.82Å; V398-V400 VanDerWaalsContact C-N 3.28Å; V398-V400 HydrophobicContact CG1-CB 4.46Å; V398-V400 PolarHBondContact O-N 3.25Å; V398-V400 VanDerWaalsContact O-N 3.15Å; V398-V401 HydrophobicContact CB-CB 4.48Å; V398-V401 HydrophobicContact CB-CG2 4.16Å; V398-V401 PolarHBondContact O-N 3.45Å; V398-V402 PolarHBondContact O-N 3.47Å; V398-V402 VanDerWaalsContact O-N 3.08Å
399	P	93.8	Very high	94	Very high	105 Å²	105	49.5 Å²	49.5	68%	0.682	25%	0.246	S	C	*	.	H	α-helix	trans	-51.6	-43	-174.1	-30.1	35.4	0	0	0	114.4	V401 V402 E403	P399-V401 VanDerWaalsContact C-N 3.33Å; P399-V401 PolarHBondContact O-N 3.27Å; P399-V402 PolarHBondContact O-N 3.46Å; P399-E403 PolarHBondContact O-N 2.86Å
400	V	94.2	Very high	93.8	Very high	29 Å²	29	54 Å²	54	18%	0.176	27%	0.265	C	S	.	.	H	α-helix	trans	-60.1	-40.8	177.9	177	0	0	0	0	112	L360 T361 V398 E403 M404	L360-V400 HydrophobicContact CG-CG1 4.48Å; T361-V400 HydrophobicContact CG2-CG1 4.31Å; T361-V400 WeakPolarHBondContact OG1-CG2 3.28Å; V398-V400 VanDerWaalsContact C-N 3.28Å; V398-V400 HydrophobicContact CG1-CB 4.46Å; V398-V400 PolarHBondContact O-N 3.25Å; V398-V400 VanDerWaalsContact O-N 3.15Å; V400-E403 PolarHBondContact O-N 3.32Å; V400-M404 WeakPolarHBondContact O-CB 3.39Å; V400-M404 WeakPolarHBondContact O-CG 3.41Å; V400-M404 PolarHBondContact O-N 3.4Å
401	V	94.4	Very high	93.8	Very high	1 Å²	1	55 Å²	55	1%	0.006	27%	0.271	C	S	.	.	H	α-helix	trans	-71.9	-35.1	179.5	179.2	0	0	0	0	110.8	L360 F390 L395 V398 P399 M404 A405	L360-V401 HydrophobicContact CD2-CG2 3.88Å; F390-V401 HydrophobicContact CD1-CG1 3.96Å; F390-V401 HydrophobicContact CE1-CG1 4.06Å; L395-V401 WeakPolarHBondContact O-CB 3.36Å; L395-V401 WeakPolarHBondContact O-CG2 3.26Å; V398-V401 HydrophobicContact CB-CB 4.48Å; V398-V401 HydrophobicContact CB-CG2 4.16Å; V398-V401 PolarHBondContact O-N 3.45Å; P399-V401 VanDerWaalsContact C-N 3.33Å; P399-V401 PolarHBondContact O-N 3.27Å; V401-M404 PolarHBondContact O-N 3.06Å; V401-A405 WeakPolarHBondContact O-CB 3.42Å; V401-A405 PolarHBondContact O-N 3.44Å
402	V	93.4	Very high	93.8	Very high	47 Å²	47	47.7 Å²	47.7	29%	0.285	24%	0.244	S	C	.	.	H	α-helix	trans	-68.2	-40	175.2	178.5	0	0	0	0	111.2	S396 V398 P399 A405 L406 L465	S396-V402 WeakPolarHBondContact O-CG2 3.23Å; V398-V402 PolarHBondContact O-N 3.47Å; V398-V402 VanDerWaalsContact O-N 3.08Å; P399-V402 PolarHBondContact O-N 3.46Å; V402-A405 WeakPolarHBondContact O-CB 3.34Å; V402-A405 PolarHBondContact O-N 3.23Å; V402-L406 PolarHBondContact O-N 3.13Å; V402-L465 HydrophobicContact CG1-CD2 4.01Å
403	E	94.2	Very high	93.8	Very high	116 Å²	116	48.1 Å²	48.1	54%	0.542	25%	0.248	S	C	.	.	H	α-helix	trans	-62.6	-45.5	172.9	-176.1	177.5	-178.1	0	0	111.2	P399 V400 A405 L406 E407	P399-E403 PolarHBondContact O-N 2.86Å; V400-E403 PolarHBondContact O-N 3.32Å; E403-A405 VanDerWaalsContact C-N 3.28Å; E403-A405 PolarHBondContact O-N 3.21Å; E403-L406 WeakPolarHBondContact O-CB 3.46Å; E403-L406 PolarHBondContact O-N 2.61Å; E403-L406 VanDerWaalsContact O-N 3.07Å; E403-E407 PolarHBondContact O-N 3.37Å; E403-E407 VanDerWaalsContact O-N 3.17Å
404	M	93.9	Very high	93.9	Very high	13 Å²	13	44.7 Å²	44.7	6%	0.064	24%	0.239	C	C	.	.	H	α-helix	trans	-67.1	-28.8	176.6	-69.4	-72.8	145.4	0	0	112.9	T364 E365 L368 W386 V400 V401 L406 E407 Y408	T364-M404 HydrophobicContact CG2-CG 4.44Å; E365-M404 HydrophobicContact CG-CE 3.95Å; L368-M404 HydrophobicContact CD2-SD 3.98Å; W386-M404 HydrophobicContact CH2-CB 4.05Å; W386-M404 HydrophobicContact CZ3-CB 4.15Å; V400-M404 WeakPolarHBondContact O-CB 3.39Å; V400-M404 WeakPolarHBondContact O-CG 3.41Å; V400-M404 PolarHBondContact O-N 3.4Å; V401-M404 PolarHBondContact O-N 3.06Å; M404-L406 VanDerWaalsContact C-N 3.29Å; M404-L406 PolarHBondContact O-N 3.11Å; M404-E407 PolarHBondContact O-N 3.14Å; M404-Y408 VanDerWaalsContact O-CB 3.25Å; M404-Y408 WeakPolarHBondContact O-CB 3.28Å; M404-Y408 PolarHBondContact O-N 3.01Å
405	A	94.6	Very high	94	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-62.5	-36.8	171.2	0	0	0	0	0	111.7	F390 V401 V402 E403 L409 L461 L465	F390-A405 HydrophobicContact CD1-CB 4.27Å; F390-A405 HydrophobicContact CE1-CB 3.76Å; F390-A405 HydrophobicContact CZ-CB 4.23Å; V401-A405 WeakPolarHBondContact O-CB 3.42Å; V401-A405 PolarHBondContact O-N 3.44Å; V402-A405 WeakPolarHBondContact O-CB 3.34Å; V402-A405 PolarHBondContact O-N 3.23Å; E403-A405 VanDerWaalsContact C-N 3.28Å; E403-A405 PolarHBondContact O-N 3.21Å; A405-L409 WeakPolarHBondContact O-CB 3.47Å; A405-L409 PolarHBondContact O-N 3.18Å; A405-L461 HydrophobicContact CB-CD2 3.44Å; A405-L461 VanDerWaalsContact CB-CD2 3.44Å; A405-L465 HydrophobicContact CB-CD1 3.76Å
406	L	94.2	Very high	94	Very high	53 Å²	53	41.9 Å²	41.9	28%	0.277	22%	0.221	S	C	.	.	H	α-helix	trans	-68.1	-44.9	175.2	-176.5	69.1	0	0	0	111.4	V402 E403 M404 L409 K410 L465 E468	V402-L406 PolarHBondContact O-N 3.13Å; E403-L406 WeakPolarHBondContact O-CB 3.46Å; E403-L406 PolarHBondContact O-N 2.61Å; E403-L406 VanDerWaalsContact O-N 3.07Å; M404-L406 VanDerWaalsContact C-N 3.29Å; M404-L406 PolarHBondContact O-N 3.11Å; L406-L409 WeakPolarHBondContact O-CB 3.46Å; L406-L409 PolarHBondContact O-N 3.13Å; L406-K410 PolarHBondContact O-N 3.35Å; L406-L465 HydrophobicContact CB-CD1 3.97Å; L406-L465 HydrophobicContact CD1-CD1 4.43Å; L406-E468 HydrophobicContact CD1-CB 3.95Å; L406-E468 HydrophobicContact CD1-CG 3.97Å
407	E	94.3	Very high	94.1	Very high	66 Å²	66	41.6 Å²	41.6	31%	0.308	22%	0.219	S	C	.	.	H	α-helix	trans	-66	-42.2	177.1	-69.1	-54.6	132.3	0	0	112	L368 E403 M404 L409 K410 V411	L368-E407 HydrophobicContact CD2-CB 3.99Å; E403-E407 PolarHBondContact O-N 3.37Å; E403-E407 VanDerWaalsContact O-N 3.17Å; M404-E407 PolarHBondContact O-N 3.14Å; E407-L409 VanDerWaalsContact C-N 3.3Å; E407-L409 PolarHBondContact O-N 2.88Å; E407-K410 WeakPolarHBondContact O-CB 3.48Å; E407-K410 PolarHBondContact O-N 2.99Å; E407-K410 VanDerWaalsContact O-N 3.14Å; E407-K410 IonicContact OE1-NZ 3.84Å; E407-K410 PolarHBondContact OE1-NZ 3.09Å; E407-K410 IonicContact OE2-NZ 3.88Å; E407-V411 WeakPolarHBondContact O-CG2 3.35Å; E407-V411 PolarHBondContact O-N 3.06Å
408	Y	95.4	Very high	94.1	Very high	1 Å²	1	36.6 Å²	36.6	0%	0.004	20%	0.196	C	C	.	.	H	α-helix	trans	-60.8	-40.6	175.2	-170.1	-77.3	0	0	0	111.6	T371 W386 F390 M404 K410 V411 S412 H454 V457 L461	T371-Y408 HydrophobicContact CG2-CD2 3.99Å; T371-Y408 HydrophobicContact CG2-CE2 3.57Å; W386-Y408 HydrophobicContact CB-CE2 4.11Å; W386-Y408 AromaticContact CD1-CD2 3.88Å; W386-Y408 AromaticContact CD1-CE2 3.34Å; W386-Y408 AromaticContact CD2-CD2 3.96Å; W386-Y408 HydrophobicContact CD2-CD2 3.96Å; W386-Y408 HydrophobicContact CD2-CE2 4.13Å; W386-Y408 AromaticContact CE2-CD2 3.88Å; W386-Y408 AromaticContact CG-CD2 3.94Å; W386-Y408 HydrophobicContact CG-CD2 3.94Å; W386-Y408 AromaticContact CG-CE2 3.61Å; W386-Y408 HydrophobicContact CG-CE2 3.61Å; W386-Y408 AromaticContact NE1-CD2 3.8Å; W386-Y408 AromaticContact NE1-CE2 3.65Å; F390-Y408 HydrophobicContact CE2-CD1 4.42Å; F390-Y408 HydrophobicContact CE2-CD2 4.47Å; F390-Y408 HydrophobicContact CE2-CG 4.22Å; F390-Y408 HydrophobicContact CZ-CG 4.38Å; M404-Y408 VanDerWaalsContact O-CB 3.25Å; M404-Y408 WeakPolarHBondContact O-CB 3.28Å; M404-Y408 PolarHBondContact O-N 3.01Å; Y408-K410 VanDerWaalsContact C-N 3.3Å; Y408-K410 PolarHBondContact O-N 3.46Å; Y408-V411 PolarHBondContact O-N 2.9Å; Y408-S412 WeakPolarHBondContact CD1-OG 3.39Å; Y408-S412 PolarHBondContact O-N 3.32Å; Y408-S412 PolarHBondContact O-OG 3.38Å; Y408-H454 AromaticContact CE1-CE1 3.66Å; Y408-H454 AromaticContact CE1-NE2 3.82Å; Y408-H454 AromaticContact CZ-NE2 3.7Å; Y408-H454 PolarHBondContact OH-CD2 3.04Å; Y408-H454 PolarHBondContact OH-NE2 3.47Å; Y408-V457 HydrophobicContact CD1-CG1 4.47Å; Y408-V457 HydrophobicContact CE1-CG1 3.7Å; Y408-L461 HydrophobicContact CD1-CD1 3.26Å; Y408-L461 HydrophobicContact CE1-CD1 3.74Å; Y408-L461 HydrophobicContact CG-CD1 4.2Å
409	L	95.1	Very high	93.9	Very high	1 Å²	1	37.4 Å²	37.4	1%	0.005	20%	0.2	C	C	.	.	H	α-helix	trans	-57.8	-42.1	175.5	-178.3	72.6	0	0	0	111.6	A405 L406 E407 S412 L458 E468 A469 F515	A405-L409 WeakPolarHBondContact O-CB 3.47Å; A405-L409 PolarHBondContact O-N 3.18Å; L406-L409 WeakPolarHBondContact O-CB 3.46Å; L406-L409 PolarHBondContact O-N 3.13Å; E407-L409 VanDerWaalsContact C-N 3.3Å; E407-L409 PolarHBondContact O-N 2.88Å; L409-S412 VanDerWaalsContact O-CB 3.29Å; L409-S412 WeakPolarHBondContact O-CB 3.36Å; L409-S412 PolarHBondContact O-N 3.17Å; L409-L458 HydrophobicContact CD1-CD2 4.06Å; L409-E468 HydrophobicContact CD2-CB 4.27Å; L409-A469 HydrophobicContact CD1-CB 4.14Å; L409-A469 HydrophobicContact CD2-CB 4.18Å; L409-F515 HydrophobicContact CD1-CE2 3.95Å; L409-F515 HydrophobicContact CD1-CZ 3.61Å; L409-F515 HydrophobicContact CG-CZ 4.3Å
410	K	93.3	Very high	93.7	Very high	95 Å²	95	32.4 Å²	32.4	41%	0.413	17%	0.168	S	C	.	.	H	α-helix	trans	-65.3	-47.5	175	-64.3	171.6	-171.2	165.5	0	111.6	L406 E407 Y408 S412 T413	L406-K410 PolarHBondContact O-N 3.35Å; E407-K410 WeakPolarHBondContact O-CB 3.48Å; E407-K410 PolarHBondContact O-N 2.99Å; E407-K410 VanDerWaalsContact O-N 3.14Å; E407-K410 IonicContact OE1-NZ 3.84Å; E407-K410 PolarHBondContact OE1-NZ 3.09Å; E407-K410 IonicContact OE2-NZ 3.88Å; Y408-K410 VanDerWaalsContact C-N 3.3Å; Y408-K410 PolarHBondContact O-N 3.46Å; K410-S412 PolarHBondContact O-N 3.33Å; K410-T413 WeakPolarHBondContact O-CB 3.38Å; K410-T413 PolarHBondContact O-N 3.18Å; K410-T413 VanDerWaalsContact O-N 3.08Å; K410-T413 PolarHBondContact O-OG1 3.03Å
411	V	94.1	Very high	93.5	Very high	20 Å²	20	31 Å²	31	12%	0.121	16%	0.16	C	C	.	.	H	α-helix	trans	-61	-29.9	178.3	171.1	0	0	0	0	111.9	L368 T371 T372 E407 Y408 T413 T414 N415	L368-V411 HydrophobicContact CD1-CG2 4.28Å; T371-V411 HydrophobicContact CG2-CG1 4.2Å; T372-V411 HydrophobicContact CG2-CB 4.37Å; T372-V411 HydrophobicContact CG2-CG1 3.78Å; T372-V411 HydrophobicContact CG2-CG2 3.58Å; E407-V411 WeakPolarHBondContact O-CG2 3.35Å; E407-V411 PolarHBondContact O-N 3.06Å; Y408-V411 PolarHBondContact O-N 2.9Å; V411-T413 PolarHBondContact O-N 2.9Å; V411-T414 PolarHBondContact O-N 3.42Å; V411-T414 VanDerWaalsContact O-N 3.14Å; V411-T414 PolarHBondContact O-OG1 2.91Å; V411-N415 WeakPolarHBondContact CG1-ND2 3.47Å; V411-N415 PolarHBondContact O-N 3.23Å
412	S	94.8	Very high	93.3	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-59.5	-29.4	177	-57	0	0	0	0	112.8	Y408 L409 K410 T414 L416 H454 L458	Y408-S412 WeakPolarHBondContact CD1-OG 3.39Å; Y408-S412 PolarHBondContact O-N 3.32Å; Y408-S412 PolarHBondContact O-OG 3.38Å; L409-S412 VanDerWaalsContact O-CB 3.29Å; L409-S412 WeakPolarHBondContact O-CB 3.36Å; L409-S412 PolarHBondContact O-N 3.17Å; K410-S412 PolarHBondContact O-N 3.33Å; S412-T414 VanDerWaalsContact C-N 3.27Å; S412-T414 PolarHBondContact O-N 2.81Å; S412-L416 WeakPolarHBondContact O-CB 3.35Å; S412-L416 VanDerWaalsContact O-CG 3.29Å; S412-L416 WeakPolarHBondContact O-CG 3.48Å; S412-L416 PolarHBondContact O-N 3.22Å; S412-L416 VanDerWaalsContact O-N 3.16Å; S412-H454 PolarHBondContact OG-CE1 3.06Å; S412-L458 WeakPolarHBondContact OG-CD2 3.35Å
413	T	93.8	Very high	93.1	Very high	37 Å²	37	33.3 Å²	33.3	23%	0.227	18%	0.177	C	C	.	.	H	α-helix	trans	-66.5	-29.1	179.6	67.2	0	0	0	0	112.6	K410 V411 V417 T472 W476	K410-T413 WeakPolarHBondContact O-CB 3.38Å; K410-T413 PolarHBondContact O-N 3.18Å; K410-T413 VanDerWaalsContact O-N 3.08Å; K410-T413 PolarHBondContact O-OG1 3.03Å; V411-T413 PolarHBondContact O-N 2.9Å; T413-V417 WeakPolarHBondContact O-CG2 3.36Å; T413-T472 HydrophobicContact CG2-CG2 3.82Å; T413-W476 HydrophobicContact CG2-CD2 4.5Å; T413-W476 HydrophobicContact CG2-CE3 3.75Å; T413-W476 HydrophobicContact CG2-CZ3 3.77Å; T413-W476 WeakPolarHBondContact O-CH2 3.44Å; T413-W476 WeakPolarHBondContact O-CZ2 3.24Å
414	T	93	Very high	92.7	Very high	88 Å²	88	30.6 Å²	30.6	54%	0.54	16%	0.164	S	C	.	.	H	α-helix	trans	-91.5	-38.6	175.6	57.1	0	0	0	0	111.7	V411 S412 L416 V417	V411-T414 PolarHBondContact O-N 3.42Å; V411-T414 VanDerWaalsContact O-N 3.14Å; V411-T414 PolarHBondContact O-OG1 2.91Å; S412-T414 VanDerWaalsContact C-N 3.27Å; S412-T414 PolarHBondContact O-N 2.81Å; T414-L416 VanDerWaalsContact C-N 3.33Å; T414-L416 PolarHBondContact O-N 3.06Å; T414-V417 WeakPolarHBondContact O-CB 3.33Å; T414-V417 PolarHBondContact O-N 3.39Å
415	N	94.1	Very high	92.3	Very high	3 Å²	3	37.4 Å²	37.4	2%	0.016	20%	0.196	C	C	.	.	H	α-helix	trans	-70.1	-24	-176.1	-84.3	-4.8	0	0	0	114.9	T371 K379 V411 V417	T371-N415 PolarHBondContact O-ND2 3.27Å; K379-N415 WeakPolarHBondContact CD-OD1 3.17Å; K379-N415 WeakPolarHBondContact CE-OD1 3.36Å; K379-N415 PolarHBondContact NZ-OD1 3.23Å; V411-N415 WeakPolarHBondContact CG1-ND2 3.47Å; V411-N415 PolarHBondContact O-N 3.23Å; N415-V417 VanDerWaalsContact C-N 3.29Å
416	L	95.3	Very high	91.8	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	22%	0.218	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76	-16.9	174.2	-74.1	175.8	0	0	0	113.4	S412 T414 R418 R451 L458 A511 V514 F515	S412-L416 WeakPolarHBondContact O-CB 3.35Å; S412-L416 VanDerWaalsContact O-CG 3.29Å; S412-L416 WeakPolarHBondContact O-CG 3.48Å; S412-L416 PolarHBondContact O-N 3.22Å; S412-L416 VanDerWaalsContact O-N 3.16Å; T414-L416 VanDerWaalsContact C-N 3.33Å; T414-L416 PolarHBondContact O-N 3.06Å; L416-R418 PolarHBondContact O-N 2.74Å; L416-R451 HydrophobicContact CD2-CG 3.83Å; L416-L458 HydrophobicContact CD1-CD1 3.72Å; L416-L458 HydrophobicContact CD2-CD1 4.42Å; L416-L458 HydrophobicContact CG-CD1 4.39Å; L416-A511 HydrophobicContact CB-CB 3.89Å; L416-V514 HydrophobicContact CD2-CG1 4.41Å; L416-F515 HydrophobicContact CD1-CB 3.77Å; L416-F515 HydrophobicContact CD1-CD2 3.8Å; L416-F515 HydrophobicContact CD1-CG 4.3Å
417	V	94.3	Very high	91.4	Very high	12 Å²	12	40.2 Å²	40.2	7%	0.073	21%	0.212	C	C	.	.	S	Bend	trans	-76.6	119.7	-179.4	-169	0	0	0	0	109.3	T413 T414 N415 T419 L507 A511	T413-V417 WeakPolarHBondContact O-CG2 3.36Å; T414-V417 WeakPolarHBondContact O-CB 3.33Å; T414-V417 PolarHBondContact O-N 3.39Å; N415-V417 VanDerWaalsContact C-N 3.29Å; V417-T419 HydrophobicContact CG1-CG2 3.95Å; V417-T419 PolarHBondContact O-N 2.79Å; V417-L507 HydrophobicContact CG1-CB 4.06Å; V417-A511 HydrophobicContact CB-CB 4.41Å; V417-A511 HydrophobicContact CG2-CB 3.86Å
418	R	91.9	Very high	91.1	Very high	57 Å²	57	41 Å²	41	22%	0.215	22%	0.223	C	C	.	.			trans	-75.3	94.4	-177.2	-171	-171.3	-51.2	-166.1	6.5	110.7	L416 F421 F443 N444 F447 L507	L416-R418 PolarHBondContact O-N 2.74Å; R418-F421 HydrophobicContact CG-CE2 4.02Å; R418-F421 HydrophobicContact CG-CZ 3.82Å; R418-F443 HydrophobicContact CG-CE1 4.28Å; R418-N444 WeakPolarHBondContact CD-OD1 3.43Å; R418-N444 PolarHBondContact NH1-OD1 3Å; R418-F447 VanDerWaalsContact CA-CZ 3.47Å; R418-F447 HydrophobicContact CB-CD1 3.97Å; R418-F447 HydrophobicContact CB-CE1 3.54Å; R418-F447 HydrophobicContact CB-CE2 4.47Å; R418-F447 HydrophobicContact CB-CZ 3.83Å; R418-F447 HydrophobicContact CG-CD1 3.65Å; R418-F447 HydrophobicContact CG-CD2 4.4Å; R418-F447 HydrophobicContact CG-CE1 3.77Å; R418-F447 HydrophobicContact CG-CG 4Å; R418-F447 HydrophobicContact CG-CZ 4.22Å; R418-L507 HydrophobicContact CB-CD2 4.13Å; R418-L507 WeakPolarHBondContact O-CD1 3.44Å
419	T	89.8	Confident	90.9	Very high	41 Å²	41	41.1 Å²	41.1	25%	0.252	23%	0.225	S	C	.	.			trans	-134.7	163.8	178	58.7	0	0	0	0	110.2	V417 F443	V417-T419 HydrophobicContact CG1-CG2 3.95Å; V417-T419 PolarHBondContact O-N 2.79Å; T419-F443 VanDerWaalsContact O-CZ 3.29Å; T419-F443 WeakPolarHBondContact O-CZ 3.18Å
420	G	89.1	Confident	90.6	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	23%	0.225	C	C	.	.			trans	96.9	30.5	177.3	0	0	0	0	0	115	C430 S433	G420-C430 VanDerWaalsContact CA-SG 3.53Å; G420-S433 WeakPolarHBondContact O-CB 3.12Å; G420-S433 PolarHBondContact O-OG 3.35Å
421	F	89.9	Confident	90.4	Very high	1 Å²	1	38 Å²	38	0%	0.004	21%	0.213	C	C	.	.			trans	-62.4	136.9	178.2	-72.8	-91.7	0	0	0	111.7	R418 S423 K424 C430 D440 F443 N444 M502	R418-F421 HydrophobicContact CG-CE2 4.02Å; R418-F421 HydrophobicContact CG-CZ 3.82Å; F421-S423 PolarHBondContact O-N 2.82Å; F421-K424 HydrophobicContact CB-CB 4.23Å; F421-K424 HydrophobicContact CB-CD 4.31Å; F421-K424 HydrophobicContact CB-CG 4.11Å; F421-K424 PolarHBondContact O-N 3.45Å; F421-C430 PolarHBondContact O-SG 3.13Å; F421-D440 HydrophobicContact CD1-CB 4.03Å; F421-F443 AromaticContact CD1-CD1 3.59Å; F421-F443 HydrophobicContact CD1-CD1 3.59Å; F421-F443 AromaticContact CD1-CE1 3.94Å; F421-F443 HydrophobicContact CD1-CE1 3.94Å; F421-F443 HydrophobicContact CD2-CE1 4.16Å; F421-F443 AromaticContact CE1-CD1 3.64Å; F421-F443 HydrophobicContact CE1-CD1 3.64Å; F421-F443 AromaticContact CE1-CE1 3.85Å; F421-F443 HydrophobicContact CE1-CE1 3.85Å; F421-F443 HydrophobicContact CE2-CE1 4.06Å; F421-F443 HydrophobicContact CG-CD1 4.12Å; F421-F443 HydrophobicContact CG-CE1 4.11Å; F421-F443 HydrophobicContact CZ-CD1 4.19Å; F421-F443 AromaticContact CZ-CE1 3.93Å; F421-F443 HydrophobicContact CZ-CE1 3.93Å; F421-N444 WeakPolarHBondContact CE1-OD1 3.21Å; F421-M502 HydrophobicContact CD1-CE 3.87Å; F421-M502 HydrophobicContact CD2-CE 3.23Å; F421-M502 HydrophobicContact CE1-CE 3.71Å; F421-M502 HydrophobicContact CE1-SD 4.2Å; F421-M502 HydrophobicContact CE2-CE 3.07Å; F421-M502 HydrophobicContact CE2-SD 3.82Å; F421-M502 HydrophobicContact CG-CE 3.63Å; F421-M502 HydrophobicContact CZ-CE 3.31Å; F421-M502 HydrophobicContact CZ-SD 3.61Å
422	P	90.4	Very high	90.2	Very high	13 Å²	13	37.1 Å²	37.1	8%	0.084	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	-51.1	-39.3	176.4	-28.6	33.1	0	0	0	114.2	K424 R434 F437 D440 F443	P422-K424 VanDerWaalsContact C-N 3.28Å; P422-K424 PolarHBondContact O-N 3.24Å; P422-R434 HydrophobicContact CB-CG 4.04Å; P422-R434 WeakPolarHBondContact O-CD 3.34Å; P422-R434 VanDerWaalsContact O-CG 3.23Å; P422-R434 WeakPolarHBondContact O-CG 3.39Å; P422-R434 PolarHBondContact O-NH1 3.33Å; P422-F437 HydrophobicContact CG-CB 4.13Å; P422-D440 VanDerWaalsContact CD-OD1 3.22Å; P422-D440 WeakPolarHBondContact CD-OD1 3.29Å; P422-F443 HydrophobicContact CG-CB 4.15Å
423	S	88.8	Confident	90	Very high	83 Å²	83	37.1 Å²	37.1	58%	0.58	21%	0.208	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71.7	-15.3	-179.4	72.8	0	0	0	0	114.9	F421 D440	F421-S423 PolarHBondContact O-N 2.82Å; S423-D440 WeakPolarHBondContact CB-OD1 3.29Å; S423-D440 VanDerWaalsContact CB-OD2 3.26Å; S423-D440 WeakPolarHBondContact CB-OD2 3.49Å; S423-D440 PolarHBondContact N-OD1 3Å; S423-D440 VanDerWaalsContact OG-CG 3.25Å; S423-D440 PolarHBondContact OG-OD1 2.94Å; S423-D440 PolarHBondContact OG-OD2 3.25Å
424	K	86.6	Confident	89.9	Confident	59 Å²	59	40.2 Å²	40.2	26%	0.257	22%	0.215	S	C	.	.			trans	-107.6	174.1	-171.8	-66.6	-166.8	174.9	-172	0	113.6	F421 P422 D426 C430 R434 M502	F421-K424 HydrophobicContact CB-CB 4.23Å; F421-K424 HydrophobicContact CB-CD 4.31Å; F421-K424 HydrophobicContact CB-CG 4.11Å; F421-K424 PolarHBondContact O-N 3.45Å; P422-K424 VanDerWaalsContact C-N 3.28Å; P422-K424 PolarHBondContact O-N 3.24Å; K424-D426 WeakPolarHBondContact CD-OD2 3.24Å; K424-D426 IonicContact NZ-OD2 3.22Å; K424-C430 VanDerWaalsContact O-CB 3.26Å; K424-C430 WeakPolarHBondContact O-CB 3.45Å; K424-C430 PolarHBondContact O-SG 3.38Å; K424-C430 VanDerWaalsContact O-SG 3.37Å; K424-R434 PolarHBondContact O-NH1 3.43Å; K424-M502 HydrophobicContact CD-CE 4.3Å
425	Q	86.2	Confident	89.6	Confident	156 Å²	156	40.3 Å²	40.3	73%	0.729	21%	0.211	S	C	*	.			trans	-134.1	27.6	171.4	-60.5	-170	8.7	0	0	112	S427	Q425-S427 VanDerWaalsContact C-N 3.34Å
426	D	82.8	Confident	89.4	Confident	88 Å²	88	41.9 Å²	41.9	47%	0.471	22%	0.219	S	C	.	.	S	Bend	trans	-81.3	-12.6	-176.8	57.5	4.2	0	0	0	113.7	K424 C430	K424-D426 WeakPolarHBondContact CD-OD2 3.24Å; K424-D426 IonicContact NZ-OD2 3.22Å; D426-C430 PolarHBondContact OD1-SG 3.45Å; D426-C430 VanDerWaalsContact OD1-SG 3.35Å
427	S	87.6	Confident	89.2	Confident	23 Å²	23	43 Å²	43	16%	0.161	22%	0.224	C	C	.	.	S	Bend	trans	-144.3	147.9	-177.6	171.9	0	0	0	0	111.3	Q425 S429 C430	Q425-S427 VanDerWaalsContact C-N 3.34Å; S427-S429 PolarHBondContact O-N 3.08Å; S427-S429 VanDerWaalsContact O-N 3.11Å; S427-S429 WeakPolarHBondContact OG-CB 3.45Å; S427-S429 PolarHBondContact OG-N 2.99Å; S427-S429 PolarHBondContact OG-OG 2.93Å; S427-C430 WeakPolarHBondContact O-CB 3.43Å; S427-C430 PolarHBondContact O-N 3.5Å; S427-C430 PolarHBondContact O-SG 3.11Å; S427-C430 VanDerWaalsContact O-SG 3.38Å
428	P	87.3	Confident	88.9	Confident	83 Å²	83	50.3 Å²	50.3	54%	0.539	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.9	-22.7	170.6	25.6	-35.6	0	0	0	112.7	C430	P428-C430 PolarHBondContact O-N 3.44Å
429	S	90	Very high	88.7	Confident	4 Å²	4	49.5 Å²	49.5	3%	0.028	27%	0.266	C	S	.	.	H	α-helix	trans	-61.2	-28.9	174.5	-62.1	0	0	0	0	113.5	S374 S427 V431 Y432 S433	S374-S429 WeakPolarHBondContact O-CA 3.26Å; S374-S429 WeakPolarHBondContact O-CB 3.45Å; S374-S429 PolarHBondContact O-OG 3.19Å; S427-S429 PolarHBondContact O-N 3.08Å; S427-S429 VanDerWaalsContact O-N 3.11Å; S427-S429 WeakPolarHBondContact OG-CB 3.45Å; S427-S429 PolarHBondContact OG-N 2.99Å; S427-S429 PolarHBondContact OG-OG 2.93Å; S429-V431 VanDerWaalsContact C-N 3.27Å; S429-V431 PolarHBondContact O-N 3.44Å; S429-Y432 PolarHBondContact O-N 3.32Å; S429-S433 PolarHBondContact O-N 3.31Å; S429-S433 PolarHBondContact O-OG 2.94Å; S429-S433 VanDerWaalsContact O-OG 3.14Å
430	C	90.8	Very high	88.6	Confident	1 Å²	1	49.7 Å²	49.7	1%	0.007	27%	0.265	C	S	.	.	H	α-helix	trans	-57.9	-36.5	-176.3	-67.7	0	0	0	0	113.3	G420 F421 K424 D426 S427 P428 S433 R434	G420-C430 VanDerWaalsContact CA-SG 3.53Å; F421-C430 PolarHBondContact O-SG 3.13Å; K424-C430 VanDerWaalsContact O-CB 3.26Å; K424-C430 WeakPolarHBondContact O-CB 3.45Å; K424-C430 PolarHBondContact O-SG 3.38Å; K424-C430 VanDerWaalsContact O-SG 3.37Å; D426-C430 PolarHBondContact OD1-SG 3.45Å; D426-C430 VanDerWaalsContact OD1-SG 3.35Å; S427-C430 WeakPolarHBondContact O-CB 3.43Å; S427-C430 PolarHBondContact O-N 3.5Å; S427-C430 PolarHBondContact O-SG 3.11Å; S427-C430 VanDerWaalsContact O-SG 3.38Å; P428-C430 PolarHBondContact O-N 3.44Å; C430-S433 PolarHBondContact O-N 3.39Å; C430-R434 PolarHBondContact O-N 3.05Å
431	V	88	Confident	88.4	Confident	29 Å²	29	51.6 Å²	51.6	18%	0.176	28%	0.275	C	S	.	.	H	α-helix	trans	-67.9	-39.9	-177.2	-167	0	0	0	0	110.9	V320 V322 S429	V320-V431 WeakPolarHBondContact O-CG1 3.41Å; V322-V431 HydrophobicContact CG2-CB 4.29Å; V322-V431 HydrophobicContact CG2-CG1 3.54Å; S429-V431 VanDerWaalsContact C-N 3.27Å; S429-V431 PolarHBondContact O-N 3.44Å
432	Y	89.3	Confident	88.2	Confident	2 Å²	2	54.4 Å²	54.4	1%	0.008	29%	0.29	C	S	.	.	H	α-helix	trans	-71.3	-39.9	175	-63.2	-82.7	0	0	0	111.6	I310 V322 Y327 H373 S429 R434 M435 D436	I310-Y432 HydrophobicContact CD1-CE2 4.33Å; I310-Y432 WeakPolarHBondContact CD1-OH 3.41Å; V322-Y432 HydrophobicContact CG1-CD1 4.48Å; V322-Y432 HydrophobicContact CG1-CE1 4.36Å; V322-Y432 HydrophobicContact CG2-CD1 4.15Å; V322-Y432 HydrophobicContact CG2-CE1 4.07Å; Y327-Y432 HydrophobicContact CD1-CD1 4.36Å; Y327-Y432 AromaticContact CD2-CD1 3.83Å; Y327-Y432 HydrophobicContact CD2-CD1 3.83Å; Y327-Y432 AromaticContact CD2-CE1 3.92Å; Y327-Y432 HydrophobicContact CD2-CE1 3.92Å; Y327-Y432 HydrophobicContact CE1-CD1 4.08Å; Y327-Y432 AromaticContact CE2-CD1 3.57Å; Y327-Y432 HydrophobicContact CE2-CD1 3.57Å; Y327-Y432 HydrophobicContact CE2-CE1 4.02Å; Y327-Y432 HydrophobicContact CG-CD1 4.25Å; Y327-Y432 HydrophobicContact CG-CE1 4.43Å; Y327-Y432 AromaticContact CZ-CD1 3.7Å; H373-Y432 AromaticContact CE1-CE1 3.78Å; H373-Y432 AromaticContact CE1-CZ 3.61Å; H373-Y432 AromaticContact NE2-CZ 3.92Å; S429-Y432 PolarHBondContact O-N 3.32Å; Y432-R434 VanDerWaalsContact C-N 3.27Å; Y432-R434 PolarHBondContact O-N 2.91Å; Y432-M435 WeakPolarHBondContact O-CB 3.19Å; Y432-M435 PolarHBondContact O-N 2.72Å; Y432-D436 PolarHBondContact O-N 2.72Å; Y432-D436 VanDerWaalsContact O-N 3.11Å
433	S	91.9	Very high	88.2	Confident	0 Å²	0	53.8 Å²	53.8	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-60.8	-35.8	178	-60.5	0	0	0	0	112.6	G420 S429 C430 M435 D436 F437	G420-S433 WeakPolarHBondContact O-CB 3.12Å; G420-S433 PolarHBondContact O-OG 3.35Å; S429-S433 PolarHBondContact O-N 3.31Å; S429-S433 PolarHBondContact O-OG 2.94Å; S429-S433 VanDerWaalsContact O-OG 3.14Å; C430-S433 PolarHBondContact O-N 3.39Å; S433-M435 PolarHBondContact O-N 3.12Å; S433-D436 PolarHBondContact O-N 3.44Å; S433-D436 VanDerWaalsContact O-N 3.17Å; S433-F437 WeakPolarHBondContact O-CD2 3.43Å; S433-F437 PolarHBondContact O-N 2.64Å
434	R	90.4	Very high	88.2	Confident	102 Å²	102	51.6 Å²	51.6	39%	0.385	27%	0.268	S	S	.	.	H	α-helix	trans	-63.8	-22.8	173	-78	-172.2	-77.1	-89	3.7	114.4	P422 K424 C430 Y432	P422-R434 HydrophobicContact CB-CG 4.04Å; P422-R434 WeakPolarHBondContact O-CD 3.34Å; P422-R434 VanDerWaalsContact O-CG 3.23Å; P422-R434 WeakPolarHBondContact O-CG 3.39Å; P422-R434 PolarHBondContact O-NH1 3.33Å; K424-R434 PolarHBondContact O-NH1 3.43Å; C430-R434 PolarHBondContact O-N 3.05Å; Y432-R434 VanDerWaalsContact C-N 3.27Å; Y432-R434 PolarHBondContact O-N 2.91Å
435	M	88.1	Confident	88.2	Confident	90 Å²	90	52.4 Å²	52.4	44%	0.443	28%	0.282	S	S	.	.	H	α-helix	trans	-88.9	-22.6	175.4	-64.4	-63.6	-64.9	0	0	112.4	V322 E324 Y327 Y432 S433	V322-M435 HydrophobicContact CB-CG 4.31Å; E324-M435 HydrophobicContact CB-CE 4.32Å; E324-M435 HydrophobicContact CG-CE 4.19Å; Y327-M435 HydrophobicContact CD1-CB 4.44Å; Y327-M435 HydrophobicContact CE1-CB 4.24Å; Y432-M435 WeakPolarHBondContact O-CB 3.19Å; Y432-M435 PolarHBondContact O-N 2.72Å; S433-M435 PolarHBondContact O-N 3.12Å
436	D	89.4	Confident	88.4	Confident	36 Å²	36	47.7 Å²	47.7	19%	0.193	26%	0.259	C	S	.	.	H	α-helix	trans	-101.8	-25.1	-172.8	-68.7	-26.4	0	0	0	113.7	Y327 K331 F377 Y432 S433	Y327-D436 VanDerWaalsContact CE1-OD1 3.26Å; Y327-D436 WeakPolarHBondContact CE1-OD1 3.19Å; Y327-D436 VanDerWaalsContact OH-CG 3.27Å; Y327-D436 PolarHBondContact OH-OD1 3.29Å; Y327-D436 PolarHBondContact OH-OD2 2.76Å; K331-D436 VanDerWaalsContact CE-OD1 3.26Å; K331-D436 WeakPolarHBondContact CE-OD1 3.43Å; K331-D436 IonicContact NZ-OD1 2.62Å; K331-D436 PolarHBondContact NZ-OD1 2.98Å; F377-D436 WeakPolarHBondContact CB-OD2 3.33Å; Y432-D436 PolarHBondContact O-N 2.72Å; Y432-D436 VanDerWaalsContact O-N 3.11Å; S433-D436 PolarHBondContact O-N 3.44Å; S433-D436 VanDerWaalsContact O-N 3.17Å
437	F	90.6	Very high	88.9	Confident	23 Å²	23	43.5 Å²	43.5	10%	0.101	24%	0.236	C	C	.	.			trans	-134.7	139.1	-171.9	-51.9	-73.2	0	0	0	110.7	P422 S433 D442 F443 F446	P422-F437 HydrophobicContact CG-CB 4.13Å; S433-F437 WeakPolarHBondContact O-CD2 3.43Å; S433-F437 PolarHBondContact O-N 2.64Å; F437-D442 HydrophobicContact CB-CB 4.3Å; F437-D442 HydrophobicContact CD1-CB 4.38Å; F437-F443 HydrophobicContact CB-CB 4.37Å; F437-F443 HydrophobicContact CD2-CB 4.14Å; F437-F443 AromaticContact CD2-CD2 3.82Å; F437-F443 HydrophobicContact CD2-CD2 3.82Å; F437-F443 HydrophobicContact CD2-CG 4.49Å; F437-F443 AromaticContact CE2-CD2 3.75Å; F437-F443 HydrophobicContact CE2-CD2 3.75Å; F437-F443 HydrophobicContact CE2-CE2 4.5Å; F437-F443 HydrophobicContact CG-CB 4.13Å; F437-F443 HydrophobicContact CZ-CD2 4.46Å; F437-F446 HydrophobicContact CD1-CB 4.43Å; F437-F446 HydrophobicContact CE1-CB 3.56Å; F437-F446 AromaticContact CE1-CD1 3.88Å; F437-F446 HydrophobicContact CE1-CD1 3.88Å; F437-F446 AromaticContact CE1-CD2 3.89Å; F437-F446 HydrophobicContact CE1-CD2 3.89Å; F437-F446 AromaticContact CE1-CG 3.5Å; F437-F446 HydrophobicContact CE1-CG 3.5Å; F437-F446 VanDerWaalsContact CE1-CG 3.5Å; F437-F446 HydrophobicContact CZ-CB 4.02Å; F437-F446 AromaticContact CZ-CD1 3.47Å; F437-F446 HydrophobicContact CZ-CD1 3.47Å; F437-F446 VanDerWaalsContact CZ-CD1 3.47Å; F437-F446 HydrophobicContact CZ-CD2 4.2Å; F437-F446 AromaticContact CZ-CE1 3.91Å; F437-F446 HydrophobicContact CZ-CE1 3.91Å; F437-F446 AromaticContact CZ-CG 3.63Å; F437-F446 HydrophobicContact CZ-CG 3.63Å; F437-F446 HydrophobicContact CZ-CZ 4.43Å
438	D	87.9	Confident	89.1	Confident	165 Å²	165	45.1 Å²	45.1	88%	0.882	25%	0.248	S	C	*	.	S	Bend	trans	-77.3	-30.1	179.2	-60.5	-41.3	0	0	0	111.9
439	S	87.8	Confident	89.3	Confident	41 Å²	41	44.8 Å²	44.8	29%	0.287	24%	0.244	S	C	.	.	S	Bend	trans	-144	165.6	-177	73.5	0	0	0	0	114.1	D441 D442 F443	S439-D441 PolarHBondContact O-N 3.2Å; S439-D441 PolarHBondContact OG-N 3.28Å; S439-D442 PolarHBondContact N-OD2 3.35Å; S439-D442 PolarHBondContact O-N 3.2Å; S439-D442 PolarHBondContact OG-N 2.93Å; S439-D442 PolarHBondContact OG-OD2 2.86Å; S439-F443 PolarHBondContact O-N 3.49Å; S439-F443 VanDerWaalsContact O-N 3.16Å
440	D	88.3	Confident	89.5	Confident	44 Å²	44	44.7 Å²	44.7	24%	0.235	24%	0.243	C	C	.	.	H	α-helix	trans	-62.5	-27.5	172.1	-77.8	6.4	0	0	0	112.6	F421 P422 S423 N444	F421-D440 HydrophobicContact CD1-CB 4.03Å; P422-D440 VanDerWaalsContact CD-OD1 3.22Å; P422-D440 WeakPolarHBondContact CD-OD1 3.29Å; S423-D440 WeakPolarHBondContact CB-OD1 3.29Å; S423-D440 VanDerWaalsContact CB-OD2 3.26Å; S423-D440 WeakPolarHBondContact CB-OD2 3.49Å; S423-D440 PolarHBondContact N-OD1 3Å; S423-D440 VanDerWaalsContact OG-CG 3.25Å; S423-D440 PolarHBondContact OG-OD1 2.94Å; S423-D440 PolarHBondContact OG-OD2 3.25Å; D440-N444 WeakPolarHBondContact O-CB 3.27Å; D440-N444 PolarHBondContact O-N 3.08Å; D440-N444 PolarHBondContact O-ND2 3.04Å
441	D	83.9	Confident	89.7	Confident	40 Å²	40	45.9 Å²	45.9	21%	0.214	25%	0.248	C	C	.	.	H	α-helix	trans	-74.6	-40.5	179.3	-69.2	-32.1	0	0	0	111.4	S439 F443 N444 S445 P824	S439-D441 PolarHBondContact O-N 3.2Å; S439-D441 PolarHBondContact OG-N 3.28Å; D441-F443 VanDerWaalsContact C-N 3.32Å; D441-F443 PolarHBondContact O-N 3.32Å; D441-N444 PolarHBondContact O-N 3.38Å; D441-S445 WeakPolarHBondContact O-CB 3.46Å; D441-S445 PolarHBondContact O-N 3.31Å; D441-P824 HydrophobicContact CB-CB 3.76Å; D441-P824 HydrophobicContact CB-CG 4.24Å
442	D	85.8	Confident	89.9	Confident	60 Å²	60	48.3 Å²	48.3	32%	0.321	27%	0.266	S	S	.	.	H	α-helix	trans	-61.4	-44.5	172.6	-59.4	-45.7	0	0	0	110.7	F437 S439 N444 S445 F446	F437-D442 HydrophobicContact CB-CB 4.3Å; F437-D442 HydrophobicContact CD1-CB 4.38Å; S439-D442 PolarHBondContact N-OD2 3.35Å; S439-D442 PolarHBondContact O-N 3.2Å; S439-D442 PolarHBondContact OG-N 2.93Å; S439-D442 PolarHBondContact OG-OD2 2.86Å; D442-N444 PolarHBondContact O-N 3.05Å; D442-S445 PolarHBondContact O-N 3.43Å; D442-F446 WeakPolarHBondContact O-CB 3.5Å; D442-F446 PolarHBondContact O-N 3.47Å
443	F	90.9	Very high	90	Very high	0 Å²	0	51.7 Å²	51.7	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-59.2	-46	173.5	172.6	-94.7	0	0	0	111.9	Q376 R418 T419 F421 P422 F437 S439 D441 S445 F446 F447	Q376-F443 HydrophobicContact CB-CE2 4.19Å; Q376-F443 HydrophobicContact CG-CE2 3.99Å; R418-F443 HydrophobicContact CG-CE1 4.28Å; T419-F443 VanDerWaalsContact O-CZ 3.29Å; T419-F443 WeakPolarHBondContact O-CZ 3.18Å; F421-F443 AromaticContact CD1-CD1 3.59Å; F421-F443 HydrophobicContact CD1-CD1 3.59Å; F421-F443 AromaticContact CD1-CE1 3.94Å; F421-F443 HydrophobicContact CD1-CE1 3.94Å; F421-F443 HydrophobicContact CD2-CE1 4.16Å; F421-F443 AromaticContact CE1-CD1 3.64Å; F421-F443 HydrophobicContact CE1-CD1 3.64Å; F421-F443 AromaticContact CE1-CE1 3.85Å; F421-F443 HydrophobicContact CE1-CE1 3.85Å; F421-F443 HydrophobicContact CE2-CE1 4.06Å; F421-F443 HydrophobicContact CG-CD1 4.12Å; F421-F443 HydrophobicContact CG-CE1 4.11Å; F421-F443 HydrophobicContact CZ-CD1 4.19Å; F421-F443 AromaticContact CZ-CE1 3.93Å; F421-F443 HydrophobicContact CZ-CE1 3.93Å; P422-F443 HydrophobicContact CG-CB 4.15Å; F437-F443 HydrophobicContact CB-CB 4.37Å; F437-F443 HydrophobicContact CD2-CB 4.14Å; F437-F443 AromaticContact CD2-CD2 3.82Å; F437-F443 HydrophobicContact CD2-CD2 3.82Å; F437-F443 HydrophobicContact CD2-CG 4.49Å; F437-F443 AromaticContact CE2-CD2 3.75Å; F437-F443 HydrophobicContact CE2-CD2 3.75Å; F437-F443 HydrophobicContact CE2-CE2 4.5Å; F437-F443 HydrophobicContact CG-CB 4.13Å; F437-F443 HydrophobicContact CZ-CD2 4.46Å; S439-F443 PolarHBondContact O-N 3.49Å; S439-F443 VanDerWaalsContact O-N 3.16Å; D441-F443 VanDerWaalsContact C-N 3.32Å; D441-F443 PolarHBondContact O-N 3.32Å; F443-S445 PolarHBondContact O-N 3.19Å; F443-F446 PolarHBondContact O-N 2.82Å; F443-F447 HydrophobicContact CE1-CB 4.39Å; F443-F447 HydrophobicContact CZ-CB 4.4Å; F443-F447 HydrophobicContact CZ-CD2 4.01Å; F443-F447 HydrophobicContact CZ-CG 4.48Å; F443-F447 VanDerWaalsContact O-CB 3.26Å; F443-F447 WeakPolarHBondContact O-CB 3.49Å; F443-F447 PolarHBondContact O-N 3.28Å
444	N	88.8	Confident	90.1	Very high	37 Å²	37	51.7 Å²	51.7	20%	0.198	28%	0.282	C	S	.	.	H	α-helix	trans	-61.4	-43.4	178.7	-91.3	-44.7	0	0	0	112.5	R418 F421 D440 D441 D442 F447 S448	R418-N444 WeakPolarHBondContact CD-OD1 3.43Å; R418-N444 PolarHBondContact NH1-OD1 3Å; F421-N444 WeakPolarHBondContact CE1-OD1 3.21Å; D440-N444 WeakPolarHBondContact O-CB 3.27Å; D440-N444 PolarHBondContact O-N 3.08Å; D440-N444 PolarHBondContact O-ND2 3.04Å; D441-N444 PolarHBondContact O-N 3.38Å; D442-N444 PolarHBondContact O-N 3.05Å; N444-F447 PolarHBondContact O-N 3.03Å; N444-S448 WeakPolarHBondContact O-CB 3.41Å; N444-S448 PolarHBondContact O-N 2.91Å; N444-S448 PolarHBondContact O-OG 3.42Å
445	S	86.7	Confident	90.3	Very high	77 Å²	77	47 Å²	47	54%	0.538	26%	0.264	S	S	.	.	H	α-helix	trans	-62.9	-47.6	177.5	-176.1	0	0	0	0	111.1	D441 D442 F443 S448 T449	D441-S445 WeakPolarHBondContact O-CB 3.46Å; D441-S445 PolarHBondContact O-N 3.31Å; D442-S445 PolarHBondContact O-N 3.43Å; F443-S445 PolarHBondContact O-N 3.19Å; S445-S448 PolarHBondContact O-N 3.41Å; S445-T449 PolarHBondContact O-N 2.91Å; S445-T449 PolarHBondContact O-OG1 3.27Å; S445-T449 VanDerWaalsContact O-OG1 3.13Å
446	F	91.1	Very high	90.6	Very high	56 Å²	56	46.5 Å²	46.5	25%	0.246	26%	0.264	C	S	.	.	H	α-helix	trans	-61.1	-47.3	175.6	-178	-90.9	0	0	0	112.2	Q376 F377 S380 F437 D442 F443 S448 T449 Y450	Q376-F446 HydrophobicContact CG-CD1 4.26Å; Q376-F446 HydrophobicContact CG-CE1 4.08Å; F377-F446 HydrophobicContact CD2-CZ 4.47Å; S380-F446 WeakPolarHBondContact OG-CZ 3.39Å; F437-F446 HydrophobicContact CD1-CB 4.43Å; F437-F446 HydrophobicContact CE1-CB 3.56Å; F437-F446 AromaticContact CE1-CD1 3.88Å; F437-F446 HydrophobicContact CE1-CD1 3.88Å; F437-F446 AromaticContact CE1-CD2 3.89Å; F437-F446 HydrophobicContact CE1-CD2 3.89Å; F437-F446 AromaticContact CE1-CG 3.5Å; F437-F446 HydrophobicContact CE1-CG 3.5Å; F437-F446 VanDerWaalsContact CE1-CG 3.5Å; F437-F446 HydrophobicContact CZ-CB 4.02Å; F437-F446 AromaticContact CZ-CD1 3.47Å; F437-F446 HydrophobicContact CZ-CD1 3.47Å; F437-F446 VanDerWaalsContact CZ-CD1 3.47Å; F437-F446 HydrophobicContact CZ-CD2 4.2Å; F437-F446 AromaticContact CZ-CE1 3.91Å; F437-F446 HydrophobicContact CZ-CE1 3.91Å; F437-F446 AromaticContact CZ-CG 3.63Å; F437-F446 HydrophobicContact CZ-CG 3.63Å; F437-F446 HydrophobicContact CZ-CZ 4.43Å; D442-F446 WeakPolarHBondContact O-CB 3.5Å; D442-F446 PolarHBondContact O-N 3.47Å; F443-F446 PolarHBondContact O-N 2.82Å; F446-S448 VanDerWaalsContact C-N 3.32Å; F446-S448 PolarHBondContact O-N 2.87Å; F446-T449 PolarHBondContact O-N 3.44Å; F446-Y450 WeakPolarHBondContact O-CB 3.33Å; F446-Y450 PolarHBondContact O-N 3.45Å
447	F	93.4	Very high	90.9	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-63.6	-37.7	-179.3	-171.5	-85.2	0	0	0	111.9	Q376 R418 F443 N444 Y450 R451	Q376-F447 HydrophobicContact CG-CD2 4.24Å; R418-F447 VanDerWaalsContact CA-CZ 3.47Å; R418-F447 HydrophobicContact CB-CD1 3.97Å; R418-F447 HydrophobicContact CB-CE1 3.54Å; R418-F447 HydrophobicContact CB-CE2 4.47Å; R418-F447 HydrophobicContact CB-CZ 3.83Å; R418-F447 HydrophobicContact CG-CD1 3.65Å; R418-F447 HydrophobicContact CG-CD2 4.4Å; R418-F447 HydrophobicContact CG-CE1 3.77Å; R418-F447 HydrophobicContact CG-CG 4Å; R418-F447 HydrophobicContact CG-CZ 4.22Å; F443-F447 HydrophobicContact CE1-CB 4.39Å; F443-F447 HydrophobicContact CZ-CB 4.4Å; F443-F447 HydrophobicContact CZ-CD2 4.01Å; F443-F447 HydrophobicContact CZ-CG 4.48Å; F443-F447 VanDerWaalsContact O-CB 3.26Å; F443-F447 WeakPolarHBondContact O-CB 3.49Å; F443-F447 PolarHBondContact O-N 3.28Å; N444-F447 PolarHBondContact O-N 3.03Å; F447-Y450 HydrophobicContact CD2-CD1 4.34Å; F447-Y450 HydrophobicContact CE2-CD1 4.25Å; F447-Y450 HydrophobicContact CE2-CE1 4.41Å; F447-Y450 WeakPolarHBondContact O-CB 3.33Å; F447-Y450 PolarHBondContact O-N 3.44Å; F447-R451 HydrophobicContact CD1-CB 4.46Å; F447-R451 HydrophobicContact CE1-CB 4.22Å; F447-R451 VanDerWaalsContact O-CB 3.32Å; F447-R451 WeakPolarHBondContact O-CB 3.36Å; F447-R451 PolarHBondContact O-N 2.97Å
448	S	90.8	Very high	91.1	Very high	57 Å²	57	43.8 Å²	43.8	40%	0.399	25%	0.25	S	S	.	.	H	α-helix	trans	-63.5	-42.8	177	-58.9	0	0	0	0	111.3	N444 S445 F446 R451 S452	N444-S448 WeakPolarHBondContact O-CB 3.41Å; N444-S448 PolarHBondContact O-N 2.91Å; N444-S448 PolarHBondContact O-OG 3.42Å; S445-S448 PolarHBondContact O-N 3.41Å; F446-S448 VanDerWaalsContact C-N 3.32Å; F446-S448 PolarHBondContact O-N 2.87Å; S448-R451 PolarHBondContact O-N 2.94Å; S448-S452 PolarHBondContact O-N 3.26Å; S448-S452 VanDerWaalsContact O-N 3.07Å
449	T	91.1	Very high	91.4	Very high	77 Å²	77	40 Å²	40	47%	0.472	22%	0.224	S	C	.	.	H	α-helix	trans	-63.6	-46.9	174.5	-54.6	0	0	0	0	111.4	S445 F446 R451 S452 Q453	S445-T449 PolarHBondContact O-N 2.91Å; S445-T449 PolarHBondContact O-OG1 3.27Å; S445-T449 VanDerWaalsContact O-OG1 3.13Å; F446-T449 PolarHBondContact O-N 3.44Å; T449-R451 PolarHBondContact O-N 3.35Å; T449-S452 WeakPolarHBondContact O-CB 3.39Å; T449-S452 PolarHBondContact O-N 3.26Å; T449-Q453 PolarHBondContact O-N 2.93Å; T449-Q453 VanDerWaalsContact O-N 3.14Å
450	Y	94.1	Very high	91.7	Very high	2 Å²	2	39 Å²	39	1%	0.008	22%	0.216	C	C	.	.	H	α-helix	trans	-56.3	-48.2	175.6	164.6	-100.8	0	0	0	112.2	K379 S380 V383 F446 F447 S452 Q453 H454	K379-Y450 HydrophobicContact CB-CE2 4.14Å; S380-Y450 VanDerWaalsContact CA-CD2 3.49Å; V383-Y450 HydrophobicContact CG2-CD2 3.94Å; V383-Y450 HydrophobicContact CG2-CE2 3.49Å; V383-Y450 VanDerWaalsContact CG2-CE2 3.49Å; F446-Y450 WeakPolarHBondContact O-CB 3.33Å; F446-Y450 PolarHBondContact O-N 3.45Å; F447-Y450 HydrophobicContact CD2-CD1 4.34Å; F447-Y450 HydrophobicContact CE2-CD1 4.25Å; F447-Y450 HydrophobicContact CE2-CE1 4.41Å; F447-Y450 WeakPolarHBondContact O-CB 3.33Å; F447-Y450 PolarHBondContact O-N 3.44Å; Y450-S452 VanDerWaalsContact C-N 3.33Å; Y450-S452 PolarHBondContact O-N 3.27Å; Y450-Q453 PolarHBondContact O-N 3.32Å; Y450-H454 AromaticContact CZ-CD2 3.68Å; Y450-H454 VanDerWaalsContact O-CB 3.27Å; Y450-H454 WeakPolarHBondContact O-CB 3.37Å; Y450-H454 PolarHBondContact O-N 2.98Å; Y450-H454 PolarHBondContact OH-CD2 3.31Å
451	R	94.7	Very high	92	Very high	26 Å²	26	37 Å²	37	10%	0.098	21%	0.205	C	C	.	.	H	α-helix	trans	-65.6	-35.3	-178.7	176.5	163.6	142.1	-174.9	-14.6	112.2	L416 F447 S448 T449 H454 G455 D510 V514	L416-R451 HydrophobicContact CD2-CG 3.83Å; F447-R451 HydrophobicContact CD1-CB 4.46Å; F447-R451 HydrophobicContact CE1-CB 4.22Å; F447-R451 VanDerWaalsContact O-CB 3.32Å; F447-R451 WeakPolarHBondContact O-CB 3.36Å; F447-R451 PolarHBondContact O-N 2.97Å; S448-R451 PolarHBondContact O-N 2.94Å; T449-R451 PolarHBondContact O-N 3.35Å; R451-H454 PolarHBondContact O-N 2.73Å; R451-G455 PolarHBondContact O-N 3.49Å; R451-D510 IonicContact CZ-OD1 3.52Å; R451-D510 IonicContact CZ-OD2 2.76Å; R451-D510 IonicContact NH1-OD1 2.67Å; R451-D510 IonicContact NH1-OD2 3.56Å; R451-D510 PolarHBondContact NH1-OD2 3.31Å; R451-D510 IonicContact NH2-OD1 2.89Å; R451-D510 PolarHBondContact NH2-OD1 3.46Å; R451-D510 IonicContact NH2-OD2 3.6Å; R451-D510 PolarHBondContact NH2-OD2 3.25Å; R451-D510 VanDerWaalsContact NH2-OD2 3.15Å; R451-V514 HydrophobicContact CG-CG1 4.32Å
452	S	92.3	Very high	92.4	Very high	79 Å²	79	35 Å²	35	55%	0.552	20%	0.195	S	C	*	.	H	α-helix	trans	-60.7	-53.5	173.1	-174.1	0	0	0	0	111.3	S448 T449 Y450 H454 G455 D456	S448-S452 PolarHBondContact O-N 3.26Å; S448-S452 VanDerWaalsContact O-N 3.07Å; T449-S452 WeakPolarHBondContact O-CB 3.39Å; T449-S452 PolarHBondContact O-N 3.26Å; Y450-S452 VanDerWaalsContact C-N 3.33Å; Y450-S452 PolarHBondContact O-N 3.27Å; S452-H454 VanDerWaalsContact C-N 3.32Å; S452-H454 PolarHBondContact O-N 3.39Å; S452-G455 WeakPolarHBondContact O-CA 3.04Å; S452-G455 PolarHBondContact O-N 2.96Å; S452-D456 PolarHBondContact O-N 2.65Å
453	Q	92.6	Very high	92.7	Very high	74 Å²	74	38 Å²	38	35%	0.346	20%	0.201	S	C	.	.	H	α-helix	trans	-61.1	-39.5	177.5	-66.9	177.4	-4.2	0	0	112.3	V383 T449 Y450 G455 D456 V457	V383-Q453 HydrophobicContact CG1-CB 4.02Å; T449-Q453 PolarHBondContact O-N 2.93Å; T449-Q453 VanDerWaalsContact O-N 3.14Å; Y450-Q453 PolarHBondContact O-N 3.32Å; Q453-G455 VanDerWaalsContact C-N 3.28Å; Q453-G455 PolarHBondContact O-N 3.01Å; Q453-D456 WeakPolarHBondContact O-CB 3.41Å; Q453-D456 PolarHBondContact O-N 3.33Å; Q453-V457 PolarHBondContact O-N 3.07Å
454	H	94.4	Very high	92.6	Very high	0 Å²	0	40 Å²	40	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-65.5	-32.4	176.2	-163.6	-61.6	0	0	0	112.1	Y408 S412 Y450 R451 S452 D456 V457 L458	Y408-H454 AromaticContact CE1-CE1 3.66Å; Y408-H454 AromaticContact CE1-NE2 3.82Å; Y408-H454 AromaticContact CZ-NE2 3.7Å; Y408-H454 PolarHBondContact OH-CD2 3.04Å; Y408-H454 PolarHBondContact OH-NE2 3.47Å; S412-H454 PolarHBondContact OG-CE1 3.06Å; Y450-H454 AromaticContact CZ-CD2 3.68Å; Y450-H454 VanDerWaalsContact O-CB 3.27Å; Y450-H454 WeakPolarHBondContact O-CB 3.37Å; Y450-H454 PolarHBondContact O-N 2.98Å; Y450-H454 PolarHBondContact OH-CD2 3.31Å; R451-H454 PolarHBondContact O-N 2.73Å; S452-H454 VanDerWaalsContact C-N 3.32Å; S452-H454 PolarHBondContact O-N 3.39Å; H454-D456 VanDerWaalsContact C-N 3.35Å; H454-V457 PolarHBondContact O-N 2.88Å; H454-L458 PolarHBondContact O-N 3.11Å
455	G	94.6	Very high	92.8	Very high	2 Å²	2	39.7 Å²	39.7	2%	0.021	21%	0.21	C	C	.	.	H	α-helix	trans	-60.7	-40.3	171.2	0	0	0	0	0	112.7	R451 S452 Q453 V457 L458 R459	R451-G455 PolarHBondContact O-N 3.49Å; S452-G455 WeakPolarHBondContact O-CA 3.04Å; S452-G455 PolarHBondContact O-N 2.96Å; Q453-G455 VanDerWaalsContact C-N 3.28Å; Q453-G455 PolarHBondContact O-N 3.01Å; G455-V457 VanDerWaalsContact C-N 3.32Å; G455-V457 PolarHBondContact O-N 3.17Å; G455-L458 WeakPolarHBondContact O-CB 3.26Å; G455-L458 PolarHBondContact O-N 2.97Å; G455-R459 WeakPolarHBondContact O-CG 3.49Å; G455-R459 PolarHBondContact O-N 3.06Å
456	D	92.6	Very high	93.1	Very high	81 Å²	81	37.5 Å²	37.5	43%	0.433	19%	0.194	S	C	.	.	H	α-helix	trans	-63.6	-38.1	175.8	-64.7	-26.3	0	0	0	112.4	S452 Q453 H454 R459 T460	S452-D456 PolarHBondContact O-N 2.65Å; Q453-D456 WeakPolarHBondContact O-CB 3.41Å; Q453-D456 PolarHBondContact O-N 3.33Å; H454-D456 VanDerWaalsContact C-N 3.35Å; D456-R459 PolarHBondContact O-N 3.32Å; D456-R459 IonicContact OD1-CZ 3.3Å; D456-R459 IonicContact OD1-NH1 3.7Å; D456-R459 PolarHBondContact OD1-NH1 2.97Å; D456-T460 PolarHBondContact O-N 3.28Å; D456-T460 VanDerWaalsContact O-N 3.11Å; D456-T460 PolarHBondContact O-OG1 3.35Å; D456-T460 VanDerWaalsContact O-OG1 3.08Å
457	V	95.6	Very high	93.1	Very high	1 Å²	1	39.5 Å²	39.5	1%	0.006	21%	0.21	C	C	.	.	H	α-helix	trans	-64	-44.4	173.4	-176.7	0	0	0	0	110.6	V383 W386 A387 F390 Y408 Q453 H454 G455 R459 T460 L461	V383-V457 HydrophobicContact CG1-CG2 3.66Å; W386-V457 HydrophobicContact CB-CG1 4.39Å; A387-V457 HydrophobicContact CB-CG2 3.7Å; F390-V457 HydrophobicContact CD2-CG1 3.79Å; F390-V457 HydrophobicContact CE2-CG1 3.96Å; Y408-V457 HydrophobicContact CD1-CG1 4.47Å; Y408-V457 HydrophobicContact CE1-CG1 3.7Å; Q453-V457 PolarHBondContact O-N 3.07Å; H454-V457 PolarHBondContact O-N 2.88Å; G455-V457 VanDerWaalsContact C-N 3.32Å; G455-V457 PolarHBondContact O-N 3.17Å; V457-R459 VanDerWaalsContact C-N 3.34Å; V457-R459 PolarHBondContact O-N 3.29Å; V457-T460 CarbonylContact O-C 3.57Å; V457-T460 WeakPolarHBondContact O-CA 3.37Å; V457-T460 WeakPolarHBondContact O-CB 3.29Å; V457-T460 PolarHBondContact O-N 3.38Å; V457-L461 HydrophobicContact CG1-CD1 4.02Å; V457-L461 HydrophobicContact CG1-CG 4.38Å; V457-L461 WeakPolarHBondContact O-CG 3.4Å; V457-L461 PolarHBondContact O-N 3.23Å
458	L	95.6	Very high	93.2	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-60.5	-39.3	176.7	-80.3	171.2	0	0	0	113.3	L409 S412 L416 H454 G455 T460 L461 S462 F515 C518	L409-L458 HydrophobicContact CD1-CD2 4.06Å; S412-L458 WeakPolarHBondContact OG-CD2 3.35Å; L416-L458 HydrophobicContact CD1-CD1 3.72Å; L416-L458 HydrophobicContact CD2-CD1 4.42Å; L416-L458 HydrophobicContact CG-CD1 4.39Å; H454-L458 PolarHBondContact O-N 3.11Å; G455-L458 WeakPolarHBondContact O-CB 3.26Å; G455-L458 PolarHBondContact O-N 2.97Å; L458-T460 VanDerWaalsContact C-N 3.31Å; L458-T460 PolarHBondContact O-N 3.17Å; L458-L461 HydrophobicContact CD2-CD1 4.3Å; L458-L461 PolarHBondContact O-N 3.37Å; L458-S462 WeakPolarHBondContact O-CB 3.48Å; L458-S462 PolarHBondContact O-N 2.9Å; L458-S462 PolarHBondContact O-OG 2.78Å; L458-F515 HydrophobicContact CD1-CD2 3.77Å; L458-F515 HydrophobicContact CD1-CE2 4.26Å; L458-F515 HydrophobicContact CD2-CD2 3.98Å; L458-F515 HydrophobicContact CD2-CE2 3.59Å; L458-C518 HydrophobicContact CB-CB 4.2Å
459	R	95	Very high	93.4	Very high	86 Å²	86	40.9 Å²	40.9	33%	0.325	21%	0.21	S	C	.	.	H	α-helix	trans	-63.9	-39.2	172.6	-64.1	-169.7	-154.6	102.7	3.8	111.1	G455 D456 V457 S462 R463 C518 Q522	G455-R459 WeakPolarHBondContact O-CG 3.49Å; G455-R459 PolarHBondContact O-N 3.06Å; D456-R459 PolarHBondContact O-N 3.32Å; D456-R459 IonicContact OD1-CZ 3.3Å; D456-R459 IonicContact OD1-NH1 3.7Å; D456-R459 PolarHBondContact OD1-NH1 2.97Å; V457-R459 VanDerWaalsContact C-N 3.34Å; V457-R459 PolarHBondContact O-N 3.29Å; R459-S462 PolarHBondContact O-N 2.8Å; R459-R463 PolarHBondContact O-N 3.06Å; R459-C518 HydrophobicContact CG-CB 3.97Å; R459-Q522 HydrophobicContact CB-CB 4.47Å; R459-Q522 WeakPolarHBondContact O-CG 3.45Å
460	T	93.5	Very high	93.6	Very high	19 Å²	19	37.5 Å²	37.5	12%	0.117	19%	0.189	C	C	.	.	H	α-helix	trans	-65.9	-42.1	175.7	-54.3	0	0	0	0	111.7	F390 R391 D456 V457 L458 R463 I464	F390-T460 HydrophobicContact CB-CG2 3.67Å; F390-T460 WeakPolarHBondContact O-CG2 3.46Å; R391-T460 HydrophobicContact CG-CG2 3.61Å; D456-T460 PolarHBondContact O-N 3.28Å; D456-T460 VanDerWaalsContact O-N 3.11Å; D456-T460 PolarHBondContact O-OG1 3.35Å; D456-T460 VanDerWaalsContact O-OG1 3.08Å; V457-T460 CarbonylContact O-C 3.57Å; V457-T460 WeakPolarHBondContact O-CA 3.37Å; V457-T460 WeakPolarHBondContact O-CB 3.29Å; V457-T460 PolarHBondContact O-N 3.38Å; L458-T460 VanDerWaalsContact C-N 3.31Å; L458-T460 PolarHBondContact O-N 3.17Å; T460-R463 VanDerWaalsContact O-CB 3.28Å; T460-R463 WeakPolarHBondContact O-CB 3.41Å; T460-R463 PolarHBondContact O-N 3.3Å; T460-I464 PolarHBondContact O-N 3.09Å
461	L	93.7	Very high	93.6	Very high	2 Å²	2	40.6 Å²	40.6	1%	0.01	20%	0.204	C	C	.	.	H	α-helix	trans	-62.4	-44.2	176.6	-74.9	167.8	0	0	0	112.4	F390 A405 Y408 V457 L458 R463 I464 L465	F390-L461 HydrophobicContact CD1-CD2 4.16Å; F390-L461 HydrophobicContact CD2-CD1 4.45Å; F390-L461 HydrophobicContact CD2-CD2 3.61Å; F390-L461 HydrophobicContact CD2-CG 3.89Å; F390-L461 HydrophobicContact CE1-CD2 4.03Å; F390-L461 HydrophobicContact CE2-CD1 4.13Å; F390-L461 HydrophobicContact CE2-CD2 3.48Å; F390-L461 VanDerWaalsContact CE2-CD2 3.48Å; F390-L461 HydrophobicContact CE2-CG 3.95Å; F390-L461 HydrophobicContact CG-CD2 3.97Å; F390-L461 HydrophobicContact CZ-CD2 3.69Å; A405-L461 HydrophobicContact CB-CD2 3.44Å; A405-L461 VanDerWaalsContact CB-CD2 3.44Å; Y408-L461 HydrophobicContact CD1-CD1 3.26Å; Y408-L461 HydrophobicContact CE1-CD1 3.74Å; Y408-L461 HydrophobicContact CG-CD1 4.2Å; V457-L461 HydrophobicContact CG1-CD1 4.02Å; V457-L461 HydrophobicContact CG1-CG 4.38Å; V457-L461 WeakPolarHBondContact O-CG 3.4Å; V457-L461 PolarHBondContact O-N 3.23Å; L458-L461 HydrophobicContact CD2-CD1 4.3Å; L458-L461 PolarHBondContact O-N 3.37Å; L461-R463 PolarHBondContact O-N 3.09Å; L461-R463 VanDerWaalsContact O-N 3.16Å; L461-I464 WeakPolarHBondContact O-CA 3.33Å; L461-I464 PolarHBondContact O-N 3.47Å; L461-L465 PolarHBondContact O-N 3.19Å
462	S	93.4	Very high	93.7	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-63.2	-21.1	178.1	-56.5	0	0	0	0	112.5	L458 R459 P466	L458-S462 WeakPolarHBondContact O-CB 3.48Å; L458-S462 PolarHBondContact O-N 2.9Å; L458-S462 PolarHBondContact O-OG 2.78Å; R459-S462 PolarHBondContact O-N 2.8Å; S462-P466 WeakPolarHBondContact O-CA 3.06Å; S462-P466 WeakPolarHBondContact O-CB 3.26Å
463	R	91.2	Very high	93.9	Very high	122 Å²	122	36.9 Å²	36.9	46%	0.46	18%	0.18	S	C	.	.	H	α-helix	trans	-74.9	-34.6	170.7	-172.2	-178.2	63.1	174.3	1.7	112.3	R459 T460 L461 Q522	R459-R463 PolarHBondContact O-N 3.06Å; T460-R463 VanDerWaalsContact O-CB 3.28Å; T460-R463 WeakPolarHBondContact O-CB 3.41Å; T460-R463 PolarHBondContact O-N 3.3Å; L461-R463 PolarHBondContact O-N 3.09Å; L461-R463 VanDerWaalsContact O-N 3.16Å; R463-Q522 HydrophobicContact CB-CG 4.19Å
464	I	90.3	Very high	94.1	Very high	43 Å²	43	33.4 Å²	33.4	22%	0.221	16%	0.164	C	C	.	.	H	α-helix	trans	-81.8	-44.1	-178.8	-57.2	170.9	0	0	0	110.3	F390 T460 L461 P466	F390-I464 HydrophobicContact CB-CD1 3.87Å; F390-I464 HydrophobicContact CD1-CD1 4.3Å; F390-I464 HydrophobicContact CG-CD1 4.36Å; T460-I464 PolarHBondContact O-N 3.09Å; L461-I464 WeakPolarHBondContact O-CA 3.33Å; L461-I464 PolarHBondContact O-N 3.47Å; I464-P466 WeakPolarHBondContact O-CD 3.29Å
465	L	92.6	Very high	94.2	Very high	29 Å²	29	38.4 Å²	38.4	15%	0.152	19%	0.188	C	C	.	.	S	Bend	trans	-123.7	60.4	-174.3	-61.4	175.4	0	0	0	111.8	V402 A405 L406 L461 V467 E468 A469	V402-L465 HydrophobicContact CG1-CD2 4.01Å; A405-L465 HydrophobicContact CB-CD1 3.76Å; L406-L465 HydrophobicContact CB-CD1 3.97Å; L406-L465 HydrophobicContact CD1-CD1 4.43Å; L461-L465 PolarHBondContact O-N 3.19Å; L465-V467 PolarHBondContact O-N 3.34Å; L465-E468 HydrophobicContact CB-CB 4.48Å; L465-E468 PolarHBondContact O-N 3.32Å; L465-A469 VanDerWaalsContact O-CB 3.23Å; L465-A469 WeakPolarHBondContact O-CB 3.27Å; L465-A469 PolarHBondContact O-N 3.5Å
466	P	92.4	Very high	94.3	Very high	31 Å²	31	39.5 Å²	39.5	20%	0.201	19%	0.191	C	C	.	.	H	α-helix	trans	-63.1	-38.6	-171.5	22.3	-32.9	0	0	0	114.1	S462 I464 F470 M527	S462-P466 WeakPolarHBondContact O-CA 3.06Å; S462-P466 WeakPolarHBondContact O-CB 3.26Å; I464-P466 WeakPolarHBondContact O-CD 3.29Å; P466-F470 WeakPolarHBondContact O-CB 3.37Å; P466-F470 PolarHBondContact O-N 3.32Å; P466-F470 VanDerWaalsContact O-N 3.08Å; P466-M527 HydrophobicContact CB-CE 4.48Å; P466-M527 HydrophobicContact CB-CG 3.66Å; P466-M527 HydrophobicContact CB-SD 3.6Å; P466-M527 HydrophobicContact CG-CG 4.23Å; P466-M527 HydrophobicContact CG-SD 4.45Å
467	V	92.1	Very high	94.5	Very high	98 Å²	98	35.7 Å²	35.7	59%	0.594	17%	0.171	S	C	*	.	H	α-helix	trans	-69.4	-47.1	-178.4	179.8	0	0	0	0	111	L465 F470 H471	L465-V467 PolarHBondContact O-N 3.34Å; V467-F470 PolarHBondContact O-N 2.78Å; V467-H471 WeakPolarHBondContact O-CB 3.48Å; V467-H471 PolarHBondContact O-N 3.26Å
468	E	93.9	Very high	94.5	Very high	86 Å²	86	39.3 Å²	39.3	40%	0.402	19%	0.185	S	C	.	.	H	α-helix	trans	-69.9	-36.7	-180	-65	-60.1	168	0	0	112.5	L406 L409 L465 H471 T472	L406-E468 HydrophobicContact CD1-CB 3.95Å; L406-E468 HydrophobicContact CD1-CG 3.97Å; L409-E468 HydrophobicContact CD2-CB 4.27Å; L465-E468 HydrophobicContact CB-CB 4.48Å; L465-E468 PolarHBondContact O-N 3.32Å; E468-H471 PolarHBondContact O-N 2.94Å; E468-T472 WeakPolarHBondContact O-CB 3.45Å; E468-T472 PolarHBondContact O-N 3.29Å; E468-T472 PolarHBondContact O-OG1 3.43Å
469	A	95.2	Very high	94.5	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-59.7	-46.3	172.5	0	0	0	0	0	111.6	L409 L465 A473 V519	L409-A469 HydrophobicContact CD1-CB 4.14Å; L409-A469 HydrophobicContact CD2-CB 4.18Å; L465-A469 VanDerWaalsContact O-CB 3.23Å; L465-A469 WeakPolarHBondContact O-CB 3.27Å; L465-A469 PolarHBondContact O-N 3.5Å; A469-A473 PolarHBondContact O-N 3.42Å; A469-A473 VanDerWaalsContact O-N 3.13Å; A469-V519 HydrophobicContact CB-CG1 4.11Å; A469-V519 HydrophobicContact CB-CG2 4.25Å
470	F	95.6	Very high	94.5	Very high	6 Å²	6	41.9 Å²	41.9	3%	0.026	20%	0.198	C	C	.	.	H	α-helix	trans	-61.1	-47.5	174.4	-178.6	-97.9	0	0	0	111.9	P466 V467 T472 A473 A474 M520 I523 P533 Q536 S537 L540 F568	P466-F470 WeakPolarHBondContact O-CB 3.37Å; P466-F470 PolarHBondContact O-N 3.32Å; P466-F470 VanDerWaalsContact O-N 3.08Å; V467-F470 PolarHBondContact O-N 2.78Å; F470-T472 PolarHBondContact O-N 3.1Å; F470-A473 PolarHBondContact O-N 2.94Å; F470-A474 HydrophobicContact CE1-CB 4.27Å; F470-A474 VanDerWaalsContact O-CB 3.28Å; F470-A474 WeakPolarHBondContact O-CB 3.26Å; F470-A474 PolarHBondContact O-N 3.4Å; F470-M520 HydrophobicContact CD2-CE 3.74Å; F470-M520 HydrophobicContact CD2-SD 4.02Å; F470-M520 HydrophobicContact CE2-CE 3.4Å; F470-M520 HydrophobicContact CE2-SD 4.11Å; F470-I523 HydrophobicContact CB-CD1 3.65Å; F470-I523 HydrophobicContact CD2-CD1 3.73Å; F470-I523 HydrophobicContact CG-CD1 4.14Å; F470-P533 HydrophobicContact CD1-CB 3.93Å; F470-P533 HydrophobicContact CD1-CG 3.62Å; F470-P533 HydrophobicContact CD2-CG 3.69Å; F470-P533 HydrophobicContact CE1-CB 3.54Å; F470-P533 HydrophobicContact CE1-CG 3.47Å; F470-P533 VanDerWaalsContact CE1-CG 3.47Å; F470-P533 HydrophobicContact CE2-CB 4.41Å; F470-P533 HydrophobicContact CE2-CG 3.53Å; F470-P533 HydrophobicContact CG-CG 3.73Å; F470-P533 HydrophobicContact CZ-CB 3.82Å; F470-P533 HydrophobicContact CZ-CG 3.43Å; F470-P533 VanDerWaalsContact CZ-CG 3.43Å; F470-Q536 HydrophobicContact CE1-CB 4.11Å; F470-Q536 HydrophobicContact CE1-CG 4.09Å; F470-Q536 HydrophobicContact CZ-CB 4.39Å; F470-S537 VanDerWaalsContact CE2-OG 3.24Å; F470-S537 WeakPolarHBondContact CE2-OG 3.31Å; F470-S537 WeakPolarHBondContact CZ-OG 3.26Å; F470-L540 HydrophobicContact CZ-CD1 4.08Å; F470-F568 HydrophobicContact CE2-CZ 4.28Å
471	H	95.1	Very high	94.5	Very high	68 Å²	68	42.9 Å²	42.9	32%	0.315	20%	0.204	S	C	.	.	H	α-helix	trans	-60.4	-47.7	-177.6	-175.6	54.7	0	0	0	111.6	V467 E468 A473 A474 E475	V467-H471 WeakPolarHBondContact O-CB 3.48Å; V467-H471 PolarHBondContact O-N 3.26Å; E468-H471 PolarHBondContact O-N 2.94Å; H471-A473 VanDerWaalsContact C-N 3.32Å; H471-A473 PolarHBondContact O-N 2.89Å; H471-A474 WeakPolarHBondContact O-CB 3.42Å; H471-A474 PolarHBondContact O-N 3.35Å; H471-E475 IonicContact CE1-OE1 3.84Å; H471-E475 PolarHBondContact CE1-OE1 3.45Å; H471-E475 IonicContact NE2-OE1 2.65Å; H471-E475 PolarHBondContact NE2-OE1 3.12Å; H471-E475 VanDerWaalsContact NE2-OE1 3.15Å; H471-E475 IonicContact NE2-OE2 3.8Å; H471-E475 WeakPolarHBondContact O-CG 3.23Å; H471-E475 PolarHBondContact O-N 2.87Å
472	T	96.2	Very high	94.5	Very high	26 Å²	26	47 Å²	47	16%	0.16	24%	0.238	C	C	.	.	H	α-helix	trans	-57.9	-44.6	176.5	-55.2	0	0	0	0	111.3	T413 E468 F470 W476 F515	T413-T472 HydrophobicContact CG2-CG2 3.82Å; E468-T472 WeakPolarHBondContact O-CB 3.45Å; E468-T472 PolarHBondContact O-N 3.29Å; E468-T472 PolarHBondContact O-OG1 3.43Å; F470-T472 PolarHBondContact O-N 3.1Å; T472-W476 WeakPolarHBondContact O-CB 3.49Å; T472-W476 PolarHBondContact O-N 3.37Å; T472-F515 HydrophobicContact CG2-CE1 4.27Å; T472-F515 HydrophobicContact CG2-CZ 4.01Å
473	A	96.3	Very high	94.5	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-66.2	-41.7	177.9	0	0	0	0	0	112.4	A469 F470 H471 W476 L477 F515 M516 V519	A469-A473 PolarHBondContact O-N 3.42Å; A469-A473 VanDerWaalsContact O-N 3.13Å; F470-A473 PolarHBondContact O-N 2.94Å; H471-A473 VanDerWaalsContact C-N 3.32Å; H471-A473 PolarHBondContact O-N 2.89Å; A473-W476 PolarHBondContact O-N 2.94Å; A473-L477 WeakPolarHBondContact O-CB 3.46Å; A473-L477 PolarHBondContact O-N 3.22Å; A473-F515 HydrophobicContact CB-CD1 3.77Å; A473-F515 HydrophobicContact CB-CE1 3.67Å; A473-M516 HydrophobicContact CB-CE 3.19Å; A473-M516 HydrophobicContact CB-SD 3.64Å; A473-V519 HydrophobicContact CB-CG1 4.46Å
474	A	96.4	Very high	94.4	Very high	1 Å²	1	48.3 Å²	48.3	1%	0.008	26%	0.264	C	S	.	.	H	α-helix	trans	-63.6	-43	179.5	0	0	0	0	0	111.8	F470 H471 R478 L540	F470-A474 HydrophobicContact CE1-CB 4.27Å; F470-A474 VanDerWaalsContact O-CB 3.28Å; F470-A474 WeakPolarHBondContact O-CB 3.26Å; F470-A474 PolarHBondContact O-N 3.4Å; H471-A474 WeakPolarHBondContact O-CB 3.42Å; H471-A474 PolarHBondContact O-N 3.35Å; A474-R478 WeakPolarHBondContact O-CG 3.37Å; A474-R478 PolarHBondContact O-N 3.28Å; A474-L540 HydrophobicContact CB-CD1 3.55Å; A474-L540 HydrophobicContact CB-CD2 4.2Å; A474-L540 HydrophobicContact CB-CG 4.42Å
475	E	96.2	Very high	94.4	Very high	105 Å²	105	48.9 Å²	48.9	49%	0.491	27%	0.269	S	S	.	.	H	α-helix	trans	-66.1	-44.5	175.8	-70.5	-167.3	151.2	0	0	111.9	H471 L477 R478 F479	H471-E475 IonicContact CE1-OE1 3.84Å; H471-E475 PolarHBondContact CE1-OE1 3.45Å; H471-E475 IonicContact NE2-OE1 2.65Å; H471-E475 PolarHBondContact NE2-OE1 3.12Å; H471-E475 VanDerWaalsContact NE2-OE1 3.15Å; H471-E475 IonicContact NE2-OE2 3.8Å; H471-E475 WeakPolarHBondContact O-CG 3.23Å; H471-E475 PolarHBondContact O-N 2.87Å; E475-L477 VanDerWaalsContact C-N 3.34Å; E475-L477 PolarHBondContact O-N 3.38Å; E475-R478 PolarHBondContact O-N 3.46Å; E475-F479 WeakPolarHBondContact O-CB 3.39Å; E475-F479 PolarHBondContact O-N 3.49Å
476	W	96.6	Very high	94.1	Very high	25 Å²	25	51.3 Å²	51.3	10%	0.095	28%	0.282	C	S	.	.	H	α-helix	trans	-63.9	-40.1	178.7	-167.2	6.4	0	0	0	111.7	T413 T472 A473 F479 Q480 A511 L512 F515	T413-W476 HydrophobicContact CG2-CD2 4.5Å; T413-W476 HydrophobicContact CG2-CE3 3.75Å; T413-W476 HydrophobicContact CG2-CZ3 3.77Å; T413-W476 WeakPolarHBondContact O-CH2 3.44Å; T413-W476 WeakPolarHBondContact O-CZ2 3.24Å; T472-W476 WeakPolarHBondContact O-CB 3.49Å; T472-W476 PolarHBondContact O-N 3.37Å; A473-W476 PolarHBondContact O-N 2.94Å; W476-F479 WeakPolarHBondContact O-CB 3.32Å; W476-F479 PolarHBondContact O-N 3.16Å; W476-Q480 WeakPolarHBondContact O-CG 3.45Å; W476-Q480 PolarHBondContact O-N 3.07Å; W476-A511 HydrophobicContact CH2-CB 4.03Å; W476-A511 HydrophobicContact CZ2-CB 4.24Å; W476-L512 HydrophobicContact CB-CD1 3.87Å; W476-L512 HydrophobicContact CD2-CB 4.13Å; W476-L512 HydrophobicContact CD2-CD1 3.82Å; W476-L512 HydrophobicContact CE3-CB 4.48Å; W476-L512 HydrophobicContact CE3-CD1 3.99Å; W476-L512 HydrophobicContact CG-CD1 3.76Å; W476-L512 HydrophobicContact CZ2-CB 4.3Å; W476-F515 HydrophobicContact CE3-CB 4.4Å; W476-F515 HydrophobicContact CE3-CD1 4.33Å; W476-F515 HydrophobicContact CE3-CG 4.26Å; W476-F515 HydrophobicContact CZ3-CB 3.9Å; W476-F515 HydrophobicContact CZ3-CD1 4.48Å; W476-F515 HydrophobicContact CZ3-CD2 4.17Å; W476-F515 AromaticContact CZ3-CG 3.95Å; W476-F515 HydrophobicContact CZ3-CG 3.95Å
477	L	97.1	Very high	93.5	Very high	1 Å²	1	51.7 Å²	51.7	1%	0.005	29%	0.285	C	S	.	.	H	α-helix	trans	-63.6	-45.7	173.9	-179.8	61.6	0	0	0	112.3	A473 E475 F479 Q480 V481 W509 L512 L540 V544 L565	A473-L477 WeakPolarHBondContact O-CB 3.46Å; A473-L477 PolarHBondContact O-N 3.22Å; E475-L477 VanDerWaalsContact C-N 3.34Å; E475-L477 PolarHBondContact O-N 3.38Å; L477-F479 VanDerWaalsContact C-N 3.27Å; L477-F479 PolarHBondContact O-N 3.47Å; L477-Q480 PolarHBondContact O-N 2.6Å; L477-V481 HydrophobicContact CD1-CG2 4.13Å; L477-V481 HydrophobicContact CG-CG2 4.49Å; L477-V481 WeakPolarHBondContact O-CB 3.12Å; L477-V481 VanDerWaalsContact O-CG2 3.29Å; L477-V481 WeakPolarHBondContact O-CG2 3.41Å; L477-V481 PolarHBondContact O-N 3.29Å; L477-W509 HydrophobicContact CD1-CZ3 4.22Å; L477-L512 HydrophobicContact CB-CD1 4.34Å; L477-L512 HydrophobicContact CB-CD2 4.2Å; L477-L512 HydrophobicContact CD1-CD2 3.86Å; L477-L540 HydrophobicContact CD2-CB 4.17Å; L477-L540 HydrophobicContact CD2-CD2 4.3Å; L477-V544 HydrophobicContact CD1-CG2 3.88Å; L477-V544 HydrophobicContact CD2-CG2 3.82Å; L477-V544 HydrophobicContact CG-CG2 4.13Å; L477-L565 HydrophobicContact CD2-CD1 4.09Å
478	R	96.5	Very high	92.8	Very high	78 Å²	78	48.2 Å²	48.2	29%	0.294	27%	0.269	S	S	.	.	H	α-helix	trans	-58.3	-42.8	174.7	-75.5	-176.9	-174.9	95.8	1.1	111.2	A474 E475 V481 A482 E539 L540	A474-R478 WeakPolarHBondContact O-CG 3.37Å; A474-R478 PolarHBondContact O-N 3.28Å; E475-R478 PolarHBondContact O-N 3.46Å; R478-V481 PolarHBondContact O-N 3.07Å; R478-A482 WeakPolarHBondContact O-CB 3.48Å; R478-A482 PolarHBondContact O-N 3.33Å; R478-E539 IonicContact CZ-OE2 3.75Å; R478-E539 IonicContact NE-OE2 3.53Å; R478-E539 IonicContact NH2-OE2 2.76Å; R478-E539 PolarHBondContact NH2-OE2 3.47Å; R478-L540 HydrophobicContact CG-CD2 3.69Å
479	F	95.7	Very high	91.4	Very high	128 Å²	128	52.7 Å²	52.7	56%	0.561	29%	0.29	S	S	*	.	H	α-helix	trans	-61.7	-46.4	177.6	177.8	-95.5	0	0	0	111.9	E475 W476 L477 A482 S483	E475-F479 WeakPolarHBondContact O-CB 3.39Å; E475-F479 PolarHBondContact O-N 3.49Å; W476-F479 WeakPolarHBondContact O-CB 3.32Å; W476-F479 PolarHBondContact O-N 3.16Å; L477-F479 VanDerWaalsContact C-N 3.27Å; L477-F479 PolarHBondContact O-N 3.47Å; F479-A482 PolarHBondContact O-N 3.22Å; F479-S483 WeakPolarHBondContact O-CB 3.47Å; F479-S483 PolarHBondContact O-N 3.27Å; F479-S483 PolarHBondContact O-OG 3.24Å
480	Q	94.8	Very high	89.3	Confident	12 Å²	12	57.5 Å²	57.5	6%	0.056	32%	0.319	C	S	.	.	H	α-helix	trans	-67.2	-38.8	179.9	-70.2	-57.5	-40	0	0	112.6	W476 L477 A482 S483 W509 L512	W476-Q480 WeakPolarHBondContact O-CG 3.45Å; W476-Q480 PolarHBondContact O-N 3.07Å; L477-Q480 PolarHBondContact O-N 2.6Å; Q480-A482 VanDerWaalsContact C-N 3.3Å; Q480-A482 PolarHBondContact O-N 2.92Å; Q480-S483 PolarHBondContact O-N 2.77Å; Q480-W509 HydrophobicContact CB-CD2 4.29Å; Q480-W509 HydrophobicContact CB-CH2 4.26Å; Q480-W509 HydrophobicContact CB-CZ2 3.83Å; Q480-L512 HydrophobicContact CB-CD2 3.85Å; Q480-L512 HydrophobicContact CG-CD2 3.6Å
481	V	94.3	Very high	87	Confident	39 Å²	39	63.7 Å²	63.7	24%	0.236	36%	0.357	C	S	.	.	H	α-helix	trans	-64.6	-34.9	175.9	170.6	0	0	0	0	111.7	L477 R478 W509 V544 Y547	L477-V481 HydrophobicContact CD1-CG2 4.13Å; L477-V481 HydrophobicContact CG-CG2 4.49Å; L477-V481 WeakPolarHBondContact O-CB 3.12Å; L477-V481 VanDerWaalsContact O-CG2 3.29Å; L477-V481 WeakPolarHBondContact O-CG2 3.41Å; L477-V481 PolarHBondContact O-N 3.29Å; R478-V481 PolarHBondContact O-N 3.07Å; V481-W509 HydrophobicContact CG2-CH2 3.85Å; V481-W509 HydrophobicContact CG2-CZ2 4.46Å; V481-V544 HydrophobicContact CG2-CG2 4.4Å; V481-Y547 HydrophobicContact CB-CD2 4.48Å; V481-Y547 HydrophobicContact CG1-CD2 3.93Å; V481-Y547 WeakPolarHBondContact O-CE2 2.89Å
482	A	93.7	Very high	84.8	Confident	88 Å²	88	62.5 Å²	62.5	73%	0.727	36%	0.357	S	S	*	.	H	α-helix	trans	-82.8	-20.7	178.7	0	0	0	0	0	114	R478 F479 Q480	R478-A482 WeakPolarHBondContact O-CB 3.48Å; R478-A482 PolarHBondContact O-N 3.33Å; F479-A482 PolarHBondContact O-N 3.22Å; Q480-A482 VanDerWaalsContact C-N 3.3Å; Q480-A482 PolarHBondContact O-N 2.92Å
483	S	92.9	Very high	82.7	Confident	32 Å²	32	69.8 Å²	69.8	22%	0.224	39%	0.386	C	S	.	.	S	Bend	trans	-79.8	143.1	-175.8	-65.8	0	0	0	0	112.2	F479 Q480	F479-S483 WeakPolarHBondContact O-CB 3.47Å; F479-S483 PolarHBondContact O-N 3.27Å; F479-S483 PolarHBondContact O-OG 3.24Å; Q480-S483 PolarHBondContact O-N 2.77Å
484	P	89.5	Confident	80.7	Confident	118 Å²	118	70.7 Å²	70.7	77%	0.766	39%	0.392	S	S	*	.			trans	-68.2	148.2	174.1	30	-34.1	0	0	0	110.7	D486	P484-D486 PolarHBondContact O-N 3.32Å
485	V	88.9	Confident	78.9	Confident	55 Å²	55	72.7 Å²	72.7	33%	0.333	41%	0.408	S	S	.	.			trans	-74.7	112.1	175	-179.3	0	0	0	0	109.2	P487 C499 Y547	V485-P487 WeakPolarHBondContact O-CD 3.42Å; V485-C499 WeakPolarHBondContact CG1-SG 3.02Å; V485-Y547 WeakPolarHBondContact CG2-OH 3.44Å
486	D	87.4	Confident	77.1	Confident	81 Å²	81	77.4 Å²	77.4	43%	0.433	43%	0.43	S	S	.	.			trans	-92.3	108.5	168.3	179.7	12	0	0	0	111.1	P484 G488 S505	P484-D486 PolarHBondContact O-N 3.32Å; D486-G488 VanDerWaalsContact C-N 3.32Å; D486-G488 PolarHBondContact OD1-N 3.36Å; D486-S505 WeakPolarHBondContact CA-OG 3.46Å; D486-S505 PolarHBondContact N-OG 2.68Å; D486-S505 WeakPolarHBondContact O-CB 3.44Å; D486-S505 PolarHBondContact O-N 3.43Å; D486-S505 PolarHBondContact O-OG 2.89Å
487	P	80	Confident	75.7	Confident	39 Å²	39	78.9 Å²	78.9	25%	0.253	45%	0.453	S	S	.	.			trans	-78.7	-7.9	175.7	32.7	-34.6	0	0	0	113.8	V485 S503	V485-P487 WeakPolarHBondContact O-CD 3.42Å; P487-S503 VanDerWaalsContact O-CB 3.27Å; P487-S503 WeakPolarHBondContact O-CB 3.49Å; P487-S503 PolarHBondContact O-OG 3.07Å
488	G	77	Confident	74.9	Confident	25 Å²	25	79.8 Å²	79.8	26%	0.258	46%	0.458	S	S	.	.			trans	76.2	-173.6	-178.4	0	0	0	0	0	114.9	D486 T490	D486-G488 VanDerWaalsContact C-N 3.32Å; D486-G488 PolarHBondContact OD1-N 3.36Å; G488-T490 PolarHBondContact O-N 2.91Å
489	E	64.3	Low	74.2	Confident	180 Å²	180	76 Å²	76	84%	0.841	44%	0.444	S	S	*	.			trans	-67.1	113.5	178.9	-70.6	-174.1	171.9	0	0	111.1	T491	E489-T491 PolarHBondContact O-N 3.04Å
490	T	51.5	Low	73.6	Confident	101 Å²	101	71.2 Å²	71.2	62%	0.62	43%	0.426	S	S	*	.			trans	-69.7	70.9	-179.2	47.9	0	0	0	0	112.2	G488	G488-T490 PolarHBondContact O-N 2.91Å
491	T	46.9	Very low	72.9	Confident	135 Å²	135	75.1 Å²	75.1	83%	0.828	45%	0.447	S	S	*	.			trans	-94.3	-14.8	165.2	46.7	0	0	0	0	112.1	E489	E489-T491 PolarHBondContact O-N 3.04Å
492	S	49.4	Very low	72.3	Confident	43 Å²	43	75.8 Å²	75.8	30%	0.301	45%	0.448	S	S	.	.	S	Bend	trans	-77.6	145.3	170.7	51.8	0	0	0	0	111.2	T494	S492-T494 PolarHBondContact O-N 2.9Å; S492-T494 PolarHBondContact O-OG1 3.4Å; S492-T494 WeakPolarHBondContact OG-CG2 3.3Å; S492-T494 PolarHBondContact OG-OG1 3.25Å
493	K	51.3	Low	72.1	Confident	180 Å²	180	71.7 Å²	71.7	78%	0.783	41%	0.414	S	S	*	.			trans	-66.3	27.4	174.2	-62	175.3	-179.9	173	0	113.3
494	T	55	Low	71.8	Confident	18 Å²	18	73 Å²	73	11%	0.11	42%	0.421	C	S	.	.			trans	-72.4	138.1	178.3	44	0	0	0	0	109.7	S492 Y831	S492-T494 PolarHBondContact O-N 2.9Å; S492-T494 PolarHBondContact O-OG1 3.4Å; S492-T494 WeakPolarHBondContact OG-CG2 3.3Å; S492-T494 PolarHBondContact OG-OG1 3.25Å; T494-Y831 HydrophobicContact CG2-CD2 3.64Å; T494-Y831 HydrophobicContact CG2-CE2 4.05Å; T494-Y831 HydrophobicContact CG2-CG 4.29Å
495	A	57	Low	72	Confident	43 Å²	43	67.8 Å²	67.8	36%	0.355	39%	0.388	S	S	.	.			trans	-53.9	142.4	170.7	0	0	0	0	0	110.3	G497 L498	A495-G497 PolarHBondContact O-N 2.89Å; A495-G497 VanDerWaalsContact O-N 3.09Å; A495-L498 HydrophobicContact CB-CD1 4.31Å; A495-L498 PolarHBondContact O-N 2.93Å
496	E	59	Low	72.1	Confident	204 Å²	204	65.6 Å²	65.6	95%	0.953	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-45.3	116.7	-175	-70.1	-178.5	166.7	0	0	111.7
497	G	67.3	Low	72.3	Confident	56 Å²	56	62.4 Å²	62.4	58%	0.577	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	95.3	0.1	173.2	0	0	0	0	0	117.8	A495	A495-G497 PolarHBondContact O-N 2.89Å; A495-G497 VanDerWaalsContact O-N 3.09Å
498	L	79.8	Confident	73	Confident	20 Å²	20	63.5 Å²	63.5	11%	0.105	36%	0.359	C	S	.	.	P	Polyproline II helix	trans	-90.2	145.3	172.6	-66.4	175.9	0	0	0	112.5	A495 I591 Y831	A495-L498 HydrophobicContact CB-CD1 4.31Å; A495-L498 PolarHBondContact O-N 2.93Å; L498-I591 HydrophobicContact CD1-CD1 4.25Å; L498-Y831 HydrophobicContact CB-CE1 4.43Å; L498-Y831 HydrophobicContact CD1-CD1 4.24Å; L498-Y831 HydrophobicContact CD1-CE1 3.92Å
499	C	82.3	Confident	73.9	Confident	0 Å²	0	62.5 Å²	62.5	0%	0	35%	0.348	C	S	.	.	P	Polyproline II helix	trans	-81.7	142	178.3	-60.3	0	0	0	0	111.8	V485 S503 V506 D551 L553 Y831	V485-C499 WeakPolarHBondContact CG1-SG 3.02Å; C499-S503 WeakPolarHBondContact CA-OG 3.34Å; C499-V506 HydrophobicContact CB-CG2 3.43Å; C499-V506 VanDerWaalsContact CB-CG2 3.43Å; C499-D551 WeakPolarHBondContact CA-OD2 3.18Å; C499-D551 WeakPolarHBondContact CB-OD2 3.42Å; C499-D551 PolarHBondContact N-OD2 3.14Å; C499-L553 WeakPolarHBondContact O-CD1 3.49Å; C499-Y831 WeakPolarHBondContact O-CE2 3.24Å; C499-Y831 VanDerWaalsContact O-CZ 3.23Å; C499-Y831 PolarHBondContact O-OH 3.47Å
