A0A3Q0KQH4_SCHMA Loading...

Heat shock protein 70 (Hsp70)-interacting protein, putative

AlphaFold DB , UniProt , Accession A0A3Q0KQH4, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,072 aa.

						>A0A3Q0KQH4_SCHMA|A0A3Q0KQH4
MKTKESLKKLQDAEKVFDLVQRLSSEDNAVASIACKEADDFLKQKCSDGFDRSVINKLDQPSKNLDDVTRKGGDVTAFMTAVAQDAQERAERRARQRERADKLKDRANTFFKAGNFKKAVELYSQAIDVAKDYDILYTNRAQAYLRLGQPDLSLKDCDTALLLFPEVQELNSNMKSTMVNNNRDIVSNPRLAKVYLHRGKALMSLNRPSEALSAYSLSRYYSASKTEKCTSTKLNSEKWPNYLIEYVLQAEAALIAQEADAKAEANFAQSAIGFKFNVNSENSNNIPSSQQLLSLLAQLARRNQNSRYYSAGLRYMNRLFMNAPKTKPTTITELNNTVHDSKIGPSESLNCNSETKKSNKKSKGAQHNSSMSDDSNIINCDNHLSTETLSDLQTIFRIKSGFSLLDKEVDAIYQIFNPDNICKKEMLIQQSNVVSSSTQNNNITESGREEDNGANETNYYSILDESERMLALLNLADHLTTNCAENQRLLIERQPNLIKITLACINLSPEFVQRITLHSSITPSSLSSENVNLTMEKQRSLHILGELRLAACNLLVNLTSLPSGRQSLLDMYGPGPILRSLASCLSTSMSNSYQVNSPTLTSTNISSLADAARGLVGRLSASSGLFNTTNSNNVDIAKSNLISSTIASVCATKAARILEYLTESSRFLILARSSSDGLQGLLSVIESALTSSSPTTNTNQPSSTTCQCLATLLDSLGNACQDRTFQKTILQSRKALLFGLSNCLSYHVPLLSDASHARLIASICRLLHNIYVGQSDQSIGTNNNSFNLPDTSNNDCSTSCLTSSKLVNSLLNSIGAILDQIGHGPELRAVVVALAGRLLPLCHDTNQLTSWFGENTTESISDLTPRTRLLLAILDSCSLDSCSKRNPVNPSTVTDEQQQQSNGNVSPSKNETNNITSHLITGCIRCLAFGTNHSINLRYAIGDDRRRVRRLARFIRARLSEYTLQSPSLCKLSVSSNQLPPRDEPLAGNVCLILQHCASDTPLAEHLQGTSVIYDLLSLIQESQRLDTKRNAAILIGKLAQSSQVHRDELSRLDGYSVLTPFNSWTAALERC
					

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	48.1	Very low	74.1	Confident	204 Å²	204	128.2 Å²	128.2	100%	1.005	63%	0.626	S	S	*	*				0	-87.5	0	-70.3	-49	-156.9	0	0	111.7	T3 K4	M1-T3 VanDerWaalsContact C-N 3.29Å; M1-T3 PolarHBondContact O-N 2.79Å; M1-K4 PolarHBondContact O-N 3.29Å
2	K	57.7	Low	75.2	Confident	175 Å²	175	120.8 Å²	120.8	76%	0.761	59%	0.592	S	S	*	*	H	α-helix	trans	-41.2	-46.6	-170.1	-70	-177.5	175.2	-179.8	0	115.5	K4 E5 S6	K2-K4 PolarHBondContact O-N 3.19Å; K2-E5 WeakPolarHBondContact O-CB 3.45Å; K2-E5 PolarHBondContact O-N 3.12Å; K2-E5 VanDerWaalsContact O-N 3.08Å; K2-S6 PolarHBondContact O-N 3.18Å; K2-S6 PolarHBondContact O-OG 2.89Å
3	T	72.5	Confident	76	Confident	111 Å²	111	116 Å²	116	68%	0.681	58%	0.583	S	S	*	*	H	α-helix	trans	-56.8	-41.1	178.5	45.4	0	0	0	0	114.8	M1 E5 L7	M1-T3 VanDerWaalsContact C-N 3.29Å; M1-T3 PolarHBondContact O-N 2.79Å; T3-E5 VanDerWaalsContact C-N 3.32Å; T3-E5 PolarHBondContact O-N 3.17Å; T3-L7 WeakPolarHBondContact O-CB 3.48Å; T3-L7 PolarHBondContact O-N 2.96Å
4	K	74.6	Confident	76.9	Confident	172 Å²	172	117.2 Å²	117.2	75%	0.748	59%	0.586	S	S	*	*	H	α-helix	trans	-67.3	-33.7	175.6	-80.6	-168.5	172.4	-172.9	0	112.2	M1 K2 K8	M1-K4 PolarHBondContact O-N 3.29Å; K2-K4 PolarHBondContact O-N 3.19Å; K4-K8 PolarHBondContact O-N 2.98Å; K4-K8 VanDerWaalsContact O-N 3.08Å
5	E	76.9	Confident	77.7	Confident	108 Å²	108	117.9 Å²	117.9	51%	0.505	58%	0.584	S	S	.	*	H	α-helix	trans	-72.6	-42.2	178.2	-162.6	-162.9	137	0	0	111.4	K2 T3 K8 K9	K2-E5 WeakPolarHBondContact O-CB 3.45Å; K2-E5 PolarHBondContact O-N 3.12Å; K2-E5 VanDerWaalsContact O-N 3.08Å; T3-E5 VanDerWaalsContact C-N 3.32Å; T3-E5 PolarHBondContact O-N 3.17Å; E5-K8 PolarHBondContact O-N 3.25Å; E5-K9 WeakPolarHBondContact O-CG 3.15Å; E5-K9 PolarHBondContact O-N 3.43Å; E5-K9 IonicContact OE1-NZ 3.62Å; E5-K9 PolarHBondContact OE1-NZ 3.09Å
6	S	77.2	Confident	78.4	Confident	71 Å²	71	114.8 Å²	114.8	50%	0.497	57%	0.573	S	S	.	*	H	α-helix	trans	-59.8	-44.9	171.9	-61.2	0	0	0	0	112.1	K2 K9 L10	K2-S6 PolarHBondContact O-N 3.18Å; K2-S6 PolarHBondContact O-OG 2.89Å; S6-K9 PolarHBondContact O-N 3.13Å; S6-L10 PolarHBondContact O-N 3.23Å
7	L	81.3	Confident	79	Confident	99 Å²	99	116.5 Å²	116.5	52%	0.518	58%	0.576	S	S	.	*	H	α-helix	trans	-62.5	-43.5	177.8	-174.5	65.5	0	0	0	111.8	T3 K9 L10 Q11	T3-L7 WeakPolarHBondContact O-CB 3.48Å; T3-L7 PolarHBondContact O-N 2.96Å; L7-K9 VanDerWaalsContact C-N 3.31Å; L7-K9 PolarHBondContact O-N 3.29Å; L7-L10 PolarHBondContact O-N 2.57Å; L7-Q11 WeakPolarHBondContact O-CG 3.32Å; L7-Q11 PolarHBondContact O-N 3.2Å
8	K	80.8	Confident	79.7	Confident	133 Å²	133	113.9 Å²	113.9	58%	0.578	57%	0.565	S	S	*	*	H	α-helix	trans	-62.4	-38.4	176.2	-170	175.3	-178.7	-178.6	0	112	K4 E5 Q11 D12	K4-K8 PolarHBondContact O-N 2.98Å; K4-K8 VanDerWaalsContact O-N 3.08Å; E5-K8 PolarHBondContact O-N 3.25Å; K8-Q11 PolarHBondContact O-N 2.68Å; K8-D12 WeakPolarHBondContact O-CB 3.3Å; K8-D12 PolarHBondContact O-N 3.17Å
9	K	81.1	Confident	80.3	Confident	124 Å²	124	108.6 Å²	108.6	54%	0.539	54%	0.539	S	S	.	.	H	α-helix	trans	-68.2	-31.2	176.5	-76.1	170.4	172.8	172.3	0	113.3	E5 S6 L7 A13	E5-K9 WeakPolarHBondContact O-CG 3.15Å; E5-K9 PolarHBondContact O-N 3.43Å; E5-K9 IonicContact OE1-NZ 3.62Å; E5-K9 PolarHBondContact OE1-NZ 3.09Å; S6-K9 PolarHBondContact O-N 3.13Å; L7-K9 VanDerWaalsContact C-N 3.31Å; L7-K9 PolarHBondContact O-N 3.29Å; K9-A13 PolarHBondContact O-N 2.89Å
10	L	80.5	Confident	80.8	Confident	109 Å²	109	107.5 Å²	107.5	57%	0.571	54%	0.538	S	S	*	.	H	α-helix	trans	-68.7	-48.1	171	-76.2	162.3	0	0	0	111.2	S6 L7 D12 A13 E14	S6-L10 PolarHBondContact O-N 3.23Å; L7-L10 PolarHBondContact O-N 2.57Å; L10-D12 VanDerWaalsContact C-N 3.3Å; L10-D12 PolarHBondContact O-N 3.01Å; L10-A13 WeakPolarHBondContact O-CA 3.39Å; L10-A13 WeakPolarHBondContact O-CB 3.49Å; L10-A13 PolarHBondContact O-N 3.43Å; L10-E14 PolarHBondContact O-N 2.81Å
11	Q	84	Confident	81.1	Confident	104 Å²	104	108 Å²	108	49%	0.486	54%	0.539	S	S	.	.	H	α-helix	trans	-62.2	-35.1	176.5	-69.1	178.7	-33	0	0	113	L7 K8 A13 K15	L7-Q11 WeakPolarHBondContact O-CG 3.32Å; L7-Q11 PolarHBondContact O-N 3.2Å; K8-Q11 PolarHBondContact O-N 2.68Å; Q11-A13 VanDerWaalsContact C-N 3.34Å; Q11-K15 WeakPolarHBondContact O-CG 3.22Å; Q11-K15 PolarHBondContact O-N 3.42Å
12	D	87.3	Confident	83.3	Confident	40 Å²	40	101.1 Å²	101.1	21%	0.214	50%	0.502	C	S	.	.	H	α-helix	trans	-63.2	-39.4	171	-79.8	-33.8	0	0	0	111.6	K8 L10 V16 K45	K8-D12 WeakPolarHBondContact O-CB 3.3Å; K8-D12 PolarHBondContact O-N 3.17Å; L10-D12 VanDerWaalsContact C-N 3.3Å; L10-D12 PolarHBondContact O-N 3.01Å; D12-V16 WeakPolarHBondContact O-CG2 3.27Å; D12-V16 PolarHBondContact O-N 3.23Å; D12-V16 VanDerWaalsContact O-N 3.15Å; D12-K45 IonicContact OD1-NZ 2.65Å; D12-K45 PolarHBondContact OD1-NZ 3.03Å; D12-K45 IonicContact OD2-NZ 2.93Å; D12-K45 PolarHBondContact OD2-NZ 2.79Å
13	A	86.2	Confident	84.8	Confident	58 Å²	58	96.4 Å²	96.4	48%	0.479	48%	0.484	S	S	.	.	H	α-helix	trans	-72.7	-40.8	180	0	0	0	0	0	112.8	K9 L10 Q11 K15 V16 F17	K9-A13 PolarHBondContact O-N 2.89Å; L10-A13 WeakPolarHBondContact O-CA 3.39Å; L10-A13 WeakPolarHBondContact O-CB 3.49Å; L10-A13 PolarHBondContact O-N 3.43Å; Q11-A13 VanDerWaalsContact C-N 3.34Å; A13-K15 VanDerWaalsContact C-N 3.33Å; A13-K15 PolarHBondContact O-N 2.95Å; A13-V16 PolarHBondContact O-N 3.47Å; A13-F17 PolarHBondContact O-N 2.97Å
14	E	88.9	Confident	85.4	Confident	133 Å²	133	95.4 Å²	95.4	62%	0.621	48%	0.482	S	S	*	.	H	α-helix	trans	-59.1	-43.5	173.7	-70.8	172.4	151	0	0	111.2	L10 F17 D18	L10-E14 PolarHBondContact O-N 2.81Å; E14-F17 PolarHBondContact O-N 2.93Å; E14-D18 PolarHBondContact O-N 3.2Å
15	K	88	Confident	86	Confident	127 Å²	127	89.5 Å²	89.5	55%	0.552	46%	0.462	S	S	*	.	H	α-helix	trans	-63	-40.4	174.9	-76.6	-175.1	174.3	-163.1	0	113.4	Q11 A13 F17 L19 F41	Q11-K15 WeakPolarHBondContact O-CG 3.22Å; Q11-K15 PolarHBondContact O-N 3.42Å; A13-K15 VanDerWaalsContact C-N 3.33Å; A13-K15 PolarHBondContact O-N 2.95Å; K15-F17 VanDerWaalsContact C-N 3.34Å; K15-L19 WeakPolarHBondContact O-CB 3.38Å; K15-L19 WeakPolarHBondContact O-CG 3.33Å; K15-L19 PolarHBondContact O-N 2.89Å; K15-F41 HydrophobicContact CD-CE2 4.33Å
16	V	88.6	Confident	86.5	Confident	68 Å²	68	93.9 Å²	93.9	41%	0.412	48%	0.483	S	S	.	.	H	α-helix	trans	-66.5	-38.1	176.2	169.4	0	0	0	0	110.9	D12 A13 V20 F41	D12-V16 WeakPolarHBondContact O-CG2 3.27Å; D12-V16 PolarHBondContact O-N 3.23Å; D12-V16 VanDerWaalsContact O-N 3.15Å; A13-V16 PolarHBondContact O-N 3.47Å; V16-V20 HydrophobicContact CG1-CG2 4.47Å; V16-V20 WeakPolarHBondContact O-CB 3.46Å; V16-V20 VanDerWaalsContact O-CG2 3.27Å; V16-V20 WeakPolarHBondContact O-CG2 3.32Å; V16-V20 PolarHBondContact O-N 3.23Å; V16-F41 HydrophobicContact CG2-CD1 4.46Å; V16-F41 HydrophobicContact CG2-CE1 3.61Å; V16-F41 HydrophobicContact CG2-CZ 4.09Å
17	F	89.8	Confident	87.2	Confident	144 Å²	144	94.5 Å²	94.5	63%	0.632	48%	0.481	S	S	*	.	H	α-helix	trans	-63.8	-48.9	176.2	-175.1	-89.9	0	0	0	112.1	A13 E14 K15 L19 V20 Q21	A13-F17 PolarHBondContact O-N 2.97Å; E14-F17 PolarHBondContact O-N 2.93Å; K15-F17 VanDerWaalsContact C-N 3.34Å; F17-L19 PolarHBondContact O-N 3.44Å; F17-V20 PolarHBondContact O-N 2.96Å; F17-Q21 PolarHBondContact O-N 3.45Å
18	D	90.8	Very high	87.5	Confident	70 Å²	70	96.5 Å²	96.5	37%	0.374	49%	0.492	S	S	.	.	H	α-helix	trans	-60.3	-44	175.9	169.2	75.5	0	0	0	112.4	E14 V20 Q21 R22	E14-D18 PolarHBondContact O-N 3.2Å; D18-V20 PolarHBondContact O-N 3.27Å; D18-Q21 PolarHBondContact O-N 3.01Å; D18-R22 WeakPolarHBondContact O-CG 3.42Å; D18-R22 PolarHBondContact O-N 3.05Å; D18-R22 IonicContact OD1-NE 3.32Å; D18-R22 PolarHBondContact OD1-NE 3.11Å; D18-R22 IonicContact OD2-CZ 3.18Å; D18-R22 IonicContact OD2-NE 2.74Å; D18-R22 PolarHBondContact OD2-NE 3.1Å; D18-R22 IonicContact OD2-NH2 3.23Å; D18-R22 PolarHBondContact OD2-NH2 2.94Å
19	L	90.8	Very high	87.9	Confident	13 Å²	13	92.8 Å²	92.8	7%	0.068	49%	0.486	C	S	.	.	H	α-helix	trans	-60.8	-43.6	175	-79.3	168	0	0	0	112.2	K15 F17 R22 L23 E37 F41	K15-L19 WeakPolarHBondContact O-CB 3.38Å; K15-L19 WeakPolarHBondContact O-CG 3.33Å; K15-L19 PolarHBondContact O-N 2.89Å; F17-L19 PolarHBondContact O-N 3.44Å; L19-R22 PolarHBondContact O-N 3.43Å; L19-L23 VanDerWaalsContact O-CB 3.31Å; L19-L23 WeakPolarHBondContact O-CB 3.2Å; L19-L23 VanDerWaalsContact O-CG 3.23Å; L19-L23 WeakPolarHBondContact O-CG 3.48Å; L19-L23 PolarHBondContact O-N 3.48Å; L19-E37 HydrophobicContact CD2-CB 3.59Å; L19-F41 HydrophobicContact CD1-CB 4.4Å; L19-F41 HydrophobicContact CD1-CG 4.46Å
20	V	89.8	Confident	88.4	Confident	86 Å²	86	89.2 Å²	89.2	52%	0.521	47%	0.474	S	S	.	.	H	α-helix	trans	-63.4	-42.4	176.1	168.1	0	0	0	0	111	V16 F17 D18 R22 L23 S24	V16-V20 HydrophobicContact CG1-CG2 4.47Å; V16-V20 WeakPolarHBondContact O-CB 3.46Å; V16-V20 VanDerWaalsContact O-CG2 3.27Å; V16-V20 WeakPolarHBondContact O-CG2 3.32Å; V16-V20 PolarHBondContact O-N 3.23Å; F17-V20 PolarHBondContact O-N 2.96Å; D18-V20 PolarHBondContact O-N 3.27Å; V20-R22 PolarHBondContact O-N 2.85Å; V20-L23 PolarHBondContact O-N 2.94Å; V20-S24 PolarHBondContact O-N 3.31Å; V20-S24 PolarHBondContact O-OG 2.87Å
21	Q	88.4	Confident	88.8	Confident	120 Å²	120	84.8 Å²	84.8	56%	0.561	45%	0.454	S	S	*	.	H	α-helix	trans	-63.6	-41.7	177.8	-171.7	172.2	-1.9	0	0	111.9	F17 D18 S24	F17-Q21 PolarHBondContact O-N 3.45Å; D18-Q21 PolarHBondContact O-N 3.01Å; Q21-S24 WeakPolarHBondContact CA-OG 3.36Å; Q21-S24 PolarHBondContact O-N 3.14Å; Q21-S24 PolarHBondContact O-OG 3.42Å
22	R	93.4	Very high	89	Confident	59 Å²	59	82.8 Å²	82.8	22%	0.223	45%	0.451	C	S	.	.	H	α-helix	trans	-72	-32	176.1	-68.1	-171.5	-73.7	131.4	-4.3	113.2	D18 L19 V20 S24 S25 V30 A34 E37	D18-R22 WeakPolarHBondContact O-CG 3.42Å; D18-R22 PolarHBondContact O-N 3.05Å; D18-R22 IonicContact OD1-NE 3.32Å; D18-R22 PolarHBondContact OD1-NE 3.11Å; D18-R22 IonicContact OD2-CZ 3.18Å; D18-R22 IonicContact OD2-NE 2.74Å; D18-R22 PolarHBondContact OD2-NE 3.1Å; D18-R22 IonicContact OD2-NH2 3.23Å; D18-R22 PolarHBondContact OD2-NH2 2.94Å; L19-R22 PolarHBondContact O-N 3.43Å; V20-R22 PolarHBondContact O-N 2.85Å; R22-S24 VanDerWaalsContact C-N 3.29Å; R22-S24 PolarHBondContact O-N 2.67Å; R22-S25 VanDerWaalsContact O-CB 3.23Å; R22-S25 WeakPolarHBondContact O-CB 3.42Å; R22-S25 PolarHBondContact O-N 3.09Å; R22-V30 HydrophobicContact CB-CG1 4Å; R22-V30 HydrophobicContact CG-CG1 4.25Å; R22-A34 HydrophobicContact CB-CB 3.64Å; R22-E37 IonicContact CZ-OE1 3.76Å; R22-E37 IonicContact CZ-OE2 3.33Å; R22-E37 IonicContact NH1-OE1 3.59Å; R22-E37 PolarHBondContact NH1-OE1 3.35Å; R22-E37 IonicContact NH1-OE2 3.19Å; R22-E37 PolarHBondContact NH1-OE2 3.4Å; R22-E37 IonicContact NH2-OE2 2.67Å; R22-E37 PolarHBondContact NH2-OE2 3.15Å