500	S	82.9	Confident	75.4	Confident	27 Å²	27	56 Å²	56	19%	0.189	32%	0.319	C	S	.	.	P	Polyproline II helix	trans	-86	170.5	164.6	76	0	0	0	0	111.4	M502 S503 V506	S500-M502 PolarHBondContact O-N 3.34Å; S500-M502 VanDerWaalsContact O-N 3.07Å; S500-M502 PolarHBondContact OG-N 3.14Å; S500-M502 VanDerWaalsContact OG-N 3.16Å; S500-S503 PolarHBondContact N-OG 3.49Å; S500-S503 WeakPolarHBondContact O-CB 3.43Å; S500-S503 PolarHBondContact O-N 3.34Å; S500-S503 VanDerWaalsContact O-N 3.15Å; S500-S503 PolarHBondContact O-OG 3.21Å; S500-S503 PolarHBondContact OG-N 3.3Å; S500-S503 PolarHBondContact OG-OG 3.09Å; S500-S503 VanDerWaalsContact OG-OG 3.09Å; S500-V506 WeakPolarHBondContact O-CG2 3.46Å
501	L	80.9	Confident	77.5	Confident	94 Å²	94	51.2 Å²	51.2	49%	0.492	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.3	-24.5	170	-78.4	178	0	0	0	113.7	L507 L553 I830	L501-L507 WeakPolarHBondContact O-CD2 3.5Å; L501-L553 HydrophobicContact CD2-CD1 4.43Å; L501-I830 HydrophobicContact CD1-CD1 3.55Å; L501-I830 HydrophobicContact CD1-CG1 4.14Å; L501-I830 HydrophobicContact CD2-CD1 3.43Å; L501-I830 VanDerWaalsContact CD2-CD1 3.43Å; L501-I830 HydrophobicContact CG-CD1 3.3Å; L501-I830 HydrophobicContact CG-CG1 4.15Å
502	M	82.4	Confident	79.9	Confident	53 Å²	53	44.8 Å²	44.8	26%	0.261	25%	0.25	S	C	.	.	T	Hydrogen-bonded Turn	trans	-103	2.1	-172	-57.7	-63	-73.7	0	0	112	F421 K424 S500	F421-M502 HydrophobicContact CD1-CE 3.87Å; F421-M502 HydrophobicContact CD2-CE 3.23Å; F421-M502 HydrophobicContact CE1-CE 3.71Å; F421-M502 HydrophobicContact CE1-SD 4.2Å; F421-M502 HydrophobicContact CE2-CE 3.07Å; F421-M502 HydrophobicContact CE2-SD 3.82Å; F421-M502 HydrophobicContact CG-CE 3.63Å; F421-M502 HydrophobicContact CZ-CE 3.31Å; F421-M502 HydrophobicContact CZ-SD 3.61Å; K424-M502 HydrophobicContact CD-CE 4.3Å; S500-M502 PolarHBondContact O-N 3.34Å; S500-M502 VanDerWaalsContact O-N 3.07Å; S500-M502 PolarHBondContact OG-N 3.14Å; S500-M502 VanDerWaalsContact OG-N 3.16Å
503	S	87.6	Confident	82.1	Confident	2 Å²	2	43 Å²	43	1%	0.014	24%	0.237	C	C	.	.	S	Bend	trans	-68.6	138.8	178.5	-65.3	0	0	0	0	110.3	P487 C499 S500 S505 V506 L507	P487-S503 VanDerWaalsContact O-CB 3.27Å; P487-S503 WeakPolarHBondContact O-CB 3.49Å; P487-S503 PolarHBondContact O-OG 3.07Å; C499-S503 WeakPolarHBondContact CA-OG 3.34Å; S500-S503 PolarHBondContact N-OG 3.49Å; S500-S503 WeakPolarHBondContact O-CB 3.43Å; S500-S503 PolarHBondContact O-N 3.34Å; S500-S503 VanDerWaalsContact O-N 3.15Å; S500-S503 PolarHBondContact O-OG 3.21Å; S500-S503 PolarHBondContact OG-N 3.3Å; S500-S503 PolarHBondContact OG-OG 3.09Å; S500-S503 VanDerWaalsContact OG-OG 3.09Å; S503-S505 PolarHBondContact O-N 3.44Å; S503-S505 VanDerWaalsContact O-N 3.15Å; S503-V506 PolarHBondContact O-N 3.12Å; S503-L507 WeakPolarHBondContact O-CG 3.43Å; S503-L507 PolarHBondContact O-N 3.29Å; S503-L507 VanDerWaalsContact O-N 3.13Å
504	P	88.6	Confident	84.2	Confident	58 Å²	58	35.7 Å²	35.7	38%	0.377	21%	0.208	S	C	.	.	H	α-helix	trans	-52.2	-41.9	-176.7	-28.8	35.9	0	0	0	113.5	L507 Q508	P504-L507 PolarHBondContact O-N 3.13Å; P504-Q508 WeakPolarHBondContact O-CG 3.5Å; P504-Q508 PolarHBondContact O-N 2.71Å; P504-Q508 VanDerWaalsContact O-N 3.12Å
505	S	91.9	Very high	86.2	Confident	9 Å²	9	34.8 Å²	34.8	6%	0.063	20%	0.202	C	C	.	.	H	α-helix	trans	-63	-44	178.2	-57.1	0	0	0	0	112.9	D486 S503 L507 Q508 W509	D486-S505 WeakPolarHBondContact CA-OG 3.46Å; D486-S505 PolarHBondContact N-OG 2.68Å; D486-S505 WeakPolarHBondContact O-CB 3.44Å; D486-S505 PolarHBondContact O-N 3.43Å; D486-S505 PolarHBondContact O-OG 2.89Å; S503-S505 PolarHBondContact O-N 3.44Å; S503-S505 VanDerWaalsContact O-N 3.15Å; S505-L507 VanDerWaalsContact C-N 3.34Å; S505-L507 PolarHBondContact O-N 3.05Å; S505-Q508 PolarHBondContact O-N 2.96Å; S505-W509 WeakPolarHBondContact O-CB 3.11Å; S505-W509 VanDerWaalsContact O-CD1 3.22Å; S505-W509 PolarHBondContact O-N 3.49Å
506	V	91.6	Very high	88	Confident	9 Å²	9	32.8 Å²	32.8	6%	0.055	19%	0.185	C	C	.	.	H	α-helix	trans	-64.6	-42.1	-179.1	172.8	0	0	0	0	110.4	C499 S500 S503 Q508 W509 D510 L553 I554	C499-V506 HydrophobicContact CB-CG2 3.43Å; C499-V506 VanDerWaalsContact CB-CG2 3.43Å; S500-V506 WeakPolarHBondContact O-CG2 3.46Å; S503-V506 PolarHBondContact O-N 3.12Å; V506-Q508 VanDerWaalsContact C-N 3.31Å; V506-Q508 PolarHBondContact O-N 2.95Å; V506-W509 PolarHBondContact O-N 2.88Å; V506-D510 WeakPolarHBondContact O-CB 3.47Å; V506-D510 PolarHBondContact O-N 3.35Å; V506-L553 HydrophobicContact CG1-CB 4.22Å; V506-L553 HydrophobicContact CG1-CD1 4.3Å; V506-L553 HydrophobicContact CG2-CB 3.9Å; V506-L553 HydrophobicContact CG2-CD1 4.09Å; V506-I554 HydrophobicContact CB-CD1 4.4Å; V506-I554 HydrophobicContact CG2-CD1 3.68Å; V506-I554 HydrophobicContact CG2-CG1 4.36Å
507	L	92.1	Very high	89.7	Confident	14 Å²	14	27 Å²	27	7%	0.073	16%	0.158	C	C	.	.	H	α-helix	trans	-61.8	-39.1	177.7	-61.4	174.5	0	0	0	112.2	V417 R418 L501 S503 P504 S505 A511	V417-L507 HydrophobicContact CG1-CB 4.06Å; R418-L507 HydrophobicContact CB-CD2 4.13Å; R418-L507 WeakPolarHBondContact O-CD1 3.44Å; L501-L507 WeakPolarHBondContact O-CD2 3.5Å; S503-L507 WeakPolarHBondContact O-CG 3.43Å; S503-L507 PolarHBondContact O-N 3.29Å; S503-L507 VanDerWaalsContact O-N 3.13Å; P504-L507 PolarHBondContact O-N 3.13Å; S505-L507 VanDerWaalsContact C-N 3.34Å; S505-L507 PolarHBondContact O-N 3.05Å; L507-A511 WeakPolarHBondContact O-CB 3.32Å; L507-A511 PolarHBondContact O-N 3.23Å; L507-A511 VanDerWaalsContact O-N 3.15Å
508	Q	94.4	Very high	91	Very high	63 Å²	63	24.6 Å²	24.6	29%	0.294	13%	0.133	S	C	.	.	H	α-helix	trans	-70.3	-47	176.9	-70.7	-66.6	-27.6	0	0	112.4	P504 S505 V506 D510 A511 L512	P504-Q508 WeakPolarHBondContact O-CG 3.5Å; P504-Q508 PolarHBondContact O-N 2.71Å; P504-Q508 VanDerWaalsContact O-N 3.12Å; S505-Q508 PolarHBondContact O-N 2.96Å; V506-Q508 VanDerWaalsContact C-N 3.31Å; V506-Q508 PolarHBondContact O-N 2.95Å; Q508-D510 VanDerWaalsContact C-N 3.35Å; Q508-D510 PolarHBondContact O-N 2.81Å; Q508-A511 PolarHBondContact O-N 3.44Å; Q508-L512 WeakPolarHBondContact O-CB 3.45Å; Q508-L512 PolarHBondContact O-N 3.04Å
509	W	96.1	Very high	91.8	Very high	4 Å²	4	23.6 Å²	23.6	2%	0.015	13%	0.128	C	C	.	.	H	α-helix	trans	-63.1	-40.3	177.6	-87.8	93.9	0	0	0	112.3	L477 Q480 V481 S505 V506 L512 T513 Y547 I554 C557 V558	L477-W509 HydrophobicContact CD1-CZ3 4.22Å; Q480-W509 HydrophobicContact CB-CD2 4.29Å; Q480-W509 HydrophobicContact CB-CH2 4.26Å; Q480-W509 HydrophobicContact CB-CZ2 3.83Å; V481-W509 HydrophobicContact CG2-CH2 3.85Å; V481-W509 HydrophobicContact CG2-CZ2 4.46Å; S505-W509 WeakPolarHBondContact O-CB 3.11Å; S505-W509 VanDerWaalsContact O-CD1 3.22Å; S505-W509 PolarHBondContact O-N 3.49Å; V506-W509 PolarHBondContact O-N 2.88Å; W509-L512 HydrophobicContact CE3-CD2 4.44Å; W509-T513 VanDerWaalsContact O-CB 3.31Å; W509-T513 WeakPolarHBondContact O-CB 3.38Å; W509-T513 PolarHBondContact O-N 3.45Å; W509-T513 PolarHBondContact O-OG1 3.5Å; W509-Y547 HydrophobicContact CZ2-CE1 4.21Å; W509-I554 HydrophobicContact CB-CD1 4.14Å; W509-I554 HydrophobicContact CD2-CG2 4.21Å; W509-I554 HydrophobicContact CG-CD1 3.94Å; W509-I554 HydrophobicContact CG-CG2 4.34Å; W509-C557 HydrophobicContact CB-CB 3.92Å; W509-C557 HydrophobicContact CD2-CB 4.44Å; W509-C557 HydrophobicContact CE3-CB 3.92Å; W509-V558 HydrophobicContact CH2-CG2 4.18Å; W509-V558 HydrophobicContact CZ3-CG2 4.08Å
510	D	94.7	Very high	92.4	Very high	43 Å²	43	23.8 Å²	23.8	23%	0.23	13%	0.129	C	C	.	.	H	α-helix	trans	-65.3	-44.4	177.5	179.4	44	0	0	0	111.7	R451 V506 Q508 T513 V514	R451-D510 IonicContact CZ-OD1 3.52Å; R451-D510 IonicContact CZ-OD2 2.76Å; R451-D510 IonicContact NH1-OD1 2.67Å; R451-D510 IonicContact NH1-OD2 3.56Å; R451-D510 PolarHBondContact NH1-OD2 3.31Å; R451-D510 IonicContact NH2-OD1 2.89Å; R451-D510 PolarHBondContact NH2-OD1 3.46Å; R451-D510 IonicContact NH2-OD2 3.6Å; R451-D510 PolarHBondContact NH2-OD2 3.25Å; R451-D510 VanDerWaalsContact NH2-OD2 3.15Å; V506-D510 WeakPolarHBondContact O-CB 3.47Å; V506-D510 PolarHBondContact O-N 3.35Å; Q508-D510 VanDerWaalsContact C-N 3.35Å; Q508-D510 PolarHBondContact O-N 2.81Å; D510-T513 PolarHBondContact O-N 2.84Å; D510-V514 PolarHBondContact O-N 2.9Å
511	A	95.9	Very high	92.8	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-62.8	-47.8	175.5	0	0	0	0	0	112.6	L416 V417 W476 L507 Q508 T513 V514 F515	L416-A511 HydrophobicContact CB-CB 3.89Å; V417-A511 HydrophobicContact CB-CB 4.41Å; V417-A511 HydrophobicContact CG2-CB 3.86Å; W476-A511 HydrophobicContact CH2-CB 4.03Å; W476-A511 HydrophobicContact CZ2-CB 4.24Å; L507-A511 WeakPolarHBondContact O-CB 3.32Å; L507-A511 PolarHBondContact O-N 3.23Å; L507-A511 VanDerWaalsContact O-N 3.15Å; Q508-A511 PolarHBondContact O-N 3.44Å; A511-T513 VanDerWaalsContact C-N 3.28Å; A511-T513 PolarHBondContact O-N 3.37Å; A511-V514 PolarHBondContact O-N 3.13Å; A511-F515 PolarHBondContact O-N 3.26Å
512	L	96.9	Very high	93.4	Very high	0 Å²	0	24.1 Å²	24.1	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-56.8	-43.9	175	166.4	64.3	0	0	0	111.2	W476 L477 Q480 Q508 W509 V514 F515 M516	W476-L512 HydrophobicContact CB-CD1 3.87Å; W476-L512 HydrophobicContact CD2-CB 4.13Å; W476-L512 HydrophobicContact CD2-CD1 3.82Å; W476-L512 HydrophobicContact CE3-CB 4.48Å; W476-L512 HydrophobicContact CE3-CD1 3.99Å; W476-L512 HydrophobicContact CG-CD1 3.76Å; W476-L512 HydrophobicContact CZ2-CB 4.3Å; L477-L512 HydrophobicContact CB-CD1 4.34Å; L477-L512 HydrophobicContact CB-CD2 4.2Å; L477-L512 HydrophobicContact CD1-CD2 3.86Å; Q480-L512 HydrophobicContact CB-CD2 3.85Å; Q480-L512 HydrophobicContact CG-CD2 3.6Å; Q508-L512 WeakPolarHBondContact O-CB 3.45Å; Q508-L512 PolarHBondContact O-N 3.04Å; W509-L512 HydrophobicContact CE3-CD2 4.44Å; L512-V514 PolarHBondContact O-N 3.36Å; L512-F515 WeakPolarHBondContact O-CB 3.43Å; L512-F515 PolarHBondContact O-N 3.22Å; L512-M516 WeakPolarHBondContact O-CB 3.37Å; L512-M516 PolarHBondContact O-N 3.18Å
513	T	96.1	Very high	93.8	Very high	6 Å²	6	21.6 Å²	21.6	4%	0.037	11%	0.112	C	C	.	.	H	α-helix	trans	-60.9	-45.6	-177.2	-62.1	0	0	0	0	111.3	W509 D510 A511 M516 E517 C557 N561	W509-T513 VanDerWaalsContact O-CB 3.31Å; W509-T513 WeakPolarHBondContact O-CB 3.38Å; W509-T513 PolarHBondContact O-N 3.45Å; W509-T513 PolarHBondContact O-OG1 3.5Å; D510-T513 PolarHBondContact O-N 2.84Å; A511-T513 VanDerWaalsContact C-N 3.28Å; A511-T513 PolarHBondContact O-N 3.37Å; T513-M516 PolarHBondContact O-N 3.41Å; T513-E517 WeakPolarHBondContact O-CG 3.37Å; T513-E517 PolarHBondContact O-N 3.4Å; T513-C557 WeakPolarHBondContact OG1-CB 3.32Å; T513-N561 PolarHBondContact OG1-ND2 3.28Å
514	V	95.5	Very high	94	Very high	26 Å²	26	24.7 Å²	24.7	16%	0.158	13%	0.125	C	C	.	.	H	α-helix	trans	-66.5	-39.5	176.2	164.2	0	0	0	0	112.5	L416 R451 D510 A511 L512 M516 C518	L416-V514 HydrophobicContact CD2-CG1 4.41Å; R451-V514 HydrophobicContact CG-CG1 4.32Å; D510-V514 PolarHBondContact O-N 2.9Å; A511-V514 PolarHBondContact O-N 3.13Å; L512-V514 PolarHBondContact O-N 3.36Å; V514-M516 VanDerWaalsContact C-N 3.3Å; V514-M516 PolarHBondContact O-N 3.4Å; V514-C518 PolarHBondContact O-N 2.97Å; V514-C518 VanDerWaalsContact O-N 3.09Å; V514-C518 PolarHBondContact O-SG 2.92Å
515	F	97.1	Very high	94	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-57.7	-47.3	173	-169.8	-91.2	0	0	0	110.6	L409 L416 L458 T472 A473 W476 A511 L512 C518 V519	L409-F515 HydrophobicContact CD1-CE2 3.95Å; L409-F515 HydrophobicContact CD1-CZ 3.61Å; L409-F515 HydrophobicContact CG-CZ 4.3Å; L416-F515 HydrophobicContact CD1-CB 3.77Å; L416-F515 HydrophobicContact CD1-CD2 3.8Å; L416-F515 HydrophobicContact CD1-CG 4.3Å; L458-F515 HydrophobicContact CD1-CD2 3.77Å; L458-F515 HydrophobicContact CD1-CE2 4.26Å; L458-F515 HydrophobicContact CD2-CD2 3.98Å; L458-F515 HydrophobicContact CD2-CE2 3.59Å; T472-F515 HydrophobicContact CG2-CE1 4.27Å; T472-F515 HydrophobicContact CG2-CZ 4.01Å; A473-F515 HydrophobicContact CB-CD1 3.77Å; A473-F515 HydrophobicContact CB-CE1 3.67Å; W476-F515 HydrophobicContact CE3-CB 4.4Å; W476-F515 HydrophobicContact CE3-CD1 4.33Å; W476-F515 HydrophobicContact CE3-CG 4.26Å; W476-F515 HydrophobicContact CZ3-CB 3.9Å; W476-F515 HydrophobicContact CZ3-CD1 4.48Å; W476-F515 HydrophobicContact CZ3-CD2 4.17Å; W476-F515 AromaticContact CZ3-CG 3.95Å; W476-F515 HydrophobicContact CZ3-CG 3.95Å; A511-F515 PolarHBondContact O-N 3.26Å; L512-F515 WeakPolarHBondContact O-CB 3.43Å; L512-F515 PolarHBondContact O-N 3.22Å; F515-C518 PolarHBondContact O-N 3.35Å; F515-V519 HydrophobicContact CD1-CG2 3.91Å; F515-V519 HydrophobicContact CE1-CG2 3.72Å; F515-V519 HydrophobicContact CZ-CG2 4.17Å; F515-V519 WeakPolarHBondContact O-CB 3.32Å; F515-V519 VanDerWaalsContact O-CG2 3.26Å; F515-V519 WeakPolarHBondContact O-CG2 3.38Å; F515-V519 PolarHBondContact O-N 3.33Å
516	M	95.7	Very high	93.6	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-66.1	-42.8	-176.9	-168.8	72.9	-75.9	0	0	112.8	A473 L512 T513 V514 C518 V519 M520 A564	A473-M516 HydrophobicContact CB-CE 3.19Å; A473-M516 HydrophobicContact CB-SD 3.64Å; L512-M516 WeakPolarHBondContact O-CB 3.37Å; L512-M516 PolarHBondContact O-N 3.18Å; T513-M516 PolarHBondContact O-N 3.41Å; V514-M516 VanDerWaalsContact C-N 3.3Å; V514-M516 PolarHBondContact O-N 3.4Å; M516-C518 PolarHBondContact O-N 2.96Å; M516-V519 HydrophobicContact CE-CB 3.85Å; M516-V519 HydrophobicContact CE-CG1 3.83Å; M516-V519 PolarHBondContact O-N 3.45Å; M516-M520 HydrophobicContact CE-CE 3.12Å; M516-M520 HydrophobicContact CE-CG 3.59Å; M516-M520 HydrophobicContact CE-SD 3.44Å; M516-M520 WeakPolarHBondContact CE-SD 3.31Å; M516-M520 HydrophobicContact CG-CE 4.49Å; M516-M520 HydrophobicContact CG-CG 4.27Å; M516-M520 WeakPolarHBondContact O-CB 3.48Å; M516-M520 WeakPolarHBondContact O-CG 3.38Å; M516-M520 PolarHBondContact O-N 3.3Å; M516-M520 HydrophobicContact SD-CE 3.43Å; M516-M520 WeakPolarHBondContact SD-CE 3.26Å; M516-M520 HydrophobicContact SD-CG 4.27Å; M516-M520 HydrophobicContact SD-SD 4.4Å; M516-A564 HydrophobicContact CG-CB 4.22Å
517	E	94.3	Very high	93.4	Very high	83 Å²	83	32.1 Å²	32.1	39%	0.388	16%	0.157	S	C	.	.	H	α-helix	trans	-60.9	-44.2	175.6	-75.1	178.9	179.9	0	0	111.9	T513 H521 S560 A564	T513-E517 WeakPolarHBondContact O-CG 3.37Å; T513-E517 PolarHBondContact O-N 3.4Å; E517-H521 WeakPolarHBondContact O-CB 3.29Å; E517-H521 PolarHBondContact O-N 3.41Å; E517-S560 WeakPolarHBondContact OE1-CB 3.36Å; E517-S560 PolarHBondContact OE1-OG 2.86Å; E517-A564 HydrophobicContact CG-CB 4.24Å
518	C	95.4	Very high	93.1	Very high	5 Å²	5	36 Å²	36	3%	0.034	18%	0.177	C	C	.	.	H	α-helix	trans	-64.1	-46.2	178.1	-67.3	0	0	0	0	111.9	L458 R459 V514 F515 M516 Q522	L458-C518 HydrophobicContact CB-CB 4.2Å; R459-C518 HydrophobicContact CG-CB 3.97Å; V514-C518 PolarHBondContact O-N 2.97Å; V514-C518 VanDerWaalsContact O-N 3.09Å; V514-C518 PolarHBondContact O-SG 2.92Å; F515-C518 PolarHBondContact O-N 3.35Å; M516-C518 PolarHBondContact O-N 2.96Å; C518-Q522 PolarHBondContact O-N 2.95Å
519	V	95.6	Very high	92.6	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-66.4	-51	-178.7	170.6	0	0	0	0	111	A469 A473 F515 M516 H521 Q522 I523	A469-V519 HydrophobicContact CB-CG1 4.11Å; A469-V519 HydrophobicContact CB-CG2 4.25Å; A473-V519 HydrophobicContact CB-CG1 4.46Å; F515-V519 HydrophobicContact CD1-CG2 3.91Å; F515-V519 HydrophobicContact CE1-CG2 3.72Å; F515-V519 HydrophobicContact CZ-CG2 4.17Å; F515-V519 WeakPolarHBondContact O-CB 3.32Å; F515-V519 VanDerWaalsContact O-CG2 3.26Å; F515-V519 WeakPolarHBondContact O-CG2 3.38Å; F515-V519 PolarHBondContact O-N 3.33Å; M516-V519 HydrophobicContact CE-CB 3.85Å; M516-V519 HydrophobicContact CE-CG1 3.83Å; M516-V519 PolarHBondContact O-N 3.45Å; V519-H521 PolarHBondContact O-N 3.19Å; V519-Q522 PolarHBondContact O-N 3Å; V519-I523 HydrophobicContact CG1-CD1 3.52Å; V519-I523 HydrophobicContact CG1-CG1 4.31Å; V519-I523 WeakPolarHBondContact O-CG1 3.37Å; V519-I523 PolarHBondContact O-N 2.96Å
520	M	94.2	Very high	91.8	Very high	4 Å²	4	49.1 Å²	49.1	2%	0.02	24%	0.239	C	C	.	.	H	α-helix	trans	-62.6	-44.5	-179.5	-71	-33.3	-179.5	0	0	111.9	F470 M516 Q522 I523 F524 A564 L565 F568	F470-M520 HydrophobicContact CD2-CE 3.74Å; F470-M520 HydrophobicContact CD2-SD 4.02Å; F470-M520 HydrophobicContact CE2-CE 3.4Å; F470-M520 HydrophobicContact CE2-SD 4.11Å; M516-M520 HydrophobicContact CE-CE 3.12Å; M516-M520 HydrophobicContact CE-CG 3.59Å; M516-M520 HydrophobicContact CE-SD 3.44Å; M516-M520 WeakPolarHBondContact CE-SD 3.31Å; M516-M520 HydrophobicContact CG-CE 4.49Å; M516-M520 HydrophobicContact CG-CG 4.27Å; M516-M520 WeakPolarHBondContact O-CB 3.48Å; M516-M520 WeakPolarHBondContact O-CG 3.38Å; M516-M520 PolarHBondContact O-N 3.3Å; M516-M520 HydrophobicContact SD-CE 3.43Å; M516-M520 WeakPolarHBondContact SD-CE 3.26Å; M516-M520 HydrophobicContact SD-CG 4.27Å; M516-M520 HydrophobicContact SD-SD 4.4Å; M520-Q522 PolarHBondContact O-N 3.12Å; M520-I523 PolarHBondContact O-N 3.39Å; M520-I523 HydrophobicContact SD-CD1 4.19Å; M520-F524 WeakPolarHBondContact O-CD2 3.45Å; M520-F524 PolarHBondContact O-N 2.96Å; M520-A564 HydrophobicContact CB-CB 4.49Å; M520-A564 WeakPolarHBondContact CB-O 3.4Å; M520-A564 HydrophobicContact CG-CB 4.29Å; M520-A564 WeakPolarHBondContact CG-O 3.35Å; M520-L565 HydrophobicContact CE-CD2 3.35Å; M520-L565 HydrophobicContact CE-CG 4.47Å; M520-F568 HydrophobicContact CE-CE2 4.07Å; M520-F568 HydrophobicContact SD-CE2 3.81Å; M520-F568 HydrophobicContact SD-CZ 4.33Å
521	H	91.7	Very high	91.4	Very high	108 Å²	108	53.8 Å²	53.8	50%	0.5	26%	0.257	S	S	.	.	H	α-helix	trans	-55.3	-43.3	177.9	179.5	83.7	0	0	0	111.7	E517 V519 K525	E517-H521 WeakPolarHBondContact O-CB 3.29Å; E517-H521 PolarHBondContact O-N 3.41Å; V519-H521 PolarHBondContact O-N 3.19Å; H521-K525 PolarHBondContact O-N 3.42Å
522	Q	93.2	Very high	91.2	Very high	19 Å²	19	54.5 Å²	54.5	9%	0.089	26%	0.261	C	S	.	.	H	α-helix	trans	-74.4	-38.3	-179.4	-174.1	64.4	28.1	0	0	113.1	R459 R463 C518 V519 M520 F524 K525 S526	R459-Q522 HydrophobicContact CB-CB 4.47Å; R459-Q522 WeakPolarHBondContact O-CG 3.45Å; R463-Q522 HydrophobicContact CB-CG 4.19Å; C518-Q522 PolarHBondContact O-N 2.95Å; V519-Q522 PolarHBondContact O-N 3Å; M520-Q522 PolarHBondContact O-N 3.12Å; Q522-F524 PolarHBondContact O-N 3.45Å; Q522-K525 PolarHBondContact O-N 3.15Å; Q522-S526 PolarHBondContact NE2-OG 2.66Å; Q522-S526 PolarHBondContact O-N 3.48Å; Q522-S526 PolarHBondContact O-OG 2.88Å
523	I	92.3	Very high	90.9	Very high	0 Å²	0	56 Å²	56	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-56	-50.6	178.9	-78.7	169.6	0	0	0	110.6	F470 V519 M520 K525 S526 M527 L532	F470-I523 HydrophobicContact CB-CD1 3.65Å; F470-I523 HydrophobicContact CD2-CD1 3.73Å; F470-I523 HydrophobicContact CG-CD1 4.14Å; V519-I523 HydrophobicContact CG1-CD1 3.52Å; V519-I523 HydrophobicContact CG1-CG1 4.31Å; V519-I523 WeakPolarHBondContact O-CG1 3.37Å; V519-I523 PolarHBondContact O-N 2.96Å; M520-I523 PolarHBondContact O-N 3.39Å; M520-I523 HydrophobicContact SD-CD1 4.19Å; I523-K525 PolarHBondContact O-N 3.35Å; I523-S526 PolarHBondContact O-N 2.94Å; I523-M527 HydrophobicContact CB-SD 4.24Å; I523-M527 HydrophobicContact CG1-SD 4.02Å; I523-M527 HydrophobicContact CG2-CG 4.3Å; I523-M527 HydrophobicContact CG2-SD 3.64Å; I523-M527 WeakPolarHBondContact O-CB 3.44Å; I523-M527 PolarHBondContact O-N 2.66Å; I523-L532 HydrophobicContact CG2-CD2 3.64Å
524	F	89.9	Confident	90.7	Very high	67 Å²	67	57.7 Å²	57.7	29%	0.294	28%	0.279	S	S	.	.	H	α-helix	trans	-67.3	-20.4	178.6	-78.5	-77.1	0	0	0	113.9	M520 Q522 L532 P567 F568	M520-F524 WeakPolarHBondContact O-CD2 3.45Å; M520-F524 PolarHBondContact O-N 2.96Å; Q522-F524 PolarHBondContact O-N 3.45Å; F524-L532 HydrophobicContact CD1-CD1 4.26Å; F524-L532 HydrophobicContact CE1-CD1 3.92Å; F524-P567 HydrophobicContact CD1-CB 4.19Å; F524-P567 HydrophobicContact CD2-CB 3.93Å; F524-P567 HydrophobicContact CD2-CG 4.21Å; F524-P567 HydrophobicContact CE1-CB 3.85Å; F524-P567 HydrophobicContact CE2-CB 3.6Å; F524-P567 HydrophobicContact CE2-CG 4.03Å; F524-P567 HydrophobicContact CG-CB 4.23Å; F524-P567 HydrophobicContact CZ-CB 3.56Å; F524-P567 HydrophobicContact CZ-CG 4.46Å; F524-F568 HydrophobicContact CE1-CD1 4.35Å; F524-F568 HydrophobicContact CE1-CE1 4.3Å; F524-F568 HydrophobicContact CE2-CD1 4.38Å; F524-F568 AromaticContact CE2-CD2 3.7Å; F524-F568 HydrophobicContact CE2-CD2 3.7Å; F524-F568 HydrophobicContact CE2-CE1 4.06Å; F524-F568 AromaticContact CE2-CE2 3.33Å; F524-F568 HydrophobicContact CE2-CE2 3.33Å; F524-F568 HydrophobicContact CE2-CG 4.22Å; F524-F568 AromaticContact CE2-CZ 3.51Å; F524-F568 HydrophobicContact CE2-CZ 3.51Å; F524-F568 HydrophobicContact CZ-CB 4.43Å; F524-F568 AromaticContact CZ-CD1 3.55Å; F524-F568 HydrophobicContact CZ-CD1 3.55Å; F524-F568 AromaticContact CZ-CD2 3.56Å; F524-F568 HydrophobicContact CZ-CD2 3.56Å; F524-F568 AromaticContact CZ-CE1 3.5Å; F524-F568 HydrophobicContact CZ-CE1 3.5Å; F524-F568 VanDerWaalsContact CZ-CE1 3.5Å; F524-F568 AromaticContact CZ-CE2 3.51Å; F524-F568 HydrophobicContact CZ-CE2 3.51Å; F524-F568 AromaticContact CZ-CG 3.58Å; F524-F568 HydrophobicContact CZ-CG 3.58Å; F524-F568 AromaticContact CZ-CZ 3.47Å; F524-F568 HydrophobicContact CZ-CZ 3.47Å; F524-F568 VanDerWaalsContact CZ-CZ 3.47Å
525	K	89.6	Confident	90.6	Very high	153 Å²	153	61.6 Å²	61.6	67%	0.665	30%	0.299	S	S	*	.	H	α-helix	trans	-85.7	-26.3	177.8	-171.5	175.2	-179.9	177.7	0	113.4	H521 Q522 I523	H521-K525 PolarHBondContact O-N 3.42Å; Q522-K525 PolarHBondContact O-N 3.15Å; I523-K525 PolarHBondContact O-N 3.35Å
526	S	84	Confident	90.4	Very high	49 Å²	49	64.6 Å²	64.6	34%	0.343	31%	0.313	S	S	.	.	H	α-helix	trans	-127.9	-19.5	-166.5	57.1	0	0	0	0	116.1	Q522 I523	Q522-S526 PolarHBondContact NE2-OG 2.66Å; Q522-S526 PolarHBondContact O-N 3.48Å; Q522-S526 PolarHBondContact O-OG 2.88Å; I523-S526 PolarHBondContact O-N 2.94Å
527	M	87.7	Confident	90.3	Very high	31 Å²	31	64.7 Å²	64.7	15%	0.153	31%	0.314	C	S	.	.	S	Bend	trans	-87.3	144.1	174.8	-67.3	-173.8	69.8	0	0	111.4	P466 I523 K531 L532	P466-M527 HydrophobicContact CB-CE 4.48Å; P466-M527 HydrophobicContact CB-CG 3.66Å; P466-M527 HydrophobicContact CB-SD 3.6Å; P466-M527 HydrophobicContact CG-CG 4.23Å; P466-M527 HydrophobicContact CG-SD 4.45Å; I523-M527 HydrophobicContact CB-SD 4.24Å; I523-M527 HydrophobicContact CG1-SD 4.02Å; I523-M527 HydrophobicContact CG2-CG 4.3Å; I523-M527 HydrophobicContact CG2-SD 3.64Å; I523-M527 WeakPolarHBondContact O-CB 3.44Å; I523-M527 PolarHBondContact O-N 2.66Å; M527-K531 HydrophobicContact CE-CB 4.02Å; M527-K531 VanDerWaalsContact CE-O 3.23Å; M527-K531 WeakPolarHBondContact CE-O 3.22Å; M527-L532 HydrophobicContact CB-CD2 4.07Å
528	D	85.6	Confident	90.3	Very high	95 Å²	95	61.1 Å²	61.1	51%	0.508	30%	0.297	S	S	.	.			trans	-62.8	138.8	168.7	-55.5	-43.4	0	0	0	110.1	Q530 K531	D528-Q530 PolarHBondContact O-N 3.48Å; D528-K531 HydrophobicContact CB-CD 4.39Å; D528-K531 PolarHBondContact O-N 3.49Å; D528-K531 IonicContact OD2-NZ 3.33Å; D528-K531 PolarHBondContact OD2-NZ 2.8Å
529	E	82.4	Confident	90.3	Very high	150 Å²	150	66.3 Å²	66.3	70%	0.701	32%	0.321	S	S	*	.	G	3₁₀ helix	trans	-52.6	-35.2	-179	-69.9	-177	176.1	0	0	113.3	K531 L532	E529-K531 VanDerWaalsContact C-N 3.27Å; E529-K531 PolarHBondContact O-N 3.16Å; E529-L532 WeakPolarHBondContact O-CB 3.45Å; E529-L532 WeakPolarHBondContact O-CG 3.35Å; E529-L532 PolarHBondContact O-N 3.49Å
530	Q	81.2	Confident	90.3	Very high	193 Å²	193	66.6 Å²	66.6	90%	0.902	32%	0.322	S	S	*	.	G	3₁₀ helix	trans	-69.5	-21.8	-179.4	-64.7	-177.3	-5	0	0	114	D528	D528-Q530 PolarHBondContact O-N 3.48Å
531	K	85.9	Confident	90.4	Very high	140 Å²	140	66.5 Å²	66.5	61%	0.609	32%	0.322	S	S	*	.	G	3₁₀ helix	trans	-98.2	1.9	-177.9	-66.3	175.1	-174.9	150.2	0	112.5	M527 D528 E529	M527-K531 HydrophobicContact CE-CB 4.02Å; M527-K531 VanDerWaalsContact CE-O 3.23Å; M527-K531 WeakPolarHBondContact CE-O 3.22Å; D528-K531 HydrophobicContact CB-CD 4.39Å; D528-K531 PolarHBondContact O-N 3.49Å; D528-K531 IonicContact OD2-NZ 3.33Å; D528-K531 PolarHBondContact OD2-NZ 2.8Å; E529-K531 VanDerWaalsContact C-N 3.27Å; E529-K531 PolarHBondContact O-N 3.16Å
532	L	90.2	Very high	90.5	Very high	16 Å²	16	63.8 Å²	63.8	8%	0.084	31%	0.31	C	S	.	.			trans	-65.7	135.5	-179.7	-70.2	175.4	0	0	0	110.6	I523 F524 M527 E529 I534 F568	I523-L532 HydrophobicContact CG2-CD2 3.64Å; F524-L532 HydrophobicContact CD1-CD1 4.26Å; F524-L532 HydrophobicContact CE1-CD1 3.92Å; M527-L532 HydrophobicContact CB-CD2 4.07Å; E529-L532 WeakPolarHBondContact O-CB 3.45Å; E529-L532 WeakPolarHBondContact O-CG 3.35Å; E529-L532 PolarHBondContact O-N 3.49Å; L532-I534 HydrophobicContact CB-CG1 4.05Å; L532-I534 PolarHBondContact O-N 3.39Å; L532-F568 HydrophobicContact CB-CE1 4.28Å
533	P	92.3	Very high	90.6	Very high	31 Å²	31	64.3 Å²	64.3	20%	0.201	32%	0.32	C	S	.	.			trans	-78.2	56.9	-178.8	33.1	-37	0	0	0	112	F470 D535 Q536 S537 F568	F470-P533 HydrophobicContact CD1-CB 3.93Å; F470-P533 HydrophobicContact CD1-CG 3.62Å; F470-P533 HydrophobicContact CD2-CG 3.69Å; F470-P533 HydrophobicContact CE1-CB 3.54Å; F470-P533 HydrophobicContact CE1-CG 3.47Å; F470-P533 VanDerWaalsContact CE1-CG 3.47Å; F470-P533 HydrophobicContact CE2-CB 4.41Å; F470-P533 HydrophobicContact CE2-CG 3.53Å; F470-P533 HydrophobicContact CG-CG 3.73Å; F470-P533 HydrophobicContact CZ-CB 3.82Å; F470-P533 HydrophobicContact CZ-CG 3.43Å; F470-P533 VanDerWaalsContact CZ-CG 3.43Å; P533-D535 PolarHBondContact O-N 3.36Å; P533-Q536 PolarHBondContact O-N 3.49Å; P533-S537 WeakPolarHBondContact O-CB 3.38Å; P533-S537 PolarHBondContact O-N 2.91Å; P533-S537 PolarHBondContact O-OG 3.13Å; P533-S537 VanDerWaalsContact O-OG 3.05Å; P533-F568 HydrophobicContact CG-CE1 4.42Å; P533-F568 HydrophobicContact CG-CZ 4.42Å
534	I	92.1	Very high	90.8	Very high	41 Å²	41	64.3 Å²	64.3	21%	0.21	32%	0.32	C	S	.	.	H	α-helix	trans	-55.6	-51.7	-170.4	-61.6	169.3	0	0	0	111.2	L532 Q536 S537 M538 F568 H571	L532-I534 HydrophobicContact CB-CG1 4.05Å; L532-I534 PolarHBondContact O-N 3.39Å; I534-Q536 PolarHBondContact O-N 3.43Å; I534-S537 PolarHBondContact O-N 3.48Å; I534-M538 HydrophobicContact CG2-CG 4.21Å; I534-M538 VanDerWaalsContact O-CG 3.24Å; I534-M538 WeakPolarHBondContact O-CG 3.32Å; I534-M538 PolarHBondContact O-N 3.44Å; I534-F568 HydrophobicContact CG1-CD1 4.45Å; I534-H571 HydrophobicContact CD1-CB 4.08Å; I534-H571 HydrophobicContact CG2-CB 4.18Å
535	D	92	Very high	91	Very high	109 Å²	109	61.8 Å²	61.8	58%	0.583	31%	0.309	S	S	*	.	H	α-helix	trans	-62.6	-43.2	-175	-66.6	-29.6	0	0	0	112.4	P533 M538 E539 R572	P533-D535 PolarHBondContact O-N 3.36Å; D535-M538 PolarHBondContact O-N 3.41Å; D535-E539 PolarHBondContact O-N 2.92Å; D535-E539 VanDerWaalsContact O-N 3.08Å; D535-R572 IonicContact OD1-CZ 2.75Å; D535-R572 IonicContact OD1-NH2 2.7Å; D535-R572 PolarHBondContact OD1-NH2 3.41Å
536	Q	93.4	Very high	91.3	Very high	63 Å²	63	59.6 Å²	59.6	29%	0.294	31%	0.305	S	S	.	.	H	α-helix	trans	-67.5	-40.7	177.7	-162.9	174.7	17.5	0	0	111.3	F470 P533 I534 M538 E539 L540	F470-Q536 HydrophobicContact CE1-CB 4.11Å; F470-Q536 HydrophobicContact CE1-CG 4.09Å; F470-Q536 HydrophobicContact CZ-CB 4.39Å; P533-Q536 PolarHBondContact O-N 3.49Å; I534-Q536 PolarHBondContact O-N 3.43Å; Q536-M538 VanDerWaalsContact C-N 3.34Å; Q536-M538 PolarHBondContact O-N 3.29Å; Q536-E539 WeakPolarHBondContact O-CB 3.26Å; Q536-E539 PolarHBondContact O-N 3.12Å; Q536-L540 WeakPolarHBondContact O-CG 3.28Å; Q536-L540 PolarHBondContact O-N 3.47Å
537	S	93.4	Very high	91.8	Very high	1 Å²	1	58.9 Å²	58.9	1%	0.007	30%	0.295	C	S	.	.	H	α-helix	trans	-62.5	-39.2	175	-65.2	0	0	0	0	112.6	F470 P533 I534 L540 L541 F568	F470-S537 VanDerWaalsContact CE2-OG 3.24Å; F470-S537 WeakPolarHBondContact CE2-OG 3.31Å; F470-S537 WeakPolarHBondContact CZ-OG 3.26Å; P533-S537 WeakPolarHBondContact O-CB 3.38Å; P533-S537 PolarHBondContact O-N 2.91Å; P533-S537 PolarHBondContact O-OG 3.13Å; P533-S537 VanDerWaalsContact O-OG 3.05Å; I534-S537 PolarHBondContact O-N 3.48Å; S537-L540 PolarHBondContact O-N 3.39Å; S537-L541 WeakPolarHBondContact O-CB 3.43Å; S537-L541 PolarHBondContact O-N 3.48Å; S537-F568 VanDerWaalsContact CB-CG 3.44Å; S537-F568 WeakPolarHBondContact OG-CD2 3.47Å; S537-F568 VanDerWaalsContact OG-CE1 3.29Å; S537-F568 WeakPolarHBondContact OG-CE1 3.45Å; S537-F568 WeakPolarHBondContact OG-CE2 3.35Å; S537-F568 WeakPolarHBondContact OG-CZ 3.41Å
538	M	93.9	Very high	92	Very high	9 Å²	9	63.9 Å²	63.9	4%	0.044	32%	0.318	C	S	.	.	H	α-helix	trans	-69.3	-34.2	177.8	-65.4	-51.5	-64.1	0	0	112	I534 D535 Q536 L541 Q542 F568 R572 F575	I534-M538 HydrophobicContact CG2-CG 4.21Å; I534-M538 VanDerWaalsContact O-CG 3.24Å; I534-M538 WeakPolarHBondContact O-CG 3.32Å; I534-M538 PolarHBondContact O-N 3.44Å; D535-M538 PolarHBondContact O-N 3.41Å; Q536-M538 VanDerWaalsContact C-N 3.34Å; Q536-M538 PolarHBondContact O-N 3.29Å; M538-L541 HydrophobicContact CE-CD2 4.03Å; M538-L541 PolarHBondContact O-N 3.42Å; M538-L541 HydrophobicContact SD-CD2 4.36Å; M538-Q542 WeakPolarHBondContact O-CB 3.14Å; M538-Q542 PolarHBondContact O-N 3.34Å; M538-F568 HydrophobicContact SD-CB 4.16Å; M538-R572 HydrophobicContact CE-CB 3.97Å; M538-R572 HydrophobicContact CG-CG 4.5Å; M538-R572 HydrophobicContact SD-CB 4.48Å; M538-F575 HydrophobicContact CE-CB 3.91Å; M538-F575 HydrophobicContact CE-CD1 3.8Å; M538-F575 HydrophobicContact CE-CD2 3.13Å; M538-F575 HydrophobicContact CE-CE1 4.01Å; M538-F575 HydrophobicContact CE-CE2 3.42Å; M538-F575 VanDerWaalsContact CE-CE2 3.42Å; M538-F575 HydrophobicContact CE-CG 3.34Å; M538-F575 HydrophobicContact CE-CZ 3.86Å
539	E	94.8	Very high	92.2	Very high	113 Å²	113	60.7 Å²	60.7	53%	0.528	30%	0.302	S	S	.	.	H	α-helix	trans	-62	-47.3	170.9	-171.6	-161.8	-178.9	0	0	111.3	R478 D535 Q536 L541 Q542 G543	R478-E539 IonicContact CZ-OE2 3.75Å; R478-E539 IonicContact NE-OE2 3.53Å; R478-E539 IonicContact NH2-OE2 2.76Å; R478-E539 PolarHBondContact NH2-OE2 3.47Å; D535-E539 PolarHBondContact O-N 2.92Å; D535-E539 VanDerWaalsContact O-N 3.08Å; Q536-E539 WeakPolarHBondContact O-CB 3.26Å; Q536-E539 PolarHBondContact O-N 3.12Å; E539-L541 PolarHBondContact O-N 2.94Å; E539-Q542 PolarHBondContact O-N 3.02Å; E539-G543 PolarHBondContact O-N 3.07Å
540	L	96	Very high	92.4	Very high	7 Å²	7	63.2 Å²	63.2	4%	0.037	31%	0.305	C	S	.	.	H	α-helix	trans	-59.9	-47	176.1	-65.9	171.4	0	0	0	111.3	F470 A474 L477 R478 Q536 S537 Q542 G543 V544 L565	F470-L540 HydrophobicContact CZ-CD1 4.08Å; A474-L540 HydrophobicContact CB-CD1 3.55Å; A474-L540 HydrophobicContact CB-CD2 4.2Å; A474-L540 HydrophobicContact CB-CG 4.42Å; L477-L540 HydrophobicContact CD2-CB 4.17Å; L477-L540 HydrophobicContact CD2-CD2 4.3Å; R478-L540 HydrophobicContact CG-CD2 3.69Å; Q536-L540 WeakPolarHBondContact O-CG 3.28Å; Q536-L540 PolarHBondContact O-N 3.47Å; S537-L540 PolarHBondContact O-N 3.39Å; L540-Q542 VanDerWaalsContact C-N 3.32Å; L540-Q542 PolarHBondContact O-N 2.8Å; L540-G543 PolarHBondContact O-N 3.22Å; L540-G543 VanDerWaalsContact O-N 3.12Å; L540-V544 WeakPolarHBondContact O-CG2 3.39Å; L540-V544 PolarHBondContact O-N 3.27Å; L540-L565 HydrophobicContact CB-CD1 4.19Å
541	L	96.1	Very high	92.8	Very high	1 Å²	1	54.3 Å²	54.3	1%	0.005	26%	0.264	C	S	.	.	H	α-helix	trans	-59	-44.7	177.9	178.4	63.5	0	0	0	111	S537 M538 E539 G543 V544 L545 I562 L565 V569 V579	S537-L541 WeakPolarHBondContact O-CB 3.43Å; S537-L541 PolarHBondContact O-N 3.48Å; M538-L541 HydrophobicContact CE-CD2 4.03Å; M538-L541 PolarHBondContact O-N 3.42Å; M538-L541 HydrophobicContact SD-CD2 4.36Å; E539-L541 PolarHBondContact O-N 2.94Å; L541-G543 VanDerWaalsContact C-N 3.32Å; L541-G543 PolarHBondContact O-N 3.23Å; L541-V544 PolarHBondContact O-N 2.9Å; L541-L545 HydrophobicContact CD1-CD1 4.22Å; L541-L545 HydrophobicContact CD1-CG 4.15Å; L541-L545 HydrophobicContact CG-CD1 3.92Å; L541-L545 HydrophobicContact CG-CG 4.29Å; L541-L545 WeakPolarHBondContact O-CB 3.22Å; L541-L545 VanDerWaalsContact O-CG 3.24Å; L541-L545 WeakPolarHBondContact O-CG 3.33Å; L541-L545 PolarHBondContact O-N 3.4Å; L541-I562 HydrophobicContact CD1-CG2 4.42Å; L541-L565 HydrophobicContact CB-CB 4.46Å; L541-L565 HydrophobicContact CB-CD1 4.35Å; L541-L565 HydrophobicContact CD1-CB 4.15Å; L541-V569 HydrophobicContact CD2-CG2 3.37Å; L541-V579 HydrophobicContact CD2-CG2 4.38Å
542	Q	95.1	Very high	93	Very high	52 Å²	52	47.7 Å²	47.7	24%	0.243	24%	0.235	C	C	.	.	H	α-helix	trans	-61.6	-41.1	176	-172.3	69.7	70	0	0	111.6	M538 E539 L540 V544 L545 N546	M538-Q542 WeakPolarHBondContact O-CB 3.14Å; M538-Q542 PolarHBondContact O-N 3.34Å; E539-Q542 PolarHBondContact O-N 3.02Å; L540-Q542 VanDerWaalsContact C-N 3.32Å; L540-Q542 PolarHBondContact O-N 2.8Å; Q542-V544 PolarHBondContact O-N 2.72Å; Q542-L545 PolarHBondContact O-N 3.4Å; Q542-N546 PolarHBondContact NE2-OD1 2.53Å; Q542-N546 WeakPolarHBondContact O-CB 3.4Å; Q542-N546 PolarHBondContact O-N 3.15Å; Q542-N546 PolarHBondContact O-ND2 3.06Å; Q542-N546 PolarHBondContact O-OD1 3.36Å
543	G	94.8	Very high	93	Very high	29 Å²	29	47.9 Å²	47.9	30%	0.299	24%	0.236	S	C	.	.	H	α-helix	trans	-57.8	-46.5	174.8	0	0	0	0	0	112.5	E539 L540 L541 N546 Y547	E539-G543 PolarHBondContact O-N 3.07Å; L540-G543 PolarHBondContact O-N 3.22Å; L540-G543 VanDerWaalsContact O-N 3.12Å; L541-G543 VanDerWaalsContact C-N 3.32Å; L541-G543 PolarHBondContact O-N 3.23Å; G543-N546 PolarHBondContact O-N 3.4Å; G543-Y547 PolarHBondContact O-N 2.86Å; G543-Y547 VanDerWaalsContact O-N 3.12Å
544	V	95.7	Very high	93.1	Very high	1 Å²	1	46.4 Å²	46.4	1%	0.006	23%	0.226	C	C	.	.	H	α-helix	trans	-70	-38.8	178.8	-179.4	0	0	0	0	112.1	L477 V481 L540 L541 Q542 N546 Y547 V558 N561 I562	L477-V544 HydrophobicContact CD1-CG2 3.88Å; L477-V544 HydrophobicContact CD2-CG2 3.82Å; L477-V544 HydrophobicContact CG-CG2 4.13Å; V481-V544 HydrophobicContact CG2-CG2 4.4Å; L540-V544 WeakPolarHBondContact O-CG2 3.39Å; L540-V544 PolarHBondContact O-N 3.27Å; L541-V544 PolarHBondContact O-N 2.9Å; Q542-V544 PolarHBondContact O-N 2.72Å; V544-N546 VanDerWaalsContact C-N 3.28Å; V544-N546 PolarHBondContact O-N 3.18Å; V544-Y547 PolarHBondContact O-N 3.01Å; V544-V558 HydrophobicContact CG1-CG1 3.7Å; V544-N561 HydrophobicContact CG1-CB 4.41Å; V544-I562 HydrophobicContact CG1-CD1 4.25Å; V544-I562 HydrophobicContact CG1-CG1 3.66Å
545	L	95.3	Very high	93.2	Very high	14 Å²	14	45.1 Å²	45.1	7%	0.073	22%	0.22	C	C	.	.	H	α-helix	trans	-62.5	-37.5	175.3	-72.9	172.6	0	0	0	111.7	L541 Q542 I562 F575 Q578 V579 K582	L541-L545 HydrophobicContact CD1-CD1 4.22Å; L541-L545 HydrophobicContact CD1-CG 4.15Å; L541-L545 HydrophobicContact CG-CD1 3.92Å; L541-L545 HydrophobicContact CG-CG 4.29Å; L541-L545 WeakPolarHBondContact O-CB 3.22Å; L541-L545 VanDerWaalsContact O-CG 3.24Å; L541-L545 WeakPolarHBondContact O-CG 3.33Å; L541-L545 PolarHBondContact O-N 3.4Å; Q542-L545 PolarHBondContact O-N 3.4Å; L545-I562 HydrophobicContact CD2-CD1 4.01Å; L545-I562 HydrophobicContact CD2-CG1 4.37Å; L545-F575 HydrophobicContact CD1-CD1 4.48Å; L545-Q578 HydrophobicContact CD1-CB 4.26Å; L545-V579 HydrophobicContact CD1-CG2 4.16Å; L545-V579 HydrophobicContact CD2-CG2 4.2Å; L545-K582 HydrophobicContact CD2-CB 3.83Å; L545-K582 HydrophobicContact CD2-CG 4.11Å; L545-K582 WeakPolarHBondContact O-CE 3.35Å; L545-K582 PolarHBondContact O-NZ 3.13Å
546	N	94.9	Very high	93.4	Very high	107 Å²	107	41.7 Å²	41.7	57%	0.572	20%	0.204	S	C	*	.	H	α-helix	trans	-78.1	-18.8	179.2	-67.7	-8.1	0	0	0	113.5	Q542 G543 V544 E548	Q542-N546 PolarHBondContact NE2-OD1 2.53Å; Q542-N546 WeakPolarHBondContact O-CB 3.4Å; Q542-N546 PolarHBondContact O-N 3.15Å; Q542-N546 PolarHBondContact O-ND2 3.06Å; Q542-N546 PolarHBondContact O-OD1 3.36Å; G543-N546 PolarHBondContact O-N 3.4Å; V544-N546 VanDerWaalsContact C-N 3.28Å; V544-N546 PolarHBondContact O-N 3.18Å; N546-E548 PolarHBondContact O-N 3.26Å
547	Y	94.9	Very high	93.5	Very high	33 Å²	33	39.2 Å²	39.2	13%	0.129	19%	0.193	C	C	.	.			trans	-70.3	122.1	-179.3	-173.7	-97	0	0	0	111.5	V481 V485 W509 G543 V544 T549 I554 V558 K582	V481-Y547 HydrophobicContact CB-CD2 4.48Å; V481-Y547 HydrophobicContact CG1-CD2 3.93Å; V481-Y547 WeakPolarHBondContact O-CE2 2.89Å; V485-Y547 WeakPolarHBondContact CG2-OH 3.44Å; W509-Y547 HydrophobicContact CZ2-CE1 4.21Å; G543-Y547 PolarHBondContact O-N 2.86Å; G543-Y547 VanDerWaalsContact O-N 3.12Å; V544-Y547 PolarHBondContact O-N 3.01Å; Y547-T549 HydrophobicContact CE1-CG2 4.17Å; Y547-I554 HydrophobicContact CE1-CG2 4.06Å; Y547-V558 HydrophobicContact CD1-CG2 3.77Å; Y547-V558 HydrophobicContact CE1-CG2 4.13Å; Y547-K582 PolarHBondContact O-NZ 3.24Å
548	E	91	Very high	93.6	Very high	136 Å²	136	39.1 Å²	39.1	64%	0.636	19%	0.193	S	C	*	.			trans	-111.8	132.2	177.5	-61.8	-154.7	135	0	0	111.1	N546 K585	N546-E548 PolarHBondContact O-N 3.26Å; E548-K585 IonicContact OE1-NZ 3.16Å; E548-K585 PolarHBondContact OE1-NZ 3.4Å
549	T	89.9	Confident	93.7	Very high	28 Å²	28	38.7 Å²	38.7	17%	0.172	19%	0.191	C	C	.	.			trans	-138.2	148	176.2	-178.2	0	0	0	0	110.5	Y547 D551 I554 L555	Y547-T549 HydrophobicContact CE1-CG2 4.17Å; T549-D551 PolarHBondContact OG1-N 3.04Å; T549-I554 HydrophobicContact CG2-CB 4.27Å; T549-I554 HydrophobicContact CG2-CG2 4.17Å; T549-L555 HydrophobicContact CG2-CB 3.84Å; T549-L555 HydrophobicContact CG2-CD1 4.4Å
550	R	87.3	Confident	93.8	Very high	204 Å²	204	34.2 Å²	34.2	77%	0.77	17%	0.172	S	C	*	.	S	Bend	trans	-93.3	-7.9	171.3	-63.4	-176.8	178.5	-173.5	-2.8	112.2
551	D	89.4	Confident	93.9	Very high	6 Å²	6	33.9 Å²	33.9	3%	0.032	17%	0.17	C	C	.	.			trans	-86	122.7	-179.1	-169.3	-75.7	0	0	0	111	C499 T549 L553 I554 L555	C499-D551 WeakPolarHBondContact CA-OD2 3.18Å; C499-D551 WeakPolarHBondContact CB-OD2 3.42Å; C499-D551 PolarHBondContact N-OD2 3.14Å; T549-D551 PolarHBondContact OG1-N 3.04Å; D551-L553 PolarHBondContact O-N 3.29Å; D551-L553 WeakPolarHBondContact OD1-CA 3.46Å; D551-L553 WeakPolarHBondContact OD1-CB 3.38Å; D551-L553 PolarHBondContact OD1-N 2.94Å; D551-I554 HydrophobicContact CB-CB 4.17Å; D551-I554 HydrophobicContact CB-CG1 3.98Å; D551-I554 PolarHBondContact OD1-N 3.11Å; D551-I554 VanDerWaalsContact OD1-N 3.1Å; D551-L555 WeakPolarHBondContact O-CB 3.37Å; D551-L555 PolarHBondContact O-N 3.47Å
552	P	89.9	Confident	93.9	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-66.4	-36	-179	25.1	-32.2	0	0	0	113.2	L555 S556 F589 I591 A602 V606 Y831	P552-L555 PolarHBondContact O-N 3.06Å; P552-S556 PolarHBondContact O-N 3.25Å; P552-F589 HydrophobicContact CB-CE1 4.05Å; P552-I591 HydrophobicContact CG-CD1 4.26Å; P552-A602 HydrophobicContact CB-CB 3.82Å; P552-A602 HydrophobicContact CG-CB 3.45Å; P552-A602 VanDerWaalsContact CG-CB 3.45Å; P552-V606 HydrophobicContact CB-CG2 3.62Å; P552-V606 WeakPolarHBondContact O-CG2 3.44Å; P552-Y831 HydrophobicContact CG-CE1 3.8Å
553	L	90.7	Very high	93.9	Very high	21 Å²	21	32.3 Å²	32.3	11%	0.11	17%	0.165	C	C	.	.	H	α-helix	trans	-68.8	-42.7	-177.6	-57.5	178.7	0	0	0	110.7	C499 L501 V506 D551 S556 C557 A602 I830 Y831	C499-L553 WeakPolarHBondContact O-CD1 3.49Å; L501-L553 HydrophobicContact CD2-CD1 4.43Å; V506-L553 HydrophobicContact CG1-CB 4.22Å; V506-L553 HydrophobicContact CG1-CD1 4.3Å; V506-L553 HydrophobicContact CG2-CB 3.9Å; V506-L553 HydrophobicContact CG2-CD1 4.09Å; D551-L553 PolarHBondContact O-N 3.29Å; D551-L553 WeakPolarHBondContact OD1-CA 3.46Å; D551-L553 WeakPolarHBondContact OD1-CB 3.38Å; D551-L553 PolarHBondContact OD1-N 2.94Å; L553-S556 WeakPolarHBondContact O-CB 3.29Å; L553-S556 PolarHBondContact O-N 3.28Å; L553-C557 PolarHBondContact O-N 3.25Å; L553-C557 PolarHBondContact O-SG 3.08Å; L553-C557 VanDerWaalsContact O-SG 3.38Å; L553-A602 HydrophobicContact CD2-CB 4.47Å; L553-I830 HydrophobicContact CD2-CD1 4.18Å; L553-Y831 HydrophobicContact CD1-CE2 4.48Å
554	I	93.8	Very high	93.8	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-67	-42.2	174.6	-54.4	-60	0	0	0	110.8	V506 W509 Y547 T549 D551 S556 C557 V558	V506-I554 HydrophobicContact CB-CD1 4.4Å; V506-I554 HydrophobicContact CG2-CD1 3.68Å; V506-I554 HydrophobicContact CG2-CG1 4.36Å; W509-I554 HydrophobicContact CB-CD1 4.14Å; W509-I554 HydrophobicContact CD2-CG2 4.21Å; W509-I554 HydrophobicContact CG-CD1 3.94Å; W509-I554 HydrophobicContact CG-CG2 4.34Å; Y547-I554 HydrophobicContact CE1-CG2 4.06Å; T549-I554 HydrophobicContact CG2-CB 4.27Å; T549-I554 HydrophobicContact CG2-CG2 4.17Å; D551-I554 HydrophobicContact CB-CB 4.17Å; D551-I554 HydrophobicContact CB-CG1 3.98Å; D551-I554 PolarHBondContact OD1-N 3.11Å; D551-I554 VanDerWaalsContact OD1-N 3.1Å; I554-S556 PolarHBondContact O-N 3.4Å; I554-C557 WeakPolarHBondContact O-CB 3.44Å; I554-C557 PolarHBondContact O-N 2.9Å; I554-V558 HydrophobicContact CG2-CG2 4.48Å; I554-V558 WeakPolarHBondContact O-CG2 3.38Å; I554-V558 PolarHBondContact O-N 3.1Å
555	L	95	Very high	93.8	Very high	14 Å²	14	31.5 Å²	31.5	7%	0.073	16%	0.156	C	C	.	.	H	α-helix	trans	-59.2	-38.3	176.5	-176.1	54.2	0	0	0	111.5	T549 D551 P552 C557 V558 L559 A586 F589 V606	T549-L555 HydrophobicContact CG2-CB 3.84Å; T549-L555 HydrophobicContact CG2-CD1 4.4Å; D551-L555 WeakPolarHBondContact O-CB 3.37Å; D551-L555 PolarHBondContact O-N 3.47Å; P552-L555 PolarHBondContact O-N 3.06Å; L555-C557 VanDerWaalsContact C-N 3.34Å; L555-C557 PolarHBondContact O-N 2.85Å; L555-V558 HydrophobicContact CD1-CB 4.47Å; L555-V558 HydrophobicContact CD1-CG1 4.46Å; L555-V558 WeakPolarHBondContact O-CB 3.29Å; L555-V558 PolarHBondContact O-N 3.45Å; L555-L559 VanDerWaalsContact O-CG 3.27Å; L555-L559 WeakPolarHBondContact O-CG 3.05Å; L555-L559 PolarHBondContact O-N 3.42Å; L555-A586 HydrophobicContact CD2-CB 4.45Å; L555-F589 HydrophobicContact CD2-CD1 4.41Å; L555-F589 HydrophobicContact CD2-CD2 3.44Å; L555-F589 VanDerWaalsContact CD2-CD2 3.44Å; L555-F589 HydrophobicContact CD2-CE2 3.58Å; L555-F589 HydrophobicContact CD2-CG 3.89Å; L555-F589 HydrophobicContact CD2-CZ 4.14Å; L555-V606 HydrophobicContact CB-CG1 4.4Å; L555-V606 HydrophobicContact CD2-CG1 3.73Å; L555-V606 HydrophobicContact CG-CG1 3.89Å
556	S	95.1	Very high	93.8	Very high	36 Å²	36	31 Å²	31	25%	0.252	15%	0.153	S	C	.	.	H	α-helix	trans	-57.8	-45.6	173	-170.3	0	0	0	0	111.8	P552 L553 I554 V558 L559 S560 H609	P552-S556 PolarHBondContact O-N 3.25Å; L553-S556 WeakPolarHBondContact O-CB 3.29Å; L553-S556 PolarHBondContact O-N 3.28Å; I554-S556 PolarHBondContact O-N 3.4Å; S556-V558 VanDerWaalsContact C-N 3.35Å; S556-V558 PolarHBondContact O-N 3.02Å; S556-L559 PolarHBondContact O-N 2.7Å; S556-S560 PolarHBondContact O-N 2.76Å; S556-S560 VanDerWaalsContact O-N 3.1Å; S556-H609 PolarHBondContact O-CE1 2.93Å; S556-H609 PolarHBondContact O-ND1 2.77Å; S556-H609 PolarHBondContact OG-ND1 3.06Å
557	C	95.9	Very high	93.8	Very high	11 Å²	11	26.9 Å²	26.9	7%	0.074	13%	0.132	C	C	.	.	H	α-helix	trans	-63.3	-40.6	177	-59.6	0	0	0	0	111.9	W509 T513 L553 I554 L555 L559 S560 N561	W509-C557 HydrophobicContact CB-CB 3.92Å; W509-C557 HydrophobicContact CD2-CB 4.44Å; W509-C557 HydrophobicContact CE3-CB 3.92Å; T513-C557 WeakPolarHBondContact OG1-CB 3.32Å; L553-C557 PolarHBondContact O-N 3.25Å; L553-C557 PolarHBondContact O-SG 3.08Å; L553-C557 VanDerWaalsContact O-SG 3.38Å; I554-C557 WeakPolarHBondContact O-CB 3.44Å; I554-C557 PolarHBondContact O-N 2.9Å; L555-C557 VanDerWaalsContact C-N 3.34Å; L555-C557 PolarHBondContact O-N 2.85Å; C557-L559 VanDerWaalsContact C-N 3.34Å; C557-L559 PolarHBondContact O-N 3.4Å; C557-S560 PolarHBondContact O-N 2.91Å; C557-N561 PolarHBondContact O-N 3Å; C557-N561 PolarHBondContact O-ND2 3.03Å
558	V	96.5	Very high	93.7	Very high	0 Å²	0	25.3 Å²	25.3	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-58.2	-44.7	174.6	169.1	0	0	0	0	111.1	W509 V544 Y547 I554 L555 S556 N561 I562	W509-V558 HydrophobicContact CH2-CG2 4.18Å; W509-V558 HydrophobicContact CZ3-CG2 4.08Å; V544-V558 HydrophobicContact CG1-CG1 3.7Å; Y547-V558 HydrophobicContact CD1-CG2 3.77Å; Y547-V558 HydrophobicContact CE1-CG2 4.13Å; I554-V558 HydrophobicContact CG2-CG2 4.48Å; I554-V558 WeakPolarHBondContact O-CG2 3.38Å; I554-V558 PolarHBondContact O-N 3.1Å; L555-V558 HydrophobicContact CD1-CB 4.47Å; L555-V558 HydrophobicContact CD1-CG1 4.46Å; L555-V558 WeakPolarHBondContact O-CB 3.29Å; L555-V558 PolarHBondContact O-N 3.45Å; S556-V558 VanDerWaalsContact C-N 3.35Å; S556-V558 PolarHBondContact O-N 3.02Å; V558-N561 PolarHBondContact O-N 3.48Å; V558-I562 HydrophobicContact CG1-CD1 4.14Å; V558-I562 WeakPolarHBondContact O-CG1 3.24Å; V558-I562 PolarHBondContact O-N 3.16Å
559	L	96.5	Very high	93.8	Very high	0 Å²	0	19 Å²	19	0%	0	10%	0.096	C	C	.	.	H	α-helix	trans	-64.3	-39.7	178.2	-64.1	171.2	0	0	0	112.7	L555 S556 C557 I562 S563 L583 A586 V606 A610	L555-L559 VanDerWaalsContact O-CG 3.27Å; L555-L559 WeakPolarHBondContact O-CG 3.05Å; L555-L559 PolarHBondContact O-N 3.42Å; S556-L559 PolarHBondContact O-N 2.7Å; C557-L559 VanDerWaalsContact C-N 3.34Å; C557-L559 PolarHBondContact O-N 3.4Å; L559-I562 PolarHBondContact O-N 3.27Å; L559-S563 PolarHBondContact O-N 3.44Å; L559-S563 PolarHBondContact O-OG 3.27Å; L559-L583 HydrophobicContact CD2-CD2 3.57Å; L559-A586 HydrophobicContact CD1-CB 4.01Å; L559-A586 HydrophobicContact CD2-CB 3.88Å; L559-V606 HydrophobicContact CD1-CG1 4.03Å; L559-A610 HydrophobicContact CD1-CB 4.04Å
560	S	96.4	Very high	93.9	Very high	18 Å²	18	19 Å²	19	13%	0.126	10%	0.096	C	C	.	.	H	α-helix	trans	-62.4	-44.2	173	-82.8	0	0	0	0	111.8	E517 S556 C557 I562 S563 A564 H609	E517-S560 WeakPolarHBondContact OE1-CB 3.36Å; E517-S560 PolarHBondContact OE1-OG 2.86Å; S556-S560 PolarHBondContact O-N 2.76Å; S556-S560 VanDerWaalsContact O-N 3.1Å; C557-S560 PolarHBondContact O-N 2.91Å; S560-I562 PolarHBondContact O-N 2.94Å; S560-S563 CarbonylContact O-C 3.59Å; S560-S563 WeakPolarHBondContact O-CA 3.44Å; S560-S563 WeakPolarHBondContact O-CB 3.24Å; S560-S563 PolarHBondContact O-N 3.28Å; S560-S563 VanDerWaalsContact O-N 3.09Å; S560-A564 PolarHBondContact O-N 3.31Å; S560-H609 PolarHBondContact OG-CE1 2.84Å; S560-H609 PolarHBondContact OG-NE2 3.16Å
561	N	96.7	Very high	94	Very high	1 Å²	1	12.9 Å²	12.9	1%	0.005	8%	0.076	C	C	.	.	H	α-helix	trans	-64.8	-37.8	178	-77.8	-79.5	0	0	0	112.2	T513 V544 C557 V558 S563 A564 L565	T513-N561 PolarHBondContact OG1-ND2 3.28Å; V544-N561 HydrophobicContact CG1-CB 4.41Å; C557-N561 PolarHBondContact O-N 3Å; C557-N561 PolarHBondContact O-ND2 3.03Å; V558-N561 PolarHBondContact O-N 3.48Å; N561-S563 VanDerWaalsContact C-N 3.31Å; N561-S563 PolarHBondContact O-N 3.27Å; N561-A564 PolarHBondContact O-N 3.06Å; N561-L565 WeakPolarHBondContact O-CB 3.25Å; N561-L565 WeakPolarHBondContact O-CG 3.35Å; N561-L565 PolarHBondContact O-N 3.27Å
562	I	96.3	Very high	94.1	Very high	0 Å²	0	17.3 Å²	17.3	0%	0	9%	0.093	C	C	.	.	H	α-helix	trans	-59	-45.6	170.4	-69.1	167.6	0	0	0	110.1	L541 V544 L545 V558 L559 S560 A564 L565 F566 V579 K582	L541-I562 HydrophobicContact CD1-CG2 4.42Å; V544-I562 HydrophobicContact CG1-CD1 4.25Å; V544-I562 HydrophobicContact CG1-CG1 3.66Å; L545-I562 HydrophobicContact CD2-CD1 4.01Å; L545-I562 HydrophobicContact CD2-CG1 4.37Å; V558-I562 HydrophobicContact CG1-CD1 4.14Å; V558-I562 WeakPolarHBondContact O-CG1 3.24Å; V558-I562 PolarHBondContact O-N 3.16Å; L559-I562 PolarHBondContact O-N 3.27Å; S560-I562 PolarHBondContact O-N 2.94Å; I562-A564 PolarHBondContact O-N 3.45Å; I562-L565 PolarHBondContact O-N 2.91Å; I562-F566 WeakPolarHBondContact O-CB 3.37Å; I562-F566 PolarHBondContact O-N 3.48Å; I562-V579 HydrophobicContact CG2-CG1 3.8Å; I562-K582 HydrophobicContact CD1-CG 3.85Å
563	S	94.9	Very high	94.1	Very high	19 Å²	19	20.3 Å²	20.3	13%	0.133	11%	0.112	C	C	.	.	H	α-helix	trans	-65.7	-36.9	179.8	-57.8	0	0	0	0	112.6	L559 S560 N561	L559-S563 PolarHBondContact O-N 3.44Å; L559-S563 PolarHBondContact O-OG 3.27Å; S560-S563 CarbonylContact O-C 3.59Å; S560-S563 WeakPolarHBondContact O-CA 3.44Å; S560-S563 WeakPolarHBondContact O-CB 3.24Å; S560-S563 PolarHBondContact O-N 3.28Å; S560-S563 VanDerWaalsContact O-N 3.09Å; N561-S563 VanDerWaalsContact C-N 3.31Å; N561-S563 PolarHBondContact O-N 3.27Å
564	A	94.6	Very high	94.1	Very high	13 Å²	13	25.8 Å²	25.8	11%	0.107	14%	0.137	C	C	.	.	H	α-helix	trans	-68.5	-36.3	176.1	0	0	0	0	0	112.3	M516 E517 M520 S560 N561 I562 P567	M516-A564 HydrophobicContact CG-CB 4.22Å; E517-A564 HydrophobicContact CG-CB 4.24Å; M520-A564 HydrophobicContact CB-CB 4.49Å; M520-A564 WeakPolarHBondContact CB-O 3.4Å; M520-A564 HydrophobicContact CG-CB 4.29Å; M520-A564 WeakPolarHBondContact CG-O 3.35Å; S560-A564 PolarHBondContact O-N 3.31Å; N561-A564 PolarHBondContact O-N 3.06Å; I562-A564 PolarHBondContact O-N 3.45Å; A564-P567 VanDerWaalsContact O-CD 3.27Å; A564-P567 WeakPolarHBondContact O-CD 3.4Å
565	L	95.6	Very high	94	Very high	1 Å²	1	26.8 Å²	26.8	1%	0.005	14%	0.141	C	C	.	.	H	α-helix	trans	-84.5	-15.7	178.2	-70.5	168.3	0	0	0	113.6	L477 M520 L540 L541 N561 I562 P567 F568	L477-L565 HydrophobicContact CD2-CD1 4.09Å; M520-L565 HydrophobicContact CE-CD2 3.35Å; M520-L565 HydrophobicContact CE-CG 4.47Å; L540-L565 HydrophobicContact CB-CD1 4.19Å; L541-L565 HydrophobicContact CB-CB 4.46Å; L541-L565 HydrophobicContact CB-CD1 4.35Å; L541-L565 HydrophobicContact CD1-CB 4.15Å; N561-L565 WeakPolarHBondContact O-CB 3.25Å; N561-L565 WeakPolarHBondContact O-CG 3.35Å; N561-L565 PolarHBondContact O-N 3.27Å; I562-L565 PolarHBondContact O-N 2.91Å; L565-P567 VanDerWaalsContact C-N 3.34Å; L565-F568 HydrophobicContact CD2-CD2 4.35Å; L565-F568 HydrophobicContact CD2-CE2 4.47Å; L565-F568 WeakPolarHBondContact O-CB 3.08Å; L565-F568 PolarHBondContact O-N 2.73Å; L565-F568 VanDerWaalsContact O-N 3.14Å
566	F	95.3	Very high	93.9	Very high	3 Å²	3	26.1 Å²	26.1	1%	0.013	14%	0.138	C	C	.	.	G	3₁₀ helix	trans	-52.4	-38.8	-177.7	-168.1	-89.3	0	0	0	115.1	I562 F568 V569 V579 I617 Y621 I625	I562-F566 WeakPolarHBondContact O-CB 3.37Å; I562-F566 PolarHBondContact O-N 3.48Å; F566-F568 PolarHBondContact O-N 3.48Å; F566-V569 HydrophobicContact CD2-CG2 4.25Å; F566-V569 HydrophobicContact CE2-CB 4.48Å; F566-V569 WeakPolarHBondContact O-CB 3.35Å; F566-V569 WeakPolarHBondContact O-CG2 3.36Å; F566-V569 PolarHBondContact O-N 3Å; F566-V579 HydrophobicContact CD2-CG1 3.93Å; F566-V579 HydrophobicContact CE2-CB 4.47Å; F566-V579 HydrophobicContact CE2-CG1 3.96Å; F566-I617 HydrophobicContact CD1-CG1 4.07Å; F566-I617 HydrophobicContact CD1-CG2 4.47Å; F566-I617 HydrophobicContact CD2-CD1 3.61Å; F566-I617 HydrophobicContact CD2-CG1 3.88Å; F566-I617 HydrophobicContact CD2-CG2 4.47Å; F566-I617 HydrophobicContact CE1-CB 4.48Å; F566-I617 HydrophobicContact CE1-CG1 4.2Å; F566-I617 HydrophobicContact CE1-CG2 3.76Å; F566-I617 HydrophobicContact CE2-CD1 3.77Å; F566-I617 HydrophobicContact CE2-CG1 3.99Å; F566-I617 HydrophobicContact CE2-CG2 3.74Å; F566-I617 HydrophobicContact CG-CD1 4.1Å; F566-I617 HydrophobicContact CG-CG1 3.92Å; F566-I617 HydrophobicContact CZ-CB 4.34Å; F566-I617 HydrophobicContact CZ-CD1 4.4Å; F566-I617 HydrophobicContact CZ-CG1 4.16Å; F566-I617 HydrophobicContact CZ-CG2 3.33Å; F566-Y621 AromaticContact CD1-CD2 3.4Å; F566-Y621 HydrophobicContact CD1-CD2 3.4Å; F566-Y621 AromaticContact CD1-CE2 3.62Å; F566-Y621 HydrophobicContact CD1-CE2 3.62Å; F566-Y621 AromaticContact CD1-CG 3.99Å; F566-Y621 HydrophobicContact CD1-CG 3.99Å; F566-Y621 HydrophobicContact CE1-CD1 4.39Å; F566-Y621 AromaticContact CE1-CD2 3.36Å; F566-Y621 HydrophobicContact CE1-CD2 3.36Å; F566-Y621 HydrophobicContact CE1-CE2 4.07Å; F566-Y621 AromaticContact CE1-CG 3.57Å; F566-Y621 HydrophobicContact CE1-CG 3.57Å; F566-I625 HydrophobicContact CZ-CD1 4.28Å
567	P	93.8	Very high	93.7	Very high	20 Å²	20	26.9 Å²	26.9	13%	0.13	14%	0.142	C	C	.	.	G	3₁₀ helix	trans	-58.6	-26.4	-178.2	-18.9	28.9	0	0	0	113.2	F524 A564 L565 V569 T570 Y621	F524-P567 HydrophobicContact CD1-CB 4.19Å; F524-P567 HydrophobicContact CD2-CB 3.93Å; F524-P567 HydrophobicContact CD2-CG 4.21Å; F524-P567 HydrophobicContact CE1-CB 3.85Å; F524-P567 HydrophobicContact CE2-CB 3.6Å; F524-P567 HydrophobicContact CE2-CG 4.03Å; F524-P567 HydrophobicContact CG-CB 4.23Å; F524-P567 HydrophobicContact CZ-CB 3.56Å; F524-P567 HydrophobicContact CZ-CG 4.46Å; A564-P567 VanDerWaalsContact O-CD 3.27Å; A564-P567 WeakPolarHBondContact O-CD 3.4Å; L565-P567 VanDerWaalsContact C-N 3.34Å; P567-V569 VanDerWaalsContact C-N 3.28Å; P567-V569 PolarHBondContact O-N 3.29Å; P567-T570 WeakPolarHBondContact O-CB 3.48Å; P567-T570 WeakPolarHBondContact O-CG2 3.3Å; P567-T570 PolarHBondContact O-N 3.13Å; P567-T570 PolarHBondContact O-OG1 3.34Å; P567-Y621 WeakPolarHBondContact CB-OH 3.43Å; P567-Y621 VanDerWaalsContact CG-OH 3.3Å; P567-Y621 WeakPolarHBondContact CG-OH 2.87Å
568	F	93	Very high	93.5	Very high	1 Å²	1	30.4 Å²	30.4	0%	0.004	16%	0.158	C	C	.	.	G	3₁₀ helix	trans	-67.9	-24.7	173.6	-68.4	-77.4	0	0	0	113.6	F470 M520 F524 L532 P533 I534 S537 M538 L565 F566 T570 H571	F470-F568 HydrophobicContact CE2-CZ 4.28Å; M520-F568 HydrophobicContact CE-CE2 4.07Å; M520-F568 HydrophobicContact SD-CE2 3.81Å; M520-F568 HydrophobicContact SD-CZ 4.33Å; F524-F568 HydrophobicContact CE1-CD1 4.35Å; F524-F568 HydrophobicContact CE1-CE1 4.3Å; F524-F568 HydrophobicContact CE2-CD1 4.38Å; F524-F568 AromaticContact CE2-CD2 3.7Å; F524-F568 HydrophobicContact CE2-CD2 3.7Å; F524-F568 HydrophobicContact CE2-CE1 4.06Å; F524-F568 AromaticContact CE2-CE2 3.33Å; F524-F568 HydrophobicContact CE2-CE2 3.33Å; F524-F568 HydrophobicContact CE2-CG 4.22Å; F524-F568 AromaticContact CE2-CZ 3.51Å; F524-F568 HydrophobicContact CE2-CZ 3.51Å; F524-F568 HydrophobicContact CZ-CB 4.43Å; F524-F568 AromaticContact CZ-CD1 3.55Å; F524-F568 HydrophobicContact CZ-CD1 3.55Å; F524-F568 AromaticContact CZ-CD2 3.56Å; F524-F568 HydrophobicContact CZ-CD2 3.56Å; F524-F568 AromaticContact CZ-CE1 3.5Å; F524-F568 HydrophobicContact CZ-CE1 3.5Å; F524-F568 VanDerWaalsContact CZ-CE1 3.5Å; F524-F568 AromaticContact CZ-CE2 3.51Å; F524-F568 HydrophobicContact CZ-CE2 3.51Å; F524-F568 AromaticContact CZ-CG 3.58Å; F524-F568 HydrophobicContact CZ-CG 3.58Å; F524-F568 AromaticContact CZ-CZ 3.47Å; F524-F568 HydrophobicContact CZ-CZ 3.47Å; F524-F568 VanDerWaalsContact CZ-CZ 3.47Å; L532-F568 HydrophobicContact CB-CE1 4.28Å; P533-F568 HydrophobicContact CG-CE1 4.42Å; P533-F568 HydrophobicContact CG-CZ 4.42Å; I534-F568 HydrophobicContact CG1-CD1 4.45Å; S537-F568 VanDerWaalsContact CB-CG 3.44Å; S537-F568 WeakPolarHBondContact OG-CD2 3.47Å; S537-F568 VanDerWaalsContact OG-CE1 3.29Å; S537-F568 WeakPolarHBondContact OG-CE1 3.45Å; S537-F568 WeakPolarHBondContact OG-CE2 3.35Å; S537-F568 WeakPolarHBondContact OG-CZ 3.41Å; M538-F568 HydrophobicContact SD-CB 4.16Å; L565-F568 HydrophobicContact CD2-CD2 4.35Å; L565-F568 HydrophobicContact CD2-CE2 4.47Å; L565-F568 WeakPolarHBondContact O-CB 3.08Å; L565-F568 PolarHBondContact O-N 2.73Å; L565-F568 VanDerWaalsContact O-N 3.14Å; F566-F568 PolarHBondContact O-N 3.48Å; F568-T570 PolarHBondContact O-N 3.16Å; F568-H571 PolarHBondContact O-N 3.4Å; F568-H571 VanDerWaalsContact O-N 3.13Å
569	V	93.4	Very high	93.5	Very high	2 Å²	2	30.4 Å²	30.4	1%	0.012	16%	0.158	C	C	.	.	G	3₁₀ helix	trans	-63.7	-24.9	179	-179.4	0	0	0	0	111.5	L541 F566 P567 H571 R572 P573 F575 V576 V579	L541-V569 HydrophobicContact CD2-CG2 3.37Å; F566-V569 HydrophobicContact CD2-CG2 4.25Å; F566-V569 HydrophobicContact CE2-CB 4.48Å; F566-V569 WeakPolarHBondContact O-CB 3.35Å; F566-V569 WeakPolarHBondContact O-CG2 3.36Å; F566-V569 PolarHBondContact O-N 3Å; P567-V569 VanDerWaalsContact C-N 3.28Å; P567-V569 PolarHBondContact O-N 3.29Å; V569-H571 PolarHBondContact O-N 2.79Å; V569-R572 CarbonylContact O-C 3.55Å; V569-R572 WeakPolarHBondContact O-CA 3.49Å; V569-R572 PolarHBondContact O-N 3.33Å; V569-P573 VanDerWaalsContact O-N 3.16Å; V569-F575 HydrophobicContact CG1-CB 4.12Å; V569-V576 HydrophobicContact CG1-CG2 3.58Å; V569-V579 HydrophobicContact CG2-CG2 4.47Å
570	T	90.8	Very high	93.3	Very high	28 Å²	28	30.5 Å²	30.5	17%	0.172	16%	0.158	C	C	.	.	G	3₁₀ helix	trans	-57.5	-30	175	64.5	0	0	0	0	112.6	P567 F568 Y621 F624	P567-T570 WeakPolarHBondContact O-CB 3.48Å; P567-T570 WeakPolarHBondContact O-CG2 3.3Å; P567-T570 PolarHBondContact O-N 3.13Å; P567-T570 PolarHBondContact O-OG1 3.34Å; F568-T570 PolarHBondContact O-N 3.16Å; T570-Y621 HydrophobicContact CG2-CD1 3.5Å; T570-Y621 HydrophobicContact CG2-CE1 3.71Å; T570-Y621 HydrophobicContact CG2-CG 4.46Å; T570-F624 HydrophobicContact CG2-CD2 3.81Å; T570-F624 HydrophobicContact CG2-CE2 3.47Å; T570-F624 VanDerWaalsContact CG2-CE2 3.47Å; T570-F624 HydrophobicContact CG2-CZ 3.99Å; T570-F624 WeakPolarHBondContact O-CE1 3.46Å
571	H	90.6	Very high	93.1	Very high	76 Å²	76	37.5 Å²	37.5	35%	0.352	18%	0.183	S	C	.	.	G	3₁₀ helix	trans	-82.9	-19.7	175.5	-58.1	-73.5	0	0	0	113.3	I534 F568 V569	I534-H571 HydrophobicContact CD1-CB 4.08Å; I534-H571 HydrophobicContact CG2-CB 4.18Å; F568-H571 PolarHBondContact O-N 3.4Å; F568-H571 VanDerWaalsContact O-N 3.13Å; V569-H571 PolarHBondContact O-N 2.79Å
572	R	90.9	Very high	93	Very high	99 Å²	99	38.5 Å²	38.5	37%	0.374	19%	0.187	S	C	.	.			trans	-135.7	73.9	175.4	-63.2	-155.4	-174.3	-161.7	3.9	111.5	D535 M538 V569 Q574 F575	D535-R572 IonicContact OD1-CZ 2.75Å; D535-R572 IonicContact OD1-NH2 2.7Å; D535-R572 PolarHBondContact OD1-NH2 3.41Å; M538-R572 HydrophobicContact CE-CB 3.97Å; M538-R572 HydrophobicContact CG-CG 4.5Å; M538-R572 HydrophobicContact SD-CB 4.48Å; V569-R572 CarbonylContact O-C 3.55Å; V569-R572 WeakPolarHBondContact O-CA 3.49Å; V569-R572 PolarHBondContact O-N 3.33Å; R572-Q574 HydrophobicContact CB-CG 4.49Å; R572-Q574 PolarHBondContact O-N 2.93Å; R572-F575 HydrophobicContact CB-CD2 4.11Å; R572-F575 HydrophobicContact CB-CE2 4.45Å; R572-F575 PolarHBondContact O-N 2.91Å
573	P	90.6	Very high	92.9	Very high	63 Å²	63	38.5 Å²	38.5	41%	0.409	19%	0.187	S	C	.	.	G	3₁₀ helix	trans	-60.1	-16.7	-173.3	-26.1	35.9	0	0	0	115.2	V569 F575 V576 F624	V569-P573 VanDerWaalsContact O-N 3.16Å; P573-F575 PolarHBondContact O-N 3.41Å; P573-V576 WeakPolarHBondContact O-CB 3.33Å; P573-V576 VanDerWaalsContact O-CG2 3.32Å; P573-V576 WeakPolarHBondContact O-CG2 3.37Å; P573-V576 PolarHBondContact O-N 3.01Å; P573-F624 HydrophobicContact CB-CD1 4.46Å; P573-F624 HydrophobicContact CG-CD1 4Å; P573-F624 HydrophobicContact CG-CE1 4.23Å
574	Q	89.8	Confident	92.9	Very high	137 Å²	137	38 Å²	38	64%	0.64	18%	0.182	S	C	*	.	G	3₁₀ helix	trans	-56.2	-19.1	174.2	68.7	-170.5	28.3	0	0	114.4	R572	R572-Q574 HydrophobicContact CB-CG 4.49Å; R572-Q574 PolarHBondContact O-N 2.93Å
575	F	91.6	Very high	92.8	Very high	20 Å²	20	41.9 Å²	41.9	9%	0.088	20%	0.197	C	C	.	.	G	3₁₀ helix	trans	-86.4	-13.3	177	-76.8	-100.9	0	0	0	113.9	M538 L545 V569 R572 P573 Q578 V579	M538-F575 HydrophobicContact CE-CB 3.91Å; M538-F575 HydrophobicContact CE-CD1 3.8Å; M538-F575 HydrophobicContact CE-CD2 3.13Å; M538-F575 HydrophobicContact CE-CE1 4.01Å; M538-F575 HydrophobicContact CE-CE2 3.42Å; M538-F575 VanDerWaalsContact CE-CE2 3.42Å; M538-F575 HydrophobicContact CE-CG 3.34Å; M538-F575 HydrophobicContact CE-CZ 3.86Å; L545-F575 HydrophobicContact CD1-CD1 4.48Å; V569-F575 HydrophobicContact CG1-CB 4.12Å; R572-F575 HydrophobicContact CB-CD2 4.11Å; R572-F575 HydrophobicContact CB-CE2 4.45Å; R572-F575 PolarHBondContact O-N 2.91Å; P573-F575 PolarHBondContact O-N 3.41Å; F575-Q578 PolarHBondContact O-N 2.91Å; F575-Q578 VanDerWaalsContact O-N 3.1Å; F575-V579 WeakPolarHBondContact O-CG2 3.17Å; F575-V579 PolarHBondContact O-N 3.07Å
576	V	92.7	Very high	92.7	Very high	1 Å²	1	42 Å²	42	1%	0.006	20%	0.198	C	C	.	.	H	α-helix	trans	-53.1	-48	-179.2	171.1	0	0	0	0	112.1	V569 P573 Q578 V579 L580 I625	V569-V576 HydrophobicContact CG1-CG2 3.58Å; P573-V576 WeakPolarHBondContact O-CB 3.33Å; P573-V576 VanDerWaalsContact O-CG2 3.32Å; P573-V576 WeakPolarHBondContact O-CG2 3.37Å; P573-V576 PolarHBondContact O-N 3.01Å; V576-Q578 VanDerWaalsContact C-N 3.33Å; V576-Q578 PolarHBondContact O-N 3.4Å; V576-V579 PolarHBondContact O-N 3.49Å; V576-L580 HydrophobicContact CG1-CD1 3.84Å; V576-L580 HydrophobicContact CG1-CG 4.27Å; V576-L580 WeakPolarHBondContact O-CG 2.89Å; V576-L580 PolarHBondContact O-N 3.4Å; V576-I625 HydrophobicContact CG1-CD1 3.58Å
577	P	91.4	Very high	92.5	Very high	51 Å²	51	41.9 Å²	41.9	33%	0.331	20%	0.197	S	C	.	.	H	α-helix	trans	-62.5	-37.1	179	-23.8	35.5	0	0	0	113.6	L580 Y581 M631	P577-L580 PolarHBondContact O-N 3Å; P577-Y581 WeakPolarHBondContact O-CB 3.27Å; P577-Y581 PolarHBondContact O-N 3.17Å; P577-M631 HydrophobicContact CB-CE 4.42Å
578	Q	92.9	Very high	92.4	Very high	86 Å²	86	42.7 Å²	42.7	40%	0.402	20%	0.202	S	C	.	.	H	α-helix	trans	-67.5	-41.2	178.8	-64.7	-175.7	49.3	0	0	111.6	L545 F575 V576 Y581 K582	L545-Q578 HydrophobicContact CD1-CB 4.26Å; F575-Q578 PolarHBondContact O-N 2.91Å; F575-Q578 VanDerWaalsContact O-N 3.1Å; V576-Q578 VanDerWaalsContact C-N 3.33Å; V576-Q578 PolarHBondContact O-N 3.4Å; Q578-Y581 PolarHBondContact O-N 2.99Å; Q578-K582 PolarHBondContact O-N 3Å; Q578-K582 VanDerWaalsContact O-N 3.1Å
579	V	94.9	Very high	92.2	Very high	0 Å²	0	44 Å²	44	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-61.5	-51.6	174.3	173.2	0	0	0	0	110.2	L541 L545 I562 F566 V569 F575 V576 Y581 K582 L583 I617	L541-V579 HydrophobicContact CD2-CG2 4.38Å; L545-V579 HydrophobicContact CD1-CG2 4.16Å; L545-V579 HydrophobicContact CD2-CG2 4.2Å; I562-V579 HydrophobicContact CG2-CG1 3.8Å; F566-V579 HydrophobicContact CD2-CG1 3.93Å; F566-V579 HydrophobicContact CE2-CB 4.47Å; F566-V579 HydrophobicContact CE2-CG1 3.96Å; V569-V579 HydrophobicContact CG2-CG2 4.47Å; F575-V579 WeakPolarHBondContact O-CG2 3.17Å; F575-V579 PolarHBondContact O-N 3.07Å; V576-V579 PolarHBondContact O-N 3.49Å; V579-Y581 VanDerWaalsContact C-N 3.3Å; V579-Y581 PolarHBondContact O-N 3.31Å; V579-K582 PolarHBondContact O-N 2.8Å; V579-K582 VanDerWaalsContact O-N 3.14Å; V579-L583 HydrophobicContact CG1-CD1 4.02Å; V579-L583 HydrophobicContact CG1-CG 4.36Å; V579-L583 WeakPolarHBondContact O-CG 3.5Å; V579-L583 PolarHBondContact O-N 2.88Å; V579-I617 HydrophobicContact CG1-CD1 4.27Å
580	L	92.6	Very high	91.7	Very high	1 Å²	1	49.6 Å²	49.6	1%	0.005	23%	0.234	C	C	.	.	H	α-helix	trans	-58.2	-43.4	179.5	-70.3	175.7	0	0	0	111.6	V576 P577 K582 L583 F584 M631 F632	V576-L580 HydrophobicContact CG1-CD1 3.84Å; V576-L580 HydrophobicContact CG1-CG 4.27Å; V576-L580 WeakPolarHBondContact O-CG 2.89Å; V576-L580 PolarHBondContact O-N 3.4Å; P577-L580 PolarHBondContact O-N 3Å; L580-K582 VanDerWaalsContact C-N 3.35Å; L580-K582 PolarHBondContact O-N 2.78Å; L580-L583 PolarHBondContact O-N 3.17Å; L580-F584 HydrophobicContact CB-CD2 4.29Å; L580-F584 HydrophobicContact CB-CE2 4.27Å; L580-F584 WeakPolarHBondContact O-CB 3.49Å; L580-F584 WeakPolarHBondContact O-CD2 3.4Å; L580-F584 PolarHBondContact O-N 3.16Å; L580-M631 HydrophobicContact CD1-CE 4.1Å; L580-F632 HydrophobicContact CD1-CD2 4.11Å; L580-F632 HydrophobicContact CD2-CD2 4.17Å; L580-F632 HydrophobicContact CD2-CE2 3.99Å
581	Y	92.6	Very high	91	Very high	165 Å²	165	50.6 Å²	50.6	65%	0.647	24%	0.237	S	C	*	.	H	α-helix	trans	-58.2	-44.9	176.3	-179.2	-98.1	0	0	0	112.3	P577 Q578 V579 F584 K585	P577-Y581 WeakPolarHBondContact O-CB 3.27Å; P577-Y581 PolarHBondContact O-N 3.17Å; Q578-Y581 PolarHBondContact O-N 2.99Å; V579-Y581 VanDerWaalsContact C-N 3.3Å; V579-Y581 PolarHBondContact O-N 3.31Å; Y581-F584 PolarHBondContact O-N 3.06Å; Y581-K585 WeakPolarHBondContact O-CB 3.33Å; Y581-K585 PolarHBondContact O-N 3.04Å
582	K	94.8	Very high	89.5	Confident	22 Å²	22	53.3 Å²	53.3	10%	0.096	26%	0.255	C	S	.	.	H	α-helix	trans	-62.5	-43.1	177	-169.4	71.5	171.6	-158.2	0	111.8	L545 Y547 I562 Q578 V579 L580 K585 A586	L545-K582 HydrophobicContact CD2-CB 3.83Å; L545-K582 HydrophobicContact CD2-CG 4.11Å; L545-K582 WeakPolarHBondContact O-CE 3.35Å; L545-K582 PolarHBondContact O-NZ 3.13Å; Y547-K582 PolarHBondContact O-NZ 3.24Å; I562-K582 HydrophobicContact CD1-CG 3.85Å; Q578-K582 PolarHBondContact O-N 3Å; Q578-K582 VanDerWaalsContact O-N 3.1Å; V579-K582 PolarHBondContact O-N 2.8Å; V579-K582 VanDerWaalsContact O-N 3.14Å; L580-K582 VanDerWaalsContact C-N 3.35Å; L580-K582 PolarHBondContact O-N 2.78Å; K582-K585 PolarHBondContact O-N 2.93Å; K582-A586 PolarHBondContact O-N 3.18Å; K582-A586 VanDerWaalsContact O-N 3.17Å
583	L	94.8	Very high	87.8	Confident	0 Å²	0	53.8 Å²	53.8	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-65.9	-45.8	178.2	-63.7	178.3	0	0	0	111.6	L559 V579 L580 K585 A586 V587 A613 I614 I617	L559-L583 HydrophobicContact CD2-CD2 3.57Å; V579-L583 HydrophobicContact CG1-CD1 4.02Å; V579-L583 HydrophobicContact CG1-CG 4.36Å; V579-L583 WeakPolarHBondContact O-CG 3.5Å; V579-L583 PolarHBondContact O-N 2.88Å; L580-L583 PolarHBondContact O-N 3.17Å; L583-K585 PolarHBondContact O-N 3.4Å; L583-A586 CarbonylContact O-C 3.52Å; L583-A586 WeakPolarHBondContact O-CA 3.36Å; L583-A586 WeakPolarHBondContact O-CB 3.46Å; L583-A586 PolarHBondContact O-N 3.08Å; L583-A586 VanDerWaalsContact O-N 3.07Å; L583-V587 WeakPolarHBondContact O-CG2 3.41Å; L583-V587 PolarHBondContact O-N 2.7Å; L583-A613 HydrophobicContact CD2-CB 4.12Å; L583-I614 HydrophobicContact CB-CD1 3.98Å; L583-I614 HydrophobicContact CB-CG1 3.76Å; L583-I614 HydrophobicContact CD1-CG1 3.83Å; L583-I614 HydrophobicContact CG-CG1 4.4Å; L583-I617 HydrophobicContact CD1-CD1 3.54Å
584	F	93.3	Very high	85.6	Confident	8 Å²	8	58.7 Å²	58.7	4%	0.035	28%	0.281	C	S	.	.	H	α-helix	trans	-62.4	-40.1	176.6	-78.6	-60.2	0	0	0	112.4	L580 Y581 A586 V587 T588 I614 F632 H635 V636 L639	L580-F584 HydrophobicContact CB-CD2 4.29Å; L580-F584 HydrophobicContact CB-CE2 4.27Å; L580-F584 WeakPolarHBondContact O-CB 3.49Å; L580-F584 WeakPolarHBondContact O-CD2 3.4Å; L580-F584 PolarHBondContact O-N 3.16Å; Y581-F584 PolarHBondContact O-N 3.06Å; F584-A586 PolarHBondContact O-N 3.17Å; F584-V587 WeakPolarHBondContact O-CB 3.5Å; F584-V587 PolarHBondContact O-N 2.84Å; F584-V587 VanDerWaalsContact O-N 3.08Å; F584-T588 PolarHBondContact O-N 3.49Å; F584-T588 PolarHBondContact O-OG1 3.14Å; F584-I614 HydrophobicContact CD1-CD1 4.1Å; F584-I614 HydrophobicContact CE1-CD1 4.11Å; F584-F632 HydrophobicContact CE1-CZ 4.33Å; F584-F632 AromaticContact CE2-CD2 3.83Å; F584-F632 HydrophobicContact CE2-CD2 3.83Å; F584-F632 AromaticContact CE2-CE2 3.86Å; F584-F632 HydrophobicContact CE2-CE2 3.86Å; F584-F632 HydrophobicContact CE2-CG 4.38Å; F584-F632 HydrophobicContact CE2-CZ 4.43Å; F584-F632 HydrophobicContact CZ-CD1 4.17Å; F584-F632 AromaticContact CZ-CD2 3.71Å; F584-F632 HydrophobicContact CZ-CD2 3.71Å; F584-F632 AromaticContact CZ-CE1 3.94Å; F584-F632 HydrophobicContact CZ-CE1 3.94Å; F584-F632 AromaticContact CZ-CE2 3.46Å; F584-F632 HydrophobicContact CZ-CE2 3.46Å; F584-F632 VanDerWaalsContact CZ-CE2 3.46Å; F584-F632 HydrophobicContact CZ-CG 4.06Å; F584-F632 AromaticContact CZ-CZ 3.58Å; F584-F632 HydrophobicContact CZ-CZ 3.58Å; F584-H635 AromaticContact CD1-CD2 3.6Å; F584-H635 AromaticContact CD1-NE2 4Å; F584-H635 AromaticContact CD2-CD2 3.68Å; F584-H635 AromaticContact CE1-CD2 3.91Å; F584-H635 AromaticContact CG-CD2 3.48Å; F584-H635 VanDerWaalsContact CG-CD2 3.48Å; F584-H635 WeakPolarHBondContact CG-CD2 3.39Å; F584-H635 AromaticContact CG-NE2 3.72Å; F584-V636 HydrophobicContact CE1-CG2 4.26Å; F584-V636 HydrophobicContact CZ-CG2 4.36Å; F584-L639 HydrophobicContact CD1-CD1 4.11Å; F584-L639 HydrophobicContact CE1-CD1 4.37Å
585	K	92.7	Very high	83.4	Confident	96 Å²	96	60.8 Å²	60.8	42%	0.417	30%	0.297	S	S	.	.	H	α-helix	trans	-56.7	-39.9	172.3	-173.9	176.3	177.7	176.9	0	111.2	E548 Y581 K582 L583 T588 F589	E548-K585 IonicContact OE1-NZ 3.16Å; E548-K585 PolarHBondContact OE1-NZ 3.4Å; Y581-K585 WeakPolarHBondContact O-CB 3.33Å; Y581-K585 PolarHBondContact O-N 3.04Å; K582-K585 PolarHBondContact O-N 2.93Å; L583-K585 PolarHBondContact O-N 3.4Å; K585-T588 CarbonylContact O-C 3.59Å; K585-T588 PolarHBondContact O-N 3.35Å; K585-T588 PolarHBondContact O-OG1 3.09Å; K585-T588 VanDerWaalsContact O-OG1 3.08Å; K585-F589 PolarHBondContact O-N 3.42Å
586	A	93.7	Very high	81.3	Confident	3 Å²	3	69.1 Å²	69.1	3%	0.025	33%	0.333	C	S	.	.	H	α-helix	trans	-72.2	-30.8	176.2	0	0	0	0	0	113.7	L555 L559 K582 L583 F584 T588 F589 A610	L555-A586 HydrophobicContact CD2-CB 4.45Å; L559-A586 HydrophobicContact CD1-CB 4.01Å; L559-A586 HydrophobicContact CD2-CB 3.88Å; K582-A586 PolarHBondContact O-N 3.18Å; K582-A586 VanDerWaalsContact O-N 3.17Å; L583-A586 CarbonylContact O-C 3.52Å; L583-A586 WeakPolarHBondContact O-CA 3.36Å; L583-A586 WeakPolarHBondContact O-CB 3.46Å; L583-A586 PolarHBondContact O-N 3.08Å; L583-A586 VanDerWaalsContact O-N 3.07Å; F584-A586 PolarHBondContact O-N 3.17Å; A586-T588 PolarHBondContact O-N 2.82Å; A586-F589 WeakPolarHBondContact O-CB 3.38Å; A586-F589 PolarHBondContact O-N 2.94Å; A586-F589 VanDerWaalsContact O-N 3.12Å; A586-A610 HydrophobicContact CB-CB 3.74Å