23	L	89.7	Confident	89.1	Confident	75 Å²	75	85.3 Å²	85.3	39%	0.393	46%	0.464	S	S	.	.	H	α-helix	trans	-65.3	-30.5	170	-79.5	167.6	0	0	0	112.7	L19 V20 S25 A34 C35 A38	L19-L23 VanDerWaalsContact O-CB 3.31Å; L19-L23 WeakPolarHBondContact O-CB 3.2Å; L19-L23 VanDerWaalsContact O-CG 3.23Å; L19-L23 WeakPolarHBondContact O-CG 3.48Å; L19-L23 PolarHBondContact O-N 3.48Å; V20-L23 PolarHBondContact O-N 2.94Å; L23-S25 VanDerWaalsContact C-N 3.28Å; L23-S25 PolarHBondContact O-N 3.4Å; L23-A34 HydrophobicContact CD2-CB 4.17Å; L23-A34 HydrophobicContact CG-CB 3.99Å; L23-C35 HydrophobicContact CD2-CB 3.86Å; L23-A38 HydrophobicContact CD1-CB 4.37Å
24	S	85.9	Confident	89.3	Confident	91 Å²	91	82.5 Å²	82.5	64%	0.636	44%	0.441	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.9	11.4	173.2	59.5	0	0	0	0	114.6	V20 Q21 R22	V20-S24 PolarHBondContact O-N 3.31Å; V20-S24 PolarHBondContact O-OG 2.87Å; Q21-S24 WeakPolarHBondContact CA-OG 3.36Å; Q21-S24 PolarHBondContact O-N 3.14Å; Q21-S24 PolarHBondContact O-OG 3.42Å; R22-S24 VanDerWaalsContact C-N 3.29Å; R22-S24 PolarHBondContact O-N 2.67Å
25	S	87.1	Confident	89.2	Confident	47 Å²	47	79.2 Å²	79.2	33%	0.329	43%	0.432	S	S	.	.			trans	-74	139.1	177.2	-166.8	0	0	0	0	111.7	R22 L23 D27	R22-S25 VanDerWaalsContact O-CB 3.23Å; R22-S25 WeakPolarHBondContact O-CB 3.42Å; R22-S25 PolarHBondContact O-N 3.09Å; L23-S25 VanDerWaalsContact C-N 3.28Å; L23-S25 PolarHBondContact O-N 3.4Å; S25-D27 PolarHBondContact O-N 3.01Å; S25-D27 PolarHBondContact OG-N 3Å
26	E	86.9	Confident	89.3	Confident	200 Å²	200	79.4 Å²	79.4	94%	0.935	43%	0.432	S	S	*	.	S	Bend	trans	-68.8	-17.3	171.6	-61.7	-178.2	172.3	0	0	112.6	N28	E26-N28 PolarHBondContact O-N 3.27Å
27	D	91	Very high	89.3	Confident	85 Å²	85	80 Å²	80	46%	0.455	43%	0.431	S	S	.	.			trans	-79.2	106	171.8	-175.4	-7.8	0	0	0	110.6	S25 A29 V30 A31	S25-D27 PolarHBondContact O-N 3.01Å; S25-D27 PolarHBondContact OG-N 3Å; D27-A29 PolarHBondContact O-N 3.43Å; D27-A29 VanDerWaalsContact O-N 3.11Å; D27-A29 VanDerWaalsContact OD1-CB 3.29Å; D27-A29 WeakPolarHBondContact OD1-CB 3.27Å; D27-A29 PolarHBondContact OD1-N 3.08Å; D27-V30 HydrophobicContact CB-CB 4.15Å; D27-V30 HydrophobicContact CB-CG2 3.96Å; D27-V30 PolarHBondContact O-N 2.84Å; D27-A31 PolarHBondContact O-N 3.33Å
28	N	88	Confident	89.2	Confident	140 Å²	140	74.1 Å²	74.1	75%	0.749	41%	0.408	S	S	*	.	H	α-helix	trans	-52.3	-29.5	174.7	-87.1	-42.3	0	0	0	113.9	E26 S32	E26-N28 PolarHBondContact O-N 3.27Å; N28-S32 WeakPolarHBondContact O-CB 3.29Å; N28-S32 PolarHBondContact O-N 2.97Å
29	A	90.7	Very high	88.9	Confident	56 Å²	56	74.7 Å²	74.7	46%	0.463	41%	0.412	S	S	.	.	H	α-helix	trans	-70.5	-45.6	176.1	0	0	0	0	0	111.1	D27 S32 I33	D27-A29 PolarHBondContact O-N 3.43Å; D27-A29 VanDerWaalsContact O-N 3.11Å; D27-A29 VanDerWaalsContact OD1-CB 3.29Å; D27-A29 WeakPolarHBondContact OD1-CB 3.27Å; D27-A29 PolarHBondContact OD1-N 3.08Å; A29-S32 PolarHBondContact O-N 3.47Å; A29-I33 WeakPolarHBondContact O-CD1 3.35Å; A29-I33 VanDerWaalsContact O-CG1 3.28Å; A29-I33 WeakPolarHBondContact O-CG1 3.43Å; A29-I33 PolarHBondContact O-N 2.86Å
30	V	90.8	Very high	88.6	Confident	48 Å²	48	78.6 Å²	78.6	29%	0.291	43%	0.432	S	S	.	.	H	α-helix	trans	-62.9	-47.6	175.6	176.2	0	0	0	0	110.6	R22 D27 S32 I33 A34	R22-V30 HydrophobicContact CB-CG1 4Å; R22-V30 HydrophobicContact CG-CG1 4.25Å; D27-V30 HydrophobicContact CB-CB 4.15Å; D27-V30 HydrophobicContact CB-CG2 3.96Å; D27-V30 PolarHBondContact O-N 2.84Å; V30-S32 PolarHBondContact O-N 2.7Å; V30-I33 PolarHBondContact O-N 2.93Å; V30-A34 WeakPolarHBondContact O-CB 3.45Å; V30-A34 PolarHBondContact O-N 2.9Å
31	A	88.4	Confident	88.4	Confident	17 Å²	17	76.4 Å²	76.4	14%	0.14	42%	0.416	C	S	.	.	H	α-helix	trans	-62.2	-40.4	178.2	0	0	0	0	0	112.3	D27 A34 C35	D27-A31 PolarHBondContact O-N 3.33Å; A31-A34 PolarHBondContact O-N 3.39Å; A31-C35 VanDerWaalsContact O-CB 3.32Å; A31-C35 WeakPolarHBondContact O-CB 3.39Å; A31-C35 PolarHBondContact O-N 2.93Å
32	S	88.5	Confident	87.9	Confident	61 Å²	61	75.4 Å²	75.4	43%	0.427	41%	0.414	S	S	.	.	H	α-helix	trans	-66.9	-36.2	177.1	-171.8	0	0	0	0	113.1	N28 A29 V30 K36	N28-S32 WeakPolarHBondContact O-CB 3.29Å; N28-S32 PolarHBondContact O-N 2.97Å; A29-S32 PolarHBondContact O-N 3.47Å; V30-S32 PolarHBondContact O-N 2.7Å; S32-K36 PolarHBondContact O-N 2.8Å
33	I	90.1	Very high	87	Confident	93 Å²	93	78.6 Å²	78.6	48%	0.477	43%	0.43	S	S	.	.	H	α-helix	trans	-69.2	-47.7	174.2	-68.4	165.1	0	0	0	110.2	A29 V30 C35 K36 E37	A29-I33 WeakPolarHBondContact O-CD1 3.35Å; A29-I33 VanDerWaalsContact O-CG1 3.28Å; A29-I33 WeakPolarHBondContact O-CG1 3.43Å; A29-I33 PolarHBondContact O-N 2.86Å; V30-I33 PolarHBondContact O-N 2.93Å; I33-C35 VanDerWaalsContact C-N 3.26Å; I33-C35 PolarHBondContact O-N 2.71Å; I33-K36 PolarHBondContact O-N 2.8Å; I33-K36 VanDerWaalsContact O-N 3.13Å; I33-E37 WeakPolarHBondContact CG2-OE1 3.46Å; I33-E37 PolarHBondContact O-N 2.83Å
34	A	90.1	Very high	86.3	Confident	0 Å²	0	82.6 Å²	82.6	0%	0	45%	0.446	C	S	.	.	H	α-helix	trans	-60.5	-34.5	178.1	0	0	0	0	0	112.6	R22 L23 V30 A31 E37 A38	R22-A34 HydrophobicContact CB-CB 3.64Å; L23-A34 HydrophobicContact CD2-CB 4.17Å; L23-A34 HydrophobicContact CG-CB 3.99Å; V30-A34 WeakPolarHBondContact O-CB 3.45Å; V30-A34 PolarHBondContact O-N 2.9Å; A31-A34 PolarHBondContact O-N 3.39Å; A34-E37 PolarHBondContact O-N 2.78Å; A34-A38 VanDerWaalsContact O-CB 3.32Å; A34-A38 WeakPolarHBondContact O-CB 3.29Å; A34-A38 PolarHBondContact O-N 2.91Å
35	C	87	Confident	85.5	Confident	63 Å²	63	82.7 Å²	82.7	43%	0.426	44%	0.435	S	S	.	.	H	α-helix	trans	-64	-42.6	174.8	-167.7	0	0	0	0	112.4	L23 A31 I33 A38 D39	L23-C35 HydrophobicContact CD2-CB 3.86Å; A31-C35 VanDerWaalsContact O-CB 3.32Å; A31-C35 WeakPolarHBondContact O-CB 3.39Å; A31-C35 PolarHBondContact O-N 2.93Å; I33-C35 VanDerWaalsContact C-N 3.26Å; I33-C35 PolarHBondContact O-N 2.71Å; C35-A38 PolarHBondContact O-N 2.62Å; C35-D39 PolarHBondContact O-N 2.8Å
36	K	88.9	Confident	83.8	Confident	131 Å²	131	82.6 Å²	82.6	57%	0.57	43%	0.434	S	S	*	.	H	α-helix	trans	-66	-42.2	174.7	-67.8	169.8	-176.1	169.6	0	112.3	S32 I33 A38 D39 D40	S32-K36 PolarHBondContact O-N 2.8Å; I33-K36 PolarHBondContact O-N 2.8Å; I33-K36 VanDerWaalsContact O-N 3.13Å; K36-A38 VanDerWaalsContact C-N 3.33Å; K36-A38 PolarHBondContact O-N 2.61Å; K36-D39 PolarHBondContact O-N 3.4Å; K36-D40 PolarHBondContact O-N 3.15Å
37	E	88.6	Confident	82.2	Confident	82 Å²	82	77.6 Å²	77.6	38%	0.383	42%	0.421	S	S	.	.	H	α-helix	trans	-64.2	-37.7	175.5	-72.6	179.7	-141.6	0	0	112.3	L19 R22 I33 A34 D40 F41	L19-E37 HydrophobicContact CD2-CB 3.59Å; R22-E37 IonicContact CZ-OE1 3.76Å; R22-E37 IonicContact CZ-OE2 3.33Å; R22-E37 IonicContact NH1-OE1 3.59Å; R22-E37 PolarHBondContact NH1-OE1 3.35Å; R22-E37 IonicContact NH1-OE2 3.19Å; R22-E37 PolarHBondContact NH1-OE2 3.4Å; R22-E37 IonicContact NH2-OE2 2.67Å; R22-E37 PolarHBondContact NH2-OE2 3.15Å; I33-E37 WeakPolarHBondContact CG2-OE1 3.46Å; I33-E37 PolarHBondContact O-N 2.83Å; A34-E37 PolarHBondContact O-N 2.78Å; E37-D40 PolarHBondContact O-N 3.36Å; E37-F41 VanDerWaalsContact O-CB 3.28Å; E37-F41 WeakPolarHBondContact O-CB 3.22Å; E37-F41 PolarHBondContact O-N 2.85Å
38	A	87.5	Confident	80.1	Confident	19 Å²	19	79.9 Å²	79.9	16%	0.157	43%	0.433	C	S	.	.	H	α-helix	trans	-64.7	-44.5	175	0	0	0	0	0	111.7	L23 A34 C35 K36 D40 F41 L42	L23-A38 HydrophobicContact CD1-CB 4.37Å; A34-A38 VanDerWaalsContact O-CB 3.32Å; A34-A38 WeakPolarHBondContact O-CB 3.29Å; A34-A38 PolarHBondContact O-N 2.91Å; C35-A38 PolarHBondContact O-N 2.62Å; K36-A38 VanDerWaalsContact C-N 3.33Å; K36-A38 PolarHBondContact O-N 2.61Å; A38-D40 PolarHBondContact O-N 2.87Å; A38-F41 PolarHBondContact O-N 3.46Å; A38-L42 WeakPolarHBondContact O-CB 3.44Å; A38-L42 VanDerWaalsContact O-CG 3.27Å; A38-L42 WeakPolarHBondContact O-CG 3.46Å; A38-L42 PolarHBondContact O-N 2.95Å
39	D	84.7	Confident	78.2	Confident	83 Å²	83	76.6 Å²	76.6	44%	0.444	43%	0.433	S	S	.	.	H	α-helix	trans	-57.8	-45.9	174.1	-86.5	-12.2	0	0	0	112.2	C35 K36 L42 K43	C35-D39 PolarHBondContact O-N 2.8Å; K36-D39 PolarHBondContact O-N 3.4Å; D39-L42 PolarHBondContact O-N 3.49Å; D39-K43 WeakPolarHBondContact O-CE 3.16Å; D39-K43 VanDerWaalsContact O-CG 3.25Å; D39-K43 WeakPolarHBondContact O-CG 3.29Å; D39-K43 PolarHBondContact O-N 2.84Å
40	D	85.7	Confident	75.9	Confident	94 Å²	94	81.6 Å²	81.6	50%	0.503	44%	0.444	S	S	.	.	H	α-helix	trans	-71.9	-34.4	179.9	-75.5	-18.2	0	0	0	112.6	K36 E37 A38 K43 Q44	K36-D40 PolarHBondContact O-N 3.15Å; E37-D40 PolarHBondContact O-N 3.36Å; A38-D40 PolarHBondContact O-N 2.87Å; D40-K43 WeakPolarHBondContact OD1-CD 3.42Å; D40-K43 IonicContact OD1-NZ 2.65Å; D40-K43 PolarHBondContact OD1-NZ 3.35Å; D40-Q44 WeakPolarHBondContact O-CB 3.39Å; D40-Q44 PolarHBondContact O-N 3.38Å; D40-Q44 VanDerWaalsContact O-N 3.08Å
41	F	84.1	Confident	73.4	Confident	40 Å²	40	83.9 Å²	83.9	18%	0.175	46%	0.455	C	S	.	.	H	α-helix	trans	-63.3	-41.6	170.8	-175.2	-101.1	0	0	0	111.6	K15 V16 L19 E37 A38 Q44 K45	K15-F41 HydrophobicContact CD-CE2 4.33Å; V16-F41 HydrophobicContact CG2-CD1 4.46Å; V16-F41 HydrophobicContact CG2-CE1 3.61Å; V16-F41 HydrophobicContact CG2-CZ 4.09Å; L19-F41 HydrophobicContact CD1-CB 4.4Å; L19-F41 HydrophobicContact CD1-CG 4.46Å; E37-F41 VanDerWaalsContact O-CB 3.28Å; E37-F41 WeakPolarHBondContact O-CB 3.22Å; E37-F41 PolarHBondContact O-N 2.85Å; A38-F41 PolarHBondContact O-N 3.46Å; F41-Q44 PolarHBondContact O-N 2.77Å; F41-K45 HydrophobicContact CE1-CG 4.43Å; F41-K45 VanDerWaalsContact CZ-CE 3.46Å; F41-K45 WeakPolarHBondContact O-CG 3.43Å; F41-K45 PolarHBondContact O-N 3.38Å
42	L	77.9	Confident	71.4	Confident	100 Å²	100	94.1 Å²	94.1	52%	0.524	49%	0.49	S	S	.	.	H	α-helix	trans	-65.2	-47.3	175.8	-73.3	169.8	0	0	0	111.9	A38 D39 Q44 K45 C46	A38-L42 WeakPolarHBondContact O-CB 3.44Å; A38-L42 VanDerWaalsContact O-CG 3.27Å; A38-L42 WeakPolarHBondContact O-CG 3.46Å; A38-L42 PolarHBondContact O-N 2.95Å; D39-L42 PolarHBondContact O-N 3.49Å; L42-Q44 PolarHBondContact O-N 3.34Å; L42-K45 PolarHBondContact O-N 2.91Å; L42-C46 PolarHBondContact O-N 3.09Å
43	K	75.6	Confident	69.1	Low	126 Å²	126	95.1 Å²	95.1	55%	0.548	50%	0.497	S	S	.	.	H	α-helix	trans	-53.2	-42.4	174.2	-70.5	163.5	-148.2	160.6	0	111.6	D39 D40 K45 C46	D39-K43 WeakPolarHBondContact O-CE 3.16Å; D39-K43 VanDerWaalsContact O-CG 3.25Å; D39-K43 WeakPolarHBondContact O-CG 3.29Å; D39-K43 PolarHBondContact O-N 2.84Å; D40-K43 WeakPolarHBondContact OD1-CD 3.42Å; D40-K43 IonicContact OD1-NZ 2.65Å; D40-K43 PolarHBondContact OD1-NZ 3.35Å; K43-K45 VanDerWaalsContact C-N 3.28Å; K43-K45 PolarHBondContact O-N 3.47Å; K43-C46 PolarHBondContact O-N 3.42Å
44	Q	75.1	Confident	66.6	Low	159 Å²	159	96.1 Å²	96.1	74%	0.743	51%	0.507	S	S	*	.	H	α-helix	trans	-71	-19.1	179.4	-164.2	175.4	95.6	0	0	113.8	D40 F41 L42	D40-Q44 WeakPolarHBondContact O-CB 3.39Å; D40-Q44 PolarHBondContact O-N 3.38Å; D40-Q44 VanDerWaalsContact O-N 3.08Å; F41-Q44 PolarHBondContact O-N 2.77Å; L42-Q44 PolarHBondContact O-N 3.34Å
45	K	68.8	Low	64.3	Low	93 Å²	93	103.1 Å²	103.1	40%	0.404	54%	0.543	S	S	.	.	H	α-helix	trans	-88	-22.5	171.3	-63.4	-69.3	179.5	-173.8	0	113.1	D12 F41 L42 K43 S47	D12-K45 IonicContact OD1-NZ 2.65Å; D12-K45 PolarHBondContact OD1-NZ 3.03Å; D12-K45 IonicContact OD2-NZ 2.93Å; D12-K45 PolarHBondContact OD2-NZ 2.79Å; F41-K45 HydrophobicContact CE1-CG 4.43Å; F41-K45 VanDerWaalsContact CZ-CE 3.46Å; F41-K45 WeakPolarHBondContact O-CG 3.43Å; F41-K45 PolarHBondContact O-N 3.38Å; L42-K45 PolarHBondContact O-N 2.91Å; K43-K45 VanDerWaalsContact C-N 3.28Å; K43-K45 PolarHBondContact O-N 3.47Å; K45-S47 VanDerWaalsContact C-N 3.3Å; K45-S47 PolarHBondContact O-N 3.2Å
46	C	52.1	Low	62	Low	45 Å²	45	106.1 Å²	106.1	30%	0.304	56%	0.555	S	S	.	*	G	3₁₀ helix	trans	-87.5	20.8	-178	-70.8	0	0	0	0	114.7	L42 K43 D48	L42-C46 PolarHBondContact O-N 3.09Å; K43-C46 PolarHBondContact O-N 3.42Å; C46-D48 PolarHBondContact O-N 3.03Å; C46-D48 VanDerWaalsContact O-N 3.13Å
47	S	52.7	Low	59.4	Low	95 Å²	95	108.2 Å²	108.2	66%	0.664	56%	0.564	S	S	*	*	G	3₁₀ helix	trans	-55	-29.7	174.7	52.6	0	0	0	0	113.7	K45 G49	K45-S47 VanDerWaalsContact C-N 3.3Å; K45-S47 PolarHBondContact O-N 3.2Å; S47-G49 PolarHBondContact O-N 3.11Å; S47-G49 VanDerWaalsContact O-N 3.07Å
48	D	47	Very low	56.9	Low	132 Å²	132	111.9 Å²	111.9	71%	0.706	59%	0.585	S	S	*	*	G	3₁₀ helix	trans	-87	32.2	-168.3	-64	13.3	0	0	0	112.7	C46 F50	C46-D48 PolarHBondContact O-N 3.03Å; C46-D48 VanDerWaalsContact O-N 3.13Å; D48-F50 WeakPolarHBondContact O-CD2 3.27Å; D48-F50 PolarHBondContact O-N 2.72Å