587	V	91.9	Very high	79.6	Confident	0 Å²	0	72.5 Å²	72.5	0%	0	36%	0.361	C	S	.	.	H	α-helix	trans	-61.4	-35.2	171.3	173.6	0	0	0	0	110.9	L583 F584 F589 R607 A610 I614 L646	L583-V587 WeakPolarHBondContact O-CG2 3.41Å; L583-V587 PolarHBondContact O-N 2.7Å; F584-V587 WeakPolarHBondContact O-CB 3.5Å; F584-V587 PolarHBondContact O-N 2.84Å; F584-V587 VanDerWaalsContact O-N 3.08Å; V587-F589 VanDerWaalsContact C-N 3.34Å; V587-R607 WeakPolarHBondContact O-CG 3.36Å; V587-R607 PolarHBondContact O-NE 2.89Å; V587-R607 PolarHBondContact O-NH1 3.33Å; V587-R607 VanDerWaalsContact O-NH1 3.09Å; V587-R607 PolarHBondContact O-NH2 2.99Å; V587-R607 VanDerWaalsContact O-NH2 3.15Å; V587-A610 HydrophobicContact CG2-CB 3.76Å; V587-I614 HydrophobicContact CG2-CD1 3.75Å; V587-L646 HydrophobicContact CG1-CD2 3.77Å
588	T	90.3	Very high	78.3	Confident	37 Å²	37	74.1 Å²	74.1	23%	0.227	37%	0.371	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.9	13.2	176.2	55.1	0	0	0	0	114.1	F584 K585 A586 H590 R607 L639 L645	F584-T588 PolarHBondContact O-N 3.49Å; F584-T588 PolarHBondContact O-OG1 3.14Å; K585-T588 CarbonylContact O-C 3.59Å; K585-T588 PolarHBondContact O-N 3.35Å; K585-T588 PolarHBondContact O-OG1 3.09Å; K585-T588 VanDerWaalsContact O-OG1 3.08Å; A586-T588 PolarHBondContact O-N 2.82Å; T588-H590 PolarHBondContact O-N 3.48Å; T588-H590 PolarHBondContact O-ND1 2.99Å; T588-R607 VanDerWaalsContact C-NH1 3.26Å; T588-L639 HydrophobicContact CG2-CD2 3.69Å; T588-L645 HydrophobicContact CG2-CD1 4.49Å; T588-L645 HydrophobicContact CG2-CD2 4.1Å; T588-L645 HydrophobicContact CG2-CG 4.32Å
589	F	89.7	Confident	77.5	Confident	28 Å²	28	74.2 Å²	74.2	12%	0.123	37%	0.368	C	S	.	.			trans	-59.5	138.6	-176.1	-173.2	-102.6	0	0	0	112.1	P552 L555 K585 A586 V587 I591 V603 V606 R607	P552-F589 HydrophobicContact CB-CE1 4.05Å; L555-F589 HydrophobicContact CD2-CD1 4.41Å; L555-F589 HydrophobicContact CD2-CD2 3.44Å; L555-F589 VanDerWaalsContact CD2-CD2 3.44Å; L555-F589 HydrophobicContact CD2-CE2 3.58Å; L555-F589 HydrophobicContact CD2-CG 3.89Å; L555-F589 HydrophobicContact CD2-CZ 4.14Å; K585-F589 PolarHBondContact O-N 3.42Å; A586-F589 WeakPolarHBondContact O-CB 3.38Å; A586-F589 PolarHBondContact O-N 2.94Å; A586-F589 VanDerWaalsContact O-N 3.12Å; V587-F589 VanDerWaalsContact C-N 3.34Å; F589-I591 HydrophobicContact CE1-CG1 4.04Å; F589-I591 HydrophobicContact CZ-CG1 4.4Å; F589-V603 HydrophobicContact CD1-CG1 4.27Å; F589-V603 HydrophobicContact CD1-CG2 4.39Å; F589-V603 HydrophobicContact CE1-CG2 4.26Å; F589-V606 HydrophobicContact CD1-CG1 4.41Å; F589-R607 HydrophobicContact CB-CG 4.28Å; F589-R607 WeakPolarHBondContact O-CD 3.15Å; F589-R607 PolarHBondContact O-NH1 2.96Å
590	H	82.1	Confident	76.7	Confident	121 Å²	121	75 Å²	75	56%	0.56	37%	0.374	S	S	*	.			trans	-149.4	159	176.4	60.3	-77.4	0	0	0	109.4	T588 D592	T588-H590 PolarHBondContact O-N 3.48Å; T588-H590 PolarHBondContact O-ND1 2.99Å; H590-D592 IonicContact CD2-OD1 3.81Å; H590-D592 IonicContact NE2-OD1 2.72Å
591	I	77.4	Confident	76.1	Confident	48 Å²	48	79.5 Å²	79.5	25%	0.246	39%	0.391	C	S	.	.			trans	-109.8	130.9	174.2	-59.5	173	0	0	0	106	L498 P552 F589 L593 V603	L498-I591 HydrophobicContact CD1-CD1 4.25Å; P552-I591 HydrophobicContact CG-CD1 4.26Å; F589-I591 HydrophobicContact CE1-CG1 4.04Å; F589-I591 HydrophobicContact CZ-CG1 4.4Å; I591-L593 HydrophobicContact CG2-CD1 4.11Å; I591-L593 HydrophobicContact CG2-CG 4.23Å; I591-L593 PolarHBondContact O-N 3.46Å; I591-V603 HydrophobicContact CD1-CG2 3.43Å; I591-V603 VanDerWaalsContact CD1-CG2 3.43Å; I591-V603 HydrophobicContact CG1-CG2 3.71Å
592	D	59.2	Low	75.6	Confident	134 Å²	134	71.7 Å²	71.7	72%	0.717	36%	0.36	S	S	*	.			trans	-69.6	38.6	-174.3	-68	-38	0	0	0	114.6	H590	H590-D592 IonicContact CD2-OD1 3.81Å; H590-D592 IonicContact NE2-OD1 2.72Å
593	L	54.2	Low	75.2	Confident	109 Å²	109	70.9 Å²	70.9	57%	0.571	36%	0.357	S	S	*	.	S	Bend	trans	-82.4	129.5	167.1	-71.5	161.6	0	0	0	107.4	I591 N595	I591-L593 HydrophobicContact CG2-CD1 4.11Å; I591-L593 HydrophobicContact CG2-CG 4.23Å; I591-L593 PolarHBondContact O-N 3.46Å; L593-N595 PolarHBondContact O-N 3.44Å
594	E	44.3	Very low	74.8	Confident	166 Å²	166	74.6 Å²	74.6	78%	0.776	37%	0.373	S	S	*	.			trans	-28.4	129.3	-175.1	-61.3	-177.2	162.7	0	0	113.1	K596 A597	E594-K596 PolarHBondContact O-N 3Å; E594-A597 PolarHBondContact O-N 3.28Å
595	N	44.1	Very low	74.6	Confident	180 Å²	180	76.7 Å²	76.7	96%	0.963	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.4	15.2	-173.2	-77.8	-34.2	0	0	0	118	L593	L593-N595 PolarHBondContact O-N 3.44Å
596	K	47.8	Very low	74.6	Confident	196 Å²	196	72.2 Å²	72.2	85%	0.852	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.8	-13.1	-176.1	-64.9	-178.3	177.9	178	0	114.6	E594	E594-K596 PolarHBondContact O-N 3Å
597	A	57	Low	74.5	Confident	72 Å²	72	72.3 Å²	72.3	60%	0.595	37%	0.365	S	S	*	.	S	Bend	trans	-96.8	142.7	-179.7	0	0	0	0	0	113.2	E594	E594-A597 PolarHBondContact O-N 3.28Å
598	P	64.8	Low	74.5	Confident	84 Å²	84	79.7 Å²	79.7	55%	0.545	39%	0.393	S	S	.	.	P	Polyproline II helix	trans	-67.5	142.6	175.1	27.6	-32	0	0	0	111.3	S600 A833	P598-S600 PolarHBondContact O-N 3.12Å; P598-A833 HydrophobicContact CG-CB 4.08Å
599	R	74.9	Confident	74.7	Confident	89 Å²	89	79.7 Å²	79.7	34%	0.336	39%	0.391	S	S	.	.	P	Polyproline II helix	trans	-56.1	132.9	-177	-59.1	177	-166.9	154	3.4	111.6	K604 L645	R599-K604 HydrophobicContact CB-CG 4.31Å; R599-K604 WeakPolarHBondContact O-CE 3.34Å; R599-L645 PolarHBondContact NH2-O 3.47Å
600	S	77.6	Confident	75	Confident	16 Å²	16	78.4 Å²	78.4	11%	0.112	39%	0.385	C	S	.	.	P	Polyproline II helix	trans	-62.8	161.8	175.3	71.9	0	0	0	0	112.5	P598 A602 V603 K604	P598-S600 PolarHBondContact O-N 3.12Å; S600-A602 VanDerWaalsContact C-N 3.26Å; S600-A602 PolarHBondContact O-N 2.75Å; S600-V603 PolarHBondContact O-N 3.43Å; S600-V603 WeakPolarHBondContact OG-CG2 3.39Å; S600-V603 PolarHBondContact OG-N 2.92Å; S600-K604 PolarHBondContact O-N 2.92Å
601	R	80	Confident	75.6	Confident	95 Å²	95	72.6 Å²	72.6	36%	0.358	36%	0.358	S	S	.	.	H	α-helix	trans	-62.7	-35.6	176.9	-168.9	175.9	-178.9	-179.4	0.2	111.4	V603 K604 N605 I830 V835	R601-V603 PolarHBondContact O-N 3.42Å; R601-K604 PolarHBondContact O-N 3.45Å; R601-N605 WeakPolarHBondContact O-CB 3.24Å; R601-N605 PolarHBondContact O-N 3.38Å; R601-N605 PolarHBondContact O-OD1 2.86Å; R601-I830 HydrophobicContact CB-CG2 4.05Å; R601-I830 WeakPolarHBondContact CB-O 3.25Å; R601-I830 HydrophobicContact CG-CG2 4.46Å; R601-I830 PolarHBondContact N-O 3.31Å; R601-V835 HydrophobicContact CB-CG2 4.02Å; R601-V835 HydrophobicContact CG-CG2 4.26Å
602	A	83	Confident	76.5	Confident	1 Å²	1	73.8 Å²	73.8	1%	0.008	37%	0.37	C	S	.	.	H	α-helix	trans	-61.3	-48	-179	0	0	0	0	0	111	P552 L553 S600 K604 N605 V606 I830 Y831	P552-A602 HydrophobicContact CB-CB 3.82Å; P552-A602 HydrophobicContact CG-CB 3.45Å; P552-A602 VanDerWaalsContact CG-CB 3.45Å; L553-A602 HydrophobicContact CD2-CB 4.47Å; S600-A602 VanDerWaalsContact C-N 3.26Å; S600-A602 PolarHBondContact O-N 2.75Å; A602-K604 PolarHBondContact O-N 3.42Å; A602-N605 WeakPolarHBondContact O-CB 3.41Å; A602-N605 PolarHBondContact O-N 2.98Å; A602-V606 WeakPolarHBondContact O-CG2 3.43Å; A602-V606 PolarHBondContact O-N 3.27Å; A602-I830 VanDerWaalsContact CA-CG2 3.49Å; A602-I830 HydrophobicContact CB-CB 4.48Å; A602-I830 HydrophobicContact CB-CG2 3.48Å; A602-I830 VanDerWaalsContact CB-CG2 3.48Å; A602-I830 VanDerWaalsContact N-CG2 3.32Å; A602-I830 PolarHBondContact N-O 2.89Å; A602-Y831 HydrophobicContact CB-CD1 4.41Å; A602-Y831 HydrophobicContact CB-CE1 3.96Å
603	V	86.7	Confident	78.2	Confident	5 Å²	5	67.5 Å²	67.5	3%	0.03	34%	0.337	C	S	.	.	H	α-helix	trans	-62.7	-44.2	179	172.2	0	0	0	0	110.9	F589 I591 S600 R601 N605 V606 R607	F589-V603 HydrophobicContact CD1-CG1 4.27Å; F589-V603 HydrophobicContact CD1-CG2 4.39Å; F589-V603 HydrophobicContact CE1-CG2 4.26Å; I591-V603 HydrophobicContact CD1-CG2 3.43Å; I591-V603 VanDerWaalsContact CD1-CG2 3.43Å; I591-V603 HydrophobicContact CG1-CG2 3.71Å; S600-V603 PolarHBondContact O-N 3.43Å; S600-V603 WeakPolarHBondContact OG-CG2 3.39Å; S600-V603 PolarHBondContact OG-N 2.92Å; R601-V603 PolarHBondContact O-N 3.42Å; V603-N605 VanDerWaalsContact C-N 3.32Å; V603-N605 PolarHBondContact O-N 3.39Å; V603-V606 PolarHBondContact O-N 3.42Å; V603-R607 VanDerWaalsContact O-CG 3.29Å; V603-R607 WeakPolarHBondContact O-CG 3.41Å; V603-R607 PolarHBondContact O-N 2.8Å; V603-R607 VanDerWaalsContact O-N 3.09Å
604	K	86	Confident	80.1	Confident	78 Å²	78	62.3 Å²	62.3	34%	0.339	31%	0.31	S	S	.	.	H	α-helix	trans	-62.8	-39.9	176.4	-66.2	-171.8	-161.4	173.6	0	112	R599 S600 R601 A602 R607 R608 V835	R599-K604 HydrophobicContact CB-CG 4.31Å; R599-K604 WeakPolarHBondContact O-CE 3.34Å; S600-K604 PolarHBondContact O-N 2.92Å; R601-K604 PolarHBondContact O-N 3.45Å; A602-K604 PolarHBondContact O-N 3.42Å; K604-R607 PolarHBondContact O-N 3.05Å; K604-R608 VanDerWaalsContact O-CB 3.3Å; K604-R608 WeakPolarHBondContact O-CB 3.38Å; K604-R608 PolarHBondContact O-N 3.25Å; K604-V835 HydrophobicContact CD-CG2 3.87Å
605	N	88.6	Confident	82.5	Confident	53 Å²	53	55.3 Å²	55.3	28%	0.283	28%	0.278	S	S	.	.	H	α-helix	trans	-61.7	-44.6	177.6	-73.8	-11.6	0	0	0	111.7	R601 A602 V603 R608 H609	R601-N605 WeakPolarHBondContact O-CB 3.24Å; R601-N605 PolarHBondContact O-N 3.38Å; R601-N605 PolarHBondContact O-OD1 2.86Å; A602-N605 WeakPolarHBondContact O-CB 3.41Å; A602-N605 PolarHBondContact O-N 2.98Å; V603-N605 VanDerWaalsContact C-N 3.32Å; V603-N605 PolarHBondContact O-N 3.39Å; N605-R608 PolarHBondContact O-N 3.49Å; N605-H609 VanDerWaalsContact O-CB 3.3Å; N605-H609 WeakPolarHBondContact O-CB 3.41Å; N605-H609 PolarHBondContact O-N 3.44Å
606	V	92.6	Very high	84.9	Confident	2 Å²	2	51.3 Å²	51.3	1%	0.012	25%	0.252	C	S	.	.	H	α-helix	trans	-62.2	-47	177	172.2	0	0	0	0	112.1	P552 L555 L559 F589 A602 V603 R608 H609 A610	P552-V606 HydrophobicContact CB-CG2 3.62Å; P552-V606 WeakPolarHBondContact O-CG2 3.44Å; L555-V606 HydrophobicContact CB-CG1 4.4Å; L555-V606 HydrophobicContact CD2-CG1 3.73Å; L555-V606 HydrophobicContact CG-CG1 3.89Å; L559-V606 HydrophobicContact CD1-CG1 4.03Å; F589-V606 HydrophobicContact CD1-CG1 4.41Å; A602-V606 WeakPolarHBondContact O-CG2 3.43Å; A602-V606 PolarHBondContact O-N 3.27Å; V603-V606 PolarHBondContact O-N 3.42Å; V606-R608 VanDerWaalsContact C-N 3.32Å; V606-R608 PolarHBondContact O-N 3.29Å; V606-H609 WeakPolarHBondContact O-CB 3.45Å; V606-H609 PolarHBondContact O-N 3.38Å; V606-H609 VanDerWaalsContact O-N 3.17Å; V606-A610 PolarHBondContact O-N 2.91Å
607	R	92.9	Very high	87.2	Confident	5 Å²	5	42.2 Å²	42.2	2%	0.019	21%	0.212	C	C	.	.	H	α-helix	trans	-63	-41.9	179.9	-65.4	167.1	64.4	97.8	4.5	111	V587 T588 F589 V603 K604 A610 C611 L645 E650	V587-R607 WeakPolarHBondContact O-CG 3.36Å; V587-R607 PolarHBondContact O-NE 2.89Å; V587-R607 PolarHBondContact O-NH1 3.33Å; V587-R607 VanDerWaalsContact O-NH1 3.09Å; V587-R607 PolarHBondContact O-NH2 2.99Å; V587-R607 VanDerWaalsContact O-NH2 3.15Å; T588-R607 VanDerWaalsContact C-NH1 3.26Å; F589-R607 HydrophobicContact CB-CG 4.28Å; F589-R607 WeakPolarHBondContact O-CD 3.15Å; F589-R607 PolarHBondContact O-NH1 2.96Å; V603-R607 VanDerWaalsContact O-CG 3.29Å; V603-R607 WeakPolarHBondContact O-CG 3.41Å; V603-R607 PolarHBondContact O-N 2.8Å; V603-R607 VanDerWaalsContact O-N 3.09Å; K604-R607 PolarHBondContact O-N 3.05Å; R607-A610 PolarHBondContact O-N 3.23Å; R607-C611 PolarHBondContact O-N 3.2Å; R607-C611 PolarHBondContact O-SG 2.67Å; R607-C611 VanDerWaalsContact O-SG 3.4Å; R607-L645 PolarHBondContact NH2-O 3.46Å; R607-E650 WeakPolarHBondContact CB-OE1 3.49Å; R607-E650 IonicContact CZ-OE1 2.7Å; R607-E650 IonicContact CZ-OE2 2.86Å; R607-E650 IonicContact NE-OE1 3.41Å; R607-E650 PolarHBondContact NE-OE1 3.03Å; R607-E650 IonicContact NE-OE2 3.76Å; R607-E650 IonicContact NH2-OE1 3.46Å; R607-E650 IonicContact NH2-OE2 3.28Å; R607-E650 PolarHBondContact NH2-OE2 3.18Å
608	R	91.9	Very high	88.9	Confident	154 Å²	154	38.8 Å²	38.8	58%	0.581	18%	0.184	S	C	*	.	H	α-helix	trans	-62.5	-41.8	173	-175.4	175.7	66.1	175.5	2.6	111.9	K604 N605 V606 C611 S612	K604-R608 VanDerWaalsContact O-CB 3.3Å; K604-R608 WeakPolarHBondContact O-CB 3.38Å; K604-R608 PolarHBondContact O-N 3.25Å; N605-R608 PolarHBondContact O-N 3.49Å; V606-R608 VanDerWaalsContact C-N 3.32Å; V606-R608 PolarHBondContact O-N 3.29Å; R608-C611 WeakPolarHBondContact O-CB 3.3Å; R608-C611 PolarHBondContact O-N 2.96Å; R608-S612 WeakPolarHBondContact O-CB 3.37Å; R608-S612 PolarHBondContact O-N 3.47Å
609	H	94.6	Very high	90.3	Very high	38 Å²	38	38.4 Å²	38.4	18%	0.176	17%	0.172	C	C	.	.	H	α-helix	trans	-61.9	-46.9	175.8	-174.5	178.5	0	0	0	110.7	S556 S560 N605 V606 C611 S612 A613	S556-H609 PolarHBondContact O-CE1 2.93Å; S556-H609 PolarHBondContact O-ND1 2.77Å; S556-H609 PolarHBondContact OG-ND1 3.06Å; S560-H609 PolarHBondContact OG-CE1 2.84Å; S560-H609 PolarHBondContact OG-NE2 3.16Å; N605-H609 VanDerWaalsContact O-CB 3.3Å; N605-H609 WeakPolarHBondContact O-CB 3.41Å; N605-H609 PolarHBondContact O-N 3.44Å; V606-H609 WeakPolarHBondContact O-CB 3.45Å; V606-H609 PolarHBondContact O-N 3.38Å; V606-H609 VanDerWaalsContact O-N 3.17Å; H609-C611 PolarHBondContact O-N 3.15Å; H609-S612 WeakPolarHBondContact O-CB 3.45Å; H609-S612 PolarHBondContact O-N 2.92Å; H609-S612 VanDerWaalsContact O-N 3.12Å; H609-A613 WeakPolarHBondContact O-CB 3.17Å; H609-A613 PolarHBondContact O-N 3.44Å
610	A	95.8	Very high	91.1	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-58.3	-45.6	175.7	0	0	0	0	0	112.2	L559 A586 V587 V606 R607 S612 A613 I614	L559-A610 HydrophobicContact CD1-CB 4.04Å; A586-A610 HydrophobicContact CB-CB 3.74Å; V587-A610 HydrophobicContact CG2-CB 3.76Å; V606-A610 PolarHBondContact O-N 2.91Å; R607-A610 PolarHBondContact O-N 3.23Å; A610-S612 PolarHBondContact O-N 3.2Å; A610-A613 PolarHBondContact O-N 3.39Å; A610-I614 WeakPolarHBondContact O-CG1 3.44Å; A610-I614 PolarHBondContact O-N 2.95Å
611	C	94.9	Very high	91.9	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-57.3	-46	173.1	-74.5	0	0	0	0	112.3	R607 R608 H609 I614 I615 Q654	R607-C611 PolarHBondContact O-N 3.2Å; R607-C611 PolarHBondContact O-SG 2.67Å; R607-C611 VanDerWaalsContact O-SG 3.4Å; R608-C611 WeakPolarHBondContact O-CB 3.3Å; R608-C611 PolarHBondContact O-N 2.96Å; H609-C611 PolarHBondContact O-N 3.15Å; C611-I614 PolarHBondContact O-N 3.46Å; C611-I615 WeakPolarHBondContact O-CG1 3.37Å; C611-I615 PolarHBondContact O-N 3.38Å; C611-Q654 PolarHBondContact SG-NE2 2.89Å; C611-Q654 VanDerWaalsContact SG-NE2 3.43Å
612	S	95.1	Very high	92.4	Very high	72 Å²	72	34.3 Å²	34.3	50%	0.503	16%	0.159	S	C	.	.	H	α-helix	trans	-63.9	-41.2	178.2	-177.8	0	0	0	0	112.4	R608 H609 A610 I614 I615 K616	R608-S612 WeakPolarHBondContact O-CB 3.37Å; R608-S612 PolarHBondContact O-N 3.47Å; H609-S612 WeakPolarHBondContact O-CB 3.45Å; H609-S612 PolarHBondContact O-N 2.92Å; H609-S612 VanDerWaalsContact O-N 3.12Å; A610-S612 PolarHBondContact O-N 3.2Å; S612-I614 PolarHBondContact O-N 3.29Å; S612-I615 PolarHBondContact O-N 3.4Å; S612-K616 WeakPolarHBondContact O-CB 3.27Å; S612-K616 PolarHBondContact O-N 3.19Å
613	A	94.8	Very high	92.8	Very high	3 Å²	3	39 Å²	39	3%	0.025	18%	0.181	C	C	.	.	H	α-helix	trans	-62.4	-42	175.6	0	0	0	0	0	111.8	L583 H609 A610 K616 I617	L583-A613 HydrophobicContact CD2-CB 4.12Å; H609-A613 WeakPolarHBondContact O-CB 3.17Å; H609-A613 PolarHBondContact O-N 3.44Å; A610-A613 PolarHBondContact O-N 3.39Å; A613-K616 PolarHBondContact O-N 2.91Å; A613-I617 WeakPolarHBondContact O-CB 3.43Å; A613-I617 WeakPolarHBondContact O-CG1 3.5Å; A613-I617 PolarHBondContact O-N 3.4Å
614	I	95.6	Very high	93	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-60.7	-48.5	174.1	-68.9	168	0	0	0	110.6	L583 F584 V587 A610 C611 S612 K616 I617 C618 F632 A657	L583-I614 HydrophobicContact CB-CD1 3.98Å; L583-I614 HydrophobicContact CB-CG1 3.76Å; L583-I614 HydrophobicContact CD1-CG1 3.83Å; L583-I614 HydrophobicContact CG-CG1 4.4Å; F584-I614 HydrophobicContact CD1-CD1 4.1Å; F584-I614 HydrophobicContact CE1-CD1 4.11Å; V587-I614 HydrophobicContact CG2-CD1 3.75Å; A610-I614 WeakPolarHBondContact O-CG1 3.44Å; A610-I614 PolarHBondContact O-N 2.95Å; C611-I614 PolarHBondContact O-N 3.46Å; S612-I614 PolarHBondContact O-N 3.29Å; I614-K616 VanDerWaalsContact C-N 3.34Å; I614-K616 PolarHBondContact O-N 2.92Å; I614-I617 PolarHBondContact O-N 2.84Å; I614-C618 WeakPolarHBondContact O-CB 3.42Å; I614-C618 PolarHBondContact O-N 2.74Å; I614-C618 PolarHBondContact O-SG 3.12Å; I614-F632 HydrophobicContact CG2-CE2 3.88Å; I614-F632 HydrophobicContact CG2-CZ 3.6Å; I614-A657 HydrophobicContact CG2-CB 3.81Å
615	I	94.9	Very high	93.3	Very high	18 Å²	18	37.9 Å²	37.9	9%	0.092	18%	0.176	C	C	.	.	H	α-helix	trans	-58.7	-46.5	177.5	-70.3	165.7	0	0	0	110.7	C611 S612 I617 C618 R619 E656 A657 L660	C611-I615 WeakPolarHBondContact O-CG1 3.37Å; C611-I615 PolarHBondContact O-N 3.38Å; S612-I615 PolarHBondContact O-N 3.4Å; I615-I617 PolarHBondContact O-N 3.31Å; I615-C618 CarbonylContact O-C 3.56Å; I615-C618 PolarHBondContact O-N 3.45Å; I615-R619 WeakPolarHBondContact O-CB 3.49Å; I615-R619 PolarHBondContact O-N 3.01Å; I615-E656 HydrophobicContact CD1-CB 4.24Å; I615-E656 HydrophobicContact CD1-CG 4.39Å; I615-E656 HydrophobicContact CG1-CB 4.41Å; I615-A657 HydrophobicContact CG1-CB 4.32Å; I615-L660 HydrophobicContact CG2-CD1 3.81Å
616	K	94.6	Very high	93.5	Very high	97 Å²	97	38.1 Å²	38.1	42%	0.422	18%	0.177	S	C	.	.	H	α-helix	trans	-59	-47.5	178.8	-175.9	178.5	-179.3	179.7	0	111.5	S612 A613 I614 C618 R619 D620	S612-K616 WeakPolarHBondContact O-CB 3.27Å; S612-K616 PolarHBondContact O-N 3.19Å; A613-K616 PolarHBondContact O-N 2.91Å; I614-K616 VanDerWaalsContact C-N 3.34Å; I614-K616 PolarHBondContact O-N 2.92Å; K616-C618 PolarHBondContact O-N 3.01Å; K616-R619 PolarHBondContact O-N 3.38Å; K616-D620 VanDerWaalsContact CG-OD2 3.32Å; K616-D620 WeakPolarHBondContact CG-OD2 3.48Å; K616-D620 WeakPolarHBondContact O-CB 3.34Å; K616-D620 VanDerWaalsContact O-CG 3.23Å; K616-D620 PolarHBondContact O-N 3.15Å
617	I	94.1	Very high	93.5	Very high	4 Å²	4	43.1 Å²	43.1	2%	0.021	21%	0.209	C	C	.	.	H	α-helix	trans	-62	-44.2	177	-72.7	165.1	0	0	0	111.3	F566 V579 L583 A613 I614 I615 R619 Y621 I625	F566-I617 HydrophobicContact CD1-CG1 4.07Å; F566-I617 HydrophobicContact CD1-CG2 4.47Å; F566-I617 HydrophobicContact CD2-CD1 3.61Å; F566-I617 HydrophobicContact CD2-CG1 3.88Å; F566-I617 HydrophobicContact CD2-CG2 4.47Å; F566-I617 HydrophobicContact CE1-CB 4.48Å; F566-I617 HydrophobicContact CE1-CG1 4.2Å; F566-I617 HydrophobicContact CE1-CG2 3.76Å; F566-I617 HydrophobicContact CE2-CD1 3.77Å; F566-I617 HydrophobicContact CE2-CG1 3.99Å; F566-I617 HydrophobicContact CE2-CG2 3.74Å; F566-I617 HydrophobicContact CG-CD1 4.1Å; F566-I617 HydrophobicContact CG-CG1 3.92Å; F566-I617 HydrophobicContact CZ-CB 4.34Å; F566-I617 HydrophobicContact CZ-CD1 4.4Å; F566-I617 HydrophobicContact CZ-CG1 4.16Å; F566-I617 HydrophobicContact CZ-CG2 3.33Å; V579-I617 HydrophobicContact CG1-CD1 4.27Å; L583-I617 HydrophobicContact CD1-CD1 3.54Å; A613-I617 WeakPolarHBondContact O-CB 3.43Å; A613-I617 WeakPolarHBondContact O-CG1 3.5Å; A613-I617 PolarHBondContact O-N 3.4Å; I614-I617 PolarHBondContact O-N 2.84Å; I615-I617 PolarHBondContact O-N 3.31Å; I617-R619 VanDerWaalsContact C-N 3.28Å; I617-R619 PolarHBondContact O-N 3.22Å; I617-Y621 PolarHBondContact O-N 3.16Å; I617-I625 HydrophobicContact CG2-CD1 3.64Å; I617-I625 HydrophobicContact CG2-CG1 3.96Å
618	C	94	Very high	93.3	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-69.1	-24.4	178.7	-63.9	0	0	0	0	112.9	I614 I615 K616 P622 A657 L660 I661	I614-C618 WeakPolarHBondContact O-CB 3.42Å; I614-C618 PolarHBondContact O-N 2.74Å; I614-C618 PolarHBondContact O-SG 3.12Å; I615-C618 CarbonylContact O-C 3.56Å; I615-C618 PolarHBondContact O-N 3.45Å; K616-C618 PolarHBondContact O-N 3.01Å; C618-P622 VanDerWaalsContact O-CB 3.32Å; C618-P622 WeakPolarHBondContact O-CB 3.27Å; C618-A657 HydrophobicContact CB-CB 4.35Å; C618-L660 HydrophobicContact CB-CB 4.16Å; C618-L660 HydrophobicContact CB-CD1 4.45Å; C618-I661 HydrophobicContact CB-CD1 4.5Å; C618-I661 HydrophobicContact CB-CG1 3.99Å
619	R	93.8	Very high	93.3	Very high	76 Å²	76	37.7 Å²	37.7	29%	0.287	19%	0.193	S	C	.	.	H	α-helix	trans	-81.8	-49.3	174.7	-176.4	-170.5	63.7	-165.4	-4.9	111.5	I615 K616 I617 P622 L660	I615-R619 WeakPolarHBondContact O-CB 3.49Å; I615-R619 PolarHBondContact O-N 3.01Å; K616-R619 PolarHBondContact O-N 3.38Å; I617-R619 VanDerWaalsContact C-N 3.28Å; I617-R619 PolarHBondContact O-N 3.22Å; R619-P622 WeakPolarHBondContact O-CD 3.35Å; R619-L660 HydrophobicContact CB-CD1 4Å; R619-L660 HydrophobicContact CB-CD2 4.23Å; R619-L660 HydrophobicContact CG-CD2 4.29Å
620	D	92.4	Very high	93.1	Very high	53 Å²	53	41.4 Å²	41.4	28%	0.283	21%	0.214	S	C	.	.	H	α-helix	trans	-83.1	-26.7	-168.6	-59.6	-6.2	0	0	0	112.2	K616 P622	K616-D620 VanDerWaalsContact CG-OD2 3.32Å; K616-D620 WeakPolarHBondContact CG-OD2 3.48Å; K616-D620 WeakPolarHBondContact O-CB 3.34Å; K616-D620 VanDerWaalsContact O-CG 3.23Å; K616-D620 PolarHBondContact O-N 3.15Å; D620-P622 VanDerWaalsContact C-CD 3.48Å
621	Y	93	Very high	92.8	Very high	54 Å²	54	45.8 Å²	45.8	21%	0.212	24%	0.236	C	C	.	.			trans	-132.8	41.7	-174.5	-56.1	-79.2	0	0	0	115	F566 P567 T570 I617 Q623 F624	F566-Y621 AromaticContact CD1-CD2 3.4Å; F566-Y621 HydrophobicContact CD1-CD2 3.4Å; F566-Y621 AromaticContact CD1-CE2 3.62Å; F566-Y621 HydrophobicContact CD1-CE2 3.62Å; F566-Y621 AromaticContact CD1-CG 3.99Å; F566-Y621 HydrophobicContact CD1-CG 3.99Å; F566-Y621 HydrophobicContact CE1-CD1 4.39Å; F566-Y621 AromaticContact CE1-CD2 3.36Å; F566-Y621 HydrophobicContact CE1-CD2 3.36Å; F566-Y621 HydrophobicContact CE1-CE2 4.07Å; F566-Y621 AromaticContact CE1-CG 3.57Å; F566-Y621 HydrophobicContact CE1-CG 3.57Å; P567-Y621 WeakPolarHBondContact CB-OH 3.43Å; P567-Y621 VanDerWaalsContact CG-OH 3.3Å; P567-Y621 WeakPolarHBondContact CG-OH 2.87Å; T570-Y621 HydrophobicContact CG2-CD1 3.5Å; T570-Y621 HydrophobicContact CG2-CE1 3.71Å; T570-Y621 HydrophobicContact CG2-CG 4.46Å; I617-Y621 PolarHBondContact O-N 3.16Å; Y621-Q623 VanDerWaalsContact C-N 3.28Å; Y621-Q623 PolarHBondContact O-N 3.47Å; Y621-F624 HydrophobicContact CD1-CD2 4.44Å; Y621-F624 PolarHBondContact O-N 2.59Å; Y621-F624 VanDerWaalsContact O-N 3.1Å
622	P	91.7	Very high	92.7	Very high	8 Å²	8	45.8 Å²	45.8	5%	0.052	24%	0.236	C	C	.	.	H	α-helix	trans	-66.6	-28	-166.6	32.2	-40.7	0	0	0	113.7	C618 R619 D620 F624 I625 L626 Q664	C618-P622 VanDerWaalsContact O-CB 3.32Å; C618-P622 WeakPolarHBondContact O-CB 3.27Å; R619-P622 WeakPolarHBondContact O-CD 3.35Å; D620-P622 VanDerWaalsContact C-CD 3.48Å; P622-F624 PolarHBondContact O-N 3.07Å; P622-I625 PolarHBondContact O-N 3.09Å; P622-I625 VanDerWaalsContact O-N 3.15Å; P622-L626 PolarHBondContact O-N 3.31Å; P622-Q664 HydrophobicContact CB-CG 3.33Å; P622-Q664 HydrophobicContact CG-CG 3.52Å; P622-Q664 VanDerWaalsContact CG-NE2 3.25Å
623	Q	91.1	Very high	92.6	Very high	100 Å²	100	43.5 Å²	43.5	47%	0.467	22%	0.216	S	C	.	.	H	α-helix	trans	-62.1	-29.3	175.9	65.8	-81.1	12.2	0	0	113.5	Y621 P627	Y621-Q623 VanDerWaalsContact C-N 3.28Å; Y621-Q623 PolarHBondContact O-N 3.47Å; Q623-P627 WeakPolarHBondContact O-CD 3.32Å
624	F	90.6	Very high	92.4	Very high	58 Å²	58	47.5 Å²	47.5	25%	0.254	24%	0.238	S	C	.	.	H	α-helix	trans	-87	-19.4	178.1	-62.8	-75.8	0	0	0	112.4	T570 P573 Y621 P622	T570-F624 HydrophobicContact CG2-CD2 3.81Å; T570-F624 HydrophobicContact CG2-CE2 3.47Å; T570-F624 VanDerWaalsContact CG2-CE2 3.47Å; T570-F624 HydrophobicContact CG2-CZ 3.99Å; T570-F624 WeakPolarHBondContact O-CE1 3.46Å; P573-F624 HydrophobicContact CB-CD1 4.46Å; P573-F624 HydrophobicContact CG-CD1 4Å; P573-F624 HydrophobicContact CG-CE1 4.23Å; Y621-F624 HydrophobicContact CD1-CD2 4.44Å; Y621-F624 PolarHBondContact O-N 2.59Å; Y621-F624 VanDerWaalsContact O-N 3.1Å; P622-F624 PolarHBondContact O-N 3.07Å
625	I	92.8	Very high	92.1	Very high	0 Å²	0	50.4 Å²	50.4	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-88.3	-33.7	178	-55.2	-53.3	0	0	0	111.6	F566 V576 I617 P622 P627 C628 F629 I661	F566-I625 HydrophobicContact CZ-CD1 4.28Å; V576-I625 HydrophobicContact CG1-CD1 3.58Å; I617-I625 HydrophobicContact CG2-CD1 3.64Å; I617-I625 HydrophobicContact CG2-CG1 3.96Å; P622-I625 PolarHBondContact O-N 3.09Å; P622-I625 VanDerWaalsContact O-N 3.15Å; I625-P627 VanDerWaalsContact C-CD 3.4Å; I625-P627 VanDerWaalsContact C-N 3.35Å; I625-C628 CarbonylContact O-C 3.52Å; I625-C628 WeakPolarHBondContact O-CA 3.26Å; I625-C628 PolarHBondContact O-N 3.21Å; I625-F629 PolarHBondContact O-N 3.33Å; I625-I661 HydrophobicContact CG2-CD1 3.62Å; I625-I661 HydrophobicContact CG2-CG1 3.87Å
626	L	92.4	Very high	92	Very high	58 Å²	58	49.7 Å²	49.7	30%	0.304	25%	0.247	S	C	.	.	G	3₁₀ helix	trans	-50.3	-41.6	-178.2	-178.3	65.6	0	0	0	114.6	P622 C628 F629 I661 Q664 F665	P622-L626 PolarHBondContact O-N 3.31Å; L626-C628 PolarHBondContact O-N 2.8Å; L626-C628 VanDerWaalsContact O-N 3.14Å; L626-F629 HydrophobicContact CD1-CB 4.42Å; L626-F629 WeakPolarHBondContact O-CB 3.4Å; L626-F629 PolarHBondContact O-N 3.45Å; L626-I661 HydrophobicContact CD1-CG2 4.18Å; L626-Q664 HydrophobicContact CD2-CB 4.17Å; L626-F665 HydrophobicContact CD1-CD1 3.78Å; L626-F665 HydrophobicContact CD1-CE1 3.64Å
627	P	91.7	Very high	91.7	Very high	107 Å²	107	49.3 Å²	49.3	70%	0.695	25%	0.246	S	C	*	.	G	3₁₀ helix	trans	-61.5	-22.1	176.9	-24.1	35.5	0	0	0	114.3	Q623 I625	Q623-P627 WeakPolarHBondContact O-CD 3.32Å; I625-P627 VanDerWaalsContact C-CD 3.4Å; I625-P627 VanDerWaalsContact C-N 3.35Å
628	C	89.5	Confident	91.4	Very high	28 Å²	28	55.3 Å²	55.3	19%	0.189	27%	0.274	C	S	.	.	G	3₁₀ helix	trans	-102	11.8	177.9	-60.6	0	0	0	0	112.5	I625 L626 D630 M631 F632	I625-C628 CarbonylContact O-C 3.52Å; I625-C628 WeakPolarHBondContact O-CA 3.26Å; I625-C628 PolarHBondContact O-N 3.21Å; L626-C628 PolarHBondContact O-N 2.8Å; L626-C628 VanDerWaalsContact O-N 3.14Å; C628-D630 PolarHBondContact O-N 2.77Å; C628-M631 HydrophobicContact CB-CE 4.09Å; C628-M631 PolarHBondContact O-N 3.04Å; C628-F632 PolarHBondContact O-N 3.25Å
629	F	91.6	Very high	91.2	Very high	17 Å²	17	55.8 Å²	55.8	8%	0.075	28%	0.276	C	S	.	.	H	α-helix	trans	-57.9	-44.7	-173.9	178.7	-102.3	0	0	0	113	I625 L626 M631 F632 Y633 L658 I661 F665 F674	I625-F629 PolarHBondContact O-N 3.33Å; L626-F629 HydrophobicContact CD1-CB 4.42Å; L626-F629 WeakPolarHBondContact O-CB 3.4Å; L626-F629 PolarHBondContact O-N 3.45Å; F629-M631 VanDerWaalsContact C-N 3.34Å; F629-M631 PolarHBondContact O-N 2.79Å; F629-F632 PolarHBondContact O-N 3.2Å; F629-Y633 HydrophobicContact CZ-CG 4.49Å; F629-Y633 VanDerWaalsContact O-CB 3.27Å; F629-Y633 WeakPolarHBondContact O-CB 3.3Å; F629-Y633 PolarHBondContact O-N 2.94Å; F629-L658 HydrophobicContact CE2-CD2 4.01Å; F629-I661 HydrophobicContact CB-CG2 4.4Å; F629-I661 HydrophobicContact CD2-CB 3.98Å; F629-I661 HydrophobicContact CD2-CD1 4.33Å; F629-I661 HydrophobicContact CD2-CG2 3.47Å; F629-I661 VanDerWaalsContact CD2-CG2 3.47Å; F629-I661 HydrophobicContact CE2-CB 4.22Å; F629-I661 HydrophobicContact CE2-CG2 4.15Å; F629-I661 HydrophobicContact CG-CG2 4.31Å; F629-F665 HydrophobicContact CD1-CE1 4.34Å; F629-F665 HydrophobicContact CD1-CZ 4.12Å; F629-F665 HydrophobicContact CE1-CE1 4.36Å; F629-F665 AromaticContact CE1-CZ 3.69Å; F629-F665 HydrophobicContact CE1-CZ 3.69Å; F629-F665 HydrophobicContact CE2-CZ 4.26Å; F629-F665 AromaticContact CZ-CZ 3.74Å; F629-F665 HydrophobicContact CZ-CZ 3.74Å; F629-F674 HydrophobicContact CE1-CE2 4.3Å; F629-F674 HydrophobicContact CE2-CZ 4.31Å; F629-F674 HydrophobicContact CZ-CD2 4.11Å; F629-F674 HydrophobicContact CZ-CE1 4.36Å; F629-F674 AromaticContact CZ-CE2 3.58Å; F629-F674 HydrophobicContact CZ-CE2 3.58Å; F629-F674 AromaticContact CZ-CZ 3.72Å; F629-F674 HydrophobicContact CZ-CZ 3.72Å
630	D	90.4	Very high	90.8	Very high	116 Å²	116	54.8 Å²	54.8	62%	0.62	27%	0.274	S	S	*	.	H	α-helix	trans	-63	-41.3	-179.1	-64.3	-34.5	0	0	0	112	C628 N634	C628-D630 PolarHBondContact O-N 2.77Å; D630-N634 VanDerWaalsContact O-CB 3.31Å; D630-N634 WeakPolarHBondContact O-CB 3.48Å; D630-N634 PolarHBondContact O-N 3.45Å; D630-N634 PolarHBondContact O-ND2 2.96Å
631	M	90.3	Very high	90.4	Very high	92 Å²	92	56.4 Å²	56.4	45%	0.453	30%	0.295	S	S	.	.	H	α-helix	trans	-62.2	-47.6	174.5	179.2	-163.8	76.2	0	0	110.8	P577 L580 C628 F629 H635	P577-M631 HydrophobicContact CB-CE 4.42Å; L580-M631 HydrophobicContact CD1-CE 4.1Å; C628-M631 HydrophobicContact CB-CE 4.09Å; C628-M631 PolarHBondContact O-N 3.04Å; F629-M631 VanDerWaalsContact C-N 3.34Å; F629-M631 PolarHBondContact O-N 2.79Å; M631-H635 WeakPolarHBondContact O-CB 3.46Å; M631-H635 PolarHBondContact O-N 3.24Å; M631-H635 VanDerWaalsContact O-N 3.08Å
632	F	91.8	Very high	89.9	Confident	0 Å²	0	57.9 Å²	57.9	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-60.8	-47.9	179	-169.5	-70.4	0	0	0	110.9	L580 F584 I614 C628 F629 H635 V636 A657 L658 I661	L580-F632 HydrophobicContact CD1-CD2 4.11Å; L580-F632 HydrophobicContact CD2-CD2 4.17Å; L580-F632 HydrophobicContact CD2-CE2 3.99Å; F584-F632 HydrophobicContact CE1-CZ 4.33Å; F584-F632 AromaticContact CE2-CD2 3.83Å; F584-F632 HydrophobicContact CE2-CD2 3.83Å; F584-F632 AromaticContact CE2-CE2 3.86Å; F584-F632 HydrophobicContact CE2-CE2 3.86Å; F584-F632 HydrophobicContact CE2-CG 4.38Å; F584-F632 HydrophobicContact CE2-CZ 4.43Å; F584-F632 HydrophobicContact CZ-CD1 4.17Å; F584-F632 AromaticContact CZ-CD2 3.71Å; F584-F632 HydrophobicContact CZ-CD2 3.71Å; F584-F632 AromaticContact CZ-CE1 3.94Å; F584-F632 HydrophobicContact CZ-CE1 3.94Å; F584-F632 AromaticContact CZ-CE2 3.46Å; F584-F632 HydrophobicContact CZ-CE2 3.46Å; F584-F632 VanDerWaalsContact CZ-CE2 3.46Å; F584-F632 HydrophobicContact CZ-CG 4.06Å; F584-F632 AromaticContact CZ-CZ 3.58Å; F584-F632 HydrophobicContact CZ-CZ 3.58Å; I614-F632 HydrophobicContact CG2-CE2 3.88Å; I614-F632 HydrophobicContact CG2-CZ 3.6Å; C628-F632 PolarHBondContact O-N 3.25Å; F629-F632 PolarHBondContact O-N 3.2Å; F632-H635 PolarHBondContact O-N 2.84Å; F632-V636 HydrophobicContact CD1-CG2 3.88Å; F632-V636 HydrophobicContact CE1-CG2 3.66Å; F632-V636 WeakPolarHBondContact O-CG2 3.33Å; F632-V636 PolarHBondContact O-N 3.26Å; F632-A657 HydrophobicContact CE1-CB 4.4Å; F632-A657 HydrophobicContact CZ-CB 4.01Å; F632-L658 HydrophobicContact CD1-CD2 3.61Å; F632-L658 HydrophobicContact CD1-CG 4.41Å; F632-L658 HydrophobicContact CE1-CD2 3.84Å; F632-L658 HydrophobicContact CE1-CG 4.17Å; F632-I661 HydrophobicContact CD1-CD1 4.2Å; F632-I661 HydrophobicContact CD2-CD1 4.35Å; F632-I661 HydrophobicContact CE1-CD1 4.26Å; F632-I661 HydrophobicContact CE2-CD1 4.4Å; F632-I661 HydrophobicContact CG-CD1 4.26Å; F632-I661 HydrophobicContact CZ-CD1 4.36Å
633	Y	92.8	Very high	88.8	Confident	24 Å²	24	65.4 Å²	65.4	9%	0.094	34%	0.341	C	S	.	.	H	α-helix	trans	-66	-43.2	-176.9	-176.4	-132.7	0	0	0	112.4	F629 H635 V636 K637 L658 F674 E677	F629-Y633 HydrophobicContact CZ-CG 4.49Å; F629-Y633 VanDerWaalsContact O-CB 3.27Å; F629-Y633 WeakPolarHBondContact O-CB 3.3Å; F629-Y633 PolarHBondContact O-N 2.94Å; Y633-H635 VanDerWaalsContact C-N 3.31Å; Y633-H635 PolarHBondContact O-N 3.45Å; Y633-V636 PolarHBondContact O-N 2.91Å; Y633-K637 HydrophobicContact CD1-CD 4.42Å; Y633-K637 HydrophobicContact CE1-CD 4.07Å; Y633-K637 VanDerWaalsContact CE1-CE 3.45Å; Y633-K637 HydrophobicContact CE2-CD 4.43Å; Y633-K637 HydrophobicContact CE2-CG 4.37Å; Y633-K637 VanDerWaalsContact CZ-NZ 3.31Å; Y633-K637 PolarHBondContact O-N 2.93Å; Y633-K637 WeakPolarHBondContact OH-CE 3.39Å; Y633-K637 PolarHBondContact OH-NZ 3.07Å; Y633-K637 VanDerWaalsContact OH-NZ 3.1Å; Y633-L658 HydrophobicContact CD2-CD1 3.78Å; Y633-L658 HydrophobicContact CD2-CD2 3.79Å; Y633-L658 HydrophobicContact CD2-CG 4.45Å; Y633-L658 HydrophobicContact CE2-CD1 4.07Å; Y633-L658 HydrophobicContact CG-CD2 4.44Å; Y633-F674 HydrophobicContact CD2-CE2 4.07Å; Y633-F674 HydrophobicContact CD2-CZ 4.36Å; Y633-F674 HydrophobicContact CE1-CE2 4.16Å; Y633-F674 AromaticContact CE2-CE2 3.65Å; Y633-F674 HydrophobicContact CE2-CE2 3.65Å; Y633-F674 HydrophobicContact CE2-CZ 4.08Å; Y633-F674 AromaticContact CZ-CE2 3.69Å; Y633-E677 VanDerWaalsContact OH-CD 3.28Å; Y633-E677 PolarHBondContact OH-OE1 3.05Å
634	N	90.9	Very high	87.8	Confident	88 Å²	88	64.4 Å²	64.4	47%	0.471	35%	0.349	S	S	.	.	H	α-helix	trans	-62.1	-40.7	174.9	-72.3	-29.5	0	0	0	111.5	D630 K637 E638	D630-N634 VanDerWaalsContact O-CB 3.31Å; D630-N634 WeakPolarHBondContact O-CB 3.48Å; D630-N634 PolarHBondContact O-N 3.45Å; D630-N634 PolarHBondContact O-ND2 2.96Å; N634-K637 WeakPolarHBondContact O-CB 3.12Å; N634-K637 PolarHBondContact O-N 3.35Å; N634-E638 WeakPolarHBondContact O-CG 3.38Å; N634-E638 PolarHBondContact O-N 3.46Å
635	H	90.4	Very high	87.3	Confident	61 Å²	61	64.3 Å²	64.3	28%	0.282	35%	0.351	S	S	.	.	H	α-helix	trans	-65.6	-40.9	177	-166.5	58.5	0	0	0	112.6	F584 M631 F632 Y633 K637 E638 L639	F584-H635 AromaticContact CD1-CD2 3.6Å; F584-H635 AromaticContact CD1-NE2 4Å; F584-H635 AromaticContact CD2-CD2 3.68Å; F584-H635 AromaticContact CE1-CD2 3.91Å; F584-H635 AromaticContact CG-CD2 3.48Å; F584-H635 VanDerWaalsContact CG-CD2 3.48Å; F584-H635 WeakPolarHBondContact CG-CD2 3.39Å; F584-H635 AromaticContact CG-NE2 3.72Å; M631-H635 WeakPolarHBondContact O-CB 3.46Å; M631-H635 PolarHBondContact O-N 3.24Å; M631-H635 VanDerWaalsContact O-N 3.08Å; F632-H635 PolarHBondContact O-N 2.84Å; Y633-H635 VanDerWaalsContact C-N 3.31Å; Y633-H635 PolarHBondContact O-N 3.45Å; H635-K637 VanDerWaalsContact C-N 3.32Å; H635-K637 PolarHBondContact O-N 2.88Å; H635-E638 IonicContact ND1-OE2 3.53Å; H635-E638 PolarHBondContact ND1-OE2 3.11Å; H635-E638 WeakPolarHBondContact O-CB 3.4Å; H635-E638 PolarHBondContact O-N 3.4Å; H635-L639 WeakPolarHBondContact O-CG 3.43Å; H635-L639 PolarHBondContact O-N 3.24Å
636	V	91.4	Very high	86.9	Confident	2 Å²	2	64.7 Å²	64.7	1%	0.012	35%	0.354	C	S	.	.	H	α-helix	trans	-63.1	-38.8	173.6	175.5	0	0	0	0	111.3	F584 F632 Y633 L639 F640 Q654 L658	F584-V636 HydrophobicContact CE1-CG2 4.26Å; F584-V636 HydrophobicContact CZ-CG2 4.36Å; F632-V636 HydrophobicContact CD1-CG2 3.88Å; F632-V636 HydrophobicContact CE1-CG2 3.66Å; F632-V636 WeakPolarHBondContact O-CG2 3.33Å; F632-V636 PolarHBondContact O-N 3.26Å; Y633-V636 PolarHBondContact O-N 2.91Å; V636-L639 PolarHBondContact O-N 2.97Å; V636-F640 HydrophobicContact CG1-CD1 4.06Å; V636-F640 HydrophobicContact CG1-CE1 3.68Å; V636-F640 HydrophobicContact CG1-CE2 4.19Å; V636-F640 HydrophobicContact CG1-CG 4.47Å; V636-F640 HydrophobicContact CG1-CZ 3.74Å; V636-F640 WeakPolarHBondContact O-CD1 3.35Å; V636-F640 WeakPolarHBondContact O-CG 3.48Å; V636-F640 PolarHBondContact O-N 2.96Å; V636-Q654 HydrophobicContact CG1-CB 3.9Å; V636-Q654 HydrophobicContact CG2-CB 4.19Å; V636-L658 HydrophobicContact CB-CD1 4.18Å; V636-L658 HydrophobicContact CG1-CD1 3.82Å; V636-L658 HydrophobicContact CG2-CD1 4.43Å
637	K	88.9	Confident	86.5	Confident	90 Å²	90	64.5 Å²	64.5	39%	0.391	36%	0.355	S	S	.	.	H	α-helix	trans	-60.1	-44	173.4	-80.2	179.9	162	170	0	112	Y633 N634 H635 L639 F640 A641 E677	Y633-K637 HydrophobicContact CD1-CD 4.42Å; Y633-K637 HydrophobicContact CE1-CD 4.07Å; Y633-K637 VanDerWaalsContact CE1-CE 3.45Å; Y633-K637 HydrophobicContact CE2-CD 4.43Å; Y633-K637 HydrophobicContact CE2-CG 4.37Å; Y633-K637 VanDerWaalsContact CZ-NZ 3.31Å; Y633-K637 PolarHBondContact O-N 2.93Å; Y633-K637 WeakPolarHBondContact OH-CE 3.39Å; Y633-K637 PolarHBondContact OH-NZ 3.07Å; Y633-K637 VanDerWaalsContact OH-NZ 3.1Å; N634-K637 WeakPolarHBondContact O-CB 3.12Å; N634-K637 PolarHBondContact O-N 3.35Å; H635-K637 VanDerWaalsContact C-N 3.32Å; H635-K637 PolarHBondContact O-N 2.88Å; K637-L639 VanDerWaalsContact C-N 3.35Å; K637-L639 PolarHBondContact O-N 3.35Å; K637-F640 PolarHBondContact O-N 3.48Å; K637-A641 PolarHBondContact O-N 3.21Å; K637-E677 IonicContact NZ-OE1 2.75Å; K637-E677 PolarHBondContact NZ-OE1 3.03Å
638	E	88.8	Confident	86.1	Confident	129 Å²	129	62.4 Å²	62.4	60%	0.603	34%	0.335	S	S	*	.	H	α-helix	trans	-60.2	-43.6	174.5	-70.5	169.2	178	0	0	111.9	N634 H635 F640 A641	N634-E638 WeakPolarHBondContact O-CG 3.38Å; N634-E638 PolarHBondContact O-N 3.46Å; H635-E638 IonicContact ND1-OE2 3.53Å; H635-E638 PolarHBondContact ND1-OE2 3.11Å; H635-E638 WeakPolarHBondContact O-CB 3.4Å; H635-E638 PolarHBondContact O-N 3.4Å; E638-F640 VanDerWaalsContact C-N 3.29Å; E638-F640 PolarHBondContact O-N 2.94Å; E638-A641 PolarHBondContact O-N 2.95Å
639	L	88.3	Confident	85.7	Confident	10 Å²	10	64.9 Å²	64.9	5%	0.052	35%	0.346	C	S	.	.	H	α-helix	trans	-64.4	-33.5	176.7	-68.8	175.2	0	0	0	112.4	F584 T588 H635 V636 K637 L645 L646	F584-L639 HydrophobicContact CD1-CD1 4.11Å; F584-L639 HydrophobicContact CE1-CD1 4.37Å; T588-L639 HydrophobicContact CG2-CD2 3.69Å; H635-L639 WeakPolarHBondContact O-CG 3.43Å; H635-L639 PolarHBondContact O-N 3.24Å; V636-L639 PolarHBondContact O-N 2.97Å; K637-L639 VanDerWaalsContact C-N 3.35Å; K637-L639 PolarHBondContact O-N 3.35Å; L639-L645 HydrophobicContact CD2-CD2 3.59Å; L639-L646 HydrophobicContact CB-CD1 3.85Å; L639-L646 HydrophobicContact CD1-CD1 4.38Å
640	F	86.1	Confident	85.6	Confident	55 Å²	55	64.5 Å²	64.5	24%	0.241	34%	0.344	C	S	.	.	H	α-helix	trans	-77.8	-26.8	179.4	-77.6	18.2	0	0	0	112.7	V636 K637 E638 N642 L646 K651 Q654 M655	V636-F640 HydrophobicContact CG1-CD1 4.06Å; V636-F640 HydrophobicContact CG1-CE1 3.68Å; V636-F640 HydrophobicContact CG1-CE2 4.19Å; V636-F640 HydrophobicContact CG1-CG 4.47Å; V636-F640 HydrophobicContact CG1-CZ 3.74Å; V636-F640 WeakPolarHBondContact O-CD1 3.35Å; V636-F640 WeakPolarHBondContact O-CG 3.48Å; V636-F640 PolarHBondContact O-N 2.96Å; K637-F640 PolarHBondContact O-N 3.48Å; E638-F640 VanDerWaalsContact C-N 3.29Å; E638-F640 PolarHBondContact O-N 2.94Å; F640-N642 PolarHBondContact O-N 2.85Å; F640-L646 HydrophobicContact CD1-CD1 4.31Å; F640-L646 HydrophobicContact CE1-CD1 4.26Å; F640-K651 HydrophobicContact CD1-CB 4.5Å; F640-K651 HydrophobicContact CD1-CG 4.09Å; F640-K651 HydrophobicContact CE1-CB 3.79Å; F640-K651 HydrophobicContact CE1-CG 3.82Å; F640-K651 HydrophobicContact CZ-CB 3.9Å; F640-K651 HydrophobicContact CZ-CG 4.37Å; F640-K651 WeakPolarHBondContact CZ-O 3.4Å; F640-Q654 HydrophobicContact CE1-CB 4.14Å; F640-Q654 HydrophobicContact CZ-CB 4.25Å; F640-M655 HydrophobicContact CE2-CG 3.89Å; F640-M655 HydrophobicContact CE2-SD 4.42Å; F640-M655 HydrophobicContact CZ-CG 3.83Å
641	A	85.1	Confident	85.5	Confident	87 Å²	87	60 Å²	60	72%	0.719	32%	0.319	S	S	*	.	H	α-helix	trans	-62.7	-27.2	178.3	0	0	0	0	0	113.1	K637 E638	K637-A641 PolarHBondContact O-N 3.21Å; E638-A641 PolarHBondContact O-N 2.95Å
642	N	81	Confident	85.4	Confident	85 Å²	85	55.9 Å²	55.9	46%	0.455	30%	0.299	S	S	.	.	S	Bend	trans	-98.5	98.6	172.8	-172.5	-16.3	0	0	0	110.8	F640 A644 L645	F640-N642 PolarHBondContact O-N 2.85Å; N642-A644 PolarHBondContact O-N 2.87Å; N642-A644 VanDerWaalsContact O-N 3.11Å; N642-A644 PolarHBondContact OD1-N 2.85Å; N642-L645 HydrophobicContact CB-CB 3.99Å; N642-L645 WeakPolarHBondContact O-CB 3.44Å; N642-L645 PolarHBondContact O-N 3.32Å; N642-L645 VanDerWaalsContact O-N 3.15Å
643	E	69.5	Low	85.4	Confident	166 Å²	166	56.9 Å²	56.9	78%	0.776	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.4	-28.6	-175.2	-70.6	-171.5	168.8	0	0	114.3
644	A	70.7	Confident	85.4	Confident	79 Å²	79	55.7 Å²	55.7	65%	0.653	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.2	-10.4	-176.5	0	0	0	0	0	114.3	N642	N642-A644 PolarHBondContact O-N 2.87Å; N642-A644 VanDerWaalsContact O-N 3.11Å; N642-A644 PolarHBondContact OD1-N 2.85Å
645	L	80.2	Confident	85.4	Confident	56 Å²	56	51.6 Å²	51.6	29%	0.293	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.3	-45.9	-171.6	-173.1	66.4	0	0	0	112.7	T588 R599 R607 L639 N642	T588-L645 HydrophobicContact CG2-CD1 4.49Å; T588-L645 HydrophobicContact CG2-CD2 4.1Å; T588-L645 HydrophobicContact CG2-CG 4.32Å; R599-L645 PolarHBondContact NH2-O 3.47Å; R607-L645 PolarHBondContact NH2-O 3.46Å; L639-L645 HydrophobicContact CD2-CD2 3.59Å; N642-L645 HydrophobicContact CB-CB 3.99Å; N642-L645 WeakPolarHBondContact O-CB 3.44Å; N642-L645 PolarHBondContact O-N 3.32Å; N642-L645 VanDerWaalsContact O-N 3.15Å
646	L	84.1	Confident	85.6	Confident	9 Å²	9	50.1 Å²	50.1	5%	0.047	27%	0.273	C	S	.	.	S	Bend	trans	-110.1	144.2	-177.4	-61.4	-174.3	0	0	0	111.5	V587 L639 F640 E650 K651	V587-L646 HydrophobicContact CG1-CD2 3.77Å; L639-L646 HydrophobicContact CB-CD1 3.85Å; L639-L646 HydrophobicContact CD1-CD1 4.38Å; F640-L646 HydrophobicContact CD1-CD1 4.31Å; F640-L646 HydrophobicContact CE1-CD1 4.26Å; L646-E650 WeakPolarHBondContact CA-OE2 3.47Å; L646-E650 HydrophobicContact CB-CB 4.23Å; L646-E650 HydrophobicContact CD2-CB 4.47Å; L646-K651 HydrophobicContact CB-CG 3.81Å; L646-K651 HydrophobicContact CD1-CG 4.2Å
647	T	83.4	Confident	85.8	Confident	53 Å²	53	50 Å²	50	33%	0.325	27%	0.272	S	S	.	.			trans	-70.6	158.3	165.9	68.3	0	0	0	0	110.5	L649 E650 K651	T647-L649 VanDerWaalsContact C-N 3.26Å; T647-L649 PolarHBondContact O-N 3.16Å; T647-E650 PolarHBondContact N-OE2 3.22Å; T647-E650 WeakPolarHBondContact O-CB 3.12Å; T647-E650 PolarHBondContact O-N 3.43Å; T647-E650 VanDerWaalsContact O-N 3.1Å; T647-E650 VanDerWaalsContact OG1-CG 3.23Å; T647-E650 WeakPolarHBondContact OG1-CG 3.24Å; T647-E650 PolarHBondContact OG1-N 3.09Å; T647-E650 PolarHBondContact OG1-OE2 2.95Å; T647-K651 PolarHBondContact O-N 3.39Å
648	F	82.4	Confident	86.1	Confident	63 Å²	63	45.8 Å²	45.8	28%	0.276	25%	0.254	S	S	.	.	H	α-helix	trans	-57.6	-38.8	177.5	-70	-64.9	0	0	0	113	E650 K651 C652 G726 F730	F648-E650 VanDerWaalsContact C-N 3.35Å; F648-E650 PolarHBondContact O-N 2.93Å; F648-K651 PolarHBondContact O-N 3.26Å; F648-C652 PolarHBondContact O-N 3.08Å; F648-C652 PolarHBondContact O-SG 3.12Å; F648-G726 WeakPolarHBondContact CD2-O 2.88Å; F648-G726 VanDerWaalsContact CE2-CA 3.42Å; F648-F730 HydrophobicContact CB-CB 3.97Å; F648-F730 HydrophobicContact CB-CD2 4.12Å; F648-F730 HydrophobicContact CB-CG 4.44Å; F648-F730 HydrophobicContact CD1-CB 3.4Å; F648-F730 HydrophobicContact CD1-CD1 4.36Å; F648-F730 AromaticContact CD1-CD2 3.73Å; F648-F730 HydrophobicContact CD1-CD2 3.73Å; F648-F730 AromaticContact CD1-CG 3.56Å; F648-F730 HydrophobicContact CD1-CG 3.56Å; F648-F730 HydrophobicContact CE1-CB 4Å; F648-F730 HydrophobicContact CE1-CG 4.18Å; F648-F730 HydrophobicContact CG-CB 3.84Å; F648-F730 HydrophobicContact CG-CD2 4.39Å; F648-F730 HydrophobicContact CG-CG 4.35Å
649	L	82.1	Confident	86.4	Confident	80 Å²	80	39.6 Å²	39.6	42%	0.419	23%	0.225	S	C	.	.	H	α-helix	trans	-64.8	-38.8	176.9	-168.1	71.8	0	0	0	112.1	T647 C652 S653 Y733	T647-L649 VanDerWaalsContact C-N 3.26Å; T647-L649 PolarHBondContact O-N 3.16Å; L649-C652 PolarHBondContact O-N 2.71Å; L649-S653 PolarHBondContact O-N 3.23Å; L649-S653 PolarHBondContact O-OG 3.34Å; L649-Y733 HydrophobicContact CD1-CD1 4.11Å; L649-Y733 HydrophobicContact CD1-CD2 4.36Å; L649-Y733 HydrophobicContact CD1-CE1 3.92Å; L649-Y733 HydrophobicContact CD1-CE2 4.21Å; L649-Y733 HydrophobicContact CD1-CG 4.34Å
650	E	89	Confident	86.7	Confident	10 Å²	10	39.8 Å²	39.8	5%	0.047	23%	0.226	C	C	.	.	H	α-helix	trans	-66.1	-42.4	174.5	-70.6	160.6	178.9	0	0	111	R607 L646 T647 F648 C652 S653 Q654	R607-E650 WeakPolarHBondContact CB-OE1 3.49Å; R607-E650 IonicContact CZ-OE1 2.7Å; R607-E650 IonicContact CZ-OE2 2.86Å; R607-E650 IonicContact NE-OE1 3.41Å; R607-E650 PolarHBondContact NE-OE1 3.03Å; R607-E650 IonicContact NE-OE2 3.76Å; R607-E650 IonicContact NH2-OE1 3.46Å; R607-E650 IonicContact NH2-OE2 3.28Å; R607-E650 PolarHBondContact NH2-OE2 3.18Å; L646-E650 WeakPolarHBondContact CA-OE2 3.47Å; L646-E650 HydrophobicContact CB-CB 4.23Å; L646-E650 HydrophobicContact CD2-CB 4.47Å; T647-E650 PolarHBondContact N-OE2 3.22Å; T647-E650 WeakPolarHBondContact O-CB 3.12Å; T647-E650 PolarHBondContact O-N 3.43Å; T647-E650 VanDerWaalsContact O-N 3.1Å; T647-E650 VanDerWaalsContact OG1-CG 3.23Å; T647-E650 WeakPolarHBondContact OG1-CG 3.24Å; T647-E650 PolarHBondContact OG1-N 3.09Å; T647-E650 PolarHBondContact OG1-OE2 2.95Å; F648-E650 VanDerWaalsContact C-N 3.35Å; F648-E650 PolarHBondContact O-N 2.93Å; E650-C652 PolarHBondContact O-N 3.01Å; E650-S653 WeakPolarHBondContact O-CB 3.4Å; E650-S653 PolarHBondContact O-N 3.2Å; E650-Q654 WeakPolarHBondContact O-CG 3.34Å; E650-Q654 PolarHBondContact O-N 3.46Å
651	K	88.4	Confident	87.1	Confident	21 Å²	21	37.1 Å²	37.1	9%	0.091	21%	0.214	C	C	.	.	H	α-helix	trans	-57.9	-48.3	173.8	-67	-176.1	-175	179.6	0	111.1	F640 L646 T647 F648 S653 Q654 M655 F730	F640-K651 HydrophobicContact CD1-CB 4.5Å; F640-K651 HydrophobicContact CD1-CG 4.09Å; F640-K651 HydrophobicContact CE1-CB 3.79Å; F640-K651 HydrophobicContact CE1-CG 3.82Å; F640-K651 HydrophobicContact CZ-CB 3.9Å; F640-K651 HydrophobicContact CZ-CG 4.37Å; F640-K651 WeakPolarHBondContact CZ-O 3.4Å; L646-K651 HydrophobicContact CB-CG 3.81Å; L646-K651 HydrophobicContact CD1-CG 4.2Å; T647-K651 PolarHBondContact O-N 3.39Å; F648-K651 PolarHBondContact O-N 3.26Å; K651-S653 VanDerWaalsContact C-N 3.29Å; K651-S653 PolarHBondContact O-N 3.02Å; K651-Q654 PolarHBondContact O-N 3.49Å; K651-Q654 VanDerWaalsContact O-N 3.15Å; K651-M655 WeakPolarHBondContact O-CG 3.47Å; K651-M655 PolarHBondContact O-N 2.83Å; K651-F730 HydrophobicContact CB-CD2 4.34Å; K651-F730 HydrophobicContact CB-CE2 3.69Å; K651-F730 HydrophobicContact CD-CE2 4.43Å
652	C	88.6	Confident	87.6	Confident	6 Å²	6	33 Å²	33	4%	0.041	18%	0.18	C	C	.	.	H	α-helix	trans	-60.7	-38.3	176.8	-64.8	0	0	0	0	112.5	F648 L649 E650 Q654 M655 E656 F730 Y733	F648-C652 PolarHBondContact O-N 3.08Å; F648-C652 PolarHBondContact O-SG 3.12Å; L649-C652 PolarHBondContact O-N 2.71Å; E650-C652 PolarHBondContact O-N 3.01Å; C652-Q654 VanDerWaalsContact C-N 3.31Å; C652-Q654 PolarHBondContact O-N 3.3Å; C652-M655 WeakPolarHBondContact O-CB 3.06Å; C652-M655 PolarHBondContact O-N 3.35Å; C652-E656 WeakPolarHBondContact O-CB 3.32Å; C652-E656 PolarHBondContact O-N 2.96Å; C652-F730 WeakPolarHBondContact SG-CD2 3.48Å; C652-F730 VanDerWaalsContact SG-CE2 3.55Å; C652-Y733 WeakPolarHBondContact SG-CB 3.36Å
653	S	91.6	Very high	88.3	Confident	20 Å²	20	30 Å²	30	14%	0.14	16%	0.164	C	C	.	.	H	α-helix	trans	-62.7	-38.6	176.4	-56.9	0	0	0	0	112.1	L649 E650 K651 E656 A657	L649-S653 PolarHBondContact O-N 3.23Å; L649-S653 PolarHBondContact O-OG 3.34Å; E650-S653 WeakPolarHBondContact O-CB 3.4Å; E650-S653 PolarHBondContact O-N 3.2Å; K651-S653 VanDerWaalsContact C-N 3.29Å; K651-S653 PolarHBondContact O-N 3.02Å; S653-E656 WeakPolarHBondContact O-CB 3.32Å; S653-E656 PolarHBondContact O-N 3.31Å; S653-A657 PolarHBondContact O-N 3.12Å; S653-A657 VanDerWaalsContact O-N 3.09Å
654	Q	91.8	Very high	89.5	Confident	0 Å²	0	24.8 Å²	24.8	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-69.2	-38.1	174.7	-60.9	-51.5	-44	0	0	111.8	C611 V636 F640 E650 K651 C652 E656 A657 L658	C611-Q654 PolarHBondContact SG-NE2 2.89Å; C611-Q654 VanDerWaalsContact SG-NE2 3.43Å; V636-Q654 HydrophobicContact CG1-CB 3.9Å; V636-Q654 HydrophobicContact CG2-CB 4.19Å; F640-Q654 HydrophobicContact CE1-CB 4.14Å; F640-Q654 HydrophobicContact CZ-CB 4.25Å; E650-Q654 WeakPolarHBondContact O-CG 3.34Å; E650-Q654 PolarHBondContact O-N 3.46Å; K651-Q654 PolarHBondContact O-N 3.49Å; K651-Q654 VanDerWaalsContact O-N 3.15Å; C652-Q654 VanDerWaalsContact C-N 3.31Å; C652-Q654 PolarHBondContact O-N 3.3Å; Q654-E656 VanDerWaalsContact C-N 3.33Å; Q654-A657 PolarHBondContact O-N 3.29Å; Q654-L658 WeakPolarHBondContact O-CG 3.33Å; Q654-L658 PolarHBondContact O-N 2.99Å
655	M	92.2	Very high	90.6	Very high	2 Å²	2	22.4 Å²	22.4	1%	0.01	12%	0.115	C	C	.	.	H	α-helix	trans	-61.6	-42.7	171.8	-66	-178.7	74.1	0	0	111.5	F640 K651 C652 A657 L658 V659 L678 I682 F730 A734	F640-M655 HydrophobicContact CE2-CG 3.89Å; F640-M655 HydrophobicContact CE2-SD 4.42Å; F640-M655 HydrophobicContact CZ-CG 3.83Å; K651-M655 WeakPolarHBondContact O-CG 3.47Å; K651-M655 PolarHBondContact O-N 2.83Å; C652-M655 WeakPolarHBondContact O-CB 3.06Å; C652-M655 PolarHBondContact O-N 3.35Å; M655-A657 VanDerWaalsContact C-N 3.33Å; M655-A657 PolarHBondContact O-N 2.97Å; M655-L658 WeakPolarHBondContact O-CB 3.34Å; M655-L658 PolarHBondContact O-N 3.04Å; M655-V659 VanDerWaalsContact O-CG2 3.31Å; M655-V659 WeakPolarHBondContact O-CG2 3.4Å; M655-V659 PolarHBondContact O-N 3.1Å; M655-L678 HydrophobicContact CE-CD1 3.89Å; M655-L678 HydrophobicContact CE-CD2 4.2Å; M655-L678 HydrophobicContact CE-CG 3.67Å; M655-L678 HydrophobicContact CG-CD1 4.31Å; M655-I682 HydrophobicContact CE-CD1 3.49Å; M655-I682 VanDerWaalsContact CE-CD1 3.49Å; M655-I682 HydrophobicContact SD-CD1 4.1Å; M655-F730 HydrophobicContact SD-CE2 4.1Å; M655-F730 HydrophobicContact SD-CZ 3.84Å; M655-A734 HydrophobicContact CE-CB 4.06Å; M655-A734 HydrophobicContact SD-CB 3.79Å
656	E	94.3	Very high	91.3	Very high	30 Å²	30	23.1 Å²	23.1	14%	0.14	12%	0.115	C	C	.	.	H	α-helix	trans	-57.9	-45.9	176.9	-167.3	178	161.9	0	0	111.6	I615 C652 S653 Q654 L658 V659 L660 A737 R741	I615-E656 HydrophobicContact CD1-CB 4.24Å; I615-E656 HydrophobicContact CD1-CG 4.39Å; I615-E656 HydrophobicContact CG1-CB 4.41Å; C652-E656 WeakPolarHBondContact O-CB 3.32Å; C652-E656 PolarHBondContact O-N 2.96Å; S653-E656 WeakPolarHBondContact O-CB 3.32Å; S653-E656 PolarHBondContact O-N 3.31Å; Q654-E656 VanDerWaalsContact C-N 3.33Å; E656-L658 PolarHBondContact O-N 3.3Å; E656-V659 PolarHBondContact O-N 3.35Å; E656-L660 WeakPolarHBondContact O-CG 3.27Å; E656-L660 PolarHBondContact O-N 3.02Å; E656-A737 HydrophobicContact CB-CB 3.96Å; E656-A737 HydrophobicContact CG-CB 4.22Å; E656-R741 HydrophobicContact CG-CG 3.53Å; E656-R741 IonicContact OE1-CZ 2.69Å; E656-R741 IonicContact OE1-NE 3.79Å; E656-R741 PolarHBondContact OE1-NE 3.38Å; E656-R741 IonicContact OE1-NH2 2.92Å; E656-R741 PolarHBondContact OE1-NH2 3.21Å
657	A	95.1	Very high	91.9	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-60.8	-42.8	175.2	0	0	0	0	0	112.3	I614 I615 C618 F632 S653 Q654 M655 V659 L660 I661	I614-A657 HydrophobicContact CG2-CB 3.81Å; I615-A657 HydrophobicContact CG1-CB 4.32Å; C618-A657 HydrophobicContact CB-CB 4.35Å; F632-A657 HydrophobicContact CE1-CB 4.4Å; F632-A657 HydrophobicContact CZ-CB 4.01Å; S653-A657 PolarHBondContact O-N 3.12Å; S653-A657 VanDerWaalsContact O-N 3.09Å; Q654-A657 PolarHBondContact O-N 3.29Å; M655-A657 VanDerWaalsContact C-N 3.33Å; M655-A657 PolarHBondContact O-N 2.97Å; A657-V659 PolarHBondContact O-N 3.04Å; A657-L660 WeakPolarHBondContact O-CB 3.5Å; A657-L660 PolarHBondContact O-N 3.1Å; A657-I661 WeakPolarHBondContact O-CG1 3.38Å; A657-I661 PolarHBondContact O-N 2.89Å; A657-I661 VanDerWaalsContact O-N 3.08Å
658	L	94.9	Very high	92.5	Very high	0 Å²	0	24.2 Å²	24.2	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-62.9	-40.4	176.4	-74.4	174.1	0	0	0	112.8	F629 F632 Y633 V636 Q654 M655 E656 L660 I661 S662 F674 L678	F629-L658 HydrophobicContact CE2-CD2 4.01Å; F632-L658 HydrophobicContact CD1-CD2 3.61Å; F632-L658 HydrophobicContact CD1-CG 4.41Å; F632-L658 HydrophobicContact CE1-CD2 3.84Å; F632-L658 HydrophobicContact CE1-CG 4.17Å; Y633-L658 HydrophobicContact CD2-CD1 3.78Å; Y633-L658 HydrophobicContact CD2-CD2 3.79Å; Y633-L658 HydrophobicContact CD2-CG 4.45Å; Y633-L658 HydrophobicContact CE2-CD1 4.07Å; Y633-L658 HydrophobicContact CG-CD2 4.44Å; V636-L658 HydrophobicContact CB-CD1 4.18Å; V636-L658 HydrophobicContact CG1-CD1 3.82Å; V636-L658 HydrophobicContact CG2-CD1 4.43Å; Q654-L658 WeakPolarHBondContact O-CG 3.33Å; Q654-L658 PolarHBondContact O-N 2.99Å; M655-L658 WeakPolarHBondContact O-CB 3.34Å; M655-L658 PolarHBondContact O-N 3.04Å; E656-L658 PolarHBondContact O-N 3.3Å; L658-L660 VanDerWaalsContact C-N 3.35Å; L658-I661 PolarHBondContact O-N 3.1Å; L658-S662 WeakPolarHBondContact O-CB 3.27Å; L658-S662 PolarHBondContact O-N 2.85Å; L658-F674 HydrophobicContact CB-CE1 4.35Å; L658-F674 HydrophobicContact CB-CZ 4.05Å; L658-L678 HydrophobicContact CD1-CD1 4.29Å
659	V	95.3	Very high	93.2	Very high	0 Å²	0	26.4 Å²	26.4	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-65	-40.5	176.1	176	0	0	0	0	110.7	M655 E656 A657 I661 S662 N663 L675 L678 V738 R741 A742	M655-V659 VanDerWaalsContact O-CG2 3.31Å; M655-V659 WeakPolarHBondContact O-CG2 3.4Å; M655-V659 PolarHBondContact O-N 3.1Å; E656-V659 PolarHBondContact O-N 3.35Å; A657-V659 PolarHBondContact O-N 3.04Å; V659-I661 PolarHBondContact O-N 2.93Å; V659-S662 PolarHBondContact O-N 3.25Å; V659-S662 PolarHBondContact O-OG 2.98Å; V659-N663 PolarHBondContact O-N 3.45Å; V659-L675 HydrophobicContact CG1-CD2 4.3Å; V659-L675 HydrophobicContact CG2-CD2 3.84Å; V659-L678 HydrophobicContact CG2-CD2 3.89Å; V659-V738 HydrophobicContact CG2-CG2 4.04Å; V659-R741 HydrophobicContact CB-CB 4.34Å; V659-R741 HydrophobicContact CG1-CB 3.79Å; V659-A742 HydrophobicContact CG1-CB 3.95Å
660	L	95.2	Very high	93.8	Very high	13 Å²	13	28 Å²	28	7%	0.068	14%	0.137	C	C	.	.	H	α-helix	trans	-61.6	-42.3	176.3	-75.7	166.4	0	0	0	112.4	I615 C618 R619 E656 A657 L658 N663 R741	I615-L660 HydrophobicContact CG2-CD1 3.81Å; C618-L660 HydrophobicContact CB-CB 4.16Å; C618-L660 HydrophobicContact CB-CD1 4.45Å; R619-L660 HydrophobicContact CB-CD1 4Å; R619-L660 HydrophobicContact CB-CD2 4.23Å; R619-L660 HydrophobicContact CG-CD2 4.29Å; E656-L660 WeakPolarHBondContact O-CG 3.27Å; E656-L660 PolarHBondContact O-N 3.02Å; A657-L660 WeakPolarHBondContact O-CB 3.5Å; A657-L660 PolarHBondContact O-N 3.1Å; L658-L660 VanDerWaalsContact C-N 3.35Å; L660-N663 WeakPolarHBondContact O-CB 3.43Å; L660-N663 PolarHBondContact O-N 3.3Å; L660-R741 HydrophobicContact CD2-CB 4.14Å; L660-R741 HydrophobicContact CD2-CG 4.22Å; L660-R741 HydrophobicContact CG-CB 4.22Å; L660-R741 HydrophobicContact CG-CG 4.2Å
661	I	94.8	Very high	94.1	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-68.6	-38.4	177.2	-55.6	158.4	0	0	0	110.6	C618 I625 L626 F629 F632 A657 L658 V659 N663 Q664	C618-I661 HydrophobicContact CB-CD1 4.5Å; C618-I661 HydrophobicContact CB-CG1 3.99Å; I625-I661 HydrophobicContact CG2-CD1 3.62Å; I625-I661 HydrophobicContact CG2-CG1 3.87Å; L626-I661 HydrophobicContact CD1-CG2 4.18Å; F629-I661 HydrophobicContact CB-CG2 4.4Å; F629-I661 HydrophobicContact CD2-CB 3.98Å; F629-I661 HydrophobicContact CD2-CD1 4.33Å; F629-I661 HydrophobicContact CD2-CG2 3.47Å; F629-I661 VanDerWaalsContact CD2-CG2 3.47Å; F629-I661 HydrophobicContact CE2-CB 4.22Å; F629-I661 HydrophobicContact CE2-CG2 4.15Å; F629-I661 HydrophobicContact CG-CG2 4.31Å; F632-I661 HydrophobicContact CD1-CD1 4.2Å; F632-I661 HydrophobicContact CD2-CD1 4.35Å; F632-I661 HydrophobicContact CE1-CD1 4.26Å; F632-I661 HydrophobicContact CE2-CD1 4.4Å; F632-I661 HydrophobicContact CG-CD1 4.26Å; F632-I661 HydrophobicContact CZ-CD1 4.36Å; A657-I661 WeakPolarHBondContact O-CG1 3.38Å; A657-I661 PolarHBondContact O-N 2.89Å; A657-I661 VanDerWaalsContact O-N 3.08Å; L658-I661 PolarHBondContact O-N 3.1Å; V659-I661 PolarHBondContact O-N 2.93Å; I661-N663 PolarHBondContact O-N 3.36Å; I661-Q664 WeakPolarHBondContact O-CB 3.44Å; I661-Q664 PolarHBondContact O-N 3.45Å
662	S	95.2	Very high	94.5	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-65.4	-25.4	-179	79.5	0	0	0	0	113.5	L658 V659 Q664 F665	L658-S662 WeakPolarHBondContact O-CB 3.27Å; L658-S662 PolarHBondContact O-N 2.85Å; V659-S662 PolarHBondContact O-N 3.25Å; V659-S662 PolarHBondContact O-OG 2.98Å; S662-Q664 PolarHBondContact O-N 2.71Å; S662-F665 VanDerWaalsContact O-CB 3.3Å; S662-F665 WeakPolarHBondContact O-CB 3.42Å; S662-F665 VanDerWaalsContact O-CD2 3.27Å; S662-F665 WeakPolarHBondContact O-CD2 2.87Å; S662-F665 VanDerWaalsContact O-CG 3.24Å; S662-F665 WeakPolarHBondContact O-CG 3.32Å; S662-F665 PolarHBondContact O-N 2.95Å
663	N	95	Very high	94.8	Very high	23 Å²	23	32 Å²	32	12%	0.123	16%	0.164	C	C	.	.	G	3₁₀ helix	trans	-56.4	-30.3	170.4	-66.8	-27.9	0	0	0	112.2	V659 L660 I661 F665 K666 Q671 R741 R743	V659-N663 PolarHBondContact O-N 3.45Å; L660-N663 WeakPolarHBondContact O-CB 3.43Å; L660-N663 PolarHBondContact O-N 3.3Å; I661-N663 PolarHBondContact O-N 3.36Å; N663-F665 PolarHBondContact O-N 3.36Å; N663-K666 PolarHBondContact O-N 3.4Å; N663-Q671 PolarHBondContact OD1-NE2 2.71Å; N663-R741 PolarHBondContact ND2-O 3.04Å; N663-R741 PolarHBondContact OD1-O 3.29Å; N663-R743 PolarHBondContact OD1-N 3.28Å; N663-R743 PolarHBondContact OD1-O 3.24Å
664	Q	94.7	Very high	95	Very high	55 Å²	55	31.8 Å²	31.8	26%	0.257	16%	0.16	S	C	.	.	G	3₁₀ helix	trans	-80	0.3	177.9	-66.5	-55.8	-35.2	0	0	114.6	P622 L626 I661 S662 K666	P622-Q664 HydrophobicContact CB-CG 3.33Å; P622-Q664 HydrophobicContact CG-CG 3.52Å; P622-Q664 VanDerWaalsContact CG-NE2 3.25Å; L626-Q664 HydrophobicContact CD2-CB 4.17Å; I661-Q664 WeakPolarHBondContact O-CB 3.44Å; I661-Q664 PolarHBondContact O-N 3.45Å; S662-Q664 PolarHBondContact O-N 2.71Å; Q664-K666 PolarHBondContact O-N 2.81Å
665	F	94.8	Very high	95.2	Very high	30 Å²	30	31.8 Å²	31.8	13%	0.132	16%	0.16	C	C	.	.	G	3₁₀ helix	trans	-61.4	-30.2	164.3	-62.6	-22.4	0	0	0	111.2	L626 F629 S662 N663 D667 K670 Q671 F674	L626-F665 HydrophobicContact CD1-CD1 3.78Å; L626-F665 HydrophobicContact CD1-CE1 3.64Å; F629-F665 HydrophobicContact CD1-CE1 4.34Å; F629-F665 HydrophobicContact CD1-CZ 4.12Å; F629-F665 HydrophobicContact CE1-CE1 4.36Å; F629-F665 AromaticContact CE1-CZ 3.69Å; F629-F665 HydrophobicContact CE1-CZ 3.69Å; F629-F665 HydrophobicContact CE2-CZ 4.26Å; F629-F665 AromaticContact CZ-CZ 3.74Å; F629-F665 HydrophobicContact CZ-CZ 3.74Å; S662-F665 VanDerWaalsContact O-CB 3.3Å; S662-F665 WeakPolarHBondContact O-CB 3.42Å; S662-F665 VanDerWaalsContact O-CD2 3.27Å; S662-F665 WeakPolarHBondContact O-CD2 2.87Å; S662-F665 VanDerWaalsContact O-CG 3.24Å; S662-F665 WeakPolarHBondContact O-CG 3.32Å; S662-F665 PolarHBondContact O-N 2.95Å; N663-F665 PolarHBondContact O-N 3.36Å; F665-D667 PolarHBondContact O-N 2.97Å; F665-D667 VanDerWaalsContact O-N 3.1Å; F665-K670 HydrophobicContact CB-CD 4.13Å; F665-K670 HydrophobicContact CB-CG 4.46Å; F665-K670 HydrophobicContact CD1-CD 4.44Å; F665-K670 HydrophobicContact CD2-CD 4.15Å; F665-K670 HydrophobicContact CD2-CG 3.9Å; F665-K670 HydrophobicContact CE2-CG 4.39Å; F665-K670 HydrophobicContact CG-CD 4Å; F665-K670 HydrophobicContact CG-CG 4.24Å; F665-Q671 HydrophobicContact CD2-CB 4.36Å; F665-F674 HydrophobicContact CE2-CB 4.15Å; F665-F674 HydrophobicContact CE2-CG 4.26Å
666	K	94.3	Very high	95.3	Very high	70 Å²	70	34 Å²	34	30%	0.304	17%	0.173	S	C	.	.			trans	49.8	33.1	-177.3	-53.8	-174.5	-177	-167.3	0	112.5	N663 Q664 P745 E750 G754	N663-K666 PolarHBondContact O-N 3.4Å; Q664-K666 PolarHBondContact O-N 2.81Å; K666-P745 HydrophobicContact CB-CG 4.03Å; K666-P745 HydrophobicContact CG-CG 4.1Å; K666-E750 WeakPolarHBondContact CD-OE2 3.41Å; K666-E750 WeakPolarHBondContact CE-OE2 3.33Å; K666-E750 IonicContact NZ-OE1 3.56Å; K666-E750 PolarHBondContact NZ-OE1 3.49Å; K666-E750 IonicContact NZ-OE2 3.61Å; K666-E750 PolarHBondContact NZ-OE2 3.17Å; K666-G754 WeakPolarHBondContact O-CA 3.47Å
667	D	96.3	Very high	95.3	Very high	68 Å²	68	37.5 Å²	37.5	36%	0.364	19%	0.189	S	C	.	.			trans	-140	117.8	-179	178.8	-46.7	0	0	0	107.6	F665 D669 K670 Q671	F665-D667 PolarHBondContact O-N 2.97Å; F665-D667 VanDerWaalsContact O-N 3.1Å; D667-D669 PolarHBondContact OD1-N 2.81Å; D667-K670 HydrophobicContact CB-CB 3.96Å; D667-K670 PolarHBondContact OD1-N 3.49Å; D667-Q671 VanDerWaalsContact O-CB 3.26Å; D667-Q671 WeakPolarHBondContact O-CB 3.36Å; D667-Q671 PolarHBondContact O-N 3.1Å
668	F	96.4	Very high	95.2	Very high	18 Å²	18	38.4 Å²	38.4	8%	0.079	19%	0.193	C	C	.	.	H	α-helix	trans	-60.7	-47	-175.2	173.4	-89.7	0	0	0	112	Q671 K672 G754 F756 R769 P771	F668-Q671 PolarHBondContact O-N 3.07Å; F668-K672 HydrophobicContact CE1-CD 3.98Å; F668-K672 HydrophobicContact CZ-CD 4.17Å; F668-K672 WeakPolarHBondContact O-CB 3.44Å; F668-K672 PolarHBondContact O-N 2.72Å; F668-G754 VanDerWaalsContact CB-O 3.28Å; F668-G754 WeakPolarHBondContact CB-O 3.48Å; F668-G754 PolarHBondContact N-O 3.46Å; F668-F756 HydrophobicContact CB-CD1 4.16Å; F668-F756 HydrophobicContact CB-CD2 4.41Å; F668-F756 HydrophobicContact CB-CE1 4.06Å; F668-F756 HydrophobicContact CB-CE2 4.28Å; F668-F756 HydrophobicContact CB-CG 4.35Å; F668-F756 HydrophobicContact CB-CZ 4.11Å; F668-F756 AromaticContact CD2-CD1 3.95Å; F668-F756 HydrophobicContact CD2-CD1 3.95Å; F668-F756 HydrophobicContact CD2-CE1 4.12Å; F668-R769 VanDerWaalsContact CD1-CZ 3.48Å; F668-R769 HydrophobicContact CD2-CG 3.92Å; F668-R769 HydrophobicContact CE2-CB 4.3Å; F668-R769 HydrophobicContact CE2-CG 3.65Å; F668-R769 HydrophobicContact CZ-CG 4.28Å; F668-P771 HydrophobicContact CD2-CG 3.8Å; F668-P771 HydrophobicContact CE2-CB 4.39Å; F668-P771 HydrophobicContact CE2-CG 4.06Å
669	D	96.4	Very high	95.1	Very high	109 Å²	109	38.6 Å²	38.6	58%	0.583	20%	0.195	S	C	*	.	H	α-helix	trans	-71.1	-40	-173.6	-69.9	-46.3	0	0	0	110.9	D667 K672 A673	D667-D669 PolarHBondContact OD1-N 2.81Å; D669-K672 PolarHBondContact O-N 3.1Å; D669-A673 WeakPolarHBondContact O-CB 3.04Å; D669-A673 PolarHBondContact O-N 2.98Å
670	K	95.4	Very high	95	Very high	114 Å²	114	40.7 Å²	40.7	50%	0.496	21%	0.212	S	C	.	.	H	α-helix	trans	-64.9	-45.7	175.6	-173.9	176.9	176.3	-177	0	111.7	F665 D667 F674	F665-K670 HydrophobicContact CB-CD 4.13Å; F665-K670 HydrophobicContact CB-CG 4.46Å; F665-K670 HydrophobicContact CD1-CD 4.44Å; F665-K670 HydrophobicContact CD2-CD 4.15Å; F665-K670 HydrophobicContact CD2-CG 3.9Å; F665-K670 HydrophobicContact CE2-CG 4.39Å; F665-K670 HydrophobicContact CG-CD 4Å; F665-K670 HydrophobicContact CG-CG 4.24Å; D667-K670 HydrophobicContact CB-CB 3.96Å; D667-K670 PolarHBondContact OD1-N 3.49Å; K670-F674 PolarHBondContact O-N 3.13Å; K670-F674 VanDerWaalsContact O-N 3.14Å
671	Q	96.1	Very high	94.8	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-65.5	-43.4	178.1	-172.7	176.7	13.4	0	0	111.2	N663 F665 D667 F668 F674 L675 P771	N663-Q671 PolarHBondContact OD1-NE2 2.71Å; F665-Q671 HydrophobicContact CD2-CB 4.36Å; D667-Q671 VanDerWaalsContact O-CB 3.26Å; D667-Q671 WeakPolarHBondContact O-CB 3.36Å; D667-Q671 PolarHBondContact O-N 3.1Å; F668-Q671 PolarHBondContact O-N 3.07Å; Q671-F674 PolarHBondContact O-N 3.28Å; Q671-L675 HydrophobicContact CG-CD1 4.35Å; Q671-L675 HydrophobicContact CG-CG 4.47Å; Q671-L675 WeakPolarHBondContact O-CG 3.44Å; Q671-L675 PolarHBondContact O-N 2.95Å; Q671-P771 HydrophobicContact CB-CB 4.38Å; Q671-P771 HydrophobicContact CB-CG 4.21Å; Q671-P771 HydrophobicContact CG-CB 4.13Å; Q671-P771 HydrophobicContact CG-CG 4.08Å
672	K	95.6	Very high	94.7	Very high	62 Å²	62	44.7 Å²	44.7	27%	0.27	24%	0.239	S	C	.	.	H	α-helix	trans	-58.5	-50.3	175.9	-178.3	-174.8	175.4	-60.7	0	111.2	F668 D669 F674 L675 D676 P771	F668-K672 HydrophobicContact CE1-CD 3.98Å; F668-K672 HydrophobicContact CZ-CD 4.17Å; F668-K672 WeakPolarHBondContact O-CB 3.44Å; F668-K672 PolarHBondContact O-N 2.72Å; D669-K672 PolarHBondContact O-N 3.1Å; K672-F674 PolarHBondContact O-N 3.09Å; K672-L675 PolarHBondContact O-N 3.04Å; K672-L675 VanDerWaalsContact O-N 3.11Å; K672-D676 IonicContact NZ-OD1 2.72Å; K672-D676 PolarHBondContact NZ-OD1 2.81Å; K672-D676 IonicContact NZ-OD2 3.6Å; K672-D676 PolarHBondContact NZ-OD2 3.2Å; K672-D676 WeakPolarHBondContact O-CB 3.47Å; K672-D676 PolarHBondContact O-N 3.04Å; K672-D676 VanDerWaalsContact O-OD1 3.11Å; K672-P771 HydrophobicContact CB-CB 4.13Å
673	A	96.3	Very high	94.6	Very high	58 Å²	58	45.9 Å²	45.9	48%	0.479	25%	0.245	S	C	.	.	H	α-helix	trans	-57.9	-38.9	179.1	0	0	0	0	0	112.4	D669 E677	D669-A673 WeakPolarHBondContact O-CB 3.04Å; D669-A673 PolarHBondContact O-N 2.98Å; A673-E677 PolarHBondContact O-N 2.98Å; A673-E677 VanDerWaalsContact O-N 3.09Å
674	F	95.8	Very high	94.6	Very high	15 Å²	15	49.5 Å²	49.5	7%	0.066	27%	0.268	C	S	.	.	H	α-helix	trans	-66	-44.4	174.9	175.7	-103.9	0	0	0	112.8	F629 Y633 L658 F665 K670 Q671 K672 D676 E677 L678	F629-F674 HydrophobicContact CE1-CE2 4.3Å; F629-F674 HydrophobicContact CE2-CZ 4.31Å; F629-F674 HydrophobicContact CZ-CD2 4.11Å; F629-F674 HydrophobicContact CZ-CE1 4.36Å; F629-F674 AromaticContact CZ-CE2 3.58Å; F629-F674 HydrophobicContact CZ-CE2 3.58Å; F629-F674 AromaticContact CZ-CZ 3.72Å; F629-F674 HydrophobicContact CZ-CZ 3.72Å; Y633-F674 HydrophobicContact CD2-CE2 4.07Å; Y633-F674 HydrophobicContact CD2-CZ 4.36Å; Y633-F674 HydrophobicContact CE1-CE2 4.16Å; Y633-F674 AromaticContact CE2-CE2 3.65Å; Y633-F674 HydrophobicContact CE2-CE2 3.65Å; Y633-F674 HydrophobicContact CE2-CZ 4.08Å; Y633-F674 AromaticContact CZ-CE2 3.69Å; L658-F674 HydrophobicContact CB-CE1 4.35Å; L658-F674 HydrophobicContact CB-CZ 4.05Å; F665-F674 HydrophobicContact CE2-CB 4.15Å; F665-F674 HydrophobicContact CE2-CG 4.26Å; K670-F674 PolarHBondContact O-N 3.13Å; K670-F674 VanDerWaalsContact O-N 3.14Å; Q671-F674 PolarHBondContact O-N 3.28Å; K672-F674 PolarHBondContact O-N 3.09Å; F674-D676 VanDerWaalsContact C-N 3.34Å; F674-E677 PolarHBondContact O-N 3.23Å; F674-L678 HydrophobicContact CE1-CD2 3.99Å; F674-L678 HydrophobicContact CZ-CD2 4.23Å; F674-L678 WeakPolarHBondContact O-CB 3.46Å; F674-L678 PolarHBondContact O-N 2.99Å
675	L	95.4	Very high	94.5	Very high	0 Å²	0	50.3 Å²	50.3	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-67.2	-35.5	176.9	-65.5	-177.8	0	0	0	111.9	V659 Q671 K672 L678 T679 A742 P771 C772	V659-L675 HydrophobicContact CG1-CD2 4.3Å; V659-L675 HydrophobicContact CG2-CD2 3.84Å; Q671-L675 HydrophobicContact CG-CD1 4.35Å; Q671-L675 HydrophobicContact CG-CG 4.47Å; Q671-L675 WeakPolarHBondContact O-CG 3.44Å; Q671-L675 PolarHBondContact O-N 2.95Å; K672-L675 PolarHBondContact O-N 3.04Å; K672-L675 VanDerWaalsContact O-N 3.11Å; L675-L678 PolarHBondContact O-N 3.42Å; L675-T679 WeakPolarHBondContact O-CB 3.49Å; L675-T679 WeakPolarHBondContact O-CG2 3.36Å; L675-T679 PolarHBondContact O-N 3.39Å; L675-T679 PolarHBondContact O-OG1 2.85Å; L675-A742 HydrophobicContact CD1-CB 3.92Å; L675-P771 HydrophobicContact CD1-CB 3.9Å; L675-C772 HydrophobicContact CD1-CB 3.98Å
676	D	94.8	Very high	94.5	Very high	50 Å²	50	48.9 Å²	48.9	27%	0.267	27%	0.265	S	S	.	.	H	α-helix	trans	-57.7	-49.7	172.5	-65.9	-4.9	0	0	0	109.8	K672 F674 A680 Q775	K672-D676 IonicContact NZ-OD1 2.72Å; K672-D676 PolarHBondContact NZ-OD1 2.81Å; K672-D676 IonicContact NZ-OD2 3.6Å; K672-D676 PolarHBondContact NZ-OD2 3.2Å; K672-D676 WeakPolarHBondContact O-CB 3.47Å; K672-D676 PolarHBondContact O-N 3.04Å; K672-D676 VanDerWaalsContact O-OD1 3.11Å; F674-D676 VanDerWaalsContact C-N 3.34Å; D676-A680 VanDerWaalsContact O-CB 3.25Å; D676-A680 WeakPolarHBondContact O-CB 3.21Å; D676-A680 PolarHBondContact O-N 3.32Å; D676-Q775 PolarHBondContact OD1-NE2 3.01Å
677	E	94.2	Very high	94.5	Very high	102 Å²	102	48.6 Å²	48.6	48%	0.477	27%	0.269	S	S	.	.	H	α-helix	trans	-62	-47.9	176.3	-178.2	-176.7	166	0	0	111.7	Y633 K637 A673 F674 T679	Y633-E677 VanDerWaalsContact OH-CD 3.28Å; Y633-E677 PolarHBondContact OH-OE1 3.05Å; K637-E677 IonicContact NZ-OE1 2.75Å; K637-E677 PolarHBondContact NZ-OE1 3.03Å; A673-E677 PolarHBondContact O-N 2.98Å; A673-E677 VanDerWaalsContact O-N 3.09Å; F674-E677 PolarHBondContact O-N 3.23Å; E677-T679 VanDerWaalsContact C-N 3.34Å; E677-T679 PolarHBondContact O-N 3.23Å
678	L	92.4	Very high	94.5	Very high	19 Å²	19	47.1 Å²	47.1	10%	0.099	27%	0.265	C	S	.	.	H	α-helix	trans	-65.4	-36.2	-174.7	-176.9	63.3	0	0	0	112.6	M655 L658 V659 F674 L675	M655-L678 HydrophobicContact CE-CD1 3.89Å; M655-L678 HydrophobicContact CE-CD2 4.2Å; M655-L678 HydrophobicContact CE-CG 3.67Å; M655-L678 HydrophobicContact CG-CD1 4.31Å; L658-L678 HydrophobicContact CD1-CD1 4.29Å; V659-L678 HydrophobicContact CG2-CD2 3.89Å; F674-L678 HydrophobicContact CE1-CD2 3.99Å; F674-L678 HydrophobicContact CZ-CD2 4.23Å; F674-L678 WeakPolarHBondContact O-CB 3.46Å; F674-L678 PolarHBondContact O-N 2.99Å; L675-L678 PolarHBondContact O-N 3.42Å
679	T	93.6	Very high	94.4	Very high	4 Å²	4	54.9 Å²	54.9	3%	0.025	30%	0.301	C	S	.	.	H	α-helix	trans	-96.8	-13.5	-175.4	61.4	0	0	0	0	114	L675 E677 P681 I682 I683 V738 Q775	L675-T679 WeakPolarHBondContact O-CB 3.49Å; L675-T679 WeakPolarHBondContact O-CG2 3.36Å; L675-T679 PolarHBondContact O-N 3.39Å; L675-T679 PolarHBondContact O-OG1 2.85Å; E677-T679 VanDerWaalsContact C-N 3.34Å; E677-T679 PolarHBondContact O-N 3.23Å; T679-P681 VanDerWaalsContact C-CD 3.49Å; T679-I682 WeakPolarHBondContact O-CB 3.43Å; T679-I682 PolarHBondContact O-N 3.5Å; T679-I683 PolarHBondContact O-N 3.27Å; T679-V738 HydrophobicContact CG2-CG2 3.83Å; T679-Q775 VanDerWaalsContact OG1-CG 3.22Å; T679-Q775 WeakPolarHBondContact OG1-CG 3.39Å