49	G	46.8	Very low	54.6	Low	72 Å²	72	117.8 Å²	117.8	74%	0.742	61%	0.614	S	S	*	*	S	Bend	trans	65.9	4.8	166.5	0	0	0	0	0	117.3	S47	S47-G49 PolarHBondContact O-N 3.11Å; S47-G49 VanDerWaalsContact O-N 3.07Å
50	F	43.6	Very low	52.1	Low	160 Å²	160	122.3 Å²	122.3	70%	0.702	63%	0.633	S	S	*	*			trans	-113.9	78	-178.3	-83.3	-78.4	0	0	0	111.5	D48 R52	D48-F50 WeakPolarHBondContact O-CD2 3.27Å; D48-F50 PolarHBondContact O-N 2.72Å; F50-R52 PolarHBondContact O-N 2.86Å
51	D	37.7	Very low	49.7	Very low	97 Å²	97	123.8 Å²	123.8	52%	0.519	65%	0.648	S	S	.	*			trans	-61.3	98.5	166.3	-88.6	-21.3	0	0	0	109.8	S53 V54	D51-S53 PolarHBondContact O-N 3.47Å; D51-V54 HydrophobicContact CB-CG2 3.79Å
52	R	46.2	Very low	47.3	Very low	232 Å²	232	127.4 Å²	127.4	88%	0.875	68%	0.678	S	S	*	*	S	Bend	trans	-82.5	1.4	178.7	-71.8	-175.7	178.7	178.3	1.9	113.8	F50	F50-R52 PolarHBondContact O-N 2.86Å
53	S	40.2	Very low	45.2	Very low	82 Å²	82	132.1 Å²	132.1	57%	0.573	69%	0.694	S	S	*	*			trans	-140	57.3	-178.2	56.5	0	0	0	0	111.2	D51 I55	D51-S53 PolarHBondContact O-N 3.47Å; S53-I55 PolarHBondContact O-N 3.21Å
54	V	38	Very low	43.2	Very low	114 Å²	114	134 Å²	134	69%	0.691	71%	0.71	S	S	*	*			trans	-72.7	73.6	164.5	-172.7	0	0	0	0	108.7	D51	D51-V54 HydrophobicContact CB-CG2 3.79Å
55	I	43.1	Very low	41.2	Very low	146 Å²	146	134.4 Å²	134.4	75%	0.749	72%	0.716	S	S	*	*			trans	-90.9	107.4	168.5	-61.7	178.1	0	0	0	106.5	S53 K57	S53-I55 PolarHBondContact O-N 3.21Å; I55-K57 PolarHBondContact O-N 3.43Å
56	N	37.7	Very low	39.5	Very low	126 Å²	126	137.6 Å²	137.6	67%	0.674	74%	0.738	S	S	*	*			trans	23.7	83.7	169	-66.3	-1.3	0	0	0	116.6	L58	N56-L58 PolarHBondContact O-N 3.43Å
57	K	34.1	Very low	38.8	Very low	176 Å²	176	141.2 Å²	141.2	77%	0.765	75%	0.754	S	S	*	*			trans	-67.6	87.1	150.9	-75	-178.8	179.9	169.8	0	108.3	I55 D59	I55-K57 PolarHBondContact O-N 3.43Å; K57-D59 PolarHBondContact O-N 3.03Å; K57-D59 VanDerWaalsContact O-N 3.14Å
58	L	36.1	Very low	38	Very low	158 Å²	158	142.7 Å²	142.7	83%	0.827	76%	0.759	S	S	*	*			trans	-67.2	100.7	156.8	-86.5	160.7	0	0	0	106.6	N56	N56-L58 PolarHBondContact O-N 3.43Å
59	D	38.9	Very low	37.7	Very low	144 Å²	144	142 Å²	142	77%	0.77	76%	0.759	S	S	*	*			trans	-58.9	153.2	171.2	-84.6	-41.4	0	0	0	110.5	K57	K57-D59 PolarHBondContact O-N 3.03Å; K57-D59 VanDerWaalsContact O-N 3.14Å
60	Q	31.9	Very low	37.4	Very low	178 Å²	178	149 Å²	149	83%	0.832	76%	0.764	S	S	*	*			trans	-54.3	136.4	-149.2	-61.1	175.3	7.9	0	0	114	S62	Q60-S62 PolarHBondContact O-N 3.3Å
61	P	36.1	Very low	37.6	Very low	125 Å²	125	149.6 Å²	149.6	81%	0.812	77%	0.766	S	S	*	*			trans	-63.9	109.6	-178.9	26.4	-34.2	0	0	0	110.4	K63	P61-K63 PolarHBondContact O-N 2.98Å
62	S	34.1	Very low	38	Very low	116 Å²	116	147.8 Å²	147.8	81%	0.811	77%	0.77	S	S	*	*			trans	-61.4	128.8	169.3	44.7	0	0	0	0	109.2	Q60 N64	Q60-S62 PolarHBondContact O-N 3.3Å; S62-N64 PolarHBondContact O-N 3.47Å; S62-N64 VanDerWaalsContact O-N 3.14Å
63	K	32.8	Very low	38.4	Very low	199 Å²	199	138.5 Å²	138.5	87%	0.865	75%	0.746	S	S	*	*	S	Bend	trans	-63.4	116.1	179.3	-64	176	-179.3	177.4	0	109.6	P61	P61-K63 PolarHBondContact O-N 2.98Å
64	N	33.6	Very low	39.6	Very low	164 Å²	164	140.6 Å²	140.6	88%	0.877	75%	0.751	S	S	*	*			trans	-178.8	102.5	140.2	-87.4	-15	0	0	0	108.2	S62 D66	S62-N64 PolarHBondContact O-N 3.47Å; S62-N64 VanDerWaalsContact O-N 3.14Å; N64-D66 PolarHBondContact O-N 3.35Å
65	L	34.2	Very low	41.4	Very low	168 Å²	168	139.7 Å²	139.7	88%	0.88	75%	0.746	S	S	*	*			trans	-100	61.8	-171.9	-172.7	71.7	0	0	0	111.1
66	D	33	Very low	43.2	Very low	160 Å²	160	137 Å²	137	86%	0.856	74%	0.736	S	S	*	*			trans	-147.3	76.2	-178.6	-82.7	-56.8	0	0	0	113	N64	N64-D66 PolarHBondContact O-N 3.35Å
67	D	36.2	Very low	45.1	Very low	121 Å²	121	133.8 Å²	133.8	65%	0.647	73%	0.727	S	S	*	*			trans	-173.2	110.8	142.5	-179.8	-4.1	0	0	0	109.1	T69	D67-T69 PolarHBondContact OD1-N 3.22Å; D67-T69 VanDerWaalsContact OD1-N 3.15Å; D67-T69 PolarHBondContact OD1-OG1 3.08Å
68	V	37.7	Very low	47.4	Very low	127 Å²	127	131.1 Å²	131.1	77%	0.77	72%	0.716	S	S	*	*			trans	-106.4	54.1	-176.2	-167.2	0	0	0	0	111.6
69	T	39.1	Very low	49.7	Very low	116 Å²	116	129.2 Å²	129.2	71%	0.712	70%	0.704	S	S	*	*			trans	-123.9	-15.7	175.6	60.1	0	0	0	0	116.3	D67 K71	D67-T69 PolarHBondContact OD1-N 3.22Å; D67-T69 VanDerWaalsContact OD1-N 3.15Å; D67-T69 PolarHBondContact OD1-OG1 3.08Å; T69-K71 PolarHBondContact O-N 3.22Å
70	R	41.8	Very low	51.9	Low	221 Å²	221	126.1 Å²	126.1	83%	0.834	69%	0.69	S	S	*	*			trans	-95.7	36.2	-169	-150.2	177.3	-178.9	168.3	0.8	117.2	G72 G73	R70-G72 PolarHBondContact O-N 3.38Å; R70-G73 PolarHBondContact O-N 3.31Å
71	K	46.6	Very low	54.3	Low	172 Å²	172	120.1 Å²	120.1	75%	0.748	67%	0.671	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.5	-10.2	-174.9	-75.3	-169	175.1	-176.7	0	116.8	T69	T69-K71 PolarHBondContact O-N 3.22Å
72	G	47.2	Very low	56.7	Low	59 Å²	59	117.2 Å²	117.2	61%	0.608	65%	0.651	S	S	*	*	H	α-helix	trans	-73.2	-26.7	178.9	0	0	0	0	0	115.5	R70 T76	R70-G72 PolarHBondContact O-N 3.38Å; G72-T76 PolarHBondContact O-OG1 2.95Å
73	G	55	Low	59.2	Low	36 Å²	36	114.5 Å²	114.5	37%	0.371	64%	0.636	S	S	.	*	H	α-helix	trans	-80.5	-32.7	-171.9	0	0	0	0	0	115.1	R70 T76 A77	R70-G73 PolarHBondContact O-N 3.31Å; G73-T76 PolarHBondContact O-N 2.89Å; G73-T76 PolarHBondContact O-OG1 2.83Å; G73-A77 PolarHBondContact O-N 3.43Å; G73-A77 VanDerWaalsContact O-N 3.07Å
74	D	64.4	Low	61.7	Low	127 Å²	127	111.3 Å²	111.3	68%	0.679	62%	0.624	S	S	*	*	H	α-helix	trans	-68.4	-46.9	-173.4	-167.6	22.4	0	0	0	111.7	T76 A77 F78	D74-T76 VanDerWaalsContact C-N 3.31Å; D74-T76 PolarHBondContact O-N 2.87Å; D74-A77 PolarHBondContact O-N 2.88Å; D74-A77 VanDerWaalsContact O-N 3.17Å; D74-F78 PolarHBondContact O-N 3Å
75	V	75.2	Confident	64.3	Low	95 Å²	95	106.7 Å²	106.7	58%	0.576	60%	0.599	S	S	*	*	H	α-helix	trans	-60.4	-39.5	175.5	-176.2	0	0	0	0	111.5	M79	V75-M79 HydrophobicContact CG1-CG 4.38Å; V75-M79 WeakPolarHBondContact O-CB 3.25Å; V75-M79 VanDerWaalsContact O-CG 3.24Å; V75-M79 WeakPolarHBondContact O-CG 3.24Å; V75-M79 PolarHBondContact O-N 3.32Å
76	T	81.2	Confident	66.8	Low	88 Å²	88	101.1 Å²	101.1	54%	0.54	58%	0.578	S	S	.	*	H	α-helix	trans	-67.3	-39	177.1	50.9	0	0	0	0	112.4	G72 G73 D74 M79 T80	G72-T76 PolarHBondContact O-OG1 2.95Å; G73-T76 PolarHBondContact O-N 2.89Å; G73-T76 PolarHBondContact O-OG1 2.83Å; D74-T76 VanDerWaalsContact C-N 3.31Å; D74-T76 PolarHBondContact O-N 2.87Å; T76-M79 PolarHBondContact O-N 3.02Å; T76-T80 PolarHBondContact O-N 3.29Å; T76-T80 PolarHBondContact O-OG1 3.12Å
77	A	78.8	Confident	69.5	Low	59 Å²	59	98.6 Å²	98.6	49%	0.488	56%	0.56	S	S	.	*	H	α-helix	trans	-63.9	-45.9	175.9	0	0	0	0	0	111.7	G73 D74 T80 A81	G73-A77 PolarHBondContact O-N 3.43Å; G73-A77 VanDerWaalsContact O-N 3.07Å; D74-A77 PolarHBondContact O-N 2.88Å; D74-A77 VanDerWaalsContact O-N 3.17Å; A77-T80 PolarHBondContact O-N 3.24Å; A77-A81 PolarHBondContact O-N 3.23Å
78	F	81.7	Confident	72.1	Confident	121 Å²	121	96.5 Å²	96.5	53%	0.531	55%	0.547	S	S	.	.	H	α-helix	trans	-59.1	-48.2	175.6	178	-98.5	0	0	0	112.2	D74 T80 A81 V82	D74-F78 PolarHBondContact O-N 3Å; F78-T80 VanDerWaalsContact C-N 3.31Å; F78-T80 PolarHBondContact O-N 3.48Å; F78-A81 PolarHBondContact O-N 3.01Å; F78-V82 HydrophobicContact CD1-CG2 4.21Å; F78-V82 HydrophobicContact CD2-CG2 4.45Å; F78-V82 HydrophobicContact CE1-CG2 3.75Å; F78-V82 HydrophobicContact CE2-CG2 4.01Å; F78-V82 HydrophobicContact CZ-CG2 3.64Å; F78-V82 WeakPolarHBondContact O-CG2 3.5Å; F78-V82 PolarHBondContact O-N 3.4Å
79	M	84	Confident	74.6	Confident	118 Å²	118	95.5 Å²	95.5	58%	0.581	53%	0.529	S	S	*	.	H	α-helix	trans	-63.3	-35.4	179.2	-70.1	-65.4	-72.4	0	0	112.4	V75 T76 A83	V75-M79 HydrophobicContact CG1-CG 4.38Å; V75-M79 WeakPolarHBondContact O-CB 3.25Å; V75-M79 VanDerWaalsContact O-CG 3.24Å; V75-M79 WeakPolarHBondContact O-CG 3.24Å; V75-M79 PolarHBondContact O-N 3.32Å; T76-M79 PolarHBondContact O-N 3.02Å; M79-A83 WeakPolarHBondContact O-CB 3.28Å; M79-A83 PolarHBondContact O-N 2.96Å
80	T	85.7	Confident	76.9	Confident	78 Å²	78	92.3 Å²	92.3	48%	0.479	51%	0.514	S	S	.	.	H	α-helix	trans	-66.4	-43.1	172.8	-60.8	0	0	0	0	112.1	T76 A77 F78 A83 Q84	T76-T80 PolarHBondContact O-N 3.29Å; T76-T80 PolarHBondContact O-OG1 3.12Å; A77-T80 PolarHBondContact O-N 3.24Å; F78-T80 VanDerWaalsContact C-N 3.31Å; F78-T80 PolarHBondContact O-N 3.48Å; T80-A83 PolarHBondContact O-N 3.2Å; T80-Q84 WeakPolarHBondContact O-CG 3.43Å; T80-Q84 PolarHBondContact O-N 3.17Å
81	A	82.9	Confident	79.2	Confident	52 Å²	52	86 Å²	86	43%	0.43	49%	0.494	S	S	.	.	H	α-helix	trans	-63.5	-44.3	177.2	0	0	0	0	0	112	A77 F78 A83 Q84 D85	A77-A81 PolarHBondContact O-N 3.23Å; F78-A81 PolarHBondContact O-N 3.01Å; A81-A83 VanDerWaalsContact C-N 3.32Å; A81-A83 PolarHBondContact O-N 3.39Å; A81-Q84 PolarHBondContact O-N 2.99Å; A81-D85 WeakPolarHBondContact O-CB 3.48Å; A81-D85 PolarHBondContact O-N 2.68Å
82	V	85.3	Confident	81.2	Confident	65 Å²	65	83 Å²	83	39%	0.394	48%	0.478	S	S	.	.	H	α-helix	trans	-62.3	-38.3	175.2	172.7	0	0	0	0	111.5	F78 A86	F78-V82 HydrophobicContact CD1-CG2 4.21Å; F78-V82 HydrophobicContact CD2-CG2 4.45Å; F78-V82 HydrophobicContact CE1-CG2 3.75Å; F78-V82 HydrophobicContact CE2-CG2 4.01Å; F78-V82 HydrophobicContact CZ-CG2 3.64Å; F78-V82 WeakPolarHBondContact O-CG2 3.5Å; F78-V82 PolarHBondContact O-N 3.4Å; V82-A86 VanDerWaalsContact O-CB 3.28Å; V82-A86 WeakPolarHBondContact O-CB 3.39Å; V82-A86 PolarHBondContact O-N 3.08Å
83	A	87.3	Confident	83.2	Confident	59 Å²	59	87.5 Å²	87.5	49%	0.488	48%	0.477	S	S	.	.	H	α-helix	trans	-65.3	-40.8	175.3	0	0	0	0	0	112.6	M79 T80 A81 A86 Q87	M79-A83 WeakPolarHBondContact O-CB 3.28Å; M79-A83 PolarHBondContact O-N 2.96Å; T80-A83 PolarHBondContact O-N 3.2Å; A81-A83 VanDerWaalsContact C-N 3.32Å; A81-A83 PolarHBondContact O-N 3.39Å; A83-A86 PolarHBondContact O-N 3.22Å; A83-Q87 WeakPolarHBondContact O-CB 3.26Å; A83-Q87 PolarHBondContact O-N 3.36Å
84	Q	85.9	Confident	84.9	Confident	132 Å²	132	88.6 Å²	88.6	62%	0.617	48%	0.483	S	S	*	.	H	α-helix	trans	-65.8	-43.4	175.6	-71.5	176.6	-1.3	0	0	112.2	T80 A81 Q87 E88	T80-Q84 WeakPolarHBondContact O-CG 3.43Å; T80-Q84 PolarHBondContact O-N 3.17Å; A81-Q84 PolarHBondContact O-N 2.99Å; Q84-Q87 WeakPolarHBondContact O-CB 3.45Å; Q84-Q87 PolarHBondContact O-N 3.13Å; Q84-E88 PolarHBondContact O-N 3.39Å
85	D	87.6	Confident	86.2	Confident	66 Å²	66	89.3 Å²	89.3	35%	0.353	48%	0.476	S	S	.	.	H	α-helix	trans	-69.3	-30.1	177.1	172.7	45.3	0	0	0	112.6	A81 R89	A81-D85 WeakPolarHBondContact O-CB 3.48Å; A81-D85 PolarHBondContact O-N 2.68Å; D85-R89 WeakPolarHBondContact O-CG 3.31Å; D85-R89 PolarHBondContact O-N 3.32Å; D85-R89 PolarHBondContact O-NH1 3.49Å; D85-R89 IonicContact OD1-CZ 3.73Å; D85-R89 IonicContact OD1-NE 3.18Å; D85-R89 IonicContact OD1-NH1 2.79Å; D85-R89 PolarHBondContact OD1-NH1 2.77Å; D85-R89 IonicContact OD1-NH2 3.35Å; D85-R89 PolarHBondContact OD1-NH2 2.84Å; D85-R89 IonicContact OD2-CZ 4Å; D85-R89 IonicContact OD2-NH1 3.78Å; D85-R89 PolarHBondContact OD2-NH1 2.77Å; D85-R89 IonicContact OD2-NH2 2.69Å; D85-R89 PolarHBondContact OD2-NH2 3.25Å
86	A	86.3	Confident	86.9	Confident	52 Å²	52	88.9 Å²	88.9	43%	0.43	47%	0.468	S	S	.	.	H	α-helix	trans	-68.1	-44.9	168.2	0	0	0	0	0	111.9	V82 A83 R89 A90	V82-A86 VanDerWaalsContact O-CB 3.28Å; V82-A86 WeakPolarHBondContact O-CB 3.39Å; V82-A86 PolarHBondContact O-N 3.08Å; A83-A86 PolarHBondContact O-N 3.22Å; A86-R89 PolarHBondContact O-N 3.33Å; A86-A90 PolarHBondContact O-N 2.78Å
87	Q	90.8	Very high	87.4	Confident	106 Å²	106	89.2 Å²	89.2	50%	0.495	46%	0.459	S	S	.	.	H	α-helix	trans	-61.8	-47.3	177	177.1	63.7	17.3	0	0	111.8	A83 Q84 R89 A90 E91	A83-Q87 WeakPolarHBondContact O-CB 3.26Å; A83-Q87 PolarHBondContact O-N 3.36Å; Q84-Q87 WeakPolarHBondContact O-CB 3.45Å; Q84-Q87 PolarHBondContact O-N 3.13Å; Q87-R89 VanDerWaalsContact C-N 3.32Å; Q87-R89 PolarHBondContact O-N 2.99Å; Q87-A90 WeakPolarHBondContact O-CA 3.48Å; Q87-A90 WeakPolarHBondContact O-CB 3.49Å; Q87-A90 PolarHBondContact O-N 3.34Å; Q87-E91 PolarHBondContact NE2-OE1 3.18Å; Q87-E91 PolarHBondContact O-N 2.86Å
88	E	90.8	Very high	88.1	Confident	77 Å²	77	91.1 Å²	91.1	36%	0.36	46%	0.458	S	S	.	.	H	α-helix	trans	-65.4	-36.4	-178.5	-157.1	-106.1	122.4	0	0	111.4	Q84 E91 R92	Q84-E88 PolarHBondContact O-N 3.39Å; E88-E91 PolarHBondContact O-N 3Å; E88-R92 VanDerWaalsContact O-CB 3.23Å; E88-R92 WeakPolarHBondContact O-CB 3.41Å; E88-R92 PolarHBondContact O-N 3.36Å; E88-R92 IonicContact OE1-CZ 2.91Å; E88-R92 IonicContact OE1-NE 3.45Å; E88-R92 PolarHBondContact OE1-NE 2.91Å; E88-R92 VanDerWaalsContact OE1-NE 3.16Å; E88-R92 IonicContact OE1-NH2 3.01Å; E88-R92 PolarHBondContact OE1-NH2 3.43Å; E88-R92 IonicContact OE2-CZ 2.95Å; E88-R92 IonicContact OE2-NH2 3.92Å; E88-R92 PolarHBondContact OE2-NH2 2.9Å
89	R	89.1	Confident	88.6	Confident	107 Å²	107	93.9 Å²	93.9	40%	0.404	47%	0.465	S	S	.	.	H	α-helix	trans	-64.8	-38	169.5	-72.7	-169	-159.1	89.7	-3.2	112.9	D85 A86 Q87 R92 R93	D85-R89 WeakPolarHBondContact O-CG 3.31Å; D85-R89 PolarHBondContact O-N 3.32Å; D85-R89 PolarHBondContact O-NH1 3.49Å; D85-R89 IonicContact OD1-CZ 3.73Å; D85-R89 IonicContact OD1-NE 3.18Å; D85-R89 IonicContact OD1-NH1 2.79Å; D85-R89 PolarHBondContact OD1-NH1 2.77Å; D85-R89 IonicContact OD1-NH2 3.35Å; D85-R89 PolarHBondContact OD1-NH2 2.84Å; D85-R89 IonicContact OD2-CZ 4Å; D85-R89 IonicContact OD2-NH1 3.78Å; D85-R89 PolarHBondContact OD2-NH1 2.77Å; D85-R89 IonicContact OD2-NH2 2.69Å; D85-R89 PolarHBondContact OD2-NH2 3.25Å; A86-R89 PolarHBondContact O-N 3.33Å; Q87-R89 VanDerWaalsContact C-N 3.32Å; Q87-R89 PolarHBondContact O-N 2.99Å; R89-R92 PolarHBondContact O-N 3.42Å; R89-R93 WeakPolarHBondContact O-CG 3.24Å; R89-R93 PolarHBondContact O-N 3.4Å
90	A	86.8	Confident	89.1	Confident	48 Å²	48	88.2 Å²	88.2	40%	0.397	44%	0.437	S	S	.	.	H	α-helix	trans	-64.9	-45.8	176.1	0	0	0	0	0	111.4	A86 Q87 R92 R93 A94	A86-A90 PolarHBondContact O-N 2.78Å; Q87-A90 WeakPolarHBondContact O-CA 3.48Å; Q87-A90 WeakPolarHBondContact O-CB 3.49Å; Q87-A90 PolarHBondContact O-N 3.34Å; A90-R92 VanDerWaalsContact C-N 3.33Å; A90-R92 PolarHBondContact O-N 2.91Å; A90-R93 PolarHBondContact O-N 2.93Å; A90-A94 WeakPolarHBondContact O-CB 3.47Å; A90-A94 PolarHBondContact O-N 3.33Å
91	E	90.9	Very high	89.5	Confident	88 Å²	88	86.4 Å²	86.4	41%	0.411	42%	0.424	S	S	.	.	H	α-helix	trans	-64.4	-35	175	-70.4	176.8	-165.4	0	0	113	Q87 E88 A94 R95	Q87-E91 PolarHBondContact NE2-OE1 3.18Å; Q87-E91 PolarHBondContact O-N 2.86Å; E88-E91 PolarHBondContact O-N 3Å; E91-A94 PolarHBondContact O-N 3.48Å; E91-R95 WeakPolarHBondContact O-CB 3.47Å; E91-R95 WeakPolarHBondContact O-CG 3.48Å; E91-R95 PolarHBondContact O-N 2.83Å; E91-R95 PolarHBondContact O-NE 2.94Å; E91-R95 VanDerWaalsContact O-NE 3.16Å
92	R	89.6	Confident	90	Very high	110 Å²	110	90.3 Å²	90.3	42%	0.415	43%	0.432	S	S	.	.	H	α-helix	trans	-66.3	-44	174.7	-163	-175.8	-59.6	159.4	-6.8	111.1	E88 R89 A90 Q96	E88-R92 VanDerWaalsContact O-CB 3.23Å; E88-R92 WeakPolarHBondContact O-CB 3.41Å; E88-R92 PolarHBondContact O-N 3.36Å; E88-R92 IonicContact OE1-CZ 2.91Å; E88-R92 IonicContact OE1-NE 3.45Å; E88-R92 PolarHBondContact OE1-NE 2.91Å; E88-R92 VanDerWaalsContact OE1-NE 3.16Å; E88-R92 IonicContact OE1-NH2 3.01Å; E88-R92 PolarHBondContact OE1-NH2 3.43Å; E88-R92 IonicContact OE2-CZ 2.95Å; E88-R92 IonicContact OE2-NH2 3.92Å; E88-R92 PolarHBondContact OE2-NH2 2.9Å; R89-R92 PolarHBondContact O-N 3.42Å; A90-R92 VanDerWaalsContact C-N 3.33Å; A90-R92 PolarHBondContact O-N 2.91Å; R92-Q96 WeakPolarHBondContact O-CG 3.27Å; R92-Q96 PolarHBondContact O-N 3.22Å
93	R	88.7	Confident	90.4	Very high	153 Å²	153	88.9 Å²	88.9	58%	0.577	42%	0.422	S	S	*	.	H	α-helix	trans	-63.6	-40.2	172.2	-74.5	176.8	179.5	161.8	-1.3	112.3	R89 A90 Q96 R97	R89-R93 WeakPolarHBondContact O-CG 3.24Å; R89-R93 PolarHBondContact O-N 3.4Å; A90-R93 PolarHBondContact O-N 2.93Å; R93-Q96 PolarHBondContact O-N 2.97Å; R93-R97 WeakPolarHBondContact O-CB 3.46Å; R93-R97 PolarHBondContact O-N 2.72Å
94	A	89.4	Confident	90.8	Very high	60 Å²	60	87.4 Å²	87.4	50%	0.496	40%	0.404	S	S	.	.	H	α-helix	trans	-61.7	-48.3	177.1	0	0	0	0	0	111.7	A90 E91 Q96 R97 E98	A90-A94 WeakPolarHBondContact O-CB 3.47Å; A90-A94 PolarHBondContact O-N 3.33Å; E91-A94 PolarHBondContact O-N 3.48Å; A94-Q96 VanDerWaalsContact C-N 3.32Å; A94-Q96 PolarHBondContact O-N 3.45Å; A94-R97 PolarHBondContact O-N 2.72Å; A94-E98 PolarHBondContact O-N 2.84Å
95	R	91.5	Very high	91.2	Very high	141 Å²	141	84.8 Å²	84.8	53%	0.532	39%	0.394	S	S	.	.	H	α-helix	trans	-61.8	-36.4	174.6	-73.6	177.7	-74.7	168.1	-7.4	112.8	E91 R99	E91-R95 WeakPolarHBondContact O-CB 3.47Å; E91-R95 WeakPolarHBondContact O-CG 3.48Å; E91-R95 PolarHBondContact O-N 2.83Å; E91-R95 PolarHBondContact O-NE 2.94Å; E91-R95 VanDerWaalsContact O-NE 3.16Å; R95-R99 WeakPolarHBondContact O-CB 3.49Å; R95-R99 PolarHBondContact O-N 3.35Å
96	Q	91.3	Very high	91.4	Very high	86 Å²	86	88.5 Å²	88.5	40%	0.402	40%	0.403	S	S	.	.	H	α-helix	trans	-65.2	-46.7	172.6	-77.5	169.9	-29.9	0	0	111.6	R92 R93 A94 R99 A100 V129	R92-Q96 WeakPolarHBondContact O-CG 3.27Å; R92-Q96 PolarHBondContact O-N 3.22Å; R93-Q96 PolarHBondContact O-N 2.97Å; A94-Q96 VanDerWaalsContact C-N 3.32Å; A94-Q96 PolarHBondContact O-N 3.45Å; Q96-R99 PolarHBondContact O-N 2.98Å; Q96-A100 WeakPolarHBondContact O-CB 3.46Å; Q96-A100 PolarHBondContact O-N 2.7Å; Q96-V129 HydrophobicContact CB-CG1 4.2Å; Q96-V129 HydrophobicContact CG-CG1 4.45Å; Q96-V129 VanDerWaalsContact O-CG1 3.3Å; Q96-V129 WeakPolarHBondContact O-CG1 3.11Å
97	R	91.9	Very high	91.6	Very high	95 Å²	95	86 Å²	86	36%	0.358	38%	0.383	S	S	.	.	H	α-helix	trans	-62.4	-45.3	178.7	-172.6	160.2	-69.7	158.4	5.4	112.1	R93 A94 R99 A100 D101 D132 Y133	R93-R97 WeakPolarHBondContact O-CB 3.46Å; R93-R97 PolarHBondContact O-N 2.72Å; A94-R97 PolarHBondContact O-N 2.72Å; R97-R99 VanDerWaalsContact C-N 3.29Å; R97-R99 PolarHBondContact O-N 3.48Å; R97-A100 CarbonylContact O-C 3.59Å; R97-A100 PolarHBondContact O-N 2.76Å; R97-A100 VanDerWaalsContact O-N 3.16Å; R97-D101 WeakPolarHBondContact O-CB 3.41Å; R97-D101 PolarHBondContact O-N 2.97Å; R97-D132 VanDerWaalsContact NH2-CG 3.31Å; R97-D132 IonicContact NH2-OD1 3.36Å; R97-D132 PolarHBondContact NH2-OD1 3.26Å; R97-D132 IonicContact NH2-OD2 3.2Å; R97-D132 PolarHBondContact NH2-OD2 3.22Å; R97-Y133 HydrophobicContact CG-CD1 4.28Å; R97-Y133 HydrophobicContact CG-CE1 4.05Å
98	E	92.3	Very high	91.5	Very high	100 Å²	100	82.6 Å²	82.6	47%	0.467	37%	0.368	S	S	.	.	H	α-helix	trans	-58.6	-38.9	175	-166	-142.6	157.3	0	0	112.6	A94 D101 K102	A94-E98 PolarHBondContact O-N 2.84Å; E98-D101 PolarHBondContact O-N 2.9Å; E98-K102 WeakPolarHBondContact O-CG 3.42Å; E98-K102 PolarHBondContact O-N 3.4Å; E98-K102 WeakPolarHBondContact OE1-CE 3.48Å; E98-K102 IonicContact OE1-NZ 3.15Å; E98-K102 PolarHBondContact OE1-NZ 2.87Å
99	R	92.3	Very high	91.4	Very high	178 Å²	178	82.9 Å²	82.9	67%	0.672	38%	0.375	S	S	*	.	H	α-helix	trans	-72.6	-37.5	177.1	-165.1	176.8	-164.4	166.9	4.9	112	R95 Q96 R97 L103 V129	R95-R99 WeakPolarHBondContact O-CB 3.49Å; R95-R99 PolarHBondContact O-N 3.35Å; Q96-R99 PolarHBondContact O-N 2.98Å; R97-R99 VanDerWaalsContact C-N 3.29Å; R97-R99 PolarHBondContact O-N 3.48Å; R99-L103 PolarHBondContact O-N 3.38Å; R99-V129 HydrophobicContact CB-CG1 4.18Å; R99-V129 HydrophobicContact CG-CG1 4.5Å
100	A	94.1	Very high	91	Very high	0 Å²	0	80.2 Å²	80.2	0%	0	37%	0.367	C	S	.	.	H	α-helix	trans	-67.6	-34.5	171.9	0	0	0	0	0	111.9	Q96 R97 L103 K104 A126 V129 A130 Y133 L136	Q96-A100 WeakPolarHBondContact O-CB 3.46Å; Q96-A100 PolarHBondContact O-N 2.7Å; R97-A100 CarbonylContact O-C 3.59Å; R97-A100 PolarHBondContact O-N 2.76Å; R97-A100 VanDerWaalsContact O-N 3.16Å; A100-L103 CarbonylContact O-C 3.59Å; A100-L103 PolarHBondContact O-N 3.18Å; A100-K104 VanDerWaalsContact O-CB 3.24Å; A100-K104 WeakPolarHBondContact O-CB 3.39Å; A100-K104 PolarHBondContact O-N 2.9Å; A100-A126 HydrophobicContact CB-CB 4.28Å; A100-V129 HydrophobicContact CB-CB 4.41Å; A100-V129 HydrophobicContact CB-CG1 4.26Å; A100-A130 HydrophobicContact CB-CB 3.62Å; A100-Y133 HydrophobicContact CB-CD1 4.47Å; A100-L136 HydrophobicContact CB-CD1 4.39Å
101	D	94	Very high	90.9	Very high	40 Å²	40	79.8 Å²	79.8	21%	0.214	36%	0.356	C	S	.	.	H	α-helix	trans	-62.5	-43.8	175.2	-85.4	-47	0	0	0	112	R97 E98 L103 K104 D105 Y133	R97-D101 WeakPolarHBondContact O-CB 3.41Å; R97-D101 PolarHBondContact O-N 2.97Å; E98-D101 PolarHBondContact O-N 2.9Å; D101-L103 VanDerWaalsContact C-N 3.28Å; D101-L103 PolarHBondContact O-N 3.47Å; D101-K104 WeakPolarHBondContact O-CB 3.16Å; D101-K104 PolarHBondContact O-N 2.93Å; D101-K104 WeakPolarHBondContact OD1-CE 3.08Å; D101-K104 IonicContact OD1-NZ 2.7Å; D101-K104 PolarHBondContact OD1-NZ 2.89Å; D101-D105 WeakPolarHBondContact O-CB 3.21Å; D101-D105 PolarHBondContact O-N 2.76Å; D101-Y133 PolarHBondContact OD1-OH 2.72Å
102	K	94.1	Very high	90.5	Very high	134 Å²	134	82.5 Å²	82.5	58%	0.583	37%	0.366	S	S	*	.	H	α-helix	trans	-61.7	-35.7	174.5	-67.7	169.7	-170.6	175.2	0	112.3	E98 R106	E98-K102 WeakPolarHBondContact O-CG 3.42Å; E98-K102 PolarHBondContact O-N 3.4Å; E98-K102 WeakPolarHBondContact OE1-CE 3.48Å; E98-K102 IonicContact OE1-NZ 3.15Å; E98-K102 PolarHBondContact OE1-NZ 2.87Å; K102-R106 PolarHBondContact O-N 2.75Å
103	L	94.2	Very high	89.6	Confident	35 Å²	35	79 Å²	79	18%	0.183	36%	0.361	C	S	.	.	H	α-helix	trans	-73.3	-42.6	174	-69.7	170.1	0	0	0	112.1	R99 A100 D101 D105 R106 A107 L122 Q125 A126 V129	R99-L103 PolarHBondContact O-N 3.38Å; A100-L103 CarbonylContact O-C 3.59Å; A100-L103 PolarHBondContact O-N 3.18Å; D101-L103 VanDerWaalsContact C-N 3.28Å; D101-L103 PolarHBondContact O-N 3.47Å; L103-D105 VanDerWaalsContact C-N 3.35Å; L103-D105 PolarHBondContact O-N 3.3Å; L103-R106 PolarHBondContact O-N 3.15Å; L103-A107 WeakPolarHBondContact O-CB 3.38Å; L103-A107 PolarHBondContact O-N 3.05Å; L103-L122 HydrophobicContact CD2-CD2 4.2Å; L103-Q125 HydrophobicContact CD1-CB 4.22Å; L103-A126 HydrophobicContact CB-CB 3.78Å; L103-A126 HydrophobicContact CD1-CB 4.46Å; L103-V129 HydrophobicContact CD1-CG2 4.26Å
104	K	95.1	Very high	88.6	Confident	27 Å²	27	71.9 Å²	71.9	12%	0.117	34%	0.335	C	S	.	.	H	α-helix	trans	-59.4	-41.5	174.3	174.5	-143.9	72.8	-165.7	0	111.6	A100 D101 A107 N108 Y123 I135 L136	A100-K104 VanDerWaalsContact O-CB 3.24Å; A100-K104 WeakPolarHBondContact O-CB 3.39Å; A100-K104 PolarHBondContact O-N 2.9Å; D101-K104 WeakPolarHBondContact O-CB 3.16Å; D101-K104 PolarHBondContact O-N 2.93Å; D101-K104 WeakPolarHBondContact OD1-CE 3.08Å; D101-K104 IonicContact OD1-NZ 2.7Å; D101-K104 PolarHBondContact OD1-NZ 2.89Å; K104-A107 CarbonylContact O-C 3.59Å; K104-A107 WeakPolarHBondContact O-CB 3.33Å; K104-A107 PolarHBondContact O-N 2.94Å; K104-N108 WeakPolarHBondContact O-CB 3.39Å; K104-N108 VanDerWaalsContact O-CG 3.22Å; K104-N108 PolarHBondContact O-N 2.7Å; K104-N108 PolarHBondContact O-ND2 3.01Å; K104-Y123 HydrophobicContact CG-CE1 4.35Å; K104-I135 HydrophobicContact CD-CG2 4.35Å; K104-L136 HydrophobicContact CB-CD2 3.63Å; K104-L136 HydrophobicContact CD-CD2 4.29Å; K104-L136 HydrophobicContact CG-CD2 3.71Å
105	D	94.5	Very high	88	Confident	78 Å²	78	69.8 Å²	69.8	42%	0.417	32%	0.316	S	S	.	.	H	α-helix	trans	-76.1	-30.7	179.7	-72.5	-37.5	0	0	0	112.6	D101 L103 N108 T109	D101-D105 WeakPolarHBondContact O-CB 3.21Å; D101-D105 PolarHBondContact O-N 2.76Å; L103-D105 VanDerWaalsContact C-N 3.35Å; L103-D105 PolarHBondContact O-N 3.3Å; D105-N108 WeakPolarHBondContact O-CB 3.47Å; D105-N108 PolarHBondContact O-N 2.79Å; D105-N108 PolarHBondContact OD1-ND2 3.39Å; D105-T109 PolarHBondContact O-N 3.34Å
106	R	90.9	Very high	87.4	Confident	143 Å²	143	64.5 Å²	64.5	54%	0.54	30%	0.296	S	S	.	.	H	α-helix	trans	-65.4	-40.4	164.5	-161.2	-175.5	-169.8	-172.3	5.4	112	K102 L103 N108 T109 F110 L122	K102-R106 PolarHBondContact O-N 2.75Å; L103-R106 PolarHBondContact O-N 3.15Å; R106-N108 VanDerWaalsContact C-N 3.33Å; R106-T109 PolarHBondContact O-N 3.2Å; R106-T109 PolarHBondContact O-OG1 2.98Å; R106-F110 HydrophobicContact CG-CD2 4.26Å; R106-F110 HydrophobicContact CG-CE2 4Å; R106-F110 VanDerWaalsContact O-CD2 3.23Å; R106-F110 WeakPolarHBondContact O-CD2 3.32Å; R106-F110 PolarHBondContact O-N 2.98Å; R106-F110 VanDerWaalsContact O-N 3.11Å; R106-L122 HydrophobicContact CB-CD1 4.29Å; R106-L122 HydrophobicContact CG-CD1 3.91Å