680	A	93.1	Very high	94.2	Very high	45 Å²	45	56.5 Å²	56.5	37%	0.372	31%	0.305	S	S	.	.	H	α-helix	trans	-50.2	-45.3	-177	0	0	0	0	0	114.6	D676 I682 T684	D676-A680 VanDerWaalsContact O-CB 3.25Å; D676-A680 WeakPolarHBondContact O-CB 3.21Å; D676-A680 PolarHBondContact O-N 3.32Å; A680-I682 VanDerWaalsContact C-N 3.3Å; A680-I682 PolarHBondContact O-N 3.42Å; A680-T684 VanDerWaalsContact O-CB 3.31Å; A680-T684 WeakPolarHBondContact O-CB 3.37Å; A680-T684 PolarHBondContact O-N 2.92Å; A680-T684 PolarHBondContact O-OG1 3.16Å
681	P	91	Very high	94.2	Very high	90 Å²	90	51.6 Å²	51.6	58%	0.584	28%	0.284	S	S	*	.	H	α-helix	trans	-62.7	-37.3	177.6	-22.2	34.1	0	0	0	112.9	T679 Q685	T679-P681 VanDerWaalsContact C-CD 3.49Å; P681-Q685 WeakPolarHBondContact O-CB 3.49Å; P681-Q685 PolarHBondContact O-N 3.47Å
682	I	91.9	Very high	94.1	Very high	7 Å²	7	53.9 Å²	53.9	4%	0.036	30%	0.298	C	S	.	.	H	α-helix	trans	-72	-48.3	-178.1	-65.6	151.9	0	0	0	110.2	M655 T679 A680 Q685 W686 F730 C731 A734	M655-I682 HydrophobicContact CE-CD1 3.49Å; M655-I682 VanDerWaalsContact CE-CD1 3.49Å; M655-I682 HydrophobicContact SD-CD1 4.1Å; T679-I682 WeakPolarHBondContact O-CB 3.43Å; T679-I682 PolarHBondContact O-N 3.5Å; A680-I682 VanDerWaalsContact C-N 3.3Å; A680-I682 PolarHBondContact O-N 3.42Å; I682-Q685 PolarHBondContact O-N 2.82Å; I682-W686 WeakPolarHBondContact O-CB 3.33Å; I682-W686 PolarHBondContact O-N 3.4Å; I682-F730 HydrophobicContact CD1-CE1 4.21Å; I682-F730 HydrophobicContact CD1-CZ 4.39Å; I682-F730 HydrophobicContact CG1-CE1 3.91Å; I682-C731 HydrophobicContact CG2-CB 4.08Å; I682-A734 HydrophobicContact CD1-CB 3.41Å; I682-A734 VanDerWaalsContact CD1-CB 3.41Å; I682-A734 HydrophobicContact CG1-CB 4.32Å
683	I	94.2	Very high	94.1	Very high	25 Å²	25	53 Å²	53	13%	0.128	30%	0.3	C	S	.	.	H	α-helix	trans	-62.2	-47.5	179.2	-61.4	-57.4	0	0	0	110.1	T679 Q685 W686 T687 M735 Q775 A778 F779	T679-I683 PolarHBondContact O-N 3.27Å; I683-Q685 VanDerWaalsContact C-N 3.29Å; I683-Q685 PolarHBondContact O-N 3.05Å; I683-W686 PolarHBondContact O-N 2.8Å; I683-W686 VanDerWaalsContact O-N 3.16Å; I683-T687 HydrophobicContact CG2-CG2 4.09Å; I683-T687 WeakPolarHBondContact O-CG2 3.34Å; I683-T687 PolarHBondContact O-N 3.15Å; I683-T687 PolarHBondContact O-OG1 3.24Å; I683-M735 HydrophobicContact CD1-SD 4.41Å; I683-Q775 HydrophobicContact CD1-CB 4.34Å; I683-A778 HydrophobicContact CG2-CB 4.27Å; I683-F779 HydrophobicContact CD1-CB 4.22Å; I683-F779 HydrophobicContact CD1-CD2 4.05Å
684	T	94.1	Very high	94	Very high	99 Å²	99	50.9 Å²	50.9	61%	0.607	28%	0.281	S	S	*	.	H	α-helix	trans	-56.9	-43	-179.5	-56.7	0	0	0	0	112.1	A680 S688	A680-T684 VanDerWaalsContact O-CB 3.31Å; A680-T684 WeakPolarHBondContact O-CB 3.37Å; A680-T684 PolarHBondContact O-N 2.92Å; A680-T684 PolarHBondContact O-OG1 3.16Å; T684-S688 PolarHBondContact O-N 2.97Å
685	Q	91.9	Very high	94.1	Very high	71 Å²	71	50.1 Å²	50.1	33%	0.332	28%	0.278	S	S	.	.	H	α-helix	trans	-72.3	-43.2	177.7	-176.2	173.1	19	0	0	112.4	P681 I682 I683 T687 S688 M691	P681-Q685 WeakPolarHBondContact O-CB 3.49Å; P681-Q685 PolarHBondContact O-N 3.47Å; I682-Q685 PolarHBondContact O-N 2.82Å; I683-Q685 VanDerWaalsContact C-N 3.29Å; I683-Q685 PolarHBondContact O-N 3.05Å; Q685-T687 VanDerWaalsContact C-N 3.32Å; Q685-T687 PolarHBondContact O-N 3.06Å; Q685-S688 WeakPolarHBondContact O-CB 3.47Å; Q685-S688 PolarHBondContact O-N 3.46Å; Q685-S688 PolarHBondContact O-OG 2.91Å; Q685-M691 WeakPolarHBondContact O-CB 3.49Å
686	W	95.4	Very high	94	Very high	0 Å²	0	57.6 Å²	57.6	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-63.3	-38	-178.6	-172.9	-101.9	0	0	0	112.3	I682 I683 S688 L695 L728 C731 L732 F779 N782 L786	I682-W686 WeakPolarHBondContact O-CB 3.33Å; I682-W686 PolarHBondContact O-N 3.4Å; I683-W686 PolarHBondContact O-N 2.8Å; I683-W686 VanDerWaalsContact O-N 3.16Å; W686-S688 VanDerWaalsContact C-N 3.33Å; W686-L695 HydrophobicContact CD2-CD1 4.38Å; W686-L695 HydrophobicContact CE3-CD1 4.45Å; W686-L695 HydrophobicContact CH2-CD1 3.91Å; W686-L695 HydrophobicContact CZ2-CD1 3.8Å; W686-L695 HydrophobicContact CZ3-CD1 4.25Å; W686-L728 HydrophobicContact CH2-CD1 4.17Å; W686-L728 HydrophobicContact CZ3-CD1 3.61Å; W686-C731 HydrophobicContact CE3-CB 3.55Å; W686-C731 HydrophobicContact CZ3-CB 3.86Å; W686-L732 HydrophobicContact CH2-CD2 3.74Å; W686-L732 HydrophobicContact CH2-CG 4.01Å; W686-L732 HydrophobicContact CZ2-CD2 4.33Å; W686-L732 HydrophobicContact CZ3-CD2 4.37Å; W686-L732 HydrophobicContact CZ3-CG 4.21Å; W686-F779 HydrophobicContact CB-CD2 4.18Å; W686-F779 HydrophobicContact CB-CE2 4.08Å; W686-F779 AromaticContact CD1-CD2 3.28Å; W686-F779 AromaticContact CD1-CE2 3.52Å; W686-F779 AromaticContact CD1-CG 3.77Å; W686-F779 AromaticContact CD2-CD2 3.91Å; W686-F779 HydrophobicContact CD2-CD2 3.91Å; W686-F779 HydrophobicContact CD2-CE1 4.41Å; W686-F779 AromaticContact CD2-CE2 3.26Å; W686-F779 HydrophobicContact CD2-CE2 3.26Å; W686-F779 AromaticContact CD2-CZ 3.56Å; W686-F779 HydrophobicContact CD2-CZ 3.56Å; W686-F779 AromaticContact CE2-CD2 3.88Å; W686-F779 AromaticContact CE2-CE1 3.7Å; W686-F779 AromaticContact CE2-CE2 3.39Å; W686-F779 AromaticContact CE2-CZ 3.28Å; W686-F779 AromaticContact CE3-CE2 3.81Å; W686-F779 HydrophobicContact CE3-CE2 3.81Å; W686-F779 AromaticContact CE3-CZ 3.91Å; W686-F779 HydrophobicContact CE3-CZ 3.91Å; W686-F779 AromaticContact CG-CD2 3.55Å; W686-F779 HydrophobicContact CG-CD2 3.55Å; W686-F779 AromaticContact CG-CE2 3.37Å; W686-F779 HydrophobicContact CG-CE2 3.37Å; W686-F779 HydrophobicContact CG-CG 4.42Å; W686-F779 HydrophobicContact CG-CZ 4.13Å; W686-F779 HydrophobicContact CH2-CE1 4.35Å; W686-F779 HydrophobicContact CH2-CE2 4.5Å; W686-F779 AromaticContact CH2-CZ 3.81Å; W686-F779 HydrophobicContact CH2-CZ 3.81Å; W686-F779 HydrophobicContact CZ2-CD1 4.47Å; W686-F779 AromaticContact CZ2-CE1 3.69Å; W686-F779 HydrophobicContact CZ2-CE1 3.69Å; W686-F779 HydrophobicContact CZ2-CE2 4.06Å; W686-F779 AromaticContact CZ2-CZ 3.45Å; W686-F779 HydrophobicContact CZ2-CZ 3.45Å; W686-F779 VanDerWaalsContact CZ2-CZ 3.45Å; W686-F779 HydrophobicContact CZ3-CE2 4.37Å; W686-F779 HydrophobicContact CZ3-CZ 4.01Å; W686-F779 AromaticContact NE1-CD1 3.75Å; W686-F779 AromaticContact NE1-CD2 3.43Å; W686-F779 AromaticContact NE1-CE1 3.78Å; W686-F779 AromaticContact NE1-CE2 3.47Å; W686-F779 AromaticContact NE1-CG 3.57Å; W686-F779 AromaticContact NE1-CZ 3.64Å; W686-F779 PolarHBondContact NE1-O 3.34Å; W686-F779 VanDerWaalsContact NE1-O 3.07Å; W686-N782 HydrophobicContact CZ2-CB 4.24Å; W686-N782 PolarHBondContact O-ND2 2.97Å; W686-L786 HydrophobicContact CH2-CD2 3.91Å
687	T	94.9	Very high	94	Very high	64 Å²	64	57.6 Å²	57.6	39%	0.393	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.3	9	179.1	65.6	0	0	0	0	113.4	I683 Q685	I683-T687 HydrophobicContact CG2-CG2 4.09Å; I683-T687 WeakPolarHBondContact O-CG2 3.34Å; I683-T687 PolarHBondContact O-N 3.15Å; I683-T687 PolarHBondContact O-OG1 3.24Å; Q685-T687 VanDerWaalsContact C-N 3.32Å; Q685-T687 PolarHBondContact O-N 3.06Å
688	S	95.8	Very high	94	Very high	38 Å²	38	54 Å²	54	27%	0.266	29%	0.291	S	S	.	.	S	Bend	trans	-64.7	151.1	175.2	66.1	0	0	0	0	111.4	T684 Q685 W686 E690 M691 T692	T684-S688 PolarHBondContact O-N 2.97Å; Q685-S688 WeakPolarHBondContact O-CB 3.47Å; Q685-S688 PolarHBondContact O-N 3.46Å; Q685-S688 PolarHBondContact O-OG 2.91Å; W686-S688 VanDerWaalsContact C-N 3.33Å; S688-E690 VanDerWaalsContact C-N 3.28Å; S688-E690 PolarHBondContact O-N 3.03Å; S688-M691 PolarHBondContact O-N 2.74Å; S688-M691 WeakPolarHBondContact OG-CB 3.44Å; S688-M691 PolarHBondContact OG-N 2.95Å; S688-T692 WeakPolarHBondContact O-CB 3.31Å; S688-T692 PolarHBondContact O-N 3.25Å; S688-T692 PolarHBondContact O-OG1 3.26Å
689	E	94	Very high	94.1	Very high	181 Å²	181	56.5 Å²	56.5	85%	0.846	31%	0.307	S	S	*	.	H	α-helix	trans	-61.6	-38.1	178.8	-67	-175	173.6	0	0	111.9	S693	E689-S693 WeakPolarHBondContact O-CB 3.32Å; E689-S693 PolarHBondContact O-N 3.07Å
690	E	93.3	Very high	94.1	Very high	143 Å²	143	61.2 Å²	61.2	67%	0.668	33%	0.327	S	S	*	.	H	α-helix	trans	-60.9	-53.5	175.9	-176.3	-179.2	179	0	0	111	S688 T692 S693 V694	S688-E690 VanDerWaalsContact C-N 3.28Å; S688-E690 PolarHBondContact O-N 3.03Å; E690-T692 VanDerWaalsContact C-N 3.35Å; E690-T692 PolarHBondContact O-N 3Å; E690-S693 PolarHBondContact O-N 3.26Å; E690-V694 WeakPolarHBondContact O-CG2 3.46Å; E690-V694 PolarHBondContact O-N 3.48Å
691	M	94.2	Very high	94.3	Very high	11 Å²	11	59 Å²	59	5%	0.054	31%	0.31	C	S	.	.	H	α-helix	trans	-62.1	-43.6	179.4	-173.8	58	63.1	0	0	111.1	Q685 S688 S693 V694 L695 F704 L728	Q685-M691 WeakPolarHBondContact O-CB 3.49Å; S688-M691 PolarHBondContact O-N 2.74Å; S688-M691 WeakPolarHBondContact OG-CB 3.44Å; S688-M691 PolarHBondContact OG-N 2.95Å; M691-S693 VanDerWaalsContact C-N 3.3Å; M691-S693 PolarHBondContact O-N 3.21Å; M691-V694 PolarHBondContact O-N 3.06Å; M691-V694 VanDerWaalsContact O-N 3.08Å; M691-L695 HydrophobicContact CG-CD1 3.69Å; M691-L695 HydrophobicContact CG-CG 4.01Å; M691-L695 VanDerWaalsContact O-CG 3.25Å; M691-L695 WeakPolarHBondContact O-CG 3.47Å; M691-L695 PolarHBondContact O-N 2.87Å; M691-L695 HydrophobicContact SD-CD1 3.98Å; M691-L695 HydrophobicContact SD-CD2 3.89Å; M691-L695 HydrophobicContact SD-CG 3.78Å; M691-F704 HydrophobicContact CE-CE1 4.34Å; M691-F704 HydrophobicContact CE-CZ 3.93Å; M691-L728 HydrophobicContact SD-CD1 4.05Å
692	T	94.4	Very high	94.4	Very high	47 Å²	47	54.9 Å²	54.9	29%	0.288	28%	0.283	S	S	.	.	H	α-helix	trans	-57.5	-43.7	176.9	-56.5	0	0	0	0	111.4	S688 E690 W696 N782	S688-T692 WeakPolarHBondContact O-CB 3.31Å; S688-T692 PolarHBondContact O-N 3.25Å; S688-T692 PolarHBondContact O-OG1 3.26Å; E690-T692 VanDerWaalsContact C-N 3.35Å; E690-T692 PolarHBondContact O-N 3Å; T692-W696 WeakPolarHBondContact O-CB 3.37Å; T692-W696 PolarHBondContact O-N 3.38Å; T692-N782 PolarHBondContact OG1-ND2 2.9Å
693	S	95	Very high	94.5	Very high	45 Å²	45	57.7 Å²	57.7	32%	0.315	30%	0.303	S	S	.	.	H	α-helix	trans	-64.6	-39.9	175	169.7	0	0	0	0	112.4	E689 E690 M691 D697 K700	E689-S693 WeakPolarHBondContact O-CB 3.32Å; E689-S693 PolarHBondContact O-N 3.07Å; E690-S693 PolarHBondContact O-N 3.26Å; M691-S693 VanDerWaalsContact C-N 3.3Å; M691-S693 PolarHBondContact O-N 3.21Å; S693-D697 PolarHBondContact O-N 2.73Å; S693-K700 WeakPolarHBondContact OG-CD 3.46Å; S693-K700 PolarHBondContact OG-NZ 3.48Å
694	V	95.7	Very high	94.4	Very high	12 Å²	12	58 Å²	58	7%	0.073	30%	0.303	C	S	.	.	H	α-helix	trans	-67	-45.1	179	168.1	0	0	0	0	111.3	E690 M691 W696 F701 F704	E690-V694 WeakPolarHBondContact O-CG2 3.46Å; E690-V694 PolarHBondContact O-N 3.48Å; M691-V694 PolarHBondContact O-N 3.06Å; M691-V694 VanDerWaalsContact O-N 3.08Å; V694-W696 VanDerWaalsContact C-N 3.27Å; V694-W696 PolarHBondContact O-N 3.39Å; V694-F701 HydrophobicContact CG1-CD2 4.22Å; V694-F701 WeakPolarHBondContact O-CB 3.49Å; V694-F704 HydrophobicContact CG1-CB 3.63Å; V694-F704 HydrophobicContact CG1-CD1 3.71Å; V694-F704 HydrophobicContact CG1-CD2 4.15Å; V694-F704 HydrophobicContact CG1-CE1 4.38Å; V694-F704 HydrophobicContact CG1-CG 3.56Å; V694-F704 HydrophobicContact CG2-CB 4.31Å; V694-F704 HydrophobicContact CG2-CD2 4.04Å; V694-F704 HydrophobicContact CG2-CG 4.22Å
695	L	95.9	Very high	94.4	Very high	0 Å²	0	53.3 Å²	53.3	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-72.5	-20	-176.9	-60.9	177	0	0	0	113.1	W686 M691 F701 L728 N782 A785 L786 T789	W686-L695 HydrophobicContact CD2-CD1 4.38Å; W686-L695 HydrophobicContact CE3-CD1 4.45Å; W686-L695 HydrophobicContact CH2-CD1 3.91Å; W686-L695 HydrophobicContact CZ2-CD1 3.8Å; W686-L695 HydrophobicContact CZ3-CD1 4.25Å; M691-L695 HydrophobicContact CG-CD1 3.69Å; M691-L695 HydrophobicContact CG-CG 4.01Å; M691-L695 VanDerWaalsContact O-CG 3.25Å; M691-L695 WeakPolarHBondContact O-CG 3.47Å; M691-L695 PolarHBondContact O-N 2.87Å; M691-L695 HydrophobicContact SD-CD1 3.98Å; M691-L695 HydrophobicContact SD-CD2 3.89Å; M691-L695 HydrophobicContact SD-CG 3.78Å; L695-F701 HydrophobicContact CD2-CE2 4.44Å; L695-L728 HydrophobicContact CD2-CD1 3.7Å; L695-N782 HydrophobicContact CD1-CB 3.83Å; L695-A785 CarbonylContact O-C 3.54Å; L695-L786 HydrophobicContact CB-CB 4.47Å; L695-L786 HydrophobicContact CD2-CB 4.17Å; L695-L786 HydrophobicContact CD2-CD1 3.87Å; L695-L786 HydrophobicContact CD2-CD2 4.23Å; L695-L786 HydrophobicContact CD2-CG 4.3Å; L695-T789 WeakPolarHBondContact O-CB 3.3Å; L695-T789 PolarHBondContact O-OG1 2.79Å
696	W	94	Very high	94.4	Very high	156 Å²	156	49.9 Å²	49.9	59%	0.591	26%	0.258	S	S	*	.	H	α-helix	trans	-88.6	-31.7	-178.6	-167.2	-81.1	0	0	0	114	T692 V694 A785 R788 T789	T692-W696 WeakPolarHBondContact O-CB 3.37Å; T692-W696 PolarHBondContact O-N 3.38Å; V694-W696 VanDerWaalsContact C-N 3.27Å; V694-W696 PolarHBondContact O-N 3.39Å; W696-A785 HydrophobicContact CE3-CB 3.71Å; W696-A785 HydrophobicContact CZ3-CB 4.18Å; W696-R788 VanDerWaalsContact CE2-NH2 3.25Å; W696-R788 VanDerWaalsContact CZ2-NH2 3.33Å; W696-T789 PolarHBondContact O-OG1 3.3Å
697	D	94.6	Very high	94.1	Very high	51 Å²	51	49.9 Å²	49.9	27%	0.273	26%	0.258	S	S	.	.			trans	-107.2	113.4	-173.7	-178.1	-16.6	0	0	0	110.9	S693 V699 K700 F701	S693-D697 PolarHBondContact O-N 2.73Å; D697-V699 PolarHBondContact O-N 2.72Å; D697-V699 VanDerWaalsContact O-N 3.15Å; D697-V699 WeakPolarHBondContact OD1-CB 3.29Å; D697-V699 PolarHBondContact OD1-N 3.42Å; D697-K700 HydrophobicContact CB-CB 4.07Å; D697-K700 HydrophobicContact CB-CD 4.05Å; D697-K700 HydrophobicContact CB-CG 4.04Å; D697-K700 PolarHBondContact O-N 3.05Å; D697-K700 WeakPolarHBondContact OD2-CE 3.29Å; D697-K700 WeakPolarHBondContact OD2-CG 3.4Å; D697-F701 WeakPolarHBondContact O-CB 3.47Å; D697-F701 PolarHBondContact O-N 3.13Å
698	P	94.1	Very high	93.8	Very high	25 Å²	25	50.1 Å²	50.1	16%	0.162	26%	0.257	C	S	.	.	H	α-helix	trans	-52.9	-34.7	178.4	-26.9	34.3	0	0	0	114.7	L702 T789 L793	P698-L702 VanDerWaalsContact O-CG 3.3Å; P698-L702 WeakPolarHBondContact O-CG 3.45Å; P698-L702 PolarHBondContact O-N 2.89Å; P698-T789 HydrophobicContact CB-CG2 4.26Å; P698-T789 HydrophobicContact CG-CG2 4.14Å; P698-L793 HydrophobicContact CB-CD2 4.06Å
699	V	94.5	Very high	93.3	Very high	73 Å²	73	50.8 Å²	50.8	44%	0.442	26%	0.256	S	S	.	.	H	α-helix	trans	-74.2	-46.6	-177.7	-177.6	0	0	0	0	110.3	D697 F701 L702 S703	D697-V699 PolarHBondContact O-N 2.72Å; D697-V699 VanDerWaalsContact O-N 3.15Å; D697-V699 WeakPolarHBondContact OD1-CB 3.29Å; D697-V699 PolarHBondContact OD1-N 3.42Å; V699-F701 VanDerWaalsContact C-N 3.27Å; V699-F701 PolarHBondContact O-N 3.14Å; V699-L702 PolarHBondContact O-N 3.32Å; V699-S703 PolarHBondContact O-N 2.98Å; V699-S703 VanDerWaalsContact O-N 3.17Å
700	K	94.6	Very high	92.5	Very high	102 Å²	102	45.8 Å²	45.8	44%	0.443	24%	0.238	S	C	.	.	H	α-helix	trans	-63.8	-36.4	175.4	-64.8	-177.4	-168.2	-179.1	0	111.4	S693 D697 S703 F704	S693-K700 WeakPolarHBondContact OG-CD 3.46Å; S693-K700 PolarHBondContact OG-NZ 3.48Å; D697-K700 HydrophobicContact CB-CB 4.07Å; D697-K700 HydrophobicContact CB-CD 4.05Å; D697-K700 HydrophobicContact CB-CG 4.04Å; D697-K700 PolarHBondContact O-N 3.05Å; D697-K700 WeakPolarHBondContact OD2-CE 3.29Å; D697-K700 WeakPolarHBondContact OD2-CG 3.4Å; K700-S703 PolarHBondContact O-N 3.43Å; K700-F704 VanDerWaalsContact O-CB 3.25Å; K700-F704 WeakPolarHBondContact O-CB 3.49Å; K700-F704 PolarHBondContact O-N 2.69Å
701	F	96.3	Very high	91.5	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-60.1	-50.8	175.1	-176.4	-96.7	0	0	0	111.9	V694 L695 D697 V699 S703 F704 V705 L728 L786 T789 L793 F847 L850	V694-F701 HydrophobicContact CG1-CD2 4.22Å; V694-F701 WeakPolarHBondContact O-CB 3.49Å; L695-F701 HydrophobicContact CD2-CE2 4.44Å; D697-F701 WeakPolarHBondContact O-CB 3.47Å; D697-F701 PolarHBondContact O-N 3.13Å; V699-F701 VanDerWaalsContact C-N 3.27Å; V699-F701 PolarHBondContact O-N 3.14Å; F701-S703 VanDerWaalsContact C-N 3.3Å; F701-S703 PolarHBondContact O-N 2.85Å; F701-F704 PolarHBondContact O-N 2.95Å; F701-V705 HydrophobicContact CD1-CG2 4.49Å; F701-V705 HydrophobicContact CD2-CG1 4.49Å; F701-V705 HydrophobicContact CE1-CG1 4Å; F701-V705 HydrophobicContact CE1-CG2 4.22Å; F701-V705 HydrophobicContact CE2-CG1 3.98Å; F701-V705 HydrophobicContact CZ-CG1 3.71Å; F701-V705 WeakPolarHBondContact O-CG2 3.27Å; F701-V705 PolarHBondContact O-N 3.48Å; F701-L728 HydrophobicContact CE2-CD2 3.72Å; F701-L728 HydrophobicContact CZ-CD2 4.09Å; F701-L786 HydrophobicContact CD2-CD1 4.25Å; F701-L786 HydrophobicContact CE2-CD1 3.65Å; F701-L786 HydrophobicContact CZ-CD1 4.08Å; F701-T789 HydrophobicContact CB-CG2 3.96Å; F701-T789 HydrophobicContact CD1-CG2 4.43Å; F701-T789 HydrophobicContact CG-CG2 4.09Å; F701-L793 HydrophobicContact CD1-CD1 3.93Å; F701-L793 HydrophobicContact CD1-CD2 4.38Å; F701-L793 HydrophobicContact CE1-CD1 3.85Å; F701-F847 HydrophobicContact CE1-CE1 4.02Å; F701-L850 HydrophobicContact CE2-CD2 4.49Å; F701-L850 HydrophobicContact CZ-CD2 3.71Å
702	L	94.1	Very high	89.9	Confident	3 Å²	3	44.5 Å²	44.5	2%	0.016	24%	0.237	C	C	.	.	H	α-helix	trans	-58.4	-42.1	179.3	-73.3	172.9	0	0	0	112.2	P698 V699 V705 G706 A707 L793 R801 L802	P698-L702 VanDerWaalsContact O-CG 3.3Å; P698-L702 WeakPolarHBondContact O-CG 3.45Å; P698-L702 PolarHBondContact O-N 2.89Å; V699-L702 PolarHBondContact O-N 3.32Å; L702-V705 WeakPolarHBondContact O-CG2 3.39Å; L702-G706 PolarHBondContact O-N 3.19Å; L702-A707 HydrophobicContact CD2-CB 3.8Å; L702-A707 PolarHBondContact O-N 3.27Å; L702-L793 HydrophobicContact CD1-CD2 4.23Å; L702-L793 HydrophobicContact CD2-CD2 3.96Å; L702-L793 HydrophobicContact CG-CD2 3.91Å; L702-R801 HydrophobicContact CD1-CB 3.98Å; L702-L802 HydrophobicContact CD2-CD2 4Å
703	S	92.9	Very high	87.9	Confident	66 Å²	66	51 Å²	51	46%	0.462	26%	0.264	S	S	.	.	H	α-helix	trans	-67.5	-41.9	176	-170.6	0	0	0	0	112.6	V699 K700 F701 V705 G706 D708	V699-S703 PolarHBondContact O-N 2.98Å; V699-S703 VanDerWaalsContact O-N 3.17Å; K700-S703 PolarHBondContact O-N 3.43Å; F701-S703 VanDerWaalsContact C-N 3.3Å; F701-S703 PolarHBondContact O-N 2.85Å; S703-V705 VanDerWaalsContact C-N 3.31Å; S703-V705 PolarHBondContact O-N 3.33Å; S703-G706 PolarHBondContact O-N 3.32Å; S703-G706 VanDerWaalsContact O-N 3.13Å; S703-D708 WeakPolarHBondContact CA-OD1 3.44Å; S703-D708 WeakPolarHBondContact CA-OD2 3.42Å; S703-D708 WeakPolarHBondContact CB-OD2 3.39Å
704	F	93.5	Very high	85.5	Confident	31 Å²	31	58.1 Å²	58.1	14%	0.136	29%	0.292	C	S	.	.	H	α-helix	trans	-61.8	-38.6	177.8	179.5	-98.9	0	0	0	112.6	M691 V694 K700 F701 N724	M691-F704 HydrophobicContact CE-CE1 4.34Å; M691-F704 HydrophobicContact CE-CZ 3.93Å; V694-F704 HydrophobicContact CG1-CB 3.63Å; V694-F704 HydrophobicContact CG1-CD1 3.71Å; V694-F704 HydrophobicContact CG1-CD2 4.15Å; V694-F704 HydrophobicContact CG1-CE1 4.38Å; V694-F704 HydrophobicContact CG1-CG 3.56Å; V694-F704 HydrophobicContact CG2-CB 4.31Å; V694-F704 HydrophobicContact CG2-CD2 4.04Å; V694-F704 HydrophobicContact CG2-CG 4.22Å; K700-F704 VanDerWaalsContact O-CB 3.25Å; K700-F704 WeakPolarHBondContact O-CB 3.49Å; K700-F704 PolarHBondContact O-N 2.69Å; F701-F704 PolarHBondContact O-N 2.95Å; F704-N724 HydrophobicContact CD1-CB 4.08Å; F704-N724 HydrophobicContact CD2-CB 4.42Å; F704-N724 HydrophobicContact CE1-CB 3.64Å; F704-N724 HydrophobicContact CE2-CB 4Å; F704-N724 HydrophobicContact CG-CB 4.45Å; F704-N724 HydrophobicContact CZ-CB 3.59Å; F704-N724 WeakPolarHBondContact O-CB 3.48Å; F704-N724 PolarHBondContact O-ND2 3.41Å
705	V	93.3	Very high	83.2	Confident	0 Å²	0	65.6 Å²	65.6	0%	0	32%	0.319	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.1	-3.4	176.9	-53.9	0	0	0	0	113.3	F701 L702 S703 A707 R725 F846 F847	F701-V705 HydrophobicContact CD1-CG2 4.49Å; F701-V705 HydrophobicContact CD2-CG1 4.49Å; F701-V705 HydrophobicContact CE1-CG1 4Å; F701-V705 HydrophobicContact CE1-CG2 4.22Å; F701-V705 HydrophobicContact CE2-CG1 3.98Å; F701-V705 HydrophobicContact CZ-CG1 3.71Å; F701-V705 WeakPolarHBondContact O-CG2 3.27Å; F701-V705 PolarHBondContact O-N 3.48Å; L702-V705 WeakPolarHBondContact O-CG2 3.39Å; S703-V705 VanDerWaalsContact C-N 3.31Å; S703-V705 PolarHBondContact O-N 3.33Å; V705-A707 HydrophobicContact CG2-CB 3.97Å; V705-R725 HydrophobicContact CB-CG 3.85Å; V705-R725 HydrophobicContact CG1-CG 4.24Å; V705-R725 WeakPolarHBondContact O-CD 3.47Å; V705-R725 PolarHBondContact O-NH1 2.85Å; V705-F846 HydrophobicContact CB-CE1 4.16Å; V705-F846 HydrophobicContact CG1-CE1 3.99Å; V705-F846 HydrophobicContact CG1-CZ 3.98Å; V705-F847 HydrophobicContact CG2-CZ 4.22Å
706	G	91.5	Very high	81	Confident	0 Å²	0	73.7 Å²	73.7	0%	0	36%	0.357	C	S	.	.	T	Hydrogen-bonded Turn	trans	66.5	31.9	178	0	0	0	0	0	114.7	L702 S703 D708 F806	L702-G706 PolarHBondContact O-N 3.19Å; S703-G706 PolarHBondContact O-N 3.32Å; S703-G706 VanDerWaalsContact O-N 3.13Å; G706-D708 VanDerWaalsContact C-N 3.31Å; G706-F806 WeakPolarHBondContact O-CE2 3.18Å
707	A	89.9	Confident	78.9	Confident	0 Å²	0	74.9 Å²	74.9	0%	0	37%	0.369	C	S	.	.	S	Bend	trans	-81.2	-13.1	176.7	0	0	0	0	0	113.1	L702 V705 L802 S803 M843 F847	L702-A707 HydrophobicContact CD2-CB 3.8Å; L702-A707 PolarHBondContact O-N 3.27Å; V705-A707 HydrophobicContact CG2-CB 3.97Å; A707-L802 HydrophobicContact CB-CD2 3.85Å; A707-S803 PolarHBondContact O-N 3.3Å; A707-M843 HydrophobicContact CB-CE 4.49Å; A707-F847 HydrophobicContact CB-CE2 4.46Å; A707-F847 HydrophobicContact CB-CZ 4.24Å
708	D	88.3	Confident	77.1	Confident	68 Å²	68	82.4 Å²	82.4	36%	0.364	39%	0.394	S	S	.	.	S	Bend	trans	-93.6	-5.7	174.2	59.7	-19.1	0	0	0	113	S703 G706	S703-D708 WeakPolarHBondContact CA-OD1 3.44Å; S703-D708 WeakPolarHBondContact CA-OD2 3.42Å; S703-D708 WeakPolarHBondContact CB-OD2 3.39Å; G706-D708 VanDerWaalsContact C-N 3.31Å
709	E	84.6	Confident	76	Confident	53 Å²	53	83.3 Å²	83.3	25%	0.248	40%	0.397	C	S	.	.	P	Polyproline II helix	trans	-80.6	134.1	178.4	-64.9	-172.6	163.3	0	0	112.2	F711 S803	E709-F711 HydrophobicContact CB-CE2 4.02Å; E709-S803 WeakPolarHBondContact O-CB 3.45Å; E709-S803 PolarHBondContact O-OG 3.03Å
710	V	78.6	Confident	75.1	Confident	75 Å²	75	84.1 Å²	84.1	46%	0.455	40%	0.402	S	S	.	.	P	Polyproline II helix	trans	-92.2	123.4	171.6	-179	0	0	0	0	109	T712	V710-T712 HydrophobicContact CG1-CG2 4.38Å
711	F	71.9	Confident	74.6	Confident	45 Å²	45	79.4 Å²	79.4	20%	0.197	38%	0.382	C	S	.	.	P	Polyproline II helix	trans	-97.3	120.5	174.8	-73.1	-89.8	0	0	0	110.1	E709 T805 F806 L839	E709-F711 HydrophobicContact CB-CE2 4.02Å; F711-T805 HydrophobicContact CB-CG2 4.31Å; F711-T805 HydrophobicContact CD2-CG2 4.47Å; F711-T805 PolarHBondContact N-OG1 3.41Å; F711-F806 AromaticContact CD2-CE2 3.83Å; F711-F806 HydrophobicContact CD2-CE2 3.83Å; F711-F806 AromaticContact CD2-CZ 3.87Å; F711-F806 HydrophobicContact CD2-CZ 3.87Å; F711-F806 AromaticContact CE2-CE2 3.69Å; F711-F806 HydrophobicContact CE2-CE2 3.69Å; F711-F806 AromaticContact CE2-CZ 3.8Å; F711-F806 HydrophobicContact CE2-CZ 3.8Å; F711-L839 HydrophobicContact CB-CD1 4.27Å; F711-L839 HydrophobicContact CD1-CD1 4.27Å; F711-L839 HydrophobicContact CG-CD1 4.11Å
712	T	60.5	Low	74	Confident	82 Å²	82	80.3 Å²	80.3	50%	0.503	39%	0.392	S	S	.	.			trans	-109.3	151.2	172.1	57.7	0	0	0	0	109.9	V710 Q714 R715	V710-T712 HydrophobicContact CG1-CG2 4.38Å; T712-Q714 PolarHBondContact O-N 3.21Å; T712-R715 PolarHBondContact O-N 3.02Å
713	E	52.7	Low	73.6	Confident	183 Å²	183	84.2 Å²	84.2	86%	0.855	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.5	-16.1	-177.7	-65.7	179.8	163.6	0	0	114.4
714	Q	44.7	Very low	73.4	Confident	195 Å²	195	83.7 Å²	83.7	91%	0.911	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.6	-4.8	178.7	-64.5	-177.9	-8.2	0	0	114.3	T712	T712-Q714 PolarHBondContact O-N 3.21Å
715	R	47	Very low	73.3	Confident	169 Å²	169	83.2 Å²	83.2	64%	0.638	41%	0.407	S	S	*	.			trans	-119.6	26.8	-171.7	-141.3	-176.5	-165	-156.4	2.8	113.1	T712 E717	T712-R715 PolarHBondContact O-N 3.02Å; R715-E717 PolarHBondContact O-N 3.19Å
716	E	50.3	Low	72.9	Confident	171 Å²	171	84 Å²	84	80%	0.799	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.9	-12.8	-174.5	-73.3	-168.1	149.3	0	0	115.1
717	E	48.9	Very low	72.8	Confident	180 Å²	180	86.3 Å²	86.3	84%	0.841	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85	-18.5	-162.6	-72.6	-167.2	160.6	0	0	117.2	R715	R715-E717 PolarHBondContact O-N 3.19Å
718	R	57.3	Low	72.9	Confident	210 Å²	210	86.3 Å²	86.3	79%	0.792	43%	0.425	S	S	*	.			trans	-151.3	103.7	173.6	-63	-174	-150.1	-159.3	6	114.1	T720	R718-T720 VanDerWaalsContact C-N 3.29Å; R718-T720 HydrophobicContact CB-CG2 4.37Å; R718-T720 PolarHBondContact O-N 3.15Å
719	D	70.7	Confident	73	Confident	44 Å²	44	84 Å²	84	24%	0.235	41%	0.414	C	S	.	.			trans	-64.9	87.2	158.4	173.9	18.6	0	0	0	109.6	A721 G722 R725	D719-A721 VanDerWaalsContact C-N 3.25Å; D719-A721 PolarHBondContact O-N 3.3Å; D719-G722 PolarHBondContact O-N 3.31Å; D719-G722 PolarHBondContact OD1-N 2.99Å; D719-G722 WeakPolarHBondContact OD2-CA 3.48Å; D719-R725 IonicContact OD1-CZ 3.97Å; D719-R725 IonicContact OD1-NH1 3.47Å; D719-R725 PolarHBondContact OD1-NH1 3.49Å; D719-R725 IonicContact OD1-NH2 3.93Å; D719-R725 PolarHBondContact OD1-NH2 3.26Å; D719-R725 IonicContact OD2-CZ 2.61Å; D719-R725 IonicContact OD2-NH2 3.46Å; D719-R725 PolarHBondContact OD2-NH2 2.94Å
720	T	76.3	Confident	73.3	Confident	90 Å²	90	82.5 Å²	82.5	55%	0.552	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.9	-27.2	-175.4	37.4	0	0	0	0	113.1	R718	R718-T720 VanDerWaalsContact C-N 3.29Å; R718-T720 HydrophobicContact CB-CG2 4.37Å; R718-T720 PolarHBondContact O-N 3.15Å
721	A	84.5	Confident	74	Confident	2 Å²	2	79 Å²	79	2%	0.017	39%	0.386	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.4	-8.3	177.5	0	0	0	0	0	113.6	D719 N724 R725	D719-A721 VanDerWaalsContact C-N 3.25Å; D719-A721 PolarHBondContact O-N 3.3Å; A721-N724 WeakPolarHBondContact O-CB 3.36Å; A721-N724 PolarHBondContact O-N 3.1Å; A721-N724 VanDerWaalsContact O-N 3.17Å; A721-R725 PolarHBondContact O-N 3.24Å
722	G	83.3	Confident	75	Confident	20 Å²	20	76.9 Å²	76.9	21%	0.206	38%	0.376	C	S	.	.	H	α-helix	trans	-53.9	-49.7	176.3	0	0	0	0	0	114.1	D719 N724 R725 G726	D719-G722 PolarHBondContact O-N 3.31Å; D719-G722 PolarHBondContact OD1-N 2.99Å; D719-G722 WeakPolarHBondContact OD2-CA 3.48Å; G722-N724 VanDerWaalsContact C-N 3.34Å; G722-N724 PolarHBondContact O-N 2.78Å; G722-R725 PolarHBondContact O-N 2.71Å; G722-G726 PolarHBondContact O-N 2.91Å
723	P	84.6	Confident	76.5	Confident	84 Å²	84	75.5 Å²	75.5	55%	0.545	36%	0.362	S	S	.	.	H	α-helix	trans	-59.1	-40.5	174.3	-25.6	35.5	0	0	0	113.2	G726 Q727	P723-G726 PolarHBondContact O-N 3.48Å; P723-Q727 WeakPolarHBondContact O-CB 3.1Å; P723-Q727 PolarHBondContact O-N 2.62Å
724	N	89.8	Confident	78.3	Confident	56 Å²	56	66.9 Å²	66.9	30%	0.299	32%	0.322	S	S	.	.	H	α-helix	trans	-60.5	-48.1	178.1	-67	-9	0	0	0	111.6	F704 A721 G722 G726 Q727 L728	F704-N724 HydrophobicContact CD1-CB 4.08Å; F704-N724 HydrophobicContact CD2-CB 4.42Å; F704-N724 HydrophobicContact CE1-CB 3.64Å; F704-N724 HydrophobicContact CE2-CB 4Å; F704-N724 HydrophobicContact CG-CB 4.45Å; F704-N724 HydrophobicContact CZ-CB 3.59Å; F704-N724 WeakPolarHBondContact O-CB 3.48Å; F704-N724 PolarHBondContact O-ND2 3.41Å; A721-N724 WeakPolarHBondContact O-CB 3.36Å; A721-N724 PolarHBondContact O-N 3.1Å; A721-N724 VanDerWaalsContact O-N 3.17Å; G722-N724 VanDerWaalsContact C-N 3.34Å; G722-N724 PolarHBondContact O-N 2.78Å; N724-G726 VanDerWaalsContact C-N 3.35Å; N724-G726 PolarHBondContact O-N 2.87Å; N724-Q727 PolarHBondContact O-N 2.93Å; N724-L728 WeakPolarHBondContact O-CB 3.46Å; N724-L728 PolarHBondContact O-N 2.95Å
725	R	90.1	Very high	80.7	Confident	21 Å²	21	57.7 Å²	57.7	8%	0.079	28%	0.279	C	S	.	.	H	α-helix	trans	-61.9	-42.8	176	-68.2	-171.2	-62.8	-93.7	0.7	112	V705 D719 A721 G722 S729 F846	V705-R725 HydrophobicContact CB-CG 3.85Å; V705-R725 HydrophobicContact CG1-CG 4.24Å; V705-R725 WeakPolarHBondContact O-CD 3.47Å; V705-R725 PolarHBondContact O-NH1 2.85Å; D719-R725 IonicContact OD1-CZ 3.97Å; D719-R725 IonicContact OD1-NH1 3.47Å; D719-R725 PolarHBondContact OD1-NH1 3.49Å; D719-R725 IonicContact OD1-NH2 3.93Å; D719-R725 PolarHBondContact OD1-NH2 3.26Å; D719-R725 IonicContact OD2-CZ 2.61Å; D719-R725 IonicContact OD2-NH2 3.46Å; D719-R725 PolarHBondContact OD2-NH2 2.94Å; A721-R725 PolarHBondContact O-N 3.24Å; G722-R725 PolarHBondContact O-N 2.71Å; R725-S729 WeakPolarHBondContact O-CB 3.43Å; R725-S729 PolarHBondContact O-N 3.29Å; R725-S729 PolarHBondContact O-OG 3.45Å; R725-F846 HydrophobicContact CB-CD2 4.01Å; R725-F846 HydrophobicContact CB-CE2 3.73Å; R725-F846 HydrophobicContact CB-CZ 4Å; R725-F846 HydrophobicContact CG-CD1 4.36Å; R725-F846 HydrophobicContact CG-CD2 4.44Å; R725-F846 HydrophobicContact CG-CE1 4Å; R725-F846 HydrophobicContact CG-CE2 4.09Å; R725-F846 HydrophobicContact CG-CZ 3.84Å; R725-F846 WeakPolarHBondContact O-CE2 3.3Å
726	G	86.6	Confident	82.9	Confident	15 Å²	15	50.7 Å²	50.7	16%	0.155	25%	0.254	C	S	.	.	H	α-helix	trans	-62.1	-43.5	177.3	0	0	0	0	0	112.5	F648 G722 P723 N724 S729 F730	F648-G726 WeakPolarHBondContact CD2-O 2.88Å; F648-G726 VanDerWaalsContact CE2-CA 3.42Å; G722-G726 PolarHBondContact O-N 2.91Å; P723-G726 PolarHBondContact O-N 3.48Å; N724-G726 VanDerWaalsContact C-N 3.35Å; N724-G726 PolarHBondContact O-N 2.87Å; G726-S729 PolarHBondContact O-N 3.32Å; G726-F730 WeakPolarHBondContact O-CB 3.42Å; G726-F730 PolarHBondContact O-N 3Å
727	Q	87.8	Confident	84.9	Confident	49 Å²	49	42.8 Å²	42.8	23%	0.229	22%	0.218	C	C	.	.	H	α-helix	trans	-67.9	-43.1	179.3	-167.1	59.8	29.3	0	0	112.5	P723 N724 S729 F730 C731	P723-Q727 WeakPolarHBondContact O-CB 3.1Å; P723-Q727 PolarHBondContact O-N 2.62Å; N724-Q727 PolarHBondContact O-N 2.93Å; Q727-S729 VanDerWaalsContact C-N 3.32Å; Q727-S729 PolarHBondContact O-N 3.33Å; Q727-F730 WeakPolarHBondContact O-CB 3.37Å; Q727-F730 PolarHBondContact O-N 3.34Å; Q727-C731 PolarHBondContact O-N 3.49Å; Q727-C731 PolarHBondContact O-SG 2.86Å; Q727-C731 VanDerWaalsContact O-SG 3.38Å
728	L	91.8	Very high	87	Confident	0 Å²	0	34.2 Å²	34.2	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-60.3	-45.2	174.5	-174.9	72.4	0	0	0	111.2	W686 M691 L695 F701 N724 F730 C731 L732 F846 L850	W686-L728 HydrophobicContact CH2-CD1 4.17Å; W686-L728 HydrophobicContact CZ3-CD1 3.61Å; M691-L728 HydrophobicContact SD-CD1 4.05Å; L695-L728 HydrophobicContact CD2-CD1 3.7Å; F701-L728 HydrophobicContact CE2-CD2 3.72Å; F701-L728 HydrophobicContact CZ-CD2 4.09Å; N724-L728 WeakPolarHBondContact O-CB 3.46Å; N724-L728 PolarHBondContact O-N 2.95Å; L728-F730 VanDerWaalsContact C-N 3.32Å; L728-F730 PolarHBondContact O-N 3Å; L728-C731 PolarHBondContact O-N 3.38Å; L728-L732 PolarHBondContact O-N 3.16Å; L728-F846 HydrophobicContact CD2-CZ 4.08Å; L728-L850 HydrophobicContact CD2-CD1 3.61Å; L728-L850 HydrophobicContact CD2-CD2 3.95Å; L728-L850 HydrophobicContact CD2-CG 4.44Å; L728-L850 HydrophobicContact CG-CD1 3.93Å
729	S	91.4	Very high	88.8	Confident	19 Å²	19	24.2 Å²	24.2	13%	0.133	14%	0.141	C	C	.	.	H	α-helix	trans	-60	-44	176.2	-57.4	0	0	0	0	111	R725 G726 Q727 L732 Y733 F846	R725-S729 WeakPolarHBondContact O-CB 3.43Å; R725-S729 PolarHBondContact O-N 3.29Å; R725-S729 PolarHBondContact O-OG 3.45Å; G726-S729 PolarHBondContact O-N 3.32Å; Q727-S729 VanDerWaalsContact C-N 3.32Å; Q727-S729 PolarHBondContact O-N 3.33Å; S729-L732 PolarHBondContact O-N 3.12Å; S729-Y733 WeakPolarHBondContact O-CB 3.33Å; S729-Y733 WeakPolarHBondContact O-CD2 3.32Å; S729-Y733 PolarHBondContact O-N 2.91Å; S729-F846 WeakPolarHBondContact OG-CE2 3.47Å
730	F	90.2	Very high	89.8	Confident	23 Å²	23	25.9 Å²	25.9	10%	0.101	15%	0.146	C	C	.	.	H	α-helix	trans	-59.4	-47	178.3	178.9	-112	0	0	0	112.8	F648 K651 C652 M655 I682 G726 Q727 L728 L732 Y733 A734	F648-F730 HydrophobicContact CB-CB 3.97Å; F648-F730 HydrophobicContact CB-CD2 4.12Å; F648-F730 HydrophobicContact CB-CG 4.44Å; F648-F730 HydrophobicContact CD1-CB 3.4Å; F648-F730 HydrophobicContact CD1-CD1 4.36Å; F648-F730 AromaticContact CD1-CD2 3.73Å; F648-F730 HydrophobicContact CD1-CD2 3.73Å; F648-F730 AromaticContact CD1-CG 3.56Å; F648-F730 HydrophobicContact CD1-CG 3.56Å; F648-F730 HydrophobicContact CE1-CB 4Å; F648-F730 HydrophobicContact CE1-CG 4.18Å; F648-F730 HydrophobicContact CG-CB 3.84Å; F648-F730 HydrophobicContact CG-CD2 4.39Å; F648-F730 HydrophobicContact CG-CG 4.35Å; K651-F730 HydrophobicContact CB-CD2 4.34Å; K651-F730 HydrophobicContact CB-CE2 3.69Å; K651-F730 HydrophobicContact CD-CE2 4.43Å; C652-F730 WeakPolarHBondContact SG-CD2 3.48Å; C652-F730 VanDerWaalsContact SG-CE2 3.55Å; M655-F730 HydrophobicContact SD-CE2 4.1Å; M655-F730 HydrophobicContact SD-CZ 3.84Å; I682-F730 HydrophobicContact CD1-CE1 4.21Å; I682-F730 HydrophobicContact CD1-CZ 4.39Å; I682-F730 HydrophobicContact CG1-CE1 3.91Å; G726-F730 WeakPolarHBondContact O-CB 3.42Å; G726-F730 PolarHBondContact O-N 3Å; Q727-F730 WeakPolarHBondContact O-CB 3.37Å; Q727-F730 PolarHBondContact O-N 3.34Å; L728-F730 VanDerWaalsContact C-N 3.32Å; L728-F730 PolarHBondContact O-N 3Å; F730-L732 VanDerWaalsContact C-N 3.3Å; F730-L732 PolarHBondContact O-N 3.44Å; F730-Y733 PolarHBondContact O-N 3.47Å; F730-A734 HydrophobicContact CE2-CB 4.49Å; F730-A734 HydrophobicContact CZ-CB 4.49Å; F730-A734 WeakPolarHBondContact O-CB 3.35Å; F730-A734 PolarHBondContact O-N 2.96Å
731	C	93.1	Very high	90.7	Very high	1 Å²	1	23.6 Å²	23.6	1%	0.007	13%	0.127	C	C	.	.	H	α-helix	trans	-57.1	-44.2	178.1	-68	0	0	0	0	111.8	I682 W686 Q727 L728 M735	I682-C731 HydrophobicContact CG2-CB 4.08Å; W686-C731 HydrophobicContact CE3-CB 3.55Å; W686-C731 HydrophobicContact CZ3-CB 3.86Å; Q727-C731 PolarHBondContact O-N 3.49Å; Q727-C731 PolarHBondContact O-SG 2.86Å; Q727-C731 VanDerWaalsContact O-SG 3.38Å; L728-C731 PolarHBondContact O-N 3.38Å; C731-M735 WeakPolarHBondContact O-CB 3.48Å; C731-M735 PolarHBondContact O-N 2.85Å
732	L	93.6	Very high	91.1	Very high	0 Å²	0	23.5 Å²	23.5	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-68.6	-48.1	178.1	-71.5	166.7	0	0	0	112.4	W686 L728 S729 F730 A734 M735 L736 F779 L783 L786 L850 N853 I857	W686-L732 HydrophobicContact CH2-CD2 3.74Å; W686-L732 HydrophobicContact CH2-CG 4.01Å; W686-L732 HydrophobicContact CZ2-CD2 4.33Å; W686-L732 HydrophobicContact CZ3-CD2 4.37Å; W686-L732 HydrophobicContact CZ3-CG 4.21Å; L728-L732 PolarHBondContact O-N 3.16Å; S729-L732 PolarHBondContact O-N 3.12Å; F730-L732 VanDerWaalsContact C-N 3.3Å; F730-L732 PolarHBondContact O-N 3.44Å; L732-A734 VanDerWaalsContact C-N 3.32Å; L732-A734 PolarHBondContact O-N 2.95Å; L732-M735 PolarHBondContact O-N 3.23Å; L732-L736 VanDerWaalsContact O-CB 3.29Å; L732-L736 WeakPolarHBondContact O-CB 3.4Å; L732-L736 PolarHBondContact O-N 3.42Å; L732-F779 HydrophobicContact CD2-CE1 4.1Å; L732-F779 HydrophobicContact CD2-CZ 3.97Å; L732-L783 HydrophobicContact CD2-CD1 3.95Å; L732-L786 HydrophobicContact CD1-CD2 3.93Å; L732-L786 HydrophobicContact CD2-CD2 4.44Å; L732-L850 HydrophobicContact CD1-CD1 3.29Å; L732-L850 HydrophobicContact CD1-CG 4.12Å; L732-N853 HydrophobicContact CB-CB 4.48Å; L732-I857 HydrophobicContact CB-CD1 4.21Å; L732-I857 HydrophobicContact CD2-CD1 3.62Å; L732-I857 WeakPolarHBondContact O-CD1 3.32Å
733	Y	91.1	Very high	91.6	Very high	54 Å²	54	28.8 Å²	28.8	21%	0.212	14%	0.14	C	C	.	.	H	α-helix	trans	-61.9	-40.1	178.7	-78.4	-59.5	0	0	0	112.2	L649 C652 S729 F730 L736 A737 S849 N853	L649-Y733 HydrophobicContact CD1-CD1 4.11Å; L649-Y733 HydrophobicContact CD1-CD2 4.36Å; L649-Y733 HydrophobicContact CD1-CE1 3.92Å; L649-Y733 HydrophobicContact CD1-CE2 4.21Å; L649-Y733 HydrophobicContact CD1-CG 4.34Å; C652-Y733 WeakPolarHBondContact SG-CB 3.36Å; S729-Y733 WeakPolarHBondContact O-CB 3.33Å; S729-Y733 WeakPolarHBondContact O-CD2 3.32Å; S729-Y733 PolarHBondContact O-N 2.91Å; F730-Y733 PolarHBondContact O-N 3.47Å; Y733-L736 PolarHBondContact O-N 3.01Å; Y733-A737 WeakPolarHBondContact O-CB 3.49Å; Y733-A737 PolarHBondContact O-N 3.32Å; Y733-S849 WeakPolarHBondContact OH-CB 3.42Å; Y733-N853 WeakPolarHBondContact CE1-ND2 3.45Å; Y733-N853 WeakPolarHBondContact CE1-OD1 3.39Å; Y733-N853 PolarHBondContact OH-ND2 3.45Å
734	A	92.1	Very high	92	Very high	1 Å²	1	27.4 Å²	27.4	1%	0.008	12%	0.124	C	C	.	.	H	α-helix	trans	-66.8	-44.2	177.9	0	0	0	0	0	111.4	M655 I682 F730 L732 L736 A737 V738	M655-A734 HydrophobicContact CE-CB 4.06Å; M655-A734 HydrophobicContact SD-CB 3.79Å; I682-A734 HydrophobicContact CD1-CB 3.41Å; I682-A734 VanDerWaalsContact CD1-CB 3.41Å; I682-A734 HydrophobicContact CG1-CB 4.32Å; F730-A734 HydrophobicContact CE2-CB 4.49Å; F730-A734 HydrophobicContact CZ-CB 4.49Å; F730-A734 WeakPolarHBondContact O-CB 3.35Å; F730-A734 PolarHBondContact O-N 2.96Å; L732-A734 VanDerWaalsContact C-N 3.32Å; L732-A734 PolarHBondContact O-N 2.95Å; A734-L736 VanDerWaalsContact C-N 3.34Å; A734-L736 PolarHBondContact O-N 3.35Å; A734-A737 PolarHBondContact O-N 3.48Å; A734-V738 WeakPolarHBondContact O-CG2 3.45Å; A734-V738 PolarHBondContact O-N 2.84Å; A734-V738 VanDerWaalsContact O-N 3.1Å
735	M	94.6	Very high	92.2	Very high	2 Å²	2	25.2 Å²	25.2	1%	0.01	11%	0.112	C	C	.	.	H	α-helix	trans	-63.5	-42	175	-166.1	68.1	-141.5	0	0	111.3	I683 C731 L732 A737 V738 V739 Q775 F776 F779 I857	I683-M735 HydrophobicContact CD1-SD 4.41Å; C731-M735 WeakPolarHBondContact O-CB 3.48Å; C731-M735 PolarHBondContact O-N 2.85Å; L732-M735 PolarHBondContact O-N 3.23Å; M735-A737 PolarHBondContact O-N 3.46Å; M735-V738 PolarHBondContact O-N 3.12Å; M735-V739 HydrophobicContact CE-CG2 3.49Å; M735-V739 VanDerWaalsContact CE-CG2 3.49Å; M735-V739 HydrophobicContact CG-CG2 4.32Å; M735-V739 WeakPolarHBondContact O-CG2 3.23Å; M735-V739 PolarHBondContact O-N 3.37Å; M735-Q775 HydrophobicContact CE-CB 4.31Å; M735-F776 HydrophobicContact CE-CB 3.68Å; M735-F776 HydrophobicContact CE-CD2 4.08Å; M735-F776 HydrophobicContact CE-CG 4.39Å; M735-F779 HydrophobicContact CB-CD1 4.45Å; M735-F779 HydrophobicContact CB-CD2 4.3Å; M735-F779 HydrophobicContact CB-CE1 4.14Å; M735-F779 HydrophobicContact CB-CE2 3.97Å; M735-F779 HydrophobicContact CB-CZ 3.89Å; M735-F779 HydrophobicContact CG-CB 4.46Å; M735-F779 HydrophobicContact CG-CD1 3.82Å; M735-F779 HydrophobicContact CG-CD2 4.03Å; M735-F779 HydrophobicContact CG-CE1 3.99Å; M735-F779 HydrophobicContact CG-CE2 4.18Å; M735-F779 HydrophobicContact CG-CG 3.85Å; M735-F779 HydrophobicContact CG-CZ 4.17Å; M735-F779 HydrophobicContact SD-CB 4.17Å; M735-F779 HydrophobicContact SD-CD2 4.09Å; M735-F779 HydrophobicContact SD-CG 4.05Å; M735-I857 HydrophobicContact CB-CD1 4.49Å
736	L	93.4	Very high	92.2	Very high	22 Å²	22	29.2 Å²	29.2	12%	0.115	15%	0.15	C	C	.	.	H	α-helix	trans	-58.8	-45.8	175.6	178.9	56.2	0	0	0	111.8	L732 Y733 A734 V738 V739 K740 H856 I857	L732-L736 VanDerWaalsContact O-CB 3.29Å; L732-L736 WeakPolarHBondContact O-CB 3.4Å; L732-L736 PolarHBondContact O-N 3.42Å; Y733-L736 PolarHBondContact O-N 3.01Å; A734-L736 VanDerWaalsContact C-N 3.34Å; A734-L736 PolarHBondContact O-N 3.35Å; L736-V738 VanDerWaalsContact C-N 3.32Å; L736-V738 PolarHBondContact O-N 3.14Å; L736-V739 PolarHBondContact O-N 2.83Å; L736-K740 WeakPolarHBondContact O-CB 3.34Å; L736-K740 PolarHBondContact O-N 3.4Å; L736-H856 HydrophobicContact CD1-CB 3.83Å; L736-H856 HydrophobicContact CD2-CB 3.98Å; L736-I857 HydrophobicContact CB-CD1 4.28Å; L736-I857 HydrophobicContact CB-CG1 3.67Å; L736-I857 HydrophobicContact CD1-CG1 3.95Å; L736-I857 HydrophobicContact CG-CG1 4.32Å
737	A	91.4	Very high	92.4	Very high	5 Å²	5	32.4 Å²	32.4	4%	0.041	16%	0.164	C	C	.	.	H	α-helix	trans	-58.9	-44	177.2	0	0	0	0	0	111.7	E656 Y733 A734 M735 R741	E656-A737 HydrophobicContact CB-CB 3.96Å; E656-A737 HydrophobicContact CG-CB 4.22Å; Y733-A737 WeakPolarHBondContact O-CB 3.49Å; Y733-A737 PolarHBondContact O-N 3.32Å; A734-A737 PolarHBondContact O-N 3.48Å; M735-A737 PolarHBondContact O-N 3.46Å; A737-R741 VanDerWaalsContact O-CB 3.3Å; A737-R741 WeakPolarHBondContact O-CB 3.13Å; A737-R741 WeakPolarHBondContact O-CG 3.48Å; A737-R741 PolarHBondContact O-N 3.17Å; A737-R741 VanDerWaalsContact O-N 3.07Å
738	V	94.4	Very high	92.6	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-65.5	-50.5	178.6	174.1	0	0	0	0	111.3	V659 T679 A734 M735 L736 K740 R741 A742 C772	V659-V738 HydrophobicContact CG2-CG2 4.04Å; T679-V738 HydrophobicContact CG2-CG2 3.83Å; A734-V738 WeakPolarHBondContact O-CG2 3.45Å; A734-V738 PolarHBondContact O-N 2.84Å; A734-V738 VanDerWaalsContact O-N 3.1Å; M735-V738 PolarHBondContact O-N 3.12Å; L736-V738 VanDerWaalsContact C-N 3.32Å; L736-V738 PolarHBondContact O-N 3.14Å; V738-K740 VanDerWaalsContact C-N 3.34Å; V738-K740 PolarHBondContact O-N 2.91Å; V738-R741 PolarHBondContact O-N 2.82Å; V738-A742 WeakPolarHBondContact O-CB 3.39Å; V738-A742 PolarHBondContact O-N 2.89Å; V738-C772 HydrophobicContact CG1-CB 3.54Å
739	V	94.3	Very high	92.6	Very high	1 Å²	1	38 Å²	38	1%	0.006	19%	0.191	C	C	.	.	H	α-helix	trans	-62.5	-41.7	179.9	176.6	0	0	0	0	111.2	M735 L736 F776 N860 A864	M735-V739 HydrophobicContact CE-CG2 3.49Å; M735-V739 VanDerWaalsContact CE-CG2 3.49Å; M735-V739 HydrophobicContact CG-CG2 4.32Å; M735-V739 WeakPolarHBondContact O-CG2 3.23Å; M735-V739 PolarHBondContact O-N 3.37Å; L736-V739 PolarHBondContact O-N 2.83Å; V739-F776 HydrophobicContact CG2-CD2 3.65Å; V739-F776 HydrophobicContact CG2-CE2 4.32Å; V739-F776 HydrophobicContact CG2-CG 4.49Å; V739-N860 HydrophobicContact CG1-CB 3.92Å; V739-A864 HydrophobicContact CG1-CB 4Å; V739-A864 VanDerWaalsContact O-CB 3.25Å; V739-A864 WeakPolarHBondContact O-CB 3.45Å
740	K	92.1	Very high	92.7	Very high	79 Å²	79	40.6 Å²	40.6	34%	0.343	20%	0.201	S	C	.	.	H	α-helix	trans	-69	-35.3	-177.8	-173.3	179.2	179.5	179.2	0	112.6	L736 V738	L736-K740 WeakPolarHBondContact O-CB 3.34Å; L736-K740 PolarHBondContact O-N 3.4Å; V738-K740 VanDerWaalsContact C-N 3.34Å; V738-K740 PolarHBondContact O-N 2.91Å
741	R	93.8	Very high	92.8	Very high	42 Å²	42	39.5 Å²	39.5	16%	0.158	20%	0.196	C	C	.	.	H	α-helix	trans	-108.7	-26.8	-168.4	-59.8	-48.2	-172.7	177.4	0.9	115.9	E656 V659 L660 N663 A737 V738 R743	E656-R741 HydrophobicContact CG-CG 3.53Å; E656-R741 IonicContact OE1-CZ 2.69Å; E656-R741 IonicContact OE1-NE 3.79Å; E656-R741 PolarHBondContact OE1-NE 3.38Å; E656-R741 IonicContact OE1-NH2 2.92Å; E656-R741 PolarHBondContact OE1-NH2 3.21Å; V659-R741 HydrophobicContact CB-CB 4.34Å; V659-R741 HydrophobicContact CG1-CB 3.79Å; L660-R741 HydrophobicContact CD2-CB 4.14Å; L660-R741 HydrophobicContact CD2-CG 4.22Å; L660-R741 HydrophobicContact CG-CB 4.22Å; L660-R741 HydrophobicContact CG-CG 4.2Å; N663-R741 PolarHBondContact ND2-O 3.04Å; N663-R741 PolarHBondContact OD1-O 3.29Å; A737-R741 VanDerWaalsContact O-CB 3.3Å; A737-R741 WeakPolarHBondContact O-CB 3.13Å; A737-R741 WeakPolarHBondContact O-CG 3.48Å; A737-R741 PolarHBondContact O-N 3.17Å; A737-R741 VanDerWaalsContact O-N 3.07Å; V738-R741 PolarHBondContact O-N 2.82Å; R741-R743 PolarHBondContact O-N 3.3Å
742	A	94.8	Very high	92.8	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	22%	0.218	C	C	.	.			trans	-68.1	118	178.2	0	0	0	0	0	109.7	V659 L675 V738 N770 C772	V659-A742 HydrophobicContact CG1-CB 3.95Å; L675-A742 HydrophobicContact CD1-CB 3.92Å; V738-A742 WeakPolarHBondContact O-CB 3.39Å; V738-A742 PolarHBondContact O-N 2.89Å; A742-N770 PolarHBondContact O-ND2 2.92Å; A742-C772 HydrophobicContact CB-CB 4.12Å
743	R	92.6	Very high	92.8	Very high	131 Å²	131	49.5 Å²	49.5	49%	0.494	25%	0.254	S	S	.	.			trans	-143.8	153	-175.5	-65.7	-173.7	-178.3	-155.9	-2.1	111.3	N663 R741	N663-R743 PolarHBondContact OD1-N 3.28Å; N663-R743 PolarHBondContact OD1-O 3.24Å; R741-R743 PolarHBondContact O-N 3.3Å
744	W	92.9	Very high	92.9	Very high	54 Å²	54	47.5 Å²	47.5	21%	0.205	25%	0.249	C	C	.	.			trans	-77	164.1	167.8	52.6	85.8	0	0	0	111.5	F756 Y768 N770 A864 L866	W744-F756 HydrophobicContact CB-CB 3.8Å; W744-F756 HydrophobicContact CB-CD1 3.45Å; W744-F756 VanDerWaalsContact CB-CD1 3.45Å; W744-F756 HydrophobicContact CB-CD2 4.46Å; W744-F756 HydrophobicContact CB-CE1 4.09Å; W744-F756 HydrophobicContact CB-CG 3.66Å; W744-Y768 HydrophobicContact CB-CD1 4.43Å; W744-Y768 AromaticContact CD1-CD1 3.47Å; W744-Y768 VanDerWaalsContact CD1-CD1 3.47Å; W744-Y768 AromaticContact CD1-CE1 3.66Å; W744-Y768 AromaticContact CD1-CG 3.85Å; W744-Y768 HydrophobicContact CD2-CD1 4.07Å; W744-Y768 AromaticContact CD2-CG 3.87Å; W744-Y768 HydrophobicContact CD2-CG 3.87Å; W744-Y768 AromaticContact CE2-CD2 3.86Å; W744-Y768 AromaticContact CE2-CG 3.61Å; W744-Y768 AromaticContact CG-CD1 3.75Å; W744-Y768 HydrophobicContact CG-CD1 3.75Å; W744-Y768 HydrophobicContact CG-CE1 4.35Å; W744-Y768 HydrophobicContact CG-CG 4.06Å; W744-Y768 HydrophobicContact CZ2-CD2 4.09Å; W744-Y768 HydrophobicContact CZ2-CG 4.13Å; W744-Y768 AromaticContact NE1-CD1 3.66Å; W744-Y768 AromaticContact NE1-CD2 3.69Å; W744-Y768 AromaticContact NE1-CE1 3.89Å; W744-Y768 AromaticContact NE1-CE2 3.91Å; W744-Y768 AromaticContact NE1-CG 3.56Å; W744-Y768 AromaticContact NE1-CZ 4Å; W744-N770 HydrophobicContact CE3-CB 4.47Å; W744-N770 HydrophobicContact CZ3-CB 4.14Å; W744-A864 WeakPolarHBondContact CZ3-O 3.29Å; W744-L866 HydrophobicContact CH2-CD1 3.51Å; W744-L866 HydrophobicContact CH2-CG 3.83Å; W744-L866 HydrophobicContact CZ2-CD1 3.72Å; W744-L866 HydrophobicContact CZ2-CG 4.41Å; W744-L866 HydrophobicContact CZ3-CD1 4.46Å
745	P	93.6	Very high	93.1	Very high	10 Å²	10	48.6 Å²	48.6	7%	0.065	26%	0.261	C	S	.	.			trans	-59.6	141.6	174.6	-23.5	34.3	0	0	0	112.6	K666 D747 E750 A751 F756	K666-P745 HydrophobicContact CB-CG 4.03Å; K666-P745 HydrophobicContact CG-CG 4.1Å; P745-D747 VanDerWaalsContact C-N 3.33Å; P745-E750 HydrophobicContact CB-CB 3.86Å; P745-E750 HydrophobicContact CG-CB 4.33Å; P745-A751 HydrophobicContact CB-CB 4.44Å; P745-F756 HydrophobicContact CG-CD2 4.19Å; P745-F756 HydrophobicContact CG-CE2 4.05Å
746	A	89.9	Confident	93.1	Very high	106 Å²	106	48.5 Å²	48.5	88%	0.876	26%	0.261	S	S	*	.	S	Bend	trans	-70.7	-29.2	177.2	0	0	0	0	0	112.8
747	D	92.3	Very high	93.1	Very high	81 Å²	81	49 Å²	49	43%	0.433	27%	0.265	S	S	.	.	S	Bend	trans	-76.7	129.7	173.9	-178.2	-91.2	0	0	0	110.9	P745 E749 E750 A751	P745-D747 VanDerWaalsContact C-N 3.33Å; D747-E749 PolarHBondContact O-N 3.3Å; D747-E749 WeakPolarHBondContact OD1-CA 3.5Å; D747-E749 WeakPolarHBondContact OD1-CB 3.49Å; D747-E749 PolarHBondContact OD1-N 3.44Å; D747-E750 HydrophobicContact CB-CB 4.07Å; D747-E750 HydrophobicContact CB-CG 3.94Å; D747-E750 PolarHBondContact O-N 3.47Å; D747-E750 PolarHBondContact OD1-N 3.02Å; D747-A751 WeakPolarHBondContact O-CB 3.32Å; D747-A751 PolarHBondContact O-N 2.96Å
748	L	90.9	Very high	93	Very high	53 Å²	53	53 Å²	53	28%	0.277	29%	0.289	S	S	.	.	H	α-helix	trans	-66.9	-36	-174.7	179.2	60.8	0	0	0	112.8	A751 R752 V757 P766	L748-A751 PolarHBondContact O-N 3.07Å; L748-R752 WeakPolarHBondContact O-CB 3.28Å; L748-R752 WeakPolarHBondContact O-CG 3.41Å; L748-R752 PolarHBondContact O-N 2.94Å; L748-V757 HydrophobicContact CD1-CG2 4.11Å; L748-P766 HydrophobicContact CD1-CB 3.7Å; L748-P766 HydrophobicContact CD1-CG 3.79Å
749	E	92.3	Very high	92.6	Very high	114 Å²	114	54.3 Å²	54.3	53%	0.533	30%	0.302	S	S	.	.	H	α-helix	trans	-74.9	-39.3	-178.8	-65.6	-58.3	127.5	0	0	110.5	D747 A751 R752 A753	D747-E749 PolarHBondContact O-N 3.3Å; D747-E749 WeakPolarHBondContact OD1-CA 3.5Å; D747-E749 WeakPolarHBondContact OD1-CB 3.49Å; D747-E749 PolarHBondContact OD1-N 3.44Å; E749-A751 VanDerWaalsContact C-N 3.34Å; E749-A751 PolarHBondContact O-N 3.3Å; E749-R752 PolarHBondContact O-N 3.45Å; E749-R752 IonicContact OE1-CZ 2.71Å; E749-R752 IonicContact OE1-NH1 3.59Å; E749-R752 PolarHBondContact OE1-NH1 3.37Å; E749-A753 VanDerWaalsContact O-CB 3.3Å; E749-A753 WeakPolarHBondContact O-CB 3.41Å; E749-A753 PolarHBondContact O-N 2.95Å
750	E	93.2	Very high	92.2	Very high	73 Å²	73	57.8 Å²	57.8	34%	0.341	33%	0.325	S	S	.	.	H	α-helix	trans	-60.2	-43.5	169.4	-66.3	-173.2	157.5	0	0	111.6	K666 P745 D747 R752 A753 G754	K666-E750 WeakPolarHBondContact CD-OE2 3.41Å; K666-E750 WeakPolarHBondContact CE-OE2 3.33Å; K666-E750 IonicContact NZ-OE1 3.56Å; K666-E750 PolarHBondContact NZ-OE1 3.49Å; K666-E750 IonicContact NZ-OE2 3.61Å; K666-E750 PolarHBondContact NZ-OE2 3.17Å; P745-E750 HydrophobicContact CB-CB 3.86Å; P745-E750 HydrophobicContact CG-CB 4.33Å; D747-E750 HydrophobicContact CB-CB 4.07Å; D747-E750 HydrophobicContact CB-CG 3.94Å; D747-E750 PolarHBondContact O-N 3.47Å; D747-E750 PolarHBondContact OD1-N 3.02Å; E750-R752 PolarHBondContact O-N 3.45Å; E750-A753 PolarHBondContact O-N 3.05Å; E750-G754 PolarHBondContact O-N 3.48Å
751	A	93.3	Very high	91.7	Very high	0 Å²	0	55.5 Å²	55.5	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-64.7	-37.8	177.5	0	0	0	0	0	112.4	P745 D747 L748 E749 G755 F756 V757 Y768	P745-A751 HydrophobicContact CB-CB 4.44Å; D747-A751 WeakPolarHBondContact O-CB 3.32Å; D747-A751 PolarHBondContact O-N 2.96Å; L748-A751 PolarHBondContact O-N 3.07Å; E749-A751 VanDerWaalsContact C-N 3.34Å; E749-A751 PolarHBondContact O-N 3.3Å; A751-G755 PolarHBondContact O-N 3.45Å; A751-F756 HydrophobicContact CB-CB 4.25Å; A751-F756 WeakPolarHBondContact O-CB 3.43Å; A751-F756 PolarHBondContact O-N 3.48Å; A751-V757 HydrophobicContact CB-CG2 4.05Å; A751-Y768 HydrophobicContact CB-CD1 4.39Å; A751-Y768 HydrophobicContact CB-CE1 3.8Å
752	R	92.3	Very high	90.9	Very high	119 Å²	119	60.3 Å²	60.3	45%	0.449	35%	0.354	S	S	.	.	H	α-helix	trans	-67.1	-48.1	173.8	-77.5	173.7	178.1	167.6	-2.8	111.7	L748 E749 E750 G754 G755 V757	L748-R752 WeakPolarHBondContact O-CB 3.28Å; L748-R752 WeakPolarHBondContact O-CG 3.41Å; L748-R752 PolarHBondContact O-N 2.94Å; E749-R752 PolarHBondContact O-N 3.45Å; E749-R752 IonicContact OE1-CZ 2.71Å; E749-R752 IonicContact OE1-NH1 3.59Å; E749-R752 PolarHBondContact OE1-NH1 3.37Å; E750-R752 PolarHBondContact O-N 3.45Å; R752-G754 VanDerWaalsContact C-N 3.31Å; R752-G754 PolarHBondContact O-N 2.75Å; R752-G755 PolarHBondContact O-N 3.49Å; R752-G755 VanDerWaalsContact O-N 3.1Å; R752-V757 HydrophobicContact CG-CB 4.04Å; R752-V757 HydrophobicContact CG-CG1 4.49Å; R752-V757 HydrophobicContact CG-CG2 3.85Å
753	A	93.9	Very high	90	Very high	93 Å²	93	65 Å²	65	77%	0.769	39%	0.393	S	S	*	.	H	α-helix	trans	-61.8	-39.8	179.6	0	0	0	0	0	111.9	E749 E750 G755	E749-A753 VanDerWaalsContact O-CB 3.3Å; E749-A753 WeakPolarHBondContact O-CB 3.41Å; E749-A753 PolarHBondContact O-N 2.95Å; E750-A753 PolarHBondContact O-N 3.05Å; A753-G755 PolarHBondContact O-N 3.41Å
754	G	93.9	Very high	89.4	Confident	11 Å²	11	61.3 Å²	61.3	11%	0.113	40%	0.396	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.6	0.3	176	0	0	0	0	0	115	K666 F668 E750 R752	K666-G754 WeakPolarHBondContact O-CA 3.47Å; F668-G754 VanDerWaalsContact CB-O 3.28Å; F668-G754 WeakPolarHBondContact CB-O 3.48Å; F668-G754 PolarHBondContact N-O 3.46Å; E750-G754 PolarHBondContact O-N 3.48Å; R752-G754 VanDerWaalsContact C-N 3.31Å; R752-G754 PolarHBondContact O-N 2.75Å
755	G	94.9	Very high	89	Confident	25 Å²	25	61 Å²	61	26%	0.258	41%	0.405	S	S	.	.	T	Hydrogen-bonded Turn	trans	73.1	24.1	177.6	0	0	0	0	0	115.1	A751 R752 A753 R769	A751-G755 PolarHBondContact O-N 3.45Å; R752-G755 PolarHBondContact O-N 3.49Å; R752-G755 VanDerWaalsContact O-N 3.1Å; A753-G755 PolarHBondContact O-N 3.41Å; G755-R769 PolarHBondContact O-NE 2.95Å; G755-R769 PolarHBondContact O-NH2 3.04Å
756	F	95.1	Very high	88.7	Confident	0 Å²	0	62.3 Å²	62.3	0%	0	41%	0.413	C	S	.	.			trans	-84.8	-20.1	177.2	-65.7	-90.5	0	0	0	113.5	F668 W744 P745 A751 Y768 R769 P771	F668-F756 HydrophobicContact CB-CD1 4.16Å; F668-F756 HydrophobicContact CB-CD2 4.41Å; F668-F756 HydrophobicContact CB-CE1 4.06Å; F668-F756 HydrophobicContact CB-CE2 4.28Å; F668-F756 HydrophobicContact CB-CG 4.35Å; F668-F756 HydrophobicContact CB-CZ 4.11Å; F668-F756 AromaticContact CD2-CD1 3.95Å; F668-F756 HydrophobicContact CD2-CD1 3.95Å; F668-F756 HydrophobicContact CD2-CE1 4.12Å; W744-F756 HydrophobicContact CB-CB 3.8Å; W744-F756 HydrophobicContact CB-CD1 3.45Å; W744-F756 VanDerWaalsContact CB-CD1 3.45Å; W744-F756 HydrophobicContact CB-CD2 4.46Å; W744-F756 HydrophobicContact CB-CE1 4.09Å; W744-F756 HydrophobicContact CB-CG 3.66Å; P745-F756 HydrophobicContact CG-CD2 4.19Å; P745-F756 HydrophobicContact CG-CE2 4.05Å; A751-F756 HydrophobicContact CB-CB 4.25Å; A751-F756 WeakPolarHBondContact O-CB 3.43Å; A751-F756 PolarHBondContact O-N 3.48Å; F756-Y768 CarbonylContact O-C 3.55Å; F756-Y768 VanDerWaalsContact O-CA 3.31Å; F756-Y768 WeakPolarHBondContact O-CA 3.42Å; F756-R769 WeakPolarHBondContact O-CG 3.3Å; F756-R769 PolarHBondContact O-N 3.3Å; F756-P771 HydrophobicContact CD1-CG 4.36Å; F756-P771 HydrophobicContact CE1-CG 3.63Å
757	V	93.3	Very high	88.6	Confident	33 Å²	33	58.5 Å²	58.5	20%	0.2	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	116.8	179.8	-177.2	0	0	0	0	110	L748 A751 R752 G759 P766 I767 Y768	L748-V757 HydrophobicContact CD1-CG2 4.11Å; A751-V757 HydrophobicContact CB-CG2 4.05Å; R752-V757 HydrophobicContact CG-CB 4.04Å; R752-V757 HydrophobicContact CG-CG1 4.49Å; R752-V757 HydrophobicContact CG-CG2 3.85Å; V757-G759 WeakPolarHBondContact CG1-O 3.49Å; V757-P766 HydrophobicContact CG1-CB 4.14Å; V757-P766 HydrophobicContact CG2-CB 4.5Å; V757-I767 CarbonylContact C-O 3.58Å; V757-I767 WeakPolarHBondContact CA-O 3.49Å; V757-Y768 HydrophobicContact CG2-CD1 3.91Å; V757-Y768 HydrophobicContact CG2-CE1 3.7Å
758	V	89.6	Confident	88.6	Confident	89 Å²	89	56.4 Å²	56.4	54%	0.539	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	-17.5	179.7	-79.1	0	0	0	0	113.5	I767 R769	V758-I767 HydrophobicContact CG2-CB 4.15Å; V758-I767 HydrophobicContact CG2-CG2 3.61Å; V758-I767 WeakPolarHBondContact CG2-O 3.44Å; V758-I767 PolarHBondContact N-O 2.78Å; V758-R769 HydrophobicContact CG1-CB 4.18Å; V758-R769 HydrophobicContact CG1-CG 3.83Å
759	G	86.5	Confident	88.7	Confident	27 Å²	27	57.5 Å²	57.5	28%	0.278	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	179.7	-164.8	180	0	0	0	0	0	113.3	V757 I767	V757-G759 WeakPolarHBondContact CG1-O 3.49Å; G759-I767 PolarHBondContact O-N 3.4Å
760	C	84.9	Confident	88.8	Confident	73 Å²	73	52.2 Å²	52.2	49%	0.493	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	146.7	171.9	-64	0	0	0	0	110.2	A765	C760-A765 CarbonylContact C-O 3.47Å; C760-A765 WeakPolarHBondContact CA-O 3.45Å
761	T	81.8	Confident	88.9	Confident	32 Å²	32	48.8 Å²	48.8	20%	0.196	32%	0.324	C	S	.	.			trans	-68.4	165.6	172.9	68.4	0	0	0	0	110.6	A763 G764 A765 I767	T761-A763 PolarHBondContact O-N 2.97Å; T761-A763 VanDerWaalsContact O-N 3.1Å; T761-A763 PolarHBondContact OG1-N 3.26Å; T761-G764 PolarHBondContact O-N 3.17Å; T761-A765 HydrophobicContact CG2-CB 4.31Å; T761-A765 PolarHBondContact N-O 3.07Å; T761-A765 WeakPolarHBondContact OG1-CB 3.46Å; T761-A765 PolarHBondContact OG1-N 3.32Å; T761-A765 VanDerWaalsContact OG1-N 3.12Å; T761-I767 HydrophobicContact CG2-CD1 4.24Å; T761-I767 HydrophobicContact CG2-CG1 3.86Å
762	P	77.3	Confident	89	Confident	142 Å²	142	48.8 Å²	48.8	92%	0.922	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.3	-24.9	174.6	-25.6	35.4	0	0	0	113.9	G764	P762-G764 VanDerWaalsContact C-N 3.3Å
763	A	76.4	Confident	89.1	Confident	99 Å²	99	43.6 Å²	43.6	82%	0.818	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.8	1.8	175.2	0	0	0	0	0	113.7	T761	T761-A763 PolarHBondContact O-N 2.97Å; T761-A763 VanDerWaalsContact O-N 3.1Å; T761-A763 PolarHBondContact OG1-N 3.26Å
764	G	79.3	Confident	89	Confident	53 Å²	53	41.8 Å²	41.8	55%	0.546	29%	0.292	S	S	.	.	S	Bend	trans	85.3	7	178.6	0	0	0	0	0	115.4	T761 P762	T761-G764 PolarHBondContact O-N 3.17Å; P762-G764 VanDerWaalsContact C-N 3.3Å
765	A	84.3	Confident	89	Confident	47 Å²	47	42.2 Å²	42.2	39%	0.388	29%	0.291	S	S	.	.	P	Polyproline II helix	trans	-79	140	178.1	0	0	0	0	0	111.1	C760 T761	C760-A765 CarbonylContact C-O 3.47Å; C760-A765 WeakPolarHBondContact CA-O 3.45Å; T761-A765 HydrophobicContact CG2-CB 4.31Å; T761-A765 PolarHBondContact N-O 3.07Å; T761-A765 WeakPolarHBondContact OG1-CB 3.46Å; T761-A765 PolarHBondContact OG1-N 3.32Å; T761-A765 VanDerWaalsContact OG1-N 3.12Å
766	P	87.6	Confident	89.1	Confident	38 Å²	38	41 Å²	41	25%	0.247	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.4	140.9	179.6	28.3	-35.4	0	0	0	111.9	L748 V757 Y768	L748-P766 HydrophobicContact CD1-CB 3.7Å; L748-P766 HydrophobicContact CD1-CG 3.79Å; V757-P766 HydrophobicContact CG1-CB 4.14Å; V757-P766 HydrophobicContact CG2-CB 4.5Å; P766-Y768 HydrophobicContact CB-CE2 4.05Å; P766-Y768 HydrophobicContact CG-CE2 3.68Å; P766-Y768 WeakPolarHBondContact CG-OH 3.47Å
767	I	88.2	Confident	89.1	Confident	26 Å²	26	44.3 Å²	44.3	13%	0.133	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	118.4	173.3	-60	171	0	0	0	107.8	V757 V758 G759 T761 Q867	V757-I767 CarbonylContact C-O 3.58Å; V757-I767 WeakPolarHBondContact CA-O 3.49Å; V758-I767 HydrophobicContact CG2-CB 4.15Å; V758-I767 HydrophobicContact CG2-CG2 3.61Å; V758-I767 WeakPolarHBondContact CG2-O 3.44Å; V758-I767 PolarHBondContact N-O 2.78Å; G759-I767 PolarHBondContact O-N 3.4Å; T761-I767 HydrophobicContact CG2-CD1 4.24Å; T761-I767 HydrophobicContact CG2-CG1 3.86Å; I767-Q867 HydrophobicContact CG2-CG 4.27Å
768	Y	91.5	Very high	89.1	Confident	38 Å²	38	44.9 Å²	44.9	15%	0.149	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	153.1	179.4	-58.8	-83.1	0	0	0	111.8	W744 A751 F756 V757 P766 L866	W744-Y768 HydrophobicContact CB-CD1 4.43Å; W744-Y768 AromaticContact CD1-CD1 3.47Å; W744-Y768 VanDerWaalsContact CD1-CD1 3.47Å; W744-Y768 AromaticContact CD1-CE1 3.66Å; W744-Y768 AromaticContact CD1-CG 3.85Å; W744-Y768 HydrophobicContact CD2-CD1 4.07Å; W744-Y768 AromaticContact CD2-CG 3.87Å; W744-Y768 HydrophobicContact CD2-CG 3.87Å; W744-Y768 AromaticContact CE2-CD2 3.86Å; W744-Y768 AromaticContact CE2-CG 3.61Å; W744-Y768 AromaticContact CG-CD1 3.75Å; W744-Y768 HydrophobicContact CG-CD1 3.75Å; W744-Y768 HydrophobicContact CG-CE1 4.35Å; W744-Y768 HydrophobicContact CG-CG 4.06Å; W744-Y768 HydrophobicContact CZ2-CD2 4.09Å; W744-Y768 HydrophobicContact CZ2-CG 4.13Å; W744-Y768 AromaticContact NE1-CD1 3.66Å; W744-Y768 AromaticContact NE1-CD2 3.69Å; W744-Y768 AromaticContact NE1-CE1 3.89Å; W744-Y768 AromaticContact NE1-CE2 3.91Å; W744-Y768 AromaticContact NE1-CG 3.56Å; W744-Y768 AromaticContact NE1-CZ 4Å; A751-Y768 HydrophobicContact CB-CD1 4.39Å; A751-Y768 HydrophobicContact CB-CE1 3.8Å; F756-Y768 CarbonylContact O-C 3.55Å; F756-Y768 VanDerWaalsContact O-CA 3.31Å; F756-Y768 WeakPolarHBondContact O-CA 3.42Å; V757-Y768 HydrophobicContact CG2-CD1 3.91Å; V757-Y768 HydrophobicContact CG2-CE1 3.7Å; P766-Y768 HydrophobicContact CB-CE2 4.05Å; P766-Y768 HydrophobicContact CG-CE2 3.68Å; P766-Y768 WeakPolarHBondContact CG-OH 3.47Å; Y768-L866 HydrophobicContact CD2-CD1 4.31Å
769	R	92.4	Very high	89.4	Confident	75 Å²	75	40.7 Å²	40.7	28%	0.283	28%	0.279	S	S	.	.			trans	-115.4	142.7	166.4	57.1	172.4	176.9	172.7	9.1	110.4	F668 G755 F756 V758	F668-R769 VanDerWaalsContact CD1-CZ 3.48Å; F668-R769 HydrophobicContact CD2-CG 3.92Å; F668-R769 HydrophobicContact CE2-CB 4.3Å; F668-R769 HydrophobicContact CE2-CG 3.65Å; F668-R769 HydrophobicContact CZ-CG 4.28Å; G755-R769 PolarHBondContact O-NE 2.95Å; G755-R769 PolarHBondContact O-NH2 3.04Å; F756-R769 WeakPolarHBondContact O-CG 3.3Å; F756-R769 PolarHBondContact O-N 3.3Å; V758-R769 HydrophobicContact CG1-CB 4.18Å; V758-R769 HydrophobicContact CG1-CG 3.83Å
770	N	94.8	Very high	89.9	Confident	3 Å²	3	39.9 Å²	39.9	2%	0.016	27%	0.268	C	S	.	.			trans	-99.5	132.6	178.8	-162.4	-55.2	0	0	0	111.3	A742 W744 C772 A773 A864 L865	A742-N770 PolarHBondContact O-ND2 2.92Å; W744-N770 HydrophobicContact CE3-CB 4.47Å; W744-N770 HydrophobicContact CZ3-CB 4.14Å; N770-C772 PolarHBondContact O-N 3.27Å; N770-C772 VanDerWaalsContact O-N 3.12Å; N770-C772 PolarHBondContact OD1-N 2.8Å; N770-C772 PolarHBondContact OD1-SG 2.89Å; N770-A773 WeakPolarHBondContact O-CB 3.23Å; N770-A773 PolarHBondContact O-N 2.86Å; N770-A773 VanDerWaalsContact O-N 3.13Å; N770-A864 WeakPolarHBondContact CB-O 3.5Å; N770-A864 PolarHBondContact ND2-O 3.49Å; N770-L865 HydrophobicContact CB-CD2 3.66Å
771	P	95.2	Very high	90.4	Very high	2 Å²	2	40.2 Å²	40.2	1%	0.013	27%	0.269	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56	-24.4	175.2	-29	37.3	0	0	0	115.5	F668 Q671 K672 L675 F756 Q775	F668-P771 HydrophobicContact CD2-CG 3.8Å; F668-P771 HydrophobicContact CE2-CB 4.39Å; F668-P771 HydrophobicContact CE2-CG 4.06Å; Q671-P771 HydrophobicContact CB-CB 4.38Å; Q671-P771 HydrophobicContact CB-CG 4.21Å; Q671-P771 HydrophobicContact CG-CB 4.13Å; Q671-P771 HydrophobicContact CG-CG 4.08Å; K672-P771 HydrophobicContact CB-CB 4.13Å; L675-P771 HydrophobicContact CD1-CB 3.9Å; F756-P771 HydrophobicContact CD1-CG 4.36Å; F756-P771 HydrophobicContact CE1-CG 3.63Å; P771-Q775 PolarHBondContact O-OE1 2.76Å
772	C	95.5	Very high	91.1	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	26%	0.264	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.8	1.8	-179.9	77.4	0	0	0	0	114.9	L675 V738 A742 N770 A774 Q775 F776	L675-C772 HydrophobicContact CD1-CB 3.98Å; V738-C772 HydrophobicContact CG1-CB 3.54Å; A742-C772 HydrophobicContact CB-CB 4.12Å; N770-C772 PolarHBondContact O-N 3.27Å; N770-C772 VanDerWaalsContact O-N 3.12Å; N770-C772 PolarHBondContact OD1-N 2.8Å; N770-C772 PolarHBondContact OD1-SG 2.89Å; C772-A774 PolarHBondContact O-N 2.86Å; C772-Q775 PolarHBondContact O-N 2.7Å; C772-Q775 PolarHBondContact O-OE1 2.92Å; C772-F776 PolarHBondContact O-N 3.02Å
773	A	94.3	Very high	92.1	Very high	9 Å²	9	32.6 Å²	32.6	7%	0.074	22%	0.22	C	C	.	.	H	α-helix	trans	-58	-46	-173.8	0	0	0	0	0	112.6	N770 Q775 F776 L777 L865 D868	N770-A773 WeakPolarHBondContact O-CB 3.23Å; N770-A773 PolarHBondContact O-N 2.86Å; N770-A773 VanDerWaalsContact O-N 3.13Å; A773-Q775 PolarHBondContact O-N 3.22Å; A773-F776 PolarHBondContact O-N 3.12Å; A773-L777 WeakPolarHBondContact O-CB 3.44Å; A773-L777 VanDerWaalsContact O-CG 3.24Å; A773-L777 WeakPolarHBondContact O-CG 3.4Å; A773-L777 PolarHBondContact O-N 3.1Å; A773-L865 HydrophobicContact CB-CD2 4.06Å; A773-D868 HydrophobicContact CB-CB 4.07Å
774	A	92.9	Very high	93	Very high	56 Å²	56	29 Å²	29	46%	0.463	19%	0.186	S	C	.	.	H	α-helix	trans	-62.6	-40.9	-178.8	0	0	0	0	0	112.5	C772 L777 A778	C772-A774 PolarHBondContact O-N 2.86Å; A774-L777 PolarHBondContact O-N 3.41Å; A774-A778 PolarHBondContact O-N 2.86Å; A774-A778 VanDerWaalsContact O-N 3.07Å
775	Q	94.1	Very high	93.9	Very high	19 Å²	19	26.4 Å²	26.4	9%	0.089	16%	0.16	C	C	.	.	H	α-helix	trans	-63.9	-46.6	177.4	-70.1	62.1	38.7	0	0	110.7	D676 T679 I683 M735 P771 C772 A773 A778 F779	D676-Q775 PolarHBondContact OD1-NE2 3.01Å; T679-Q775 VanDerWaalsContact OG1-CG 3.22Å; T679-Q775 WeakPolarHBondContact OG1-CG 3.39Å; I683-Q775 HydrophobicContact CD1-CB 4.34Å; M735-Q775 HydrophobicContact CE-CB 4.31Å; P771-Q775 PolarHBondContact O-OE1 2.76Å; C772-Q775 PolarHBondContact O-N 2.7Å; C772-Q775 PolarHBondContact O-OE1 2.92Å; A773-Q775 PolarHBondContact O-N 3.22Å; Q775-A778 PolarHBondContact O-N 2.91Å; Q775-F779 WeakPolarHBondContact O-CB 3.4Å; Q775-F779 PolarHBondContact O-N 3.03Å
776	F	95.4	Very high	94.5	Very high	0 Å²	0	24.2 Å²	24.2	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-62.9	-44.8	178.7	177.3	-92.3	0	0	0	111.6	M735 V739 C772 A773 A778 F779 L780 I857 L858 A861 L865 F869	M735-F776 HydrophobicContact CE-CB 3.68Å; M735-F776 HydrophobicContact CE-CD2 4.08Å; M735-F776 HydrophobicContact CE-CG 4.39Å; V739-F776 HydrophobicContact CG2-CD2 3.65Å; V739-F776 HydrophobicContact CG2-CE2 4.32Å; V739-F776 HydrophobicContact CG2-CG 4.49Å; C772-F776 PolarHBondContact O-N 3.02Å; A773-F776 PolarHBondContact O-N 3.12Å; F776-A778 VanDerWaalsContact C-N 3.28Å; F776-A778 PolarHBondContact O-N 3.4Å; F776-F779 CarbonylContact O-C 3.49Å; F776-F779 WeakPolarHBondContact O-CA 3.36Å; F776-F779 WeakPolarHBondContact O-CB 3.06Å; F776-F779 PolarHBondContact O-N 2.85Å; F776-L780 HydrophobicContact CE1-CB 4.27Å; F776-L780 HydrophobicContact CE1-CD1 4.13Å; F776-L780 HydrophobicContact CE1-CD2 4.16Å; F776-L780 HydrophobicContact CE1-CG 4.42Å; F776-L780 HydrophobicContact CZ-CD1 3.95Å; F776-L780 WeakPolarHBondContact O-CB 3.49Å; F776-L780 PolarHBondContact O-N 3.34Å; F776-I857 HydrophobicContact CD2-CG2 4.36Å; F776-I857 HydrophobicContact CE2-CG2 3.73Å; F776-L858 HydrophobicContact CZ-CD2 4.42Å; F776-A861 HydrophobicContact CE1-CB 3.99Å; F776-A861 HydrophobicContact CE2-CB 3.75Å; F776-A861 HydrophobicContact CZ-CB 3.38Å; F776-L865 HydrophobicContact CB-CD1 3.86Å; F776-L865 HydrophobicContact CD1-CD1 3.26Å; F776-L865 HydrophobicContact CD2-CD1 4.35Å; F776-L865 HydrophobicContact CE1-CD1 3.86Å; F776-L865 HydrophobicContact CG-CD1 3.55Å; F776-F869 AromaticContact CE1-CD2 3.77Å; F776-F869 HydrophobicContact CE1-CD2 3.77Å; F776-F869 HydrophobicContact CE1-CE2 4.08Å; F776-F869 HydrophobicContact CZ-CD2 4.24Å; F776-F869 HydrophobicContact CZ-CE2 4.18Å
777	L	94.8	Very high	95	Very high	69 Å²	69	22.4 Å²	22.4	36%	0.361	13%	0.13	S	C	.	.	H	α-helix	trans	-62.2	-35.9	178.9	-69.5	174.8	0	0	0	112	A773 A774 F779 P781 V872	A773-L777 WeakPolarHBondContact O-CB 3.44Å; A773-L777 VanDerWaalsContact O-CG 3.24Å; A773-L777 WeakPolarHBondContact O-CG 3.4Å; A773-L777 PolarHBondContact O-N 3.1Å; A774-L777 PolarHBondContact O-N 3.41Å; L777-F779 VanDerWaalsContact C-N 3.34Å; L777-P781 WeakPolarHBondContact O-CD 3.33Å; L777-V872 HydrophobicContact CD2-CG2 3.46Å; L777-V872 VanDerWaalsContact CD2-CG2 3.46Å
778	A	94.9	Very high	95.4	Very high	46 Å²	46	23.5 Å²	23.5	38%	0.38	13%	0.132	S	C	.	.	H	α-helix	trans	-68.8	-31.5	171.8	0	0	0	0	0	112.9	I683 A774 Q775 F776	I683-A778 HydrophobicContact CG2-CB 4.27Å; A774-A778 PolarHBondContact O-N 2.86Å; A774-A778 VanDerWaalsContact O-N 3.07Å; Q775-A778 PolarHBondContact O-N 2.91Å; F776-A778 VanDerWaalsContact C-N 3.28Å; F776-A778 PolarHBondContact O-N 3.4Å
779	F	95.9	Very high	95.6	Very high	0 Å²	0	21.8 Å²	21.8	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-78.9	-31.9	-179.5	-167.3	-89.3	0	0	0	113.4	I683 W686 L732 M735 Q775 F776 L777 N782 L783 I857	I683-F779 HydrophobicContact CD1-CB 4.22Å; I683-F779 HydrophobicContact CD1-CD2 4.05Å; W686-F779 HydrophobicContact CB-CD2 4.18Å; W686-F779 HydrophobicContact CB-CE2 4.08Å; W686-F779 AromaticContact CD1-CD2 3.28Å; W686-F779 AromaticContact CD1-CE2 3.52Å; W686-F779 AromaticContact CD1-CG 3.77Å; W686-F779 AromaticContact CD2-CD2 3.91Å; W686-F779 HydrophobicContact CD2-CD2 3.91Å; W686-F779 HydrophobicContact CD2-CE1 4.41Å; W686-F779 AromaticContact CD2-CE2 3.26Å; W686-F779 HydrophobicContact CD2-CE2 3.26Å; W686-F779 AromaticContact CD2-CZ 3.56Å; W686-F779 HydrophobicContact CD2-CZ 3.56Å; W686-F779 AromaticContact CE2-CD2 3.88Å; W686-F779 AromaticContact CE2-CE1 3.7Å; W686-F779 AromaticContact CE2-CE2 3.39Å; W686-F779 AromaticContact CE2-CZ 3.28Å; W686-F779 AromaticContact CE3-CE2 3.81Å; W686-F779 HydrophobicContact CE3-CE2 3.81Å; W686-F779 AromaticContact CE3-CZ 3.91Å; W686-F779 HydrophobicContact CE3-CZ 3.91Å; W686-F779 AromaticContact CG-CD2 3.55Å; W686-F779 HydrophobicContact CG-CD2 3.55Å; W686-F779 AromaticContact CG-CE2 3.37Å; W686-F779 HydrophobicContact CG-CE2 3.37Å; W686-F779 HydrophobicContact CG-CG 4.42Å; W686-F779 HydrophobicContact CG-CZ 4.13Å; W686-F779 HydrophobicContact CH2-CE1 4.35Å; W686-F779 HydrophobicContact CH2-CE2 4.5Å; W686-F779 AromaticContact CH2-CZ 3.81Å; W686-F779 HydrophobicContact CH2-CZ 3.81Å; W686-F779 HydrophobicContact CZ2-CD1 4.47Å; W686-F779 AromaticContact CZ2-CE1 3.69Å; W686-F779 HydrophobicContact CZ2-CE1 3.69Å; W686-F779 HydrophobicContact CZ2-CE2 4.06Å; W686-F779 AromaticContact CZ2-CZ 3.45Å; W686-F779 HydrophobicContact CZ2-CZ 3.45Å; W686-F779 VanDerWaalsContact CZ2-CZ 3.45Å; W686-F779 HydrophobicContact CZ3-CE2 4.37Å; W686-F779 HydrophobicContact CZ3-CZ 4.01Å; W686-F779 AromaticContact NE1-CD1 3.75Å; W686-F779 AromaticContact NE1-CD2 3.43Å; W686-F779 AromaticContact NE1-CE1 3.78Å; W686-F779 AromaticContact NE1-CE2 3.47Å; W686-F779 AromaticContact NE1-CG 3.57Å; W686-F779 AromaticContact NE1-CZ 3.64Å; W686-F779 PolarHBondContact NE1-O 3.34Å; W686-F779 VanDerWaalsContact NE1-O 3.07Å; L732-F779 HydrophobicContact CD2-CE1 4.1Å; L732-F779 HydrophobicContact CD2-CZ 3.97Å; M735-F779 HydrophobicContact CB-CD1 4.45Å; M735-F779 HydrophobicContact CB-CD2 4.3Å; M735-F779 HydrophobicContact CB-CE1 4.14Å; M735-F779 HydrophobicContact CB-CE2 3.97Å; M735-F779 HydrophobicContact CB-CZ 3.89Å; M735-F779 HydrophobicContact CG-CB 4.46Å; M735-F779 HydrophobicContact CG-CD1 3.82Å; M735-F779 HydrophobicContact CG-CD2 4.03Å; M735-F779 HydrophobicContact CG-CE1 3.99Å; M735-F779 HydrophobicContact CG-CE2 4.18Å; M735-F779 HydrophobicContact CG-CG 3.85Å; M735-F779 HydrophobicContact CG-CZ 4.17Å; M735-F779 HydrophobicContact SD-CB 4.17Å; M735-F779 HydrophobicContact SD-CD2 4.09Å; M735-F779 HydrophobicContact SD-CG 4.05Å; Q775-F779 WeakPolarHBondContact O-CB 3.4Å; Q775-F779 PolarHBondContact O-N 3.03Å; F776-F779 CarbonylContact O-C 3.49Å; F776-F779 WeakPolarHBondContact O-CA 3.36Å; F776-F779 WeakPolarHBondContact O-CB 3.06Å; F776-F779 PolarHBondContact O-N 2.85Å; L777-F779 VanDerWaalsContact C-N 3.34Å; F779-N782 PolarHBondContact O-N 3.19Å; F779-L783 HydrophobicContact CD1-CB 3.95Å; F779-L783 HydrophobicContact CD1-CD2 4.35Å; F779-L783 HydrophobicContact CE1-CB 3.97Å; F779-L783 HydrophobicContact CE1-CD1 4.29Å; F779-L783 HydrophobicContact CE1-CD2 4.37Å; F779-L783 HydrophobicContact CE1-CG 4.44Å; F779-L783 PolarHBondContact O-N 3.44Å; F779-I857 HydrophobicContact CE1-CD1 4.43Å