107	A	90.5	Very high	87	Confident	0 Å²	0	65 Å²	65	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-65.5	-36.5	173.6	0	0	0	0	0	111.6	L103 K104 F110 F111 L122 Y123	L103-A107 WeakPolarHBondContact O-CB 3.38Å; L103-A107 PolarHBondContact O-N 3.05Å; K104-A107 CarbonylContact O-C 3.59Å; K104-A107 WeakPolarHBondContact O-CB 3.33Å; K104-A107 PolarHBondContact O-N 2.94Å; A107-F110 PolarHBondContact O-N 2.92Å; A107-F111 VanDerWaalsContact O-CB 3.22Å; A107-F111 WeakPolarHBondContact O-CB 3.25Å; A107-F111 PolarHBondContact O-N 2.72Å; A107-L122 HydrophobicContact CB-CB 3.67Å; A107-Y123 HydrophobicContact CB-CD1 3.48Å; A107-Y123 VanDerWaalsContact CB-CD1 3.48Å; A107-Y123 HydrophobicContact CB-CD2 4.12Å; A107-Y123 HydrophobicContact CB-CE1 3.33Å; A107-Y123 HydrophobicContact CB-CE2 4Å; A107-Y123 HydrophobicContact CB-CG 3.85Å
108	N	90.2	Very high	86.7	Confident	35 Å²	35	64.3 Å²	64.3	19%	0.187	30%	0.297	C	S	.	.	H	α-helix	trans	-63.8	-38.6	173.3	-75.9	-40	0	0	0	111.7	K104 D105 R106 F111 K112 Y123 N139	K104-N108 WeakPolarHBondContact O-CB 3.39Å; K104-N108 VanDerWaalsContact O-CG 3.22Å; K104-N108 PolarHBondContact O-N 2.7Å; K104-N108 PolarHBondContact O-ND2 3.01Å; D105-N108 WeakPolarHBondContact O-CB 3.47Å; D105-N108 PolarHBondContact O-N 2.79Å; D105-N108 PolarHBondContact OD1-ND2 3.39Å; R106-N108 VanDerWaalsContact C-N 3.33Å; N108-F111 PolarHBondContact O-N 3.43Å; N108-K112 WeakPolarHBondContact O-CB 3.2Å; N108-K112 VanDerWaalsContact O-CG 3.24Å; N108-K112 WeakPolarHBondContact O-CG 3.26Å; N108-K112 PolarHBondContact O-N 3.11Å; N108-Y123 PolarHBondContact OD1-OH 2.87Å; N108-Y123 VanDerWaalsContact OD1-OH 3.07Å; N108-N139 PolarHBondContact OD1-ND2 2.83Å
109	T	88.8	Confident	86.5	Confident	83 Å²	83	59.6 Å²	59.6	51%	0.509	28%	0.275	S	S	.	.	H	α-helix	trans	-69.3	-42.2	175.1	58.1	0	0	0	0	111.8	D105 R106 F111 K112 A113	D105-T109 PolarHBondContact O-N 3.34Å; R106-T109 PolarHBondContact O-N 3.2Å; R106-T109 PolarHBondContact O-OG1 2.98Å; T109-F111 PolarHBondContact O-N 2.98Å; T109-K112 PolarHBondContact O-N 2.08Å; T109-A113 WeakPolarHBondContact O-CB 3.47Å; T109-A113 PolarHBondContact O-N 2.09Å
110	F	80.7	Confident	86.6	Confident	51 Å²	51	51.9 Å²	51.9	22%	0.224	25%	0.247	C	C	.	.	H	α-helix	trans	-64.1	-37.3	172.3	-76.4	-66.8	0	0	0	112.8	R106 A107 A113 G114 N115 K118 A119 L122	R106-F110 HydrophobicContact CG-CD2 4.26Å; R106-F110 HydrophobicContact CG-CE2 4Å; R106-F110 VanDerWaalsContact O-CD2 3.23Å; R106-F110 WeakPolarHBondContact O-CD2 3.32Å; R106-F110 PolarHBondContact O-N 2.98Å; R106-F110 VanDerWaalsContact O-N 3.11Å; A107-F110 PolarHBondContact O-N 2.92Å; F110-A113 CarbonylContact O-C 3.37Å; F110-A113 PolarHBondContact O-N 2.89Å; F110-G114 CarbonylContact O-C 3.07Å; F110-G114 PolarHBondContact O-N 3.34Å; F110-N115 HydrophobicContact CB-CB 4.46Å; F110-N115 HydrophobicContact CD1-CB 4.2Å; F110-N115 PolarHBondContact O-N 2.07Å; F110-K118 HydrophobicContact CD1-CB 4.35Å; F110-K118 HydrophobicContact CD1-CD 4.06Å; F110-K118 HydrophobicContact CD1-CG 4.22Å; F110-K118 HydrophobicContact CD2-CG 4.14Å; F110-K118 HydrophobicContact CE1-CD 3.78Å; F110-K118 HydrophobicContact CE1-CG 4.35Å; F110-K118 HydrophobicContact CE2-CD 4.27Å; F110-K118 HydrophobicContact CE2-CG 4.25Å; F110-K118 HydrophobicContact CG-CB 4.29Å; F110-K118 HydrophobicContact CG-CD 4.45Å; F110-K118 HydrophobicContact CG-CG 4.13Å; F110-K118 HydrophobicContact CZ-CD 3.89Å; F110-K118 HydrophobicContact CZ-CG 4.36Å; F110-A119 HydrophobicContact CB-CB 4.39Å; F110-L122 HydrophobicContact CD2-CD1 3.35Å; F110-L122 HydrophobicContact CE2-CD1 3.67Å; F110-L122 HydrophobicContact CG-CD1 4.44Å
111	F	84.5	Confident	86.5	Confident	38 Å²	38	57 Å²	57	17%	0.167	27%	0.271	C	S	.	.	H	α-helix	trans	-66.1	-42.2	174.8	-174.8	-81.6	0	0	0	112.2	A107 N108 T109 A113 G114 F116 A119 Q142 A143	A107-F111 VanDerWaalsContact O-CB 3.22Å; A107-F111 WeakPolarHBondContact O-CB 3.25Å; A107-F111 PolarHBondContact O-N 2.72Å; N108-F111 PolarHBondContact O-N 3.43Å; T109-F111 PolarHBondContact O-N 2.98Å; F111-A113 VanDerWaalsContact C-N 3.33Å; F111-G114 WeakPolarHBondContact O-CA 3.43Å; F111-G114 PolarHBondContact O-N 3.45Å; F111-F116 AromaticContact CD2-CD1 3.72Å; F111-F116 HydrophobicContact CD2-CD1 3.72Å; F111-F116 HydrophobicContact CD2-CE1 4.01Å; F111-F116 HydrophobicContact CE1-CE1 4.45Å; F111-F116 AromaticContact CE2-CD1 3.76Å; F111-F116 HydrophobicContact CE2-CD1 3.76Å; F111-F116 AromaticContact CE2-CE1 3.86Å; F111-F116 HydrophobicContact CE2-CE1 3.86Å; F111-F116 HydrophobicContact CG-CD1 4.37Å; F111-F116 HydrophobicContact CG-CE1 4.37Å; F111-F116 HydrophobicContact CZ-CD1 4.44Å; F111-F116 HydrophobicContact CZ-CE1 4.08Å; F111-A119 HydrophobicContact CB-CB 3.99Å; F111-A119 HydrophobicContact CD2-CB 4.47Å; F111-Q142 HydrophobicContact CE2-CB 4.3Å; F111-Q142 HydrophobicContact CE2-CG 4.21Å; F111-Q142 HydrophobicContact CZ-CB 4.36Å; F111-Q142 HydrophobicContact CZ-CG 3.8Å; F111-A143 HydrophobicContact CD2-CB 3.98Å; F111-A143 HydrophobicContact CE2-CB 3.98Å
112	K	81.6	Confident	86.5	Confident	145 Å²	145	55.4 Å²	55.4	63%	0.63	26%	0.263	S	S	*	.	H	α-helix	trans	-66	-34.9	173.9	-75.2	173.5	-179.4	-176.6	0	112.3	N108 T109 G114	N108-K112 WeakPolarHBondContact O-CB 3.2Å; N108-K112 VanDerWaalsContact O-CG 3.24Å; N108-K112 WeakPolarHBondContact O-CG 3.26Å; N108-K112 PolarHBondContact O-N 3.11Å; T109-K112 PolarHBondContact O-N 2.08Å; K112-G114 PolarHBondContact O-N 2.08Å
113	A	70.7	Confident	86.7	Confident	38 Å²	38	49.1 Å²	49.1	31%	0.314	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.8	-7.5	169.1	0	0	0	0	0	112.9	T109 F110 F111 N697 T698	T109-A113 WeakPolarHBondContact O-CB 3.47Å; T109-A113 PolarHBondContact O-N 2.09Å; F110-A113 CarbonylContact O-C 3.37Å; F110-A113 PolarHBondContact O-N 2.89Å; F111-A113 VanDerWaalsContact C-N 3.33Å; A113-N697 CarbonylContact O-C 3.55Å; A113-T698 VanDerWaalsContact O-CA 3.23Å; A113-T698 WeakPolarHBondContact O-CA 3.24Å; A113-T698 PolarHBondContact O-N 2.75Å
114	G	67.9	Low	86.8	Confident	2 Å²	2	48.7 Å²	48.7	2%	0.021	24%	0.236	C	C	.	.	T	Hydrogen-bonded Turn	trans	78.5	3.8	-179.8	0	0	0	0	0	116	F110 F111 K112 F116 T698	F110-G114 CarbonylContact O-C 3.07Å; F110-G114 PolarHBondContact O-N 3.34Å; F111-G114 WeakPolarHBondContact O-CA 3.43Å; F111-G114 PolarHBondContact O-N 3.45Å; K112-G114 PolarHBondContact O-N 2.08Å; G114-F116 WeakPolarHBondContact O-CD2 3.29Å; G114-F116 WeakPolarHBondContact O-CE2 3.34Å; G114-F116 WeakPolarHBondContact O-CG 3.19Å; G114-F116 PolarHBondContact O-N 2.94Å; G114-T698 CarbonylContact C-O 3.55Å; G114-T698 CarbonylContact O-C 3.52Å
115	N	77.2	Confident	86.8	Confident	17 Å²	17	52 Å²	52	9%	0.091	25%	0.251	C	S	.	.			trans	-75.1	76.3	172.1	-168.9	-24.8	0	0	0	110.5	F110 K117 K118 A119 Q700	F110-N115 HydrophobicContact CB-CB 4.46Å; F110-N115 HydrophobicContact CD1-CB 4.2Å; F110-N115 PolarHBondContact O-N 2.07Å; N115-K117 VanDerWaalsContact C-N 3.31Å; N115-K117 PolarHBondContact O-N 3.04Å; N115-K118 HydrophobicContact CB-CB 4.38Å; N115-K118 PolarHBondContact O-N 2.88Å; N115-K118 VanDerWaalsContact OD1-CB 3.29Å; N115-K118 WeakPolarHBondContact OD1-CB 3.33Å; N115-K118 PolarHBondContact OD1-N 3.13Å; N115-K118 VanDerWaalsContact OD1-N 3.1Å; N115-A119 WeakPolarHBondContact O-CB 3.34Å; N115-A119 PolarHBondContact O-N 2.75Å; N115-Q700 PolarHBondContact ND2-OE1 3.41Å
116	F	79.3	Confident	86.9	Confident	29 Å²	29	48.3 Å²	48.3	13%	0.127	23%	0.232	C	C	.	.	H	α-helix	trans	-65.4	-30.6	-174	-53.3	-61.7	0	0	0	112.8	F111 G114 A119 V120 A143 R146 L147	F111-F116 AromaticContact CD2-CD1 3.72Å; F111-F116 HydrophobicContact CD2-CD1 3.72Å; F111-F116 HydrophobicContact CD2-CE1 4.01Å; F111-F116 HydrophobicContact CE1-CE1 4.45Å; F111-F116 AromaticContact CE2-CD1 3.76Å; F111-F116 HydrophobicContact CE2-CD1 3.76Å; F111-F116 AromaticContact CE2-CE1 3.86Å; F111-F116 HydrophobicContact CE2-CE1 3.86Å; F111-F116 HydrophobicContact CG-CD1 4.37Å; F111-F116 HydrophobicContact CG-CE1 4.37Å; F111-F116 HydrophobicContact CZ-CD1 4.44Å; F111-F116 HydrophobicContact CZ-CE1 4.08Å; G114-F116 WeakPolarHBondContact O-CD2 3.29Å; G114-F116 WeakPolarHBondContact O-CE2 3.34Å; G114-F116 WeakPolarHBondContact O-CG 3.19Å; G114-F116 PolarHBondContact O-N 2.94Å; F116-A119 PolarHBondContact O-N 3.21Å; F116-V120 WeakPolarHBondContact O-CG2 3.38Å; F116-V120 PolarHBondContact O-N 2.98Å; F116-A143 HydrophobicContact CB-CB 4.41Å; F116-R146 HydrophobicContact CB-CB 4.46Å; F116-R146 HydrophobicContact CD1-CB 3.8Å; F116-R146 HydrophobicContact CD1-CG 4.22Å; F116-R146 HydrophobicContact CD2-CB 3.56Å; F116-R146 HydrophobicContact CE1-CB 3.88Å; F116-R146 HydrophobicContact CE1-CG 3.88Å; F116-R146 HydrophobicContact CE2-CB 3.64Å; F116-R146 HydrophobicContact CE2-CG 4.2Å; F116-R146 HydrophobicContact CG-CB 3.66Å; F116-R146 HydrophobicContact CZ-CB 3.81Å; F116-R146 HydrophobicContact CZ-CG 3.87Å; F116-L147 HydrophobicContact CB-CD1 4.3Å; F116-L147 HydrophobicContact CB-CD2 3.81Å; F116-L147 HydrophobicContact CB-CG 3.78Å
117	K	83.2	Confident	87.1	Confident	98 Å²	98	41.9 Å²	41.9	43%	0.426	21%	0.208	S	C	.	.	H	α-helix	trans	-63.7	-50.7	175.3	-64	-169.5	177.9	178.3	0	111	N115 A119 V120 E121 L147 S702	N115-K117 VanDerWaalsContact C-N 3.31Å; N115-K117 PolarHBondContact O-N 3.04Å; K117-A119 VanDerWaalsContact C-N 3.3Å; K117-A119 PolarHBondContact O-N 2.96Å; K117-V120 WeakPolarHBondContact O-CB 3.37Å; K117-V120 PolarHBondContact O-N 3.13Å; K117-V120 VanDerWaalsContact O-N 3.12Å; K117-E121 WeakPolarHBondContact O-CG 3.22Å; K117-E121 PolarHBondContact O-N 3.42Å; K117-L147 HydrophobicContact CD-CD2 4.45Å; K117-L147 HydrophobicContact CG-CD1 4.21Å; K117-L147 HydrophobicContact CG-CD2 3.52Å; K117-S702 PolarHBondContact NZ-OG 2.88Å
118	K	84.7	Confident	87.2	Confident	80 Å²	80	47.2 Å²	47.2	35%	0.348	24%	0.236	S	C	.	.	H	α-helix	trans	-68.6	-28.6	178	-160.9	155	-171.6	160.5	0	113.1	F110 N115 L122	F110-K118 HydrophobicContact CD1-CB 4.35Å; F110-K118 HydrophobicContact CD1-CD 4.06Å; F110-K118 HydrophobicContact CD1-CG 4.22Å; F110-K118 HydrophobicContact CD2-CG 4.14Å; F110-K118 HydrophobicContact CE1-CD 3.78Å; F110-K118 HydrophobicContact CE1-CG 4.35Å; F110-K118 HydrophobicContact CE2-CD 4.27Å; F110-K118 HydrophobicContact CE2-CG 4.25Å; F110-K118 HydrophobicContact CG-CB 4.29Å; F110-K118 HydrophobicContact CG-CD 4.45Å; F110-K118 HydrophobicContact CG-CG 4.13Å; F110-K118 HydrophobicContact CZ-CD 3.89Å; F110-K118 HydrophobicContact CZ-CG 4.36Å; N115-K118 HydrophobicContact CB-CB 4.38Å; N115-K118 PolarHBondContact O-N 2.88Å; N115-K118 VanDerWaalsContact OD1-CB 3.29Å; N115-K118 WeakPolarHBondContact OD1-CB 3.33Å; N115-K118 PolarHBondContact OD1-N 3.13Å; N115-K118 VanDerWaalsContact OD1-N 3.1Å; K118-L122 HydrophobicContact CG-CD1 4.38Å; K118-L122 WeakPolarHBondContact O-CB 3.15Å; K118-L122 WeakPolarHBondContact O-CG 3.23Å; K118-L122 PolarHBondContact O-N 3.07Å; K118-L122 VanDerWaalsContact O-N 3.09Å
119	A	88.4	Confident	87.3	Confident	0 Å²	0	47.6 Å²	47.6	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-65.4	-46.7	168	0	0	0	0	0	111.6	F110 F111 N115 F116 K117 E121 L122 Y123	F110-A119 HydrophobicContact CB-CB 4.39Å; F111-A119 HydrophobicContact CB-CB 3.99Å; F111-A119 HydrophobicContact CD2-CB 4.47Å; N115-A119 WeakPolarHBondContact O-CB 3.34Å; N115-A119 PolarHBondContact O-N 2.75Å; F116-A119 PolarHBondContact O-N 3.21Å; K117-A119 VanDerWaalsContact C-N 3.3Å; K117-A119 PolarHBondContact O-N 2.96Å; A119-E121 PolarHBondContact O-N 2.79Å; A119-L122 PolarHBondContact O-N 2.74Å; A119-Y123 HydrophobicContact CB-CD2 4.31Å; A119-Y123 HydrophobicContact CB-CE2 3.93Å; A119-Y123 WeakPolarHBondContact O-CB 3.49Å; A119-Y123 WeakPolarHBondContact O-CD2 3.37Å; A119-Y123 PolarHBondContact O-N 3.16Å
120	V	93.3	Very high	87.4	Confident	16 Å²	16	43.8 Å²	43.8	10%	0.097	22%	0.217	C	C	.	.	H	α-helix	trans	-58.9	-43.4	174.8	164.5	0	0	0	0	111.8	F116 K117 S124 R140 A143 Y144 L147	F116-V120 WeakPolarHBondContact O-CG2 3.38Å; F116-V120 PolarHBondContact O-N 2.98Å; K117-V120 WeakPolarHBondContact O-CB 3.37Å; K117-V120 PolarHBondContact O-N 3.13Å; K117-V120 VanDerWaalsContact O-N 3.12Å; V120-S124 WeakPolarHBondContact O-CB 3.4Å; V120-S124 PolarHBondContact O-N 3.11Å; V120-S124 PolarHBondContact O-OG 3.21Å; V120-R140 HydrophobicContact CB-CG 4.41Å; V120-R140 HydrophobicContact CG1-CG 4.27Å; V120-R140 HydrophobicContact CG2-CG 4.06Å; V120-A143 HydrophobicContact CG2-CB 3.62Å; V120-Y144 HydrophobicContact CG1-CE1 3.66Å; V120-Y144 HydrophobicContact CG1-CE2 4.49Å; V120-Y144 WeakPolarHBondContact CG1-OH 3.35Å; V120-Y144 HydrophobicContact CG2-CD1 4.08Å; V120-Y144 HydrophobicContact CG2-CE1 4Å; V120-Y144 HydrophobicContact CG2-CG 4.46Å; V120-L147 HydrophobicContact CG2-CD1 3.87Å