780	L	96.1	Very high	95.7	Very high	11 Å²	11	18.5 Å²	18.5	6%	0.058	11%	0.114	C	C	.	.	H	α-helix	trans	-56.2	-44	-169.6	-179.8	63.5	0	0	0	115.1	F776 N782 L783 L784 L858 V872	F776-L780 HydrophobicContact CE1-CB 4.27Å; F776-L780 HydrophobicContact CE1-CD1 4.13Å; F776-L780 HydrophobicContact CE1-CD2 4.16Å; F776-L780 HydrophobicContact CE1-CG 4.42Å; F776-L780 HydrophobicContact CZ-CD1 3.95Å; F776-L780 WeakPolarHBondContact O-CB 3.49Å; F776-L780 PolarHBondContact O-N 3.34Å; L780-N782 VanDerWaalsContact C-N 3.35Å; L780-N782 PolarHBondContact O-N 3.43Å; L780-L783 WeakPolarHBondContact O-CB 3.46Å; L780-L783 PolarHBondContact O-N 2.93Å; L780-L784 HydrophobicContact CD1-CD1 4.15Å; L780-L784 HydrophobicContact CD1-CD2 4.38Å; L780-L784 HydrophobicContact CD1-CG 3.94Å; L780-L784 HydrophobicContact CG-CD1 4.13Å; L780-L784 HydrophobicContact CG-CG 4.34Å; L780-L784 WeakPolarHBondContact O-CG 3.24Å; L780-L784 PolarHBondContact O-N 3.48Å; L780-L858 HydrophobicContact CD1-CD2 3.77Å; L780-V872 HydrophobicContact CD2-CG1 4.25Å
781	P	95.9	Very high	95.7	Very high	79 Å²	79	18.4 Å²	18.4	51%	0.513	11%	0.113	S	C	.	.	H	α-helix	trans	-59.1	-44.1	-177.5	-26	35.7	0	0	0	113.2	L777 L784 A785	L777-P781 WeakPolarHBondContact O-CD 3.33Å; P781-L784 PolarHBondContact O-N 3.5Å; P781-A785 PolarHBondContact O-N 3.48Å
782	N	97	Very high	95.7	Very high	15 Å²	15	19 Å²	19	8%	0.08	12%	0.118	C	C	.	.	H	α-helix	trans	-75.9	-27.9	179.3	-82	-2.8	0	0	0	112.3	W686 T692 L695 F779 L780 A785 L786	W686-N782 HydrophobicContact CZ2-CB 4.24Å; W686-N782 PolarHBondContact O-ND2 2.97Å; T692-N782 PolarHBondContact OG1-ND2 2.9Å; L695-N782 HydrophobicContact CD1-CB 3.83Å; F779-N782 PolarHBondContact O-N 3.19Å; L780-N782 VanDerWaalsContact C-N 3.35Å; L780-N782 PolarHBondContact O-N 3.43Å; N782-A785 PolarHBondContact O-N 2.86Å; N782-L786 WeakPolarHBondContact O-CB 3.34Å; N782-L786 PolarHBondContact O-N 3.23Å
783	L	97.1	Very high	95.7	Very high	0 Å²	0	19.1 Å²	19.1	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-63.8	-47.1	169.4	176.5	62.2	0	0	0	111.5	L732 F779 L780 A785 L786 I787 C854 I857 L858	L732-L783 HydrophobicContact CD2-CD1 3.95Å; F779-L783 HydrophobicContact CD1-CB 3.95Å; F779-L783 HydrophobicContact CD1-CD2 4.35Å; F779-L783 HydrophobicContact CE1-CB 3.97Å; F779-L783 HydrophobicContact CE1-CD1 4.29Å; F779-L783 HydrophobicContact CE1-CD2 4.37Å; F779-L783 HydrophobicContact CE1-CG 4.44Å; F779-L783 PolarHBondContact O-N 3.44Å; L780-L783 WeakPolarHBondContact O-CB 3.46Å; L780-L783 PolarHBondContact O-N 2.93Å; L783-A785 VanDerWaalsContact C-N 3.33Å; L783-A785 PolarHBondContact O-N 3.46Å; L783-L786 PolarHBondContact O-N 3.32Å; L783-I787 HydrophobicContact CD1-CD1 4.22Å; L783-I787 HydrophobicContact CG-CD1 4.14Å; L783-I787 WeakPolarHBondContact O-CG1 3.33Å; L783-I787 PolarHBondContact O-N 2.93Å; L783-C854 HydrophobicContact CD1-CB 3.94Å; L783-I857 HydrophobicContact CD1-CD1 4.48Å; L783-I857 HydrophobicContact CD2-CB 4.15Å; L783-I857 HydrophobicContact CD2-CG2 3.56Å; L783-L858 HydrophobicContact CD2-CD2 3.73Å; L783-L858 HydrophobicContact CD2-CG 4.02Å
784	L	96.9	Very high	95.7	Very high	22 Å²	22	19.8 Å²	19.8	12%	0.115	12%	0.12	C	C	.	.	H	α-helix	trans	-62.9	-40.5	175.5	-70.2	178.8	0	0	0	111.4	L780 P781 I787 R788 L858 S882	L780-L784 HydrophobicContact CD1-CD1 4.15Å; L780-L784 HydrophobicContact CD1-CD2 4.38Å; L780-L784 HydrophobicContact CD1-CG 3.94Å; L780-L784 HydrophobicContact CG-CD1 4.13Å; L780-L784 HydrophobicContact CG-CG 4.34Å; L780-L784 WeakPolarHBondContact O-CG 3.24Å; L780-L784 PolarHBondContact O-N 3.48Å; P781-L784 PolarHBondContact O-N 3.5Å; L784-I787 PolarHBondContact O-N 3.45Å; L784-R788 PolarHBondContact O-N 2.93Å; L784-L858 HydrophobicContact CD2-CD1 4.34Å; L784-S882 WeakPolarHBondContact O-CB 3.46Å; L784-S882 PolarHBondContact O-OG 2.86Å
785	A	96.8	Very high	95.8	Very high	0 Å²	0	19.4 Å²	19.4	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-59.6	-46.3	173.9	0	0	0	0	0	112.3	L695 W696 P781 N782 L783 R788 T789	L695-A785 CarbonylContact O-C 3.54Å; W696-A785 HydrophobicContact CE3-CB 3.71Å; W696-A785 HydrophobicContact CZ3-CB 4.18Å; P781-A785 PolarHBondContact O-N 3.48Å; N782-A785 PolarHBondContact O-N 2.86Å; L783-A785 VanDerWaalsContact C-N 3.33Å; L783-A785 PolarHBondContact O-N 3.46Å; A785-R788 WeakPolarHBondContact O-CB 3.48Å; A785-R788 PolarHBondContact O-N 3.32Å; A785-T789 WeakPolarHBondContact O-CB 3.11Å; A785-T789 PolarHBondContact O-N 2.87Å; A785-T789 PolarHBondContact O-OG1 3.41Å; A785-T789 VanDerWaalsContact O-OG1 3.1Å
786	L	97.1	Very high	95.8	Very high	0 Å²	0	22.4 Å²	22.4	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-62.1	-44.2	177	177.4	56.9	0	0	0	112.1	W686 L695 F701 L732 N782 L783 R788 T789 Q790 L850	W686-L786 HydrophobicContact CH2-CD2 3.91Å; L695-L786 HydrophobicContact CB-CB 4.47Å; L695-L786 HydrophobicContact CD2-CB 4.17Å; L695-L786 HydrophobicContact CD2-CD1 3.87Å; L695-L786 HydrophobicContact CD2-CD2 4.23Å; L695-L786 HydrophobicContact CD2-CG 4.3Å; F701-L786 HydrophobicContact CD2-CD1 4.25Å; F701-L786 HydrophobicContact CE2-CD1 3.65Å; F701-L786 HydrophobicContact CZ-CD1 4.08Å; L732-L786 HydrophobicContact CD1-CD2 3.93Å; L732-L786 HydrophobicContact CD2-CD2 4.44Å; N782-L786 WeakPolarHBondContact O-CB 3.34Å; N782-L786 PolarHBondContact O-N 3.23Å; L783-L786 PolarHBondContact O-N 3.32Å; L786-R788 VanDerWaalsContact C-N 3.33Å; L786-R788 PolarHBondContact O-N 2.71Å; L786-T789 PolarHBondContact O-N 3.23Å; L786-Q790 HydrophobicContact CD1-CG 3.99Å; L786-Q790 HydrophobicContact CG-CG 4.38Å; L786-Q790 WeakPolarHBondContact O-CB 3.28Å; L786-Q790 VanDerWaalsContact O-CG 3.32Å; L786-Q790 WeakPolarHBondContact O-CG 3.05Å; L786-Q790 PolarHBondContact O-N 2.99Å; L786-L850 HydrophobicContact CD1-CD2 4.44Å
787	I	97.3	Very high	95.7	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-59.5	-45.8	177.3	-70.4	166.6	0	0	0	110.6	L783 L784 T789 Q790 N791 C854 F855 L858 A883	L783-I787 HydrophobicContact CD1-CD1 4.22Å; L783-I787 HydrophobicContact CG-CD1 4.14Å; L783-I787 WeakPolarHBondContact O-CG1 3.33Å; L783-I787 PolarHBondContact O-N 2.93Å; L784-I787 PolarHBondContact O-N 3.45Å; I787-T789 PolarHBondContact O-N 2.76Å; I787-Q790 PolarHBondContact O-N 2.89Å; I787-N791 PolarHBondContact O-N 2.89Å; I787-C854 HydrophobicContact CD1-CB 4.04Å; I787-C854 HydrophobicContact CG1-CB 3.65Å; I787-F855 HydrophobicContact CG2-CE1 4.16Å; I787-F855 HydrophobicContact CG2-CE2 4.47Å; I787-F855 HydrophobicContact CG2-CZ 3.72Å; I787-L858 HydrophobicContact CD1-CD1 3.35Å; I787-L858 HydrophobicContact CD1-CG 4.1Å; I787-A883 HydrophobicContact CG2-CB 4.21Å
788	R	97	Very high	95.6	Very high	49 Å²	49	25.6 Å²	25.6	19%	0.185	14%	0.143	C	C	.	.	H	α-helix	trans	-58.5	-49.7	176	-173.6	179.1	53.6	-108.1	-7.7	110.9	W696 L784 A785 L786 Q790 N791 S792 G881 T885	W696-R788 VanDerWaalsContact CE2-NH2 3.25Å; W696-R788 VanDerWaalsContact CZ2-NH2 3.33Å; L784-R788 PolarHBondContact O-N 2.93Å; A785-R788 WeakPolarHBondContact O-CB 3.48Å; A785-R788 PolarHBondContact O-N 3.32Å; L786-R788 VanDerWaalsContact C-N 3.33Å; L786-R788 PolarHBondContact O-N 2.71Å; R788-Q790 PolarHBondContact O-N 2.92Å; R788-N791 PolarHBondContact O-N 3.42Å; R788-S792 PolarHBondContact O-N 2.96Å; R788-S792 PolarHBondContact O-OG 3.31Å; R788-G881 WeakPolarHBondContact CD-O 3.28Å; R788-T885 HydrophobicContact CG-CG2 4.17Å
789	T	96.4	Very high	95.5	Very high	2 Å²	2	26 Å²	26	1%	0.012	14%	0.141	C	C	.	.	H	α-helix	trans	-58.9	-47.6	179.8	-67	0	0	0	0	111.4	L695 W696 P698 F701 A785 L786 I787 N791 S792 L793	L695-T789 WeakPolarHBondContact O-CB 3.3Å; L695-T789 PolarHBondContact O-OG1 2.79Å; W696-T789 PolarHBondContact O-OG1 3.3Å; P698-T789 HydrophobicContact CB-CG2 4.26Å; P698-T789 HydrophobicContact CG-CG2 4.14Å; F701-T789 HydrophobicContact CB-CG2 3.96Å; F701-T789 HydrophobicContact CD1-CG2 4.43Å; F701-T789 HydrophobicContact CG-CG2 4.09Å; A785-T789 WeakPolarHBondContact O-CB 3.11Å; A785-T789 PolarHBondContact O-N 2.87Å; A785-T789 PolarHBondContact O-OG1 3.41Å; A785-T789 VanDerWaalsContact O-OG1 3.1Å; L786-T789 PolarHBondContact O-N 3.23Å; I787-T789 PolarHBondContact O-N 2.76Å; T789-N791 PolarHBondContact O-N 3.42Å; T789-S792 CarbonylContact O-C 3.56Å; T789-S792 WeakPolarHBondContact O-CA 3.37Å; T789-S792 WeakPolarHBondContact O-CB 3.5Å; T789-S792 PolarHBondContact O-N 2.92Å; T789-S792 VanDerWaalsContact O-N 3.09Å; T789-L793 WeakPolarHBondContact O-CG 3.43Å; T789-L793 PolarHBondContact O-N 3.02Å
790	Q	94.9	Very high	95.3	Very high	7 Å²	7	30 Å²	30	3%	0.033	17%	0.174	C	C	.	.	H	α-helix	trans	-57.7	-45.5	177	-76.1	177.9	0.9	0	0	112.7	L786 I787 R788 S792 L793 F794 F851	L786-Q790 HydrophobicContact CD1-CG 3.99Å; L786-Q790 HydrophobicContact CG-CG 4.38Å; L786-Q790 WeakPolarHBondContact O-CB 3.28Å; L786-Q790 VanDerWaalsContact O-CG 3.32Å; L786-Q790 WeakPolarHBondContact O-CG 3.05Å; L786-Q790 PolarHBondContact O-N 2.99Å; I787-Q790 PolarHBondContact O-N 2.89Å; R788-Q790 PolarHBondContact O-N 2.92Å; Q790-S792 VanDerWaalsContact C-N 3.29Å; Q790-S792 PolarHBondContact O-N 3.42Å; Q790-L793 WeakPolarHBondContact O-CB 3.33Å; Q790-L793 PolarHBondContact O-N 3.24Å; Q790-L793 VanDerWaalsContact O-N 3.13Å; Q790-F794 WeakPolarHBondContact O-CD2 3.26Å; Q790-F794 WeakPolarHBondContact O-CE2 3.37Å; Q790-F851 HydrophobicContact CB-CD2 4.45Å
791	N	94.8	Very high	95.2	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-62.7	-38.4	176	-76.8	-18.4	0	0	0	111.8	I787 R788 T789 L793 F794 S882 A883 T885 V890	I787-N791 PolarHBondContact O-N 2.89Å; R788-N791 PolarHBondContact O-N 3.42Å; T789-N791 PolarHBondContact O-N 3.42Å; N791-L793 VanDerWaalsContact C-N 3.28Å; N791-L793 PolarHBondContact O-N 2.94Å; N791-F794 PolarHBondContact O-N 2.66Å; N791-S882 PolarHBondContact ND2-O 2.74Å; N791-S882 VanDerWaalsContact ND2-O 3.14Å; N791-A883 PolarHBondContact ND2-O 3.44Å; N791-T885 WeakPolarHBondContact CB-O 3.33Å; N791-V890 HydrophobicContact CB-CG2 4.3Å
792	S	95.4	Very high	95	Very high	16 Å²	16	31.7 Å²	31.7	11%	0.112	17%	0.171	C	C	.	.	H	α-helix	trans	-69.2	-21.9	175	-62.1	0	0	0	0	113.6	R788 T789 Q790 F794 M795 N798	R788-S792 PolarHBondContact O-N 2.96Å; R788-S792 PolarHBondContact O-OG 3.31Å; T789-S792 CarbonylContact O-C 3.56Å; T789-S792 WeakPolarHBondContact O-CA 3.37Å; T789-S792 WeakPolarHBondContact O-CB 3.5Å; T789-S792 PolarHBondContact O-N 2.92Å; T789-S792 VanDerWaalsContact O-N 3.09Å; Q790-S792 VanDerWaalsContact C-N 3.29Å; Q790-S792 PolarHBondContact O-N 3.42Å; S792-F794 PolarHBondContact O-N 2.89Å; S792-M795 WeakPolarHBondContact O-CB 3.34Å; S792-M795 WeakPolarHBondContact O-CG 3.28Å; S792-M795 PolarHBondContact O-N 2.98Å; S792-N798 PolarHBondContact O-ND2 3.47Å
793	L	94.9	Very high	94.7	Very high	2 Å²	2	31.3 Å²	31.3	1%	0.01	17%	0.169	C	C	.	.	H	α-helix	trans	-61.7	-26.9	177.6	-65.8	-177.2	0	0	0	113	P698 F701 L702 T789 Q790 N791 M795 N798 V799 Y810 F847	P698-L793 HydrophobicContact CB-CD2 4.06Å; F701-L793 HydrophobicContact CD1-CD1 3.93Å; F701-L793 HydrophobicContact CD1-CD2 4.38Å; F701-L793 HydrophobicContact CE1-CD1 3.85Å; L702-L793 HydrophobicContact CD1-CD2 4.23Å; L702-L793 HydrophobicContact CD2-CD2 3.96Å; L702-L793 HydrophobicContact CG-CD2 3.91Å; T789-L793 WeakPolarHBondContact O-CG 3.43Å; T789-L793 PolarHBondContact O-N 3.02Å; Q790-L793 WeakPolarHBondContact O-CB 3.33Å; Q790-L793 PolarHBondContact O-N 3.24Å; Q790-L793 VanDerWaalsContact O-N 3.13Å; N791-L793 VanDerWaalsContact C-N 3.28Å; N791-L793 PolarHBondContact O-N 2.94Å; L793-M795 VanDerWaalsContact C-N 3.26Å; L793-M795 PolarHBondContact O-N 3.48Å; L793-N798 WeakPolarHBondContact O-CB 3.35Å; L793-V799 WeakPolarHBondContact O-CG2 3.35Å; L793-Y810 HydrophobicContact CB-CE2 4.36Å; L793-F847 HydrophobicContact CD1-CE1 3.84Å
794	F	94.8	Very high	94.1	Very high	23 Å²	23	39.4 Å²	39.4	10%	0.101	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.1	-10.1	177.7	-58.2	-73	0	0	0	113.5	Q790 N791 S792 Y810 F851 H889 V890 P891 R894	Q790-F794 WeakPolarHBondContact O-CD2 3.26Å; Q790-F794 WeakPolarHBondContact O-CE2 3.37Å; N791-F794 PolarHBondContact O-N 2.66Å; S792-F794 PolarHBondContact O-N 2.89Å; F794-Y810 HydrophobicContact CD1-CD2 4.2Å; F794-Y810 HydrophobicContact CD1-CG 4.27Å; F794-Y810 HydrophobicContact CE1-CD1 4.33Å; F794-Y810 HydrophobicContact CE1-CD2 4.37Å; F794-Y810 AromaticContact CE1-CG 3.98Å; F794-Y810 HydrophobicContact CE1-CG 3.98Å; F794-F851 HydrophobicContact CE2-CE2 4.4Å; F794-H889 HydrophobicContact CB-CB 3.98Å; F794-H889 WeakPolarHBondContact CB-O 3.31Å; F794-H889 WeakPolarHBondContact O-CB 3.4Å; F794-V890 HydrophobicContact CD2-CB 4.44Å; F794-V890 HydrophobicContact CD2-CG1 4.49Å; F794-V890 HydrophobicContact CD2-CG2 3.98Å; F794-V890 HydrophobicContact CE2-CG1 4.38Å; F794-V890 HydrophobicContact CE2-CG2 4.5Å; F794-P891 HydrophobicContact CD1-CG 4.25Å; F794-P891 HydrophobicContact CE1-CG 3.95Å; F794-P891 HydrophobicContact CZ-CG 4.45Å; F794-R894 HydrophobicContact CZ-CG 4.11Å
795	M	95.1	Very high	93.6	Very high	48 Å²	48	40.4 Å²	40.4	24%	0.236	21%	0.214	C	C	.	.	S	Bend	trans	-62.5	141.5	174.7	-64	-166.4	-44.5	0	0	110.4	S792 L793 E797 N798 V799	S792-M795 WeakPolarHBondContact O-CB 3.34Å; S792-M795 WeakPolarHBondContact O-CG 3.28Å; S792-M795 PolarHBondContact O-N 2.98Å; L793-M795 VanDerWaalsContact C-N 3.26Å; L793-M795 PolarHBondContact O-N 3.48Å; M795-E797 PolarHBondContact O-N 3.36Å; M795-N798 PolarHBondContact O-N 3.31Å; M795-V799 PolarHBondContact O-N 3.37Å
796	P	93.1	Very high	93.2	Very high	82 Å²	82	40.6 Å²	40.6	53%	0.532	22%	0.215	S	C	.	.	H	α-helix	trans	-52.6	-36.7	-175.9	-28.6	34.8	0	0	0	114	N798 V799 A800	P796-N798 VanDerWaalsContact C-N 3.33Å; P796-N798 PolarHBondContact O-N 3.01Å; P796-V799 PolarHBondContact O-N 3.44Å; P796-A800 WeakPolarHBondContact O-CB 3.49Å; P796-A800 PolarHBondContact O-N 3.44Å
797	E	93.6	Very high	92.8	Very high	129 Å²	129	44 Å²	44	60%	0.603	24%	0.239	S	C	*	.	H	α-helix	trans	-62	-38	177.6	-52.8	177.6	-160.5	0	0	113	M795 R801	M795-E797 PolarHBondContact O-N 3.36Å; E797-R801 VanDerWaalsContact C-NH1 3.26Å; E797-R801 WeakPolarHBondContact O-CG 3.36Å; E797-R801 PolarHBondContact O-NH1 3.43Å
798	N	93	Very high	92.4	Very high	6 Å²	6	49.8 Å²	49.8	3%	0.032	26%	0.261	C	S	.	.	H	α-helix	trans	-83.6	-34.8	-179.9	-73.4	-37.1	0	0	0	111.9	S792 L793 M795 P796 A800 R801	S792-N798 PolarHBondContact O-ND2 3.47Å; L793-N798 WeakPolarHBondContact O-CB 3.35Å; M795-N798 PolarHBondContact O-N 3.31Å; P796-N798 VanDerWaalsContact C-N 3.33Å; P796-N798 PolarHBondContact O-N 3.01Å; N798-A800 VanDerWaalsContact C-N 3.27Å; N798-A800 PolarHBondContact O-N 3.42Å; N798-R801 WeakPolarHBondContact O-CB 3.32Å; N798-R801 PolarHBondContact O-N 3.47Å; N798-R801 VanDerWaalsContact O-N 3.11Å; N798-R801 PolarHBondContact OD1-NH1 2.92Å
799	V	92.6	Very high	92.1	Very high	55 Å²	55	47.4 Å²	47.4	33%	0.333	25%	0.252	S	S	.	.	H	α-helix	trans	-60.9	-40.2	171.7	177.7	0	0	0	0	110.5	L793 M795 P796 R801 L802 Y810	L793-V799 WeakPolarHBondContact O-CG2 3.35Å; M795-V799 PolarHBondContact O-N 3.37Å; P796-V799 PolarHBondContact O-N 3.44Å; V799-R801 PolarHBondContact O-N 2.88Å; V799-R801 VanDerWaalsContact O-N 3.16Å; V799-L802 HydrophobicContact CG1-CD1 4.38Å; V799-L802 WeakPolarHBondContact O-CB 3.38Å; V799-L802 WeakPolarHBondContact O-CG 3.46Å; V799-L802 PolarHBondContact O-N 2.96Å; V799-L802 VanDerWaalsContact O-N 3.14Å; V799-Y810 HydrophobicContact CG2-CD2 4.25Å; V799-Y810 HydrophobicContact CG2-CE2 4.21Å
800	A	92.6	Very high	91.9	Very high	85 Å²	85	48.3 Å²	48.3	70%	0.702	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.3	-12.3	176.5	0	0	0	0	0	114.5	P796 N798	P796-A800 WeakPolarHBondContact O-CB 3.49Å; P796-A800 PolarHBondContact O-N 3.44Å; N798-A800 VanDerWaalsContact C-N 3.27Å; N798-A800 PolarHBondContact O-N 3.42Å
801	R	92.6	Very high	91.7	Very high	106 Å²	106	51 Å²	51	40%	0.4	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.4	-10	175.8	-67.6	171.5	177.7	104	10.7	113	L702 E797 N798 V799	L702-R801 HydrophobicContact CD1-CB 3.98Å; E797-R801 VanDerWaalsContact C-NH1 3.26Å; E797-R801 WeakPolarHBondContact O-CG 3.36Å; E797-R801 PolarHBondContact O-NH1 3.43Å; N798-R801 WeakPolarHBondContact O-CB 3.32Å; N798-R801 PolarHBondContact O-N 3.47Å; N798-R801 VanDerWaalsContact O-N 3.11Å; N798-R801 PolarHBondContact OD1-NH1 2.92Å; V799-R801 PolarHBondContact O-N 2.88Å; V799-R801 VanDerWaalsContact O-N 3.16Å
802	L	91.6	Very high	91.4	Very high	18 Å²	18	51.9 Å²	51.9	9%	0.094	28%	0.275	C	S	.	.	S	Bend	trans	-64.9	145.5	173.7	-63.8	173.8	0	0	0	110.2	L702 A707 V799 Y810	L702-L802 HydrophobicContact CD2-CD2 4Å; A707-L802 HydrophobicContact CB-CD2 3.85Å; V799-L802 HydrophobicContact CG1-CD1 4.38Å; V799-L802 WeakPolarHBondContact O-CB 3.38Å; V799-L802 WeakPolarHBondContact O-CG 3.46Å; V799-L802 PolarHBondContact O-N 2.96Å; V799-L802 VanDerWaalsContact O-N 3.14Å; L802-Y810 HydrophobicContact CD1-CD2 4.02Å; L802-Y810 HydrophobicContact CD1-CE2 3.67Å; L802-Y810 HydrophobicContact CD2-CE2 4.44Å; L802-Y810 HydrophobicContact CG-CE2 4.4Å
803	S	90.3	Very high	91	Very high	8 Å²	8	53.2 Å²	53.2	6%	0.056	28%	0.28	C	S	.	.			trans	-68.2	162.4	172.4	75.5	0	0	0	0	111.4	A707 E709 T805 F806 S807	A707-S803 PolarHBondContact O-N 3.3Å; E709-S803 WeakPolarHBondContact O-CB 3.45Å; E709-S803 PolarHBondContact O-OG 3.03Å; S803-T805 PolarHBondContact O-N 3.09Å; S803-F806 CarbonylContact O-C 3.41Å; S803-F806 PolarHBondContact O-N 2.73Å; S803-F806 WeakPolarHBondContact OG-CD2 3.39Å; S803-F806 PolarHBondContact OG-N 3Å; S803-S807 PolarHBondContact O-N 3.28Å
804	E	86.3	Confident	90.5	Very high	170 Å²	170	57.7 Å²	57.7	79%	0.794	30%	0.304	S	S	*	.	G	3₁₀ helix	trans	-55.2	-39.2	174.1	-171.5	176.1	179.8	0	0	111.6	F806 S807	E804-F806 VanDerWaalsContact C-N 3.32Å; E804-F806 PolarHBondContact O-N 3.19Å; E804-S807 PolarHBondContact O-OG 2.81Å
805	T	85	Confident	89.8	Confident	43 Å²	43	57.9 Å²	57.9	26%	0.264	31%	0.312	S	S	.	.	G	3₁₀ helix	trans	-60.1	-37.1	176.6	-48.1	0	0	0	0	112.9	F711 S803	F711-T805 HydrophobicContact CB-CG2 4.31Å; F711-T805 HydrophobicContact CD2-CG2 4.47Å; F711-T805 PolarHBondContact N-OG1 3.41Å; S803-T805 PolarHBondContact O-N 3.09Å
806	F	89.6	Confident	89.3	Confident	4 Å²	4	58.4 Å²	58.4	2%	0.018	32%	0.316	C	S	.	.	G	3₁₀ helix	trans	-111.3	14.6	-174.7	-61.2	-55.7	0	0	0	114.1	G706 F711 S803 E804 R808 A809 L839 L840 M843	G706-F806 WeakPolarHBondContact O-CE2 3.18Å; F711-F806 AromaticContact CD2-CE2 3.83Å; F711-F806 HydrophobicContact CD2-CE2 3.83Å; F711-F806 AromaticContact CD2-CZ 3.87Å; F711-F806 HydrophobicContact CD2-CZ 3.87Å; F711-F806 AromaticContact CE2-CE2 3.69Å; F711-F806 HydrophobicContact CE2-CE2 3.69Å; F711-F806 AromaticContact CE2-CZ 3.8Å; F711-F806 HydrophobicContact CE2-CZ 3.8Å; S803-F806 CarbonylContact O-C 3.41Å; S803-F806 PolarHBondContact O-N 2.73Å; S803-F806 WeakPolarHBondContact OG-CD2 3.39Å; S803-F806 PolarHBondContact OG-N 3Å; E804-F806 VanDerWaalsContact C-N 3.32Å; E804-F806 PolarHBondContact O-N 3.19Å; F806-R808 PolarHBondContact O-N 3.5Å; F806-A809 HydrophobicContact CB-CB 4.13Å; F806-A809 WeakPolarHBondContact O-CB 3.48Å; F806-A809 PolarHBondContact O-N 2.96Å; F806-L839 HydrophobicContact CE1-CB 4.39Å; F806-L840 HydrophobicContact CD1-CD1 4.3Å; F806-M843 HydrophobicContact CD1-CB 3.8Å; F806-M843 HydrophobicContact CD1-CE 4.29Å; F806-M843 HydrophobicContact CD1-CG 3.89Å; F806-M843 HydrophobicContact CD2-CE 4.2Å; F806-M843 HydrophobicContact CE1-CB 3.82Å; F806-M843 HydrophobicContact CE1-CE 4.01Å; F806-M843 HydrophobicContact CE1-CG 4.19Å; F806-M843 HydrophobicContact CE2-CE 3.9Å; F806-M843 HydrophobicContact CG-CE 4.39Å; F806-M843 HydrophobicContact CG-CG 4.34Å; F806-M843 HydrophobicContact CZ-CE 3.81Å
807	S	88.7	Confident	89.1	Confident	72 Å²	72	56 Å²	56	50%	0.503	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.4	-28.1	178.7	53.6	0	0	0	0	114	S803 E804	S803-S807 PolarHBondContact O-N 3.28Å; E804-S807 PolarHBondContact O-OG 2.81Å
808	R	89.1	Confident	88.7	Confident	120 Å²	120	52 Å²	52	45%	0.453	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.7	17	179.5	-61.8	-177.7	64.4	-163.4	-0.1	114.3	F806 Y810 D811 L840 Q844	F806-R808 PolarHBondContact O-N 3.5Å; R808-Y810 PolarHBondContact O-N 3.22Å; R808-Y810 VanDerWaalsContact O-N 3.12Å; R808-D811 IonicContact CZ-OD2 3.56Å; R808-D811 IonicContact NE-OD2 2.65Å; R808-D811 PolarHBondContact NE-OD2 3.12Å; R808-D811 IonicContact NH2-OD2 3.88Å; R808-D811 PolarHBondContact NH2-OD2 3.47Å; R808-D811 WeakPolarHBondContact O-CB 3.37Å; R808-D811 PolarHBondContact O-N 3.26Å; R808-D811 VanDerWaalsContact O-N 3.15Å; R808-L840 HydrophobicContact CB-CD1 4.35Å; R808-L840 HydrophobicContact CB-CD2 4.14Å; R808-Q844 PolarHBondContact O-NE2 3.32Å
809	A	90.5	Very high	88.3	Confident	0 Å²	0	56.4 Å²	56.4	0%	0	31%	0.307	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-16.9	-175	0	0	0	0	0	114.2	F806 L840 M843 Q844 F847	F806-A809 HydrophobicContact CB-CB 4.13Å; F806-A809 WeakPolarHBondContact O-CB 3.48Å; F806-A809 PolarHBondContact O-N 2.96Å; A809-L840 HydrophobicContact CB-CD1 4.33Å; A809-M843 HydrophobicContact CB-CG 3.91Å; A809-Q844 WeakPolarHBondContact O-CG 3.46Å; A809-F847 HydrophobicContact CB-CD2 4.16Å; A809-F847 HydrophobicContact CB-CE2 4.15Å
810	Y	92	Very high	88	Confident	21 Å²	21	55.6 Å²	55.6	8%	0.082	30%	0.3	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.2	-3.6	178.9	-58.6	-31.8	0	0	0	114.2	L793 F794 V799 L802 R808 F847	L793-Y810 HydrophobicContact CB-CE2 4.36Å; F794-Y810 HydrophobicContact CD1-CD2 4.2Å; F794-Y810 HydrophobicContact CD1-CG 4.27Å; F794-Y810 HydrophobicContact CE1-CD1 4.33Å; F794-Y810 HydrophobicContact CE1-CD2 4.37Å; F794-Y810 AromaticContact CE1-CG 3.98Å; F794-Y810 HydrophobicContact CE1-CG 3.98Å; V799-Y810 HydrophobicContact CG2-CD2 4.25Å; V799-Y810 HydrophobicContact CG2-CE2 4.21Å; L802-Y810 HydrophobicContact CD1-CD2 4.02Å; L802-Y810 HydrophobicContact CD1-CE2 3.67Å; L802-Y810 HydrophobicContact CD2-CE2 4.44Å; L802-Y810 HydrophobicContact CG-CE2 4.4Å; R808-Y810 PolarHBondContact O-N 3.22Å; R808-Y810 VanDerWaalsContact O-N 3.12Å; Y810-F847 HydrophobicContact CD1-CD2 4.25Å; Y810-F847 HydrophobicContact CD1-CG 4.25Å; Y810-F847 AromaticContact CE1-CD1 3.89Å; Y810-F847 HydrophobicContact CE1-CD1 3.89Å; Y810-F847 AromaticContact CE1-CD2 3.9Å; Y810-F847 HydrophobicContact CE1-CD2 3.9Å; Y810-F847 AromaticContact CE1-CE1 3.83Å; Y810-F847 HydrophobicContact CE1-CE1 3.83Å; Y810-F847 AromaticContact CE1-CE2 3.87Å; Y810-F847 HydrophobicContact CE1-CE2 3.87Å; Y810-F847 AromaticContact CE1-CG 3.93Å; Y810-F847 HydrophobicContact CE1-CG 3.93Å; Y810-F847 AromaticContact CE1-CZ 3.85Å; Y810-F847 HydrophobicContact CE1-CZ 3.85Å
811	D	89.9	Confident	87.7	Confident	64 Å²	64	53.5 Å²	53.5	34%	0.342	28%	0.277	S	S	.	.	S	Bend	trans	-66.7	158.1	176.2	-72.2	-0.9	0	0	0	111.1	R808 M813	R808-D811 IonicContact CZ-OD2 3.56Å; R808-D811 IonicContact NE-OD2 2.65Å; R808-D811 PolarHBondContact NE-OD2 3.12Å; R808-D811 IonicContact NH2-OD2 3.88Å; R808-D811 PolarHBondContact NH2-OD2 3.47Å; R808-D811 WeakPolarHBondContact O-CB 3.37Å; R808-D811 PolarHBondContact O-N 3.26Å; R808-D811 VanDerWaalsContact O-N 3.15Å; D811-M813 PolarHBondContact O-N 2.97Å
812	V	88.6	Confident	87.1	Confident	17 Å²	17	51.6 Å²	51.6	10%	0.103	29%	0.291	C	S	.	.	P	Polyproline II helix	trans	-62.4	133.2	168.6	-176.4	0	0	0	0	108.8	D816 K817 I820 H893 L972	V812-D816 HydrophobicContact CG1-CB 3.73Å; V812-K817 HydrophobicContact CB-CG 4.07Å; V812-K817 HydrophobicContact CG1-CG 3.79Å; V812-K817 WeakPolarHBondContact O-CE 3.21Å; V812-K817 PolarHBondContact O-NZ 3.32Å; V812-I820 HydrophobicContact CG1-CD1 4.15Å; V812-H893 HydrophobicContact CG2-CB 4.38Å; V812-L972 HydrophobicContact CG2-CD1 4.32Å
813	M	87.8	Confident	86.6	Confident	44 Å²	44	54.9 Å²	54.9	22%	0.217	31%	0.308	C	S	.	.	P	Polyproline II helix	trans	-63.4	145.1	176.5	-65.7	-174	-63	0	0	110.4	D811 G815 D816 K817 Q844	D811-M813 PolarHBondContact O-N 2.97Å; M813-G815 VanDerWaalsContact C-N 3.25Å; M813-G815 PolarHBondContact O-N 3.47Å; M813-D816 WeakPolarHBondContact CE-OD2 3.22Å; M813-D816 WeakPolarHBondContact O-CB 3.4Å; M813-D816 PolarHBondContact O-N 3.5Å; M813-K817 PolarHBondContact O-N 2.7Å; M813-Q844 HydrophobicContact CG-CB 3.86Å; M813-Q844 HydrophobicContact SD-CB 4.41Å
814	D	83.3	Confident	85.7	Confident	96 Å²	96	57.5 Å²	57.5	51%	0.513	32%	0.324	S	S	.	.	H	α-helix	trans	-61.4	-33.7	-175.3	-66.3	-26	0	0	0	113.2	D816 K817 L818	D814-D816 VanDerWaalsContact C-N 3.34Å; D814-D816 PolarHBondContact O-N 2.92Å; D814-K817 WeakPolarHBondContact O-CB 3.26Å; D814-K817 PolarHBondContact O-N 2.94Å; D814-K817 IonicContact OD1-NZ 2.78Å; D814-K817 PolarHBondContact OD1-NZ 3.33Å; D814-L818 WeakPolarHBondContact O-CG 3.17Å; D814-L818 PolarHBondContact O-N 3.18Å; D814-L818 VanDerWaalsContact O-N 3.15Å
815	G	81	Confident	84.9	Confident	27 Å²	27	53.5 Å²	53.5	28%	0.278	31%	0.306	S	S	.	.	H	α-helix	trans	-61	-41.4	172.3	0	0	0	0	0	112.8	M813 L818 V819 Q825	M813-G815 VanDerWaalsContact C-N 3.25Å; M813-G815 PolarHBondContact O-N 3.47Å; G815-L818 PolarHBondContact O-N 3.02Å; G815-V819 WeakPolarHBondContact O-CG2 3.46Å; G815-V819 PolarHBondContact O-N 3.41Å; G815-Q825 PolarHBondContact O-NE2 2.87Å
816	D	84.9	Confident	83.9	Confident	59 Å²	59	54.5 Å²	54.5	32%	0.316	31%	0.313	S	S	.	.	H	α-helix	trans	-71.3	-34.3	178.6	-62.5	-20.8	0	0	0	111.1	V812 M813 D814 L818 V819 I820	V812-D816 HydrophobicContact CG1-CB 3.73Å; M813-D816 WeakPolarHBondContact CE-OD2 3.22Å; M813-D816 WeakPolarHBondContact O-CB 3.4Å; M813-D816 PolarHBondContact O-N 3.5Å; D814-D816 VanDerWaalsContact C-N 3.34Å; D814-D816 PolarHBondContact O-N 2.92Å; D816-L818 PolarHBondContact O-N 3.4Å; D816-V819 PolarHBondContact O-N 3.08Å; D816-I820 WeakPolarHBondContact O-CB 3.33Å; D816-I820 WeakPolarHBondContact O-CD1 3.49Å; D816-I820 WeakPolarHBondContact O-CG1 3.4Å; D816-I820 PolarHBondContact O-N 2.69Å
817	K	88.5	Confident	82.5	Confident	31 Å²	31	59.3 Å²	59.3	14%	0.135	35%	0.345	C	S	.	.	H	α-helix	trans	-59	-47	173.7	-64.7	-179.1	-175.1	146.9	0	111.6	V812 M813 D814 V819 I820 L821 L968	V812-K817 HydrophobicContact CB-CG 4.07Å; V812-K817 HydrophobicContact CG1-CG 3.79Å; V812-K817 WeakPolarHBondContact O-CE 3.21Å; V812-K817 PolarHBondContact O-NZ 3.32Å; M813-K817 PolarHBondContact O-N 2.7Å; D814-K817 WeakPolarHBondContact O-CB 3.26Å; D814-K817 PolarHBondContact O-N 2.94Å; D814-K817 IonicContact OD1-NZ 2.78Å; D814-K817 PolarHBondContact OD1-NZ 3.33Å; K817-V819 VanDerWaalsContact C-N 3.32Å; K817-V819 PolarHBondContact O-N 3.28Å; K817-I820 PolarHBondContact O-N 2.73Å; K817-L821 WeakPolarHBondContact O-CB 3.41Å; K817-L821 WeakPolarHBondContact O-CG 3.31Å; K817-L821 PolarHBondContact O-N 3.38Å; K817-L968 HydrophobicContact CB-CD1 4.32Å; K817-L968 HydrophobicContact CB-CD2 4.34Å; K817-L968 HydrophobicContact CD-CD2 3.82Å; K817-L968 HydrophobicContact CG-CD1 4.29Å; K817-L968 HydrophobicContact CG-CD2 3.69Å
818	L	84.6	Confident	81.3	Confident	47 Å²	47	59.4 Å²	59.4	25%	0.246	34%	0.339	C	S	.	.	H	α-helix	trans	-60.1	-43.5	177.9	-66.6	173.7	0	0	0	111.2	D814 G815 D816 L821 G822 L823 Q825	D814-L818 WeakPolarHBondContact O-CG 3.17Å; D814-L818 PolarHBondContact O-N 3.18Å; D814-L818 VanDerWaalsContact O-N 3.15Å; G815-L818 PolarHBondContact O-N 3.02Å; D816-L818 PolarHBondContact O-N 3.4Å; L818-L821 PolarHBondContact O-N 3.14Å; L818-G822 PolarHBondContact O-N 2.89Å; L818-L823 HydrophobicContact CB-CB 4.45Å; L818-L823 HydrophobicContact CD2-CB 3.97Å; L818-L823 HydrophobicContact CD2-CD1 4.03Å; L818-L823 PolarHBondContact O-N 2.87Å; L818-Q825 HydrophobicContact CB-CG 4.39Å; L818-Q825 HydrophobicContact CD1-CG 4.36Å
819	V	85	Confident	80.1	Confident	97 Å²	97	56.3 Å²	56.3	59%	0.588	33%	0.332	S	S	*	.	H	α-helix	trans	-63.3	-43.7	177.1	173.9	0	0	0	0	111.6	G815 D816 K817 L821 G822	G815-V819 WeakPolarHBondContact O-CG2 3.46Å; G815-V819 PolarHBondContact O-N 3.41Å; D816-V819 PolarHBondContact O-N 3.08Å; K817-V819 VanDerWaalsContact C-N 3.32Å; K817-V819 PolarHBondContact O-N 3.28Å; V819-L821 VanDerWaalsContact C-N 3.3Å; V819-L821 PolarHBondContact O-N 3.01Å; V819-G822 PolarHBondContact O-N 3.48Å; V819-G822 VanDerWaalsContact O-N 3.16Å
820	I	86.4	Confident	79	Confident	39 Å²	39	57.4 Å²	57.4	20%	0.2	34%	0.337	C	S	.	.	H	α-helix	trans	-64.9	-35.4	178.6	-68.5	160.4	0	0	0	111.5	V812 D816 K817 G822 L968 Q971 L972 L975	V812-I820 HydrophobicContact CG1-CD1 4.15Å; D816-I820 WeakPolarHBondContact O-CB 3.33Å; D816-I820 WeakPolarHBondContact O-CD1 3.49Å; D816-I820 WeakPolarHBondContact O-CG1 3.4Å; D816-I820 PolarHBondContact O-N 2.69Å; K817-I820 PolarHBondContact O-N 2.73Å; I820-G822 VanDerWaalsContact C-N 3.3Å; I820-L968 HydrophobicContact CB-CD1 4.06Å; I820-L968 HydrophobicContact CD1-CD1 4.27Å; I820-L968 HydrophobicContact CG2-CD1 3.76Å; I820-Q971 HydrophobicContact CG2-CB 3.72Å; I820-L972 HydrophobicContact CD1-CD2 3.79Å; I820-L975 HydrophobicContact CG1-CD1 4.28Å; I820-L975 HydrophobicContact CG2-CD1 4.1Å
821	L	85.8	Confident	77.8	Confident	40 Å²	40	58 Å²	58	21%	0.209	34%	0.34	C	S	.	.	H	α-helix	trans	-80.6	-8.7	176.9	-68.2	172.6	0	0	0	113.4	K817 L818 V819 L823 M967 L968	K817-L821 WeakPolarHBondContact O-CB 3.41Å; K817-L821 WeakPolarHBondContact O-CG 3.31Å; K817-L821 PolarHBondContact O-N 3.38Å; L818-L821 PolarHBondContact O-N 3.14Å; V819-L821 VanDerWaalsContact C-N 3.3Å; V819-L821 PolarHBondContact O-N 3.01Å; L821-L823 VanDerWaalsContact C-N 3.29Å; L821-L823 HydrophobicContact CB-CD1 4.04Å; L821-L823 HydrophobicContact CB-CG 3.98Å; L821-L823 HydrophobicContact CD1-CD1 4.18Å; L821-M967 HydrophobicContact CD2-CB 3.96Å; L821-L968 HydrophobicContact CD2-CB 4.33Å
822	G	80.4	Confident	76.4	Confident	67 Å²	67	59.3 Å²	59.3	69%	0.691	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.8	22.7	-176.3	0	0	0	0	0	113.7	L818 V819 I820	L818-G822 PolarHBondContact O-N 2.89Å; V819-G822 PolarHBondContact O-N 3.48Å; V819-G822 VanDerWaalsContact O-N 3.16Å; I820-G822 VanDerWaalsContact C-N 3.3Å
823	L	80.4	Confident	74.6	Confident	86 Å²	86	61.1 Å²	61.1	45%	0.45	36%	0.363	S	S	.	.	P	Polyproline II helix	trans	-90.9	143.2	178.8	-62.6	175.6	0	0	0	110.6	L818 L821	L818-L823 HydrophobicContact CB-CB 4.45Å; L818-L823 HydrophobicContact CD2-CB 3.97Å; L818-L823 HydrophobicContact CD2-CD1 4.03Å; L818-L823 PolarHBondContact O-N 2.87Å; L821-L823 VanDerWaalsContact C-N 3.29Å; L821-L823 HydrophobicContact CB-CD1 4.04Å; L821-L823 HydrophobicContact CB-CG 3.98Å; L821-L823 HydrophobicContact CD1-CD1 4.18Å
824	P	71.4	Confident	73.1	Confident	63 Å²	63	62.2 Å²	62.2	41%	0.409	37%	0.373	S	S	.	.	P	Polyproline II helix	trans	-60.7	142.2	175.5	22.4	-29.8	0	0	0	111.1	D441	D441-P824 HydrophobicContact CB-CB 3.76Å; D441-P824 HydrophobicContact CB-CG 4.24Å
825	Q	69.2	Low	71.7	Confident	86 Å²	86	60.6 Å²	60.6	40%	0.402	37%	0.367	S	S	.	.	P	Polyproline II helix	trans	-79.8	138.9	173.6	-73.1	-150.3	-3.1	0	0	110.6	G815 L818	G815-Q825 PolarHBondContact O-NE2 2.87Å; L818-Q825 HydrophobicContact CB-CG 4.39Å; L818-Q825 HydrophobicContact CD1-CG 4.36Å
826	P	64.9	Low	70.6	Confident	64 Å²	64	62.3 Å²	62.3	42%	0.416	37%	0.368	S	S	.	.	P	Polyproline II helix	trans	-63.1	140.9	-179.2	25.6	-34	0	0	0	110.7	L828	P826-L828 PolarHBondContact O-N 3.48Å
827	P	61	Low	69.6	Low	105 Å²	105	66.4 Å²	66.4	68%	0.682	38%	0.382	S	S	*	.			trans	-63.7	113.6	176.7	24.7	-32	0	0	0	109.3
828	L	62.5	Low	68.9	Low	74 Å²	74	67.1 Å²	67.1	39%	0.387	39%	0.392	S	S	.	.			trans	-90.6	130.9	175.7	-71.5	163.7	0	0	0	109	P826 I830 K837	P826-L828 PolarHBondContact O-N 3.48Å; L828-I830 PolarHBondContact O-N 3.24Å; L828-I830 VanDerWaalsContact O-N 3.17Å; L828-K837 VanDerWaalsContact CD2-CE 3.47Å
829	D	64.6	Low	68.8	Low	56 Å²	56	68.3 Å²	68.3	30%	0.299	40%	0.398	S	S	.	.			trans	-61.5	119.7	169.1	-168.2	-23.7	0	0	0	108.5	Y831 D832	D829-Y831 PolarHBondContact O-N 3.27Å; D829-Y831 PolarHBondContact OD1-N 2.93Å; D829-D832 HydrophobicContact CB-CB 4.09Å; D829-D832 PolarHBondContact O-N 3.04Å
830	I	66.9	Low	68.7	Low	22 Å²	22	65.3 Å²	65.3	11%	0.113	38%	0.378	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.1	-18.6	-174.6	-49.2	-168.2	0	0	0	110.9	L501 L553 R601 A602 L828	L501-I830 HydrophobicContact CD1-CD1 3.55Å; L501-I830 HydrophobicContact CD1-CG1 4.14Å; L501-I830 HydrophobicContact CD2-CD1 3.43Å; L501-I830 VanDerWaalsContact CD2-CD1 3.43Å; L501-I830 HydrophobicContact CG-CD1 3.3Å; L501-I830 HydrophobicContact CG-CG1 4.15Å; L553-I830 HydrophobicContact CD2-CD1 4.18Å; R601-I830 HydrophobicContact CB-CG2 4.05Å; R601-I830 WeakPolarHBondContact CB-O 3.25Å; R601-I830 HydrophobicContact CG-CG2 4.46Å; R601-I830 PolarHBondContact N-O 3.31Å; A602-I830 VanDerWaalsContact CA-CG2 3.49Å; A602-I830 HydrophobicContact CB-CB 4.48Å; A602-I830 HydrophobicContact CB-CG2 3.48Å; A602-I830 VanDerWaalsContact CB-CG2 3.48Å; A602-I830 VanDerWaalsContact N-CG2 3.32Å; A602-I830 PolarHBondContact N-O 2.89Å; L828-I830 PolarHBondContact O-N 3.24Å; L828-I830 VanDerWaalsContact O-N 3.17Å
831	Y	67	Low	68.6	Low	35 Å²	35	65.3 Å²	65.3	14%	0.137	38%	0.379	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.5	-12.5	179	-62.9	-78.4	0	0	0	114	T494 L498 C499 P552 L553 A602 D829	T494-Y831 HydrophobicContact CG2-CD2 3.64Å; T494-Y831 HydrophobicContact CG2-CE2 4.05Å; T494-Y831 HydrophobicContact CG2-CG 4.29Å; L498-Y831 HydrophobicContact CB-CE1 4.43Å; L498-Y831 HydrophobicContact CD1-CD1 4.24Å; L498-Y831 HydrophobicContact CD1-CE1 3.92Å; C499-Y831 WeakPolarHBondContact O-CE2 3.24Å; C499-Y831 VanDerWaalsContact O-CZ 3.23Å; C499-Y831 PolarHBondContact O-OH 3.47Å; P552-Y831 HydrophobicContact CG-CE1 3.8Å; L553-Y831 HydrophobicContact CD1-CE2 4.48Å; A602-Y831 HydrophobicContact CB-CD1 4.41Å; A602-Y831 HydrophobicContact CB-CE1 3.96Å; D829-Y831 PolarHBondContact O-N 3.27Å; D829-Y831 PolarHBondContact OD1-N 2.93Å
832	D	59.9	Low	68.5	Low	91 Å²	91	68.7 Å²	68.7	49%	0.487	39%	0.389	S	S	.	.	S	Bend	trans	-67.1	138.4	172.8	-92.6	-17.8	0	0	0	111.3	D829	D829-D832 HydrophobicContact CB-CB 4.09Å; D829-D832 PolarHBondContact O-N 3.04Å
833	A	50.2	Low	69	Low	55 Å²	55	65.7 Å²	65.7	46%	0.455	36%	0.357	S	S	.	.	S	Bend	trans	-105.9	102.2	-178.1	0	0	0	0	0	108.1	P598	P598-A833 HydrophobicContact CG-CB 4.08Å
834	P	57.3	Low	69.5	Low	66 Å²	66	62 Å²	62	43%	0.429	34%	0.337	S	S	.	.			cis	-137.2	164.7	46.8	18.4	7.8	0	0	0	116.4	H836	P834-H836 VanDerWaalsContact CB-O 3.32Å; P834-H836 WeakPolarHBondContact CB-O 3.49Å; P834-H836 VanDerWaalsContact CG-O 3.23Å; P834-H836 WeakPolarHBondContact CG-O 3.41Å; P834-H836 PolarHBondContact O-N 3.14Å
835	V	53.7	Low	70.4	Confident	62 Å²	62	59.4 Å²	59.4	38%	0.376	32%	0.322	S	S	.	.	S	Bend	trans	-60.6	-29.2	175	173	0	0	0	0	113.9	R601 K604	R601-V835 HydrophobicContact CB-CG2 4.02Å; R601-V835 HydrophobicContact CG-CG2 4.26Å; K604-V835 HydrophobicContact CD-CG2 3.87Å
836	H	57.5	Low	71.4	Confident	64 Å²	64	56.2 Å²	56.2	30%	0.296	31%	0.307	S	S	.	.	S	Bend	trans	-109.9	125.2	167.4	-70	-71.9	0	0	0	106.3	P834 S838 D841 R842	P834-H836 VanDerWaalsContact CB-O 3.32Å; P834-H836 WeakPolarHBondContact CB-O 3.49Å; P834-H836 VanDerWaalsContact CG-O 3.23Å; P834-H836 WeakPolarHBondContact CG-O 3.41Å; P834-H836 PolarHBondContact O-N 3.14Å; H836-S838 PolarHBondContact O-N 3.39Å; H836-D841 HydrophobicContact CB-CB 3.96Å; H836-D841 PolarHBondContact ND1-O 3.4Å; H836-R842 HydrophobicContact CB-CB 4.14Å
837	K	63.6	Low	72.9	Confident	144 Å²	144	53.7 Å²	53.7	63%	0.626	29%	0.289	S	S	*	.	S	Bend	trans	-67.9	-26.3	-175.1	-63.5	-179.9	177.4	179	0	111.1	L828 D841	L828-K837 VanDerWaalsContact CD2-CE 3.47Å; K837-D841 WeakPolarHBondContact CB-OD2 3.37Å; K837-D841 PolarHBondContact N-OD2 3.16Å; K837-D841 VanDerWaalsContact N-OD2 3.11Å
838	S	75.6	Confident	74.4	Confident	47 Å²	47	49.8 Å²	49.8	33%	0.329	26%	0.263	S	S	.	.	S	Bend	trans	-137.4	165.5	-178.7	75.8	0	0	0	0	113.1	H836 L840 D841 R842	H836-S838 PolarHBondContact O-N 3.39Å; S838-L840 PolarHBondContact O-N 3.37Å; S838-L840 PolarHBondContact OG-N 3.44Å; S838-D841 PolarHBondContact N-OD2 3.33Å; S838-D841 PolarHBondContact O-N 3.49Å; S838-D841 PolarHBondContact OG-N 2.71Å; S838-D841 PolarHBondContact OG-OD1 3.03Å; S838-R842 PolarHBondContact O-N 2.97Å
839	L	80.5	Confident	75.8	Confident	71 Å²	71	48.1 Å²	48.1	37%	0.372	26%	0.257	S	S	.	.	H	α-helix	trans	-62.3	-33.7	168.6	-72.7	171.2	0	0	0	111.7	F711 F806 R842 M843	F711-L839 HydrophobicContact CB-CD1 4.27Å; F711-L839 HydrophobicContact CD1-CD1 4.27Å; F711-L839 HydrophobicContact CG-CD1 4.11Å; F806-L839 HydrophobicContact CE1-CB 4.39Å; L839-R842 PolarHBondContact O-N 3.21Å; L839-M843 PolarHBondContact O-N 3.26Å; L839-M843 VanDerWaalsContact O-N 3.08Å
840	L	84.8	Confident	77.2	Confident	35 Å²	35	45.5 Å²	45.5	18%	0.183	24%	0.244	C	C	.	.	H	α-helix	trans	-62.9	-47.7	175.9	175.9	64.7	0	0	0	111.3	F806 R808 A809 S838 R842 M843 Q844	F806-L840 HydrophobicContact CD1-CD1 4.3Å; R808-L840 HydrophobicContact CB-CD1 4.35Å; R808-L840 HydrophobicContact CB-CD2 4.14Å; A809-L840 HydrophobicContact CB-CD1 4.33Å; S838-L840 PolarHBondContact O-N 3.37Å; S838-L840 PolarHBondContact OG-N 3.44Å; L840-R842 PolarHBondContact O-N 3.37Å; L840-M843 CarbonylContact O-C 3.56Å; L840-M843 WeakPolarHBondContact O-CA 3.49Å; L840-M843 WeakPolarHBondContact O-CB 3.37Å; L840-M843 PolarHBondContact O-N 3.37Å; L840-Q844 HydrophobicContact CD1-CG 4.3Å; L840-Q844 HydrophobicContact CG-CG 4.4Å; L840-Q844 WeakPolarHBondContact O-CG 3.2Å; L840-Q844 PolarHBondContact O-N 2.91Å
841	D	83.4	Confident	78.5	Confident	38 Å²	38	44.7 Å²	44.7	20%	0.203	24%	0.239	C	C	.	.	H	α-helix	trans	-58.3	-37.5	178.1	-65	3.8	0	0	0	111.4	H836 K837 S838 G845	H836-D841 HydrophobicContact CB-CB 3.96Å; H836-D841 PolarHBondContact ND1-O 3.4Å; K837-D841 WeakPolarHBondContact CB-OD2 3.37Å; K837-D841 PolarHBondContact N-OD2 3.16Å; K837-D841 VanDerWaalsContact N-OD2 3.11Å; S838-D841 PolarHBondContact N-OD2 3.33Å; S838-D841 PolarHBondContact O-N 3.49Å; S838-D841 PolarHBondContact OG-N 2.71Å; S838-D841 PolarHBondContact OG-OD1 3.03Å; D841-G845 PolarHBondContact O-N 2.91Å
842	R	83.9	Confident	79.9	Confident	112 Å²	112	45 Å²	45	42%	0.423	24%	0.242	S	C	.	.	H	α-helix	trans	-66.7	-41.2	176.6	-171.8	-174	-61	173.5	3	111.1	H836 S838 L839 L840 F846	H836-R842 HydrophobicContact CB-CB 4.14Å; S838-R842 PolarHBondContact O-N 2.97Å; L839-R842 PolarHBondContact O-N 3.21Å; L840-R842 PolarHBondContact O-N 3.37Å; R842-F846 WeakPolarHBondContact O-CB 3.49Å; R842-F846 PolarHBondContact O-N 3.49Å
843	M	90	Very high	81.5	Confident	3 Å²	3	41.4 Å²	41.4	2%	0.015	22%	0.223	C	C	.	.	H	α-helix	trans	-67.4	-43.3	177.1	-169.6	63.4	82.5	0	0	111.4	A707 F806 A809 L839 L840 F846 F847	A707-M843 HydrophobicContact CB-CE 4.49Å; F806-M843 HydrophobicContact CD1-CB 3.8Å; F806-M843 HydrophobicContact CD1-CE 4.29Å; F806-M843 HydrophobicContact CD1-CG 3.89Å; F806-M843 HydrophobicContact CD2-CE 4.2Å; F806-M843 HydrophobicContact CE1-CB 3.82Å; F806-M843 HydrophobicContact CE1-CE 4.01Å; F806-M843 HydrophobicContact CE1-CG 4.19Å; F806-M843 HydrophobicContact CE2-CE 3.9Å; F806-M843 HydrophobicContact CG-CE 4.39Å; F806-M843 HydrophobicContact CG-CG 4.34Å; F806-M843 HydrophobicContact CZ-CE 3.81Å; A809-M843 HydrophobicContact CB-CG 3.91Å; L839-M843 PolarHBondContact O-N 3.26Å; L839-M843 VanDerWaalsContact O-N 3.08Å; L840-M843 CarbonylContact O-C 3.56Å; L840-M843 WeakPolarHBondContact O-CA 3.49Å; L840-M843 WeakPolarHBondContact O-CB 3.37Å; L840-M843 PolarHBondContact O-N 3.37Å; M843-F846 WeakPolarHBondContact O-CB 3.47Å; M843-F846 PolarHBondContact O-N 3.39Å; M843-F846 HydrophobicContact SD-CD1 4.06Å; M843-F847 HydrophobicContact CG-CD2 3.79Å; M843-F847 HydrophobicContact CG-CE2 3.57Å; M843-F847 VanDerWaalsContact O-CD2 3.29Å; M843-F847 WeakPolarHBondContact O-CD2 2.92Å; M843-F847 PolarHBondContact O-N 3.37Å; M843-F847 HydrophobicContact SD-CD2 4.04Å; M843-F847 HydrophobicContact SD-CE2 3.54Å; M843-F847 VanDerWaalsContact SD-CE2 3.54Å; M843-F847 HydrophobicContact SD-CZ 4.35Å
844	Q	91.6	Very high	83.8	Confident	8 Å²	8	38.8 Å²	38.8	4%	0.037	20%	0.201	C	C	.	.	H	α-helix	trans	-58.6	-48.6	173.5	-72.3	174.9	-25	0	0	111.3	R808 A809 M813 L840 F846 F847 N848	R808-Q844 PolarHBondContact O-NE2 3.32Å; A809-Q844 WeakPolarHBondContact O-CG 3.46Å; M813-Q844 HydrophobicContact CG-CB 3.86Å; M813-Q844 HydrophobicContact SD-CB 4.41Å; L840-Q844 HydrophobicContact CD1-CG 4.3Å; L840-Q844 HydrophobicContact CG-CG 4.4Å; L840-Q844 WeakPolarHBondContact O-CG 3.2Å; L840-Q844 PolarHBondContact O-N 2.91Å; Q844-F846 VanDerWaalsContact C-N 3.3Å; Q844-F846 PolarHBondContact O-N 2.97Å; Q844-F847 PolarHBondContact O-N 3.32Å; Q844-N848 WeakPolarHBondContact O-CB 3.48Å; Q844-N848 PolarHBondContact O-N 3.43Å
845	G	89.4	Confident	85.7	Confident	10 Å²	10	35.7 Å²	35.7	10%	0.103	18%	0.181	C	C	.	.	H	α-helix	trans	-61.5	-36.8	176.6	0	0	0	0	0	113.1	D841 S849	D841-G845 PolarHBondContact O-N 2.91Å; G845-S849 WeakPolarHBondContact O-CB 3.48Å; G845-S849 PolarHBondContact O-N 3Å; G845-S849 PolarHBondContact O-OG 3.46Å
846	F	92.1	Very high	87.7	Confident	18 Å²	18	35.6 Å²	35.6	8%	0.079	18%	0.176	C	C	.	.	H	α-helix	trans	-63.2	-55.5	173.4	166.9	-104.9	0	0	0	111.4	V705 R725 L728 S729 R842 M843 Q844 N848 S849 L850	V705-F846 HydrophobicContact CB-CE1 4.16Å; V705-F846 HydrophobicContact CG1-CE1 3.99Å; V705-F846 HydrophobicContact CG1-CZ 3.98Å; R725-F846 HydrophobicContact CB-CD2 4.01Å; R725-F846 HydrophobicContact CB-CE2 3.73Å; R725-F846 HydrophobicContact CB-CZ 4Å; R725-F846 HydrophobicContact CG-CD1 4.36Å; R725-F846 HydrophobicContact CG-CD2 4.44Å; R725-F846 HydrophobicContact CG-CE1 4Å; R725-F846 HydrophobicContact CG-CE2 4.09Å; R725-F846 HydrophobicContact CG-CZ 3.84Å; R725-F846 WeakPolarHBondContact O-CE2 3.3Å; L728-F846 HydrophobicContact CD2-CZ 4.08Å; S729-F846 WeakPolarHBondContact OG-CE2 3.47Å; R842-F846 WeakPolarHBondContact O-CB 3.49Å; R842-F846 PolarHBondContact O-N 3.49Å; M843-F846 WeakPolarHBondContact O-CB 3.47Å; M843-F846 PolarHBondContact O-N 3.39Å; M843-F846 HydrophobicContact SD-CD1 4.06Å; Q844-F846 VanDerWaalsContact C-N 3.3Å; Q844-F846 PolarHBondContact O-N 2.97Å; F846-N848 PolarHBondContact O-N 3.22Å; F846-S849 PolarHBondContact O-N 3.5Å; F846-L850 HydrophobicContact CE1-CD2 4.19Å; F846-L850 HydrophobicContact CE2-CD1 4.02Å; F846-L850 HydrophobicContact CE2-CD2 4.46Å; F846-L850 HydrophobicContact CZ-CD1 4.19Å; F846-L850 HydrophobicContact CZ-CD2 3.88Å; F846-L850 WeakPolarHBondContact O-CB 3.49Å; F846-L850 PolarHBondContact O-N 3.15Å
847	F	94.5	Very high	89.5	Confident	11 Å²	11	32.6 Å²	32.6	5%	0.048	16%	0.162	C	C	.	.	H	α-helix	trans	-62	-33.3	177.8	-77.9	-67.6	0	0	0	112.4	F701 V705 A707 L793 A809 Y810 M843 Q844 F851 R894	F701-F847 HydrophobicContact CE1-CE1 4.02Å; V705-F847 HydrophobicContact CG2-CZ 4.22Å; A707-F847 HydrophobicContact CB-CE2 4.46Å; A707-F847 HydrophobicContact CB-CZ 4.24Å; L793-F847 HydrophobicContact CD1-CE1 3.84Å; A809-F847 HydrophobicContact CB-CD2 4.16Å; A809-F847 HydrophobicContact CB-CE2 4.15Å; Y810-F847 HydrophobicContact CD1-CD2 4.25Å; Y810-F847 HydrophobicContact CD1-CG 4.25Å; Y810-F847 AromaticContact CE1-CD1 3.89Å; Y810-F847 HydrophobicContact CE1-CD1 3.89Å; Y810-F847 AromaticContact CE1-CD2 3.9Å; Y810-F847 HydrophobicContact CE1-CD2 3.9Å; Y810-F847 AromaticContact CE1-CE1 3.83Å; Y810-F847 HydrophobicContact CE1-CE1 3.83Å; Y810-F847 AromaticContact CE1-CE2 3.87Å; Y810-F847 HydrophobicContact CE1-CE2 3.87Å; Y810-F847 AromaticContact CE1-CG 3.93Å; Y810-F847 HydrophobicContact CE1-CG 3.93Å; Y810-F847 AromaticContact CE1-CZ 3.85Å; Y810-F847 HydrophobicContact CE1-CZ 3.85Å; M843-F847 HydrophobicContact CG-CD2 3.79Å; M843-F847 HydrophobicContact CG-CE2 3.57Å; M843-F847 VanDerWaalsContact O-CD2 3.29Å; M843-F847 WeakPolarHBondContact O-CD2 2.92Å; M843-F847 PolarHBondContact O-N 3.37Å; M843-F847 HydrophobicContact SD-CD2 4.04Å; M843-F847 HydrophobicContact SD-CE2 3.54Å; M843-F847 VanDerWaalsContact SD-CE2 3.54Å; M843-F847 HydrophobicContact SD-CZ 4.35Å; Q844-F847 PolarHBondContact O-N 3.32Å; F847-F851 WeakPolarHBondContact O-CB 3.35Å; F847-F851 PolarHBondContact O-N 3.32Å; F847-R894 PolarHBondContact O-NH1 2.87Å
848	N	93	Very high	91.1	Very high	24 Å²	24	25.8 Å²	25.8	13%	0.128	13%	0.133	C	C	.	.	H	α-helix	trans	-59.5	-61.3	171.8	-161.7	56.4	0	0	0	112.1	Q844 F846 L850 F851 E852 R894	Q844-N848 WeakPolarHBondContact O-CB 3.48Å; Q844-N848 PolarHBondContact O-N 3.43Å; F846-N848 PolarHBondContact O-N 3.22Å; N848-L850 VanDerWaalsContact C-N 3.29Å; N848-L850 PolarHBondContact O-N 2.99Å; N848-F851 PolarHBondContact O-N 2.96Å; N848-E852 PolarHBondContact O-N 2.86Å; N848-E852 VanDerWaalsContact O-N 3.1Å; N848-R894 VanDerWaalsContact CA-NH2 3.34Å; N848-R894 PolarHBondContact OD1-NH2 3.4Å
849	S	92.1	Very high	92	Very high	38 Å²	38	23.6 Å²	23.6	27%	0.266	12%	0.118	S	C	.	.	H	α-helix	trans	-59.8	-40.9	-178.6	-53	0	0	0	0	111.9	Y733 G845 F846 F851 E852 N853	Y733-S849 WeakPolarHBondContact OH-CB 3.42Å; G845-S849 WeakPolarHBondContact O-CB 3.48Å; G845-S849 PolarHBondContact O-N 3Å; G845-S849 PolarHBondContact O-OG 3.46Å; F846-S849 PolarHBondContact O-N 3.5Å; S849-F851 PolarHBondContact O-N 3.47Å; S849-E852 PolarHBondContact O-N 2.98Å; S849-N853 WeakPolarHBondContact O-CB 3.47Å; S849-N853 PolarHBondContact O-N 3.31Å; S849-N853 PolarHBondContact O-ND2 3.36Å
850	L	94.4	Very high	92.7	Very high	2 Å²	2	22 Å²	22	1%	0.01	11%	0.109	C	C	.	.	H	α-helix	trans	-61.9	-44.4	-178	-165.7	78.8	0	0	0	111.7	F701 L728 L732 L786 F846 N848 C854	F701-L850 HydrophobicContact CE2-CD2 4.49Å; F701-L850 HydrophobicContact CZ-CD2 3.71Å; L728-L850 HydrophobicContact CD2-CD1 3.61Å; L728-L850 HydrophobicContact CD2-CD2 3.95Å; L728-L850 HydrophobicContact CD2-CG 4.44Å; L728-L850 HydrophobicContact CG-CD1 3.93Å; L732-L850 HydrophobicContact CD1-CD1 3.29Å; L732-L850 HydrophobicContact CD1-CG 4.12Å; L786-L850 HydrophobicContact CD1-CD2 4.44Å; F846-L850 HydrophobicContact CE1-CD2 4.19Å; F846-L850 HydrophobicContact CE2-CD1 4.02Å; F846-L850 HydrophobicContact CE2-CD2 4.46Å; F846-L850 HydrophobicContact CZ-CD1 4.19Å; F846-L850 HydrophobicContact CZ-CD2 3.88Å; F846-L850 WeakPolarHBondContact O-CB 3.49Å; F846-L850 PolarHBondContact O-N 3.15Å; N848-L850 VanDerWaalsContact C-N 3.29Å; N848-L850 PolarHBondContact O-N 2.99Å; L850-C854 PolarHBondContact O-N 3.35Å; L850-C854 PolarHBondContact O-SG 3.2Å
851	F	94.9	Very high	93.1	Very high	4 Å²	4	20.3 Å²	20.3	2%	0.018	10%	0.101	C	C	.	.	H	α-helix	trans	-66.6	-48.9	178	-173.4	-87.2	0	0	0	111.6	Q790 F794 F847 N848 S849 N853 C854 F855 R894	Q790-F851 HydrophobicContact CB-CD2 4.45Å; F794-F851 HydrophobicContact CE2-CE2 4.4Å; F847-F851 WeakPolarHBondContact O-CB 3.35Å; F847-F851 PolarHBondContact O-N 3.32Å; N848-F851 PolarHBondContact O-N 2.96Å; S849-F851 PolarHBondContact O-N 3.47Å; F851-N853 PolarHBondContact O-N 2.91Å; F851-C854 PolarHBondContact O-N 2.92Å; F851-F855 AromaticContact CD1-CD2 3.93Å; F851-F855 HydrophobicContact CD1-CD2 3.93Å; F851-F855 HydrophobicContact CD1-CE2 4.06Å; F851-F855 HydrophobicContact CD2-CE2 4.22Å; F851-F855 AromaticContact CE1-CD2 3.66Å; F851-F855 HydrophobicContact CE1-CD2 3.66Å; F851-F855 AromaticContact CE1-CE2 3.53Å; F851-F855 HydrophobicContact CE1-CE2 3.53Å; F851-F855 AromaticContact CE2-CE2 3.74Å; F851-F855 HydrophobicContact CE2-CE2 3.74Å; F851-F855 HydrophobicContact CG-CD2 4.48Å; F851-F855 HydrophobicContact CG-CE2 4.38Å; F851-F855 HydrophobicContact CZ-CD2 4.01Å; F851-F855 AromaticContact CZ-CE2 3.36Å; F851-F855 HydrophobicContact CZ-CE2 3.36Å; F851-F855 HydrophobicContact CZ-CZ 4.28Å; F851-F855 WeakPolarHBondContact O-CD2 3.42Å; F851-F855 PolarHBondContact O-N 3.37Å; F851-R894 HydrophobicContact CD1-CB 4.43Å; F851-R894 HydrophobicContact CE1-CB 3.81Å; F851-R894 VanDerWaalsContact CE1-O 3.28Å; F851-R894 WeakPolarHBondContact CE1-O 3.4Å; F851-R894 HydrophobicContact CE2-CB 4.33Å; F851-R894 HydrophobicContact CZ-CB 3.74Å
852	E	95.1	Very high	93.5	Very high	43 Å²	43	18.6 Å²	18.6	20%	0.201	9%	0.091	C	C	.	.	H	α-helix	trans	-64.9	-40.7	-178.2	-66.5	-167	141.4	0	0	112.1	N848 S849 C854 F855 H856 S897 L901	N848-E852 PolarHBondContact O-N 2.86Å; N848-E852 VanDerWaalsContact O-N 3.1Å; S849-E852 PolarHBondContact O-N 2.98Å; E852-C854 VanDerWaalsContact C-N 3.35Å; E852-C854 PolarHBondContact O-N 3.38Å; E852-F855 PolarHBondContact O-N 3.15Å; E852-H856 WeakPolarHBondContact O-CB 3.47Å; E852-H856 PolarHBondContact O-CD2 3.12Å; E852-H856 VanDerWaalsContact O-CD2 3.31Å; E852-H856 PolarHBondContact O-N 3.09Å; E852-S897 PolarHBondContact OE1-OG 3.42Å; E852-L901 HydrophobicContact CB-CD1 3.89Å; E852-L901 HydrophobicContact CG-CD1 4.1Å
853	N	94.9	Very high	93.8	Very high	15 Å²	15	15.8 Å²	15.8	8%	0.08	9%	0.088	C	C	.	.	H	α-helix	trans	-63.3	-38.5	178.4	-74.1	-39.8	0	0	0	112.5	L732 Y733 S849 F851 F855 H856 I857	L732-N853 HydrophobicContact CB-CB 4.48Å; Y733-N853 WeakPolarHBondContact CE1-ND2 3.45Å; Y733-N853 WeakPolarHBondContact CE1-OD1 3.39Å; Y733-N853 PolarHBondContact OH-ND2 3.45Å; S849-N853 WeakPolarHBondContact O-CB 3.47Å; S849-N853 PolarHBondContact O-N 3.31Å; S849-N853 PolarHBondContact O-ND2 3.36Å; F851-N853 PolarHBondContact O-N 2.91Å; N853-F855 VanDerWaalsContact C-N 3.34Å; N853-F855 PolarHBondContact O-N 3.24Å; N853-H856 PolarHBondContact O-N 3.2Å; N853-I857 WeakPolarHBondContact O-CD1 3.11Å; N853-I857 VanDerWaalsContact O-CG1 3.23Å; N853-I857 WeakPolarHBondContact O-CG1 3.42Å; N853-I857 PolarHBondContact O-N 3.38Å
854	C	96.7	Very high	93.9	Very high	0 Å²	0	16.2 Å²	16.2	0%	0	9%	0.092	C	C	.	.	H	α-helix	trans	-58.1	-47	175.3	-72.8	0	0	0	0	111.8	L783 I787 L850 F851 E852 I857 L858	L783-C854 HydrophobicContact CD1-CB 3.94Å; I787-C854 HydrophobicContact CD1-CB 4.04Å; I787-C854 HydrophobicContact CG1-CB 3.65Å; L850-C854 PolarHBondContact O-N 3.35Å; L850-C854 PolarHBondContact O-SG 3.2Å; F851-C854 PolarHBondContact O-N 2.92Å; E852-C854 VanDerWaalsContact C-N 3.35Å; E852-C854 PolarHBondContact O-N 3.38Å; C854-I857 PolarHBondContact O-N 2.94Å; C854-L858 PolarHBondContact O-N 3.09Å
855	F	97.2	Very high	93.9	Very high	0 Å²	0	15.9 Å²	15.9	0%	0	9%	0.09	C	C	.	.	H	α-helix	trans	-74.6	-30.3	179	-72.6	-66.6	0	0	0	113	I787 F851 E852 N853 L858 G859 A883 M898 L901 F902	I787-F855 HydrophobicContact CG2-CE1 4.16Å; I787-F855 HydrophobicContact CG2-CE2 4.47Å; I787-F855 HydrophobicContact CG2-CZ 3.72Å; F851-F855 AromaticContact CD1-CD2 3.93Å; F851-F855 HydrophobicContact CD1-CD2 3.93Å; F851-F855 HydrophobicContact CD1-CE2 4.06Å; F851-F855 HydrophobicContact CD2-CE2 4.22Å; F851-F855 AromaticContact CE1-CD2 3.66Å; F851-F855 HydrophobicContact CE1-CD2 3.66Å; F851-F855 AromaticContact CE1-CE2 3.53Å; F851-F855 HydrophobicContact CE1-CE2 3.53Å; F851-F855 AromaticContact CE2-CE2 3.74Å; F851-F855 HydrophobicContact CE2-CE2 3.74Å; F851-F855 HydrophobicContact CG-CD2 4.48Å; F851-F855 HydrophobicContact CG-CE2 4.38Å; F851-F855 HydrophobicContact CZ-CD2 4.01Å; F851-F855 AromaticContact CZ-CE2 3.36Å; F851-F855 HydrophobicContact CZ-CE2 3.36Å; F851-F855 HydrophobicContact CZ-CZ 4.28Å; F851-F855 WeakPolarHBondContact O-CD2 3.42Å; F851-F855 PolarHBondContact O-N 3.37Å; E852-F855 PolarHBondContact O-N 3.15Å; N853-F855 VanDerWaalsContact C-N 3.34Å; N853-F855 PolarHBondContact O-N 3.24Å; F855-L858 PolarHBondContact O-N 3.44Å; F855-G859 PolarHBondContact O-N 3.45Å; F855-A883 HydrophobicContact CE1-CB 3.9Å; F855-A883 HydrophobicContact CZ-CB 4.32Å; F855-M898 HydrophobicContact CD1-CB 4.41Å; F855-M898 HydrophobicContact CD1-CG 3.88Å; F855-M898 HydrophobicContact CD2-CB 4.28Å; F855-M898 HydrophobicContact CE1-CB 4.29Å; F855-M898 HydrophobicContact CE1-CG 3.54Å; F855-M898 HydrophobicContact CE1-SD 4.04Å; F855-M898 HydrophobicContact CE2-CB 4.17Å; F855-M898 HydrophobicContact CE2-CG 4.24Å; F855-M898 HydrophobicContact CG-CB 4.4Å; F855-M898 HydrophobicContact CG-CG 4.36Å; F855-M898 HydrophobicContact CZ-CB 4.16Å; F855-M898 HydrophobicContact CZ-CG 3.73Å; F855-M898 HydrophobicContact CZ-SD 3.94Å; F855-L901 HydrophobicContact CB-CB 4.33Å; F855-F902 HydrophobicContact CB-CB 3.91Å; F855-F902 HydrophobicContact CD1-CB 3.68Å; F855-F902 AromaticContact CD1-CD1 3.83Å; F855-F902 HydrophobicContact CD1-CD1 3.83Å; F855-F902 AromaticContact CD1-CG 3.97Å; F855-F902 HydrophobicContact CD1-CG 3.97Å; F855-F902 HydrophobicContact CE1-CD1 4.12Å; F855-F902 HydrophobicContact CG-CB 4.23Å
856	H	96.1	Very high	93.9	Very high	61 Å²	61	17.6 Å²	17.6	28%	0.282	10%	0.097	S	C	.	.	H	α-helix	trans	-61.6	-43.1	169.5	-91.1	-64.3	0	0	0	112.1	L736 E852 N853 G859 N860 L901	L736-H856 HydrophobicContact CD1-CB 3.83Å; L736-H856 HydrophobicContact CD2-CB 3.98Å; E852-H856 WeakPolarHBondContact O-CB 3.47Å; E852-H856 PolarHBondContact O-CD2 3.12Å; E852-H856 VanDerWaalsContact O-CD2 3.31Å; E852-H856 PolarHBondContact O-N 3.09Å; N853-H856 PolarHBondContact O-N 3.2Å; H856-G859 PolarHBondContact O-N 3.08Å; H856-N860 WeakPolarHBondContact O-CB 3.3Å; H856-N860 PolarHBondContact O-N 2.9Å; H856-N860 PolarHBondContact O-ND2 3.21Å; H856-L901 WeakPolarHBondContact CE1-CD2 3.45Å
857	I	96.5	Very high	93.6	Very high	0 Å²	0	19.9 Å²	19.9	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-61.6	-49.4	178	-68.3	162.6	0	0	0	110	L732 M735 L736 F776 F779 L783 N853 C854 G859 N860 A861	L732-I857 HydrophobicContact CB-CD1 4.21Å; L732-I857 HydrophobicContact CD2-CD1 3.62Å; L732-I857 WeakPolarHBondContact O-CD1 3.32Å; M735-I857 HydrophobicContact CB-CD1 4.49Å; L736-I857 HydrophobicContact CB-CD1 4.28Å; L736-I857 HydrophobicContact CB-CG1 3.67Å; L736-I857 HydrophobicContact CD1-CG1 3.95Å; L736-I857 HydrophobicContact CG-CG1 4.32Å; F776-I857 HydrophobicContact CD2-CG2 4.36Å; F776-I857 HydrophobicContact CE2-CG2 3.73Å; F779-I857 HydrophobicContact CE1-CD1 4.43Å; L783-I857 HydrophobicContact CD1-CD1 4.48Å; L783-I857 HydrophobicContact CD2-CB 4.15Å; L783-I857 HydrophobicContact CD2-CG2 3.56Å; N853-I857 WeakPolarHBondContact O-CD1 3.11Å; N853-I857 VanDerWaalsContact O-CG1 3.23Å; N853-I857 WeakPolarHBondContact O-CG1 3.42Å; N853-I857 PolarHBondContact O-N 3.38Å; C854-I857 PolarHBondContact O-N 2.94Å; I857-G859 PolarHBondContact O-N 3.23Å; I857-N860 PolarHBondContact O-N 3.16Å; I857-A861 PolarHBondContact O-N 2.91Å; I857-A861 VanDerWaalsContact O-N 3.08Å
858	L	95.7	Very high	93.4	Very high	2 Å²	2	22 Å²	22	1%	0.01	12%	0.12	C	C	.	.	H	α-helix	trans	-64.1	-39.3	177.2	-70.1	-175.2	0	0	0	112.9	F776 L780 L783 L784 I787 C854 F855 N860 A861 F902	F776-L858 HydrophobicContact CZ-CD2 4.42Å; L780-L858 HydrophobicContact CD1-CD2 3.77Å; L783-L858 HydrophobicContact CD2-CD2 3.73Å; L783-L858 HydrophobicContact CD2-CG 4.02Å; L784-L858 HydrophobicContact CD2-CD1 4.34Å; I787-L858 HydrophobicContact CD1-CD1 3.35Å; I787-L858 HydrophobicContact CD1-CG 4.1Å; C854-L858 PolarHBondContact O-N 3.09Å; F855-L858 PolarHBondContact O-N 3.44Å; L858-N860 VanDerWaalsContact C-N 3.33Å; L858-N860 PolarHBondContact O-N 2.75Å; L858-A861 WeakPolarHBondContact O-CB 3.46Å; L858-A861 PolarHBondContact O-N 3.26Å; L858-F902 HydrophobicContact CB-CD2 3.54Å; L858-F902 HydrophobicContact CB-CE2 3.71Å; L858-F902 HydrophobicContact CB-CG 4.23Å; L858-F902 HydrophobicContact CD1-CE2 4.35Å; L858-F902 HydrophobicContact CD1-CZ 4.36Å
859	G	94.8	Very high	93.4	Very high	1 Å²	1	21 Å²	21	1%	0.01	11%	0.114	C	C	.	.	H	α-helix	trans	-64.5	-35.7	178.6	0	0	0	0	0	113.1	F855 H856 I857 P863 Q905	F855-G859 PolarHBondContact O-N 3.45Å; H856-G859 PolarHBondContact O-N 3.08Å; I857-G859 PolarHBondContact O-N 3.23Å; G859-P863 WeakPolarHBondContact O-CD 3.49Å; G859-Q905 WeakPolarHBondContact O-CB 3.37Å
860	N	94.8	Very high	93.4	Very high	37 Å²	37	19.6 Å²	19.6	20%	0.198	10%	0.103	C	C	.	.	H	α-helix	trans	-83.5	-15.9	176.6	-74.4	-89.7	0	0	0	113.3	V739 H856 I857 L858 P863 A864	V739-N860 HydrophobicContact CG1-CB 3.92Å; H856-N860 WeakPolarHBondContact O-CB 3.3Å; H856-N860 PolarHBondContact O-N 2.9Å; H856-N860 PolarHBondContact O-ND2 3.21Å; I857-N860 PolarHBondContact O-N 3.16Å; L858-N860 VanDerWaalsContact C-N 3.33Å; L858-N860 PolarHBondContact O-N 2.75Å; N860-P863 WeakPolarHBondContact O-CD 3.3Å; N860-P863 WeakPolarHBondContact O-CG 3.49Å; N860-A864 WeakPolarHBondContact O-CB 3.45Å; N860-A864 PolarHBondContact O-N 3.08Å; N860-A864 VanDerWaalsContact O-N 3.08Å
861	A	94.3	Very high	93.2	Very high	0 Å²	0	23.6 Å²	23.6	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-63.7	-43.6	-177.9	0	0	0	0	0	112.8	F776 I857 L858 A864 L865 F869	F776-A861 HydrophobicContact CE1-CB 3.99Å; F776-A861 HydrophobicContact CE2-CB 3.75Å; F776-A861 HydrophobicContact CZ-CB 3.38Å; I857-A861 PolarHBondContact O-N 2.91Å; I857-A861 VanDerWaalsContact O-N 3.08Å; L858-A861 WeakPolarHBondContact O-CB 3.46Å; L858-A861 PolarHBondContact O-N 3.26Å; A861-A864 PolarHBondContact O-N 3.27Å; A861-L865 VanDerWaalsContact O-CB 3.29Å; A861-L865 WeakPolarHBondContact O-CB 3.45Å; A861-L865 WeakPolarHBondContact O-CG 3.47Å; A861-L865 PolarHBondContact O-N 2.99Å; A861-F869 HydrophobicContact CB-CD2 3.83Å; A861-F869 HydrophobicContact CB-CE2 3.84Å; A861-F869 HydrophobicContact CB-CG 4.2Å; A861-F869 HydrophobicContact CB-CZ 4.22Å
862	G	91.1	Very high	93.1	Very high	1 Å²	1	25.2 Å²	25.2	1%	0.01	14%	0.138	C	C	.	.	H	α-helix	trans	-54.7	-60.8	176.9	0	0	0	0	0	113.8	A864 L866 Y870	G862-A864 VanDerWaalsContact C-N 3.32Å; G862-A864 PolarHBondContact O-N 3.17Å; G862-L866 WeakPolarHBondContact O-CA 3.27Å; G862-L866 PolarHBondContact O-N 3.29Å; G862-Y870 WeakPolarHBondContact CA-OH 3.49Å
863	P	90.4	Very high	92.8	Very high	53 Å²	53	31.9 Å²	31.9	34%	0.344	17%	0.169	S	C	.	.	H	α-helix	trans	-68	-29.1	-179.9	25.9	-33.6	0	0	0	113.4	G859 N860	G859-P863 WeakPolarHBondContact O-CD 3.49Å; N860-P863 WeakPolarHBondContact O-CD 3.3Å; N860-P863 WeakPolarHBondContact O-CG 3.49Å
864	A	91.6	Very high	92.5	Very high	12 Å²	12	34.4 Å²	34.4	10%	0.099	19%	0.188	C	C	.	.	H	α-helix	trans	-77.9	-39.4	-179	0	0	0	0	0	113.4	V739 W744 N770 N860 A861 G862	V739-A864 HydrophobicContact CG1-CB 4Å; V739-A864 VanDerWaalsContact O-CB 3.25Å; V739-A864 WeakPolarHBondContact O-CB 3.45Å; W744-A864 WeakPolarHBondContact CZ3-O 3.29Å; N770-A864 WeakPolarHBondContact CB-O 3.5Å; N770-A864 PolarHBondContact ND2-O 3.49Å; N860-A864 WeakPolarHBondContact O-CB 3.45Å; N860-A864 PolarHBondContact O-N 3.08Å; N860-A864 VanDerWaalsContact O-N 3.08Å; A861-A864 PolarHBondContact O-N 3.27Å; G862-A864 VanDerWaalsContact C-N 3.32Å; G862-A864 PolarHBondContact O-N 3.17Å
865	L	92	Very high	92.3	Very high	1 Å²	1	35 Å²	35	1%	0.005	19%	0.191	C	C	.	.	H	α-helix	trans	-106.7	-17.9	-170.7	-56.6	-179.7	0	0	0	113.4	N770 A773 F776 A861 Q867 D868 F869	N770-L865 HydrophobicContact CB-CD2 3.66Å; A773-L865 HydrophobicContact CB-CD2 4.06Å; F776-L865 HydrophobicContact CB-CD1 3.86Å; F776-L865 HydrophobicContact CD1-CD1 3.26Å; F776-L865 HydrophobicContact CD2-CD1 4.35Å; F776-L865 HydrophobicContact CE1-CD1 3.86Å; F776-L865 HydrophobicContact CG-CD1 3.55Å; A861-L865 VanDerWaalsContact O-CB 3.29Å; A861-L865 WeakPolarHBondContact O-CB 3.45Å; A861-L865 WeakPolarHBondContact O-CG 3.47Å; A861-L865 PolarHBondContact O-N 2.99Å; L865-Q867 PolarHBondContact O-N 3.2Å; L865-D868 HydrophobicContact CB-CB 4.36Å; L865-D868 PolarHBondContact O-N 3.42Å; L865-F869 HydrophobicContact CB-CB 3.86Å; L865-F869 HydrophobicContact CD1-CB 4.31Å
866	L	88.6	Confident	92	Very high	47 Å²	47	35.7 Å²	35.7	25%	0.246	20%	0.197	C	C	.	.	T	Hydrogen-bonded Turn	trans	50.9	-120	-178.8	-55.8	175.6	0	0	0	111.5	W744 Y768 G862 D868 F869 Y870	W744-L866 HydrophobicContact CH2-CD1 3.51Å; W744-L866 HydrophobicContact CH2-CG 3.83Å; W744-L866 HydrophobicContact CZ2-CD1 3.72Å; W744-L866 HydrophobicContact CZ2-CG 4.41Å; W744-L866 HydrophobicContact CZ3-CD1 4.46Å; Y768-L866 HydrophobicContact CD2-CD1 4.31Å; G862-L866 WeakPolarHBondContact O-CA 3.27Å; G862-L866 PolarHBondContact O-N 3.29Å; L866-D868 VanDerWaalsContact C-N 3.29Å; L866-D868 PolarHBondContact O-N 2.79Å; L866-F869 PolarHBondContact O-N 3.26Å; L866-F869 VanDerWaalsContact O-N 3.13Å; L866-Y870 WeakPolarHBondContact O-CD2 3.43Å; L866-Y870 PolarHBondContact O-N 3.32Å; L866-Y870 VanDerWaalsContact O-N 3.13Å
867	Q	87.3	Confident	91.9	Very high	66 Å²	66	39 Å²	39	31%	0.308	21%	0.212	S	C	.	.	H	α-helix	trans	-59.3	-39	-174.9	-67.6	-175.7	-1.1	0	0	112.2	I767 L865 F869 Y870 T871	I767-Q867 HydrophobicContact CG2-CG 4.27Å; L865-Q867 PolarHBondContact O-N 3.2Å; Q867-F869 PolarHBondContact O-N 3.49Å; Q867-F869 VanDerWaalsContact O-N 3.07Å; Q867-Y870 PolarHBondContact O-N 2.81Å; Q867-Y870 VanDerWaalsContact O-N 3.11Å; Q867-T871 WeakPolarHBondContact O-CB 3.44Å; Q867-T871 WeakPolarHBondContact O-CG2 3.44Å; Q867-T871 PolarHBondContact O-N 2.95Å; Q867-T871 PolarHBondContact O-OG1 3.48Å
868	D	89.8	Confident	91.7	Very high	56 Å²	56	40.2 Å²	40.2	30%	0.299	22%	0.224	S	C	.	.	H	α-helix	trans	-59.1	-26.7	-179.2	-67.6	-28.8	0	0	0	112.4	A773 L865 L866	A773-D868 HydrophobicContact CB-CB 4.07Å; L865-D868 HydrophobicContact CB-CB 4.36Å; L865-D868 PolarHBondContact O-N 3.42Å; L866-D868 VanDerWaalsContact C-N 3.29Å; L866-D868 PolarHBondContact O-N 2.79Å
869	F	93.7	Very high	91.7	Very high	1 Å²	1	40.1 Å²	40.1	0%	0.004	22%	0.224	C	C	.	.	H	α-helix	trans	-86	-49.9	172	177.8	-110	0	0	0	112.1	F776 A861 L865 L866 Q867 T871 V872 L875 L906	F776-F869 AromaticContact CE1-CD2 3.77Å; F776-F869 HydrophobicContact CE1-CD2 3.77Å; F776-F869 HydrophobicContact CE1-CE2 4.08Å; F776-F869 HydrophobicContact CZ-CD2 4.24Å; F776-F869 HydrophobicContact CZ-CE2 4.18Å; A861-F869 HydrophobicContact CB-CD2 3.83Å; A861-F869 HydrophobicContact CB-CE2 3.84Å; A861-F869 HydrophobicContact CB-CG 4.2Å; A861-F869 HydrophobicContact CB-CZ 4.22Å; L865-F869 HydrophobicContact CB-CB 3.86Å; L865-F869 HydrophobicContact CD1-CB 4.31Å; L866-F869 PolarHBondContact O-N 3.26Å; L866-F869 VanDerWaalsContact O-N 3.13Å; Q867-F869 PolarHBondContact O-N 3.49Å; Q867-F869 VanDerWaalsContact O-N 3.07Å; F869-T871 PolarHBondContact O-N 3.1Å; F869-V872 WeakPolarHBondContact O-CB 3.16Å; F869-V872 VanDerWaalsContact O-CG2 3.23Å; F869-V872 WeakPolarHBondContact O-CG2 3.43Å; F869-V872 PolarHBondContact O-N 3.27Å; F869-V872 VanDerWaalsContact O-N 3.16Å; F869-L875 HydrophobicContact CD1-CD2 4.27Å; F869-L875 HydrophobicContact CE1-CD2 3.96Å; F869-L875 HydrophobicContact CE2-CD1 3.97Å; F869-L875 HydrophobicContact CE2-CD2 4.33Å; F869-L875 HydrophobicContact CZ-CD1 4.08Å; F869-L875 HydrophobicContact CZ-CD2 4Å; F869-L875 WeakPolarHBondContact O-CD2 3.44Å; F869-L906 HydrophobicContact CE1-CD1 3.86Å
870	Y	92.2	Very high	91.6	Very high	10 Å²	10	43.3 Å²	43.3	4%	0.039	24%	0.24	C	C	.	.	H	α-helix	trans	-69.7	-17.5	-174.6	-65.9	-65.6	0	0	0	114.4	G862 L866 Q867 L906 S909 C910 P911 Y914 L918	G862-Y870 WeakPolarHBondContact CA-OH 3.49Å; L866-Y870 WeakPolarHBondContact O-CD2 3.43Å; L866-Y870 PolarHBondContact O-N 3.32Å; L866-Y870 VanDerWaalsContact O-N 3.13Å; Q867-Y870 PolarHBondContact O-N 2.81Å; Q867-Y870 VanDerWaalsContact O-N 3.11Å; Y870-L906 HydrophobicContact CE1-CD1 3.96Å; Y870-S909 VanDerWaalsContact OH-C 3.25Å; Y870-S909 PolarHBondContact OH-O 3.22Å; Y870-S909 PolarHBondContact OH-OG 3.48Å; Y870-C910 HydrophobicContact CE1-CB 4.03Å; Y870-C910 WeakPolarHBondContact OH-CA 3.33Å; Y870-C910 PolarHBondContact OH-N 2.95Å; Y870-P911 HydrophobicContact CD2-CG 4.12Å; Y870-P911 VanDerWaalsContact CE2-CD 3.44Å; Y870-P911 HydrophobicContact CE2-CG 4.27Å; Y870-Y914 HydrophobicContact CG-CD2 4.14Å; Y870-Y914 HydrophobicContact CG-CE2 4.42Å; Y870-L918 HydrophobicContact CD1-CD2 3.52Å; Y870-L918 HydrophobicContact CE1-CD2 3.8Å
871	T	90.1	Very high	91.6	Very high	86 Å²	86	43.2 Å²	43.2	53%	0.528	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.8	4.2	174.5	61.6	0	0	0	0	114.1	Q867 F869 E873 Y914	Q867-T871 WeakPolarHBondContact O-CB 3.44Å; Q867-T871 WeakPolarHBondContact O-CG2 3.44Å; Q867-T871 PolarHBondContact O-N 2.95Å; Q867-T871 PolarHBondContact O-OG1 3.48Å; F869-T871 PolarHBondContact O-N 3.1Å; T871-E873 PolarHBondContact O-N 2.76Å; T871-Y914 HydrophobicContact CG2-CE1 4.46Å; T871-Y914 VanDerWaalsContact CG2-OH 3.29Å; T871-Y914 WeakPolarHBondContact CG2-OH 3.26Å
872	V	92.3	Very high	91.6	Very high	37 Å²	37	43.4 Å²	43.4	22%	0.224	25%	0.249	C	C	.	.	S	Bend	trans	-59.7	129	174.9	172	0	0	0	0	109.9	L777 L780 F869 S874 L875	L777-V872 HydrophobicContact CD2-CG2 3.46Å; L777-V872 VanDerWaalsContact CD2-CG2 3.46Å; L780-V872 HydrophobicContact CD2-CG1 4.25Å; F869-V872 WeakPolarHBondContact O-CB 3.16Å; F869-V872 VanDerWaalsContact O-CG2 3.23Å; F869-V872 WeakPolarHBondContact O-CG2 3.43Å; F869-V872 PolarHBondContact O-N 3.27Å; F869-V872 VanDerWaalsContact O-N 3.16Å; V872-S874 PolarHBondContact O-N 3.47Å; V872-L875 HydrophobicContact CB-CB 4.15Å; V872-L875 HydrophobicContact CB-CD1 4.33Å; V872-L875 HydrophobicContact CG1-CB 4.34Å; V872-L875 HydrophobicContact CG1-CD1 4.33Å; V872-L875 WeakPolarHBondContact O-CB 3.06Å; V872-L875 PolarHBondContact O-N 3.22Å
873	E	88.7	Confident	91.7	Very high	184 Å²	184	43.4 Å²	43.4	86%	0.86	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.7	132.8	-178.5	-164.8	173.6	-166.8	0	0	110.7	T871 L875	T871-E873 PolarHBondContact O-N 2.76Å; E873-L875 PolarHBondContact O-N 3.18Å; E873-L875 VanDerWaalsContact O-N 3.12Å
874	S	88.6	Confident	91.9	Very high	67 Å²	67	42.4 Å²	42.4	47%	0.469	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	52.6	30.4	-177.4	-76.2	0	0	0	0	114.9	V872 A876 E877 G878	V872-S874 PolarHBondContact O-N 3.47Å; S874-A876 VanDerWaalsContact C-N 3.32Å; S874-A876 PolarHBondContact O-N 3.34Å; S874-E877 VanDerWaalsContact CB-OE2 3.27Å; S874-E877 WeakPolarHBondContact CB-OE2 3.39Å; S874-E877 PolarHBondContact O-N 2.84Å; S874-E877 VanDerWaalsContact O-N 3.1Å; S874-E877 PolarHBondContact OG-OE2 3.01Å; S874-G878 PolarHBondContact O-N 3.4Å
875	L	92.2	Very high	91.9	Very high	13 Å²	13	43.6 Å²	43.6	7%	0.068	25%	0.245	C	C	.	.	H	α-helix	trans	-54.3	-44.8	-179.6	-179.5	63.9	0	0	0	113.1	F869 V872 E873 E877 G878 I879 L918	F869-L875 HydrophobicContact CD1-CD2 4.27Å; F869-L875 HydrophobicContact CE1-CD2 3.96Å; F869-L875 HydrophobicContact CE2-CD1 3.97Å; F869-L875 HydrophobicContact CE2-CD2 4.33Å; F869-L875 HydrophobicContact CZ-CD1 4.08Å; F869-L875 HydrophobicContact CZ-CD2 4Å; F869-L875 WeakPolarHBondContact O-CD2 3.44Å; V872-L875 HydrophobicContact CB-CB 4.15Å; V872-L875 HydrophobicContact CB-CD1 4.33Å; V872-L875 HydrophobicContact CG1-CB 4.34Å; V872-L875 HydrophobicContact CG1-CD1 4.33Å; V872-L875 WeakPolarHBondContact O-CB 3.06Å; V872-L875 PolarHBondContact O-N 3.22Å; E873-L875 PolarHBondContact O-N 3.18Å; E873-L875 VanDerWaalsContact O-N 3.12Å; L875-E877 VanDerWaalsContact C-N 3.35Å; L875-E877 PolarHBondContact O-N 3.14Å; L875-G878 PolarHBondContact O-N 3.31Å; L875-I879 HydrophobicContact CD1-CD1 3.98Å; L875-I879 HydrophobicContact CD1-CG1 4.29Å; L875-I879 HydrophobicContact CG-CD1 3.85Å; L875-I879 VanDerWaalsContact O-CG1 3.31Å; L875-I879 WeakPolarHBondContact O-CG1 3.31Å; L875-I879 PolarHBondContact O-N 3.28Å; L875-L918 HydrophobicContact CB-CD1 4.46Å; L875-L918 HydrophobicContact CD2-CD1 4.08Å; L875-L918 HydrophobicContact CD2-CD2 4.03Å; L875-L918 HydrophobicContact CG-CD1 4.11Å