121	E	93.3	Very high	87.8	Confident	107 Å²	107	47.6 Å²	47.6	50%	0.5	23%	0.233	S	C	.	.	H	α-helix	trans	-57.5	-50.5	174.6	-71.7	164.5	-166	0	0	111.7	K117 A119 S124 Q125	K117-E121 WeakPolarHBondContact O-CG 3.22Å; K117-E121 PolarHBondContact O-N 3.42Å; A119-E121 PolarHBondContact O-N 2.79Å; E121-S124 WeakPolarHBondContact O-CB 3.29Å; E121-S124 PolarHBondContact O-N 3.29Å; E121-Q125 WeakPolarHBondContact O-CG 3.19Å; E121-Q125 PolarHBondContact O-N 3.32Å
122	L	93.9	Very high	88	Confident	8 Å²	8	49.3 Å²	49.3	4%	0.042	24%	0.244	C	C	.	.	H	α-helix	trans	-72.8	-33.5	-177.7	-72.5	166.4	0	0	0	113.2	L103 R106 A107 F110 K118 A119 S124 Q125 A126	L103-L122 HydrophobicContact CD2-CD2 4.2Å; R106-L122 HydrophobicContact CB-CD1 4.29Å; R106-L122 HydrophobicContact CG-CD1 3.91Å; A107-L122 HydrophobicContact CB-CB 3.67Å; F110-L122 HydrophobicContact CD2-CD1 3.35Å; F110-L122 HydrophobicContact CE2-CD1 3.67Å; F110-L122 HydrophobicContact CG-CD1 4.44Å; K118-L122 HydrophobicContact CG-CD1 4.38Å; K118-L122 WeakPolarHBondContact O-CB 3.15Å; K118-L122 WeakPolarHBondContact O-CG 3.23Å; K118-L122 PolarHBondContact O-N 3.07Å; K118-L122 VanDerWaalsContact O-N 3.09Å; A119-L122 PolarHBondContact O-N 2.74Å; L122-S124 VanDerWaalsContact C-N 3.31Å; L122-Q125 PolarHBondContact O-N 3.45Å; L122-A126 WeakPolarHBondContact O-CB 3.14Å; L122-A126 PolarHBondContact O-N 2.64Å
123	Y	97.3	Very high	88.4	Confident	1 Å²	1	43.6 Å²	43.6	0%	0.004	22%	0.219	C	C	.	.	H	α-helix	trans	-65.2	-36.4	168.6	-68.8	-50.9	0	0	0	111.3	K104 A107 N108 A119 A126 I127 N139 R140	K104-Y123 HydrophobicContact CG-CE1 4.35Å; A107-Y123 HydrophobicContact CB-CD1 3.48Å; A107-Y123 VanDerWaalsContact CB-CD1 3.48Å; A107-Y123 HydrophobicContact CB-CD2 4.12Å; A107-Y123 HydrophobicContact CB-CE1 3.33Å; A107-Y123 HydrophobicContact CB-CE2 4Å; A107-Y123 HydrophobicContact CB-CG 3.85Å; N108-Y123 PolarHBondContact OD1-OH 2.87Å; N108-Y123 VanDerWaalsContact OD1-OH 3.07Å; A119-Y123 HydrophobicContact CB-CD2 4.31Å; A119-Y123 HydrophobicContact CB-CE2 3.93Å; A119-Y123 WeakPolarHBondContact O-CB 3.49Å; A119-Y123 WeakPolarHBondContact O-CD2 3.37Å; A119-Y123 PolarHBondContact O-N 3.16Å; Y123-A126 WeakPolarHBondContact O-CB 3.38Å; Y123-A126 PolarHBondContact O-N 2.86Å; Y123-I127 WeakPolarHBondContact O-CB 3.2Å; Y123-I127 WeakPolarHBondContact O-CD1 3.33Å; Y123-I127 VanDerWaalsContact O-CG1 3.25Å; Y123-I127 WeakPolarHBondContact O-CG1 3.42Å; Y123-I127 PolarHBondContact O-N 3.22Å; Y123-N139 HydrophobicContact CD1-CB 4.31Å; Y123-N139 HydrophobicContact CE1-CB 3.68Å; Y123-N139 HydrophobicContact CE2-CB 3.93Å; Y123-N139 VanDerWaalsContact CZ-CB 3.49Å; Y123-R140 HydrophobicContact CD2-CB 4.03Å; Y123-R140 HydrophobicContact CD2-CG 4.39Å; Y123-R140 HydrophobicContact CG-CB 4.17Å
124	S	96	Very high	89.3	Confident	27 Å²	27	42.5 Å²	42.5	19%	0.189	21%	0.208	C	C	.	.	H	α-helix	trans	-67	-44.1	176.2	-55.6	0	0	0	0	111.3	V120 E121 L122 A126 I127 D128 R140	V120-S124 WeakPolarHBondContact O-CB 3.4Å; V120-S124 PolarHBondContact O-N 3.11Å; V120-S124 PolarHBondContact O-OG 3.21Å; E121-S124 WeakPolarHBondContact O-CB 3.29Å; E121-S124 PolarHBondContact O-N 3.29Å; L122-S124 VanDerWaalsContact C-N 3.31Å; S124-A126 VanDerWaalsContact C-N 3.29Å; S124-A126 PolarHBondContact O-N 3.25Å; S124-I127 WeakPolarHBondContact O-CB 3.38Å; S124-I127 PolarHBondContact O-N 3.23Å; S124-I127 VanDerWaalsContact O-N 3.13Å; S124-D128 PolarHBondContact O-N 2.61Å; S124-R140 WeakPolarHBondContact OG-CD 3.47Å; S124-R140 PolarHBondContact OG-NH1 2.74Å
125	Q	95.5	Very high	90.5	Very high	96 Å²	96	44.7 Å²	44.7	45%	0.449	22%	0.219	S	C	.	.	H	α-helix	trans	-60.4	-36.8	171.5	-68.7	171.5	24	0	0	112.4	L103 E121 L122 V129	L103-Q125 HydrophobicContact CD1-CB 4.22Å; E121-Q125 WeakPolarHBondContact O-CG 3.19Å; E121-Q125 PolarHBondContact O-N 3.32Å; L122-Q125 PolarHBondContact O-N 3.45Å; Q125-V129 WeakPolarHBondContact O-CG2 3.46Å; Q125-V129 PolarHBondContact O-N 3.34Å
126	A	96.2	Very high	91.3	Very high	0 Å²	0	43.9 Å²	43.9	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-66.9	-40.3	174.1	0	0	0	0	0	111.8	A100 L103 L122 Y123 S124 V129 A130 L136	A100-A126 HydrophobicContact CB-CB 4.28Å; L103-A126 HydrophobicContact CB-CB 3.78Å; L103-A126 HydrophobicContact CD1-CB 4.46Å; L122-A126 WeakPolarHBondContact O-CB 3.14Å; L122-A126 PolarHBondContact O-N 2.64Å; Y123-A126 WeakPolarHBondContact O-CB 3.38Å; Y123-A126 PolarHBondContact O-N 2.86Å; S124-A126 VanDerWaalsContact C-N 3.29Å; S124-A126 PolarHBondContact O-N 3.25Å; A126-V129 PolarHBondContact O-N 3.49Å; A126-A130 PolarHBondContact O-N 2.86Å; A126-L136 VanDerWaalsContact C-CD1 3.46Å; A126-L136 HydrophobicContact CB-CD1 3.69Å; A126-L136 HydrophobicContact CB-CD2 3.96Å; A126-L136 HydrophobicContact CB-CG 4.42Å
127	I	96.1	Very high	92.1	Very high	8 Å²	8	44 Å²	44	4%	0.041	21%	0.214	C	C	.	.	H	α-helix	trans	-64.9	-41.5	176	-74.1	162.6	0	0	0	110.6	Y123 S124 V129 A130 K131 L136 Y137	Y123-I127 WeakPolarHBondContact O-CB 3.2Å; Y123-I127 WeakPolarHBondContact O-CD1 3.33Å; Y123-I127 VanDerWaalsContact O-CG1 3.25Å; Y123-I127 WeakPolarHBondContact O-CG1 3.42Å; Y123-I127 PolarHBondContact O-N 3.22Å; S124-I127 WeakPolarHBondContact O-CB 3.38Å; S124-I127 PolarHBondContact O-N 3.23Å; S124-I127 VanDerWaalsContact O-N 3.13Å; I127-V129 PolarHBondContact O-N 3.4Å; I127-A130 CarbonylContact O-C 3.59Å; I127-A130 PolarHBondContact O-N 3.49Å; I127-K131 HydrophobicContact CG2-CG 4.46Å; I127-K131 WeakPolarHBondContact O-CA 3.41Å; I127-K131 WeakPolarHBondContact O-CG 3.46Å; I127-K131 PolarHBondContact O-N 2.96Å; I127-K131 VanDerWaalsContact O-N 3.1Å; I127-L136 HydrophobicContact CD1-CB 4.05Å; I127-L136 HydrophobicContact CG1-CB 3.55Å; I127-L136 HydrophobicContact CG1-CD1 3.86Å; I127-L136 HydrophobicContact CG1-CG 4.38Å; I127-Y137 HydrophobicContact CD1-CD1 3.92Å; I127-Y137 HydrophobicContact CD1-CD2 4.26Å; I127-Y137 HydrophobicContact CD1-CE1 3.98Å; I127-Y137 HydrophobicContact CD1-CE2 4.29Å; I127-Y137 HydrophobicContact CD1-CG 4.08Å; I127-Y137 HydrophobicContact CG1-CD2 4.28Å; I127-Y137 HydrophobicContact CG1-CE1 4.47Å; I127-Y137 HydrophobicContact CG1-CE2 4.04Å; I127-Y137 HydrophobicContact CG2-CE1 4.14Å; I127-Y137 HydrophobicContact CG2-CE2 4.16Å; I127-Y137 WeakPolarHBondContact CG2-OH 3.38Å
128	D	93.4	Very high	92.6	Very high	112 Å²	112	39.6 Å²	39.6	60%	0.599	20%	0.195	S	C	*	.	H	α-helix	trans	-61.3	-27.9	176	-75.3	-41.4	0	0	0	113	S124	S124-D128 PolarHBondContact O-N 2.61Å
129	V	91.9	Very high	93.1	Very high	43 Å²	43	36.6 Å²	36.6	26%	0.261	18%	0.183	S	C	.	.	H	α-helix	trans	-82.9	-38.5	173.2	175.6	0	0	0	0	112.5	Q96 R99 A100 L103 Q125 A126 I127	Q96-V129 HydrophobicContact CB-CG1 4.2Å; Q96-V129 HydrophobicContact CG-CG1 4.45Å; Q96-V129 VanDerWaalsContact O-CG1 3.3Å; Q96-V129 WeakPolarHBondContact O-CG1 3.11Å; R99-V129 HydrophobicContact CB-CG1 4.18Å; R99-V129 HydrophobicContact CG-CG1 4.5Å; A100-V129 HydrophobicContact CB-CB 4.41Å; A100-V129 HydrophobicContact CB-CG1 4.26Å; L103-V129 HydrophobicContact CD1-CG2 4.26Å; Q125-V129 WeakPolarHBondContact O-CG2 3.46Å; Q125-V129 PolarHBondContact O-N 3.34Å; A126-V129 PolarHBondContact O-N 3.49Å; I127-V129 PolarHBondContact O-N 3.4Å
130	A	89.8	Confident	93.4	Very high	3 Å²	3	38.3 Å²	38.3	3%	0.025	19%	0.189	C	C	.	.			trans	-138.9	83.9	-176.5	0	0	0	0	0	111.8	A100 A126 I127 D132 Y133	A100-A130 HydrophobicContact CB-CB 3.62Å; A126-A130 PolarHBondContact O-N 2.86Å; I127-A130 CarbonylContact O-C 3.59Å; I127-A130 PolarHBondContact O-N 3.49Å; A130-D132 PolarHBondContact O-N 2.94Å; A130-Y133 WeakPolarHBondContact O-CB 3.27Å; A130-Y133 PolarHBondContact O-N 3.48Å
131	K	90.6	Very high	93.4	Very high	132 Å²	132	37.5 Å²	37.5	57%	0.574	19%	0.185	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71.4	-13.9	-177.2	-63.7	-176.8	-179.9	-172.4	0	114.1	I127 Y133 Y137	I127-K131 HydrophobicContact CG2-CG 4.46Å; I127-K131 WeakPolarHBondContact O-CA 3.41Å; I127-K131 WeakPolarHBondContact O-CG 3.46Å; I127-K131 PolarHBondContact O-N 2.96Å; I127-K131 VanDerWaalsContact O-N 3.1Å; K131-Y133 VanDerWaalsContact C-N 3.34Å; K131-Y137 PolarHBondContact O-OH 2.92Å
132	D	88.1	Confident	93.3	Very high	74 Å²	74	34.6 Å²	34.6	40%	0.396	17%	0.171	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.7	15.3	179.2	70.9	-32	0	0	0	113	R97 A130	R97-D132 VanDerWaalsContact NH2-CG 3.31Å; R97-D132 IonicContact NH2-OD1 3.36Å; R97-D132 PolarHBondContact NH2-OD1 3.26Å; R97-D132 IonicContact NH2-OD2 3.2Å; R97-D132 PolarHBondContact NH2-OD2 3.22Å; A130-D132 PolarHBondContact O-N 2.94Å
133	Y	90	Very high	92.9	Very high	25 Å²	25	34.2 Å²	34.2	10%	0.098	17%	0.169	C	C	.	.			trans	-109.4	91	-170.3	-161.9	-174.5	0	0	0	113.5	R97 A100 D101 A130 K131 I135 L136	R97-Y133 HydrophobicContact CG-CD1 4.28Å; R97-Y133 HydrophobicContact CG-CE1 4.05Å; A100-Y133 HydrophobicContact CB-CD1 4.47Å; D101-Y133 PolarHBondContact OD1-OH 2.72Å; A130-Y133 WeakPolarHBondContact O-CB 3.27Å; A130-Y133 PolarHBondContact O-N 3.48Å; K131-Y133 VanDerWaalsContact C-N 3.34Å; Y133-I135 VanDerWaalsContact C-N 3.29Å; Y133-I135 HydrophobicContact CD2-CB 4.21Å; Y133-I135 HydrophobicContact CD2-CG1 4.46Å; Y133-I135 HydrophobicContact CE2-CB 3.82Å; Y133-I135 HydrophobicContact CE2-CD1 3.81Å; Y133-I135 HydrophobicContact CE2-CG1 3.87Å; Y133-I135 PolarHBondContact O-N 3.24Å; Y133-I135 VanDerWaalsContact O-N 3.15Å; Y133-L136 HydrophobicContact CD1-CD1 3.81Å; Y133-L136 HydrophobicContact CD1-CD2 3.9Å; Y133-L136 HydrophobicContact CD1-CG 3.67Å; Y133-L136 HydrophobicContact CE1-CD2 4.15Å; Y133-L136 HydrophobicContact CE1-CG 4.38Å; Y133-L136 HydrophobicContact CG-CD1 4.14Å; Y133-L136 HydrophobicContact CG-CG 3.87Å; Y133-L136 WeakPolarHBondContact O-CB 3.36Å; Y133-L136 PolarHBondContact O-N 3.33Å
134	D	88.9	Confident	92.5	Very high	15 Å²	15	35.6 Å²	35.6	8%	0.08	18%	0.175	C	C	.	.	H	α-helix	trans	-39.5	-45.6	177	64.7	-27.2	0	0	0	115.7	L136 Y137 T138 L163 F164 R190	D134-L136 PolarHBondContact O-N 3.47Å; D134-Y137 PolarHBondContact O-N 3.03Å; D134-T138 WeakPolarHBondContact O-CB 3.06Å; D134-T138 PolarHBondContact O-N 3.21Å; D134-T138 PolarHBondContact O-OG1 3.28Å; D134-L163 HydrophobicContact CB-CB 4.29Å; D134-F164 HydrophobicContact CB-CE2 3.89Å; D134-F164 HydrophobicContact CB-CZ 3.9Å; D134-F164 WeakPolarHBondContact OD2-CZ 3.37Å; D134-R190 IonicContact OD2-CZ 2.7Å; D134-R190 IonicContact OD2-NE 2.67Å; D134-R190 PolarHBondContact OD2-NE 2.86Å; D134-R190 IonicContact OD2-NH2 3.52Å; D134-R190 PolarHBondContact OD2-NH2 3.31Å; D134-R190 VanDerWaalsContact OD2-NH2 3.11Å
135	I	93	Very high	91.9	Very high	48 Å²	48	36 Å²	36	25%	0.246	17%	0.174	C	C	.	.	H	α-helix	trans	-61.1	-33.5	-177	-63.9	-178.6	0	0	0	111.9	K104 Y133 T138 N139	K104-I135 HydrophobicContact CD-CG2 4.35Å; Y133-I135 VanDerWaalsContact C-N 3.29Å; Y133-I135 HydrophobicContact CD2-CB 4.21Å; Y133-I135 HydrophobicContact CD2-CG1 4.46Å; Y133-I135 HydrophobicContact CE2-CB 3.82Å; Y133-I135 HydrophobicContact CE2-CD1 3.81Å; Y133-I135 HydrophobicContact CE2-CG1 3.87Å; Y133-I135 PolarHBondContact O-N 3.24Å; Y133-I135 VanDerWaalsContact O-N 3.15Å; I135-T138 PolarHBondContact O-N 2.97Å; I135-N139 WeakPolarHBondContact O-CB 3.09Å; I135-N139 PolarHBondContact O-N 3.21Å
136	L	94.6	Very high	91.2	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-68.2	-49.9	-176.9	-52.8	-177.4	0	0	0	111.1	A100 K104 A126 I127 Y133 D134 T138 N139 R140	A100-L136 HydrophobicContact CB-CD1 4.39Å; K104-L136 HydrophobicContact CB-CD2 3.63Å; K104-L136 HydrophobicContact CD-CD2 4.29Å; K104-L136 HydrophobicContact CG-CD2 3.71Å; A126-L136 VanDerWaalsContact C-CD1 3.46Å; A126-L136 HydrophobicContact CB-CD1 3.69Å; A126-L136 HydrophobicContact CB-CD2 3.96Å; A126-L136 HydrophobicContact CB-CG 4.42Å; I127-L136 HydrophobicContact CD1-CB 4.05Å; I127-L136 HydrophobicContact CG1-CB 3.55Å; I127-L136 HydrophobicContact CG1-CD1 3.86Å; I127-L136 HydrophobicContact CG1-CG 4.38Å; Y133-L136 HydrophobicContact CD1-CD1 3.81Å; Y133-L136 HydrophobicContact CD1-CD2 3.9Å; Y133-L136 HydrophobicContact CD1-CG 3.67Å; Y133-L136 HydrophobicContact CE1-CD2 4.15Å; Y133-L136 HydrophobicContact CE1-CG 4.38Å; Y133-L136 HydrophobicContact CG-CD1 4.14Å; Y133-L136 HydrophobicContact CG-CG 3.87Å; Y133-L136 WeakPolarHBondContact O-CB 3.36Å; Y133-L136 PolarHBondContact O-N 3.33Å; D134-L136 PolarHBondContact O-N 3.47Å; L136-T138 VanDerWaalsContact C-N 3.34Å; L136-T138 PolarHBondContact O-N 2.82Å; L136-N139 PolarHBondContact O-N 3.04Å; L136-R140 VanDerWaalsContact O-CB 3.31Å; L136-R140 WeakPolarHBondContact O-CB 3.04Å; L136-R140 PolarHBondContact O-N 3.33Å