876	A	92.2	Very high	91.9	Very high	15 Å²	15	45 Å²	45	12%	0.124	26%	0.255	C	S	.	.	H	α-helix	trans	-60	-45.2	178.2	0	0	0	0	0	111.5	S874 I879 I880 L918 P921	S874-A876 VanDerWaalsContact C-N 3.32Å; S874-A876 PolarHBondContact O-N 3.34Å; A876-I879 PolarHBondContact O-N 2.98Å; A876-I880 WeakPolarHBondContact O-CD1 3.5Å; A876-I880 WeakPolarHBondContact O-CG1 3.4Å; A876-I880 PolarHBondContact O-N 3.17Å; A876-L918 HydrophobicContact CB-CD1 3.79Å; A876-P921 HydrophobicContact CB-CG 4.22Å
877	E	93	Very high	92.1	Very high	131 Å²	131	43.6 Å²	43.6	61%	0.612	25%	0.248	S	C	*	.	H	α-helix	trans	-66.3	-39.8	178.3	-60.9	176.5	160.8	0	0	111.4	S874 L875 I880 G881	S874-E877 VanDerWaalsContact CB-OE2 3.27Å; S874-E877 WeakPolarHBondContact CB-OE2 3.39Å; S874-E877 PolarHBondContact O-N 2.84Å; S874-E877 VanDerWaalsContact O-N 3.1Å; S874-E877 PolarHBondContact OG-OE2 3.01Å; L875-E877 VanDerWaalsContact C-N 3.35Å; L875-E877 PolarHBondContact O-N 3.14Å; E877-I880 PolarHBondContact O-N 3.04Å; E877-G881 PolarHBondContact O-N 2.95Å
878	G	92.8	Very high	92.3	Very high	24 Å²	24	46 Å²	46	25%	0.247	26%	0.263	C	S	.	.	H	α-helix	trans	-63.1	-40.7	175.6	0	0	0	0	0	113	S874 L875 S882	S874-G878 PolarHBondContact O-N 3.4Å; L875-G878 PolarHBondContact O-N 3.31Å; G878-S882 VanDerWaalsContact O-CB 3.31Å; G878-S882 WeakPolarHBondContact O-CB 3.32Å; G878-S882 PolarHBondContact O-N 2.84Å; G878-S882 PolarHBondContact O-OG 2.96Å
879	I	94.7	Very high	92.5	Very high	1 Å²	1	47.7 Å²	47.7	1%	0.005	27%	0.269	C	S	.	.	H	α-helix	trans	-67	-47.9	174.6	-67.1	162.7	0	0	0	110.2	L875 A876 S882 A883 F902 L918 L922	L875-I879 HydrophobicContact CD1-CD1 3.98Å; L875-I879 HydrophobicContact CD1-CG1 4.29Å; L875-I879 HydrophobicContact CG-CD1 3.85Å; L875-I879 VanDerWaalsContact O-CG1 3.31Å; L875-I879 WeakPolarHBondContact O-CG1 3.31Å; L875-I879 PolarHBondContact O-N 3.28Å; A876-I879 PolarHBondContact O-N 2.98Å; I879-S882 CarbonylContact O-C 2.96Å; I879-S882 PolarHBondContact O-N 3.39Å; I879-S882 VanDerWaalsContact O-N 3.15Å; I879-A883 HydrophobicContact CG2-CB 4.16Å; I879-A883 WeakPolarHBondContact O-CB 3.1Å; I879-A883 PolarHBondContact O-N 3.39Å; I879-F902 HydrophobicContact CD1-CZ 4.05Å; I879-F902 HydrophobicContact CG1-CZ 4.28Å; I879-F902 HydrophobicContact CG2-CE1 3.88Å; I879-F902 HydrophobicContact CG2-CZ 3.93Å; I879-L918 HydrophobicContact CD1-CD1 4.26Å; I879-L922 HydrophobicContact CB-CD2 4.06Å; I879-L922 HydrophobicContact CD1-CD1 4.14Å; I879-L922 HydrophobicContact CG2-CD1 4.39Å; I879-L922 HydrophobicContact CG2-CD2 3.71Å
880	I	94.2	Very high	92.5	Very high	67 Å²	67	47.7 Å²	47.7	34%	0.344	27%	0.269	S	S	.	.	H	α-helix	trans	-60.1	-49.8	179.1	-68.1	166	0	0	0	110.4	A876 E877 S882 F884 L922	A876-I880 WeakPolarHBondContact O-CD1 3.5Å; A876-I880 WeakPolarHBondContact O-CG1 3.4Å; A876-I880 PolarHBondContact O-N 3.17Å; E877-I880 PolarHBondContact O-N 3.04Å; I880-S882 PolarHBondContact O-N 2.96Å; I880-F884 HydrophobicContact CB-CD2 4.46Å; I880-F884 HydrophobicContact CG1-CD2 4.01Å; I880-F884 HydrophobicContact CG1-CE2 4.36Å; I880-F884 PolarHBondContact O-N 3.36Å; I880-L922 HydrophobicContact CD1-CD2 4.1Å; I880-L922 HydrophobicContact CG1-CD2 3.53Å
881	G	93.5	Very high	92.6	Very high	36 Å²	36	48.9 Å²	48.9	37%	0.371	28%	0.278	S	S	.	.	H	α-helix	trans	-68.5	3.2	179.1	0	0	0	0	0	114.7	R788 E877 T885	R788-G881 WeakPolarHBondContact CD-O 3.28Å; E877-G881 PolarHBondContact O-N 2.95Å; G881-T885 PolarHBondContact O-OG1 2.81Å
882	S	94.3	Very high	92.7	Very high	4 Å²	4	45.4 Å²	45.4	3%	0.028	26%	0.256	C	S	.	.	H	α-helix	trans	-129.3	-73.2	177.6	-49.1	0	0	0	0	111.4	L784 N791 G878 I879 I880 F884 T885	L784-S882 WeakPolarHBondContact O-CB 3.46Å; L784-S882 PolarHBondContact O-OG 2.86Å; N791-S882 PolarHBondContact ND2-O 2.74Å; N791-S882 VanDerWaalsContact ND2-O 3.14Å; G878-S882 VanDerWaalsContact O-CB 3.31Å; G878-S882 WeakPolarHBondContact O-CB 3.32Å; G878-S882 PolarHBondContact O-N 2.84Å; G878-S882 PolarHBondContact O-OG 2.96Å; I879-S882 CarbonylContact O-C 2.96Å; I879-S882 PolarHBondContact O-N 3.39Å; I879-S882 VanDerWaalsContact O-N 3.15Å; I880-S882 PolarHBondContact O-N 2.96Å; S882-F884 VanDerWaalsContact C-N 3.27Å; S882-F884 PolarHBondContact O-N 3.41Å; S882-T885 WeakPolarHBondContact O-CB 3.4Å; S882-T885 PolarHBondContact O-N 3.39Å; S882-T885 PolarHBondContact O-OG1 3.1Å
883	A	93.8	Very high	92.7	Very high	1 Å²	1	45 Å²	45	1%	0.008	25%	0.252	C	S	.	.	H	α-helix	trans	-63.4	-29.1	-175.1	0	0	0	0	0	113.4	I787 N791 F855 I879 M898	I787-A883 HydrophobicContact CG2-CB 4.21Å; N791-A883 PolarHBondContact ND2-O 3.44Å; F855-A883 HydrophobicContact CE1-CB 3.9Å; F855-A883 HydrophobicContact CZ-CB 4.32Å; I879-A883 HydrophobicContact CG2-CB 4.16Å; I879-A883 WeakPolarHBondContact O-CB 3.1Å; I879-A883 PolarHBondContact O-N 3.39Å; A883-M898 HydrophobicContact CB-SD 4.45Å
884	F	94.3	Very high	93	Very high	32 Å²	32	36.6 Å²	36.6	14%	0.14	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	-102.5	13.7	-178.3	-57.2	-15.7	0	0	0	113.7	I880 S882 L887 M898 L903 L922 L926	I880-F884 HydrophobicContact CB-CD2 4.46Å; I880-F884 HydrophobicContact CG1-CD2 4.01Å; I880-F884 HydrophobicContact CG1-CE2 4.36Å; I880-F884 PolarHBondContact O-N 3.36Å; S882-F884 VanDerWaalsContact C-N 3.27Å; S882-F884 PolarHBondContact O-N 3.41Å; F884-L887 HydrophobicContact CB-CD1 3.94Å; F884-L887 HydrophobicContact CB-CG 4.43Å; F884-L887 HydrophobicContact CD1-CD1 4.28Å; F884-L887 HydrophobicContact CG-CD1 4.3Å; F884-M898 HydrophobicContact CD1-CE 4.45Å; F884-M898 HydrophobicContact CD1-SD 4.45Å; F884-M898 HydrophobicContact CE1-CE 4.29Å; F884-M898 HydrophobicContact CE1-SD 4.42Å; F884-L903 HydrophobicContact CE1-CD1 4.32Å; F884-L903 HydrophobicContact CE1-CD2 4.24Å; F884-L903 HydrophobicContact CZ-CD2 4.03Å; F884-L922 HydrophobicContact CD2-CD2 4.45Å; F884-L922 HydrophobicContact CE2-CB 4.23Å; F884-L922 HydrophobicContact CE2-CD2 3.67Å; F884-L922 HydrophobicContact CZ-CB 4.49Å; F884-L922 HydrophobicContact CZ-CD2 4.18Å; F884-L926 HydrophobicContact CE1-CD1 4.29Å; F884-L926 HydrophobicContact CZ-CB 4.49Å; F884-L926 HydrophobicContact CZ-CD1 4.44Å
885	T	91.9	Very high	93.3	Very high	36 Å²	36	33.5 Å²	33.5	22%	0.221	19%	0.19	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.4	139.6	174	-56.3	0	0	0	0	110.2	R788 N791 G881 S882 L887	R788-T885 HydrophobicContact CG-CG2 4.17Å; N791-T885 WeakPolarHBondContact CB-O 3.33Å; G881-T885 PolarHBondContact O-OG1 2.81Å; S882-T885 WeakPolarHBondContact O-CB 3.4Å; S882-T885 PolarHBondContact O-N 3.39Å; S882-T885 PolarHBondContact O-OG1 3.1Å; T885-L887 PolarHBondContact O-N 3.28Å; T885-L887 VanDerWaalsContact O-N 3.08Å
886	S	91.4	Very high	93.5	Very high	31 Å²	31	35.6 Å²	35.6	22%	0.217	20%	0.197	C	C	.	.	T	Hydrogen-bonded Turn	trans	54.4	27.6	172.4	-54.8	0	0	0	0	116	D888 H889	S886-D888 PolarHBondContact O-N 3.32Å; S886-D888 VanDerWaalsContact O-N 3.08Å; S886-H889 PolarHBondContact O-N 3.17Å
887	L	92.9	Very high	93.6	Very high	17 Å²	17	35.2 Å²	35.2	9%	0.089	19%	0.194	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.7	-29.9	-175.4	-68.6	178.7	0	0	0	114.2	F884 T885 H889 V890 L895 M898 Y929 R933	F884-L887 HydrophobicContact CB-CD1 3.94Å; F884-L887 HydrophobicContact CB-CG 4.43Å; F884-L887 HydrophobicContact CD1-CD1 4.28Å; F884-L887 HydrophobicContact CG-CD1 4.3Å; T885-L887 PolarHBondContact O-N 3.28Å; T885-L887 VanDerWaalsContact O-N 3.08Å; L887-H889 PolarHBondContact O-N 2.9Å; L887-V890 PolarHBondContact O-N 2.92Å; L887-V890 VanDerWaalsContact O-N 3.14Å; L887-L895 HydrophobicContact CD2-CD2 3.77Å; L887-M898 HydrophobicContact CD2-CE 4.27Å; L887-Y929 HydrophobicContact CB-CE1 3.81Å; L887-Y929 HydrophobicContact CB-CE2 4.36Å; L887-Y929 HydrophobicContact CD1-CD1 4.12Å; L887-Y929 HydrophobicContact CD1-CE1 4.2Å; L887-Y929 PolarHBondContact O-OH 2.86Å; L887-Y929 VanDerWaalsContact O-OH 3.12Å; L887-R933 PolarHBondContact O-NH1 3.39Å
888	D	91.9	Very high	93.7	Very high	118 Å²	118	29 Å²	29	63%	0.631	17%	0.165	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.2	-31.3	177.2	-68.8	-36.4	0	0	0	113.7	S886 Y929	S886-D888 PolarHBondContact O-N 3.32Å; S886-D888 VanDerWaalsContact O-N 3.08Å; D888-Y929 VanDerWaalsContact CA-OH 3.28Å; D888-Y929 WeakPolarHBondContact CA-OH 3.38Å; D888-Y929 PolarHBondContact N-OH 3.48Å; D888-Y929 WeakPolarHBondContact OD1-CE2 3.42Å; D888-Y929 PolarHBondContact OD1-OH 3.34Å; D888-Y929 VanDerWaalsContact OD1-OH 3.06Å
889	H	93.5	Very high	93.9	Very high	91 Å²	91	27.9 Å²	27.9	42%	0.421	15%	0.153	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.6	-16.9	-179.3	-60.5	-62.7	0	0	0	113.3	F794 S886 L887	F794-H889 HydrophobicContact CB-CB 3.98Å; F794-H889 WeakPolarHBondContact CB-O 3.31Å; F794-H889 WeakPolarHBondContact O-CB 3.4Å; S886-H889 PolarHBondContact O-N 3.17Å; L887-H889 PolarHBondContact O-N 2.9Å
890	V	94.3	Very high	93.9	Very high	1 Å²	1	31.2 Å²	31.2	1%	0.006	17%	0.166	C	C	.	.	S	Bend	trans	-68.3	128	179.2	-177.7	0	0	0	0	109.3	N791 F794 L887 R894 L895 R933	N791-V890 HydrophobicContact CB-CG2 4.3Å; F794-V890 HydrophobicContact CD2-CB 4.44Å; F794-V890 HydrophobicContact CD2-CG1 4.49Å; F794-V890 HydrophobicContact CD2-CG2 3.98Å; F794-V890 HydrophobicContact CE2-CG1 4.38Å; F794-V890 HydrophobicContact CE2-CG2 4.5Å; L887-V890 PolarHBondContact O-N 2.92Å; L887-V890 VanDerWaalsContact O-N 3.14Å; V890-R894 HydrophobicContact CG1-CB 3.7Å; V890-L895 HydrophobicContact CB-CD2 4.02Å; V890-L895 HydrophobicContact CB-CG 4.24Å; V890-L895 HydrophobicContact CG1-CD2 3.81Å; V890-L895 HydrophobicContact CG1-CG 3.9Å; V890-R933 PolarHBondContact O-NH1 3.09Å; V890-R933 PolarHBondContact O-NH2 3.31Å
891	P	93.4	Very high	93.9	Very high	35 Å²	35	28.9 Å²	28.9	23%	0.227	15%	0.154	C	C	.	.			trans	-74.6	159.2	-176.5	27.9	-33.3	0	0	0	112.8	F794 H893 R894 L895	F794-P891 HydrophobicContact CD1-CG 4.25Å; F794-P891 HydrophobicContact CE1-CG 3.95Å; F794-P891 HydrophobicContact CZ-CG 4.45Å; P891-H893 VanDerWaalsContact C-N 3.33Å; P891-H893 VanDerWaalsContact CG-CE1 3.47Å; P891-H893 WeakPolarHBondContact CG-CE1 3.39Å; P891-H893 PolarHBondContact O-N 3.03Å; P891-R894 HydrophobicContact CG-CB 4.22Å; P891-R894 HydrophobicContact CG-CG 3.71Å; P891-R894 PolarHBondContact O-N 3.38Å; P891-L895 PolarHBondContact O-N 3.47Å; P891-L895 VanDerWaalsContact O-N 3.09Å
892	D	93.6	Very high	94	Very high	13 Å²	13	27.2 Å²	27.2	7%	0.07	14%	0.136	C	C	.	.	H	α-helix	trans	-60.8	-37.5	-169.6	-64	-35.6	0	0	0	113	R894 L895 R896 R933 K937 L972 L976	D892-R894 VanDerWaalsContact C-N 3.29Å; D892-R894 PolarHBondContact O-N 3.33Å; D892-L895 PolarHBondContact O-N 2.97Å; D892-R896 WeakPolarHBondContact O-CB 3.16Å; D892-R896 PolarHBondContact O-N 2.85Å; D892-R933 IonicContact OD1-CZ 3.77Å; D892-R933 VanDerWaalsContact OD1-CZ 3.29Å; D892-R933 IonicContact OD1-NE 2.59Å; D892-R933 PolarHBondContact OD1-NE 3.44Å; D892-R933 IonicContact OD1-NH2 3.24Å; D892-R933 PolarHBondContact OD1-NH2 2.78Å; D892-K937 IonicContact OD2-NZ 2.97Å; D892-K937 PolarHBondContact OD2-NZ 3.47Å; D892-L972 HydrophobicContact CB-CB 4.45Å; D892-L976 HydrophobicContact CB-CD2 3.76Å; D892-L976 WeakPolarHBondContact OD1-CD2 3.32Å
893	H	92.1	Very high	94.1	Very high	29 Å²	29	27 Å²	27	13%	0.134	14%	0.135	C	C	.	.	H	α-helix	trans	-65	-29.3	176.5	69.6	-87.4	0	0	0	113.3	V812 P891 R896 S897 L972	V812-H893 HydrophobicContact CG2-CB 4.38Å; P891-H893 VanDerWaalsContact C-N 3.33Å; P891-H893 VanDerWaalsContact CG-CE1 3.47Å; P891-H893 WeakPolarHBondContact CG-CE1 3.39Å; P891-H893 PolarHBondContact O-N 3.03Å; H893-R896 WeakPolarHBondContact O-CB 3.27Å; H893-S897 PolarHBondContact O-N 2.81Å; H893-L972 HydrophobicContact CB-CD2 3.82Å
894	R	94.4	Very high	94.1	Very high	6 Å²	6	29.3 Å²	29.3	2%	0.023	15%	0.145	C	C	.	.	H	α-helix	trans	-81.7	-42	177.6	-62.4	-60.2	178.1	141.2	-2.3	112	F794 F847 N848 F851 V890 P891 D892 R896 S897 M898	F794-R894 HydrophobicContact CZ-CG 4.11Å; F847-R894 PolarHBondContact O-NH1 2.87Å; N848-R894 VanDerWaalsContact CA-NH2 3.34Å; N848-R894 PolarHBondContact OD1-NH2 3.4Å; F851-R894 HydrophobicContact CD1-CB 4.43Å; F851-R894 HydrophobicContact CE1-CB 3.81Å; F851-R894 VanDerWaalsContact CE1-O 3.28Å; F851-R894 WeakPolarHBondContact CE1-O 3.4Å; F851-R894 HydrophobicContact CE2-CB 4.33Å; F851-R894 HydrophobicContact CZ-CB 3.74Å; V890-R894 HydrophobicContact CG1-CB 3.7Å; P891-R894 HydrophobicContact CG-CB 4.22Å; P891-R894 HydrophobicContact CG-CG 3.71Å; P891-R894 PolarHBondContact O-N 3.38Å; D892-R894 VanDerWaalsContact C-N 3.29Å; D892-R894 PolarHBondContact O-N 3.33Å; R894-R896 PolarHBondContact O-N 2.68Å; R894-S897 PolarHBondContact O-N 2.97Å; R894-S897 VanDerWaalsContact O-N 3.16Å; R894-M898 PolarHBondContact O-N 2.95Å
895	L	95.4	Very high	94	Very high	2 Å²	2	31.2 Å²	31.2	1%	0.01	15%	0.154	C	C	.	.	H	α-helix	trans	-57.5	-39.8	171.5	-69.7	178.7	0	0	0	111.2	L887 V890 P891 D892 M898 I899 L976	L887-L895 HydrophobicContact CD2-CD2 3.77Å; V890-L895 HydrophobicContact CB-CD2 4.02Å; V890-L895 HydrophobicContact CB-CG 4.24Å; V890-L895 HydrophobicContact CG1-CD2 3.81Å; V890-L895 HydrophobicContact CG1-CG 3.9Å; P891-L895 PolarHBondContact O-N 3.47Å; P891-L895 VanDerWaalsContact O-N 3.09Å; D892-L895 PolarHBondContact O-N 2.97Å; L895-M898 HydrophobicContact CD2-CE 4.03Å; L895-M898 PolarHBondContact O-N 2.99Å; L895-I899 WeakPolarHBondContact O-CG1 3.3Å; L895-I899 PolarHBondContact O-N 2.65Å; L895-L976 HydrophobicContact CB-CD1 3.95Å
896	R	95.1	Very high	94.2	Very high	57 Å²	57	29.6 Å²	29.6	22%	0.215	14%	0.144	C	C	.	.	H	α-helix	trans	-56.3	-52.9	173.9	-171.1	-171.2	166.7	-128.7	-8.7	111.7	D892 H893 R894 M898 I899 R900 L976 E979	D892-R896 WeakPolarHBondContact O-CB 3.16Å; D892-R896 PolarHBondContact O-N 2.85Å; H893-R896 WeakPolarHBondContact O-CB 3.27Å; R894-R896 PolarHBondContact O-N 2.68Å; R896-M898 PolarHBondContact O-N 2.9Å; R896-I899 PolarHBondContact O-N 3Å; R896-R900 WeakPolarHBondContact O-CB 3.23Å; R896-R900 PolarHBondContact O-N 3.06Å; R896-L976 HydrophobicContact CB-CD1 4.23Å; R896-E979 HydrophobicContact CG-CB 4.3Å; R896-E979 HydrophobicContact CG-CG 3.78Å; R896-E979 IonicContact CZ-OE1 3.58Å; R896-E979 IonicContact NE-OE1 2.78Å; R896-E979 PolarHBondContact NE-OE1 2.83Å; R896-E979 IonicContact NH2-OE1 2.76Å; R896-E979 PolarHBondContact NH2-OE1 3.18Å
897	S	94.4	Very high	94.3	Very high	7 Å²	7	28.6 Å²	28.6	5%	0.049	14%	0.137	C	C	.	.	H	α-helix	trans	-62.2	-40.1	178.8	-65.8	0	0	0	0	112.1	E852 H893 R894 I899 R900 L901	E852-S897 PolarHBondContact OE1-OG 3.42Å; H893-S897 PolarHBondContact O-N 2.81Å; R894-S897 PolarHBondContact O-N 2.97Å; R894-S897 VanDerWaalsContact O-N 3.16Å; S897-I899 PolarHBondContact O-N 3.32Å; S897-R900 PolarHBondContact O-N 3.4Å; S897-L901 WeakPolarHBondContact O-CB 3.18Å; S897-L901 WeakPolarHBondContact O-CG 3.42Å; S897-L901 PolarHBondContact O-N 3.34Å
898	M	96.3	Very high	94.2	Very high	1 Å²	1	32.5 Å²	32.5	1%	0.005	16%	0.157	C	C	.	.	H	α-helix	trans	-59	-47.2	174.6	177.1	-175.6	77.6	0	0	112.2	F855 A883 F884 L887 R894 L895 R896 F902 L903 L926	F855-M898 HydrophobicContact CD1-CB 4.41Å; F855-M898 HydrophobicContact CD1-CG 3.88Å; F855-M898 HydrophobicContact CD2-CB 4.28Å; F855-M898 HydrophobicContact CE1-CB 4.29Å; F855-M898 HydrophobicContact CE1-CG 3.54Å; F855-M898 HydrophobicContact CE1-SD 4.04Å; F855-M898 HydrophobicContact CE2-CB 4.17Å; F855-M898 HydrophobicContact CE2-CG 4.24Å; F855-M898 HydrophobicContact CG-CB 4.4Å; F855-M898 HydrophobicContact CG-CG 4.36Å; F855-M898 HydrophobicContact CZ-CB 4.16Å; F855-M898 HydrophobicContact CZ-CG 3.73Å; F855-M898 HydrophobicContact CZ-SD 3.94Å; A883-M898 HydrophobicContact CB-SD 4.45Å; F884-M898 HydrophobicContact CD1-CE 4.45Å; F884-M898 HydrophobicContact CD1-SD 4.45Å; F884-M898 HydrophobicContact CE1-CE 4.29Å; F884-M898 HydrophobicContact CE1-SD 4.42Å; L887-M898 HydrophobicContact CD2-CE 4.27Å; R894-M898 PolarHBondContact O-N 2.95Å; L895-M898 HydrophobicContact CD2-CE 4.03Å; L895-M898 PolarHBondContact O-N 2.99Å; R896-M898 PolarHBondContact O-N 2.9Å; M898-F902 WeakPolarHBondContact O-CB 3.28Å; M898-F902 PolarHBondContact O-N 2.98Å; M898-F902 VanDerWaalsContact O-N 3.15Å; M898-L903 HydrophobicContact CE-CD1 4.1Å; M898-L903 HydrophobicContact CG-CD1 4.48Å; M898-L903 PolarHBondContact O-N 3.1Å; M898-L926 HydrophobicContact CE-CD1 4.42Å
899	I	96.3	Very high	94.1	Very high	1 Å²	1	28.1 Å²	28.1	1%	0.005	14%	0.135	C	C	.	.	I	π-helix	trans	-63.5	-49.2	-179.7	-71.6	165.3	0	0	0	110.7	L895 R896 S897 L903 K904 M930 L976 E979 V980 L983	L895-I899 WeakPolarHBondContact O-CG1 3.3Å; L895-I899 PolarHBondContact O-N 2.65Å; R896-I899 PolarHBondContact O-N 3Å; S897-I899 PolarHBondContact O-N 3.32Å; I899-L903 HydrophobicContact CG1-CD1 3.99Å; I899-L903 PolarHBondContact O-N 2.98Å; I899-K904 PolarHBondContact O-N 3.24Å; I899-M930 HydrophobicContact CD1-CE 4.11Å; I899-M930 HydrophobicContact CD1-SD 4.45Å; I899-L976 HydrophobicContact CD1-CD1 3.95Å; I899-E979 HydrophobicContact CG2-CB 4.4Å; I899-V980 HydrophobicContact CD1-CG2 3.7Å; I899-L983 HydrophobicContact CG2-CB 4.06Å; I899-L983 HydrophobicContact CG2-CD2 4.02Å
900	R	94.7	Very high	94	Very high	70 Å²	70	24.2 Å²	24.2	26%	0.264	12%	0.118	S	C	.	.	I	π-helix	trans	-67.9	-47.8	-175.4	-175.8	177.9	65	160.1	-0.5	112.6	R896 S897	R896-R900 WeakPolarHBondContact O-CB 3.23Å; R896-R900 PolarHBondContact O-N 3.06Å; S897-R900 PolarHBondContact O-N 3.4Å
901	L	94.9	Very high	93.8	Very high	19 Å²	19	25.8 Å²	25.8	10%	0.099	13%	0.128	C	C	.	.	I	π-helix	trans	-85.2	-30.1	-169.1	-58.1	178.9	0	0	0	113.1	E852 F855 H856 S897	E852-L901 HydrophobicContact CB-CD1 3.89Å; E852-L901 HydrophobicContact CG-CD1 4.1Å; F855-L901 HydrophobicContact CB-CB 4.33Å; H856-L901 WeakPolarHBondContact CE1-CD2 3.45Å; S897-L901 WeakPolarHBondContact O-CB 3.18Å; S897-L901 WeakPolarHBondContact O-CG 3.42Å; S897-L901 PolarHBondContact O-N 3.34Å
902	F	95.6	Very high	93.5	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	14%	0.144	C	C	.	.	I	π-helix	trans	-112.6	-63.1	-176.8	166.7	-127.1	0	0	0	112.7	F855 L858 I879 M898 K904 Q905 L906	F855-F902 HydrophobicContact CB-CB 3.91Å; F855-F902 HydrophobicContact CD1-CB 3.68Å; F855-F902 AromaticContact CD1-CD1 3.83Å; F855-F902 HydrophobicContact CD1-CD1 3.83Å; F855-F902 AromaticContact CD1-CG 3.97Å; F855-F902 HydrophobicContact CD1-CG 3.97Å; F855-F902 HydrophobicContact CE1-CD1 4.12Å; F855-F902 HydrophobicContact CG-CB 4.23Å; L858-F902 HydrophobicContact CB-CD2 3.54Å; L858-F902 HydrophobicContact CB-CE2 3.71Å; L858-F902 HydrophobicContact CB-CG 4.23Å; L858-F902 HydrophobicContact CD1-CE2 4.35Å; L858-F902 HydrophobicContact CD1-CZ 4.36Å; I879-F902 HydrophobicContact CD1-CZ 4.05Å; I879-F902 HydrophobicContact CG1-CZ 4.28Å; I879-F902 HydrophobicContact CG2-CE1 3.88Å; I879-F902 HydrophobicContact CG2-CZ 3.93Å; M898-F902 WeakPolarHBondContact O-CB 3.28Å; M898-F902 PolarHBondContact O-N 2.98Å; M898-F902 VanDerWaalsContact O-N 3.15Å; F902-K904 PolarHBondContact O-N 2.65Å; F902-Q905 PolarHBondContact O-N 2.96Å; F902-L906 HydrophobicContact CD2-CB 4.45Å; F902-L906 HydrophobicContact CE2-CB 4.19Å; F902-L906 HydrophobicContact CE2-CD1 4.36Å; F902-L906 HydrophobicContact CE2-CD2 4.01Å; F902-L906 HydrophobicContact CE2-CG 4.42Å; F902-L906 HydrophobicContact CZ-CD2 3.86Å; F902-L906 WeakPolarHBondContact O-CB 3.18Å; F902-L906 PolarHBondContact O-N 2.7Å
903	L	95.7	Very high	93.2	Very high	1 Å²	1	33.4 Å²	33.4	1%	0.005	17%	0.168	C	C	.	.	I	π-helix	trans	-66.7	-40.8	-167.4	-67	168.4	0	0	0	112.9	F884 M898 I899 Q905 L906 V907 L926 L983	F884-L903 HydrophobicContact CE1-CD1 4.32Å; F884-L903 HydrophobicContact CE1-CD2 4.24Å; F884-L903 HydrophobicContact CZ-CD2 4.03Å; M898-L903 HydrophobicContact CE-CD1 4.1Å; M898-L903 HydrophobicContact CG-CD1 4.48Å; M898-L903 PolarHBondContact O-N 3.1Å; I899-L903 HydrophobicContact CG1-CD1 3.99Å; I899-L903 PolarHBondContact O-N 2.98Å; L903-Q905 VanDerWaalsContact C-N 3.34Å; L903-Q905 PolarHBondContact O-N 3.24Å; L903-L906 PolarHBondContact O-N 2.89Å; L903-V907 WeakPolarHBondContact O-CG2 3.47Å; L903-V907 PolarHBondContact O-N 3.08Å; L903-L926 HydrophobicContact CD1-CD1 4.36Å; L903-L926 HydrophobicContact CD1-CD2 3.4Å; L903-L983 HydrophobicContact CB-CD1 4.38Å; L903-L983 HydrophobicContact CB-CD2 4.24Å
904	K	94.3	Very high	93.1	Very high	49 Å²	49	34.4 Å²	34.4	21%	0.213	17%	0.171	C	C	.	.	H	α-helix	trans	-59.6	-46.1	175.1	-177.7	175	174	176.3	0	111.2	I899 F902 V907 I908 D982 L983	I899-K904 PolarHBondContact O-N 3.24Å; F902-K904 PolarHBondContact O-N 2.65Å; K904-V907 PolarHBondContact O-N 3.44Å; K904-I908 HydrophobicContact CG-CD1 3.88Å; K904-I908 VanDerWaalsContact O-CG1 3.28Å; K904-I908 WeakPolarHBondContact O-CG1 3.42Å; K904-I908 PolarHBondContact O-N 2.99Å; K904-D982 WeakPolarHBondContact CE-OD2 3.38Å; K904-D982 IonicContact NZ-OD2 3.52Å; K904-D982 PolarHBondContact NZ-OD2 3.12Å; K904-L983 HydrophobicContact CB-CD1 4.26Å
905	Q	93	Very high	92.9	Very high	71 Å²	71	35 Å²	35	33%	0.332	17%	0.174	S	C	.	.	H	α-helix	trans	-66.4	-41	178.4	-64.9	-57.9	-27.6	0	0	112.2	G859 F902 L903 V907 I908 S909	G859-Q905 WeakPolarHBondContact O-CB 3.37Å; F902-Q905 PolarHBondContact O-N 2.96Å; L903-Q905 VanDerWaalsContact C-N 3.34Å; L903-Q905 PolarHBondContact O-N 3.24Å; Q905-V907 VanDerWaalsContact C-N 3.3Å; Q905-V907 PolarHBondContact O-N 3.47Å; Q905-I908 PolarHBondContact O-N 2.84Å; Q905-S909 WeakPolarHBondContact O-CB 3.41Å; Q905-S909 PolarHBondContact O-N 3.36Å; Q905-S909 PolarHBondContact O-OG 3.42Å
906	L	94.4	Very high	92.5	Very high	3 Å²	3	38.5 Å²	38.5	2%	0.016	19%	0.193	C	C	.	.	H	α-helix	trans	-58.5	-43	175.3	-176.2	69.7	0	0	0	111.2	F869 Y870 F902 L903 C910 L918 L919 L922	F869-L906 HydrophobicContact CE1-CD1 3.86Å; Y870-L906 HydrophobicContact CE1-CD1 3.96Å; F902-L906 HydrophobicContact CD2-CB 4.45Å; F902-L906 HydrophobicContact CE2-CB 4.19Å; F902-L906 HydrophobicContact CE2-CD1 4.36Å; F902-L906 HydrophobicContact CE2-CD2 4.01Å; F902-L906 HydrophobicContact CE2-CG 4.42Å; F902-L906 HydrophobicContact CZ-CD2 3.86Å; F902-L906 WeakPolarHBondContact O-CB 3.18Å; F902-L906 PolarHBondContact O-N 2.7Å; L903-L906 PolarHBondContact O-N 2.89Å; L906-C910 WeakPolarHBondContact O-CB 3.1Å; L906-C910 PolarHBondContact O-N 3.33Å; L906-L918 HydrophobicContact CD1-CD2 4.42Å; L906-L919 HydrophobicContact CD2-CD2 4.12Å; L906-L919 HydrophobicContact CG-CD2 4Å; L906-L922 HydrophobicContact CD2-CD1 3.83Å
907	V	93.3	Very high	92.2	Very high	10 Å²	10	39.2 Å²	39.2	6%	0.061	21%	0.207	C	C	.	.	H	α-helix	trans	-66.3	-45.8	178.1	168.9	0	0	0	0	111.9	L903 K904 Q905 S909 L919 L923 L983 V986 L1028	L903-V907 WeakPolarHBondContact O-CG2 3.47Å; L903-V907 PolarHBondContact O-N 3.08Å; K904-V907 PolarHBondContact O-N 3.44Å; Q905-V907 VanDerWaalsContact C-N 3.3Å; Q905-V907 PolarHBondContact O-N 3.47Å; V907-S909 VanDerWaalsContact C-N 3.34Å; V907-S909 PolarHBondContact O-N 3.4Å; V907-L919 HydrophobicContact CG2-CD1 4.48Å; V907-L919 HydrophobicContact CG2-CD2 4.25Å; V907-L923 HydrophobicContact CG2-CD1 3.84Å; V907-L923 HydrophobicContact CG2-CD2 4.06Å; V907-L923 HydrophobicContact CG2-CG 4.43Å; V907-L983 HydrophobicContact CG2-CD1 4.1Å; V907-V986 HydrophobicContact CG1-CG1 4.29Å; V907-L1028 HydrophobicContact CG1-CD2 3.66Å
908	I	91.1	Very high	92.1	Very high	99 Å²	99	39.3 Å²	39.3	51%	0.508	21%	0.206	S	C	.	.	H	α-helix	trans	-65.3	-38.5	-177.7	-67.7	166.8	0	0	0	111.5	K904 Q905 V986	K904-I908 HydrophobicContact CG-CD1 3.88Å; K904-I908 VanDerWaalsContact O-CG1 3.28Å; K904-I908 WeakPolarHBondContact O-CG1 3.42Å; K904-I908 PolarHBondContact O-N 2.99Å; Q905-I908 PolarHBondContact O-N 2.84Å; I908-V986 HydrophobicContact CD1-CG1 3.97Å; I908-V986 HydrophobicContact CG1-CG1 3.45Å; I908-V986 VanDerWaalsContact CG1-CG1 3.45Å
909	S	90.9	Very high	91.9	Very high	26 Å²	26	39.3 Å²	39.3	18%	0.182	21%	0.206	C	C	.	.	H	α-helix	trans	-89.9	-11.6	-174	56.3	0	0	0	0	114.8	Y870 Q905 V907 P911	Y870-S909 VanDerWaalsContact OH-C 3.25Å; Y870-S909 PolarHBondContact OH-O 3.22Å; Y870-S909 PolarHBondContact OH-OG 3.48Å; Q905-S909 WeakPolarHBondContact O-CB 3.41Å; Q905-S909 PolarHBondContact O-N 3.36Å; Q905-S909 PolarHBondContact O-OG 3.42Å; V907-S909 VanDerWaalsContact C-N 3.34Å; V907-S909 PolarHBondContact O-N 3.4Å; S909-P911 WeakPolarHBondContact O-CD 3.49Å
910	C	91.4	Very high	91.6	Very high	9 Å²	9	43.1 Å²	43.1	6%	0.061	22%	0.221	C	C	.	.			trans	-75.3	123.2	-173.3	-172.9	0	0	0	0	113	Y870 L906 H915 L919	Y870-C910 HydrophobicContact CE1-CB 4.03Å; Y870-C910 WeakPolarHBondContact OH-CA 3.33Å; Y870-C910 PolarHBondContact OH-N 2.95Å; L906-C910 WeakPolarHBondContact O-CB 3.1Å; L906-C910 PolarHBondContact O-N 3.33Å; C910-H915 PolarHBondContact O-NE2 2.9Å; C910-L919 HydrophobicContact CB-CD1 3.71Å; C910-L919 HydrophobicContact CB-CD2 4.23Å; C910-L919 HydrophobicContact CB-CG 4.09Å
911	P	88.8	Confident	91.5	Very high	33 Å²	33	41.4 Å²	41.4	21%	0.214	22%	0.218	C	C	.	.			trans	-62.2	147.7	175.2	-21.2	31.9	0	0	0	112.9	Y870 S909 E913 Y914 H915	Y870-P911 HydrophobicContact CD2-CG 4.12Å; Y870-P911 VanDerWaalsContact CE2-CD 3.44Å; Y870-P911 HydrophobicContact CE2-CG 4.27Å; S909-P911 WeakPolarHBondContact O-CD 3.49Å; P911-E913 WeakPolarHBondContact CB-OE2 3.16Å; P911-E913 PolarHBondContact O-N 3.02Å; P911-E913 VanDerWaalsContact O-N 3.07Å; P911-Y914 HydrophobicContact CB-CD2 3.96Å; P911-Y914 HydrophobicContact CB-CE2 4.32Å; P911-Y914 HydrophobicContact CG-CD2 4.03Å; P911-Y914 HydrophobicContact CG-CE2 4.24Å; P911-Y914 PolarHBondContact O-N 3.3Å; P911-H915 PolarHBondContact O-CD2 3.47Å; P911-H915 PolarHBondContact O-NE2 3.34Å
912	P	87.3	Confident	91.4	Very high	87 Å²	87	40.5 Å²	40.5	57%	0.565	21%	0.214	S	C	*	.	G	3₁₀ helix	trans	-53.3	-30	-179	-27.1	35.5	0	0	0	115.2	Y914 H915	P912-Y914 PolarHBondContact O-N 3.45Å; P912-H915 PolarHBondContact O-N 3Å
913	E	87.9	Confident	91.2	Very high	122 Å²	122	40.6 Å²	40.6	57%	0.57	22%	0.215	S	C	*	.	G	3₁₀ helix	trans	-62.9	-27.4	-179.9	-58.8	83.6	177.7	0	0	112.8	P911	P911-E913 WeakPolarHBondContact CB-OE2 3.16Å; P911-E913 PolarHBondContact O-N 3.02Å; P911-E913 VanDerWaalsContact O-N 3.07Å
914	Y	89.8	Confident	90.9	Very high	49 Å²	49	40.8 Å²	40.8	19%	0.192	22%	0.217	C	C	.	.	G	3₁₀ helix	trans	-102.9	4.4	-177.3	-54.6	-77.9	0	0	0	113.3	Y870 T871 P911 P912 D916 L918 L919	Y870-Y914 HydrophobicContact CG-CD2 4.14Å; Y870-Y914 HydrophobicContact CG-CE2 4.42Å; T871-Y914 HydrophobicContact CG2-CE1 4.46Å; T871-Y914 VanDerWaalsContact CG2-OH 3.29Å; T871-Y914 WeakPolarHBondContact CG2-OH 3.26Å; P911-Y914 HydrophobicContact CB-CD2 3.96Å; P911-Y914 HydrophobicContact CB-CE2 4.32Å; P911-Y914 HydrophobicContact CG-CD2 4.03Å; P911-Y914 HydrophobicContact CG-CE2 4.24Å; P911-Y914 PolarHBondContact O-N 3.3Å; P912-Y914 PolarHBondContact O-N 3.45Å; Y914-D916 PolarHBondContact O-N 3.4Å; Y914-L918 WeakPolarHBondContact O-CB 3.3Å; Y914-L918 PolarHBondContact O-N 3.22Å; Y914-L919 PolarHBondContact O-N 2.93Å
915	H	90.5	Very high	90.8	Very high	20 Å²	20	42.1 Å²	42.1	9%	0.093	23%	0.23	C	C	.	.	I	π-helix	trans	-61.4	-43.3	-179.3	-72.7	-174.7	0	0	0	112.3	C910 P911 P912 L919 R920 L1028	C910-H915 PolarHBondContact O-NE2 2.9Å; P911-H915 PolarHBondContact O-CD2 3.47Å; P911-H915 PolarHBondContact O-NE2 3.34Å; P912-H915 PolarHBondContact O-N 3Å; H915-L919 PolarHBondContact O-N 3.27Å; H915-R920 PolarHBondContact O-N 3.46Å; H915-L1028 HydrophobicContact CB-CD1 3.88Å
916	D	87.9	Confident	90.8	Very high	75 Å²	75	39 Å²	39	40%	0.401	22%	0.216	S	C	.	.	I	π-helix	trans	-80.9	-33	-177.1	-165.9	62.9	0	0	0	113.3	Y914 R920 H1035	Y914-D916 PolarHBondContact O-N 3.4Å; D916-R920 PolarHBondContact O-NE 2.8Å; D916-R920 VanDerWaalsContact OD1-CD 3.32Å; D916-R920 WeakPolarHBondContact OD1-CD 3.09Å; D916-R920 IonicContact OD1-NE 2.82Å; D916-R920 PolarHBondContact OD1-NE 3.38Å; D916-H1035 IonicContact OD1-CD2 3.58Å; D916-H1035 IonicContact OD1-CE1 2.8Å; D916-H1035 IonicContact OD1-NE2 3.69Å; D916-H1035 PolarHBondContact OD1-NE2 2.92Å
917	S	88.8	Confident	90.8	Very high	72 Å²	72	38.9 Å²	38.9	50%	0.503	22%	0.215	S	C	.	.	I	π-helix	trans	-85.7	-32.3	-177.6	58	0	0	0	0	113.9	P921	S917-P921 VanDerWaalsContact O-CG 3.32Å; S917-P921 WeakPolarHBondContact O-CG 3.25Å
918	L	91.5	Very high	90.7	Very high	8 Å²	8	40.3 Å²	40.3	4%	0.042	22%	0.224	C	C	.	.	I	π-helix	trans	-111.9	-57	-177.9	179.4	65.7	0	0	0	113	Y870 L875 A876 I879 L906 Y914 P921 L922	Y870-L918 HydrophobicContact CD1-CD2 3.52Å; Y870-L918 HydrophobicContact CE1-CD2 3.8Å; L875-L918 HydrophobicContact CB-CD1 4.46Å; L875-L918 HydrophobicContact CD2-CD1 4.08Å; L875-L918 HydrophobicContact CD2-CD2 4.03Å; L875-L918 HydrophobicContact CG-CD1 4.11Å; A876-L918 HydrophobicContact CB-CD1 3.79Å; I879-L918 HydrophobicContact CD1-CD1 4.26Å; L906-L918 HydrophobicContact CD1-CD2 4.42Å; Y914-L918 WeakPolarHBondContact O-CB 3.3Å; Y914-L918 PolarHBondContact O-N 3.22Å; L918-P921 VanDerWaalsContact O-CD 3.31Å; L918-P921 WeakPolarHBondContact O-CD 3.2Å; L918-P921 VanDerWaalsContact O-CG 3.32Å; L918-P921 WeakPolarHBondContact O-CG 3.34Å; L918-L922 HydrophobicContact CD1-CD1 3.77Å; L918-L922 HydrophobicContact CG-CD1 4.1Å; L918-L922 WeakPolarHBondContact O-CD1 3.45Å; L918-L922 VanDerWaalsContact O-CG 3.24Å; L918-L922 WeakPolarHBondContact O-CG 3.36Å
919	L	92.6	Very high	90.9	Very high	1 Å²	1	37.4 Å²	37.4	1%	0.005	21%	0.207	C	C	.	.	I	π-helix	trans	-72.7	-40.7	-170.8	-66.3	-174.4	0	0	0	113	L906 V907 C910 Y914 H915 L922 L923 L1028	L906-L919 HydrophobicContact CD2-CD2 4.12Å; L906-L919 HydrophobicContact CG-CD2 4Å; V907-L919 HydrophobicContact CG2-CD1 4.48Å; V907-L919 HydrophobicContact CG2-CD2 4.25Å; C910-L919 HydrophobicContact CB-CD1 3.71Å; C910-L919 HydrophobicContact CB-CD2 4.23Å; C910-L919 HydrophobicContact CB-CG 4.09Å; Y914-L919 PolarHBondContact O-N 2.93Å; H915-L919 PolarHBondContact O-N 3.27Å; L919-L922 PolarHBondContact O-N 3.07Å; L919-L923 HydrophobicContact CB-CD1 4.28Å; L919-L923 WeakPolarHBondContact O-CB 3.38Å; L919-L923 WeakPolarHBondContact O-CG 3.48Å; L919-L923 PolarHBondContact O-N 3.43Å; L919-L1028 HydrophobicContact CB-CD1 4.11Å; L919-L1028 HydrophobicContact CD1-CD1 3.84Å; L919-L1028 HydrophobicContact CD1-CD2 3.63Å; L919-L1028 HydrophobicContact CD1-CG 4.38Å
920	R	90.2	Very high	91.1	Very high	81 Å²	81	36.3 Å²	36.3	31%	0.306	20%	0.199	S	C	.	.	H	α-helix	trans	-55.8	-54.1	177.6	-179.7	-167.6	70.6	103.6	5.4	113.3	H915 D916 L922 G924 L1032 H1035	H915-R920 PolarHBondContact O-N 3.46Å; D916-R920 PolarHBondContact O-NE 2.8Å; D916-R920 VanDerWaalsContact OD1-CD 3.32Å; D916-R920 WeakPolarHBondContact OD1-CD 3.09Å; D916-R920 IonicContact OD1-NE 2.82Å; D916-R920 PolarHBondContact OD1-NE 3.38Å; R920-L922 PolarHBondContact O-N 2.89Å; R920-G924 PolarHBondContact O-N 3.47Å; R920-L1032 HydrophobicContact CB-CD2 4.38Å; R920-H1035 WeakPolarHBondContact CD-CD2 3.32Å; R920-H1035 WeakPolarHBondContact CD-NE2 3.37Å
921	P	90.8	Very high	91.2	Very high	34 Å²	34	37.3 Å²	37.3	22%	0.221	20%	0.202	C	C	.	.	H	α-helix	trans	-65.8	-18.9	179.9	25.2	-34.3	0	0	0	113.5	A876 S917 L918 P925	A876-P921 HydrophobicContact CB-CG 4.22Å; S917-P921 VanDerWaalsContact O-CG 3.32Å; S917-P921 WeakPolarHBondContact O-CG 3.25Å; L918-P921 VanDerWaalsContact O-CD 3.31Å; L918-P921 WeakPolarHBondContact O-CD 3.2Å; L918-P921 VanDerWaalsContact O-CG 3.32Å; L918-P921 WeakPolarHBondContact O-CG 3.34Å; P921-P925 VanDerWaalsContact O-CD 3.25Å; P921-P925 WeakPolarHBondContact O-CD 3.17Å; P921-P925 WeakPolarHBondContact O-CG 3.5Å
922	L	92.8	Very high	91.4	Very high	1 Å²	1	41.4 Å²	41.4	1%	0.005	22%	0.219	C	C	.	.	H	α-helix	trans	-85.4	-54.3	175.6	-66.4	174	0	0	0	112.6	I879 I880 F884 L906 L918 L919 R920 L926	I879-L922 HydrophobicContact CB-CD2 4.06Å; I879-L922 HydrophobicContact CD1-CD1 4.14Å; I879-L922 HydrophobicContact CG2-CD1 4.39Å; I879-L922 HydrophobicContact CG2-CD2 3.71Å; I880-L922 HydrophobicContact CD1-CD2 4.1Å; I880-L922 HydrophobicContact CG1-CD2 3.53Å; F884-L922 HydrophobicContact CD2-CD2 4.45Å; F884-L922 HydrophobicContact CE2-CB 4.23Å; F884-L922 HydrophobicContact CE2-CD2 3.67Å; F884-L922 HydrophobicContact CZ-CB 4.49Å; F884-L922 HydrophobicContact CZ-CD2 4.18Å; L906-L922 HydrophobicContact CD2-CD1 3.83Å; L918-L922 HydrophobicContact CD1-CD1 3.77Å; L918-L922 HydrophobicContact CG-CD1 4.1Å; L918-L922 WeakPolarHBondContact O-CD1 3.45Å; L918-L922 VanDerWaalsContact O-CG 3.24Å; L918-L922 WeakPolarHBondContact O-CG 3.36Å; L919-L922 PolarHBondContact O-N 3.07Å; R920-L922 PolarHBondContact O-N 2.89Å; L922-L926 VanDerWaalsContact O-CB 3.29Å; L922-L926 WeakPolarHBondContact O-CB 3.3Å; L922-L926 PolarHBondContact O-N 3.47Å
923	L	92.8	Very high	91.8	Very high	2 Å²	2	38.8 Å²	38.8	1%	0.01	20%	0.198	C	C	.	.	H	α-helix	trans	-73.8	-35.8	-170.8	-67.1	-179.9	0	0	0	113	V907 L919 L926 F927 L983 L1028 L1032	V907-L923 HydrophobicContact CG2-CD1 3.84Å; V907-L923 HydrophobicContact CG2-CD2 4.06Å; V907-L923 HydrophobicContact CG2-CG 4.43Å; L919-L923 HydrophobicContact CB-CD1 4.28Å; L919-L923 WeakPolarHBondContact O-CB 3.38Å; L919-L923 WeakPolarHBondContact O-CG 3.48Å; L919-L923 PolarHBondContact O-N 3.43Å; L923-L926 HydrophobicContact CD2-CD2 4.36Å; L923-L926 PolarHBondContact O-N 3.15Å; L923-F927 HydrophobicContact CB-CD2 4.05Å; L923-F927 HydrophobicContact CB-CE2 3.84Å; L923-F927 HydrophobicContact CD1-CE2 4.36Å; L923-F927 HydrophobicContact CD2-CE2 4.21Å; L923-F927 HydrophobicContact CD2-CZ 4.43Å; L923-F927 HydrophobicContact CG-CE2 4.36Å; L923-F927 WeakPolarHBondContact O-CB 3.27Å; L923-F927 WeakPolarHBondContact O-CD2 3.19Å; L923-F927 WeakPolarHBondContact O-CG 3.18Å; L923-F927 PolarHBondContact O-N 2.89Å; L923-L983 HydrophobicContact CD2-CD2 4.33Å; L923-L1028 HydrophobicContact CD1-CD2 4.25Å; L923-L1032 HydrophobicContact CD1-CD1 4.22Å
924	G	89.5	Confident	92.1	Very high	5 Å²	5	33 Å²	33	5%	0.052	17%	0.171	C	C	.	.	H	α-helix	trans	-58.3	-57.8	-179.5	0	0	0	0	0	113	R920 L926 T928	R920-G924 PolarHBondContact O-N 3.47Å; G924-L926 VanDerWaalsContact C-N 3.34Å; G924-L926 PolarHBondContact O-N 2.98Å; G924-T928 PolarHBondContact O-N 2.97Å; G924-T928 PolarHBondContact O-OG1 3.49Å
925	P	90.9	Very high	92.2	Very high	77 Å²	77	33 Å²	33	50%	0.5	17%	0.174	S	C	.	.	H	α-helix	trans	-60.8	-40.7	175.1	-25.5	36.3	0	0	0	112.8	P921 T928 Y929	P921-P925 VanDerWaalsContact O-CD 3.25Å; P921-P925 WeakPolarHBondContact O-CD 3.17Å; P921-P925 WeakPolarHBondContact O-CG 3.5Å; P925-T928 PolarHBondContact O-N 3.46Å; P925-Y929 WeakPolarHBondContact O-CB 3.24Å; P925-Y929 PolarHBondContact O-N 3.49Å
926	L	93.3	Very high	92.4	Very high	4 Å²	4	36.2 Å²	36.2	2%	0.021	20%	0.195	C	C	.	.	H	α-helix	trans	-60.7	-50.6	179.1	178.8	74.2	0	0	0	112.3	F884 M898 L903 L922 L923 G924 T928 Y929 M930 L983	F884-L926 HydrophobicContact CE1-CD1 4.29Å; F884-L926 HydrophobicContact CZ-CB 4.49Å; F884-L926 HydrophobicContact CZ-CD1 4.44Å; M898-L926 HydrophobicContact CE-CD1 4.42Å; L903-L926 HydrophobicContact CD1-CD1 4.36Å; L903-L926 HydrophobicContact CD1-CD2 3.4Å; L922-L926 VanDerWaalsContact O-CB 3.29Å; L922-L926 WeakPolarHBondContact O-CB 3.3Å; L922-L926 PolarHBondContact O-N 3.47Å; L923-L926 HydrophobicContact CD2-CD2 4.36Å; L923-L926 PolarHBondContact O-N 3.15Å; G924-L926 VanDerWaalsContact C-N 3.34Å; G924-L926 PolarHBondContact O-N 2.98Å; L926-T928 VanDerWaalsContact C-N 3.27Å; L926-T928 PolarHBondContact O-N 3.34Å; L926-Y929 WeakPolarHBondContact O-CB 3.49Å; L926-Y929 PolarHBondContact O-N 2.91Å; L926-M930 HydrophobicContact CD1-CG 4.17Å; L926-M930 HydrophobicContact CG-CG 4.29Å; L926-M930 WeakPolarHBondContact O-CB 3.34Å; L926-M930 VanDerWaalsContact O-CG 3.3Å; L926-M930 WeakPolarHBondContact O-CG 3.29Å; L926-M930 PolarHBondContact O-N 3.49Å; L926-L983 HydrophobicContact CD2-CD2 3.99Å
927	F	93.9	Very high	92.6	Very high	2 Å²	2	36.3 Å²	36.3	1%	0.009	19%	0.192	C	C	.	.	H	α-helix	trans	-63.9	-36.5	179.8	-73.7	-53.1	0	0	0	111.8	L923 Q931 L983 L984 L1042 L1045	L923-F927 HydrophobicContact CB-CD2 4.05Å; L923-F927 HydrophobicContact CB-CE2 3.84Å; L923-F927 HydrophobicContact CD1-CE2 4.36Å; L923-F927 HydrophobicContact CD2-CE2 4.21Å; L923-F927 HydrophobicContact CD2-CZ 4.43Å; L923-F927 HydrophobicContact CG-CE2 4.36Å; L923-F927 WeakPolarHBondContact O-CB 3.27Å; L923-F927 WeakPolarHBondContact O-CD2 3.19Å; L923-F927 WeakPolarHBondContact O-CG 3.18Å; L923-F927 PolarHBondContact O-N 2.89Å; F927-Q931 VanDerWaalsContact O-CB 3.22Å; F927-Q931 WeakPolarHBondContact O-CB 3.11Å; F927-Q931 PolarHBondContact O-N 3.3Å; F927-L983 HydrophobicContact CE1-CD2 4.1Å; F927-L983 HydrophobicContact CE1-CG 4.23Å; F927-L983 HydrophobicContact CZ-CD2 4.15Å; F927-L983 HydrophobicContact CZ-CG 4.04Å; F927-L984 HydrophobicContact CE1-CB 3.92Å; F927-L984 HydrophobicContact CZ-CB 4.13Å; F927-L1042 HydrophobicContact CB-CD2 4.29Å; F927-L1042 HydrophobicContact CD2-CD2 3.44Å; F927-L1042 VanDerWaalsContact CD2-CD2 3.44Å; F927-L1042 HydrophobicContact CE2-CD2 3.79Å; F927-L1042 HydrophobicContact CG-CD2 3.86Å; F927-L1042 HydrophobicContact CZ-CD2 4.48Å; F927-L1045 HydrophobicContact CB-CD2 4.31Å; F927-L1045 HydrophobicContact CD1-CD2 3.85Å; F927-L1045 HydrophobicContact CG-CD2 4.43Å
928	T	92.8	Very high	92.8	Very high	39 Å²	39	32.9 Å²	32.9	24%	0.239	17%	0.168	C	C	.	.	H	α-helix	trans	-63.1	-45.3	174.8	-54.2	0	0	0	0	111	G924 P925 L926 Q931 Q932 S1041	G924-T928 PolarHBondContact O-N 2.97Å; G924-T928 PolarHBondContact O-OG1 3.49Å; P925-T928 PolarHBondContact O-N 3.46Å; L926-T928 VanDerWaalsContact C-N 3.27Å; L926-T928 PolarHBondContact O-N 3.34Å; T928-Q931 PolarHBondContact O-N 2.94Å; T928-Q932 WeakPolarHBondContact O-CG 3.34Å; T928-Q932 PolarHBondContact O-N 3.24Å; T928-Q932 VanDerWaalsContact O-N 3.15Å; T928-S1041 WeakPolarHBondContact OG1-CB 3.48Å; T928-S1041 PolarHBondContact OG1-OG 3.41Å
929	Y	94.1	Very high	92.7	Very high	39 Å²	39	37.1 Å²	37.1	15%	0.153	19%	0.187	C	C	.	.	H	α-helix	trans	-61.2	-51.4	175.5	176.5	-101	0	0	0	112.3	L887 D888 P925 L926 Q931 Q932 R933	L887-Y929 HydrophobicContact CB-CE1 3.81Å; L887-Y929 HydrophobicContact CB-CE2 4.36Å; L887-Y929 HydrophobicContact CD1-CD1 4.12Å; L887-Y929 HydrophobicContact CD1-CE1 4.2Å; L887-Y929 PolarHBondContact O-OH 2.86Å; L887-Y929 VanDerWaalsContact O-OH 3.12Å; D888-Y929 VanDerWaalsContact CA-OH 3.28Å; D888-Y929 WeakPolarHBondContact CA-OH 3.38Å; D888-Y929 PolarHBondContact N-OH 3.48Å; D888-Y929 WeakPolarHBondContact OD1-CE2 3.42Å; D888-Y929 PolarHBondContact OD1-OH 3.34Å; D888-Y929 VanDerWaalsContact OD1-OH 3.06Å; P925-Y929 WeakPolarHBondContact O-CB 3.24Å; P925-Y929 PolarHBondContact O-N 3.49Å; L926-Y929 WeakPolarHBondContact O-CB 3.49Å; L926-Y929 PolarHBondContact O-N 2.91Å; Y929-Q931 VanDerWaalsContact C-N 3.28Å; Y929-Q931 PolarHBondContact O-N 3.33Å; Y929-Q932 PolarHBondContact O-N 3.31Å; Y929-Q932 VanDerWaalsContact O-N 3.12Å; Y929-R933 HydrophobicContact CE1-CB 4.49Å; Y929-R933 PolarHBondContact O-N 3.48Å; Y929-R933 PolarHBondContact OH-NH1 3.43Å; Y929-R933 VanDerWaalsContact OH-NH1 3.09Å
930	M	95.2	Very high	92.5	Very high	2 Å²	2	39.7 Å²	39.7	1%	0.01	20%	0.203	C	C	.	.	H	α-helix	trans	-63	-36.6	-179.3	-67.8	-49.8	-64.2	0	0	111.7	I899 L926 L934 L976 V980	I899-M930 HydrophobicContact CD1-CE 4.11Å; I899-M930 HydrophobicContact CD1-SD 4.45Å; L926-M930 HydrophobicContact CD1-CG 4.17Å; L926-M930 HydrophobicContact CG-CG 4.29Å; L926-M930 WeakPolarHBondContact O-CB 3.34Å; L926-M930 VanDerWaalsContact O-CG 3.3Å; L926-M930 WeakPolarHBondContact O-CG 3.29Å; L926-M930 PolarHBondContact O-N 3.49Å; M930-L934 HydrophobicContact CE-CG 4.48Å; M930-L934 WeakPolarHBondContact O-CB 3.17Å; M930-L934 WeakPolarHBondContact O-CG 3.39Å; M930-L934 PolarHBondContact O-N 2.94Å; M930-L976 HydrophobicContact CE-CD1 3.74Å; M930-L976 HydrophobicContact CE-CD2 3.85Å; M930-L976 HydrophobicContact CE-CG 3.81Å; M930-V980 HydrophobicContact CB-CG1 4.11Å; M930-V980 HydrophobicContact CB-CG2 4.15Å; M930-V980 HydrophobicContact CE-CG2 3.42Å; M930-V980 VanDerWaalsContact CE-CG2 3.42Å; M930-V980 HydrophobicContact CG-CG2 4.04Å
931	Q	93.1	Very high	92.4	Very high	30 Å²	30	36.4 Å²	36.4	14%	0.14	19%	0.191	C	C	.	.	H	α-helix	trans	-58.8	-49.7	172.4	-176.9	-144.3	-28	0	0	111.3	F927 T928 Y929 N935 L1045	F927-Q931 VanDerWaalsContact O-CB 3.22Å; F927-Q931 WeakPolarHBondContact O-CB 3.11Å; F927-Q931 PolarHBondContact O-N 3.3Å; T928-Q931 PolarHBondContact O-N 2.94Å; Y929-Q931 VanDerWaalsContact C-N 3.28Å; Y929-Q931 PolarHBondContact O-N 3.33Å; Q931-N935 WeakPolarHBondContact O-CB 3.46Å; Q931-N935 PolarHBondContact O-N 2.97Å; Q931-L1045 HydrophobicContact CB-CB 4.25Å; Q931-L1045 HydrophobicContact CB-CD1 4.11Å; Q931-L1045 HydrophobicContact CG-CB 4.2Å; Q931-L1045 HydrophobicContact CG-CD1 4.38Å
932	Q	93.6	Very high	92	Very high	120 Å²	120	37.2 Å²	37.2	56%	0.561	19%	0.194	S	C	*	.	H	α-helix	trans	-62.7	-50.6	-179.8	-69.7	175	1.9	0	0	111.5	T928 Y929 N935 V936	T928-Q932 WeakPolarHBondContact O-CG 3.34Å; T928-Q932 PolarHBondContact O-N 3.24Å; T928-Q932 VanDerWaalsContact O-N 3.15Å; Y929-Q932 PolarHBondContact O-N 3.31Å; Y929-Q932 VanDerWaalsContact O-N 3.12Å; Q932-N935 PolarHBondContact O-N 3.33Å; Q932-V936 WeakPolarHBondContact O-CG2 3.49Å; Q932-V936 PolarHBondContact O-N 2.94Å; Q932-V936 VanDerWaalsContact O-N 3.12Å
933	R	95	Very high	91.5	Very high	32 Å²	32	42.9 Å²	42.9	12%	0.121	22%	0.22	C	C	.	.	H	α-helix	trans	-59.4	-50.9	-179.7	-177.3	-179.6	-179.2	121.2	-3.4	112.3	L887 V890 D892 Y929 N935 V936 K937	L887-R933 PolarHBondContact O-NH1 3.39Å; V890-R933 PolarHBondContact O-NH1 3.09Å; V890-R933 PolarHBondContact O-NH2 3.31Å; D892-R933 IonicContact OD1-CZ 3.77Å; D892-R933 VanDerWaalsContact OD1-CZ 3.29Å; D892-R933 IonicContact OD1-NE 2.59Å; D892-R933 PolarHBondContact OD1-NE 3.44Å; D892-R933 IonicContact OD1-NH2 3.24Å; D892-R933 PolarHBondContact OD1-NH2 2.78Å; Y929-R933 HydrophobicContact CE1-CB 4.49Å; Y929-R933 PolarHBondContact O-N 3.48Å; Y929-R933 PolarHBondContact OH-NH1 3.43Å; Y929-R933 VanDerWaalsContact OH-NH1 3.09Å; R933-N935 VanDerWaalsContact C-N 3.32Å; R933-N935 PolarHBondContact O-N 3.26Å; R933-V936 PolarHBondContact O-N 3.18Å; R933-K937 WeakPolarHBondContact O-CG 3.46Å; R933-K937 PolarHBondContact O-N 3.05Å
934	L	95	Very high	90.7	Very high	1 Å²	1	46.9 Å²	46.9	1%	0.005	24%	0.235	C	C	.	.	H	α-helix	trans	-64.8	-37.8	-179.1	-70.7	177	0	0	0	111.4	M930 V936 K937 W938 V973 L976 V980 W1052	M930-L934 HydrophobicContact CE-CG 4.48Å; M930-L934 WeakPolarHBondContact O-CB 3.17Å; M930-L934 WeakPolarHBondContact O-CG 3.39Å; M930-L934 PolarHBondContact O-N 2.94Å; L934-V936 PolarHBondContact O-N 3.16Å; L934-K937 PolarHBondContact O-N 3.34Å; L934-W938 WeakPolarHBondContact O-CB 3.44Å; L934-W938 PolarHBondContact O-N 2.89Å; L934-V973 HydrophobicContact CD2-CG1 4.4Å; L934-L976 HydrophobicContact CD2-CD2 4.14Å; L934-L976 HydrophobicContact CD2-CG 4.2Å; L934-V980 HydrophobicContact CD1-CB 4.27Å; L934-V980 HydrophobicContact CD1-CG1 4.32Å; L934-V980 HydrophobicContact CD1-CG2 4.16Å; L934-W1052 HydrophobicContact CB-CH2 3.63Å; L934-W1052 HydrophobicContact CB-CZ2 3.79Å; L934-W1052 HydrophobicContact CB-CZ3 4.37Å; L934-W1052 HydrophobicContact CD1-CH2 3.75Å; L934-W1052 HydrophobicContact CD1-CZ3 3.96Å; L934-W1052 HydrophobicContact CG-CH2 4.35Å
935	N	92.9	Very high	89.4	Confident	49 Å²	49	50.2 Å²	50.2	26%	0.262	26%	0.255	S	S	.	.	H	α-helix	trans	-63.8	-42.5	178.5	-158.7	19.7	0	0	0	111.7	Q931 Q932 R933 Q939	Q931-N935 WeakPolarHBondContact O-CB 3.46Å; Q931-N935 PolarHBondContact O-N 2.97Å; Q932-N935 PolarHBondContact O-N 3.33Å; R933-N935 VanDerWaalsContact C-N 3.32Å; R933-N935 PolarHBondContact O-N 3.26Å; N935-Q939 WeakPolarHBondContact O-CB 3.31Å; N935-Q939 WeakPolarHBondContact O-CG 3.38Å; N935-Q939 PolarHBondContact O-N 3.24Å
936	V	93.5	Very high	87.7	Confident	87 Å²	87	50.2 Å²	50.2	53%	0.527	26%	0.256	S	S	.	.	H	α-helix	trans	-62.6	-47.1	174.5	173.7	0	0	0	0	111.1	Q932 R933 L934 W938 Q939 V940	Q932-V936 WeakPolarHBondContact O-CG2 3.49Å; Q932-V936 PolarHBondContact O-N 2.94Å; Q932-V936 VanDerWaalsContact O-N 3.12Å; R933-V936 PolarHBondContact O-N 3.18Å; L934-V936 PolarHBondContact O-N 3.16Å; V936-W938 PolarHBondContact O-N 3.06Å; V936-Q939 WeakPolarHBondContact O-CB 3.47Å; V936-Q939 PolarHBondContact O-N 3.05Å; V936-V940 WeakPolarHBondContact O-CG2 3.43Å; V936-V940 PolarHBondContact O-N 3.47Å
937	K	92.8	Very high	85.7	Confident	76 Å²	76	54.9 Å²	54.9	33%	0.33	29%	0.285	S	S	.	.	H	α-helix	trans	-61.2	-45.5	179.5	-71.4	-80.4	-174.2	150.1	0	112.2	D892 R933 L934 Q939 V940 I941 V973	D892-K937 IonicContact OD2-NZ 2.97Å; D892-K937 PolarHBondContact OD2-NZ 3.47Å; R933-K937 WeakPolarHBondContact O-CG 3.46Å; R933-K937 PolarHBondContact O-N 3.05Å; L934-K937 PolarHBondContact O-N 3.34Å; K937-Q939 VanDerWaalsContact C-N 3.34Å; K937-Q939 PolarHBondContact O-N 3.41Å; K937-V940 PolarHBondContact O-N 3.37Å; K937-I941 WeakPolarHBondContact O-CG1 3.37Å; K937-I941 PolarHBondContact O-N 2.95Å; K937-V973 HydrophobicContact CB-CG1 4.04Å; K937-V973 HydrophobicContact CB-CG2 4Å; K937-V973 HydrophobicContact CD-CG2 4.06Å; K937-V973 HydrophobicContact CG-CG2 4.29Å
938	W	92.2	Very high	83.3	Confident	1 Å²	1	60.6 Å²	60.6	0%	0.004	32%	0.316	C	S	.	.	H	α-helix	trans	-68.1	-31.8	177	-81.4	113	0	0	0	113	L934 V936 I941 N942 V973 R974 T977 W1052 K1053 D1054	L934-W938 WeakPolarHBondContact O-CB 3.44Å; L934-W938 PolarHBondContact O-N 2.89Å; V936-W938 PolarHBondContact O-N 3.06Å; W938-I941 HydrophobicContact CD2-CD1 4.42Å; W938-I941 HydrophobicContact CE3-CB 4.32Å; W938-I941 HydrophobicContact CE3-CD1 4.06Å; W938-I941 HydrophobicContact CE3-CG2 4.22Å; W938-I941 HydrophobicContact CZ3-CD1 4.35Å; W938-I941 HydrophobicContact CZ3-CG2 4.21Å; W938-I941 PolarHBondContact O-N 3.29Å; W938-N942 VanDerWaalsContact O-CB 3.26Å; W938-N942 WeakPolarHBondContact O-CB 3.36Å; W938-N942 PolarHBondContact O-N 3.15Å; W938-N942 PolarHBondContact O-ND2 3.29Å; W938-V973 HydrophobicContact CD2-CG1 4.25Å; W938-V973 HydrophobicContact CG-CG1 4.41Å; W938-V973 HydrophobicContact CZ2-CG1 4.31Å; W938-R974 HydrophobicContact CH2-CG 3.57Å; W938-R974 HydrophobicContact CZ2-CG 3.89Å; W938-T977 PolarHBondContact NE1-OG1 3.13Å; W938-W1052 HydrophobicContact CB-CG 4.15Å; W938-W1052 AromaticContact CD1-CD1 3.59Å; W938-W1052 AromaticContact CD1-CD2 3.29Å; W938-W1052 AromaticContact CD1-CE2 3.44Å; W938-W1052 VanDerWaalsContact CD1-CE2 3.44Å; W938-W1052 AromaticContact CD1-CE3 3.88Å; W938-W1052 AromaticContact CD1-CG 3.41Å; W938-W1052 VanDerWaalsContact CD1-CG 3.41Å; W938-W1052 AromaticContact CD1-NE1 3.59Å; W938-W1052 HydrophobicContact CD2-CB 3.73Å; W938-W1052 HydrophobicContact CD2-CD2 4.43Å; W938-W1052 AromaticContact CD2-CG 3.81Å; W938-W1052 HydrophobicContact CD2-CG 3.81Å; W938-W1052 AromaticContact CE2-CG 3.84Å; W938-W1052 HydrophobicContact CE3-CB 4.21Å; W938-W1052 HydrophobicContact CG-CB 4.03Å; W938-W1052 AromaticContact CG-CD1 3.44Å; W938-W1052 VanDerWaalsContact CG-CD1 3.44Å; W938-W1052 AromaticContact CG-CD2 3.93Å; W938-W1052 HydrophobicContact CG-CD2 3.93Å; W938-W1052 AromaticContact CG-CG 3.54Å; W938-W1052 HydrophobicContact CG-CG 3.54Å; W938-W1052 AromaticContact CG-NE1 3.75Å; W938-W1052 HydrophobicContact CH2-CB 4.43Å; W938-W1052 HydrophobicContact CZ2-CB 4.01Å; W938-W1052 AromaticContact NE1-CD2 3.44Å; W938-W1052 AromaticContact NE1-CE3 3.62Å; W938-W1052 AromaticContact NE1-CG 3.6Å; W938-K1053 HydrophobicContact CZ3-CB 3.95Å; W938-D1054 HydrophobicContact CH2-CB 4.37Å; W938-D1054 HydrophobicContact CZ2-CB 4.5Å
939	Q	90.1	Very high	81	Confident	96 Å²	96	64.8 Å²	64.8	45%	0.449	34%	0.336	S	S	.	.	H	α-helix	trans	-62.6	-44.4	171.4	-78	171	5.8	0	0	111.6	N935 V936 K937 N942 Q943	N935-Q939 WeakPolarHBondContact O-CB 3.31Å; N935-Q939 WeakPolarHBondContact O-CG 3.38Å; N935-Q939 PolarHBondContact O-N 3.24Å; V936-Q939 WeakPolarHBondContact O-CB 3.47Å; V936-Q939 PolarHBondContact O-N 3.05Å; K937-Q939 VanDerWaalsContact C-N 3.34Å; K937-Q939 PolarHBondContact O-N 3.41Å; Q939-N942 PolarHBondContact O-N 2.97Å; Q939-Q943 WeakPolarHBondContact O-CB 3.4Å; Q939-Q943 VanDerWaalsContact O-CG 3.29Å; Q939-Q943 WeakPolarHBondContact O-CG 3.44Å; Q939-Q943 PolarHBondContact O-N 3.45Å
940	V	88.8	Confident	78.4	Confident	55 Å²	55	71.1 Å²	71.1	33%	0.333	37%	0.367	S	S	.	.	H	α-helix	trans	-60.5	-49	175.9	173.7	0	0	0	0	110.8	V936 K937 N942 Q943 R944	V936-V940 WeakPolarHBondContact O-CG2 3.43Å; V936-V940 PolarHBondContact O-N 3.47Å; K937-V940 PolarHBondContact O-N 3.37Å; V940-N942 VanDerWaalsContact C-N 3.31Å; V940-N942 PolarHBondContact O-N 2.99Å; V940-Q943 PolarHBondContact O-N 3.2Å; V940-R944 WeakPolarHBondContact O-CG 3.49Å; V940-R944 PolarHBondContact O-N 3.06Å; V940-R944 VanDerWaalsContact O-N 3.15Å
941	I	87	Confident	76	Confident	12 Å²	12	77.9 Å²	77.9	6%	0.062	40%	0.403	C	S	.	.	H	α-helix	trans	-58.5	-44	177.7	-67.3	161.4	0	0	0	111	K937 W938 Q943 R944 T945 E970 V973	K937-I941 WeakPolarHBondContact O-CG1 3.37Å; K937-I941 PolarHBondContact O-N 2.95Å; W938-I941 HydrophobicContact CD2-CD1 4.42Å; W938-I941 HydrophobicContact CE3-CB 4.32Å; W938-I941 HydrophobicContact CE3-CD1 4.06Å; W938-I941 HydrophobicContact CE3-CG2 4.22Å; W938-I941 HydrophobicContact CZ3-CD1 4.35Å; W938-I941 HydrophobicContact CZ3-CG2 4.21Å; W938-I941 PolarHBondContact O-N 3.29Å; I941-Q943 PolarHBondContact O-N 3.31Å; I941-R944 PolarHBondContact O-N 2.77Å; I941-T945 PolarHBondContact O-N 3.42Å; I941-T945 PolarHBondContact O-OG1 3.39Å; I941-E970 HydrophobicContact CD1-CB 4.43Å; I941-E970 HydrophobicContact CD1-CG 4.17Å; I941-E970 HydrophobicContact CG2-CG 4.11Å; I941-V973 HydrophobicContact CD1-CB 3.9Å; I941-V973 HydrophobicContact CD1-CG1 3.82Å; I941-V973 HydrophobicContact CD1-CG2 4.13Å
942	N	83.1	Confident	73.4	Confident	51 Å²	51	85.4 Å²	85.4	27%	0.273	44%	0.439	S	S	.	.	H	α-helix	trans	-67.6	-35.1	-179.6	-74.5	-25	0	0	0	113.1	W938 Q939 V940 K1053	W938-N942 VanDerWaalsContact O-CB 3.26Å; W938-N942 WeakPolarHBondContact O-CB 3.36Å; W938-N942 PolarHBondContact O-N 3.15Å; W938-N942 PolarHBondContact O-ND2 3.29Å; Q939-N942 PolarHBondContact O-N 2.97Å; V940-N942 VanDerWaalsContact C-N 3.31Å; V940-N942 PolarHBondContact O-N 2.99Å; N942-K1053 WeakPolarHBondContact OD1-CD 3.48Å; N942-K1053 WeakPolarHBondContact OD1-CE 3.43Å
943	Q	82	Confident	71	Confident	120 Å²	120	88.8 Å²	88.8	56%	0.561	46%	0.455	S	S	*	.	H	α-helix	trans	-66.6	-41.7	176.6	-76.8	171.3	-0.3	0	0	111.7	Q939 V940 I941 T945 S946 V947	Q939-Q943 WeakPolarHBondContact O-CB 3.4Å; Q939-Q943 VanDerWaalsContact O-CG 3.29Å; Q939-Q943 WeakPolarHBondContact O-CG 3.44Å; Q939-Q943 PolarHBondContact O-N 3.45Å; V940-Q943 PolarHBondContact O-N 3.2Å; I941-Q943 PolarHBondContact O-N 3.31Å; Q943-T945 VanDerWaalsContact C-N 3.32Å; Q943-T945 PolarHBondContact O-N 3.15Å; Q943-S946 PolarHBondContact O-N 2.83Å; Q943-S946 PolarHBondContact O-OG 3.19Å; Q943-V947 WeakPolarHBondContact O-CG2 3.43Å; Q943-V947 PolarHBondContact O-N 2.99Å
944	R	75.9	Confident	68.5	Low	87 Å²	87	95.9 Å²	95.9	33%	0.328	49%	0.489	S	S	.	.	H	α-helix	trans	-60.7	-40.8	178.3	-65.8	-179.5	-167.4	169	-4.5	112	V940 I941 S946 V947 E966 E969	V940-R944 WeakPolarHBondContact O-CG 3.49Å; V940-R944 PolarHBondContact O-N 3.06Å; V940-R944 VanDerWaalsContact O-N 3.15Å; I941-R944 PolarHBondContact O-N 2.77Å; R944-S946 PolarHBondContact O-N 3.36Å; R944-S946 VanDerWaalsContact O-N 3.16Å; R944-V947 PolarHBondContact O-N 2.95Å; R944-E966 WeakPolarHBondContact CD-OE1 3.46Å; R944-E966 IonicContact NH1-OE1 3.92Å; R944-E969 IonicContact NH1-OE2 2.73Å; R944-E969 IonicContact NH2-OE2 3.29Å
945	T	62.4	Low	65.6	Low	75 Å²	75	103 Å²	103	46%	0.46	52%	0.522	S	S	.	.	H	α-helix	trans	-65.6	-18.1	176.1	-29.9	0	0	0	0	114	I941 Q943 K1053	I941-T945 PolarHBondContact O-N 3.42Å; I941-T945 PolarHBondContact O-OG1 3.39Å; Q943-T945 VanDerWaalsContact C-N 3.32Å; Q943-T945 PolarHBondContact O-N 3.15Å; T945-K1053 VanDerWaalsContact CG2-NZ 3.29Å; T945-K1053 PolarHBondContact OG1-NZ 3.31Å
946	S	55.7	Low	63	Low	77 Å²	77	105 Å²	105	54%	0.538	55%	0.545	S	S	.	.	H	α-helix	trans	-95.1	-14.5	-180	57	0	0	0	0	114.6	Q943 R944	Q943-S946 PolarHBondContact O-N 2.83Å; Q943-S946 PolarHBondContact O-OG 3.19Å; R944-S946 PolarHBondContact O-N 3.36Å; R944-S946 VanDerWaalsContact O-N 3.16Å
947	V	51.5	Low	60.2	Low	101 Å²	101	107.5 Å²	107.5	61%	0.612	56%	0.561	S	S	*	*	H	α-helix	trans	-93	-26.7	-177.5	176	0	0	0	0	111.7	Q943 R944 D949	Q943-V947 WeakPolarHBondContact O-CG2 3.43Å; Q943-V947 PolarHBondContact O-N 2.99Å; R944-V947 PolarHBondContact O-N 2.95Å; V947-D949 PolarHBondContact O-N 3.47Å
948	N	43.6	Very low	57.7	Low	123 Å²	123	113.4 Å²	113.4	66%	0.658	58%	0.582	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.1	6.4	176	-68.9	6.2	0	0	0	114.6
949	D	44	Very low	55.7	Low	126 Å²	126	117.5 Å²	117.5	67%	0.674	60%	0.601	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.3	-10.7	179.8	-86.1	-22.5	0	0	0	113.6	V947	V947-D949 PolarHBondContact O-N 3.47Å
950	E	38.2	Very low	53.6	Low	172 Å²	172	119.7 Å²	119.7	80%	0.804	62%	0.616	S	S	*	*	T	Hydrogen-bonded Turn	trans	-127.9	-24.6	-173.5	-70.8	-168.7	164.2	0	0	119.1
951	D	44.7	Very low	51.8	Low	144 Å²	144	121.9 Å²	121.9	77%	0.77	63%	0.633	S	S	*	*			trans	-161.1	119.2	177.8	-76.4	-56.5	0	0	0	110.7
952	E	39.6	Very low	50.6	Low	188 Å²	188	124.2 Å²	124.2	88%	0.879	65%	0.654	S	S	*	*			trans	175.2	77.8	148.9	-97	167.9	-152.5	0	0	110.7
953	E	43.8	Very low	49.8	Very low	192 Å²	192	125.2 Å²	125.2	90%	0.897	66%	0.661	S	S	*	*			trans	-102.6	94.4	154.5	-76.4	-176.7	171.2	0	0	106.7
954	E	42.1	Very low	49.4	Very low	181 Å²	181	122.6 Å²	122.6	85%	0.846	65%	0.654	S	S	*	*			trans	164.3	73.1	153.1	-93.3	176.2	-176.2	0	0	112.9
955	Q	35	Very low	49.5	Very low	151 Å²	151	122.6 Å²	122.6	71%	0.706	66%	0.658	S	S	*	*			trans	-164.3	52	153.2	-111.7	151.4	50.6	0	0	116.9	V957 Y958 E959	Q955-V957 VanDerWaalsContact C-N 3.27Å; Q955-V957 PolarHBondContact O-N 3.03Å; Q955-Y958 PolarHBondContact O-N 3.08Å; Q955-E959 VanDerWaalsContact C-OE1 3.23Å; Q955-E959 WeakPolarHBondContact O-CG 3.27Å
956	A	36.4	Very low	50.4	Low	89 Å²	89	122.4 Å²	122.4	74%	0.736	65%	0.651	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.3	24.9	-171.4	0	0	0	0	0	119.4
957	V	35.5	Very low	51.8	Low	141 Å²	141	123 Å²	123	86%	0.855	65%	0.647	S	S	*	*	T	Hydrogen-bonded Turn	trans	-133.4	-13.4	174.3	-169.9	0	0	0	0	114	Q955	Q955-V957 VanDerWaalsContact C-N 3.27Å; Q955-V957 PolarHBondContact O-N 3.03Å
958	Y	40.8	Very low	53.5	Low	200 Å²	200	118.4 Å²	118.4	78%	0.784	62%	0.619	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.7	-3.8	172.9	-86.3	-87.3	0	0	0	113.8	Q955	Q955-Y958 PolarHBondContact O-N 3.08Å
959	E	48.8	Very low	55.6	Low	87 Å²	87	116.4 Å²	116.4	41%	0.407	61%	0.605	S	S	.	*	H	α-helix	trans	-70.8	-39.4	-171.3	-79.8	164.3	-171.7	0	0	114.2	Q955 C961 A962 V963	Q955-E959 VanDerWaalsContact C-OE1 3.23Å; Q955-E959 WeakPolarHBondContact O-CG 3.27Å; E959-C961 VanDerWaalsContact C-N 3.34Å; E959-C961 PolarHBondContact O-N 3.45Å; E959-A962 PolarHBondContact O-N 3.25Å; E959-V963 WeakPolarHBondContact O-CB 3.31Å; E959-V963 VanDerWaalsContact O-CG2 3.27Å; E959-V963 WeakPolarHBondContact O-CG2 3.4Å; E959-V963 PolarHBondContact O-N 2.97Å
960	D	46.3	Very low	57.8	Low	142 Å²	142	112.3 Å²	112.3	76%	0.759	58%	0.582	S	S	*	*	H	α-helix	trans	-62.4	-37.5	-173.8	-86.9	-12.6	0	0	0	113.7	T964	D960-T964 WeakPolarHBondContact O-CB 3.44Å; D960-T964 VanDerWaalsContact O-CG2 3.3Å; D960-T964 WeakPolarHBondContact O-CG2 3.42Å; D960-T964 PolarHBondContact O-N 2.82Å; D960-T964 PolarHBondContact O-OG1 3.27Å
961	C	51.8	Low	60.3	Low	101 Å²	101	106.6 Å²	106.6	68%	0.682	56%	0.555	S	S	*	*	H	α-helix	trans	-76.2	-32.2	179.7	-160.9	0	0	0	0	111.9	E959 T964 Q965	E959-C961 VanDerWaalsContact C-N 3.34Å; E959-C961 PolarHBondContact O-N 3.45Å; C961-T964 WeakPolarHBondContact CA-OG1 3.45Å; C961-T964 PolarHBondContact O-OG1 2.94Å; C961-Q965 VanDerWaalsContact O-CB 3.31Å; C961-Q965 WeakPolarHBondContact O-CB 3.47Å; C961-Q965 PolarHBondContact O-N 3.48Å
962	A	61	Low	62.5	Low	60 Å²	60	100.7 Å²	100.7	50%	0.496	52%	0.524	S	S	.	.	H	α-helix	trans	-73.9	-43.4	177.4	0	0	0	0	0	111.7	E959 Q965 E966	E959-A962 PolarHBondContact O-N 3.25Å; A962-Q965 PolarHBondContact O-N 3.47Å; A962-E966 WeakPolarHBondContact O-CB 3.36Å; A962-E966 PolarHBondContact O-N 3.32Å
963	V	66.8	Low	65.1	Low	72 Å²	72	91.9 Å²	91.9	44%	0.436	48%	0.483	S	S	.	.	H	α-helix	trans	-64.6	-44.6	178.5	173.9	0	0	0	0	111.1	E959 Q965 E966 M967	E959-V963 WeakPolarHBondContact O-CB 3.31Å; E959-V963 VanDerWaalsContact O-CG2 3.27Å; E959-V963 WeakPolarHBondContact O-CG2 3.4Å; E959-V963 PolarHBondContact O-N 2.97Å; V963-Q965 VanDerWaalsContact C-N 3.34Å; V963-Q965 PolarHBondContact O-N 3.1Å; V963-E966 PolarHBondContact O-N 3.44Å; V963-M967 HydrophobicContact CG1-CG 4.44Å; V963-M967 HydrophobicContact CG1-SD 4.1Å; V963-M967 WeakPolarHBondContact O-CB 3.03Å; V963-M967 VanDerWaalsContact O-CG 3.28Å; V963-M967 WeakPolarHBondContact O-CG 3.49Å; V963-M967 PolarHBondContact O-N 3.42Å
964	T	73.4	Confident	67.5	Low	65 Å²	65	85.5 Å²	85.5	40%	0.399	45%	0.451	S	S	.	.	H	α-helix	trans	-64.6	-37.5	177.6	48.2	0	0	0	0	112.5	D960 C961 L968	D960-T964 WeakPolarHBondContact O-CB 3.44Å; D960-T964 VanDerWaalsContact O-CG2 3.3Å; D960-T964 WeakPolarHBondContact O-CG2 3.42Å; D960-T964 PolarHBondContact O-N 2.82Å; D960-T964 PolarHBondContact O-OG1 3.27Å; C961-T964 WeakPolarHBondContact CA-OG1 3.45Å; C961-T964 PolarHBondContact O-OG1 2.94Å; T964-L968 WeakPolarHBondContact O-CB 3.44Å; T964-L968 PolarHBondContact O-N 3.33Å
965	Q	78.4	Confident	69.9	Low	88 Å²	88	78.8 Å²	78.8	41%	0.411	42%	0.42	S	S	.	.	H	α-helix	trans	-68.4	-42.1	175.5	-176.9	63.4	22.4	0	0	112.1	C961 A962 V963 L968 E969	C961-Q965 VanDerWaalsContact O-CB 3.31Å; C961-Q965 WeakPolarHBondContact O-CB 3.47Å; C961-Q965 PolarHBondContact O-N 3.48Å; A962-Q965 PolarHBondContact O-N 3.47Å; V963-Q965 VanDerWaalsContact C-N 3.34Å; V963-Q965 PolarHBondContact O-N 3.1Å; Q965-L968 WeakPolarHBondContact O-CB 3.37Å; Q965-L968 PolarHBondContact O-N 2.77Å; Q965-E969 WeakPolarHBondContact O-CG 3.09Å; Q965-E969 PolarHBondContact O-N 2.82Å
966	E	81.9	Confident	72.8	Confident	71 Å²	71	71.6 Å²	71.6	33%	0.332	39%	0.387	S	S	.	.	H	α-helix	trans	-62.6	-46.6	175.1	173.8	169.4	-161.5	0	0	111.7	R944 A962 V963 L968 E969 E970	R944-E966 WeakPolarHBondContact CD-OE1 3.46Å; R944-E966 IonicContact NH1-OE1 3.92Å; A962-E966 WeakPolarHBondContact O-CB 3.36Å; A962-E966 PolarHBondContact O-N 3.32Å; V963-E966 PolarHBondContact O-N 3.44Å; E966-L968 VanDerWaalsContact C-N 3.27Å; E966-L968 PolarHBondContact O-N 3.21Å; E966-E969 PolarHBondContact O-N 3.46Å; E966-E970 PolarHBondContact O-N 3.28Å
967	M	85.1	Confident	75.6	Confident	89 Å²	89	67.4 Å²	67.4	44%	0.438	35%	0.352	S	S	.	.	H	α-helix	trans	-59.7	-40.1	176	-73.9	-178.4	67.5	0	0	111.4	L821 V963 E970 Q971	L821-M967 HydrophobicContact CD2-CB 3.96Å; V963-M967 HydrophobicContact CG1-CG 4.44Å; V963-M967 HydrophobicContact CG1-SD 4.1Å; V963-M967 WeakPolarHBondContact O-CB 3.03Å; V963-M967 VanDerWaalsContact O-CG 3.28Å; V963-M967 WeakPolarHBondContact O-CG 3.49Å; V963-M967 PolarHBondContact O-N 3.42Å; M967-E970 PolarHBondContact O-N 2.76Å; M967-Q971 WeakPolarHBondContact O-CB 3.11Å; M967-Q971 VanDerWaalsContact O-CG 3.23Å; M967-Q971 WeakPolarHBondContact O-CG 3.31Å; M967-Q971 PolarHBondContact O-N 2.78Å
968	L	87.5	Confident	78.4	Confident	5 Å²	5	65.4 Å²	65.4	3%	0.026	33%	0.329	C	S	.	.	H	α-helix	trans	-61.5	-46.7	176.5	177.5	66.6	0	0	0	111.4	K817 I820 L821 T964 Q965 E966 E970 Q971 L972	K817-L968 HydrophobicContact CB-CD1 4.32Å; K817-L968 HydrophobicContact CB-CD2 4.34Å; K817-L968 HydrophobicContact CD-CD2 3.82Å; K817-L968 HydrophobicContact CG-CD1 4.29Å; K817-L968 HydrophobicContact CG-CD2 3.69Å; I820-L968 HydrophobicContact CB-CD1 4.06Å; I820-L968 HydrophobicContact CD1-CD1 4.27Å; I820-L968 HydrophobicContact CG2-CD1 3.76Å; L821-L968 HydrophobicContact CD2-CB 4.33Å; T964-L968 WeakPolarHBondContact O-CB 3.44Å; T964-L968 PolarHBondContact O-N 3.33Å; Q965-L968 WeakPolarHBondContact O-CB 3.37Å; Q965-L968 PolarHBondContact O-N 2.77Å; E966-L968 VanDerWaalsContact C-N 3.27Å; E966-L968 PolarHBondContact O-N 3.21Å; L968-E970 PolarHBondContact O-N 3.04Å; L968-Q971 PolarHBondContact O-N 3.39Å; L968-L972 HydrophobicContact CD1-CD1 4.49Å; L968-L972 HydrophobicContact CD1-CG 4.44Å; L968-L972 HydrophobicContact CG-CD1 4.25Å; L968-L972 WeakPolarHBondContact O-CB 3.45Å; L968-L972 VanDerWaalsContact O-CG 3.3Å; L968-L972 WeakPolarHBondContact O-CG 3.43Å; L968-L972 PolarHBondContact O-N 3.29Å
969	E	86.8	Confident	80.9	Confident	80 Å²	80	57 Å²	57	37%	0.374	30%	0.297	S	S	.	.	H	α-helix	trans	-59.8	-44.9	176.6	-72.9	179.5	-178.1	0	0	111.8	R944 Q965 E966 L972 V973	R944-E969 IonicContact NH1-OE2 2.73Å; R944-E969 IonicContact NH2-OE2 3.29Å; Q965-E969 WeakPolarHBondContact O-CG 3.09Å; Q965-E969 PolarHBondContact O-N 2.82Å; E966-E969 PolarHBondContact O-N 3.46Å; E969-L972 PolarHBondContact O-N 3.45Å; E969-V973 WeakPolarHBondContact O-CG2 3.43Å; E969-V973 PolarHBondContact O-N 3.11Å
970	E	89.8	Confident	83.2	Confident	40 Å²	40	52.9 Å²	52.9	19%	0.187	28%	0.278	C	S	.	.	H	α-helix	trans	-61.4	-45.7	176.6	-179	176.5	-170.9	0	0	111.6	I941 E966 M967 L968 L972 V973 R974	I941-E970 HydrophobicContact CD1-CB 4.43Å; I941-E970 HydrophobicContact CD1-CG 4.17Å; I941-E970 HydrophobicContact CG2-CG 4.11Å; E966-E970 PolarHBondContact O-N 3.28Å; M967-E970 PolarHBondContact O-N 2.76Å; L968-E970 PolarHBondContact O-N 3.04Å; E970-L972 VanDerWaalsContact C-N 3.35Å; E970-L972 PolarHBondContact O-N 3.43Å; E970-V973 PolarHBondContact O-N 2.88Å; E970-R974 VanDerWaalsContact CD-NH2 3.26Å; E970-R974 WeakPolarHBondContact O-CG 3.23Å; E970-R974 PolarHBondContact O-N 3.47Å; E970-R974 IonicContact OE1-CZ 3.18Å; E970-R974 IonicContact OE1-NE 3.99Å; E970-R974 PolarHBondContact OE1-NE 2.92Å; E970-R974 IonicContact OE1-NH2 3.15Å; E970-R974 PolarHBondContact OE1-NH2 3.35Å; E970-R974 IonicContact OE2-NH2 3.12Å
971	Q	90.5	Very high	85.4	Confident	52 Å²	52	46.6 Å²	46.6	24%	0.243	24%	0.244	C	C	.	.	H	α-helix	trans	-65.5	-37.8	179.1	-66.7	-64.3	6.1	0	0	112.1	I820 M967 L968 V973 R974 L975	I820-Q971 HydrophobicContact CG2-CB 3.72Å; M967-Q971 WeakPolarHBondContact O-CB 3.11Å; M967-Q971 VanDerWaalsContact O-CG 3.23Å; M967-Q971 WeakPolarHBondContact O-CG 3.31Å; M967-Q971 PolarHBondContact O-N 2.78Å; L968-Q971 PolarHBondContact O-N 3.39Å; Q971-V973 VanDerWaalsContact C-N 3.34Å; Q971-V973 PolarHBondContact O-N 3.42Å; Q971-R974 PolarHBondContact O-N 3.32Å; Q971-R974 VanDerWaalsContact OE1-CD 3.29Å; Q971-L975 WeakPolarHBondContact O-CB 3.47Å; Q971-L975 VanDerWaalsContact O-CG 3.31Å; Q971-L975 WeakPolarHBondContact O-CG 3.38Å; Q971-L975 PolarHBondContact O-N 3.07Å
972	L	92.4	Very high	87.4	Confident	20 Å²	20	43.9 Å²	43.9	11%	0.105	22%	0.223	C	C	.	.	H	α-helix	trans	-61	-42.8	173.4	-75.2	174.8	0	0	0	111.9	V812 I820 D892 H893 L968 E969 E970 L975 L976	V812-L972 HydrophobicContact CG2-CD1 4.32Å; I820-L972 HydrophobicContact CD1-CD2 3.79Å; D892-L972 HydrophobicContact CB-CB 4.45Å; H893-L972 HydrophobicContact CB-CD2 3.82Å; L968-L972 HydrophobicContact CD1-CD1 4.49Å; L968-L972 HydrophobicContact CD1-CG 4.44Å; L968-L972 HydrophobicContact CG-CD1 4.25Å; L968-L972 WeakPolarHBondContact O-CB 3.45Å; L968-L972 VanDerWaalsContact O-CG 3.3Å; L968-L972 WeakPolarHBondContact O-CG 3.43Å; L968-L972 PolarHBondContact O-N 3.29Å; E969-L972 PolarHBondContact O-N 3.45Å; E970-L972 VanDerWaalsContact C-N 3.35Å; E970-L972 PolarHBondContact O-N 3.43Å; L972-L975 PolarHBondContact O-N 3.46Å; L972-L976 WeakPolarHBondContact O-CB 3.23Å; L972-L976 PolarHBondContact O-N 3.04Å
973	V	93.4	Very high	89	Confident	4 Å²	4	41.1 Å²	41.1	2%	0.024	20%	0.2	C	C	.	.	H	α-helix	trans	-64.9	-40.7	175.9	173.5	0	0	0	0	111.1	L934 K937 W938 I941 E969 E970 Q971 L976 T977	L934-V973 HydrophobicContact CD2-CG1 4.4Å; K937-V973 HydrophobicContact CB-CG1 4.04Å; K937-V973 HydrophobicContact CB-CG2 4Å; K937-V973 HydrophobicContact CD-CG2 4.06Å; K937-V973 HydrophobicContact CG-CG2 4.29Å; W938-V973 HydrophobicContact CD2-CG1 4.25Å; W938-V973 HydrophobicContact CG-CG1 4.41Å; W938-V973 HydrophobicContact CZ2-CG1 4.31Å; I941-V973 HydrophobicContact CD1-CB 3.9Å; I941-V973 HydrophobicContact CD1-CG1 3.82Å; I941-V973 HydrophobicContact CD1-CG2 4.13Å; E969-V973 WeakPolarHBondContact O-CG2 3.43Å; E969-V973 PolarHBondContact O-N 3.11Å; E970-V973 PolarHBondContact O-N 2.88Å; Q971-V973 VanDerWaalsContact C-N 3.34Å; Q971-V973 PolarHBondContact O-N 3.42Å; V973-L976 PolarHBondContact O-N 3.43Å; V973-T977 VanDerWaalsContact O-CB 3.22Å; V973-T977 WeakPolarHBondContact O-CB 3.42Å; V973-T977 PolarHBondContact O-N 3.29Å; V973-T977 PolarHBondContact O-OG1 2.62Å
974	R	93.3	Very high	90.2	Very high	58 Å²	58	37.7 Å²	37.7	22%	0.219	18%	0.179	C	C	.	.	H	α-helix	trans	-61.3	-46.6	174.1	-74.1	170.7	-179	175.9	1.7	111.9	W938 E970 Q971 T977 R978	W938-R974 HydrophobicContact CH2-CG 3.57Å; W938-R974 HydrophobicContact CZ2-CG 3.89Å; E970-R974 VanDerWaalsContact CD-NH2 3.26Å; E970-R974 WeakPolarHBondContact O-CG 3.23Å; E970-R974 PolarHBondContact O-N 3.47Å; E970-R974 IonicContact OE1-CZ 3.18Å; E970-R974 IonicContact OE1-NE 3.99Å; E970-R974 PolarHBondContact OE1-NE 2.92Å; E970-R974 IonicContact OE1-NH2 3.15Å; E970-R974 PolarHBondContact OE1-NH2 3.35Å; E970-R974 IonicContact OE2-NH2 3.12Å; Q971-R974 PolarHBondContact O-N 3.32Å; Q971-R974 VanDerWaalsContact OE1-CD 3.29Å; R974-T977 WeakPolarHBondContact O-CB 3.21Å; R974-T977 PolarHBondContact O-N 3.27Å; R974-R978 WeakPolarHBondContact O-CG 3.46Å; R974-R978 PolarHBondContact O-N 3.12Å
975	L	93.4	Very high	91.1	Very high	40 Å²	40	35.4 Å²	35.4	21%	0.209	16%	0.164	C	C	.	.	H	α-helix	trans	-63	-45.7	178.3	-71	173.5	0	0	0	111.7	I820 Q971 L972 T977 R978 E979	I820-L975 HydrophobicContact CG1-CD1 4.28Å; I820-L975 HydrophobicContact CG2-CD1 4.1Å; Q971-L975 WeakPolarHBondContact O-CB 3.47Å; Q971-L975 VanDerWaalsContact O-CG 3.31Å; Q971-L975 WeakPolarHBondContact O-CG 3.38Å; Q971-L975 PolarHBondContact O-N 3.07Å; L972-L975 PolarHBondContact O-N 3.46Å; L975-T977 VanDerWaalsContact C-N 3.34Å; L975-T977 PolarHBondContact O-N 2.93Å; L975-R978 PolarHBondContact O-N 3.31Å; L975-E979 WeakPolarHBondContact O-CG 3.37Å; L975-E979 PolarHBondContact O-N 2.91Å; L975-E979 VanDerWaalsContact O-N 3.12Å
976	L	95.3	Very high	91.7	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-61.9	-42.2	175.8	-179.8	60.3	0	0	0	111.8	D892 L895 R896 I899 M930 L934 L972 V973 R978 E979 V980	D892-L976 HydrophobicContact CB-CD2 3.76Å; D892-L976 WeakPolarHBondContact OD1-CD2 3.32Å; L895-L976 HydrophobicContact CB-CD1 3.95Å; R896-L976 HydrophobicContact CB-CD1 4.23Å; I899-L976 HydrophobicContact CD1-CD1 3.95Å; M930-L976 HydrophobicContact CE-CD1 3.74Å; M930-L976 HydrophobicContact CE-CD2 3.85Å; M930-L976 HydrophobicContact CE-CG 3.81Å; L934-L976 HydrophobicContact CD2-CD2 4.14Å; L934-L976 HydrophobicContact CD2-CG 4.2Å; L972-L976 WeakPolarHBondContact O-CB 3.23Å; L972-L976 PolarHBondContact O-N 3.04Å; V973-L976 PolarHBondContact O-N 3.43Å; L976-R978 PolarHBondContact O-N 3.33Å; L976-E979 PolarHBondContact O-N 3.43Å; L976-V980 HydrophobicContact CD1-CG2 4.37Å; L976-V980 WeakPolarHBondContact O-CG2 3.06Å; L976-V980 PolarHBondContact O-N 3.19Å
977	T	94.8	Very high	92.1	Very high	0 Å²	0	30 Å²	30	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-57	-48.2	175.6	-66	0	0	0	0	111.5	W938 V973 R974 L975 E979 V980 L981 W1052	W938-T977 PolarHBondContact NE1-OG1 3.13Å; V973-T977 VanDerWaalsContact O-CB 3.22Å; V973-T977 WeakPolarHBondContact O-CB 3.42Å; V973-T977 PolarHBondContact O-N 3.29Å; V973-T977 PolarHBondContact O-OG1 2.62Å; R974-T977 WeakPolarHBondContact O-CB 3.21Å; R974-T977 PolarHBondContact O-N 3.27Å; L975-T977 VanDerWaalsContact C-N 3.34Å; L975-T977 PolarHBondContact O-N 2.93Å; T977-E979 VanDerWaalsContact C-N 3.3Å; T977-E979 PolarHBondContact O-N 3.29Å; T977-V980 PolarHBondContact O-N 3.37Å; T977-L981 HydrophobicContact CG2-CD1 3.9Å; T977-L981 WeakPolarHBondContact O-CG 3.34Å; T977-L981 PolarHBondContact O-N 2.9Å; T977-L981 VanDerWaalsContact O-N 3.09Å; T977-W1052 HydrophobicContact CG2-CE3 3.39Å; T977-W1052 HydrophobicContact CG2-CZ3 3.57Å