137	Y	96.6	Very high	90.3	Very high	32 Å²	32	39.9 Å²	39.9	13%	0.125	19%	0.187	C	C	.	.	H	α-helix	trans	-60.5	-43.6	173.7	-65.7	-88.9	0	0	0	111.1	I127 K131 D134 N139 R140 A141 T159 L163	I127-Y137 HydrophobicContact CD1-CD1 3.92Å; I127-Y137 HydrophobicContact CD1-CD2 4.26Å; I127-Y137 HydrophobicContact CD1-CE1 3.98Å; I127-Y137 HydrophobicContact CD1-CE2 4.29Å; I127-Y137 HydrophobicContact CD1-CG 4.08Å; I127-Y137 HydrophobicContact CG1-CD2 4.28Å; I127-Y137 HydrophobicContact CG1-CE1 4.47Å; I127-Y137 HydrophobicContact CG1-CE2 4.04Å; I127-Y137 HydrophobicContact CG2-CE1 4.14Å; I127-Y137 HydrophobicContact CG2-CE2 4.16Å; I127-Y137 WeakPolarHBondContact CG2-OH 3.38Å; K131-Y137 PolarHBondContact O-OH 2.92Å; D134-Y137 PolarHBondContact O-N 3.03Å; Y137-N139 VanDerWaalsContact C-N 3.32Å; Y137-N139 PolarHBondContact O-N 2.89Å; Y137-R140 PolarHBondContact O-N 3.34Å; Y137-A141 WeakPolarHBondContact O-CB 3.08Å; Y137-A141 PolarHBondContact O-N 3.5Å; Y137-T159 WeakPolarHBondContact CD1-OG1 3.02Å; Y137-L163 HydrophobicContact CD2-CD1 3.84Å; Y137-L163 HydrophobicContact CE2-CD1 3.83Å
138	T	93.7	Very high	89.3	Confident	5 Å²	5	41.3 Å²	41.3	3%	0.031	20%	0.203	C	C	.	.	H	α-helix	trans	-58.1	-42.6	177.2	-51.1	0	0	0	0	112.4	D134 I135 L136 Q142 K193 V194 H197	D134-T138 WeakPolarHBondContact O-CB 3.06Å; D134-T138 PolarHBondContact O-N 3.21Å; D134-T138 PolarHBondContact O-OG1 3.28Å; I135-T138 PolarHBondContact O-N 2.97Å; L136-T138 VanDerWaalsContact C-N 3.34Å; L136-T138 PolarHBondContact O-N 2.82Å; T138-Q142 PolarHBondContact O-N 2.7Å; T138-K193 HydrophobicContact CG2-CB 4.3Å; T138-K193 HydrophobicContact CG2-CD 3.75Å; T138-K193 HydrophobicContact CG2-CG 3.83Å; T138-V194 HydrophobicContact CG2-CG2 3.85Å; T138-V194 WeakPolarHBondContact OG1-CG2 3.06Å; T138-H197 PolarHBondContact O-CD2 3.39Å
139	N	93.7	Very high	88.8	Confident	16 Å²	16	39.8 Å²	39.8	9%	0.086	19%	0.193	C	C	.	.	H	α-helix	trans	-79.6	-30.9	179.5	-72	-0.5	0	0	0	112.7	N108 Y123 I135 L136 Y137 Q142 A143 K193	N108-N139 PolarHBondContact OD1-ND2 2.83Å; Y123-N139 HydrophobicContact CD1-CB 4.31Å; Y123-N139 HydrophobicContact CE1-CB 3.68Å; Y123-N139 HydrophobicContact CE2-CB 3.93Å; Y123-N139 VanDerWaalsContact CZ-CB 3.49Å; I135-N139 WeakPolarHBondContact O-CB 3.09Å; I135-N139 PolarHBondContact O-N 3.21Å; L136-N139 PolarHBondContact O-N 3.04Å; Y137-N139 VanDerWaalsContact C-N 3.32Å; Y137-N139 PolarHBondContact O-N 2.89Å; N139-Q142 WeakPolarHBondContact O-CB 3.32Å; N139-Q142 PolarHBondContact O-N 3.27Å; N139-A143 PolarHBondContact O-N 3.01Å; N139-A143 VanDerWaalsContact O-N 3.09Å; N139-K193 PolarHBondContact OD1-NZ 2.67Å
140	R	95.7	Very high	88.2	Confident	36 Å²	36	38.5 Å²	38.5	14%	0.136	19%	0.186	C	C	.	.	H	α-helix	trans	-70.8	-39.6	175.1	-165.4	176.2	70.6	177.3	-2.7	111.8	V120 Y123 S124 L136 Y137 Q142 A143 Y144 D156	V120-R140 HydrophobicContact CB-CG 4.41Å; V120-R140 HydrophobicContact CG1-CG 4.27Å; V120-R140 HydrophobicContact CG2-CG 4.06Å; Y123-R140 HydrophobicContact CD2-CB 4.03Å; Y123-R140 HydrophobicContact CD2-CG 4.39Å; Y123-R140 HydrophobicContact CG-CB 4.17Å; S124-R140 WeakPolarHBondContact OG-CD 3.47Å; S124-R140 PolarHBondContact OG-NH1 2.74Å; L136-R140 VanDerWaalsContact O-CB 3.31Å; L136-R140 WeakPolarHBondContact O-CB 3.04Å; L136-R140 PolarHBondContact O-N 3.33Å; Y137-R140 PolarHBondContact O-N 3.34Å; R140-Q142 VanDerWaalsContact C-N 3.33Å; R140-Q142 PolarHBondContact O-N 2.91Å; R140-A143 CarbonylContact O-C 3.59Å; R140-A143 WeakPolarHBondContact O-CA 3.21Å; R140-A143 WeakPolarHBondContact O-CB 3.27Å; R140-A143 PolarHBondContact O-N 3.49Å; R140-Y144 HydrophobicContact CG-CD2 4.08Å; R140-Y144 HydrophobicContact CG-CE2 3.69Å; R140-Y144 WeakPolarHBondContact O-CD2 3.39Å; R140-Y144 PolarHBondContact O-N 3.25Å; R140-D156 VanDerWaalsContact CB-OD2 3.25Å; R140-D156 WeakPolarHBondContact CB-OD2 3.45Å; R140-D156 VanDerWaalsContact CG-OD2 3.3Å; R140-D156 WeakPolarHBondContact CG-OD2 3.35Å; R140-D156 IonicContact CZ-OD1 3.23Å; R140-D156 IonicContact CZ-OD2 2.78Å; R140-D156 IonicContact NE-OD1 3.7Å; R140-D156 PolarHBondContact NE-OD1 3.11Å; R140-D156 IonicContact NE-OD2 3.6Å; R140-D156 PolarHBondContact NE-OD2 2.93Å; R140-D156 IonicContact NH2-OD1 2.74Å; R140-D156 PolarHBondContact NH2-OD1 3.3Å; R140-D156 IonicContact NH2-OD2 2.66Å
141	A	92.9	Very high	88.1	Confident	0 Å²	0	42.8 Å²	42.8	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-53.1	-49.5	166.7	0	0	0	0	0	111.8	Y137 A143 Y144 L145 S153 D156	Y137-A141 WeakPolarHBondContact O-CB 3.08Å; Y137-A141 PolarHBondContact O-N 3.5Å; A141-A143 PolarHBondContact O-N 3.44Å; A141-Y144 PolarHBondContact O-N 2.73Å; A141-Y144 VanDerWaalsContact O-N 3.1Å; A141-L145 PolarHBondContact O-N 3.25Å; A141-S153 PolarHBondContact O-OG 3.22Å; A141-S153 VanDerWaalsContact O-OG 3.13Å; A141-D156 HydrophobicContact CB-CB 3.74Å; A141-D156 PolarHBondContact N-OD2 3.37Å
142	Q	91.2	Very high	88.1	Confident	46 Å²	46	39.6 Å²	39.6	22%	0.215	20%	0.197	C	C	.	.	H	α-helix	trans	-58.8	-32.9	176.9	-160.3	179.3	-21.8	0	0	112.9	F111 T138 N139 R140 R146 H197	F111-Q142 HydrophobicContact CE2-CB 4.3Å; F111-Q142 HydrophobicContact CE2-CG 4.21Å; F111-Q142 HydrophobicContact CZ-CB 4.36Å; F111-Q142 HydrophobicContact CZ-CG 3.8Å; T138-Q142 PolarHBondContact O-N 2.7Å; N139-Q142 WeakPolarHBondContact O-CB 3.32Å; N139-Q142 PolarHBondContact O-N 3.27Å; R140-Q142 VanDerWaalsContact C-N 3.33Å; R140-Q142 PolarHBondContact O-N 2.91Å; Q142-R146 PolarHBondContact O-N 3.47Å; Q142-H197 WeakPolarHBondContact CB-NE2 3.43Å; Q142-H197 VanDerWaalsContact CD-CE1 3.45Å; Q142-H197 WeakPolarHBondContact CG-NE2 2.86Å; Q142-H197 PolarHBondContact OE1-NE2 2.99Å
143	A	86.1	Confident	88.2	Confident	0 Å²	0	36 Å²	36	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-76.2	-38.9	175.1	0	0	0	0	0	112.3	F111 F116 V120 N139 R140 A141 L145 R146 L147	F111-A143 HydrophobicContact CD2-CB 3.98Å; F111-A143 HydrophobicContact CE2-CB 3.98Å; F116-A143 HydrophobicContact CB-CB 4.41Å; V120-A143 HydrophobicContact CG2-CB 3.62Å; N139-A143 PolarHBondContact O-N 3.01Å; N139-A143 VanDerWaalsContact O-N 3.09Å; R140-A143 CarbonylContact O-C 3.59Å; R140-A143 WeakPolarHBondContact O-CA 3.21Å; R140-A143 WeakPolarHBondContact O-CB 3.27Å; R140-A143 PolarHBondContact O-N 3.49Å; A141-A143 PolarHBondContact O-N 3.44Å; A143-L145 PolarHBondContact O-N 2.82Å; A143-R146 CarbonylContact O-C 3.6Å; A143-R146 PolarHBondContact O-N 3.05Å; A143-R146 VanDerWaalsContact O-N 3.11Å; A143-L147 WeakPolarHBondContact O-CG 3.35Å; A143-L147 PolarHBondContact O-N 3.11Å
144	Y	88.9	Confident	88.4	Confident	30 Å²	30	35.5 Å²	35.5	12%	0.118	18%	0.177	C	C	.	.	H	α-helix	trans	-61.9	-38.1	173.8	-77.1	-50.7	0	0	0	112.9	V120 R140 A141 R146 L147 G148 Q149 L152 D156	V120-Y144 HydrophobicContact CG1-CE1 3.66Å; V120-Y144 HydrophobicContact CG1-CE2 4.49Å; V120-Y144 WeakPolarHBondContact CG1-OH 3.35Å; V120-Y144 HydrophobicContact CG2-CD1 4.08Å; V120-Y144 HydrophobicContact CG2-CE1 4Å; V120-Y144 HydrophobicContact CG2-CG 4.46Å; R140-Y144 HydrophobicContact CG-CD2 4.08Å; R140-Y144 HydrophobicContact CG-CE2 3.69Å; R140-Y144 WeakPolarHBondContact O-CD2 3.39Å; R140-Y144 PolarHBondContact O-N 3.25Å; A141-Y144 PolarHBondContact O-N 2.73Å; A141-Y144 VanDerWaalsContact O-N 3.1Å; Y144-R146 VanDerWaalsContact C-N 3.31Å; Y144-R146 PolarHBondContact O-N 2.88Å; Y144-L147 HydrophobicContact CD1-CD1 4.38Å; Y144-L147 CarbonylContact O-C 3.6Å; Y144-L147 PolarHBondContact O-N 3.49Å; Y144-L147 VanDerWaalsContact O-N 3.12Å; Y144-G148 PolarHBondContact O-N 3.2Å; Y144-Q149 HydrophobicContact CD1-CB 4.12Å; Y144-Q149 VanDerWaalsContact CD1-OE1 3.31Å; Y144-Q149 PolarHBondContact O-N 3.17Å; Y144-L152 HydrophobicContact CD1-CB 3.81Å; Y144-L152 HydrophobicContact CD1-CD1 3.94Å; Y144-L152 HydrophobicContact CD2-CB 3.68Å; Y144-L152 HydrophobicContact CE1-CB 3.95Å; Y144-L152 HydrophobicContact CE1-CD1 3.52Å; Y144-L152 HydrophobicContact CE1-CG 4.39Å; Y144-L152 HydrophobicContact CE2-CB 3.8Å; Y144-L152 HydrophobicContact CG-CB 3.69Å; Y144-D156 WeakPolarHBondContact CD2-OD2 3.45Å; Y144-D156 VanDerWaalsContact CE2-OD2 3.25Å; Y144-D156 WeakPolarHBondContact CE2-OD2 3.33Å
145	L	82.6	Confident	88.6	Confident	34 Å²	34	41.1 Å²	41.1	18%	0.178	20%	0.2	C	C	.	.	H	α-helix	trans	-58.3	-42.7	170.4	-68.2	175	0	0	0	112.1	A141 A143 L147 G148 P150 S153 H197 K200 A201	A141-L145 PolarHBondContact O-N 3.25Å; A143-L145 PolarHBondContact O-N 2.82Å; L145-L147 PolarHBondContact O-N 3.18Å; L145-G148 PolarHBondContact O-N 3.45Å; L145-P150 HydrophobicContact CD2-CB 4.49Å; L145-S153 WeakPolarHBondContact CG-OG 3.04Å; L145-H197 HydrophobicContact CD1-CB 4.34Å; L145-K200 HydrophobicContact CD1-CB 3.84Å; L145-K200 HydrophobicContact CD2-CB 4.44Å; L145-A201 HydrophobicContact CD2-CB 3.97Å
146	R	81.1	Confident	88.7	Confident	145 Å²	145	39.3 Å²	39.3	55%	0.547	19%	0.191	S	C	.	.	H	α-helix	trans	-73	-14.7	177.4	-66.5	-56.9	-165.3	-162	6.1	114.1	F116 Q142 A143 Y144	F116-R146 HydrophobicContact CB-CB 4.46Å; F116-R146 HydrophobicContact CD1-CB 3.8Å; F116-R146 HydrophobicContact CD1-CG 4.22Å; F116-R146 HydrophobicContact CD2-CB 3.56Å; F116-R146 HydrophobicContact CE1-CB 3.88Å; F116-R146 HydrophobicContact CE1-CG 3.88Å; F116-R146 HydrophobicContact CE2-CB 3.64Å; F116-R146 HydrophobicContact CE2-CG 4.2Å; F116-R146 HydrophobicContact CG-CB 3.66Å; F116-R146 HydrophobicContact CZ-CB 3.81Å; F116-R146 HydrophobicContact CZ-CG 3.87Å; Q142-R146 PolarHBondContact O-N 3.47Å; A143-R146 CarbonylContact O-C 3.6Å; A143-R146 PolarHBondContact O-N 3.05Å; A143-R146 VanDerWaalsContact O-N 3.11Å; Y144-R146 VanDerWaalsContact C-N 3.31Å; Y144-R146 PolarHBondContact O-N 2.88Å
147	L	76.4	Confident	88.7	Confident	34 Å²	34	39.3 Å²	39.3	18%	0.178	19%	0.191	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.5	0.3	171.5	-68.9	172.5	0	0	0	113.6	F116 K117 V120 A143 Y144 L145 Q149	F116-L147 HydrophobicContact CB-CD1 4.3Å; F116-L147 HydrophobicContact CB-CD2 3.81Å; F116-L147 HydrophobicContact CB-CG 3.78Å; K117-L147 HydrophobicContact CD-CD2 4.45Å; K117-L147 HydrophobicContact CG-CD1 4.21Å; K117-L147 HydrophobicContact CG-CD2 3.52Å; V120-L147 HydrophobicContact CG2-CD1 3.87Å; A143-L147 WeakPolarHBondContact O-CG 3.35Å; A143-L147 PolarHBondContact O-N 3.11Å; Y144-L147 HydrophobicContact CD1-CD1 4.38Å; Y144-L147 CarbonylContact O-C 3.6Å; Y144-L147 PolarHBondContact O-N 3.49Å; Y144-L147 VanDerWaalsContact O-N 3.12Å; L145-L147 PolarHBondContact O-N 3.18Å; L147-Q149 VanDerWaalsContact C-N 3.32Å; L147-Q149 HydrophobicContact CB-CG 4.2Å
148	G	76.1	Confident	88.5	Confident	37 Å²	37	40.3 Å²	40.3	38%	0.381	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	67.6	30.7	-174.1	0	0	0	0	0	113.4	Y144 L145 P150	Y144-G148 PolarHBondContact O-N 3.2Å; L145-G148 PolarHBondContact O-N 3.45Å; G148-P150 VanDerWaalsContact O-CD 3.25Å; G148-P150 WeakPolarHBondContact O-CD 3.49Å
149	Q	81.9	Confident	88.5	Confident	80 Å²	80	42.7 Å²	42.7	37%	0.374	21%	0.213	S	C	.	.			trans	-117.1	62	-177.4	-65.4	-178.7	-17.2	0	0	111.5	Y144 L147 D151 L152 S153	Y144-Q149 HydrophobicContact CD1-CB 4.12Å; Y144-Q149 VanDerWaalsContact CD1-OE1 3.31Å; Y144-Q149 PolarHBondContact O-N 3.17Å; L147-Q149 VanDerWaalsContact C-N 3.32Å; L147-Q149 HydrophobicContact CB-CG 4.2Å; Q149-D151 VanDerWaalsContact C-N 3.31Å; Q149-D151 PolarHBondContact O-N 3.48Å; Q149-L152 HydrophobicContact CB-CD1 4.38Å; Q149-L152 PolarHBondContact O-N 2.79Å; Q149-L152 VanDerWaalsContact O-N 3.16Å; Q149-S153 PolarHBondContact O-N 3.32Å
150	P	81	Confident	88.5	Confident	17 Å²	17	41.9 Å²	41.9	11%	0.11	21%	0.209	C	C	.	.	H	α-helix	trans	-65.9	-28.4	-170.5	30.1	-37.3	0	0	0	113.5	L145 G148 L152 S153 L154 A201 L205	L145-P150 HydrophobicContact CD2-CB 4.49Å; G148-P150 VanDerWaalsContact O-CD 3.25Å; G148-P150 WeakPolarHBondContact O-CD 3.49Å; P150-L152 VanDerWaalsContact C-N 3.28Å; P150-L152 PolarHBondContact O-N 3.17Å; P150-S153 CarbonylContact O-C 3.02Å; P150-S153 WeakPolarHBondContact O-CB 3.43Å; P150-S153 PolarHBondContact O-N 3.5Å; P150-L154 WeakPolarHBondContact O-CB 3.49Å; P150-L154 PolarHBondContact O-N 3.49Å; P150-A201 HydrophobicContact CB-CB 4.5Å; P150-L205 HydrophobicContact CB-CD1 4.35Å; P150-L205 HydrophobicContact CB-CD2 4.33Å; P150-L205 HydrophobicContact CB-CG 3.97Å; P150-L205 HydrophobicContact CG-CD2 3.87Å; P150-L205 HydrophobicContact CG-CG 4.02Å