978	R	94.3	Very high	92.3	Very high	99 Å²	99	25.8 Å²	25.8	37%	0.374	12%	0.121	S	C	.	.	H	α-helix	trans	-60.8	-40.2	178.8	-72.8	172.4	-179.1	-175.6	-0.5	111.9	R974 L975 L976 L981 D982 D1054	R974-R978 WeakPolarHBondContact O-CG 3.46Å; R974-R978 PolarHBondContact O-N 3.12Å; L975-R978 PolarHBondContact O-N 3.31Å; L976-R978 PolarHBondContact O-N 3.33Å; R978-L981 PolarHBondContact O-N 3.31Å; R978-D982 WeakPolarHBondContact O-CB 3.4Å; R978-D982 PolarHBondContact O-N 2.93Å; R978-D1054 IonicContact CZ-OD1 3.68Å; R978-D1054 IonicContact CZ-OD2 2.77Å; R978-D1054 IonicContact NE-OD1 2.74Å; R978-D1054 IonicContact NE-OD2 3.13Å; R978-D1054 PolarHBondContact NE-OD2 2.74Å; R978-D1054 IonicContact NH2-OD1 3.37Å; R978-D1054 PolarHBondContact NH2-OD1 2.8Å; R978-D1054 IonicContact NH2-OD2 3.75Å; R978-D1054 PolarHBondContact NH2-OD2 3.19Å
979	E	95.1	Very high	92.3	Very high	24 Å²	24	26 Å²	26	11%	0.112	12%	0.122	C	C	.	.	H	α-helix	trans	-73.6	-37.8	-177.7	-65.5	-89.9	-168.4	0	0	112	R896 I899 L975 L976 T977 L981 D982 L983	R896-E979 HydrophobicContact CG-CB 4.3Å; R896-E979 HydrophobicContact CG-CG 3.78Å; R896-E979 IonicContact CZ-OE1 3.58Å; R896-E979 IonicContact NE-OE1 2.78Å; R896-E979 PolarHBondContact NE-OE1 2.83Å; R896-E979 IonicContact NH2-OE1 2.76Å; R896-E979 PolarHBondContact NH2-OE1 3.18Å; I899-E979 HydrophobicContact CG2-CB 4.4Å; L975-E979 WeakPolarHBondContact O-CG 3.37Å; L975-E979 PolarHBondContact O-N 2.91Å; L975-E979 VanDerWaalsContact O-N 3.12Å; L976-E979 PolarHBondContact O-N 3.43Å; T977-E979 VanDerWaalsContact C-N 3.3Å; T977-E979 PolarHBondContact O-N 3.29Å; E979-L981 VanDerWaalsContact C-N 3.32Å; E979-L981 PolarHBondContact O-N 3.21Å; E979-D982 PolarHBondContact O-N 2.99Å; E979-L983 WeakPolarHBondContact O-CB 3.34Å; E979-L983 PolarHBondContact O-N 3.13Å
980	V	95.4	Very high	91.9	Very high	1 Å²	1	24.8 Å²	24.8	1%	0.006	12%	0.123	C	C	.	.	H	α-helix	trans	-61.6	-42	172	170.5	0	0	0	0	111.2	I899 M930 L934 L976 T977 L983 L984 L1045	I899-V980 HydrophobicContact CD1-CG2 3.7Å; M930-V980 HydrophobicContact CB-CG1 4.11Å; M930-V980 HydrophobicContact CB-CG2 4.15Å; M930-V980 HydrophobicContact CE-CG2 3.42Å; M930-V980 VanDerWaalsContact CE-CG2 3.42Å; M930-V980 HydrophobicContact CG-CG2 4.04Å; L934-V980 HydrophobicContact CD1-CB 4.27Å; L934-V980 HydrophobicContact CD1-CG1 4.32Å; L934-V980 HydrophobicContact CD1-CG2 4.16Å; L976-V980 HydrophobicContact CD1-CG2 4.37Å; L976-V980 WeakPolarHBondContact O-CG2 3.06Å; L976-V980 PolarHBondContact O-N 3.19Å; T977-V980 PolarHBondContact O-N 3.37Å; V980-L983 PolarHBondContact O-N 3.13Å; V980-L984 WeakPolarHBondContact O-CB 3.43Å; V980-L984 PolarHBondContact O-N 2.9Å; V980-L1045 HydrophobicContact CG1-CD2 3.98Å
981	L	93.3	Very high	90.8	Very high	10 Å²	10	30 Å²	30	5%	0.052	14%	0.141	C	C	.	.	H	α-helix	trans	-77.8	-29.2	-178.1	-67.7	169.8	0	0	0	112.4	T977 R978 E979 L984 N985 L1045 W1052 N1057	T977-L981 HydrophobicContact CG2-CD1 3.9Å; T977-L981 WeakPolarHBondContact O-CG 3.34Å; T977-L981 PolarHBondContact O-N 2.9Å; T977-L981 VanDerWaalsContact O-N 3.09Å; R978-L981 PolarHBondContact O-N 3.31Å; E979-L981 VanDerWaalsContact C-N 3.32Å; E979-L981 PolarHBondContact O-N 3.21Å; L981-L984 HydrophobicContact CD2-CD1 4.48Å; L981-L984 PolarHBondContact O-N 3.38Å; L981-N985 VanDerWaalsContact O-CB 3.27Å; L981-N985 WeakPolarHBondContact O-CB 3.34Å; L981-N985 PolarHBondContact O-N 2.87Å; L981-L1045 HydrophobicContact CD2-CG 4.34Å; L981-W1052 HydrophobicContact CD1-CZ3 4.23Å; L981-N1057 WeakPolarHBondContact CD1-ND2 3.47Å; L981-N1057 WeakPolarHBondContact CD1-OD1 3.42Å
982	D	93.2	Very high	88.6	Confident	44 Å²	44	35.4 Å²	35.4	24%	0.235	16%	0.163	C	C	.	.	H	α-helix	trans	-65.9	-43.3	167.9	-166.4	47.1	0	0	0	111.3	K904 R978 E979 L984 N985 V986	K904-D982 WeakPolarHBondContact CE-OD2 3.38Å; K904-D982 IonicContact NZ-OD2 3.52Å; K904-D982 PolarHBondContact NZ-OD2 3.12Å; R978-D982 WeakPolarHBondContact O-CB 3.4Å; R978-D982 PolarHBondContact O-N 2.93Å; E979-D982 PolarHBondContact O-N 2.99Å; D982-L984 VanDerWaalsContact C-N 3.33Å; D982-L984 PolarHBondContact O-N 2.87Å; D982-N985 WeakPolarHBondContact O-CB 3.29Å; D982-N985 PolarHBondContact O-N 3.22Å; D982-V986 WeakPolarHBondContact O-CG2 3.47Å; D982-V986 PolarHBondContact O-N 3.2Å
983	L	94.5	Very high	85.9	Confident	2 Å²	2	37.8 Å²	37.8	1%	0.01	19%	0.186	C	C	.	.	H	α-helix	trans	-58.5	-44.7	172.1	178	66.1	0	0	0	111.4	I899 L903 K904 V907 L923 L926 F927 E979 V980 N985 S987	I899-L983 HydrophobicContact CG2-CB 4.06Å; I899-L983 HydrophobicContact CG2-CD2 4.02Å; L903-L983 HydrophobicContact CB-CD1 4.38Å; L903-L983 HydrophobicContact CB-CD2 4.24Å; K904-L983 HydrophobicContact CB-CD1 4.26Å; V907-L983 HydrophobicContact CG2-CD1 4.1Å; L923-L983 HydrophobicContact CD2-CD2 4.33Å; L926-L983 HydrophobicContact CD2-CD2 3.99Å; F927-L983 HydrophobicContact CE1-CD2 4.1Å; F927-L983 HydrophobicContact CE1-CG 4.23Å; F927-L983 HydrophobicContact CZ-CD2 4.15Å; F927-L983 HydrophobicContact CZ-CG 4.04Å; E979-L983 WeakPolarHBondContact O-CB 3.34Å; E979-L983 PolarHBondContact O-N 3.13Å; V980-L983 PolarHBondContact O-N 3.13Å; L983-N985 VanDerWaalsContact C-N 3.35Å; L983-S987 VanDerWaalsContact O-CB 3.27Å; L983-S987 WeakPolarHBondContact O-CB 3.4Å; L983-S987 PolarHBondContact O-N 3.34Å; L983-S987 PolarHBondContact O-OG 3.13Å
984	L	93.5	Very high	82.7	Confident	0 Å²	0	43.5 Å²	43.5	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-61.7	-43.7	177.2	-179	152.6	0	0	0	111.6	F927 V980 L981 D982 S987 C988 L1042 L1045 V1065 L1069	F927-L984 HydrophobicContact CE1-CB 3.92Å; F927-L984 HydrophobicContact CZ-CB 4.13Å; V980-L984 WeakPolarHBondContact O-CB 3.43Å; V980-L984 PolarHBondContact O-N 2.9Å; L981-L984 HydrophobicContact CD2-CD1 4.48Å; L981-L984 PolarHBondContact O-N 3.38Å; D982-L984 VanDerWaalsContact C-N 3.33Å; D982-L984 PolarHBondContact O-N 2.87Å; L984-S987 PolarHBondContact O-N 3.38Å; L984-C988 WeakPolarHBondContact O-CB 3.49Å; L984-C988 PolarHBondContact O-N 2.89Å; L984-C988 PolarHBondContact O-SG 3.15Å; L984-C988 VanDerWaalsContact O-SG 3.41Å; L984-L1042 HydrophobicContact CD1-CD2 3.91Å; L984-L1042 HydrophobicContact CG-CD2 4.29Å; L984-L1045 HydrophobicContact CD1-CD2 3.83Å; L984-L1045 HydrophobicContact CD1-CG 4.23Å; L984-V1065 HydrophobicContact CD2-CG1 3.33Å; L984-V1065 HydrophobicContact CD2-CG2 4.38Å; L984-L1069 HydrophobicContact CD2-CD1 4.19Å
985	N	91.2	Very high	79.3	Confident	17 Å²	17	49.8 Å²	49.8	9%	0.091	26%	0.255	C	S	.	.	H	α-helix	trans	-60.8	-52.5	178.1	178.4	28.4	0	0	0	111.1	L981 D982 L983 S987 C988 I989	L981-N985 VanDerWaalsContact O-CB 3.27Å; L981-N985 WeakPolarHBondContact O-CB 3.34Å; L981-N985 PolarHBondContact O-N 2.87Å; D982-N985 WeakPolarHBondContact O-CB 3.29Å; D982-N985 PolarHBondContact O-N 3.22Å; L983-N985 VanDerWaalsContact C-N 3.35Å; N985-S987 VanDerWaalsContact C-N 3.26Å; N985-S987 PolarHBondContact O-N 2.85Å; N985-C988 PolarHBondContact O-N 3.47Å; N985-I989 WeakPolarHBondContact O-CB 3.22Å; N985-I989 PolarHBondContact O-N 3.48Å; N985-I989 VanDerWaalsContact OD1-CD1 3.29Å; N985-I989 WeakPolarHBondContact OD1-CD1 3.44Å
986	V	90.6	Very high	76.1	Confident	46 Å²	46	53.3 Å²	53.3	28%	0.279	28%	0.28	S	S	.	.	H	α-helix	trans	-61	-35.4	176.6	173.5	0	0	0	0	111.9	V907 I908 D982	V907-V986 HydrophobicContact CG1-CG1 4.29Å; I908-V986 HydrophobicContact CD1-CG1 3.97Å; I908-V986 HydrophobicContact CG1-CG1 3.45Å; I908-V986 VanDerWaalsContact CG1-CG1 3.45Å; D982-V986 WeakPolarHBondContact O-CG2 3.47Å; D982-V986 PolarHBondContact O-N 3.2Å
987	S	90.8	Very high	72.8	Confident	0 Å²	0	58 Å²	58	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-69	-37.5	178.8	-58.8	0	0	0	0	112.6	L983 L984 N985 S1026 L1028 G1029	L983-S987 VanDerWaalsContact O-CB 3.27Å; L983-S987 WeakPolarHBondContact O-CB 3.4Å; L983-S987 PolarHBondContact O-N 3.34Å; L983-S987 PolarHBondContact O-OG 3.13Å; L984-S987 PolarHBondContact O-N 3.38Å; N985-S987 VanDerWaalsContact C-N 3.26Å; N985-S987 PolarHBondContact O-N 2.85Å; S987-S1026 PolarHBondContact O-OG 3.21Å; S987-L1028 WeakPolarHBondContact O-CB 3.29Å; S987-G1029 PolarHBondContact O-N 2.82Å
988	C	89.9	Confident	69.6	Low	0 Å²	0	62.1 Å²	62.1	0%	0	35%	0.353	C	S	.	.	H	α-helix	trans	-111.4	-23	-166.2	-58	0	0	0	0	115.2	L984 N985 L1025 S1026 L1069	L984-C988 WeakPolarHBondContact O-CB 3.49Å; L984-C988 PolarHBondContact O-N 2.89Å; L984-C988 PolarHBondContact O-SG 3.15Å; L984-C988 VanDerWaalsContact O-SG 3.41Å; N985-C988 PolarHBondContact O-N 3.47Å; C988-L1025 HydrophobicContact CB-CD2 4.5Å; C988-L1025 CarbonylContact O-C 3.59Å; C988-L1025 VanDerWaalsContact O-CA 3.31Å; C988-L1025 WeakPolarHBondContact O-CA 3.44Å; C988-L1025 VanDerWaalsContact O-CD2 3.24Å; C988-L1025 WeakPolarHBondContact O-CD2 3.3Å; C988-S1026 VanDerWaalsContact C-OG 3.3Å; C988-S1026 PolarHBondContact O-N 2.91Å; C988-S1026 PolarHBondContact O-OG 3.49Å; C988-L1069 HydrophobicContact CB-CD2 3.79Å
989	I	87.7	Confident	66.5	Low	10 Å²	10	65.8 Å²	65.8	5%	0.051	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	127.5	-166.6	-60.2	160.1	0	0	0	110	N985 D1023 M1064 V1065	N985-I989 WeakPolarHBondContact O-CB 3.22Å; N985-I989 PolarHBondContact O-N 3.48Å; N985-I989 VanDerWaalsContact OD1-CD1 3.29Å; N985-I989 WeakPolarHBondContact OD1-CD1 3.44Å; I989-D1023 HydrophobicContact CG2-CB 4.08Å; I989-M1064 VanDerWaalsContact CD1-O 3.29Å; I989-M1064 WeakPolarHBondContact CD1-O 3.37Å; I989-V1065 HydrophobicContact CD1-CB 4.07Å; I989-V1065 HydrophobicContact CD1-CG1 4.36Å; I989-V1065 HydrophobicContact CD1-CG2 3.64Å
990	S	78.6	Confident	63.2	Low	54 Å²	54	74 Å²	74	38%	0.378	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	123.8	173.2	-174.8	0	0	0	0	109.9	E1024	S990-E1024 PolarHBondContact N-O 3.27Å
991	R	64.9	Low	60	Low	150 Å²	150	80 Å²	80	57%	0.566	44%	0.441	S	S	*	.			trans	-92.4	118.8	166.2	-68.1	-178.2	178.9	179.3	-1.6	108.3	A993 M1064	R991-A993 VanDerWaalsContact C-N 3.25Å; R991-A993 PolarHBondContact O-N 2.92Å; R991-M1064 PolarHBondContact NH2-SD 3.41Å
992	K	45.4	Very low	56.7	Low	164 Å²	164	87.8 Å²	87.8	71%	0.713	48%	0.478	S	S	*	.			trans	-72	87.2	162.8	-79.9	-177.4	179	171.9	0	108.2
993	A	34.7	Very low	53.4	Low	71 Å²	71	92.9 Å²	92.9	59%	0.587	50%	0.503	S	S	*	.			trans	-67.8	145.1	160.7	0	0	0	0	0	108.6	R991 E995	R991-A993 VanDerWaalsContact C-N 3.25Å; R991-A993 PolarHBondContact O-N 2.92Å; A993-E995 PolarHBondContact O-N 3.5Å
994	P	27.5	Very low	50.1	Low	124 Å²	124	99.5 Å²	99.5	81%	0.805	54%	0.539	S	S	*	.			trans	-56.8	128.2	163.1	16.7	-17.2	0	0	0	107.8	P996	P994-P996 WeakPolarHBondContact O-CD 3.15Å; P994-P996 VanDerWaalsContact O-N 3.13Å
995	E	21.6	Very low	46.8	Very low	189 Å²	189	108.8 Å²	108.8	88%	0.883	58%	0.582	S	S	*	*			trans	-45.3	117.7	-177.1	-74	178.8	154	0	0	111	A993 A997	A993-E995 PolarHBondContact O-N 3.5Å; E995-A997 PolarHBondContact O-N 2.84Å
996	P	26.9	Very low	43.5	Very low	115 Å²	115	115.9 Å²	115.9	75%	0.747	62%	0.615	S	S	*	*			trans	-74.1	114	164	28.1	-27.1	0	0	0	107.3	P994 A998	P994-P996 WeakPolarHBondContact O-CD 3.15Å; P994-P996 VanDerWaalsContact O-N 3.13Å; P996-A998 PolarHBondContact O-N 3.48Å; P996-A998 VanDerWaalsContact O-N 3.11Å
997	A	26	Very low	40.3	Very low	98 Å²	98	121.3 Å²	121.3	81%	0.81	64%	0.642	S	S	*	*	S	Bend	trans	-55.2	117	169.1	0	0	0	0	0	109.5	E995	E995-A997 PolarHBondContact O-N 2.84Å
998	A	27.1	Very low	37.2	Very low	86 Å²	86	127.6 Å²	127.6	71%	0.711	68%	0.68	S	S	*	*	S	Bend	trans	54.2	125.2	168.5	0	0	0	0	0	116.7	P996 K1000	P996-A998 PolarHBondContact O-N 3.48Å; P996-A998 VanDerWaalsContact O-N 3.11Å; A998-K1000 PolarHBondContact O-N 2.98Å
999	I	29.3	Very low	34	Very low	176 Å²	176	134.7 Å²	134.7	90%	0.903	72%	0.715	S	S	*	*			trans	-36.7	99.7	170.8	-59.4	163.2	0	0	0	110.6
1000	K	26	Very low	30.9	Very low	197 Å²	197	143 Å²	143	86%	0.857	76%	0.756	S	S	*	*			trans	-102.4	130.2	159.9	-91.2	-176.7	174.9	179	0	106.7	A998	A998-K1000 PolarHBondContact O-N 2.98Å
1001	E	26.5	Very low	28.2	Very low	126 Å²	126	148.4 Å²	148.4	59%	0.589	78%	0.775	S	S	*	*			trans	-46.6	135.1	-175.3	-61	-178.6	145.9	0	0	112.6	I1003	E1001-I1003 PolarHBondContact O-N 3.15Å; E1001-I1003 VanDerWaalsContact O-N 3.08Å
1002	E	24.3	Very low	26.2	Very low	175 Å²	175	147 Å²	147	82%	0.818	79%	0.789	S	S	*	*			trans	-52	110.3	173.8	-67.7	172.5	162.2	0	0	110.1
1003	I	24.3	Very low	25.1	Very low	150 Å²	150	144.3 Å²	144.3	77%	0.769	79%	0.785	S	S	*	*			trans	-82.3	128.1	157.8	-64.1	174.6	0	0	0	105.5	E1001 E1005	E1001-I1003 PolarHBondContact O-N 3.15Å; E1001-I1003 VanDerWaalsContact O-N 3.08Å; I1003-E1005 PolarHBondContact O-N 3.08Å
1004	D	24.8	Very low	24.7	Very low	141 Å²	141	149.5 Å²	149.5	75%	0.754	80%	0.798	S	S	*	*			trans	-38.1	119.9	-175.9	-67.5	-55.1	0	0	0	113.6	E1006	D1004-E1006 VanDerWaalsContact C-N 3.25Å; D1004-E1006 PolarHBondContact O-N 3.27Å
1005	E	24	Very low	24.6	Very low	195 Å²	195	149.8 Å²	149.8	91%	0.911	80%	0.797	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.4	28.4	-179.3	-76.7	-167.7	150.8	0	0	114.1	I1003	I1003-E1005 PolarHBondContact O-N 3.08Å
1006	E	23.5	Very low	24.7	Very low	167 Å²	167	144.9 Å²	144.9	78%	0.78	79%	0.788	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.7	-9.2	-178.9	-72	-161.7	150.3	0	0	115.3	D1004	D1004-E1006 VanDerWaalsContact C-N 3.25Å; D1004-E1006 PolarHBondContact O-N 3.27Å
1007	D	23.6	Very low	24.7	Very low	160 Å²	160	145.5 Å²	145.5	86%	0.856	80%	0.795	S	S	*	*	S	Bend	trans	-110.9	9	-170.5	-85.3	-24.9	0	0	0	117.4
1008	V	24	Very low	24.5	Very low	132 Å²	132	145.3 Å²	145.3	80%	0.8	79%	0.789	S	S	*	*			trans	-119	63.4	-177.9	-161.8	0	0	0	0	112.6
1009	M	22.4	Very low	24.7	Very low	148 Å²	148	147.1 Å²	147.1	73%	0.729	79%	0.793	S	S	*	*			trans	-129.8	42	170.4	-80	-78.3	-144.8	0	0	112.3
1010	M	24.2	Very low	24.9	Very low	185 Å²	185	146.8 Å²	146.8	91%	0.911	79%	0.787	S	S	*	*	S	Bend	trans	-158.4	91.9	156.7	-85.9	-128.2	-117.5	0	0	110.5
1011	E	21.4	Very low	25.4	Very low	167 Å²	167	141.5 Å²	141.5	78%	0.78	77%	0.773	S	S	*	*			trans	-175.7	90.5	147.4	-106.6	176	-165.6	0	0	108.7	V1013	E1011-V1013 VanDerWaalsContact C-N 3.3Å; E1011-V1013 HydrophobicContact CG-CG2 4.43Å; E1011-V1013 PolarHBondContact O-N 2.83Å
1012	S	21.8	Very low	26.6	Very low	122 Å²	122	140.6 Å²	140.6	85%	0.853	78%	0.776	S	S	*	*			trans	-89.4	71.8	166.3	53	0	0	0	0	109.3	Q1014	S1012-Q1014 PolarHBondContact O-N 2.95Å
1013	V	23.7	Very low	28.6	Very low	106 Å²	106	133.9 Å²	133.9	64%	0.642	75%	0.746	S	S	*	*			trans	-75.9	106.9	167.2	-177.1	0	0	0	0	107.7	E1011 V1015	E1011-V1013 VanDerWaalsContact C-N 3.3Å; E1011-V1013 HydrophobicContact CG-CG2 4.43Å; E1011-V1013 PolarHBondContact O-N 2.83Å; V1013-V1015 PolarHBondContact O-N 3.12Å
1014	Q	26.4	Very low	31.2	Very low	181 Å²	181	131.5 Å²	131.5	85%	0.846	73%	0.732	S	S	*	*			trans	-60	95.2	170.6	-71.3	178.3	-15.3	0	0	109.9	S1012	S1012-Q1014 PolarHBondContact O-N 2.95Å
1015	V	23.9	Very low	34.1	Very low	130 Å²	130	126 Å²	126	79%	0.788	70%	0.702	S	S	*	*			trans	-78.3	139.8	165.2	-177.7	0	0	0	0	108.7	V1013	V1013-V1015 PolarHBondContact O-N 3.12Å
1016	A	24.4	Very low	37.2	Very low	85 Å²	85	117.7 Å²	117.7	70%	0.702	67%	0.666	S	S	*	*			trans	-52.2	148.5	-173.6	0	0	0	0	0	114.1	S1018	A1016-S1018 PolarHBondContact O-N 3.35Å
1017	S	26.8	Very low	40.2	Very low	128 Å²	128	115.3 Å²	115.3	90%	0.895	66%	0.655	S	S	*	*			trans	-43.3	102.1	-179.3	54.6	0	0	0	0	115.1
1018	S	22.5	Very low	43.3	Very low	95 Å²	95	108.1 Å²	108.1	66%	0.664	62%	0.616	S	S	*	*	P	Polyproline II helix	trans	-93.2	160.1	149.6	61.8	0	0	0	0	109.5	A1016 Q1020	A1016-S1018 PolarHBondContact O-N 3.35Å; S1018-Q1020 PolarHBondContact O-N 2.91Å
1019	P	30.1	Very low	46.4	Very low	123 Å²	123	101.8 Å²	101.8	80%	0.799	58%	0.578	S	S	*	*	P	Polyproline II helix	trans	-62	130.1	178.4	-2.3	14.8	0	0	0	109.2
1020	Q	34.9	Very low	49.6	Very low	169 Å²	169	98.9 Å²	98.9	79%	0.79	56%	0.561	S	S	*	*	P	Polyproline II helix	trans	-55.4	132.2	-179.7	-71.2	-172.9	-52.3	0	0	110.5	S1018 T1022	S1018-Q1020 PolarHBondContact O-N 2.91Å; Q1020-T1022 PolarHBondContact O-N 3.14Å
1021	P	36.3	Very low	52.6	Low	87 Å²	87	91 Å²	91	57%	0.565	52%	0.524	S	S	*	.	P	Polyproline II helix	trans	-59.9	125.7	161.6	27	-31.5	0	0	0	107.3	D1023	P1021-D1023 PolarHBondContact O-N 3.12Å
1022	T	51.1	Low	55.8	Low	106 Å²	106	83 Å²	83	65%	0.65	49%	0.486	S	S	*	.			trans	-72.7	99.9	174.1	46.1	0	0	0	0	108	Q1020 E1024	Q1020-T1022 PolarHBondContact O-N 3.14Å; T1022-E1024 PolarHBondContact O-N 3.11Å
1023	D	66.9	Low	58.9	Low	35 Å²	35	78.1 Å²	78.1	19%	0.187	45%	0.45	C	S	.	.			trans	-56.1	132.1	170	-67.6	-28.7	0	0	0	109.3	I989 P1021 M1064 N1068	I989-D1023 HydrophobicContact CG2-CB 4.08Å; P1021-D1023 PolarHBondContact O-N 3.12Å; D1023-M1064 WeakPolarHBondContact OD2-CE 3.47Å; D1023-N1068 PolarHBondContact O-OD1 2.94Å
1024	E	78.9	Confident	61.8	Low	100 Å²	100	81.1 Å²	81.1	47%	0.467	46%	0.455	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	162.7	-179.1	-74.3	-177.8	-179.6	0	0	110.5	S990 T1022 S1026	S990-E1024 PolarHBondContact N-O 3.27Å; T1022-E1024 PolarHBondContact O-N 3.11Å; E1024-S1026 PolarHBondContact O-N 3.27Å
1025	L	85.8	Confident	64.4	Low	25 Å²	25	75.2 Å²	75.2	13%	0.131	43%	0.427	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.8	134.3	173.5	-72.6	176.2	0	0	0	111	C988 K1030 M1033 L1069 P1072	C988-L1025 HydrophobicContact CB-CD2 4.5Å; C988-L1025 CarbonylContact O-C 3.59Å; C988-L1025 VanDerWaalsContact O-CA 3.31Å; C988-L1025 WeakPolarHBondContact O-CA 3.44Å; C988-L1025 VanDerWaalsContact O-CD2 3.24Å; C988-L1025 WeakPolarHBondContact O-CD2 3.3Å; L1025-K1030 HydrophobicContact CB-CG 4.1Å; L1025-K1030 WeakPolarHBondContact O-CE 3.45Å; L1025-M1033 HydrophobicContact CD1-CG 4.42Å; L1025-L1069 HydrophobicContact CD2-CD2 3.97Å; L1025-P1072 HydrophobicContact CD1-CB 4.46Å; L1025-P1072 HydrophobicContact CD1-CG 3.3Å; L1025-P1072 HydrophobicContact CG-CG 4.49Å
1026	S	89	Confident	66.8	Low	20 Å²	20	76.1 Å²	76.1	14%	0.14	42%	0.423	C	S	.	.			trans	-64.8	163.6	170.5	68.9	0	0	0	0	111.1	S987 C988 E1024 L1028 G1029 K1030	S987-S1026 PolarHBondContact O-OG 3.21Å; C988-S1026 VanDerWaalsContact C-OG 3.3Å; C988-S1026 PolarHBondContact O-N 2.91Å; C988-S1026 PolarHBondContact O-OG 3.49Å; E1024-S1026 PolarHBondContact O-N 3.27Å; S1026-L1028 VanDerWaalsContact C-N 3.29Å; S1026-L1028 PolarHBondContact O-N 3.45Å; S1026-G1029 WeakPolarHBondContact O-CA 3.47Å; S1026-G1029 PolarHBondContact O-N 3.49Å; S1026-G1029 VanDerWaalsContact O-N 3.1Å; S1026-G1029 PolarHBondContact OG-N 3.41Å; S1026-K1030 WeakPolarHBondContact O-CG 3.2Å; S1026-K1030 PolarHBondContact O-N 2.81Å
1027	E	87.1	Confident	69.2	Low	118 Å²	118	76.4 Å²	76.4	55%	0.551	42%	0.42	S	S	*	.	H	α-helix	trans	-60	-39.4	175	-68.1	-54.8	126.6	0	0	112.1	K1030 C1031	E1027-K1030 PolarHBondContact O-N 3.33Å; E1027-K1030 IonicContact OE1-NZ 2.79Å; E1027-K1030 PolarHBondContact OE1-NZ 2.97Å; E1027-C1031 PolarHBondContact O-N 3.03Å
1028	L	88.3	Confident	71.9	Confident	8 Å²	8	70.7 Å²	70.7	4%	0.042	38%	0.379	C	S	.	.	H	α-helix	trans	-63.8	-43.3	171.5	178.5	61.4	0	0	0	111.4	V907 H915 L919 L923 S987 S1026 K1030 C1031 L1032	V907-L1028 HydrophobicContact CG1-CD2 3.66Å; H915-L1028 HydrophobicContact CB-CD1 3.88Å; L919-L1028 HydrophobicContact CB-CD1 4.11Å; L919-L1028 HydrophobicContact CD1-CD1 3.84Å; L919-L1028 HydrophobicContact CD1-CD2 3.63Å; L919-L1028 HydrophobicContact CD1-CG 4.38Å; L923-L1028 HydrophobicContact CD1-CD2 4.25Å; S987-L1028 WeakPolarHBondContact O-CB 3.29Å; S1026-L1028 VanDerWaalsContact C-N 3.29Å; S1026-L1028 PolarHBondContact O-N 3.45Å; L1028-K1030 VanDerWaalsContact C-N 3.32Å; L1028-K1030 PolarHBondContact O-N 2.95Å; L1028-C1031 CarbonylContact O-C 3.31Å; L1028-C1031 WeakPolarHBondContact O-CA 3.38Å; L1028-C1031 VanDerWaalsContact O-CB 3.31Å; L1028-C1031 WeakPolarHBondContact O-CB 3.34Å; L1028-C1031 PolarHBondContact O-N 3.36Å; L1028-L1032 HydrophobicContact CD1-CD1 4.27Å; L1028-L1032 HydrophobicContact CD1-CD2 4.36Å; L1028-L1032 HydrophobicContact CD1-CG 4.04Å; L1028-L1032 HydrophobicContact CG-CD1 4.05Å; L1028-L1032 HydrophobicContact CG-CG 4.25Å; L1028-L1032 WeakPolarHBondContact O-CG 3.44Å; L1028-L1032 PolarHBondContact O-N 2.94Å
1029	G	89.2	Confident	74.8	Confident	0 Å²	0	68.2 Å²	68.2	0%	0	36%	0.356	C	S	.	.	H	α-helix	trans	-56.3	-46.3	174.4	0	0	0	0	0	111.8	S987 S1026 C1031 L1032 M1033	S987-G1029 PolarHBondContact O-N 2.82Å; S1026-G1029 WeakPolarHBondContact O-CA 3.47Å; S1026-G1029 PolarHBondContact O-N 3.49Å; S1026-G1029 VanDerWaalsContact O-N 3.1Å; S1026-G1029 PolarHBondContact OG-N 3.41Å; G1029-C1031 VanDerWaalsContact C-N 3.3Å; G1029-C1031 PolarHBondContact O-N 3.07Å; G1029-L1032 PolarHBondContact O-N 2.91Å; G1029-M1033 WeakPolarHBondContact O-CB 3.42Å; G1029-M1033 WeakPolarHBondContact O-CG 3.21Å; G1029-M1033 PolarHBondContact O-N 3.34Å
1030	K	88.7	Confident	77.5	Confident	86 Å²	86	65.6 Å²	65.6	37%	0.374	33%	0.333	S	S	.	.	H	α-helix	trans	-61.5	-37.4	174	-65.8	170.8	-168.3	168.2	0	112	L1025 S1026 E1027 L1028 K1034	L1025-K1030 HydrophobicContact CB-CG 4.1Å; L1025-K1030 WeakPolarHBondContact O-CE 3.45Å; S1026-K1030 WeakPolarHBondContact O-CG 3.2Å; S1026-K1030 PolarHBondContact O-N 2.81Å; E1027-K1030 PolarHBondContact O-N 3.33Å; E1027-K1030 IonicContact OE1-NZ 2.79Å; E1027-K1030 PolarHBondContact OE1-NZ 2.97Å; L1028-K1030 VanDerWaalsContact C-N 3.32Å; L1028-K1030 PolarHBondContact O-N 2.95Å; K1030-K1034 WeakPolarHBondContact O-CG 3.46Å
1031	C	87.9	Confident	80	Confident	19 Å²	19	58.2 Å²	58.2	13%	0.128	30%	0.301	C	S	.	.	H	α-helix	trans	-64.9	-51.1	175.6	179.6	0	0	0	0	111.7	E1027 L1028 G1029 M1033 K1034	E1027-C1031 PolarHBondContact O-N 3.03Å; L1028-C1031 CarbonylContact O-C 3.31Å; L1028-C1031 WeakPolarHBondContact O-CA 3.38Å; L1028-C1031 VanDerWaalsContact O-CB 3.31Å; L1028-C1031 WeakPolarHBondContact O-CB 3.34Å; L1028-C1031 PolarHBondContact O-N 3.36Å; G1029-C1031 VanDerWaalsContact C-N 3.3Å; G1029-C1031 PolarHBondContact O-N 3.07Å; C1031-M1033 VanDerWaalsContact C-N 3.32Å; C1031-M1033 PolarHBondContact O-N 3.1Å; C1031-K1034 WeakPolarHBondContact O-CB 3.32Å; C1031-K1034 PolarHBondContact O-N 3.25Å
1032	L	88.4	Confident	82.6	Confident	0 Å²	0	54.1 Å²	54.1	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-63.7	-37.1	-179.7	-64.2	175.5	0	0	0	112	R920 L923 L1028 G1029 K1034 H1035 V1038 L1042	R920-L1032 HydrophobicContact CB-CD2 4.38Å; L923-L1032 HydrophobicContact CD1-CD1 4.22Å; L1028-L1032 HydrophobicContact CD1-CD1 4.27Å; L1028-L1032 HydrophobicContact CD1-CD2 4.36Å; L1028-L1032 HydrophobicContact CD1-CG 4.04Å; L1028-L1032 HydrophobicContact CG-CD1 4.05Å; L1028-L1032 HydrophobicContact CG-CG 4.25Å; L1028-L1032 WeakPolarHBondContact O-CG 3.44Å; L1028-L1032 PolarHBondContact O-N 2.94Å; G1029-L1032 PolarHBondContact O-N 2.91Å; L1032-K1034 PolarHBondContact O-N 3.34Å; L1032-H1035 PolarHBondContact O-N 3.5Å; L1032-V1038 HydrophobicContact CB-CG1 4.17Å; L1032-V1038 HydrophobicContact CD2-CG1 4.2Å; L1032-L1042 HydrophobicContact CB-CD1 4.13Å; L1032-L1042 HydrophobicContact CD1-CD1 4.44Å
1033	M	86.1	Confident	84.5	Confident	19 Å²	19	49 Å²	49	9%	0.094	24%	0.243	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.6	-11.9	179.5	-68.1	-63.9	-63.5	0	0	114.2	L1025 G1029 C1031 L1042 L1069 V1073	L1025-M1033 HydrophobicContact CD1-CG 4.42Å; G1029-M1033 WeakPolarHBondContact O-CB 3.42Å; G1029-M1033 WeakPolarHBondContact O-CG 3.21Å; G1029-M1033 PolarHBondContact O-N 3.34Å; C1031-M1033 VanDerWaalsContact C-N 3.32Å; C1031-M1033 PolarHBondContact O-N 3.1Å; M1033-L1042 HydrophobicContact SD-CD1 4.46Å; M1033-L1069 WeakPolarHBondContact CE-O 3.48Å; M1033-L1069 HydrophobicContact SD-CD2 4.01Å; M1033-V1073 HydrophobicContact CE-CG1 3.82Å
1034	K	85.1	Confident	85.6	Confident	170 Å²	170	49 Å²	49	74%	0.739	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	-75.1	-24.8	174.8	-75.2	170	-177.4	178	0	113.3	K1030 C1031 L1032	K1030-K1034 WeakPolarHBondContact O-CG 3.46Å; C1031-K1034 WeakPolarHBondContact O-CB 3.32Å; C1031-K1034 PolarHBondContact O-N 3.25Å; L1032-K1034 PolarHBondContact O-N 3.34Å
1035	H	81.1	Confident	86.3	Confident	56 Å²	56	44.2 Å²	44.2	26%	0.259	22%	0.222	S	C	.	.	S	Bend	trans	-100.7	124	-171.2	-69.7	-81.6	0	0	0	111.3	D916 R920 L1032 S1037 V1038 Y1039	D916-H1035 IonicContact OD1-CD2 3.58Å; D916-H1035 IonicContact OD1-CE1 2.8Å; D916-H1035 IonicContact OD1-NE2 3.69Å; D916-H1035 PolarHBondContact OD1-NE2 2.92Å; R920-H1035 WeakPolarHBondContact CD-CD2 3.32Å; R920-H1035 WeakPolarHBondContact CD-NE2 3.37Å; L1032-H1035 PolarHBondContact O-N 3.5Å; H1035-S1037 PolarHBondContact O-N 3.46Å; H1035-V1038 HydrophobicContact CB-CB 4.49Å; H1035-V1038 HydrophobicContact CB-CG2 4.31Å; H1035-V1038 PolarHBondContact O-N 2.83Å; H1035-V1038 VanDerWaalsContact O-N 3.12Å; H1035-Y1039 WeakPolarHBondContact O-CD1 3.48Å; H1035-Y1039 PolarHBondContact O-N 3.41Å; H1035-Y1039 VanDerWaalsContact O-N 3.13Å
1036	E	74.8	Confident	86.7	Confident	150 Å²	150	43 Å²	43	70%	0.701	22%	0.215	S	C	*	.	H	α-helix	trans	-61.2	-39.5	-170.5	-168.8	173	-176.3	0	0	114.4	V1038 Y1039	E1036-V1038 VanDerWaalsContact C-N 3.25Å; E1036-V1038 PolarHBondContact O-N 3.33Å; E1036-Y1039 VanDerWaalsContact CA-CE1 3.44Å; E1036-Y1039 HydrophobicContact CB-CE1 4.01Å; E1036-Y1039 HydrophobicContact CG-CE1 3.84Å
1037	S	73.4	Confident	86.9	Confident	91 Å²	91	42.1 Å²	42.1	64%	0.636	21%	0.209	S	C	*	.	H	α-helix	trans	-68.4	-21.2	179.2	56.5	0	0	0	0	114.1	H1035 S1041	H1035-S1037 PolarHBondContact O-N 3.46Å; S1037-S1041 PolarHBondContact O-OG 3.43Å
1038	V	83.4	Confident	87.2	Confident	7 Å²	7	37 Å²	37	4%	0.042	19%	0.186	C	C	.	.	H	α-helix	trans	-99.4	-45.3	-174.4	-178.5	0	0	0	0	111.2	L1032 H1035 E1036 M1040 S1041 L1042	L1032-V1038 HydrophobicContact CB-CG1 4.17Å; L1032-V1038 HydrophobicContact CD2-CG1 4.2Å; H1035-V1038 HydrophobicContact CB-CB 4.49Å; H1035-V1038 HydrophobicContact CB-CG2 4.31Å; H1035-V1038 PolarHBondContact O-N 2.83Å; H1035-V1038 VanDerWaalsContact O-N 3.12Å; E1036-V1038 VanDerWaalsContact C-N 3.25Å; E1036-V1038 PolarHBondContact O-N 3.33Å; V1038-M1040 VanDerWaalsContact C-N 3.28Å; V1038-M1040 PolarHBondContact O-N 3.36Å; V1038-S1041 PolarHBondContact O-N 3.05Å; V1038-L1042 HydrophobicContact CG1-CD1 4.05Å; V1038-L1042 HydrophobicContact CG1-CG 4.29Å; V1038-L1042 WeakPolarHBondContact O-CG 3.21Å; V1038-L1042 PolarHBondContact O-N 3.47Å
1039	Y	84.8	Confident	87.5	Confident	44 Å²	44	36.7 Å²	36.7	17%	0.173	18%	0.184	C	C	.	.	H	α-helix	trans	-64.3	-34.9	-175.1	85.8	-109.6	0	0	0	112	H1035 E1036 L1042 L1043 V1073	H1035-Y1039 WeakPolarHBondContact O-CD1 3.48Å; H1035-Y1039 PolarHBondContact O-N 3.41Å; H1035-Y1039 VanDerWaalsContact O-N 3.13Å; E1036-Y1039 VanDerWaalsContact CA-CE1 3.44Å; E1036-Y1039 HydrophobicContact CB-CE1 4.01Å; E1036-Y1039 HydrophobicContact CG-CE1 3.84Å; Y1039-L1042 PolarHBondContact O-N 3.31Å; Y1039-L1043 HydrophobicContact CD2-CD1 3.86Å; Y1039-L1043 HydrophobicContact CE2-CD1 4.27Å; Y1039-L1043 WeakPolarHBondContact O-CB 3.29Å; Y1039-L1043 WeakPolarHBondContact O-CG 3.33Å; Y1039-L1043 PolarHBondContact O-N 3.43Å; Y1039-V1073 HydrophobicContact CD2-CG1 4.43Å
1040	M	85.5	Confident	87.7	Confident	67 Å²	67	36.7 Å²	36.7	33%	0.33	18%	0.184	S	C	.	.	H	α-helix	trans	-66.6	-40.8	176.9	-72.6	-63.6	-87.8	0	0	111.8	V1038 L1043 T1044	V1038-M1040 VanDerWaalsContact C-N 3.28Å; V1038-M1040 PolarHBondContact O-N 3.36Å; M1040-L1043 PolarHBondContact O-N 3.46Å; M1040-T1044 VanDerWaalsContact O-CB 3.3Å; M1040-T1044 WeakPolarHBondContact O-CB 3.28Å; M1040-T1044 PolarHBondContact O-N 3Å; M1040-T1044 PolarHBondContact O-OG1 3.44Å
1041	S	87.5	Confident	87.7	Confident	15 Å²	15	34.3 Å²	34.3	11%	0.105	18%	0.178	C	C	.	.	H	α-helix	trans	-63.4	-42.3	174.7	-61	0	0	0	0	111.5	T928 S1037 V1038 T1044 L1045	T928-S1041 WeakPolarHBondContact OG1-CB 3.48Å; T928-S1041 PolarHBondContact OG1-OG 3.41Å; S1037-S1041 PolarHBondContact O-OG 3.43Å; V1038-S1041 PolarHBondContact O-N 3.05Å; S1041-T1044 PolarHBondContact O-N 2.73Å; S1041-L1045 VanDerWaalsContact O-CB 3.23Å; S1041-L1045 WeakPolarHBondContact O-CB 3.23Å; S1041-L1045 PolarHBondContact O-N 3.26Å
1042	L	90.9	Very high	87.8	Confident	0 Å²	0	33.5 Å²	33.5	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-63.2	-45.5	177.3	-68.7	176.1	0	0	0	112.4	F927 L984 L1032 M1033 V1038 Y1039 S1046 L1069	F927-L1042 HydrophobicContact CB-CD2 4.29Å; F927-L1042 HydrophobicContact CD2-CD2 3.44Å; F927-L1042 VanDerWaalsContact CD2-CD2 3.44Å; F927-L1042 HydrophobicContact CE2-CD2 3.79Å; F927-L1042 HydrophobicContact CG-CD2 3.86Å; F927-L1042 HydrophobicContact CZ-CD2 4.48Å; L984-L1042 HydrophobicContact CD1-CD2 3.91Å; L984-L1042 HydrophobicContact CG-CD2 4.29Å; L1032-L1042 HydrophobicContact CB-CD1 4.13Å; L1032-L1042 HydrophobicContact CD1-CD1 4.44Å; M1033-L1042 HydrophobicContact SD-CD1 4.46Å; V1038-L1042 HydrophobicContact CG1-CD1 4.05Å; V1038-L1042 HydrophobicContact CG1-CG 4.29Å; V1038-L1042 WeakPolarHBondContact O-CG 3.21Å; V1038-L1042 PolarHBondContact O-N 3.47Å; Y1039-L1042 PolarHBondContact O-N 3.31Å; L1042-S1046 WeakPolarHBondContact O-CB 3.33Å; L1042-S1046 PolarHBondContact O-N 2.9Å; L1042-S1046 PolarHBondContact O-OG 3.1Å; L1042-L1069 HydrophobicContact CB-CD1 4.39Å
1043	L	91.1	Very high	87.6	Confident	0 Å²	0	37.1 Å²	37.1	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-63.8	-45.7	175.6	-74.5	173.1	0	0	0	111	Y1039 M1040 S1046 F1047 L1069 L1070 V1073 F1086	Y1039-L1043 HydrophobicContact CD2-CD1 3.86Å; Y1039-L1043 HydrophobicContact CE2-CD1 4.27Å; Y1039-L1043 WeakPolarHBondContact O-CB 3.29Å; Y1039-L1043 WeakPolarHBondContact O-CG 3.33Å; Y1039-L1043 PolarHBondContact O-N 3.43Å; M1040-L1043 PolarHBondContact O-N 3.46Å; L1043-S1046 PolarHBondContact O-N 3.1Å; L1043-F1047 HydrophobicContact CD2-CE2 4.2Å; L1043-F1047 WeakPolarHBondContact O-CD2 3.31Å; L1043-F1047 PolarHBondContact O-N 3.09Å; L1043-L1069 HydrophobicContact CD2-CB 3.77Å; L1043-L1070 HydrophobicContact CD2-CB 4.29Å; L1043-L1070 HydrophobicContact CD2-CD1 4.45Å; L1043-V1073 HydrophobicContact CD1-CG2 4.17Å; L1043-F1086 HydrophobicContact CB-CE1 3.84Å; L1043-F1086 HydrophobicContact CB-CZ 3.97Å; L1043-F1086 HydrophobicContact CD1-CZ 3.89Å; L1043-F1086 HydrophobicContact CG-CZ 4.44Å
1044	T	91.1	Very high	87.7	Confident	34 Å²	34	36.6 Å²	36.6	21%	0.209	19%	0.186	C	C	.	.	H	α-helix	trans	-63.9	-45.3	-179	-52.4	0	0	0	0	111.2	M1040 S1041 T1048 W1085	M1040-T1044 VanDerWaalsContact O-CB 3.3Å; M1040-T1044 WeakPolarHBondContact O-CB 3.28Å; M1040-T1044 PolarHBondContact O-N 3Å; M1040-T1044 PolarHBondContact O-OG1 3.44Å; S1041-T1044 PolarHBondContact O-N 2.73Å; T1044-T1048 WeakPolarHBondContact O-CB 3.12Å; T1044-T1048 PolarHBondContact O-N 2.85Å; T1044-T1048 PolarHBondContact O-OG1 2.73Å; T1044-W1085 HydrophobicContact CG2-CH2 3.73Å; T1044-W1085 HydrophobicContact CG2-CZ2 4.12Å; T1044-W1085 HydrophobicContact CG2-CZ3 4.4Å
1045	L	93.2	Very high	87.8	Confident	0 Å²	0	30.6 Å²	30.6	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-57.6	-50.1	174.2	176.2	57	0	0	0	111.3	F927 Q931 V980 L981 L984 S1041 F1047 S1049 W1052	F927-L1045 HydrophobicContact CB-CD2 4.31Å; F927-L1045 HydrophobicContact CD1-CD2 3.85Å; F927-L1045 HydrophobicContact CG-CD2 4.43Å; Q931-L1045 HydrophobicContact CB-CB 4.25Å; Q931-L1045 HydrophobicContact CB-CD1 4.11Å; Q931-L1045 HydrophobicContact CG-CB 4.2Å; Q931-L1045 HydrophobicContact CG-CD1 4.38Å; V980-L1045 HydrophobicContact CG1-CD2 3.98Å; L981-L1045 HydrophobicContact CD2-CG 4.34Å; L984-L1045 HydrophobicContact CD1-CD2 3.83Å; L984-L1045 HydrophobicContact CD1-CG 4.23Å; S1041-L1045 VanDerWaalsContact O-CB 3.23Å; S1041-L1045 WeakPolarHBondContact O-CB 3.23Å; S1041-L1045 PolarHBondContact O-N 3.26Å; L1045-F1047 PolarHBondContact O-N 3.22Å; L1045-S1049 VanDerWaalsContact O-CB 3.32Å; L1045-S1049 WeakPolarHBondContact O-CB 3.2Å; L1045-S1049 PolarHBondContact O-N 2.9Å; L1045-W1052 HydrophobicContact CD1-CH2 3.69Å; L1045-W1052 HydrophobicContact CD1-CZ3 4.37Å
1046	S	93.6	Very high	88.1	Confident	0 Å²	0	31.1 Å²	31.1	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-61.3	-48.7	-177.1	-57.2	0	0	0	0	112	L1042 L1043 S1049 L1069	L1042-S1046 WeakPolarHBondContact O-CB 3.33Å; L1042-S1046 PolarHBondContact O-N 2.9Å; L1042-S1046 PolarHBondContact O-OG 3.1Å; L1043-S1046 PolarHBondContact O-N 3.1Å; S1046-S1049 PolarHBondContact O-N 3.35Å; S1046-S1049 PolarHBondContact O-OG 3.46Å; S1046-L1069 VanDerWaalsContact OG-CD1 3.28Å; S1046-L1069 WeakPolarHBondContact OG-CD1 3.29Å
1047	F	94.6	Very high	88.8	Confident	0 Å²	0	24.3 Å²	24.3	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-75.3	-34.2	-177.9	-82.6	-95.7	0	0	0	113.3	L1043 L1045 S1049 L1050 C1066 L1070 W1085 F1086 V1090 I1114	L1043-F1047 HydrophobicContact CD2-CE2 4.2Å; L1043-F1047 WeakPolarHBondContact O-CD2 3.31Å; L1043-F1047 PolarHBondContact O-N 3.09Å; L1045-F1047 PolarHBondContact O-N 3.22Å; F1047-S1049 VanDerWaalsContact C-N 3.27Å; F1047-S1049 PolarHBondContact O-N 3.32Å; F1047-L1050 HydrophobicContact CD1-CD1 4.26Å; F1047-L1050 WeakPolarHBondContact O-CB 3.05Å; F1047-L1050 PolarHBondContact O-N 3.28Å; F1047-C1066 HydrophobicContact CD2-CB 4.48Å; F1047-C1066 HydrophobicContact CE1-CB 4.37Å; F1047-C1066 HydrophobicContact CE2-CB 3.91Å; F1047-C1066 HydrophobicContact CZ-CB 3.84Å; F1047-L1070 HydrophobicContact CZ-CD2 4.11Å; F1047-W1085 HydrophobicContact CB-CH2 3.81Å; F1047-W1085 HydrophobicContact CB-CZ3 3.62Å; F1047-W1085 HydrophobicContact CG-CZ3 4.43Å; F1047-F1086 HydrophobicContact CB-CD1 4.21Å; F1047-F1086 HydrophobicContact CD1-CB 4.02Å; F1047-F1086 HydrophobicContact CD1-CD1 4.02Å; F1047-F1086 HydrophobicContact CD1-CG 4.45Å; F1047-F1086 WeakPolarHBondContact CD1-O 3.35Å; F1047-F1086 AromaticContact CD2-CD1 3.67Å; F1047-F1086 HydrophobicContact CD2-CD1 3.67Å; F1047-F1086 HydrophobicContact CD2-CE1 4.11Å; F1047-F1086 HydrophobicContact CE1-CB 3.84Å; F1047-F1086 HydrophobicContact CE1-CD1 4.31Å; F1047-F1086 HydrophobicContact CE1-CG 4.39Å; F1047-F1086 AromaticContact CE2-CD1 3.98Å; F1047-F1086 HydrophobicContact CE2-CD1 3.98Å; F1047-F1086 HydrophobicContact CE2-CE1 4.5Å; F1047-F1086 HydrophobicContact CE2-CG 4.48Å; F1047-F1086 AromaticContact CG-CD1 3.69Å; F1047-F1086 HydrophobicContact CG-CD1 3.69Å; F1047-F1086 HydrophobicContact CG-CE1 4.44Å; F1047-F1086 HydrophobicContact CZ-CB 4.22Å; F1047-F1086 HydrophobicContact CZ-CD1 4.29Å; F1047-F1086 HydrophobicContact CZ-CG 4.41Å; F1047-V1090 HydrophobicContact CD1-CG2 3.96Å; F1047-V1090 HydrophobicContact CE1-CG2 3.7Å; F1047-I1114 HydrophobicContact CE1-CD1 3.67Å; F1047-I1114 HydrophobicContact CZ-CD1 3.95Å
1048	T	92.9	Very high	89.7	Confident	12 Å²	12	20 Å²	20	7%	0.074	11%	0.109	C	C	.	.	H	α-helix	trans	-63.6	-39.3	173	-55.4	0	0	0	0	110.2	T1044 L1050 S1051 W1052	T1044-T1048 WeakPolarHBondContact O-CB 3.12Å; T1044-T1048 PolarHBondContact O-N 2.85Å; T1044-T1048 PolarHBondContact O-OG1 2.73Å; T1048-L1050 PolarHBondContact O-N 3.23Å; T1048-L1050 VanDerWaalsContact O-N 3.14Å; T1048-S1051 PolarHBondContact O-N 3.31Å; T1048-S1051 PolarHBondContact O-OG 2.82Å; T1048-W1052 HydrophobicContact CG2-CZ2 4.14Å
1049	S	93.7	Very high	90	Very high	0 Å²	0	23.1 Å²	23.1	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-64.5	-21.1	-176.6	79.4	0	0	0	0	114.6	L1045 S1046 F1047 S1051 W1052 N1057	L1045-S1049 VanDerWaalsContact O-CB 3.32Å; L1045-S1049 WeakPolarHBondContact O-CB 3.2Å; L1045-S1049 PolarHBondContact O-N 2.9Å; S1046-S1049 PolarHBondContact O-N 3.35Å; S1046-S1049 PolarHBondContact O-OG 3.46Å; F1047-S1049 VanDerWaalsContact C-N 3.27Å; F1047-S1049 PolarHBondContact O-N 3.32Å; S1049-S1051 PolarHBondContact O-N 3.3Å; S1049-W1052 VanDerWaalsContact CA-CE3 3.41Å; S1049-W1052 PolarHBondContact O-N 2.86Å; S1049-N1057 PolarHBondContact O-ND2 3.49Å
1050	L	93.4	Very high	90.2	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	14%	0.136	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-23.3	173.8	-60.2	179.3	0	0	0	113.2	F1047 T1048 T1061 A1062 V1090 A1093 H1097 L1107 L1110	F1047-L1050 HydrophobicContact CD1-CD1 4.26Å; F1047-L1050 WeakPolarHBondContact O-CB 3.05Å; F1047-L1050 PolarHBondContact O-N 3.28Å; T1048-L1050 PolarHBondContact O-N 3.23Å; T1048-L1050 VanDerWaalsContact O-N 3.14Å; L1050-T1061 HydrophobicContact CD2-CG2 4.14Å; L1050-A1062 HydrophobicContact CD2-CB 3.89Å; L1050-V1090 HydrophobicContact CD1-CG2 3.87Å; L1050-A1093 HydrophobicContact CB-CB 3.6Å; L1050-A1093 WeakPolarHBondContact O-CB 3.44Å; L1050-H1097 PolarHBondContact O-CD2 2.93Å; L1050-H1097 VanDerWaalsContact O-CD2 3.3Å; L1050-H1097 PolarHBondContact O-NE2 2.96Å; L1050-L1107 HydrophobicContact CD1-CD2 4.35Å; L1050-L1107 HydrophobicContact CD2-CD2 4.34Å; L1050-L1110 HydrophobicContact CD1-CD2 3.99Å
1051	S	88.1	Confident	90.5	Very high	36 Å²	36	23.6 Å²	23.6	25%	0.252	12%	0.121	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.4	-8.6	-178.3	69.8	0	0	0	0	114.2	T1048 S1049	T1048-S1051 PolarHBondContact O-N 3.31Å; T1048-S1051 PolarHBondContact O-OG 2.82Å; S1049-S1051 PolarHBondContact O-N 3.3Å
1052	W	90.8	Very high	90.7	Very high	2 Å²	2	23.2 Å²	23.2	1%	0.008	12%	0.119	C	C	.	.	S	Bend	trans	-73.5	139.7	176.8	-63.2	-21.4	0	0	0	110.1	L934 W938 T977 L981 L1045 T1048 S1049 D1054 H1097	L934-W1052 HydrophobicContact CB-CH2 3.63Å; L934-W1052 HydrophobicContact CB-CZ2 3.79Å; L934-W1052 HydrophobicContact CB-CZ3 4.37Å; L934-W1052 HydrophobicContact CD1-CH2 3.75Å; L934-W1052 HydrophobicContact CD1-CZ3 3.96Å; L934-W1052 HydrophobicContact CG-CH2 4.35Å; W938-W1052 HydrophobicContact CB-CG 4.15Å; W938-W1052 AromaticContact CD1-CD1 3.59Å; W938-W1052 AromaticContact CD1-CD2 3.29Å; W938-W1052 AromaticContact CD1-CE2 3.44Å; W938-W1052 VanDerWaalsContact CD1-CE2 3.44Å; W938-W1052 AromaticContact CD1-CE3 3.88Å; W938-W1052 AromaticContact CD1-CG 3.41Å; W938-W1052 VanDerWaalsContact CD1-CG 3.41Å; W938-W1052 AromaticContact CD1-NE1 3.59Å; W938-W1052 HydrophobicContact CD2-CB 3.73Å; W938-W1052 HydrophobicContact CD2-CD2 4.43Å; W938-W1052 AromaticContact CD2-CG 3.81Å; W938-W1052 HydrophobicContact CD2-CG 3.81Å; W938-W1052 AromaticContact CE2-CG 3.84Å; W938-W1052 HydrophobicContact CE3-CB 4.21Å; W938-W1052 HydrophobicContact CG-CB 4.03Å; W938-W1052 AromaticContact CG-CD1 3.44Å; W938-W1052 VanDerWaalsContact CG-CD1 3.44Å; W938-W1052 AromaticContact CG-CD2 3.93Å; W938-W1052 HydrophobicContact CG-CD2 3.93Å; W938-W1052 AromaticContact CG-CG 3.54Å; W938-W1052 HydrophobicContact CG-CG 3.54Å; W938-W1052 AromaticContact CG-NE1 3.75Å; W938-W1052 HydrophobicContact CH2-CB 4.43Å; W938-W1052 HydrophobicContact CZ2-CB 4.01Å; W938-W1052 AromaticContact NE1-CD2 3.44Å; W938-W1052 AromaticContact NE1-CE3 3.62Å; W938-W1052 AromaticContact NE1-CG 3.6Å; T977-W1052 HydrophobicContact CG2-CE3 3.39Å; T977-W1052 HydrophobicContact CG2-CZ3 3.57Å; L981-W1052 HydrophobicContact CD1-CZ3 4.23Å; L1045-W1052 HydrophobicContact CD1-CH2 3.69Å; L1045-W1052 HydrophobicContact CD1-CZ3 4.37Å; T1048-W1052 HydrophobicContact CG2-CZ2 4.14Å; S1049-W1052 VanDerWaalsContact CA-CE3 3.41Å; S1049-W1052 PolarHBondContact O-N 2.86Å; W1052-D1054 PolarHBondContact O-N 2.94Å; W1052-H1097 PolarHBondContact O-CE1 3.03Å; W1052-H1097 PolarHBondContact O-NE2 2.93Å
1053	K	85.3	Confident	90.5	Very high	76 Å²	76	26 Å²	26	33%	0.33	14%	0.138	S	C	.	.	S	Bend	trans	-71.1	56.1	-175.9	-67.1	-176	-177.3	178.2	0	113.2	W938 N942 T945 V1096	W938-K1053 HydrophobicContact CZ3-CB 3.95Å; N942-K1053 WeakPolarHBondContact OD1-CD 3.48Å; N942-K1053 WeakPolarHBondContact OD1-CE 3.43Å; T945-K1053 VanDerWaalsContact CG2-NZ 3.29Å; T945-K1053 PolarHBondContact OG1-NZ 3.31Å; K1053-V1096 HydrophobicContact CG-CG1 4.41Å
1054	D	87.6	Confident	90.3	Very high	8 Å²	8	27.6 Å²	27.6	4%	0.043	15%	0.146	C	C	.	.			trans	-132.6	99.4	169.9	-178.3	-4.5	0	0	0	109.7	W938 R978 W1052 T1056 N1057 C1058	W938-D1054 HydrophobicContact CH2-CB 4.37Å; W938-D1054 HydrophobicContact CZ2-CB 4.5Å; R978-D1054 IonicContact CZ-OD1 3.68Å; R978-D1054 IonicContact CZ-OD2 2.77Å; R978-D1054 IonicContact NE-OD1 2.74Å; R978-D1054 IonicContact NE-OD2 3.13Å; R978-D1054 PolarHBondContact NE-OD2 2.74Å; R978-D1054 IonicContact NH2-OD1 3.37Å; R978-D1054 PolarHBondContact NH2-OD1 2.8Å; R978-D1054 IonicContact NH2-OD2 3.75Å; R978-D1054 PolarHBondContact NH2-OD2 3.19Å; W1052-D1054 PolarHBondContact O-N 2.94Å; D1054-T1056 VanDerWaalsContact C-N 3.27Å; D1054-T1056 PolarHBondContact O-N 2.95Å; D1054-T1056 PolarHBondContact OD1-N 3.23Å; D1054-T1056 VanDerWaalsContact OD1-N 3.12Å; D1054-N1057 HydrophobicContact CB-CB 3.86Å; D1054-N1057 WeakPolarHBondContact O-CB 3.39Å; D1054-N1057 PolarHBondContact O-N 3.03Å; D1054-N1057 PolarHBondContact OD1-N 3.22Å; D1054-C1058 PolarHBondContact O-N 2.94Å
1055	T	87.4	Confident	90.2	Very high	45 Å²	45	26.1 Å²	26.1	28%	0.276	14%	0.137	S	C	.	.	H	α-helix	trans	-59.3	-36.2	-177.4	-55.9	0	0	0	0	112.4	C1058 H1059 H1100 C1103	T1055-C1058 PolarHBondContact O-N 2.89Å; T1055-H1059 WeakPolarHBondContact O-CB 3.4Å; T1055-H1059 PolarHBondContact O-N 2.94Å; T1055-H1100 HydrophobicContact CG2-CB 3.96Å; T1055-C1103 WeakPolarHBondContact CG2-SG 3.38Å; T1055-C1103 PolarHBondContact O-SG 3.46Å
1056	T	87.3	Confident	90.2	Very high	67 Å²	67	26.1 Å²	26.1	41%	0.411	14%	0.137	S	C	.	.	H	α-helix	trans	-67.6	-42.7	179.8	-55.6	0	0	0	0	110.5	D1054 R1060	D1054-T1056 VanDerWaalsContact C-N 3.27Å; D1054-T1056 PolarHBondContact O-N 2.95Å; D1054-T1056 PolarHBondContact OD1-N 3.23Å; D1054-T1056 VanDerWaalsContact OD1-N 3.12Å; T1056-R1060 WeakPolarHBondContact O-CG 3.35Å; T1056-R1060 PolarHBondContact O-N 2.78Å; T1056-R1060 VanDerWaalsContact O-N 3.12Å
1057	N	89.3	Confident	90.1	Very high	7 Å²	7	28 Å²	28	4%	0.037	14%	0.144	C	C	.	.	H	α-helix	trans	-63.5	-48.8	176	179.1	36.8	0	0	0	111.8	L981 S1049 D1054 H1059 R1060 T1061	L981-N1057 WeakPolarHBondContact CD1-ND2 3.47Å; L981-N1057 WeakPolarHBondContact CD1-OD1 3.42Å; S1049-N1057 PolarHBondContact O-ND2 3.49Å; D1054-N1057 HydrophobicContact CB-CB 3.86Å; D1054-N1057 WeakPolarHBondContact O-CB 3.39Å; D1054-N1057 PolarHBondContact O-N 3.03Å; D1054-N1057 PolarHBondContact OD1-N 3.22Å; N1057-H1059 VanDerWaalsContact C-N 3.3Å; N1057-H1059 PolarHBondContact O-N 3.29Å; N1057-R1060 PolarHBondContact O-N 2.93Å; N1057-T1061 WeakPolarHBondContact O-CB 3.46Å; N1057-T1061 PolarHBondContact O-N 3.31Å; N1057-T1061 PolarHBondContact O-OG1 2.95Å; N1057-T1061 VanDerWaalsContact O-OG1 3.13Å; N1057-T1061 PolarHBondContact OD1-OG1 3.23Å; N1057-T1061 VanDerWaalsContact OD1-OG1 3.05Å
1058	C	92.8	Very high	89.9	Confident	0 Å²	0	29 Å²	29	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-55.1	-46.8	178.5	-175.2	0	0	0	0	111.3	D1054 T1055 A1062 H1097	D1054-C1058 PolarHBondContact O-N 2.94Å; T1055-C1058 PolarHBondContact O-N 2.89Å; C1058-A1062 WeakPolarHBondContact O-CB 3.35Å; C1058-A1062 PolarHBondContact O-N 3.26Å; C1058-H1097 PolarHBondContact SG-CD2 3.42Å
1059	H	89.9	Confident	89.7	Confident	73 Å²	73	28.4 Å²	28.4	34%	0.338	15%	0.146	S	C	.	.	H	α-helix	trans	-57.5	-52.9	176.2	172.2	77.8	0	0	0	112.7	T1055 N1057 S1063 A1102	T1055-H1059 WeakPolarHBondContact O-CB 3.4Å; T1055-H1059 PolarHBondContact O-N 2.94Å; N1057-H1059 VanDerWaalsContact C-N 3.3Å; N1057-H1059 PolarHBondContact O-N 3.29Å; H1059-S1063 WeakPolarHBondContact O-CB 3.34Å; H1059-S1063 PolarHBondContact O-N 3.39Å; H1059-S1063 VanDerWaalsContact O-N 3.09Å; H1059-S1063 PolarHBondContact O-OG 2.82Å; H1059-A1102 PolarHBondContact ND1-O 3.23Å
1060	R	88.3	Confident	89.6	Confident	117 Å²	117	28.4 Å²	28.4	44%	0.442	15%	0.146	S	C	.	.	H	α-helix	trans	-63.1	-47.8	-177.9	-73.1	-178.4	178.9	-172.5	0.4	111.5	T1056 N1057 S1063 M1064	T1056-R1060 WeakPolarHBondContact O-CG 3.35Å; T1056-R1060 PolarHBondContact O-N 2.78Å; T1056-R1060 VanDerWaalsContact O-N 3.12Å; N1057-R1060 PolarHBondContact O-N 2.93Å; R1060-S1063 PolarHBondContact O-N 3.35Å; R1060-S1063 PolarHBondContact O-OG 3.15Å; R1060-M1064 WeakPolarHBondContact O-CB 3.46Å; R1060-M1064 PolarHBondContact O-N 3.33Å
1061	T	90.8	Very high	89.3	Confident	4 Å²	4	35.1 Å²	35.1	3%	0.025	17%	0.171	C	C	.	.	I	π-helix	trans	-68.7	-40.3	-176.8	-57.4	0	0	0	0	111.8	L1050 N1057 V1065 C1066	L1050-T1061 HydrophobicContact CD2-CG2 4.14Å; N1057-T1061 WeakPolarHBondContact O-CB 3.46Å; N1057-T1061 PolarHBondContact O-N 3.31Å; N1057-T1061 PolarHBondContact O-OG1 2.95Å; N1057-T1061 VanDerWaalsContact O-OG1 3.13Å; N1057-T1061 PolarHBondContact OD1-OG1 3.23Å; N1057-T1061 VanDerWaalsContact OD1-OG1 3.05Å; T1061-V1065 HydrophobicContact CG2-CB 3.92Å; T1061-V1065 HydrophobicContact CG2-CG1 4.29Å; T1061-V1065 HydrophobicContact CG2-CG2 4.34Å; T1061-V1065 WeakPolarHBondContact O-CA 3.5Å; T1061-V1065 WeakPolarHBondContact O-CB 3.42Å; T1061-V1065 PolarHBondContact O-N 3.11Å; T1061-C1066 PolarHBondContact O-N 3.08Å
1062	A	91.8	Very high	89.1	Confident	6 Å²	6	36.6 Å²	36.6	5%	0.05	18%	0.18	C	C	.	.	I	π-helix	trans	-66.1	-38.8	176.9	0	0	0	0	0	113	L1050 C1058 P1106 L1107 L1110	L1050-A1062 HydrophobicContact CD2-CB 3.89Å; C1058-A1062 WeakPolarHBondContact O-CB 3.35Å; C1058-A1062 PolarHBondContact O-N 3.26Å; A1062-P1106 HydrophobicContact CB-CB 4.12Å; A1062-L1107 HydrophobicContact CB-CD2 3.75Å; A1062-L1107 HydrophobicContact CB-CG 4.22Å; A1062-L1110 HydrophobicContact CB-CD2 4.26Å
1063	S	88.4	Confident	88.8	Confident	58 Å²	58	37.6 Å²	37.6	41%	0.406	19%	0.186	S	C	.	.	I	π-helix	trans	-80.5	-37.4	-176.9	55.8	0	0	0	0	113.5	H1059 R1060	H1059-S1063 WeakPolarHBondContact O-CB 3.34Å; H1059-S1063 PolarHBondContact O-N 3.39Å; H1059-S1063 VanDerWaalsContact O-N 3.09Å; H1059-S1063 PolarHBondContact O-OG 2.82Å; R1060-S1063 PolarHBondContact O-N 3.35Å; R1060-S1063 PolarHBondContact O-OG 3.15Å
1064	M	85.4	Confident	88.6	Confident	34 Å²	34	34.9 Å²	34.9	17%	0.167	18%	0.176	C	C	.	.	I	π-helix	trans	-109.7	-31.1	-169.6	-53	-169.3	73	0	0	113.9	I989 R991 D1023 R1060 N1068	I989-M1064 VanDerWaalsContact CD1-O 3.29Å; I989-M1064 WeakPolarHBondContact CD1-O 3.37Å; R991-M1064 PolarHBondContact NH2-SD 3.41Å; D1023-M1064 WeakPolarHBondContact OD2-CE 3.47Å; R1060-M1064 WeakPolarHBondContact O-CB 3.46Å; R1060-M1064 PolarHBondContact O-N 3.33Å; M1064-N1068 PolarHBondContact O-ND2 3.25Å
1065	V	89.8	Confident	88	Confident	4 Å²	4	38.5 Å²	38.5	2%	0.024	21%	0.207	C	C	.	.	I	π-helix	trans	-105.2	-59.7	-163.5	-178.5	0	0	0	0	113.2	L984 I989 T1061 W1067 N1068 L1069	L984-V1065 HydrophobicContact CD2-CG1 3.33Å; L984-V1065 HydrophobicContact CD2-CG2 4.38Å; I989-V1065 HydrophobicContact CD1-CB 4.07Å; I989-V1065 HydrophobicContact CD1-CG1 4.36Å; I989-V1065 HydrophobicContact CD1-CG2 3.64Å; T1061-V1065 HydrophobicContact CG2-CB 3.92Å; T1061-V1065 HydrophobicContact CG2-CG1 4.29Å; T1061-V1065 HydrophobicContact CG2-CG2 4.34Å; T1061-V1065 WeakPolarHBondContact O-CA 3.5Å; T1061-V1065 WeakPolarHBondContact O-CB 3.42Å; T1061-V1065 PolarHBondContact O-N 3.11Å; V1065-W1067 PolarHBondContact O-N 3.15Å; V1065-N1068 PolarHBondContact O-N 3.38Å; V1065-N1068 VanDerWaalsContact O-N 3.15Å; V1065-L1069 HydrophobicContact CG1-CD1 3.71Å; V1065-L1069 HydrophobicContact CG1-CG 4.24Å; V1065-L1069 PolarHBondContact O-N 2.92Å
1066	C	93.3	Very high	87.4	Confident	0 Å²	0	38 Å²	38	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-56.7	-46.4	-165.8	-72.6	0	0	0	0	113.5	F1047 T1061 L1070 L1110	F1047-C1066 HydrophobicContact CD2-CB 4.48Å; F1047-C1066 HydrophobicContact CE1-CB 4.37Å; F1047-C1066 HydrophobicContact CE2-CB 3.91Å; F1047-C1066 HydrophobicContact CZ-CB 3.84Å; T1061-C1066 PolarHBondContact O-N 3.08Å; C1066-L1070 WeakPolarHBondContact O-CB 3.44Å; C1066-L1070 PolarHBondContact O-N 3.02Å; C1066-L1110 HydrophobicContact CB-CD1 3.86Å; C1066-L1110 HydrophobicContact CB-CD2 3.59Å; C1066-L1110 HydrophobicContact CB-CG 4.39Å
1067	W	91.8	Very high	86.8	Confident	39 Å²	39	42 Å²	42	15%	0.148	23%	0.23	C	C	.	.	H	α-helix	trans	-70.2	-40.3	-179.5	-178.5	-115.9	0	0	0	112.4	V1065 L1069 L1070 R1071 V1074 L1110 L1113 I1114 N1117	V1065-W1067 PolarHBondContact O-N 3.15Å; W1067-L1069 VanDerWaalsContact C-N 3.3Å; W1067-L1069 PolarHBondContact O-N 2.82Å; W1067-L1070 HydrophobicContact CE3-CD2 4.44Å; W1067-L1070 HydrophobicContact CZ3-CD2 4.32Å; W1067-L1070 PolarHBondContact O-N 3.37Å; W1067-R1071 HydrophobicContact CZ2-CB 4.29Å; W1067-R1071 HydrophobicContact CZ2-CG 4.3Å; W1067-R1071 WeakPolarHBondContact O-CB 3.32Å; W1067-R1071 PolarHBondContact O-N 2.9Å; W1067-V1074 HydrophobicContact CH2-CG2 4.3Å; W1067-V1074 HydrophobicContact CZ3-CG2 4.42Å; W1067-L1110 HydrophobicContact CB-CD1 3.85Å; W1067-L1113 HydrophobicContact CB-CD1 4.36Å; W1067-L1113 HydrophobicContact CD2-CB 3.91Å; W1067-L1113 HydrophobicContact CD2-CD1 4.05Å; W1067-L1113 HydrophobicContact CD2-CG 4.49Å; W1067-L1113 HydrophobicContact CE3-CB 3.84Å; W1067-L1113 HydrophobicContact CG-CD1 3.83Å; W1067-L1113 HydrophobicContact CH2-CB 4.35Å; W1067-L1113 HydrophobicContact CZ2-CB 4.38Å; W1067-L1113 HydrophobicContact CZ3-CB 4.07Å; W1067-I1114 HydrophobicContact CE3-CG1 4.38Å; W1067-I1114 HydrophobicContact CZ3-CG1 4.43Å; W1067-N1117 HydrophobicContact CH2-CB 3.72Å; W1067-N1117 VanDerWaalsContact CH2-ND2 3.34Å; W1067-N1117 WeakPolarHBondContact CH2-ND2 3.31Å
1068	N	89.4	Confident	86.6	Confident	20 Å²	20	42.6 Å²	42.6	11%	0.107	23%	0.233	C	C	.	.	H	α-helix	trans	-65.8	-33.7	-178.8	-74.9	-28.6	0	0	0	112.3	D1023 M1064 V1065 P1072	D1023-N1068 PolarHBondContact O-OD1 2.94Å; M1064-N1068 PolarHBondContact O-ND2 3.25Å; V1065-N1068 PolarHBondContact O-N 3.38Å; V1065-N1068 VanDerWaalsContact O-N 3.15Å; N1068-P1072 WeakPolarHBondContact O-CD 3.45Å
1069	L	89.9	Confident	86.3	Confident	0 Å²	0	48.2 Å²	48.2	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-76.2	-36.3	172.1	-68.2	-178.8	0	0	0	113.4	L984 C988 L1025 M1033 L1042 L1043 S1046 V1065 W1067 P1072	L984-L1069 HydrophobicContact CD2-CD1 4.19Å; C988-L1069 HydrophobicContact CB-CD2 3.79Å; L1025-L1069 HydrophobicContact CD2-CD2 3.97Å; M1033-L1069 WeakPolarHBondContact CE-O 3.48Å; M1033-L1069 HydrophobicContact SD-CD2 4.01Å; L1042-L1069 HydrophobicContact CB-CD1 4.39Å; L1043-L1069 HydrophobicContact CD2-CB 3.77Å; S1046-L1069 VanDerWaalsContact OG-CD1 3.28Å; S1046-L1069 WeakPolarHBondContact OG-CD1 3.29Å; V1065-L1069 HydrophobicContact CG1-CD1 3.71Å; V1065-L1069 HydrophobicContact CG1-CG 4.24Å; V1065-L1069 PolarHBondContact O-N 2.92Å; W1067-L1069 VanDerWaalsContact C-N 3.3Å; W1067-L1069 PolarHBondContact O-N 2.82Å; L1069-P1072 WeakPolarHBondContact O-CD 3.32Å
1070	L	89.8	Confident	86.2	Confident	0 Å²	0	47.3 Å²	47.3	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-76.1	-37.9	-178.3	-175.5	64.6	0	0	0	112.2	L1043 F1047 C1066 W1067 P1072 V1073 V1074 L1078 F1086 I1114 L1118	L1043-L1070 HydrophobicContact CD2-CB 4.29Å; L1043-L1070 HydrophobicContact CD2-CD1 4.45Å; F1047-L1070 HydrophobicContact CZ-CD2 4.11Å; C1066-L1070 WeakPolarHBondContact O-CB 3.44Å; C1066-L1070 PolarHBondContact O-N 3.02Å; W1067-L1070 HydrophobicContact CE3-CD2 4.44Å; W1067-L1070 HydrophobicContact CZ3-CD2 4.32Å; W1067-L1070 PolarHBondContact O-N 3.37Å; L1070-P1072 VanDerWaalsContact C-CD 3.42Å; L1070-V1073 HydrophobicContact CD1-CG2 3.93Å; L1070-V1073 WeakPolarHBondContact O-CG2 3.31Å; L1070-V1073 PolarHBondContact O-N 3.27Å; L1070-V1074 HydrophobicContact CG-CG2 4.15Å; L1070-V1074 WeakPolarHBondContact O-CG2 3.32Å; L1070-V1074 PolarHBondContact O-N 2.95Å; L1070-L1078 HydrophobicContact CD1-CD1 4.3Å; L1070-F1086 HydrophobicContact CD1-CD2 4.03Å; L1070-F1086 HydrophobicContact CD1-CE2 4.04Å; L1070-I1114 HydrophobicContact CD2-CD1 4.26Å; L1070-I1114 HydrophobicContact CD2-CG1 3.81Å; L1070-I1114 HydrophobicContact CD2-CG2 4.5Å; L1070-L1118 HydrophobicContact CD2-CD1 4.33Å
1071	R	88.4	Confident	86.3	Confident	141 Å²	141	49.3 Å²	49.3	53%	0.532	28%	0.277	S	S	.	.	G	3₁₀ helix	trans	-49.7	-45.4	-172.9	179.7	-178.6	-179.2	-172.7	-1.1	115.1	W1067 V1073 V1074	W1067-R1071 HydrophobicContact CZ2-CB 4.29Å; W1067-R1071 HydrophobicContact CZ2-CG 4.3Å; W1067-R1071 WeakPolarHBondContact O-CB 3.32Å; W1067-R1071 PolarHBondContact O-N 2.9Å; R1071-V1073 VanDerWaalsContact C-N 3.29Å; R1071-V1073 PolarHBondContact O-N 3.28Å; R1071-V1074 WeakPolarHBondContact O-CB 3.38Å; R1071-V1074 PolarHBondContact O-N 2.86Å
1072	P	84.4	Confident	86.2	Confident	67 Å²	67	49.9 Å²	49.9	44%	0.435	28%	0.283	S	S	.	.	G	3₁₀ helix	trans	-66.7	-29.8	-179.5	-13.2	25	0	0	0	113.5	L1025 N1068 L1069 L1070	L1025-P1072 HydrophobicContact CD1-CB 4.46Å; L1025-P1072 HydrophobicContact CD1-CG 3.3Å; L1025-P1072 HydrophobicContact CG-CG 4.49Å; N1068-P1072 WeakPolarHBondContact O-CD 3.45Å; L1069-P1072 WeakPolarHBondContact O-CD 3.32Å; L1070-P1072 VanDerWaalsContact C-CD 3.42Å
1073	V	83.3	Confident	86.1	Confident	23 Å²	23	49.6 Å²	49.6	14%	0.139	28%	0.28	C	S	.	.	G	3₁₀ helix	trans	-90.2	-9.2	-177.5	-59.7	0	0	0	0	113	M1033 Y1039 L1043 L1070 R1071 A1075 G1076 L1078	M1033-V1073 HydrophobicContact CE-CG1 3.82Å; Y1039-V1073 HydrophobicContact CD2-CG1 4.43Å; L1043-V1073 HydrophobicContact CD1-CG2 4.17Å; L1070-V1073 HydrophobicContact CD1-CG2 3.93Å; L1070-V1073 WeakPolarHBondContact O-CG2 3.31Å; L1070-V1073 PolarHBondContact O-N 3.27Å; R1071-V1073 VanDerWaalsContact C-N 3.29Å; R1071-V1073 PolarHBondContact O-N 3.28Å; V1073-A1075 PolarHBondContact O-N 3.33Å; V1073-G1076 WeakPolarHBondContact O-CA 3.41Å; V1073-G1076 PolarHBondContact O-N 3.46Å; V1073-L1078 HydrophobicContact CB-CD2 4.25Å; V1073-L1078 HydrophobicContact CG2-CD2 4.1Å
1074	V	81.8	Confident	86.3	Confident	19 Å²	19	48.5 Å²	48.5	12%	0.115	27%	0.271	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.3	-33.4	174	170.1	0	0	0	0	112.2	W1067 L1070 R1071 G1076 N1117 L1118 R1121	W1067-V1074 HydrophobicContact CH2-CG2 4.3Å; W1067-V1074 HydrophobicContact CZ3-CG2 4.42Å; L1070-V1074 HydrophobicContact CG-CG2 4.15Å; L1070-V1074 WeakPolarHBondContact O-CG2 3.32Å; L1070-V1074 PolarHBondContact O-N 2.95Å; R1071-V1074 WeakPolarHBondContact O-CB 3.38Å; R1071-V1074 PolarHBondContact O-N 2.86Å; V1074-G1076 VanDerWaalsContact C-N 3.32Å; V1074-N1117 HydrophobicContact CG1-CB 4.15Å; V1074-L1118 HydrophobicContact CB-CD2 4.27Å; V1074-L1118 HydrophobicContact CG1-CD2 3.85Å; V1074-L1118 HydrophobicContact CG1-CG 4.48Å; V1074-L1118 HydrophobicContact CG2-CD2 4.12Å; V1074-L1118 HydrophobicContact CG2-CG 4.44Å; V1074-R1121 PolarHBondContact O-NH1 3.44Å
1075	A	73.9	Confident	86.7	Confident	85 Å²	85	50.8 Å²	50.8	70%	0.702	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.4	-22.5	175.8	0	0	0	0	0	112.7	V1073 R1121	V1073-A1075 PolarHBondContact O-N 3.33Å; A1075-R1121 VanDerWaalsContact C-NH1 3.35Å; A1075-R1121 PolarHBondContact O-NH1 3.48Å
1076	G	75.3	Confident	86.8	Confident	34 Å²	34	50.8 Å²	50.8	35%	0.351	28%	0.278	S	S	.	.	S	Bend	trans	-72.2	-178.6	176.6	0	0	0	0	0	113.5	V1073 V1074 R1121	V1073-G1076 WeakPolarHBondContact O-CA 3.41Å; V1073-G1076 PolarHBondContact O-N 3.46Å; V1074-G1076 VanDerWaalsContact C-N 3.32Å; G1076-R1121 PolarHBondContact O-NH1 3.32Å; G1076-R1121 PolarHBondContact O-NH2 3Å
1077	N	75.9	Confident	86.9	Confident	151 Å²	151	50.8 Å²	50.8	81%	0.807	28%	0.278	S	S	*	.			trans	-95	89.8	171.8	-75.4	-20	0	0	0	109.2	R1121	N1077-R1121 PolarHBondContact OD1-NH2 3.17Å
1078	L	84.1	Confident	87	Confident	20 Å²	20	50.6 Å²	50.6	11%	0.105	28%	0.281	C	S	.	.			trans	-74.4	144.3	171.1	-62.7	171.3	0	0	0	110.2	L1070 V1073 V1083 L1118 Y1122	L1070-L1078 HydrophobicContact CD1-CD1 4.3Å; V1073-L1078 HydrophobicContact CB-CD2 4.25Å; V1073-L1078 HydrophobicContact CG2-CD2 4.1Å; L1078-V1083 HydrophobicContact CB-CG2 3.73Å; L1078-V1083 HydrophobicContact CD1-CG2 4.1Å; L1078-L1118 HydrophobicContact CD1-CD2 4.07Å; L1078-Y1122 WeakPolarHBondContact CA-OH 3.31Å; L1078-Y1122 WeakPolarHBondContact CB-OH 3.19Å; L1078-Y1122 PolarHBondContact N-OH 2.78Å; L1078-Y1122 VanDerWaalsContact O-CE1 3.23Å; L1078-Y1122 WeakPolarHBondContact O-CE1 3.33Å; L1078-Y1122 PolarHBondContact O-OH 3.02Å
1079	L	86.9	Confident	87.2	Confident	118 Å²	118	50 Å²	50	62%	0.618	28%	0.278	S	S	*	.			trans	-64.7	135.6	170.6	-68.5	172.2	0	0	0	109.6	E1081 A1082 V1083	L1079-E1081 PolarHBondContact O-N 3.07Å; L1079-A1082 HydrophobicContact CB-CB 4.32Å; L1079-A1082 WeakPolarHBondContact O-CB 3.24Å; L1079-A1082 PolarHBondContact O-N 2.87Å; L1079-V1083 PolarHBondContact O-N 2.87Å
1080	P	87.8	Confident	87.4	Confident	54 Å²	54	50 Å²	50	35%	0.351	28%	0.278	S	S	.	.	H	α-helix	trans	-53.6	-37.5	178.3	-28.4	35.5	0	0	0	113.5	A1082 V1083 T1084 Y1122 E1124	P1080-A1082 VanDerWaalsContact C-N 3.35Å; P1080-A1082 PolarHBondContact O-N 3.25Å; P1080-V1083 PolarHBondContact O-N 3.31Å; P1080-T1084 WeakPolarHBondContact O-CG2 3.43Å; P1080-T1084 PolarHBondContact O-N 3.24Å; P1080-T1084 PolarHBondContact O-OG1 3.11Å; P1080-Y1122 HydrophobicContact CG-CD1 4.46Å; P1080-Y1122 HydrophobicContact CG-CE1 4.46Å; P1080-E1124 HydrophobicContact CB-CG 4.18Å
1081	E	89.5	Confident	87.6	Confident	158 Å²	158	50.6 Å²	50.6	74%	0.738	28%	0.281	S	S	*	.	H	α-helix	trans	-63.3	-36.5	176.4	-65.4	172.7	-178.2	0	0	113.1	L1079 T1084 W1085	L1079-E1081 PolarHBondContact O-N 3.07Å; E1081-T1084 WeakPolarHBondContact CA-OG1 3.36Å; E1081-T1084 PolarHBondContact O-OG1 3.32Å; E1081-W1085 VanDerWaalsContact O-CB 3.28Å; E1081-W1085 WeakPolarHBondContact O-CB 3.39Å; E1081-W1085 PolarHBondContact O-N 2.7Å
1082	A	88.6	Confident	87.7	Confident	17 Å²	17	50.8 Å²	50.8	14%	0.14	28%	0.282	C	S	.	.	H	α-helix	trans	-69.8	-40.5	176.1	0	0	0	0	0	110.8	L1079 P1080 W1085 F1086	L1079-A1082 HydrophobicContact CB-CB 4.32Å; L1079-A1082 WeakPolarHBondContact O-CB 3.24Å; L1079-A1082 PolarHBondContact O-N 2.87Å; P1080-A1082 VanDerWaalsContact C-N 3.35Å; P1080-A1082 PolarHBondContact O-N 3.25Å; A1082-W1085 PolarHBondContact O-N 3.41Å; A1082-F1086 HydrophobicContact CB-CE2 4.11Å; A1082-F1086 WeakPolarHBondContact O-CD2 3.47Å; A1082-F1086 WeakPolarHBondContact O-CG 3.24Å; A1082-F1086 PolarHBondContact O-N 3.23Å
1083	V	90.3	Very high	88.1	Confident	0 Å²	0	47.6 Å²	47.6	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-62.2	-44.6	177.5	174.7	0	0	0	0	111.1	L1078 L1079 P1080 Y1087 L1118 Y1122 L1125	L1078-V1083 HydrophobicContact CB-CG2 3.73Å; L1078-V1083 HydrophobicContact CD1-CG2 4.1Å; L1079-V1083 PolarHBondContact O-N 2.87Å; P1080-V1083 PolarHBondContact O-N 3.31Å; V1083-Y1087 WeakPolarHBondContact O-CB 3.47Å; V1083-Y1087 PolarHBondContact O-N 2.92Å; V1083-L1118 HydrophobicContact CG1-CB 4.31Å; V1083-L1118 HydrophobicContact CG1-CD1 3.98Å; V1083-L1118 HydrophobicContact CG2-CD1 4.38Å; V1083-Y1122 HydrophobicContact CB-CG 4.46Å; V1083-Y1122 HydrophobicContact CG1-CD2 4.33Å; V1083-Y1122 HydrophobicContact CG1-CG 4.15Å; V1083-Y1122 HydrophobicContact CG2-CD1 4.12Å; V1083-Y1122 HydrophobicContact CG2-CD2 4.09Å; V1083-Y1122 HydrophobicContact CG2-CE1 4.07Å; V1083-Y1122 HydrophobicContact CG2-CE2 4.07Å; V1083-Y1122 HydrophobicContact CG2-CG 4.12Å; V1083-L1125 HydrophobicContact CG1-CD1 3.82Å; V1083-L1125 HydrophobicContact CG1-CD2 3.7Å; V1083-L1125 HydrophobicContact CG1-CG 3.73Å
1084	T	92.3	Very high	88.4	Confident	35 Å²	35	46.5 Å²	46.5	22%	0.215	26%	0.255	C	S	.	.	H	α-helix	trans	-66.6	-37.7	175	56.6	0	0	0	0	111.7	P1080 E1081 Y1087 T1088 E1124 V1128	P1080-T1084 WeakPolarHBondContact O-CG2 3.43Å; P1080-T1084 PolarHBondContact O-N 3.24Å; P1080-T1084 PolarHBondContact O-OG1 3.11Å; E1081-T1084 WeakPolarHBondContact CA-OG1 3.36Å; E1081-T1084 PolarHBondContact O-OG1 3.32Å; T1084-Y1087 PolarHBondContact O-N 3.48Å; T1084-T1088 WeakPolarHBondContact O-CB 3.23Å; T1084-T1088 VanDerWaalsContact O-CG2 3.26Å; T1084-T1088 WeakPolarHBondContact O-CG2 3.25Å; T1084-T1088 PolarHBondContact O-N 3.29Å; T1084-T1088 PolarHBondContact O-OG1 3.37Å; T1084-E1124 HydrophobicContact CG2-CB 3.57Å; T1084-V1128 HydrophobicContact CG2-CG2 3.97Å
1085	W	93.8	Very high	88.7	Confident	82 Å²	82	50.3 Å²	50.3	31%	0.311	27%	0.271	S	S	.	.	H	α-helix	trans	-64.5	-44.7	176.7	-176	86.8	0	0	0	113.3	T1044 F1047 E1081 A1082 Y1087 T1088 S1089	T1044-W1085 HydrophobicContact CG2-CH2 3.73Å; T1044-W1085 HydrophobicContact CG2-CZ2 4.12Å; T1044-W1085 HydrophobicContact CG2-CZ3 4.4Å; F1047-W1085 HydrophobicContact CB-CH2 3.81Å; F1047-W1085 HydrophobicContact CB-CZ3 3.62Å; F1047-W1085 HydrophobicContact CG-CZ3 4.43Å; E1081-W1085 VanDerWaalsContact O-CB 3.28Å; E1081-W1085 WeakPolarHBondContact O-CB 3.39Å; E1081-W1085 PolarHBondContact O-N 2.7Å; A1082-W1085 PolarHBondContact O-N 3.41Å; W1085-Y1087 VanDerWaalsContact C-N 3.32Å; W1085-Y1087 PolarHBondContact O-N 3.4Å; W1085-T1088 WeakPolarHBondContact CA-OG1 3.22Å; W1085-T1088 PolarHBondContact O-N 3.04Å; W1085-T1088 PolarHBondContact O-OG1 3.24Å; W1085-S1089 WeakPolarHBondContact O-CB 3.38Å; W1085-S1089 PolarHBondContact O-N 2.59Å; W1085-S1089 PolarHBondContact O-OG 2.8Å
1086	F	93.1	Very high	89.3	Confident	4 Å²	4	49.2 Å²	49.2	2%	0.018	26%	0.256	C	S	.	.	H	α-helix	trans	-60.2	-46.1	175.6	-65.6	-46.7	0	0	0	110.9	L1043 F1047 L1070 A1082 S1089 V1090	L1043-F1086 HydrophobicContact CB-CE1 3.84Å; L1043-F1086 HydrophobicContact CB-CZ 3.97Å; L1043-F1086 HydrophobicContact CD1-CZ 3.89Å; L1043-F1086 HydrophobicContact CG-CZ 4.44Å; F1047-F1086 HydrophobicContact CB-CD1 4.21Å; F1047-F1086 HydrophobicContact CD1-CB 4.02Å; F1047-F1086 HydrophobicContact CD1-CD1 4.02Å; F1047-F1086 HydrophobicContact CD1-CG 4.45Å; F1047-F1086 WeakPolarHBondContact CD1-O 3.35Å; F1047-F1086 AromaticContact CD2-CD1 3.67Å; F1047-F1086 HydrophobicContact CD2-CD1 3.67Å; F1047-F1086 HydrophobicContact CD2-CE1 4.11Å; F1047-F1086 HydrophobicContact CE1-CB 3.84Å; F1047-F1086 HydrophobicContact CE1-CD1 4.31Å; F1047-F1086 HydrophobicContact CE1-CG 4.39Å; F1047-F1086 AromaticContact CE2-CD1 3.98Å; F1047-F1086 HydrophobicContact CE2-CD1 3.98Å; F1047-F1086 HydrophobicContact CE2-CE1 4.5Å; F1047-F1086 HydrophobicContact CE2-CG 4.48Å; F1047-F1086 AromaticContact CG-CD1 3.69Å; F1047-F1086 HydrophobicContact CG-CD1 3.69Å; F1047-F1086 HydrophobicContact CG-CE1 4.44Å; F1047-F1086 HydrophobicContact CZ-CB 4.22Å; F1047-F1086 HydrophobicContact CZ-CD1 4.29Å; F1047-F1086 HydrophobicContact CZ-CG 4.41Å; L1070-F1086 HydrophobicContact CD1-CD2 4.03Å; L1070-F1086 HydrophobicContact CD1-CE2 4.04Å; A1082-F1086 HydrophobicContact CB-CE2 4.11Å; A1082-F1086 WeakPolarHBondContact O-CD2 3.47Å; A1082-F1086 WeakPolarHBondContact O-CG 3.24Å; A1082-F1086 PolarHBondContact O-N 3.23Å; F1086-S1089 PolarHBondContact O-N 3.31Å; F1086-V1090 PolarHBondContact O-N 3.41Å
1087	Y	94.3	Very high	89.9	Confident	0 Å²	0	47.9 Å²	47.9	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-66.3	-45.9	-178.4	-163.7	-114.3	0	0	0	111.9	V1083 T1084 W1085 S1089 V1090 L1091 A1111 I1114 Y1115 L1125 V1128 M1129 F1164	V1083-Y1087 WeakPolarHBondContact O-CB 3.47Å; V1083-Y1087 PolarHBondContact O-N 2.92Å; T1084-Y1087 PolarHBondContact O-N 3.48Å; W1085-Y1087 VanDerWaalsContact C-N 3.32Å; W1085-Y1087 PolarHBondContact O-N 3.4Å; Y1087-S1089 VanDerWaalsContact C-N 3.31Å; Y1087-S1089 PolarHBondContact O-N 3.28Å; Y1087-V1090 PolarHBondContact O-N 3.09Å; Y1087-L1091 HydrophobicContact CD1-CD1 4.01Å; Y1087-L1091 HydrophobicContact CD1-CG 4.44Å; Y1087-L1091 HydrophobicContact CE1-CD1 3.85Å; Y1087-L1091 HydrophobicContact CE1-CD2 4.49Å; Y1087-L1091 HydrophobicContact CE1-CG 4.31Å; Y1087-L1091 WeakPolarHBondContact O-CG 3.41Å; Y1087-L1091 PolarHBondContact O-N 2.93Å; Y1087-A1111 HydrophobicContact CE2-CB 4.17Å; Y1087-A1111 WeakPolarHBondContact CE2-O 3.47Å; Y1087-I1114 HydrophobicContact CD2-CB 4.21Å; Y1087-I1114 HydrophobicContact CD2-CG2 3.78Å; Y1087-Y1115 HydrophobicContact CE1-CD2 4.33Å; Y1087-Y1115 HydrophobicContact CE2-CD2 4.16Å; Y1087-Y1115 AromaticContact CZ-CD2 3.81Å; Y1087-L1125 HydrophobicContact CD1-CD2 3.92Å; Y1087-L1125 HydrophobicContact CD2-CD2 4.24Å; Y1087-L1125 HydrophobicContact CG-CD2 3.64Å; Y1087-V1128 HydrophobicContact CD1-CB 4.17Å; Y1087-V1128 HydrophobicContact CD1-CG1 3.78Å; Y1087-V1128 HydrophobicContact CE1-CG1 4.28Å; Y1087-M1129 HydrophobicContact CE1-CG 3.9Å; Y1087-M1129 HydrophobicContact CE1-SD 3.81Å; Y1087-M1129 PolarHBondContact OH-SD 3.37Å; Y1087-F1164 WeakPolarHBondContact OH-CZ 3.42Å
1088	T	93.4	Very high	90.2	Very high	35 Å²	35	40.8 Å²	40.8	22%	0.215	20%	0.203	C	C	.	.	H	α-helix	trans	-63.9	-33.8	176.7	51.1	0	0	0	0	112.7	T1084 W1085 V1090 L1091 R1092 V1128	T1084-T1088 WeakPolarHBondContact O-CB 3.23Å; T1084-T1088 VanDerWaalsContact O-CG2 3.26Å; T1084-T1088 WeakPolarHBondContact O-CG2 3.25Å; T1084-T1088 PolarHBondContact O-N 3.29Å; T1084-T1088 PolarHBondContact O-OG1 3.37Å; W1085-T1088 WeakPolarHBondContact CA-OG1 3.22Å; W1085-T1088 PolarHBondContact O-N 3.04Å; W1085-T1088 PolarHBondContact O-OG1 3.24Å; T1088-V1090 VanDerWaalsContact C-N 3.35Å; T1088-V1090 PolarHBondContact O-N 2.67Å; T1088-L1091 PolarHBondContact O-N 3.39Å; T1088-R1092 WeakPolarHBondContact O-CG 3.47Å; T1088-R1092 PolarHBondContact O-N 2.87Å; T1088-V1128 HydrophobicContact CG2-CG1 3.67Å; T1088-V1128 HydrophobicContact CG2-CG2 4.33Å
1089	S	93.6	Very high	90	Very high	7 Å²	7	44.4 Å²	44.4	5%	0.049	22%	0.22	C	C	.	.	H	α-helix	trans	-60.6	-42.8	173.7	-61.9	0	0	0	0	112.1	W1085 F1086 Y1087 R1092 A1093	W1085-S1089 WeakPolarHBondContact O-CB 3.38Å; W1085-S1089 PolarHBondContact O-N 2.59Å; W1085-S1089 PolarHBondContact O-OG 2.8Å; F1086-S1089 PolarHBondContact O-N 3.31Å; Y1087-S1089 VanDerWaalsContact C-N 3.31Å; Y1087-S1089 PolarHBondContact O-N 3.28Å; S1089-R1092 PolarHBondContact O-N 2.99Å; S1089-A1093 WeakPolarHBondContact O-CB 3.34Å; S1089-A1093 PolarHBondContact O-N 2.94Å
1090	V	95.4	Very high	89.7	Confident	0 Å²	0	42.5 Å²	42.5	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-67.1	-39.1	175.3	-179.1	0	0	0	0	111.6	F1047 L1050 F1086 Y1087 T1088 A1093 L1094 L1107 L1110 A1111 I1114	F1047-V1090 HydrophobicContact CD1-CG2 3.96Å; F1047-V1090 HydrophobicContact CE1-CG2 3.7Å; L1050-V1090 HydrophobicContact CD1-CG2 3.87Å; F1086-V1090 PolarHBondContact O-N 3.41Å; Y1087-V1090 PolarHBondContact O-N 3.09Å; T1088-V1090 VanDerWaalsContact C-N 3.35Å; T1088-V1090 PolarHBondContact O-N 2.67Å; V1090-A1093 WeakPolarHBondContact O-CB 3.28Å; V1090-A1093 PolarHBondContact O-N 3.14Å; V1090-L1094 PolarHBondContact O-N 3.09Å; V1090-L1107 HydrophobicContact CG1-CD2 4.24Å; V1090-L1110 HydrophobicContact CG1-CD2 4.36Å; V1090-L1110 HydrophobicContact CG1-CG 4.44Å; V1090-L1110 HydrophobicContact CG2-CD2 3.72Å; V1090-L1110 HydrophobicContact CG2-CG 4.08Å; V1090-A1111 HydrophobicContact CG1-CB 3.88Å; V1090-I1114 HydrophobicContact CG2-CD1 3.88Å
1091	L	93	Very high	89.3	Confident	12 Å²	12	47.1 Å²	47.1	6%	0.063	22%	0.224	C	C	.	.	H	α-helix	trans	-66.2	-39.5	176.1	-63.7	-178.3	0	0	0	112.3	Y1087 T1088 A1093 L1094 Q1095 V1128 V1132 L1168	Y1087-L1091 HydrophobicContact CD1-CD1 4.01Å; Y1087-L1091 HydrophobicContact CD1-CG 4.44Å; Y1087-L1091 HydrophobicContact CE1-CD1 3.85Å; Y1087-L1091 HydrophobicContact CE1-CD2 4.49Å; Y1087-L1091 HydrophobicContact CE1-CG 4.31Å; Y1087-L1091 WeakPolarHBondContact O-CG 3.41Å; Y1087-L1091 PolarHBondContact O-N 2.93Å; T1088-L1091 PolarHBondContact O-N 3.39Å; L1091-A1093 VanDerWaalsContact C-N 3.35Å; L1091-L1094 HydrophobicContact CD2-CD1 4.24Å; L1091-L1094 WeakPolarHBondContact O-CB 3.15Å; L1091-L1094 PolarHBondContact O-N 2.95Å; L1091-Q1095 WeakPolarHBondContact O-CG 3.36Å; L1091-Q1095 PolarHBondContact O-N 3.24Å; L1091-V1128 HydrophobicContact CD1-CG1 3.84Å; L1091-V1132 HydrophobicContact CD1-CG2 4.38Å; L1091-L1168 HydrophobicContact CD2-CD1 4.28Å; L1091-L1168 HydrophobicContact CD2-CD2 3.68Å
1092	R	90.8	Very high	89	Confident	146 Å²	146	42.5 Å²	42.5	55%	0.551	21%	0.213	S	C	*	.	H	α-helix	trans	-63	-41.9	172.6	-74.1	177.3	-176	176.5	1.5	111.3	T1088 S1089 L1094 Q1095 V1096	T1088-R1092 WeakPolarHBondContact O-CG 3.47Å; T1088-R1092 PolarHBondContact O-N 2.87Å; S1089-R1092 PolarHBondContact O-N 2.99Å; R1092-L1094 VanDerWaalsContact C-N 3.28Å; R1092-L1094 PolarHBondContact O-N 3.19Å; R1092-Q1095 WeakPolarHBondContact O-CA 3.25Å; R1092-Q1095 WeakPolarHBondContact O-CB 3.44Å; R1092-Q1095 PolarHBondContact O-N 3.12Å; R1092-V1096 WeakPolarHBondContact O-CG2 3.45Å; R1092-V1096 PolarHBondContact O-N 3.08Å
1093	A	92.4	Very high	88.9	Confident	0 Å²	0	41.7 Å²	41.7	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-61.1	-37.8	174.1	0	0	0	0	0	112.4	L1050 S1089 V1090 L1091 Q1095 V1096 H1097 L1107	L1050-A1093 HydrophobicContact CB-CB 3.6Å; L1050-A1093 WeakPolarHBondContact O-CB 3.44Å; S1089-A1093 WeakPolarHBondContact O-CB 3.34Å; S1089-A1093 PolarHBondContact O-N 2.94Å; V1090-A1093 WeakPolarHBondContact O-CB 3.28Å; V1090-A1093 PolarHBondContact O-N 3.14Å; L1091-A1093 VanDerWaalsContact C-N 3.35Å; A1093-Q1095 VanDerWaalsContact C-N 3.32Å; A1093-V1096 PolarHBondContact O-N 3.14Å; A1093-H1097 PolarHBondContact O-N 3.18Å; A1093-L1107 HydrophobicContact CB-CD1 4.08Å; A1093-L1107 HydrophobicContact CB-CD2 3.83Å
1094	L	90.3	Very high	88.8	Confident	0 Å²	0	42.3 Å²	42.3	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-63.5	-36.4	171.3	-78.5	168.8	0	0	0	112.1	V1090 L1091 R1092 G1098 L1107 L1168 T1171 G1173	V1090-L1094 PolarHBondContact O-N 3.09Å; L1091-L1094 HydrophobicContact CD2-CD1 4.24Å; L1091-L1094 WeakPolarHBondContact O-CB 3.15Å; L1091-L1094 PolarHBondContact O-N 2.95Å; R1092-L1094 VanDerWaalsContact C-N 3.28Å; R1092-L1094 PolarHBondContact O-N 3.19Å; L1094-G1098 WeakPolarHBondContact O-CA 3.41Å; L1094-G1098 PolarHBondContact O-N 3.22Å; L1094-L1107 HydrophobicContact CD2-CB 3.45Å; L1094-L1107 VanDerWaalsContact CD2-CB 3.45Å; L1094-L1107 HydrophobicContact CD2-CD1 3.99Å; L1094-L1107 HydrophobicContact CD2-CG 4.4Å; L1094-L1107 HydrophobicContact CG-CB 3.79Å; L1094-L1107 HydrophobicContact CG-CD1 4.22Å; L1094-L1168 HydrophobicContact CD1-CD1 3.85Å; L1094-T1171 CarbonylContact C-O 3.6Å; L1094-G1173 PolarHBondContact O-N 2.9Å
1095	Q	88	Confident	88.6	Confident	98 Å²	98	43 Å²	43	46%	0.458	21%	0.214	S	C	.	.	H	α-helix	trans	-68	-37.1	175.6	-69.4	171	-20.1	0	0	112.3	L1091 R1092 A1093 T1171 G1173	L1091-Q1095 WeakPolarHBondContact O-CG 3.36Å; L1091-Q1095 PolarHBondContact O-N 3.24Å; R1092-Q1095 WeakPolarHBondContact O-CA 3.25Å; R1092-Q1095 WeakPolarHBondContact O-CB 3.44Å; R1092-Q1095 PolarHBondContact O-N 3.12Å; A1093-Q1095 VanDerWaalsContact C-N 3.32Å; Q1095-T1171 VanDerWaalsContact CA-O 3.24Å; Q1095-T1171 WeakPolarHBondContact CA-O 3.47Å; Q1095-T1171 WeakPolarHBondContact CG-O 3.46Å; Q1095-T1171 PolarHBondContact N-O 3.06Å; Q1095-G1173 WeakPolarHBondContact O-CA 3.42Å
1096	V	86.4	Confident	88.4	Confident	63 Å²	63	39.9 Å²	39.9	38%	0.382	20%	0.204	S	C	.	.	H	α-helix	trans	-79.7	-48.9	-179.2	177.5	0	0	0	0	111.8	K1053 R1092 A1093	K1053-V1096 HydrophobicContact CG-CG1 4.41Å; R1092-V1096 WeakPolarHBondContact O-CG2 3.45Å; R1092-V1096 PolarHBondContact O-N 3.08Å; A1093-V1096 PolarHBondContact O-N 3.14Å
1097	H	87.9	Confident	88.5	Confident	5 Å²	5	39.7 Å²	39.7	2%	0.023	20%	0.203	C	C	.	.	H	α-helix	trans	-107.5	-5.8	-170.1	-57.2	-75.1	0	0	0	114.5	L1050 W1052 C1058 A1093 Q1099 H1100 C1103 L1107	L1050-H1097 PolarHBondContact O-CD2 2.93Å; L1050-H1097 VanDerWaalsContact O-CD2 3.3Å; L1050-H1097 PolarHBondContact O-NE2 2.96Å; W1052-H1097 PolarHBondContact O-CE1 3.03Å; W1052-H1097 PolarHBondContact O-NE2 2.93Å; C1058-H1097 PolarHBondContact SG-CD2 3.42Å; A1093-H1097 PolarHBondContact O-N 3.18Å; H1097-Q1099 PolarHBondContact O-N 2.78Å; H1097-H1100 PolarHBondContact O-N 3.04Å; H1097-C1103 HydrophobicContact CB-CB 3.9Å; H1097-L1107 HydrophobicContact CB-CD1 4.49Å
1098	G	83.2	Confident	88.3	Confident	3 Å²	3	39.8 Å²	39.8	3%	0.031	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.3	-18.2	-171	0	0	0	0	0	115.3	L1094 H1100 N1104 I1172 G1173	L1094-G1098 WeakPolarHBondContact O-CA 3.41Å; L1094-G1098 PolarHBondContact O-N 3.22Å; G1098-H1100 PolarHBondContact O-N 3.35Å; G1098-N1104 PolarHBondContact O-ND2 3.35Å; G1098-I1172 WeakPolarHBondContact O-CG2 3.41Å; G1098-G1173 CarbonylContact C-O 3.44Å
1099	Q	78.8	Confident	88.2	Confident	96 Å²	96	39.4 Å²	39.4	45%	0.449	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-28.4	172.3	69.8	179.5	9.4	0	0	112.5	H1097 G1173	H1097-Q1099 PolarHBondContact O-N 2.78Å; Q1099-G1173 WeakPolarHBondContact CA-O 3.42Å; Q1099-G1173 PolarHBondContact N-O 3.42Å
1100	H	81.3	Confident	88.2	Confident	77 Å²	77	39.2 Å²	39.2	36%	0.356	20%	0.199	S	C	.	.	S	Bend	trans	-90.5	117.6	178.7	-59.2	-71.4	0	0	0	109.8	T1055 H1097 G1098 A1102 C1103 N1104	T1055-H1100 HydrophobicContact CG2-CB 3.96Å; H1097-H1100 PolarHBondContact O-N 3.04Å; G1098-H1100 PolarHBondContact O-N 3.35Å; H1100-A1102 PolarHBondContact O-N 3.45Å; H1100-C1103 PolarHBondContact O-N 2.89Å; H1100-N1104 WeakPolarHBondContact O-CB 3.44Å; H1100-N1104 PolarHBondContact O-N 2.84Å
1101	E	79.1	Confident	88.1	Confident	151 Å²	151	39.2 Å²	39.2	71%	0.706	20%	0.199	S	C	*	.	H	α-helix	trans	-57.8	-34.2	-179	-172.7	169.5	-164.2	0	0	112.7	C1103 N1104 T1105	E1101-C1103 VanDerWaalsContact C-N 3.26Å; E1101-C1103 PolarHBondContact O-N 3.29Å; E1101-N1104 PolarHBondContact O-N 3.39Å; E1101-T1105 PolarHBondContact O-N 3.02Å
1102	A	82.3	Confident	88.1	Confident	61 Å²	61	38.8 Å²	38.8	50%	0.504	20%	0.197	S	C	.	.	H	α-helix	trans	-58.2	-32.6	175.8	0	0	0	0	0	113.4	H1059 H1100 P1106	H1059-A1102 PolarHBondContact ND1-O 3.23Å; H1100-A1102 PolarHBondContact O-N 3.45Å; A1102-P1106 WeakPolarHBondContact O-CD 3.46Å; A1102-P1106 VanDerWaalsContact O-CG 3.24Å; A1102-P1106 WeakPolarHBondContact O-CG 3.37Å
1103	C	87.8	Confident	88.1	Confident	0 Å²	0	34.3 Å²	34.3	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-95.1	-36.7	176.3	-68.9	0	0	0	0	112.3	T1055 H1097 H1100 E1101 T1105 P1106 L1107	T1055-C1103 WeakPolarHBondContact CG2-SG 3.38Å; T1055-C1103 PolarHBondContact O-SG 3.46Å; H1097-C1103 HydrophobicContact CB-CB 3.9Å; H1100-C1103 PolarHBondContact O-N 2.89Å; E1101-C1103 VanDerWaalsContact C-N 3.26Å; E1101-C1103 PolarHBondContact O-N 3.29Å; C1103-T1105 VanDerWaalsContact C-N 3.32Å; C1103-T1105 PolarHBondContact O-N 3.39Å; C1103-P1106 WeakPolarHBondContact O-CD 3.5Å; C1103-L1107 HydrophobicContact CB-CD1 4.09Å; C1103-L1107 VanDerWaalsContact O-CB 3.25Å; C1103-L1107 WeakPolarHBondContact O-CB 3.16Å; C1103-L1107 VanDerWaalsContact O-CG 3.24Å; C1103-L1107 WeakPolarHBondContact O-CG 3.42Å; C1103-L1107 PolarHBondContact O-N 2.97Å
1104	N	87.9	Confident	88.1	Confident	14 Å²	14	34.3 Å²	34.3	8%	0.075	18%	0.183	C	C	.	.	H	α-helix	trans	-53.5	-48.7	-179.4	-173.6	-51.5	0	0	0	111.6	G1098 H1100 E1101 C1108 K1165 I1172	G1098-N1104 PolarHBondContact O-ND2 3.35Å; H1100-N1104 WeakPolarHBondContact O-CB 3.44Å; H1100-N1104 PolarHBondContact O-N 2.84Å; E1101-N1104 PolarHBondContact O-N 3.39Å; N1104-C1108 VanDerWaalsContact O-CB 3.29Å; N1104-C1108 WeakPolarHBondContact O-CB 3.41Å; N1104-C1108 PolarHBondContact O-N 3.12Å; N1104-C1108 PolarHBondContact O-SG 3.29Å; N1104-K1165 WeakPolarHBondContact OD1-CE 3.41Å; N1104-K1165 PolarHBondContact OD1-NZ 2.87Å; N1104-I1172 WeakPolarHBondContact ND2-CG2 3.36Å
1105	T	88.1	Confident	88.2	Confident	50 Å²	50	34.3 Å²	34.3	31%	0.307	18%	0.183	S	C	.	.	H	α-helix	trans	-65	-53.3	-177.7	-61.7	0	0	0	0	112.6	E1101 C1103 L1107 N1109	E1101-T1105 PolarHBondContact O-N 3.02Å; C1103-T1105 VanDerWaalsContact C-N 3.32Å; C1103-T1105 PolarHBondContact O-N 3.39Å; T1105-L1107 PolarHBondContact O-N 2.76Å; T1105-N1109 PolarHBondContact O-N 3Å; T1105-N1109 PolarHBondContact O-ND2 3.45Å; T1105-N1109 PolarHBondContact O-OD1 2.9Å
1106	P	90.1	Very high	88.3	Confident	16 Å²	16	31 Å²	31	10%	0.104	17%	0.168	C	C	.	.	H	α-helix	trans	-58.7	-42.5	174.1	-26.7	35.1	0	0	0	114.4	A1062 A1102 C1103 N1109 L1110	A1062-P1106 HydrophobicContact CB-CB 4.12Å; A1102-P1106 WeakPolarHBondContact O-CD 3.46Å; A1102-P1106 VanDerWaalsContact O-CG 3.24Å; A1102-P1106 WeakPolarHBondContact O-CG 3.37Å; C1103-P1106 WeakPolarHBondContact O-CD 3.5Å; P1106-N1109 WeakPolarHBondContact O-CB 3.45Å; P1106-N1109 PolarHBondContact O-N 3.28Å; P1106-L1110 WeakPolarHBondContact O-CB 3.43Å; P1106-L1110 PolarHBondContact O-N 3.01Å
1107	L	93.5	Very high	88.5	Confident	0 Å²	0	31.2 Å²	31.2	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-68.3	-41.2	-179	-72.6	170.3	0	0	0	112.3	L1050 A1062 V1090 A1093 L1094 H1097 C1103 T1105 N1109 L1110 A1111	L1050-L1107 HydrophobicContact CD1-CD2 4.35Å; L1050-L1107 HydrophobicContact CD2-CD2 4.34Å; A1062-L1107 HydrophobicContact CB-CD2 3.75Å; A1062-L1107 HydrophobicContact CB-CG 4.22Å; V1090-L1107 HydrophobicContact CG1-CD2 4.24Å; A1093-L1107 HydrophobicContact CB-CD1 4.08Å; A1093-L1107 HydrophobicContact CB-CD2 3.83Å; L1094-L1107 HydrophobicContact CD2-CB 3.45Å; L1094-L1107 VanDerWaalsContact CD2-CB 3.45Å; L1094-L1107 HydrophobicContact CD2-CD1 3.99Å; L1094-L1107 HydrophobicContact CD2-CG 4.4Å; L1094-L1107 HydrophobicContact CG-CB 3.79Å; L1094-L1107 HydrophobicContact CG-CD1 4.22Å; H1097-L1107 HydrophobicContact CB-CD1 4.49Å; C1103-L1107 HydrophobicContact CB-CD1 4.09Å; C1103-L1107 VanDerWaalsContact O-CB 3.25Å; C1103-L1107 WeakPolarHBondContact O-CB 3.16Å; C1103-L1107 VanDerWaalsContact O-CG 3.24Å; C1103-L1107 WeakPolarHBondContact O-CG 3.42Å; C1103-L1107 PolarHBondContact O-N 2.97Å; T1105-L1107 PolarHBondContact O-N 2.76Å; L1107-N1109 VanDerWaalsContact C-N 3.29Å; L1107-N1109 PolarHBondContact O-N 3.39Å; L1107-L1110 PolarHBondContact O-N 2.98Å; L1107-A1111 WeakPolarHBondContact O-CB 3.38Å; L1107-A1111 PolarHBondContact O-N 2.92Å
1108	C	91.2	Very high	88.6	Confident	2 Å²	2	31 Å²	31	1%	0.014	17%	0.166	C	C	.	.	H	α-helix	trans	-62.8	-37.8	173	-74	0	0	0	0	111.6	N1104 M1112	N1104-C1108 VanDerWaalsContact O-CB 3.29Å; N1104-C1108 WeakPolarHBondContact O-CB 3.41Å; N1104-C1108 PolarHBondContact O-N 3.12Å; N1104-C1108 PolarHBondContact O-SG 3.29Å; C1108-M1112 WeakPolarHBondContact O-CB 3.39Å; C1108-M1112 PolarHBondContact O-N 2.65Å
1109	N	91.3	Very high	89	Confident	27 Å²	27	31.5 Å²	31.5	14%	0.144	17%	0.167	C	C	.	.	H	α-helix	trans	-65.3	-45.5	174.8	-66	-14.7	0	0	0	111.5	T1105 P1106 L1107 M1112 L1113 R1161	T1105-N1109 PolarHBondContact O-N 3Å; T1105-N1109 PolarHBondContact O-ND2 3.45Å; T1105-N1109 PolarHBondContact O-OD1 2.9Å; P1106-N1109 WeakPolarHBondContact O-CB 3.45Å; P1106-N1109 PolarHBondContact O-N 3.28Å; L1107-N1109 VanDerWaalsContact C-N 3.29Å; L1107-N1109 PolarHBondContact O-N 3.39Å; N1109-M1112 WeakPolarHBondContact O-CB 3.15Å; N1109-M1112 PolarHBondContact O-N 2.75Å; N1109-L1113 VanDerWaalsContact O-CG 3.32Å; N1109-L1113 WeakPolarHBondContact O-CG 3.31Å; N1109-L1113 PolarHBondContact O-N 3.33Å; N1109-R1161 VanDerWaalsContact ND2-CZ 3.28Å; N1109-R1161 PolarHBondContact ND2-NH1 3.01Å; N1109-R1161 WeakPolarHBondContact OD1-CD 3.25Å; N1109-R1161 WeakPolarHBondContact OD1-CG 3.47Å; N1109-R1161 PolarHBondContact OD1-NE 2.99Å
1110	L	93.2	Very high	89.4	Confident	2 Å²	2	30.6 Å²	30.6	1%	0.01	17%	0.17	C	C	.	.	H	α-helix	trans	-61.3	-46.7	177.8	179.4	61.9	0	0	0	111	L1050 A1062 C1066 W1067 V1090 P1106 L1107 M1112 L1113 I1114	L1050-L1110 HydrophobicContact CD1-CD2 3.99Å; A1062-L1110 HydrophobicContact CB-CD2 4.26Å; C1066-L1110 HydrophobicContact CB-CD1 3.86Å; C1066-L1110 HydrophobicContact CB-CD2 3.59Å; C1066-L1110 HydrophobicContact CB-CG 4.39Å; W1067-L1110 HydrophobicContact CB-CD1 3.85Å; V1090-L1110 HydrophobicContact CG1-CD2 4.36Å; V1090-L1110 HydrophobicContact CG1-CG 4.44Å; V1090-L1110 HydrophobicContact CG2-CD2 3.72Å; V1090-L1110 HydrophobicContact CG2-CG 4.08Å; P1106-L1110 WeakPolarHBondContact O-CB 3.43Å; P1106-L1110 PolarHBondContact O-N 3.01Å; L1107-L1110 PolarHBondContact O-N 2.98Å; L1110-M1112 VanDerWaalsContact C-N 3.31Å; L1110-M1112 PolarHBondContact O-N 2.95Å; L1110-L1113 PolarHBondContact O-N 3.43Å; L1110-I1114 HydrophobicContact CD1-CD1 4.02Å; L1110-I1114 HydrophobicContact CD1-CG1 4.27Å; L1110-I1114 HydrophobicContact CG-CD1 3.95Å; L1110-I1114 VanDerWaalsContact O-CG1 3.26Å; L1110-I1114 WeakPolarHBondContact O-CG1 3.29Å; L1110-I1114 PolarHBondContact O-N 3.26Å
1111	A	94.1	Very high	89.7	Confident	0 Å²	0	32.3 Å²	32.3	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-58.5	-43.5	175.1	0	0	0	0	0	111.5	Y1087 V1090 L1107 I1114 Y1115 F1164 L1168	Y1087-A1111 HydrophobicContact CE2-CB 4.17Å; Y1087-A1111 WeakPolarHBondContact CE2-O 3.47Å; V1090-A1111 HydrophobicContact CG1-CB 3.88Å; L1107-A1111 WeakPolarHBondContact O-CB 3.38Å; L1107-A1111 PolarHBondContact O-N 2.92Å; A1111-I1114 PolarHBondContact O-N 3.12Å; A1111-Y1115 WeakPolarHBondContact O-CB 3.48Å; A1111-Y1115 PolarHBondContact O-N 3.31Å; A1111-F1164 HydrophobicContact CB-CE1 3.9Å; A1111-L1168 HydrophobicContact CB-CD1 3.67Å
1112	M	92.4	Very high	90.2	Very high	4 Å²	4	26 Å²	26	2%	0.02	14%	0.143	C	C	.	.	H	α-helix	trans	-61.2	-48	176.1	-173.2	-174	70.7	0	0	111.4	C1108 N1109 L1110 I1114 Y1115 E1116 R1160 R1161 F1164	C1108-M1112 WeakPolarHBondContact O-CB 3.39Å; C1108-M1112 PolarHBondContact O-N 2.65Å; N1109-M1112 WeakPolarHBondContact O-CB 3.15Å; N1109-M1112 PolarHBondContact O-N 2.75Å; L1110-M1112 VanDerWaalsContact C-N 3.31Å; L1110-M1112 PolarHBondContact O-N 2.95Å; M1112-I1114 PolarHBondContact O-N 3.16Å; M1112-Y1115 PolarHBondContact O-N 2.87Å; M1112-E1116 HydrophobicContact CG-CG 4.11Å; M1112-E1116 WeakPolarHBondContact O-CB 3.46Å; M1112-E1116 WeakPolarHBondContact O-CG 3.46Å; M1112-E1116 PolarHBondContact O-N 3.1Å; M1112-R1160 HydrophobicContact SD-CB 4.3Å; M1112-R1161 HydrophobicContact SD-CB 4.24Å; M1112-F1164 HydrophobicContact CB-CB 4.38Å; M1112-F1164 HydrophobicContact CB-CD1 3.55Å; M1112-F1164 HydrophobicContact CB-CE1 3.85Å; M1112-F1164 HydrophobicContact CB-CG 3.9Å; M1112-F1164 HydrophobicContact CB-CZ 4.46Å; M1112-F1164 HydrophobicContact CG-CB 4.07Å; M1112-F1164 HydrophobicContact CG-CD1 4.07Å; M1112-F1164 HydrophobicContact CG-CD2 4.26Å; M1112-F1164 HydrophobicContact CG-CG 3.87Å; M1112-F1164 VanDerWaalsContact N-CE1 3.27Å; M1112-F1164 HydrophobicContact SD-CB 4.24Å
1113	L	91.5	Very high	90.5	Very high	51 Å²	51	28.8 Å²	28.8	27%	0.267	15%	0.147	S	C	.	.	H	α-helix	trans	-60.2	-44.7	179.6	-72	170	0	0	0	111.9	W1067 N1109 L1110 N1117	W1067-L1113 HydrophobicContact CB-CD1 4.36Å; W1067-L1113 HydrophobicContact CD2-CB 3.91Å; W1067-L1113 HydrophobicContact CD2-CD1 4.05Å; W1067-L1113 HydrophobicContact CD2-CG 4.49Å; W1067-L1113 HydrophobicContact CE3-CB 3.84Å; W1067-L1113 HydrophobicContact CG-CD1 3.83Å; W1067-L1113 HydrophobicContact CH2-CB 4.35Å; W1067-L1113 HydrophobicContact CZ2-CB 4.38Å; W1067-L1113 HydrophobicContact CZ3-CB 4.07Å; N1109-L1113 VanDerWaalsContact O-CG 3.32Å; N1109-L1113 WeakPolarHBondContact O-CG 3.31Å; N1109-L1113 PolarHBondContact O-N 3.33Å; L1110-L1113 PolarHBondContact O-N 3.43Å; L1113-N1117 WeakPolarHBondContact O-CB 3.4Å; L1113-N1117 PolarHBondContact O-N 2.94Å; L1113-N1117 PolarHBondContact O-ND2 3.39Å
1114	I	92.6	Very high	90.7	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-62	-47.4	176.7	-64.8	171.2	0	0	0	110.1	F1047 W1067 L1070 Y1087 V1090 L1110 A1111 M1112 L1118	F1047-I1114 HydrophobicContact CE1-CD1 3.67Å; F1047-I1114 HydrophobicContact CZ-CD1 3.95Å; W1067-I1114 HydrophobicContact CE3-CG1 4.38Å; W1067-I1114 HydrophobicContact CZ3-CG1 4.43Å; L1070-I1114 HydrophobicContact CD2-CD1 4.26Å; L1070-I1114 HydrophobicContact CD2-CG1 3.81Å; L1070-I1114 HydrophobicContact CD2-CG2 4.5Å; Y1087-I1114 HydrophobicContact CD2-CB 4.21Å; Y1087-I1114 HydrophobicContact CD2-CG2 3.78Å; V1090-I1114 HydrophobicContact CG2-CD1 3.88Å; L1110-I1114 HydrophobicContact CD1-CD1 4.02Å; L1110-I1114 HydrophobicContact CD1-CG1 4.27Å; L1110-I1114 HydrophobicContact CG-CD1 3.95Å; L1110-I1114 VanDerWaalsContact O-CG1 3.26Å; L1110-I1114 WeakPolarHBondContact O-CG1 3.29Å; L1110-I1114 PolarHBondContact O-N 3.26Å; A1111-I1114 PolarHBondContact O-N 3.12Å; M1112-I1114 PolarHBondContact O-N 3.16Å; I1114-L1118 HydrophobicContact CG2-CD1 3.95Å; I1114-L1118 WeakPolarHBondContact O-CB 3.45Å; I1114-L1118 PolarHBondContact O-N 2.95Å
1115	Y	92.2	Very high	90.8	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-63.4	-53.5	-179	-161.5	-97	0	0	0	111.6	Y1087 A1111 M1112 N1117 R1119 L1125 M1129 Y1143 D1144 L1147 F1164	Y1087-Y1115 HydrophobicContact CE1-CD2 4.33Å; Y1087-Y1115 HydrophobicContact CE2-CD2 4.16Å; Y1087-Y1115 AromaticContact CZ-CD2 3.81Å; A1111-Y1115 WeakPolarHBondContact O-CB 3.48Å; A1111-Y1115 PolarHBondContact O-N 3.31Å; M1112-Y1115 PolarHBondContact O-N 2.87Å; Y1115-N1117 VanDerWaalsContact C-N 3.26Å; Y1115-N1117 PolarHBondContact O-N 2.8Å; Y1115-R1119 HydrophobicContact CD1-CB 4.15Å; Y1115-R1119 HydrophobicContact CD1-CG 4.28Å; Y1115-R1119 HydrophobicContact CE1-CB 4.16Å; Y1115-R1119 HydrophobicContact CE1-CG 3.77Å; Y1115-R1119 HydrophobicContact CE2-CG 4.4Å; Y1115-R1119 HydrophobicContact CG-CB 4.39Å; Y1115-R1119 WeakPolarHBondContact O-CA 3.33Å; Y1115-R1119 WeakPolarHBondContact O-CB 3.45Å; Y1115-R1119 PolarHBondContact O-N 3.47Å; Y1115-R1119 PolarHBondContact OH-NE 3.07Å; Y1115-L1125 HydrophobicContact CD2-CB 4.12Å; Y1115-L1125 HydrophobicContact CE2-CB 3.91Å; Y1115-M1129 HydrophobicContact CD2-CG 3.94Å; Y1115-M1129 HydrophobicContact CE2-CB 4.31Å; Y1115-M1129 HydrophobicContact CE2-CG 3.31Å; Y1115-Y1143 HydrophobicContact CD1-CE1 4.47Å; Y1115-Y1143 HydrophobicContact CE1-CD1 4.45Å; Y1115-D1144 VanDerWaalsContact CE1-OD1 3.27Å; Y1115-D1144 WeakPolarHBondContact CE1-OD1 3.2Å; Y1115-D1144 PolarHBondContact OH-OD1 3.41Å; Y1115-L1147 HydrophobicContact CD1-CD1 3.92Å; Y1115-L1147 HydrophobicContact CE1-CD1 4.02Å; Y1115-F1164 AromaticContact CD1-CE2 3.78Å; Y1115-F1164 HydrophobicContact CD1-CE2 3.78Å; Y1115-F1164 HydrophobicContact CD1-CZ 4.38Å; Y1115-F1164 AromaticContact CG-CE2 3.85Å; Y1115-F1164 HydrophobicContact CG-CE2 3.85Å; Y1115-F1164 AromaticContact CG-CZ 3.98Å; Y1115-F1164 HydrophobicContact CG-CZ 3.98Å
1116	E	90.3	Very high	91	Very high	28 Å²	28	33.4 Å²	33.4	13%	0.131	16%	0.161	C	C	.	.	H	α-helix	trans	-59.6	-34.4	-176.7	-67.4	-166.1	151.4	0	0	113.2	M1112 P1120 Y1143 L1147 R1160	M1112-E1116 HydrophobicContact CG-CG 4.11Å; M1112-E1116 WeakPolarHBondContact O-CB 3.46Å; M1112-E1116 WeakPolarHBondContact O-CG 3.46Å; M1112-E1116 PolarHBondContact O-N 3.1Å; E1116-P1120 WeakPolarHBondContact O-CD 3.42Å; E1116-Y1143 HydrophobicContact CG-CE1 4.47Å; E1116-Y1143 PolarHBondContact OE1-OH 3.27Å; E1116-L1147 HydrophobicContact CB-CD2 4.04Å; E1116-L1147 HydrophobicContact CG-CD2 3.75Å; E1116-R1160 IonicContact OE1-CZ 3.3Å; E1116-R1160 IonicContact OE1-NH1 3.52Å; E1116-R1160 PolarHBondContact OE1-NH1 2.69Å; E1116-R1160 IonicContact OE2-CZ 3.68Å; E1116-R1160 IonicContact OE2-NH1 3.89Å; E1116-R1160 PolarHBondContact OE2-NH1 3.46Å
1117	N	89.5	Confident	91	Very high	69 Å²	69	35 Å²	35	37%	0.369	18%	0.176	S	C	.	.	H	α-helix	trans	-91.4	-29.6	-174.6	-71.5	-86.4	0	0	0	114.1	W1067 V1074 L1113 Y1115	W1067-N1117 HydrophobicContact CH2-CB 3.72Å; W1067-N1117 VanDerWaalsContact CH2-ND2 3.34Å; W1067-N1117 WeakPolarHBondContact CH2-ND2 3.31Å; V1074-N1117 HydrophobicContact CG1-CB 4.15Å; L1113-N1117 WeakPolarHBondContact O-CB 3.4Å; L1113-N1117 PolarHBondContact O-N 2.94Å; L1113-N1117 PolarHBondContact O-ND2 3.39Å; Y1115-N1117 VanDerWaalsContact C-N 3.26Å; Y1115-N1117 PolarHBondContact O-N 2.8Å
1118	L	90.6	Very high	90.9	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-100.5	-28.1	-178.8	-68	173.2	0	0	0	113.1	L1070 V1074 L1078 V1083 I1114 P1120 R1121 Y1122 L1125	L1070-L1118 HydrophobicContact CD2-CD1 4.33Å; V1074-L1118 HydrophobicContact CB-CD2 4.27Å; V1074-L1118 HydrophobicContact CG1-CD2 3.85Å; V1074-L1118 HydrophobicContact CG1-CG 4.48Å; V1074-L1118 HydrophobicContact CG2-CD2 4.12Å; V1074-L1118 HydrophobicContact CG2-CG 4.44Å; L1078-L1118 HydrophobicContact CD1-CD2 4.07Å; V1083-L1118 HydrophobicContact CG1-CB 4.31Å; V1083-L1118 HydrophobicContact CG1-CD1 3.98Å; V1083-L1118 HydrophobicContact CG2-CD1 4.38Å; I1114-L1118 HydrophobicContact CG2-CD1 3.95Å; I1114-L1118 WeakPolarHBondContact O-CB 3.45Å; I1114-L1118 PolarHBondContact O-N 2.95Å; L1118-P1120 VanDerWaalsContact C-N 3.34Å; L1118-R1121 PolarHBondContact O-N 3.36Å; L1118-Y1122 HydrophobicContact CB-CD2 4.08Å; L1118-Y1122 HydrophobicContact CD2-CD2 4.06Å; L1118-Y1122 HydrophobicContact CD2-CE2 3.89Å; L1118-Y1122 WeakPolarHBondContact O-CD2 3.41Å; L1118-Y1122 PolarHBondContact O-N 3.39Å; L1118-L1125 HydrophobicContact CB-CD1 3.66Å
1119	R	90.3	Very high	90.9	Very high	13 Å²	13	35.5 Å²	35.5	5%	0.049	18%	0.178	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.4	-37.6	-178.6	178.4	65.5	-171.9	88.6	2.4	114.6	Y1115 R1121 M1123 L1125 D1144	Y1115-R1119 HydrophobicContact CD1-CB 4.15Å; Y1115-R1119 HydrophobicContact CD1-CG 4.28Å; Y1115-R1119 HydrophobicContact CE1-CB 4.16Å; Y1115-R1119 HydrophobicContact CE1-CG 3.77Å; Y1115-R1119 HydrophobicContact CE2-CG 4.4Å; Y1115-R1119 HydrophobicContact CG-CB 4.39Å; Y1115-R1119 WeakPolarHBondContact O-CA 3.33Å; Y1115-R1119 WeakPolarHBondContact O-CB 3.45Å; Y1115-R1119 PolarHBondContact O-N 3.47Å; Y1115-R1119 PolarHBondContact OH-NE 3.07Å; R1119-R1121 PolarHBondContact O-N 2.76Å; R1119-M1123 PolarHBondContact NH1-SD 3.07Å; R1119-L1125 HydrophobicContact CB-CD1 4.45Å; R1119-D1144 IonicContact CZ-OD2 3.33Å; R1119-D1144 IonicContact NE-OD1 3.69Å; R1119-D1144 PolarHBondContact NE-OD1 3.34Å; R1119-D1144 IonicContact NE-OD2 3.68Å; R1119-D1144 PolarHBondContact NE-OD2 2.96Å; R1119-D1144 IonicContact NH2-OD2 3.68Å; R1119-D1144 PolarHBondContact NH2-OD2 3.09Å
1120	P	88.2	Confident	90.9	Very high	78 Å²	78	37.5 Å²	37.5	51%	0.506	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-23.5	177.2	-25.3	36.1	0	0	0	114.2	E1116 L1118	E1116-P1120 WeakPolarHBondContact O-CD 3.42Å; L1118-P1120 VanDerWaalsContact C-N 3.34Å
1121	R	87.8	Confident	90.7	Very high	113 Å²	113	44.3 Å²	44.3	43%	0.426	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	-103.6	-28.2	-179.5	-65	179.4	67.5	-175	1.9	113.3	V1074 A1075 G1076 N1077 L1118 R1119	V1074-R1121 PolarHBondContact O-NH1 3.44Å; A1075-R1121 VanDerWaalsContact C-NH1 3.35Å; A1075-R1121 PolarHBondContact O-NH1 3.48Å; G1076-R1121 PolarHBondContact O-NH1 3.32Å; G1076-R1121 PolarHBondContact O-NH2 3Å; N1077-R1121 PolarHBondContact OD1-NH2 3.17Å; L1118-R1121 PolarHBondContact O-N 3.36Å; R1119-R1121 PolarHBondContact O-N 2.76Å
1122	Y	89.9	Confident	90.3	Very high	17 Å²	17	44.6 Å²	44.6	7%	0.067	23%	0.225	C	C	.	.			trans	-122.7	109	-172.9	-60.9	-82.1	0	0	0	110.9	L1078 P1080 V1083 L1118 E1124	L1078-Y1122 WeakPolarHBondContact CA-OH 3.31Å; L1078-Y1122 WeakPolarHBondContact CB-OH 3.19Å; L1078-Y1122 PolarHBondContact N-OH 2.78Å; L1078-Y1122 VanDerWaalsContact O-CE1 3.23Å; L1078-Y1122 WeakPolarHBondContact O-CE1 3.33Å; L1078-Y1122 PolarHBondContact O-OH 3.02Å; P1080-Y1122 HydrophobicContact CG-CD1 4.46Å; P1080-Y1122 HydrophobicContact CG-CE1 4.46Å; V1083-Y1122 HydrophobicContact CB-CG 4.46Å; V1083-Y1122 HydrophobicContact CG1-CD2 4.33Å; V1083-Y1122 HydrophobicContact CG1-CG 4.15Å; V1083-Y1122 HydrophobicContact CG2-CD1 4.12Å; V1083-Y1122 HydrophobicContact CG2-CD2 4.09Å; V1083-Y1122 HydrophobicContact CG2-CE1 4.07Å; V1083-Y1122 HydrophobicContact CG2-CE2 4.07Å; V1083-Y1122 HydrophobicContact CG2-CG 4.12Å; L1118-Y1122 HydrophobicContact CB-CD2 4.08Å; L1118-Y1122 HydrophobicContact CD2-CD2 4.06Å; L1118-Y1122 HydrophobicContact CD2-CE2 3.89Å; L1118-Y1122 WeakPolarHBondContact O-CD2 3.41Å; L1118-Y1122 PolarHBondContact O-N 3.39Å; Y1122-E1124 VanDerWaalsContact C-N 3.29Å; Y1122-E1124 WeakPolarHBondContact CA-OE2 3.5Å; Y1122-E1124 PolarHBondContact O-N 3.15Å
1123	M	88.1	Confident	89.8	Confident	121 Å²	121	47.5 Å²	47.5	60%	0.596	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74.2	-22.3	-179.3	-69.8	-69.5	-70.5	0	0	112.4	R1119 L1125 R1126	R1119-M1123 PolarHBondContact NH1-SD 3.07Å; M1123-L1125 PolarHBondContact O-N 2.93Å; M1123-R1126 WeakPolarHBondContact O-CB 3.47Å; M1123-R1126 PolarHBondContact O-N 3.19Å
1124	E	91.8	Very high	89.3	Confident	74 Å²	74	52.4 Å²	52.4	35%	0.346	27%	0.271	S	S	.	.	H	α-helix	trans	-60.4	-29.3	-178.7	-60.6	78.9	-177.5	0	0	112.1	P1080 T1084 Y1122 R1126 A1127 V1128	P1080-E1124 HydrophobicContact CB-CG 4.18Å; T1084-E1124 HydrophobicContact CG2-CB 3.57Å; Y1122-E1124 VanDerWaalsContact C-N 3.29Å; Y1122-E1124 WeakPolarHBondContact CA-OE2 3.5Å; Y1122-E1124 PolarHBondContact O-N 3.15Å; E1124-R1126 PolarHBondContact O-N 3.35Å; E1124-A1127 WeakPolarHBondContact O-CA 3.44Å; E1124-A1127 WeakPolarHBondContact O-CB 3.32Å; E1124-A1127 PolarHBondContact O-N 3.17Å; E1124-V1128 PolarHBondContact O-N 3.41Å
1125	L	90.9	Very high	88.9	Confident	0 Å²	0	53.7 Å²	53.7	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-61.7	-32.7	174.8	-71.3	178.7	0	0	0	112.5	V1083 Y1087 Y1115 L1118 R1119 M1123 V1128 M1129	V1083-L1125 HydrophobicContact CG1-CD1 3.82Å; V1083-L1125 HydrophobicContact CG1-CD2 3.7Å; V1083-L1125 HydrophobicContact CG1-CG 3.73Å; Y1087-L1125 HydrophobicContact CD1-CD2 3.92Å; Y1087-L1125 HydrophobicContact CD2-CD2 4.24Å; Y1087-L1125 HydrophobicContact CG-CD2 3.64Å; Y1115-L1125 HydrophobicContact CD2-CB 4.12Å; Y1115-L1125 HydrophobicContact CE2-CB 3.91Å; L1118-L1125 HydrophobicContact CB-CD1 3.66Å; R1119-L1125 HydrophobicContact CB-CD1 4.45Å; M1123-L1125 PolarHBondContact O-N 2.93Å; L1125-V1128 PolarHBondContact O-N 3.44Å; L1125-M1129 WeakPolarHBondContact O-CG 3.33Å; L1125-M1129 PolarHBondContact O-N 3.37Å
1126	R	91	Very high	88.6	Confident	87 Å²	87	56.6 Å²	56.6	33%	0.328	30%	0.298	S	S	.	.	H	α-helix	trans	-65.6	-41.8	172.2	-171.5	178	178.3	-131.8	3.9	110.9	M1123 E1124 V1128 M1129 T1130 L1140 D1141 D1144	M1123-R1126 WeakPolarHBondContact O-CB 3.47Å; M1123-R1126 PolarHBondContact O-N 3.19Å; E1124-R1126 PolarHBondContact O-N 3.35Å; R1126-V1128 VanDerWaalsContact C-N 3.3Å; R1126-V1128 PolarHBondContact O-N 3.35Å; R1126-M1129 PolarHBondContact O-N 3.5Å; R1126-M1129 VanDerWaalsContact O-N 3.16Å; R1126-T1130 WeakPolarHBondContact O-CG2 3.36Å; R1126-T1130 PolarHBondContact O-N 2.97Å; R1126-T1130 PolarHBondContact O-OG1 3.46Å; R1126-L1140 HydrophobicContact CG-CD2 4.38Å; R1126-D1141 IonicContact CZ-OD1 3.14Å; R1126-D1141 IonicContact NE-OD1 2.73Å; R1126-D1141 IonicContact NH2-OD1 2.69Å; R1126-D1141 PolarHBondContact NH2-OD1 2.93Å; R1126-D1141 IonicContact NH2-OD2 3.61Å; R1126-D1144 WeakPolarHBondContact CD-OD2 3.38Å; R1126-D1144 IonicContact NE-OD2 2.77Å
1127	A	90.2	Very high	88.4	Confident	50 Å²	50	60 Å²	60	41%	0.413	32%	0.316	S	S	.	.	H	α-helix	trans	-61.4	-39.8	177.9	0	0	0	0	0	111.6	E1124 T1130 Q1131	E1124-A1127 WeakPolarHBondContact O-CA 3.44Å; E1124-A1127 WeakPolarHBondContact O-CB 3.32Å; E1124-A1127 PolarHBondContact O-N 3.17Å; A1127-T1130 WeakPolarHBondContact CA-OG1 3.44Å; A1127-T1130 PolarHBondContact O-N 3.3Å; A1127-T1130 PolarHBondContact O-OG1 3.26Å; A1127-Q1131 WeakPolarHBondContact O-CG 3.45Å
1128	V	91.8	Very high	88.2	Confident	12 Å²	12	62.8 Å²	62.8	7%	0.073	33%	0.331	C	S	.	.	H	α-helix	trans	-66.6	-43.3	173.2	-178.5	0	0	0	0	111.3	T1084 Y1087 T1088 L1091 E1124 L1125 R1126 T1130 Q1131	T1084-V1128 HydrophobicContact CG2-CG2 3.97Å; Y1087-V1128 HydrophobicContact CD1-CB 4.17Å; Y1087-V1128 HydrophobicContact CD1-CG1 3.78Å; Y1087-V1128 HydrophobicContact CE1-CG1 4.28Å; T1088-V1128 HydrophobicContact CG2-CG1 3.67Å; T1088-V1128 HydrophobicContact CG2-CG2 4.33Å; L1091-V1128 HydrophobicContact CD1-CG1 3.84Å; E1124-V1128 PolarHBondContact O-N 3.41Å; L1125-V1128 PolarHBondContact O-N 3.44Å; R1126-V1128 VanDerWaalsContact C-N 3.3Å; R1126-V1128 PolarHBondContact O-N 3.35Å; V1128-T1130 VanDerWaalsContact C-N 3.29Å; V1128-T1130 PolarHBondContact O-N 3.3Å; V1128-Q1131 WeakPolarHBondContact O-CB 3.48Å; V1128-Q1131 PolarHBondContact O-N 3.22Å
1129	M	91.1	Very high	88	Confident	0 Å²	0	64.8 Å²	64.8	0%	0	35%	0.347	C	S	.	.	H	α-helix	trans	-60.1	-37.7	176.8	-81.8	-64.5	-83.4	0	0	112.9	Y1087 Y1115 L1125 R1126 Q1131 V1132 I1135 L1140 F1164 L1167 L1168	Y1087-M1129 HydrophobicContact CE1-CG 3.9Å; Y1087-M1129 HydrophobicContact CE1-SD 3.81Å; Y1087-M1129 PolarHBondContact OH-SD 3.37Å; Y1115-M1129 HydrophobicContact CD2-CG 3.94Å; Y1115-M1129 HydrophobicContact CE2-CB 4.31Å; Y1115-M1129 HydrophobicContact CE2-CG 3.31Å; L1125-M1129 WeakPolarHBondContact O-CG 3.33Å; L1125-M1129 PolarHBondContact O-N 3.37Å; R1126-M1129 PolarHBondContact O-N 3.5Å; R1126-M1129 VanDerWaalsContact O-N 3.16Å; M1129-Q1131 PolarHBondContact O-N 2.99Å; M1129-V1132 VanDerWaalsContact O-CB 3.3Å; M1129-V1132 WeakPolarHBondContact O-CB 3.46Å; M1129-V1132 WeakPolarHBondContact O-CG2 3.45Å; M1129-V1132 PolarHBondContact O-N 2.98Å; M1129-V1132 HydrophobicContact SD-CG2 4.25Å; M1129-I1135 HydrophobicContact CB-CD1 4.37Å; M1129-I1135 HydrophobicContact CE-CD1 3.8Å; M1129-I1135 VanDerWaalsContact O-CD1 3.29Å; M1129-I1135 WeakPolarHBondContact O-CD1 3.5Å; M1129-L1140 HydrophobicContact CB-CD1 4.19Å; M1129-L1140 HydrophobicContact CB-CD2 3.92Å; M1129-L1140 HydrophobicContact CE-CD1 3.92Å; M1129-L1140 HydrophobicContact CG-CD1 4.43Å; M1129-F1164 HydrophobicContact CE-CE2 4.36Å; M1129-F1164 HydrophobicContact CE-CZ 4.42Å; M1129-L1167 HydrophobicContact CE-CB 3.85Å; M1129-L1167 HydrophobicContact CE-CD1 4.23Å; M1129-L1168 HydrophobicContact CE-CD2 3.91Å; M1129-L1168 HydrophobicContact SD-CD2 3.62Å
1130	T	90.4	Very high	87.9	Confident	68 Å²	68	64.1 Å²	64.1	42%	0.417	35%	0.345	S	S	.	.	H	α-helix	trans	-66.8	-15.6	176.6	49.9	0	0	0	0	113.8	R1126 A1127 V1128 V1132 L1140	R1126-T1130 WeakPolarHBondContact O-CG2 3.36Å; R1126-T1130 PolarHBondContact O-N 2.97Å; R1126-T1130 PolarHBondContact O-OG1 3.46Å; A1127-T1130 WeakPolarHBondContact CA-OG1 3.44Å; A1127-T1130 PolarHBondContact O-N 3.3Å; A1127-T1130 PolarHBondContact O-OG1 3.26Å; V1128-T1130 VanDerWaalsContact C-N 3.29Å; V1128-T1130 PolarHBondContact O-N 3.3Å; T1130-V1132 VanDerWaalsContact C-N 3.35Å; T1130-L1140 HydrophobicContact CG2-CD2 4.05Å
1131	Q	89.5	Confident	87.8	Confident	145 Å²	145	62.6 Å²	62.6	68%	0.678	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.2	-9.1	174	-62.6	170	22.9	0	0	112.9	A1127 V1128 M1129 P1133	A1127-Q1131 WeakPolarHBondContact O-CG 3.45Å; V1128-Q1131 WeakPolarHBondContact O-CB 3.48Å; V1128-Q1131 PolarHBondContact O-N 3.22Å; M1129-Q1131 PolarHBondContact O-N 2.99Å; Q1131-P1133 WeakPolarHBondContact O-CD 3.43Å
1132	V	86.7	Confident	87.8	Confident	6 Å²	6	61.2 Å²	61.2	4%	0.036	33%	0.333	C	S	.	.	S	Bend	trans	-63.4	125.4	175.6	172.5	0	0	0	0	108.9	L1091 M1129 T1130 N1134 I1135 L1168 T1171	L1091-V1132 HydrophobicContact CD1-CG2 4.38Å; M1129-V1132 VanDerWaalsContact O-CB 3.3Å; M1129-V1132 WeakPolarHBondContact O-CB 3.46Å; M1129-V1132 WeakPolarHBondContact O-CG2 3.45Å; M1129-V1132 PolarHBondContact O-N 2.98Å; M1129-V1132 HydrophobicContact SD-CG2 4.25Å; T1130-V1132 VanDerWaalsContact C-N 3.35Å; V1132-N1134 PolarHBondContact O-N 3.46Å; V1132-I1135 HydrophobicContact CB-CB 4.15Å; V1132-I1135 HydrophobicContact CB-CD1 4.25Å; V1132-I1135 HydrophobicContact CG1-CB 4.29Å; V1132-I1135 WeakPolarHBondContact O-CG2 3.32Å; V1132-I1135 PolarHBondContact O-N 3.32Å; V1132-L1168 HydrophobicContact CG2-CD2 4.32Å; V1132-T1171 HydrophobicContact CB-CG2 4.39Å; V1132-T1171 HydrophobicContact CG1-CG2 4.01Å; V1132-T1171 HydrophobicContact CG2-CG2 4.01Å
1133	P	81.6	Confident	87.6	Confident	66 Å²	66	61.1 Å²	61.1	43%	0.429	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.3	136.8	-180	-25.5	34.2	0	0	0	111.6	Q1131 I1135 G1170	Q1131-P1133 WeakPolarHBondContact O-CD 3.43Å; P1133-I1135 PolarHBondContact O-N 3.08Å; P1133-I1135 VanDerWaalsContact O-N 3.16Å; P1133-G1170 WeakPolarHBondContact O-CA 3.34Å
1134	N	79.9	Confident	87.5	Confident	154 Å²	154	55.8 Å²	55.8	82%	0.824	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.1	24.7	176.3	-56.1	-41.6	0	0	0	115.6	V1132	V1132-N1134 PolarHBondContact O-N 3.46Å
1135	I	84.8	Confident	87.2	Confident	26 Å²	26	58.3 Å²	58.3	13%	0.133	32%	0.318	C	S	.	.			trans	-70.4	137.7	175	-164.8	168.6	0	0	0	111.6	M1129 V1132 P1133 I1137 L1140 L1167	M1129-I1135 HydrophobicContact CB-CD1 4.37Å; M1129-I1135 HydrophobicContact CE-CD1 3.8Å; M1129-I1135 VanDerWaalsContact O-CD1 3.29Å; M1129-I1135 WeakPolarHBondContact O-CD1 3.5Å; V1132-I1135 HydrophobicContact CB-CB 4.15Å; V1132-I1135 HydrophobicContact CB-CD1 4.25Å; V1132-I1135 HydrophobicContact CG1-CB 4.29Å; V1132-I1135 WeakPolarHBondContact O-CG2 3.32Å; V1132-I1135 PolarHBondContact O-N 3.32Å; P1133-I1135 PolarHBondContact O-N 3.08Å; P1133-I1135 VanDerWaalsContact O-N 3.16Å; I1135-I1137 PolarHBondContact O-N 2.72Å; I1135-L1140 HydrophobicContact CD1-CD1 4.48Å; I1135-L1140 HydrophobicContact CD1-CD2 4.14Å; I1135-L1167 HydrophobicContact CD1-CB 4.32Å; I1135-L1167 HydrophobicContact CG1-CD2 4.36Å
1136	S	85.7	Confident	86.7	Confident	62 Å²	62	63.8 Å²	63.8	43%	0.434	34%	0.339	S	S	.	.			trans	-81.7	112.5	171.7	170.8	0	0	0	0	109.8	D1138 A1139 L1140	S1136-D1138 VanDerWaalsContact C-N 3.35Å; S1136-D1138 PolarHBondContact O-N 3.39Å; S1136-A1139 PolarHBondContact O-N 2.95Å; S1136-A1139 WeakPolarHBondContact OG-CB 3.4Å; S1136-A1139 PolarHBondContact OG-N 3.28Å; S1136-L1140 PolarHBondContact O-N 2.88Å
1137	I	87.3	Confident	86.2	Confident	98 Å²	98	61.9 Å²	61.9	50%	0.503	34%	0.335	S	S	.	.	H	α-helix	trans	-61.1	-44	179.3	-60	173.1	0	0	0	110.6	I1135 A1139 L1140 D1141	I1135-I1137 PolarHBondContact O-N 2.72Å; I1137-A1139 VanDerWaalsContact C-N 3.31Å; I1137-A1139 PolarHBondContact O-N 3.16Å; I1137-L1140 WeakPolarHBondContact O-CB 3.44Å; I1137-L1140 PolarHBondContact O-N 3.4Å; I1137-L1140 VanDerWaalsContact O-N 3.16Å; I1137-D1141 PolarHBondContact O-N 2.87Å
1138	D	85.7	Confident	85.4	Confident	129 Å²	129	64.4 Å²	64.4	69%	0.69	35%	0.345	S	S	*	.	H	α-helix	trans	-60.3	-40	177.7	-58.3	-31.3	0	0	0	112.6	S1136 D1141 L1142	S1136-D1138 VanDerWaalsContact C-N 3.35Å; S1136-D1138 PolarHBondContact O-N 3.39Å; D1138-D1141 PolarHBondContact O-N 2.99Å; D1138-L1142 WeakPolarHBondContact O-CB 3.37Å; D1138-L1142 PolarHBondContact O-N 2.84Å
1139	A	84.7	Confident	84.6	Confident	41 Å²	41	68 Å²	68	34%	0.339	36%	0.364	S	S	.	.	H	α-helix	trans	-70.5	-35.8	178.2	0	0	0	0	0	111.9	S1136 I1137 Y1143 L1167	S1136-A1139 PolarHBondContact O-N 2.95Å; S1136-A1139 WeakPolarHBondContact OG-CB 3.4Å; S1136-A1139 PolarHBondContact OG-N 3.28Å; I1137-A1139 VanDerWaalsContact C-N 3.31Å; I1137-A1139 PolarHBondContact O-N 3.16Å; A1139-Y1143 PolarHBondContact O-N 2.93Å; A1139-Y1143 VanDerWaalsContact O-N 3.1Å; A1139-L1167 HydrophobicContact CB-CD2 3.91Å
1140	L	88	Confident	83.2	Confident	0 Å²	0	73.4 Å²	73.4	0%	0	40%	0.402	C	S	.	.	H	α-helix	trans	-65.5	-46	173.3	-179.5	62.7	0	0	0	110.8	R1126 M1129 T1130 I1135 S1136 I1137 L1142 Y1143 D1144 L1167	R1126-L1140 HydrophobicContact CG-CD2 4.38Å; M1129-L1140 HydrophobicContact CB-CD1 4.19Å; M1129-L1140 HydrophobicContact CB-CD2 3.92Å; M1129-L1140 HydrophobicContact CE-CD1 3.92Å; M1129-L1140 HydrophobicContact CG-CD1 4.43Å; T1130-L1140 HydrophobicContact CG2-CD2 4.05Å; I1135-L1140 HydrophobicContact CD1-CD1 4.48Å; I1135-L1140 HydrophobicContact CD1-CD2 4.14Å; S1136-L1140 PolarHBondContact O-N 2.88Å; I1137-L1140 WeakPolarHBondContact O-CB 3.44Å; I1137-L1140 PolarHBondContact O-N 3.4Å; I1137-L1140 VanDerWaalsContact O-N 3.16Å; L1140-L1142 VanDerWaalsContact C-N 3.33Å; L1140-L1142 PolarHBondContact O-N 3.25Å; L1140-Y1143 WeakPolarHBondContact O-CB 3.36Å; L1140-Y1143 PolarHBondContact O-N 3.43Å; L1140-Y1143 VanDerWaalsContact O-N 3.08Å; L1140-D1144 PolarHBondContact O-N 3.04Å; L1140-L1167 HydrophobicContact CD1-CD1 4.26Å
1141	D	87.8	Confident	81.5	Confident	46 Å²	46	77 Å²	77	25%	0.246	42%	0.418	C	S	.	.	H	α-helix	trans	-61.9	-41	178.7	-73.6	-15.9	0	0	0	111.5	R1126 I1137 D1138 Y1143 D1144 Q1145	R1126-D1141 IonicContact CZ-OD1 3.14Å; R1126-D1141 IonicContact NE-OD1 2.73Å; R1126-D1141 IonicContact NH2-OD1 2.69Å; R1126-D1141 PolarHBondContact NH2-OD1 2.93Å; R1126-D1141 IonicContact NH2-OD2 3.61Å; I1137-D1141 PolarHBondContact O-N 2.87Å; D1138-D1141 PolarHBondContact O-N 2.99Å; D1141-Y1143 VanDerWaalsContact C-N 3.31Å; D1141-Y1143 PolarHBondContact O-N 3.29Å; D1141-D1144 PolarHBondContact O-N 3.47Å; D1141-Q1145 WeakPolarHBondContact O-CB 3.38Å; D1141-Q1145 WeakPolarHBondContact O-CG 3.38Å; D1141-Q1145 PolarHBondContact O-N 3.49Å
1142	L	86.1	Confident	80.3	Confident	84 Å²	84	71.8 Å²	71.8	44%	0.44	40%	0.4	S	S	.	.	H	α-helix	trans	-64.5	-35	174.1	-174.8	67.8	0	0	0	112.6	D1138 L1140 R1146	D1138-L1142 WeakPolarHBondContact O-CB 3.37Å; D1138-L1142 PolarHBondContact O-N 2.84Å; L1140-L1142 VanDerWaalsContact C-N 3.33Å; L1140-L1142 PolarHBondContact O-N 3.25Å; L1142-R1146 WeakPolarHBondContact O-CG 3.34Å; L1142-R1146 PolarHBondContact O-N 3.1Å
1143	Y	86.3	Confident	78.9	Confident	14 Å²	14	80.9 Å²	80.9	6%	0.055	44%	0.442	C	S	.	.	H	α-helix	trans	-70.2	-46.1	176.1	-161.6	-88.6	0	0	0	110.9	Y1115 E1116 A1139 L1140 D1141 R1146 L1147 Q1163 F1164 L1167	Y1115-Y1143 HydrophobicContact CD1-CE1 4.47Å; Y1115-Y1143 HydrophobicContact CE1-CD1 4.45Å; E1116-Y1143 HydrophobicContact CG-CE1 4.47Å; E1116-Y1143 PolarHBondContact OE1-OH 3.27Å; A1139-Y1143 PolarHBondContact O-N 2.93Å; A1139-Y1143 VanDerWaalsContact O-N 3.1Å; L1140-Y1143 WeakPolarHBondContact O-CB 3.36Å; L1140-Y1143 PolarHBondContact O-N 3.43Å; L1140-Y1143 VanDerWaalsContact O-N 3.08Å; D1141-Y1143 VanDerWaalsContact C-N 3.31Å; D1141-Y1143 PolarHBondContact O-N 3.29Å; Y1143-R1146 PolarHBondContact O-N 2.99Å; Y1143-L1147 HydrophobicContact CD1-CD1 3.81Å; Y1143-L1147 HydrophobicContact CD1-CG 4.24Å; Y1143-L1147 HydrophobicContact CE1-CD1 3.74Å; Y1143-L1147 HydrophobicContact CE1-CD2 4.38Å; Y1143-L1147 HydrophobicContact CE1-CG 4.14Å; Y1143-L1147 PolarHBondContact O-N 3.49Å; Y1143-Q1163 HydrophobicContact CE2-CB 4.34Å; Y1143-F1164 HydrophobicContact CD1-CD2 4.34Å; Y1143-F1164 AromaticContact CE1-CD2 3.71Å; Y1143-F1164 HydrophobicContact CE1-CD2 3.71Å; Y1143-F1164 HydrophobicContact CE1-CE2 4.15Å; Y1143-F1164 HydrophobicContact CE2-CB 4.41Å; Y1143-F1164 HydrophobicContact CE2-CD2 4.29Å; Y1143-F1164 AromaticContact CZ-CD2 3.7Å; Y1143-L1167 HydrophobicContact CD2-CD1 4.37Å; Y1143-L1167 HydrophobicContact CG-CD1 4.16Å
1144	D	86.4	Confident	78	Confident	9 Å²	9	87 Å²	87	5%	0.048	46%	0.462	C	S	.	.	H	α-helix	trans	-60.4	-45.6	177.5	-96.2	3.4	0	0	0	111.9	Y1115 R1119 R1126 L1140 D1141 R1146 L1147 V1148	Y1115-D1144 VanDerWaalsContact CE1-OD1 3.27Å; Y1115-D1144 WeakPolarHBondContact CE1-OD1 3.2Å; Y1115-D1144 PolarHBondContact OH-OD1 3.41Å; R1119-D1144 IonicContact CZ-OD2 3.33Å; R1119-D1144 IonicContact NE-OD1 3.69Å; R1119-D1144 PolarHBondContact NE-OD1 3.34Å; R1119-D1144 IonicContact NE-OD2 3.68Å; R1119-D1144 PolarHBondContact NE-OD2 2.96Å; R1119-D1144 IonicContact NH2-OD2 3.68Å; R1119-D1144 PolarHBondContact NH2-OD2 3.09Å; R1126-D1144 WeakPolarHBondContact CD-OD2 3.38Å; R1126-D1144 IonicContact NE-OD2 2.77Å; L1140-D1144 PolarHBondContact O-N 3.04Å; D1141-D1144 PolarHBondContact O-N 3.47Å; D1144-R1146 VanDerWaalsContact C-N 3.26Å; D1144-R1146 PolarHBondContact O-N 3.43Å; D1144-L1147 PolarHBondContact O-N 3.42Å; D1144-V1148 WeakPolarHBondContact O-CG2 3.35Å; D1144-V1148 PolarHBondContact O-N 3.22Å; D1144-V1148 VanDerWaalsContact O-N 3.11Å
1145	Q	84.4	Confident	77.3	Confident	128 Å²	128	81 Å²	81	60%	0.598	43%	0.434	S	S	*	.	H	α-helix	trans	-57	-40.1	177.4	-76.6	171.7	8	0	0	112.1	D1141 L1147 V1148 D1149	D1141-Q1145 WeakPolarHBondContact O-CB 3.38Å; D1141-Q1145 WeakPolarHBondContact O-CG 3.38Å; D1141-Q1145 PolarHBondContact O-N 3.49Å; Q1145-L1147 VanDerWaalsContact C-N 3.33Å; Q1145-L1147 PolarHBondContact O-N 3.2Å; Q1145-V1148 PolarHBondContact O-N 3.38Å; Q1145-D1149 VanDerWaalsContact O-CB 3.28Å; Q1145-D1149 WeakPolarHBondContact O-CB 3.13Å; Q1145-D1149 PolarHBondContact O-N 3.13Å
1146	R	82.3	Confident	76.6	Confident	114 Å²	114	82.3 Å²	82.3	43%	0.43	45%	0.454	S	S	.	.	H	α-helix	trans	-70.8	-25.4	177.9	-71.4	177.9	-174.4	160.5	8	113.9	L1142 Y1143 D1144	L1142-R1146 WeakPolarHBondContact O-CG 3.34Å; L1142-R1146 PolarHBondContact O-N 3.1Å; Y1143-R1146 PolarHBondContact O-N 2.99Å; D1144-R1146 VanDerWaalsContact C-N 3.26Å; D1144-R1146 PolarHBondContact O-N 3.43Å
1147	L	79.4	Confident	75.9	Confident	47 Å²	47	84.5 Å²	84.5	25%	0.246	46%	0.457	C	S	.	.	H	α-helix	trans	-77.9	-32.8	175.9	-70.1	174.9	0	0	0	111.9	Y1115 E1116 Y1143 D1144 Q1145	Y1115-L1147 HydrophobicContact CD1-CD1 3.92Å; Y1115-L1147 HydrophobicContact CE1-CD1 4.02Å; E1116-L1147 HydrophobicContact CB-CD2 4.04Å; E1116-L1147 HydrophobicContact CG-CD2 3.75Å; Y1143-L1147 HydrophobicContact CD1-CD1 3.81Å; Y1143-L1147 HydrophobicContact CD1-CG 4.24Å; Y1143-L1147 HydrophobicContact CE1-CD1 3.74Å; Y1143-L1147 HydrophobicContact CE1-CD2 4.38Å; Y1143-L1147 HydrophobicContact CE1-CG 4.14Å; Y1143-L1147 PolarHBondContact O-N 3.49Å; D1144-L1147 PolarHBondContact O-N 3.42Å; Q1145-L1147 VanDerWaalsContact C-N 3.33Å; Q1145-L1147 PolarHBondContact O-N 3.2Å
1148	V	72.8	Confident	75.2	Confident	103 Å²	103	87.6 Å²	87.6	62%	0.624	47%	0.467	S	S	*	.	H	α-helix	trans	-85	-31.5	-179	179.9	0	0	0	0	111.8	D1144 Q1145 S1150	D1144-V1148 WeakPolarHBondContact O-CG2 3.35Å; D1144-V1148 PolarHBondContact O-N 3.22Å; D1144-V1148 VanDerWaalsContact O-N 3.11Å; Q1145-V1148 PolarHBondContact O-N 3.38Å; V1148-S1150 PolarHBondContact O-N 3.23Å
1149	D	76.4	Confident	74.9	Confident	87 Å²	87	87.6 Å²	87.6	47%	0.465	46%	0.461	S	S	.	.			trans	-79	105.8	179.3	-171	-2.1	0	0	0	112.4	Q1145 N1151 A1152	Q1145-D1149 VanDerWaalsContact O-CB 3.28Å; Q1145-D1149 WeakPolarHBondContact O-CB 3.13Å; Q1145-D1149 PolarHBondContact O-N 3.13Å; D1149-N1151 PolarHBondContact O-N 3.44Å; D1149-N1151 VanDerWaalsContact O-N 3.14Å; D1149-N1151 PolarHBondContact OD1-N 2.79Å; D1149-A1152 HydrophobicContact CB-CB 4.38Å; D1149-A1152 PolarHBondContact O-N 3.06Å
1150	S	60.3	Low	74.6	Confident	115 Å²	115	88.7 Å²	88.7	80%	0.804	46%	0.456	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.8	-19.2	178.3	62.6	0	0	0	0	114.9	V1148	V1148-S1150 PolarHBondContact O-N 3.23Å
1151	N	56.5	Low	74.2	Confident	143 Å²	143	92 Å²	92	77%	0.765	47%	0.468	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97	-1.3	-176.5	-70.1	-35	0	0	0	113.9	D1149	D1149-N1151 PolarHBondContact O-N 3.44Å; D1149-N1151 VanDerWaalsContact O-N 3.14Å; D1149-N1151 PolarHBondContact OD1-N 2.79Å
1152	A	62.9	Low	73.8	Confident	35 Å²	35	93.6 Å²	93.6	29%	0.289	48%	0.477	S	S	.	.	S	Bend	trans	-72.4	131	-179.1	0	0	0	0	0	112.1	D1149 K1154	D1149-A1152 HydrophobicContact CB-CB 4.38Å; D1149-A1152 PolarHBondContact O-N 3.06Å; A1152-K1154 PolarHBondContact O-N 3.05Å
1153	Q	57.5	Low	73.6	Confident	197 Å²	197	92.1 Å²	92.1	92%	0.921	47%	0.468	S	S	*	.			trans	-57.2	114.4	170.6	-90.7	-177.6	-14.1	0	0	110.1	A1155	Q1153-A1155 PolarHBondContact O-N 2.88Å; Q1153-A1155 VanDerWaalsContact O-N 3.09Å
1154	K	62	Low	73.6	Confident	194 Å²	194	91.5 Å²	91.5	84%	0.843	47%	0.466	S	S	*	.			trans	-62.2	113.7	176.8	-68.5	-174.8	-179.6	-179.1	0	109.4	A1152	A1152-K1154 PolarHBondContact O-N 3.05Å
1155	A	65.3	Low	73.5	Confident	29 Å²	29	94.1 Å²	94.1	24%	0.24	48%	0.477	C	S	.	.			trans	-59.1	144.5	171.1	0	0	0	0	0	110	Q1153 K1159 R1160	Q1153-A1155 PolarHBondContact O-N 2.88Å; Q1153-A1155 VanDerWaalsContact O-N 3.09Å; A1155-K1159 HydrophobicContact CB-CB 4.5Å; A1155-K1159 HydrophobicContact CB-CD 4.28Å; A1155-R1160 HydrophobicContact CB-CG 3.81Å; A1155-R1160 WeakPolarHBondContact O-CD 3.46Å; A1155-R1160 WeakPolarHBondContact O-CG 3.27Å; A1155-R1160 PolarHBondContact O-NE 3Å; A1155-R1160 VanDerWaalsContact O-NE 3.09Å
1156	G	70.8	Confident	73.4	Confident	53 Å²	53	94.5 Å²	94.5	55%	0.546	48%	0.476	S	S	.	.			trans	-52	143.2	175.2	0	0	0	0	0	111.5	K1158 K1159 R1160	G1156-K1158 VanDerWaalsContact C-N 3.28Å; G1156-K1158 PolarHBondContact O-N 3.49Å; G1156-K1158 VanDerWaalsContact O-N 3.17Å; G1156-K1159 WeakPolarHBondContact O-CA 3.32Å; G1156-K1159 WeakPolarHBondContact O-CB 3.34Å; G1156-K1159 PolarHBondContact O-N 3Å; G1156-R1160 PolarHBondContact O-N 3.37Å; G1156-R1160 VanDerWaalsContact O-N 3.13Å
1157	E	70.6	Confident	73.6	Confident	109 Å²	109	89.6 Å²	89.6	51%	0.509	46%	0.459	S	S	.	.	H	α-helix	trans	-52.6	-42.9	-169.3	-163.9	-167.5	146	0	0	113.3	K1159 R1160 R1161	E1157-K1159 VanDerWaalsContact C-N 3.31Å; E1157-K1159 PolarHBondContact O-N 3.14Å; E1157-R1160 PolarHBondContact O-N 3.04Å; E1157-R1161 WeakPolarHBondContact O-CB 3.32Å; E1157-R1161 PolarHBondContact O-N 3.13Å; E1157-R1161 IonicContact OE1-CZ 3.86Å; E1157-R1161 IonicContact OE1-NH2 2.74Å; E1157-R1161 PolarHBondContact OE1-NH2 2.96Å
1158	K	73.2	Confident	73.9	Confident	163 Å²	163	87.4 Å²	87.4	71%	0.709	45%	0.447	S	S	*	.	H	α-helix	trans	-56.7	-43.3	175.3	-173	174.8	-177.9	175.4	0	112.5	G1156 R1161 D1162	G1156-K1158 VanDerWaalsContact C-N 3.28Å; G1156-K1158 PolarHBondContact O-N 3.49Å; G1156-K1158 VanDerWaalsContact O-N 3.17Å; K1158-R1161 PolarHBondContact O-N 3.47Å; K1158-D1162 VanDerWaalsContact O-CG 3.25Å; K1158-D1162 PolarHBondContact O-N 3.16Å
1159	K	78.4	Confident	74.3	Confident	129 Å²	129	85.3 Å²	85.3	56%	0.561	44%	0.441	S	S	*	.	H	α-helix	trans	-69.7	-35.1	-179.9	-172.5	177.1	178.1	-175.9	0	111.9	A1155 G1156 E1157 Q1163	A1155-K1159 HydrophobicContact CB-CB 4.5Å; A1155-K1159 HydrophobicContact CB-CD 4.28Å; G1156-K1159 WeakPolarHBondContact O-CA 3.32Å; G1156-K1159 WeakPolarHBondContact O-CB 3.34Å; G1156-K1159 PolarHBondContact O-N 3Å; E1157-K1159 VanDerWaalsContact C-N 3.31Å; E1157-K1159 PolarHBondContact O-N 3.14Å; K1159-Q1163 WeakPolarHBondContact O-CB 3.35Å; K1159-Q1163 VanDerWaalsContact O-CG 3.24Å; K1159-Q1163 WeakPolarHBondContact O-CG 3.3Å; K1159-Q1163 PolarHBondContact O-N 3.17Å; K1159-Q1163 VanDerWaalsContact O-N 3.09Å
1160	R	79.3	Confident	74.3	Confident	63 Å²	63	82.8 Å²	82.8	24%	0.238	44%	0.435	C	S	.	.	H	α-helix	trans	-66.6	-47.6	174.5	-69.1	-168.3	-72.3	140.9	0.7	111.1	M1112 E1116 A1155 G1156 E1157 D1162 Q1163 F1164	M1112-R1160 HydrophobicContact SD-CB 4.3Å; E1116-R1160 IonicContact OE1-CZ 3.3Å; E1116-R1160 IonicContact OE1-NH1 3.52Å; E1116-R1160 PolarHBondContact OE1-NH1 2.69Å; E1116-R1160 IonicContact OE2-CZ 3.68Å; E1116-R1160 IonicContact OE2-NH1 3.89Å; E1116-R1160 PolarHBondContact OE2-NH1 3.46Å; A1155-R1160 HydrophobicContact CB-CG 3.81Å; A1155-R1160 WeakPolarHBondContact O-CD 3.46Å; A1155-R1160 WeakPolarHBondContact O-CG 3.27Å; A1155-R1160 PolarHBondContact O-NE 3Å; A1155-R1160 VanDerWaalsContact O-NE 3.09Å; G1156-R1160 PolarHBondContact O-N 3.37Å; G1156-R1160 VanDerWaalsContact O-N 3.13Å; E1157-R1160 PolarHBondContact O-N 3.04Å; R1160-D1162 PolarHBondContact O-N 3.01Å; R1160-Q1163 WeakPolarHBondContact O-CB 3.4Å; R1160-Q1163 PolarHBondContact O-N 3.22Å; R1160-Q1163 VanDerWaalsContact O-N 3.12Å; R1160-F1164 WeakPolarHBondContact O-CB 3.34Å; R1160-F1164 PolarHBondContact O-N 2.72Å
1161	R	80.1	Confident	75.4	Confident	69 Å²	69	77.6 Å²	77.6	26%	0.26	40%	0.399	S	S	.	.	H	α-helix	trans	-55.1	-47.8	175.2	-168.8	-178.6	-66	-162	-2.1	112.4	N1109 M1112 E1157 K1158 Q1163 F1164 K1165	N1109-R1161 VanDerWaalsContact ND2-CZ 3.28Å; N1109-R1161 PolarHBondContact ND2-NH1 3.01Å; N1109-R1161 WeakPolarHBondContact OD1-CD 3.25Å; N1109-R1161 WeakPolarHBondContact OD1-CG 3.47Å; N1109-R1161 PolarHBondContact OD1-NE 2.99Å; M1112-R1161 HydrophobicContact SD-CB 4.24Å; E1157-R1161 WeakPolarHBondContact O-CB 3.32Å; E1157-R1161 PolarHBondContact O-N 3.13Å; E1157-R1161 IonicContact OE1-CZ 3.86Å; E1157-R1161 IonicContact OE1-NH2 2.74Å; E1157-R1161 PolarHBondContact OE1-NH2 2.96Å; K1158-R1161 PolarHBondContact O-N 3.47Å; R1161-Q1163 VanDerWaalsContact C-N 3.34Å; R1161-Q1163 PolarHBondContact O-N 3.36Å; R1161-F1164 PolarHBondContact O-N 3.38Å; R1161-K1165 VanDerWaalsContact O-CB 3.32Å; R1161-K1165 WeakPolarHBondContact O-CB 3.21Å; R1161-K1165 PolarHBondContact O-N 3.24Å
1162	D	78.8	Confident	76.7	Confident	80 Å²	80	72.6 Å²	72.6	43%	0.428	37%	0.372	S	S	.	.	H	α-helix	trans	-66.4	-33.7	177.8	-69.9	-19.5	0	0	0	113.1	K1158 R1160 K1166	K1158-D1162 VanDerWaalsContact O-CG 3.25Å; K1158-D1162 PolarHBondContact O-N 3.16Å; R1160-D1162 PolarHBondContact O-N 3.01Å; D1162-K1166 WeakPolarHBondContact O-CG 3.35Å
1163	Q	82.8	Confident	77.2	Confident	53 Å²	53	71.4 Å²	71.4	25%	0.248	36%	0.363	C	S	.	.	H	α-helix	trans	-69	-45.6	174.5	-77.3	174.3	5.8	0	0	111	Y1143 K1159 R1160 R1161 K1166	Y1143-Q1163 HydrophobicContact CE2-CB 4.34Å; K1159-Q1163 WeakPolarHBondContact O-CB 3.35Å; K1159-Q1163 VanDerWaalsContact O-CG 3.24Å; K1159-Q1163 WeakPolarHBondContact O-CG 3.3Å; K1159-Q1163 PolarHBondContact O-N 3.17Å; K1159-Q1163 VanDerWaalsContact O-N 3.09Å; R1160-Q1163 WeakPolarHBondContact O-CB 3.4Å; R1160-Q1163 PolarHBondContact O-N 3.22Å; R1160-Q1163 VanDerWaalsContact O-N 3.12Å; R1161-Q1163 VanDerWaalsContact C-N 3.34Å; R1161-Q1163 PolarHBondContact O-N 3.36Å; Q1163-K1166 WeakPolarHBondContact O-CB 3.45Å; Q1163-K1166 PolarHBondContact O-N 2.95Å
1164	F	84.9	Confident	77.9	Confident	1 Å²	1	66.4 Å²	66.4	0%	0.004	34%	0.338	C	S	.	.	H	α-helix	trans	-68.1	-41.5	-178.7	-164	-97.2	0	0	0	112.3	Y1087 A1111 M1112 Y1115 M1129 Y1143 R1160 R1161 K1166 L1167 L1168	Y1087-F1164 WeakPolarHBondContact OH-CZ 3.42Å; A1111-F1164 HydrophobicContact CB-CE1 3.9Å; M1112-F1164 HydrophobicContact CB-CB 4.38Å; M1112-F1164 HydrophobicContact CB-CD1 3.55Å; M1112-F1164 HydrophobicContact CB-CE1 3.85Å; M1112-F1164 HydrophobicContact CB-CG 3.9Å; M1112-F1164 HydrophobicContact CB-CZ 4.46Å; M1112-F1164 HydrophobicContact CG-CB 4.07Å; M1112-F1164 HydrophobicContact CG-CD1 4.07Å; M1112-F1164 HydrophobicContact CG-CD2 4.26Å; M1112-F1164 HydrophobicContact CG-CG 3.87Å; M1112-F1164 VanDerWaalsContact N-CE1 3.27Å; M1112-F1164 HydrophobicContact SD-CB 4.24Å; Y1115-F1164 AromaticContact CD1-CE2 3.78Å; Y1115-F1164 HydrophobicContact CD1-CE2 3.78Å; Y1115-F1164 HydrophobicContact CD1-CZ 4.38Å; Y1115-F1164 AromaticContact CG-CE2 3.85Å; Y1115-F1164 HydrophobicContact CG-CE2 3.85Å; Y1115-F1164 AromaticContact CG-CZ 3.98Å; Y1115-F1164 HydrophobicContact CG-CZ 3.98Å; M1129-F1164 HydrophobicContact CE-CE2 4.36Å; M1129-F1164 HydrophobicContact CE-CZ 4.42Å; Y1143-F1164 HydrophobicContact CD1-CD2 4.34Å; Y1143-F1164 AromaticContact CE1-CD2 3.71Å; Y1143-F1164 HydrophobicContact CE1-CD2 3.71Å; Y1143-F1164 HydrophobicContact CE1-CE2 4.15Å; Y1143-F1164 HydrophobicContact CE2-CB 4.41Å; Y1143-F1164 HydrophobicContact CE2-CD2 4.29Å; Y1143-F1164 AromaticContact CZ-CD2 3.7Å; R1160-F1164 WeakPolarHBondContact O-CB 3.34Å; R1160-F1164 PolarHBondContact O-N 2.72Å; R1161-F1164 PolarHBondContact O-N 3.38Å; F1164-K1166 PolarHBondContact O-N 3.35Å; F1164-K1166 VanDerWaalsContact O-N 3.16Å; F1164-L1167 HydrophobicContact CD2-CD1 4.29Å; F1164-L1167 WeakPolarHBondContact O-CB 3.25Å; F1164-L1167 PolarHBondContact O-N 3.05Å; F1164-L1168 HydrophobicContact CD1-CD1 3.95Å; F1164-L1168 HydrophobicContact CD1-CG 4.3Å; F1164-L1168 HydrophobicContact CE1-CD1 3.53Å; F1164-L1168 HydrophobicContact CE1-CG 4Å; F1164-L1168 HydrophobicContact CZ-CD1 4.46Å; F1164-L1168 PolarHBondContact O-N 3.25Å
1165	K	84.3	Confident	78.2	Confident	65 Å²	65	58.4 Å²	58.4	28%	0.283	31%	0.308	S	S	.	.	H	α-helix	trans	-56.3	-32.4	174.7	-175.8	168.1	178.7	166.4	0	112.7	N1104 R1161 L1168 A1169	N1104-K1165 WeakPolarHBondContact OD1-CE 3.41Å; N1104-K1165 PolarHBondContact OD1-NZ 2.87Å; R1161-K1165 VanDerWaalsContact O-CB 3.32Å; R1161-K1165 WeakPolarHBondContact O-CB 3.21Å; R1161-K1165 PolarHBondContact O-N 3.24Å; K1165-L1168 PolarHBondContact O-N 3.07Å; K1165-A1169 PolarHBondContact O-N 2.93Å
1166	K	83.2	Confident	77.8	Confident	135 Å²	135	62.8 Å²	62.8	59%	0.587	33%	0.327	S	S	*	.	H	α-helix	trans	-69.3	-34.7	174.8	-70.6	169.2	-175.3	171.6	0	113	D1162 Q1163 F1164 L1168 A1169	D1162-K1166 WeakPolarHBondContact O-CG 3.35Å; Q1163-K1166 WeakPolarHBondContact O-CB 3.45Å; Q1163-K1166 PolarHBondContact O-N 2.95Å; F1164-K1166 PolarHBondContact O-N 3.35Å; F1164-K1166 VanDerWaalsContact O-N 3.16Å; K1166-L1168 VanDerWaalsContact C-N 3.27Å; K1166-L1168 PolarHBondContact O-N 2.75Å; K1166-A1169 WeakPolarHBondContact O-CB 3.35Å; K1166-A1169 PolarHBondContact O-N 3.38Å
1167	L	85.9	Confident	76.6	Confident	12 Å²	12	65.1 Å²	65.1	6%	0.063	33%	0.334	C	S	.	.	H	α-helix	trans	-65.6	-35.1	176.3	-63.3	174.2	0	0	0	111	M1129 I1135 A1139 L1140 Y1143 F1164 A1169	M1129-L1167 HydrophobicContact CE-CB 3.85Å; M1129-L1167 HydrophobicContact CE-CD1 4.23Å; I1135-L1167 HydrophobicContact CD1-CB 4.32Å; I1135-L1167 HydrophobicContact CG1-CD2 4.36Å; A1139-L1167 HydrophobicContact CB-CD2 3.91Å; L1140-L1167 HydrophobicContact CD1-CD1 4.26Å; Y1143-L1167 HydrophobicContact CD2-CD1 4.37Å; Y1143-L1167 HydrophobicContact CG-CD1 4.16Å; F1164-L1167 HydrophobicContact CD2-CD1 4.29Å; F1164-L1167 WeakPolarHBondContact O-CB 3.25Å; F1164-L1167 PolarHBondContact O-N 3.05Å; L1167-A1169 VanDerWaalsContact C-N 3.35Å
1168	L	86.8	Confident	76	Confident	0 Å²	0	64.6 Å²	64.6	0%	0	33%	0.331	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.1	4	-179.3	-62.4	-173.5	0	0	0	114.9	L1091 L1094 A1111 M1129 V1132 F1164 K1165 K1166 G1170 T1171 I1172	L1091-L1168 HydrophobicContact CD2-CD1 4.28Å; L1091-L1168 HydrophobicContact CD2-CD2 3.68Å; L1094-L1168 HydrophobicContact CD1-CD1 3.85Å; A1111-L1168 HydrophobicContact CB-CD1 3.67Å; M1129-L1168 HydrophobicContact CE-CD2 3.91Å; M1129-L1168 HydrophobicContact SD-CD2 3.62Å; V1132-L1168 HydrophobicContact CG2-CD2 4.32Å; F1164-L1168 HydrophobicContact CD1-CD1 3.95Å; F1164-L1168 HydrophobicContact CD1-CG 4.3Å; F1164-L1168 HydrophobicContact CE1-CD1 3.53Å; F1164-L1168 HydrophobicContact CE1-CG 4Å; F1164-L1168 HydrophobicContact CZ-CD1 4.46Å; F1164-L1168 PolarHBondContact O-N 3.25Å; K1165-L1168 PolarHBondContact O-N 3.07Å; K1166-L1168 VanDerWaalsContact C-N 3.27Å; K1166-L1168 PolarHBondContact O-N 2.75Å; L1168-G1170 PolarHBondContact O-N 3.23Å; L1168-G1170 VanDerWaalsContact O-N 3.13Å; L1168-T1171 PolarHBondContact O-N 2.94Å; L1168-T1171 PolarHBondContact O-OG1 2.77Å; L1168-I1172 PolarHBondContact O-N 2.77Å
1169	A	80.9	Confident	75.1	Confident	60 Å²	60	62.1 Å²	62.1	50%	0.496	32%	0.322	S	S	.	.	G	3₁₀ helix	trans	-57.3	-34.6	-171.8	0	0	0	0	0	113.6	K1165 K1166 L1167 T1171 I1172	K1165-A1169 PolarHBondContact O-N 2.93Å; K1166-A1169 WeakPolarHBondContact O-CB 3.35Å; K1166-A1169 PolarHBondContact O-N 3.38Å; L1167-A1169 VanDerWaalsContact C-N 3.35Å; A1169-T1171 VanDerWaalsContact C-N 3.29Å; A1169-T1171 PolarHBondContact O-N 3.44Å; A1169-I1172 PolarHBondContact O-N 3.44Å
1170	G	76.4	Confident	73.9	Confident	34 Å²	34	63.9 Å²	63.9	35%	0.351	33%	0.33	S	S	.	.	G	3₁₀ helix	trans	-74.6	-12.2	179.1	0	0	0	0	0	115.5	P1133 L1168	P1133-G1170 WeakPolarHBondContact O-CA 3.34Å; L1168-G1170 PolarHBondContact O-N 3.23Å; L1168-G1170 VanDerWaalsContact O-N 3.13Å
1171	T	83.3	Confident	72.7	Confident	6 Å²	6	66.7 Å²	66.7	4%	0.037	34%	0.341	C	S	.	.	G	3₁₀ helix	trans	-97.9	-9.8	174	38.8	0	0	0	0	113.6	L1094 Q1095 V1132 L1168 A1169 G1173	L1094-T1171 CarbonylContact C-O 3.6Å; Q1095-T1171 VanDerWaalsContact CA-O 3.24Å; Q1095-T1171 WeakPolarHBondContact CA-O 3.47Å; Q1095-T1171 WeakPolarHBondContact CG-O 3.46Å; Q1095-T1171 PolarHBondContact N-O 3.06Å; V1132-T1171 HydrophobicContact CB-CG2 4.39Å; V1132-T1171 HydrophobicContact CG1-CG2 4.01Å; V1132-T1171 HydrophobicContact CG2-CG2 4.01Å; L1168-T1171 PolarHBondContact O-N 2.94Å; L1168-T1171 PolarHBondContact O-OG1 2.77Å; A1169-T1171 VanDerWaalsContact C-N 3.29Å; A1169-T1171 PolarHBondContact O-N 3.44Å; T1171-G1173 PolarHBondContact O-N 3.23Å
1172	I	82.5	Confident	71.5	Confident	37 Å²	37	68.8 Å²	68.8	19%	0.19	35%	0.352	C	S	.	.	S	Bend	trans	-71.6	120	-179.3	-63	173.2	0	0	0	108.6	G1098 N1104 L1168 A1169 K1174	G1098-I1172 WeakPolarHBondContact O-CG2 3.41Å; N1104-I1172 WeakPolarHBondContact ND2-CG2 3.36Å; L1168-I1172 PolarHBondContact O-N 2.77Å; A1169-I1172 PolarHBondContact O-N 3.44Å; I1172-K1174 PolarHBondContact O-N 2.63Å
1173	G	75.3	Confident	70.3	Confident	11 Å²	11	71.6 Å²	71.6	11%	0.113	36%	0.363	C	S	.	.			trans	-53.5	134.9	176	0	0	0	0	0	111.8	L1094 Q1095 G1098 Q1099 T1171	L1094-G1173 PolarHBondContact O-N 2.9Å; Q1095-G1173 WeakPolarHBondContact O-CA 3.42Å; G1098-G1173 CarbonylContact C-O 3.44Å; Q1099-G1173 WeakPolarHBondContact CA-O 3.42Å; Q1099-G1173 PolarHBondContact N-O 3.42Å; T1171-G1173 PolarHBondContact O-N 3.23Å
1174	K	72.1	Confident	69	Low	91 Å²	91	70.8 Å²	70.8	40%	0.396	36%	0.361	S	S	.	.			trans	-105.1	149	174.8	-59.2	-178.8	-174.3	171.7	0	109	I1172 Q1178 Q1179 E1183	I1172-K1174 PolarHBondContact O-N 2.63Å; K1174-Q1178 HydrophobicContact CB-CB 3.93Å; K1174-Q1178 HydrophobicContact CD-CB 4.46Å; K1174-Q1179 HydrophobicContact CB-CG 4.32Å; K1174-Q1179 PolarHBondContact O-NE2 3.42Å; K1174-E1183 IonicContact NZ-OE1 3.98Å; K1174-E1183 PolarHBondContact NZ-OE1 3.38Å
1175	A	66.8	Low	67.4	Low	26 Å²	26	76.9 Å²	76.9	22%	0.215	39%	0.389	C	S	.	.			trans	-56.8	150	172.8	0	0	0	0	0	111.5	C1177 Q1178 Q1179	A1175-C1177 PolarHBondContact O-N 3.26Å; A1175-C1177 VanDerWaalsContact O-N 3.17Å; A1175-Q1178 HydrophobicContact CB-CG 4.41Å; A1175-Q1178 WeakPolarHBondContact O-CA 3.4Å; A1175-Q1178 VanDerWaalsContact O-CB 3.3Å; A1175-Q1178 WeakPolarHBondContact O-CB 3.46Å; A1175-Q1178 PolarHBondContact O-N 2.72Å; A1175-Q1179 PolarHBondContact O-N 2.85Å; A1175-Q1179 VanDerWaalsContact O-N 3.16Å
1176	L	57.5	Low	66.4	Low	121 Å²	121	74.1 Å²	74.1	63%	0.634	38%	0.377	S	S	*	.	H	α-helix	trans	-49.4	-43.5	180	-87.6	152.1	0	0	0	112.4	Q1178 Q1179 F1180	L1176-Q1178 PolarHBondContact O-N 3.08Å; L1176-Q1178 VanDerWaalsContact O-N 3.08Å; L1176-Q1179 PolarHBondContact O-N 3.23Å; L1176-F1180 HydrophobicContact CD2-CE2 3.88Å
1177	C	45	Very low	65.2	Low	102 Å²	102	74.1 Å²	74.1	69%	0.689	37%	0.374	S	S	*	.	H	α-helix	trans	-61.6	-17.9	176.4	63.7	0	0	0	0	114.4	A1175	A1175-C1177 PolarHBondContact O-N 3.26Å; A1175-C1177 VanDerWaalsContact O-N 3.17Å
1178	Q	58.3	Low	63.9	Low	98 Å²	98	78 Å²	78	46%	0.458	40%	0.395	S	S	.	.	H	α-helix	trans	-98.3	-20.8	176.1	-60.2	178.5	3.3	0	0	112.8	K1174 A1175 L1176	K1174-Q1178 HydrophobicContact CB-CB 3.93Å; K1174-Q1178 HydrophobicContact CD-CB 4.46Å; A1175-Q1178 HydrophobicContact CB-CG 4.41Å; A1175-Q1178 WeakPolarHBondContact O-CA 3.4Å; A1175-Q1178 VanDerWaalsContact O-CB 3.3Å; A1175-Q1178 WeakPolarHBondContact O-CB 3.46Å; A1175-Q1178 PolarHBondContact O-N 2.72Å; L1176-Q1178 PolarHBondContact O-N 3.08Å; L1176-Q1178 VanDerWaalsContact O-N 3.08Å
1179	Q	54.8	Low	63	Low	111 Å²	111	79.2 Å²	79.2	52%	0.519	40%	0.401	S	S	.	.	H	α-helix	trans	-74.4	-45.8	-177.5	-70.9	-175	6.6	0	0	112.5	K1174 A1175 L1176 R1181	K1174-Q1179 HydrophobicContact CB-CG 4.32Å; K1174-Q1179 PolarHBondContact O-NE2 3.42Å; A1175-Q1179 PolarHBondContact O-N 2.85Å; A1175-Q1179 VanDerWaalsContact O-N 3.16Å; L1176-Q1179 PolarHBondContact O-N 3.23Å; Q1179-R1181 PolarHBondContact O-N 2.89Å
1180	F	53.4	Low	62	Low	166 Å²	166	80.8 Å²	80.8	73%	0.728	41%	0.406	S	S	*	.	S	Bend	trans	-82	3.6	179.2	-61.3	-70.5	0	0	0	113.7	L1176 K1182	L1176-F1180 HydrophobicContact CD2-CE2 3.88Å; F1180-K1182 PolarHBondContact O-N 3.15Å
1181	R	54.3	Low	60.9	Low	122 Å²	122	81.4 Å²	81.4	46%	0.46	41%	0.405	S	S	.	.	S	Bend	trans	-84.9	115.6	179.5	-165.4	173.5	180	175.8	-1.5	109.4	Q1179 E1183	Q1179-R1181 PolarHBondContact O-N 2.89Å; R1181-E1183 PolarHBondContact O-N 3.07Å; R1181-E1183 VanDerWaalsContact O-N 3.16Å
1182	K	54.3	Low	59.7	Low	114 Å²	114	85.5 Å²	85.5	50%	0.496	43%	0.426	S	S	.	.			trans	-50.7	121.7	172.2	-168	174.8	-172.5	169.5	0	109.6	E41 F76 F1180 V1184	E41-K1182 IonicContact OE1-NZ 2.81Å; E41-K1182 PolarHBondContact OE1-NZ 2.9Å; F76-K1182 HydrophobicContact CD1-CD 3.92Å; F76-K1182 HydrophobicContact CD1-CG 3.97Å; F76-K1182 HydrophobicContact CE1-CB 3.61Å; F76-K1182 HydrophobicContact CE1-CD 3.61Å; F76-K1182 HydrophobicContact CE1-CG 3.44Å; F76-K1182 VanDerWaalsContact CE1-CG 3.44Å; F76-K1182 HydrophobicContact CE2-CD 4.33Å; F76-K1182 HydrophobicContact CG-CD 4.42Å; F76-K1182 HydrophobicContact CZ-CB 3.83Å; F76-K1182 HydrophobicContact CZ-CD 3.83Å; F76-K1182 HydrophobicContact CZ-CG 4Å; F1180-K1182 PolarHBondContact O-N 3.15Å; K1182-V1184 PolarHBondContact O-N 2.7Å
1183	E	53.2	Low	58.4	Low	139 Å²	139	87.8 Å²	87.8	65%	0.65	44%	0.435	S	S	*	.			trans	-65.6	127	-175.9	-71.1	-163.8	157.7	0	0	110.7	K1174 R1181	K1174-E1183 IonicContact NZ-OE1 3.98Å; K1174-E1183 PolarHBondContact NZ-OE1 3.38Å; R1181-E1183 PolarHBondContact O-N 3.07Å; R1181-E1183 VanDerWaalsContact O-N 3.16Å
1184	V	55.9	Low	56.9	Low	36 Å²	36	96.2 Å²	96.2	22%	0.218	47%	0.469	C	S	.	.			trans	-90.6	108.7	179.1	178.5	0	0	0	0	108.4	K75 F76 K1182 I1186	K75-V1184 HydrophobicContact CB-CG1 4.35Å; K75-V1184 HydrophobicContact CB-CG2 4.16Å; K75-V1184 HydrophobicContact CD-CG2 4.29Å; K75-V1184 HydrophobicContact CG-CG1 4.38Å; K75-V1184 HydrophobicContact CG-CG2 4.14Å; F76-V1184 HydrophobicContact CD1-CG2 4.26Å; F76-V1184 HydrophobicContact CE1-CG2 3.7Å; F76-V1184 HydrophobicContact CZ-CG2 4.17Å; K1182-V1184 PolarHBondContact O-N 2.7Å; V1184-I1186 HydrophobicContact CG1-CG1 4.22Å; V1184-I1186 PolarHBondContact O-N 3.43Å
1185	H	52.3	Low	55.2	Low	128 Å²	128	101 Å²	101	59%	0.593	49%	0.49	S	S	*	.			trans	-79.8	117.5	178.4	-170.9	70.8	0	0	0	111.3	N79	N79-H1185 PolarHBondContact ND2-O 3.19Å
1186	I	62.2	Low	53.7	Low	7 Å²	7	105.5 Å²	105.5	4%	0.036	52%	0.516	C	S	.	.			trans	-112	118.9	174.6	-56.8	177.6	0	0	0	108.6	K124 R125 L169 P170 R173 V1184	K124-I1186 HydrophobicContact CB-CD1 4.18Å; R125-I1186 HydrophobicContact CG-CG2 4.35Å; L169-I1186 HydrophobicContact CD2-CD1 4.32Å; P170-I1186 HydrophobicContact CG-CB 4.24Å; R173-I1186 HydrophobicContact CG-CG2 4.16Å; V1184-I1186 HydrophobicContact CG1-CG1 4.22Å; V1184-I1186 PolarHBondContact O-N 3.43Å
1187	R	58.9	Low	52.4	Low	135 Å²	135	108.6 Å²	108.6	51%	0.509	53%	0.525	S	S	.	.	P	Polyproline II helix	trans	-65.4	135.3	176.1	-71.4	-178.3	-179	170.5	7.5	110.1	N79 L1189	N79-R1187 PolarHBondContact O-NH1 2.88Å; N79-R1187 PolarHBondContact O-NH2 3.37Å; R1187-L1189 PolarHBondContact O-N 3.47Å
1188	N	58.8	Low	52.1	Low	94 Å²	94	109.5 Å²	109.5	50%	0.503	53%	0.529	S	S	.	.	P	Polyproline II helix	trans	-69.7	129.3	171.6	-66.7	-47.4	0	0	0	109.4
1189	L	66.7	Low	50.9	Low	25 Å²	25	111.7 Å²	111.7	13%	0.131	54%	0.544	C	S	.	.	P	Polyproline II helix	trans	-84.9	156	172.1	-63.3	-171.2	0	0	0	110.2	Q129 H130 R1187 S1191	Q129-L1189 HydrophobicContact CB-CB 4.19Å; Q129-L1189 HydrophobicContact CB-CD1 3.86Å; Q129-L1189 HydrophobicContact CG-CB 3.85Å; Q129-L1189 HydrophobicContact CG-CD1 4.36Å; H130-L1189 HydrophobicContact CB-CD1 4.48Å; H130-L1189 WeakPolarHBondContact CE1-CD2 3.48Å; H130-L1189 WeakPolarHBondContact ND1-CD1 3.39Å; R1187-L1189 PolarHBondContact O-N 3.47Å; L1189-S1191 PolarHBondContact O-N 3.35Å
1190	P	59.9	Low	50.1	Low	93 Å²	93	116 Å²	116	60%	0.604	56%	0.561	S	S	*	*	P	Polyproline II helix	trans	-54.9	132.5	175.6	20.5	-31.5	0	0	0	110.6	Q129 L1192	Q129-P1190 WeakPolarHBondContact CG-O 3.35Å; Q129-P1190 PolarHBondContact NE2-O 3.17Å; P1190-L1192 PolarHBondContact O-N 3.42Å
1191	S	54.1	Low	49.3	Very low	47 Å²	47	114.7 Å²	114.7	33%	0.329	56%	0.562	S	S	.	*	P	Polyproline II helix	trans	-63.7	128.6	-178.9	-174.8	0	0	0	0	110.3	L1189 F1193	L1189-S1191 PolarHBondContact O-N 3.35Å; S1191-F1193 PolarHBondContact O-N 3.11Å; S1191-F1193 PolarHBondContact OG-N 3.45Å; S1191-F1193 PolarHBondContact OG-O 2.99Å
1192	L	57.3	Low	48.7	Very low	93 Å²	93	116.1 Å²	116.1	49%	0.487	58%	0.577	S	S	.	*	S	Bend	trans	-65.5	-28.9	173.6	-69.3	175	0	0	0	111.7	P128 Q129 P1190	P128-L1192 HydrophobicContact CB-CD1 3.72Å; P128-L1192 HydrophobicContact CG-CD1 3.41Å; P128-L1192 VanDerWaalsContact CG-CD1 3.41Å; P128-L1192 HydrophobicContact CG-CG 4.44Å; Q129-L1192 HydrophobicContact CB-CD2 4.46Å; Q129-L1192 HydrophobicContact CG-CD1 4.4Å; Q129-L1192 HydrophobicContact CG-CD2 3.88Å; Q129-L1192 HydrophobicContact CG-CG 3.82Å; P1190-L1192 PolarHBondContact O-N 3.42Å
1193	F	54.7	Low	47.9	Very low	85 Å²	85	117.3 Å²	117.3	37%	0.373	59%	0.594	S	S	.	*			trans	-109.5	78.4	-175	-54.6	-72.4	0	0	0	109.5	Q179 Q183 S1191 K1195	Q179-F1193 HydrophobicContact CG-CD2 4.48Å; Q183-F1193 VanDerWaalsContact CD-CZ 3.42Å; Q183-F1193 VanDerWaalsContact NE2-CE1 3.29Å; Q183-F1193 VanDerWaalsContact OE1-CE2 3.23Å; S1191-F1193 PolarHBondContact O-N 3.11Å; S1191-F1193 PolarHBondContact OG-N 3.45Å; S1191-F1193 PolarHBondContact OG-O 2.99Å; F1193-K1195 PolarHBondContact O-N 3.03Å
1194	K	44.6	Very low	47	Very low	188 Å²	188	118.4 Å²	118.4	82%	0.817	60%	0.599	S	S	*	*	P	Polyproline II helix	trans	-65.7	118.3	161.2	-74.6	-177.8	179.6	175	0	107
1195	K	37	Very low	45.9	Very low	192 Å²	192	122.2 Å²	122.2	84%	0.835	62%	0.622	S	S	*	*	P	Polyproline II helix	trans	-53.4	127	159.6	-78.7	-173.4	176	-174.2	0	106.4	F1193 K1197	F1193-K1195 PolarHBondContact O-N 3.03Å; K1195-K1197 PolarHBondContact O-N 3.39Å
1196	P	34	Very low	45	Very low	120 Å²	120	123.5 Å²	123.5	78%	0.779	63%	0.628	S	S	*	*	P	Polyproline II helix	trans	-54.9	121.8	169.7	21.8	-28.5	0	0	0	106.1
1197	K	31.2	Very low	43.7	Very low	186 Å²	186	130.2 Å²	130.2	81%	0.809	66%	0.659	S	S	*	*	P	Polyproline II helix	trans	-58.2	131.8	162.6	-79.1	-179.9	175.1	179	0	104.4	K1195 D1199	K1195-K1197 PolarHBondContact O-N 3.39Å; K1197-D1199 PolarHBondContact O-N 3.35Å
1198	P	37.9	Very low	42.5	Very low	121 Å²	121	131.8 Å²	131.8	79%	0.786	68%	0.677	S	S	*	*	P	Polyproline II helix	trans	-54.6	121.4	164.6	23.9	-29.7	0	0	0	105.8	K1200	P1198-K1200 PolarHBondContact O-N 3.22Å
1199	D	32.7	Very low	41.5	Very low	144 Å²	144	130.1 Å²	130.1	77%	0.77	68%	0.682	S	S	*	*	P	Polyproline II helix	trans	-52.7	119.4	174.8	-88.6	-38.9	0	0	0	106.9	K1197 D1201	K1197-D1199 PolarHBondContact O-N 3.35Å; D1199-D1201 PolarHBondContact O-N 3.34Å
1200	K	39.6	Very low	40.3	Very low	202 Å²	202	135.2 Å²	135.2	88%	0.878	71%	0.709	S	S	*	*			trans	-73	92.6	159.3	-81.1	-172.6	173.1	-172.6	0	104.3	P1198 I1202	P1198-K1200 PolarHBondContact O-N 3.22Å; K1200-I1202 PolarHBondContact O-N 2.95Å
1201	D	36.6	Very low	39.3	Very low	138 Å²	138	135.4 Å²	135.4	74%	0.738	72%	0.718	S	S	*	*			trans	-52.3	123.3	168	-81.7	-34.1	0	0	0	108.7	D1199 V1203	D1199-D1201 PolarHBondContact O-N 3.34Å; D1201-V1203 PolarHBondContact O-N 2.96Å
1202	I	41.6	Very low	38.8	Very low	151 Å²	151	137.6 Å²	137.6	77%	0.774	74%	0.739	S	S	*	*			trans	-59.1	110	165.6	-64.4	162.2	0	0	0	106	K1200 E1204	K1200-I1202 PolarHBondContact O-N 2.95Å; I1202-E1204 HydrophobicContact CG2-CB 4.35Å
1203	V	36.7	Very low	37.9	Very low	140 Å²	140	139.1 Å²	139.1	85%	0.848	75%	0.747	S	S	*	*			trans	-99.9	87.6	160.7	-178.2	0	0	0	0	106.9	D1201	D1201-V1203 PolarHBondContact O-N 2.96Å
1204	E	34.1	Very low	37.4	Very low	162 Å²	162	143.7 Å²	143.7	76%	0.757	77%	0.767	S	S	*	*			trans	-94.9	127.4	151	-105.7	-178.3	179.9	0	0	107.5	I1202	I1202-E1204 HydrophobicContact CG2-CB 4.35Å
1205	T	32.4	Very low	37.2	Very low	115 Å²	115	138.9 Å²	138.9	71%	0.706	76%	0.757	S	S	*	*			trans	63.6	113	153.1	25.9	0	0	0	0	120.7
1206	E	34.4	Very low	37.6	Very low	156 Å²	156	135.9 Å²	135.9	73%	0.729	76%	0.757	S	S	*	*			trans	70	118.4	130.4	-73.2	-172.2	159.1	0	0	122
1207	Q	33.5	Very low	37.6	Very low	147 Å²	147	138.7 Å²	138.7	69%	0.687	76%	0.76	S	S	*	*			trans	83.1	124.9	131.2	-72.2	-175.4	16.8	0	0	120.4
1208	L	35	Very low	37.7	Very low	169 Å²	169	134.1 Å²	134.1	89%	0.885	75%	0.751	S	S	*	*			trans	75.7	132.5	153.6	-56	149.1	0	0	0	114.3
1209	G	38.3	Very low	37.4	Very low	59 Å²	59	135.4 Å²	135.4	61%	0.608	75%	0.752	S	S	*	*			cis	149.8	103.7	19.1	0	0	0	0	0	105.8
1210	L	40.8	Very low	37.5	Very low	132 Å²	132	132.9 Å²	132.9	69%	0.691	75%	0.751	S	S	*	*	S	Bend	trans	-166.6	-18.7	168.8	-110.6	143.4	0	0	0	111.5	A1212	L1210-A1212 PolarHBondContact O-N 2.9Å
1211	A	39.8	Very low	37.1	Very low	97 Å²	97	135.2 Å²	135.2	80%	0.802	77%	0.772	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.6	-6.3	166.1	0	0	0	0	0	114
1212	A	42.4	Very low	37.1	Very low	92 Å²	92	135.1 Å²	135.1	76%	0.76	77%	0.773	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.3	-0.7	179.3	0	0	0	0	0	114.4	L1210	L1210-A1212 PolarHBondContact O-N 2.9Å
1213	L	38.3	Very low	36.9	Very low	126 Å²	126	134.2 Å²	134.2	66%	0.66	77%	0.773	S	S	*	*	S	Bend	trans	-98.7	-8.6	-176.2	-96	153.4	0	0	0	114.5
1214	F	45.4	Very low	36.9	Very low	180 Å²	180	133.9 Å²	133.9	79%	0.789	77%	0.769	S	S	*	*	S	Bend	trans	-139.4	11.1	-170.7	-61	-71.9	0	0	0	115.7
1215	S	39.3	Very low	37.1	Very low	87 Å²	87	132.2 Å²	132.2	61%	0.608	77%	0.77	S	S	*	*	S	Bend	trans	-98.1	123.6	167.4	68.1	0	0	0	0	110.7	E1217	S1215-E1217 PolarHBondContact O-N 3.05Å
1216	P	44.6	Very low	37.4	Very low	129 Å²	129	133.3 Å²	133.3	84%	0.838	77%	0.774	S	S	*	*			trans	-64.7	120.8	172.6	-11.6	25.9	0	0	0	110.1
1217	E	35.2	Very low	37.5	Very low	180 Å²	180	131.8 Å²	131.8	84%	0.841	78%	0.777	S	S	*	*			trans	-39.9	152.8	153.1	-69.3	178.1	169.1	0	0	111.7	S1215	S1215-E1217 PolarHBondContact O-N 3.05Å
1218	S	33.2	Very low	37.8	Very low	89 Å²	89	130.7 Å²	130.7	62%	0.622	78%	0.783	S	S	*	*			cis	-177.3	160.5	1.2	46	0	0	0	0	107.8
1219	N	32	Very low	38.1	Very low	149 Å²	149	127.8 Å²	127.8	80%	0.797	78%	0.775	S	S	*	*			trans	134.8	94.6	149.5	-69.3	-29.7	0	0	0	110.9
1220	A	33.4	Very low	38	Very low	91 Å²	91	133.5 Å²	133.5	75%	0.752	79%	0.789	S	S	*	*				75.2	83.9	72.5	0	0	0	0	0	112.7
1221	L	32	Very low	37.8	Very low	250 Å²	250	133.6 Å²	133.6	100%	1.309	80%	0.798	S	S	*	*				-161.2	0	111.2	-104.2	160.9	0	0	0	109.8

Retrieved 1,221 of 1,221 residues in 601.5 ms (Link to these results)

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