151	D	86	Confident	88.3	Confident	93 Å²	93	41 Å²	41	50%	0.497	21%	0.207	S	C	.	.	H	α-helix	trans	-58.7	-38.3	173.8	-55.7	-95.4	0	0	0	113.2	Q149 K155	Q149-D151 VanDerWaalsContact C-N 3.31Å; Q149-D151 PolarHBondContact O-N 3.48Å; D151-K155 WeakPolarHBondContact O-CD 3.28Å; D151-K155 VanDerWaalsContact O-CG 3.31Å; D151-K155 WeakPolarHBondContact O-CG 3.23Å; D151-K155 PolarHBondContact O-N 2.77Å
152	L	90.8	Very high	88.1	Confident	64 Å²	64	45.8 Å²	45.8	34%	0.335	23%	0.232	S	C	.	.	H	α-helix	trans	-78	-35.2	177.7	-59.8	-176.6	0	0	0	110.6	Y144 Q149 P150 D156	Y144-L152 HydrophobicContact CD1-CB 3.81Å; Y144-L152 HydrophobicContact CD1-CD1 3.94Å; Y144-L152 HydrophobicContact CD2-CB 3.68Å; Y144-L152 HydrophobicContact CE1-CB 3.95Å; Y144-L152 HydrophobicContact CE1-CD1 3.52Å; Y144-L152 HydrophobicContact CE1-CG 4.39Å; Y144-L152 HydrophobicContact CE2-CB 3.8Å; Y144-L152 HydrophobicContact CG-CB 3.69Å; Q149-L152 HydrophobicContact CB-CD1 4.38Å; Q149-L152 PolarHBondContact O-N 2.79Å; Q149-L152 VanDerWaalsContact O-N 3.16Å; P150-L152 VanDerWaalsContact C-N 3.28Å; P150-L152 PolarHBondContact O-N 3.17Å; L152-D156 WeakPolarHBondContact O-CB 3.3Å; L152-D156 PolarHBondContact O-N 3.02Å
153	S	91.4	Very high	87.9	Confident	0 Å²	0	46.3 Å²	46.3	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-62.5	-40.9	170.9	-177.1	0	0	0	0	112.8	A141 L145 Q149 P150 D156 C157	A141-S153 PolarHBondContact O-OG 3.22Å; A141-S153 VanDerWaalsContact O-OG 3.13Å; L145-S153 WeakPolarHBondContact CG-OG 3.04Å; Q149-S153 PolarHBondContact O-N 3.32Å; P150-S153 CarbonylContact O-C 3.02Å; P150-S153 WeakPolarHBondContact O-CB 3.43Å; P150-S153 PolarHBondContact O-N 3.5Å; S153-D156 PolarHBondContact O-N 2.82Å; S153-C157 WeakPolarHBondContact O-CB 3.36Å; S153-C157 PolarHBondContact O-N 3.4Å; S153-C157 PolarHBondContact O-SG 2.82Å; S153-C157 VanDerWaalsContact O-SG 3.35Å
154	L	93	Very high	87.9	Confident	14 Å²	14	46.4 Å²	46.4	7%	0.073	24%	0.236	C	C	.	.	H	α-helix	trans	-65.4	-47	179.8	-179.5	55.8	0	0	0	110.3	P150 D156 C157 D158 R198 A201 L202 L205	P150-L154 WeakPolarHBondContact O-CB 3.49Å; P150-L154 PolarHBondContact O-N 3.49Å; L154-D156 PolarHBondContact O-N 3.24Å; L154-C157 WeakPolarHBondContact O-CB 3.42Å; L154-C157 PolarHBondContact O-N 3.1Å; L154-D158 PolarHBondContact O-N 3.37Å; L154-R198 HydrophobicContact CD1-CG 3.73Å; L154-A201 HydrophobicContact CB-CB 4.03Å; L154-L202 HydrophobicContact CD1-CD2 4.09Å; L154-L202 HydrophobicContact CD1-CG 4.08Å; L154-L202 HydrophobicContact CD2-CD2 3.87Å; L154-L205 HydrophobicContact CB-CD1 4.23Å; L154-L205 HydrophobicContact CD2-CD1 3.73Å
155	K	93.5	Very high	87.3	Confident	133 Å²	133	48.7 Å²	48.7	58%	0.578	26%	0.255	S	S	*	.	H	α-helix	trans	-58.1	-45.6	174.8	-71.9	168	-175.3	173.1	0	112.3	D151 D158 T159	D151-K155 WeakPolarHBondContact O-CD 3.28Å; D151-K155 VanDerWaalsContact O-CG 3.31Å; D151-K155 WeakPolarHBondContact O-CG 3.23Å; D151-K155 PolarHBondContact O-N 2.77Å; K155-D158 PolarHBondContact O-N 3.33Å; K155-T159 WeakPolarHBondContact O-CG2 3.26Å; K155-T159 PolarHBondContact O-N 3.22Å; K155-T159 PolarHBondContact O-OG1 2.87Å; K155-T159 VanDerWaalsContact O-OG1 3.13Å
156	D	95	Very high	86.9	Confident	9 Å²	9	50 Å²	50	5%	0.048	26%	0.26	C	S	.	.	H	α-helix	trans	-62	-44.1	176	-88.1	1.9	0	0	0	111.7	R140 A141 Y144 L152 S153 L154 T159 A160	R140-D156 VanDerWaalsContact CB-OD2 3.25Å; R140-D156 WeakPolarHBondContact CB-OD2 3.45Å; R140-D156 VanDerWaalsContact CG-OD2 3.3Å; R140-D156 WeakPolarHBondContact CG-OD2 3.35Å; R140-D156 IonicContact CZ-OD1 3.23Å; R140-D156 IonicContact CZ-OD2 2.78Å; R140-D156 IonicContact NE-OD1 3.7Å; R140-D156 PolarHBondContact NE-OD1 3.11Å; R140-D156 IonicContact NE-OD2 3.6Å; R140-D156 PolarHBondContact NE-OD2 2.93Å; R140-D156 IonicContact NH2-OD1 2.74Å; R140-D156 PolarHBondContact NH2-OD1 3.3Å; R140-D156 IonicContact NH2-OD2 2.66Å; A141-D156 HydrophobicContact CB-CB 3.74Å; A141-D156 PolarHBondContact N-OD2 3.37Å; Y144-D156 WeakPolarHBondContact CD2-OD2 3.45Å; Y144-D156 VanDerWaalsContact CE2-OD2 3.25Å; Y144-D156 WeakPolarHBondContact CE2-OD2 3.33Å; L152-D156 WeakPolarHBondContact O-CB 3.3Å; L152-D156 PolarHBondContact O-N 3.02Å; S153-D156 PolarHBondContact O-N 2.82Å; L154-D156 PolarHBondContact O-N 3.24Å; D156-T159 WeakPolarHBondContact CA-OG1 3.11Å; D156-T159 PolarHBondContact O-N 3.49Å; D156-T159 PolarHBondContact O-OG1 3.47Å; D156-A160 WeakPolarHBondContact O-CB 3.12Å; D156-A160 PolarHBondContact O-N 2.7Å
157	C	94.2	Very high	86.5	Confident	0 Å²	0	43.4 Å²	43.4	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-59.4	-48.1	174.3	-78.2	0	0	0	0	112.3	S153 L154 T159 A160 L161 V194 R198	S153-C157 WeakPolarHBondContact O-CB 3.36Å; S153-C157 PolarHBondContact O-N 3.4Å; S153-C157 PolarHBondContact O-SG 2.82Å; S153-C157 VanDerWaalsContact O-SG 3.35Å; L154-C157 WeakPolarHBondContact O-CB 3.42Å; L154-C157 PolarHBondContact O-N 3.1Å; C157-T159 VanDerWaalsContact C-N 3.34Å; C157-T159 PolarHBondContact O-N 3.49Å; C157-A160 WeakPolarHBondContact O-CB 3.45Å; C157-A160 PolarHBondContact O-N 2.92Å; C157-A160 VanDerWaalsContact O-N 3.13Å; C157-L161 WeakPolarHBondContact O-CG 3.49Å; C157-L161 PolarHBondContact O-N 3.41Å; C157-V194 HydrophobicContact CB-CG1 4.18Å; C157-V194 WeakPolarHBondContact O-CG1 3.36Å; C157-R198 HydrophobicContact CB-CB 3.91Å; C157-R198 HydrophobicContact CB-CG 4.18Å; C157-R198 PolarHBondContact SG-N 2.71Å; C157-R198 VanDerWaalsContact SG-N 3.39Å
158	D	93.8	Very high	86.4	Confident	54 Å²	54	46.8 Å²	46.8	29%	0.289	25%	0.251	S	S	.	.	H	α-helix	trans	-64.6	-37.6	179.7	-66.4	-30.4	0	0	0	111.2	L154 K155 L161 L162 R198	L154-D158 PolarHBondContact O-N 3.37Å; K155-D158 PolarHBondContact O-N 3.33Å; D158-L161 PolarHBondContact O-N 3.49Å; D158-L162 WeakPolarHBondContact O-CG 3.26Å; D158-L162 PolarHBondContact O-N 3.47Å; D158-R198 IonicContact OD1-CZ 3.25Å; D158-R198 IonicContact OD1-NE 2.73Å; D158-R198 PolarHBondContact OD1-NE 2.72Å; D158-R198 IonicContact OD1-NH2 2.7Å; D158-R198 PolarHBondContact OD1-NH2 3.11Å
159	T	92.6	Very high	86	Confident	54 Å²	54	50.3 Å²	50.3	33%	0.331	26%	0.257	S	S	.	.	H	α-helix	trans	-68.4	-33.7	171	56.1	0	0	0	0	113.5	Y137 K155 D156 C157 L162	Y137-T159 WeakPolarHBondContact CD1-OG1 3.02Å; K155-T159 WeakPolarHBondContact O-CG2 3.26Å; K155-T159 PolarHBondContact O-N 3.22Å; K155-T159 PolarHBondContact O-OG1 2.87Å; K155-T159 VanDerWaalsContact O-OG1 3.13Å; D156-T159 WeakPolarHBondContact CA-OG1 3.11Å; D156-T159 PolarHBondContact O-N 3.49Å; D156-T159 PolarHBondContact O-OG1 3.47Å; C157-T159 VanDerWaalsContact C-N 3.34Å; C157-T159 PolarHBondContact O-N 3.49Å; T159-L162 PolarHBondContact O-N 3.26Å
160	A	93.3	Very high	85.2	Confident	0 Å²	0	49.4 Å²	49.4	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-66.4	-41	174	0	0	0	0	0	111.2	D156 C157 L162 L163 F164 V194	D156-A160 WeakPolarHBondContact O-CB 3.12Å; D156-A160 PolarHBondContact O-N 2.7Å; C157-A160 WeakPolarHBondContact O-CB 3.45Å; C157-A160 PolarHBondContact O-N 2.92Å; C157-A160 VanDerWaalsContact O-N 3.13Å; A160-L162 VanDerWaalsContact C-N 3.31Å; A160-L162 PolarHBondContact O-N 2.79Å; A160-L163 WeakPolarHBondContact O-CB 3.31Å; A160-L163 PolarHBondContact O-N 3.31Å; A160-L163 VanDerWaalsContact O-N 3.08Å; A160-F164 WeakPolarHBondContact O-CD2 3.36Å; A160-F164 WeakPolarHBondContact O-CE2 3.24Å; A160-V194 HydrophobicContact CB-CG1 3.98Å; A160-V194 HydrophobicContact CB-CG2 3.83Å
161	L	91.6	Very high	84.5	Confident	16 Å²	16	52.8 Å²	52.8	8%	0.084	27%	0.272	C	S	.	.	H	α-helix	trans	-57.9	-42.2	174.7	-71.1	-178.9	0	0	0	111.9	C157 D158 L163 F164 V167 L191 V194 Y195	C157-L161 WeakPolarHBondContact O-CG 3.49Å; C157-L161 PolarHBondContact O-N 3.41Å; D158-L161 PolarHBondContact O-N 3.49Å; L161-L163 PolarHBondContact O-N 3.01Å; L161-L163 VanDerWaalsContact O-N 3.13Å; L161-F164 PolarHBondContact O-N 3.33Å; L161-V167 HydrophobicContact CB-CG1 4.38Å; L161-V167 WeakPolarHBondContact O-CB 3.23Å; L161-L191 HydrophobicContact CD2-CD1 3.37Å; L161-V194 HydrophobicContact CD2-CB 4.22Å; L161-V194 HydrophobicContact CD2-CG1 3.58Å; L161-V194 HydrophobicContact CG-CG1 3.71Å; L161-Y195 HydrophobicContact CD1-CD1 4.44Å; L161-Y195 HydrophobicContact CD1-CE1 3.75Å; L161-Y195 HydrophobicContact CD2-CD1 4.31Å; L161-Y195 HydrophobicContact CD2-CD2 4.18Å; L161-Y195 HydrophobicContact CD2-CE1 3.83Å; L161-Y195 HydrophobicContact CD2-CE2 3.71Å; L161-Y195 HydrophobicContact CD2-CG 4.45Å; L161-Y195 HydrophobicContact CG-CE1 4.48Å
162	L	88.6	Confident	83.2	Confident	102 Å²	102	52 Å²	52	53%	0.534	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-15.8	176.9	-70.1	171.9	0	0	0	114.2	D158 T159 A160 Q168	D158-L162 WeakPolarHBondContact O-CG 3.26Å; D158-L162 PolarHBondContact O-N 3.47Å; T159-L162 PolarHBondContact O-N 3.26Å; A160-L162 VanDerWaalsContact C-N 3.31Å; A160-L162 PolarHBondContact O-N 2.79Å; L162-Q168 PolarHBondContact O-NE2 3.18Å
163	L	88.7	Confident	81.4	Confident	56 Å²	56	51.9 Å²	51.9	29%	0.293	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.7	-6.6	177.9	-65.6	174	0	0	0	114	D134 Y137 A160 L161	D134-L163 HydrophobicContact CB-CB 4.29Å; Y137-L163 HydrophobicContact CD2-CD1 3.84Å; Y137-L163 HydrophobicContact CE2-CD1 3.83Å; A160-L163 WeakPolarHBondContact O-CB 3.31Å; A160-L163 PolarHBondContact O-N 3.31Å; A160-L163 VanDerWaalsContact O-N 3.08Å; L161-L163 PolarHBondContact O-N 3.01Å; L161-L163 VanDerWaalsContact O-N 3.13Å
164	F	85.4	Confident	79.4	Confident	2 Å²	2	56.9 Å²	56.9	1%	0.009	30%	0.298	C	S	.	.			trans	-91	122.1	175.8	-71.5	-88.4	0	0	0	111.3	D134 A160 L161 E166 V167 Q168 N188 R190 L191 V194	D134-F164 HydrophobicContact CB-CE2 3.89Å; D134-F164 HydrophobicContact CB-CZ 3.9Å; D134-F164 WeakPolarHBondContact OD2-CZ 3.37Å; A160-F164 WeakPolarHBondContact O-CD2 3.36Å; A160-F164 WeakPolarHBondContact O-CE2 3.24Å; L161-F164 PolarHBondContact O-N 3.33Å; F164-E166 PolarHBondContact O-N 2.86Å; F164-V167 HydrophobicContact CB-CB 4.25Å; F164-V167 HydrophobicContact CB-CG2 3.89Å; F164-V167 PolarHBondContact O-N 3.28Å; F164-Q168 PolarHBondContact O-N 3.25Å; F164-Q168 VanDerWaalsContact O-N 3.09Å; F164-N188 WeakPolarHBondContact CD1-ND2 3.41Å; F164-N188 WeakPolarHBondContact CE1-ND2 3.29Å; F164-R190 HydrophobicContact CE1-CB 3.96Å; F164-R190 HydrophobicContact CZ-CB 3.82Å; F164-L191 HydrophobicContact CD1-CB 4.2Å; F164-L191 HydrophobicContact CD2-CD1 3.89Å; F164-L191 HydrophobicContact CE1-CB 4.08Å; F164-L191 HydrophobicContact CE2-CD1 4.25Å; F164-L191 HydrophobicContact CG-CD1 4.09Å; F164-L191 HydrophobicContact CZ-CB 4.31Å; F164-V194 HydrophobicContact CE2-CG2 4.03Å
165	P	77.2	Confident	77.3	Confident	78 Å²	78	65.9 Å²	65.9	51%	0.506	34%	0.336	S	S	.	.	H	α-helix	trans	-55.4	-40.3	175.5	-26.4	35.3	0	0	0	112.6	V167 Q168 E169	P165-V167 PolarHBondContact O-N 3Å; P165-V167 VanDerWaalsContact O-N 3.16Å; P165-Q168 PolarHBondContact O-N 2.89Å; P165-Q168 VanDerWaalsContact O-N 3.08Å; P165-E169 WeakPolarHBondContact O-CB 3.45Å; P165-E169 PolarHBondContact O-N 3.22Å
166	E	73.3	Confident	74.7	Confident	63 Å²	63	64.4 Å²	64.4	29%	0.294	34%	0.343	S	S	.	.	H	α-helix	trans	-51.2	-37.6	174.4	-63.7	157	-160.5	0	0	113.1	F164 L170 N188 L191	F164-E166 PolarHBondContact O-N 2.86Å; E166-L170 WeakPolarHBondContact O-CB 3.29Å; E166-L170 PolarHBondContact O-N 3.35Å; E166-L170 VanDerWaalsContact O-N 3.09Å; E166-N188 VanDerWaalsContact CD-ND2 3.32Å; E166-N188 PolarHBondContact OE1-ND2 2.82Å; E166-N188 VanDerWaalsContact OE1-ND2 3.14Å; E166-N188 PolarHBondContact OE2-ND2 3.3Å; E166-L191 VanDerWaalsContact OE2-CD2 3.31Å; E166-L191 WeakPolarHBondContact OE2-CD2 3.36Å
167	V	73.2	Confident	71.8	Confident	5 Å²	5	67.6 Å²	67.6	3%	0.03	36%	0.363	C	S	.	.	H	α-helix	trans	-85.8	-33.3	-179.7	-179	0	0	0	0	111.3	L161 F164 P165 L170 N171 L191	L161-V167 HydrophobicContact CB-CG1 4.38Å; L161-V167 WeakPolarHBondContact O-CB 3.23Å; F164-V167 HydrophobicContact CB-CB 4.25Å; F164-V167 HydrophobicContact CB-CG2 3.89Å; F164-V167 PolarHBondContact O-N 3.28Å; P165-V167 PolarHBondContact O-N 3Å; P165-V167 VanDerWaalsContact O-N 3.16Å; V167-L170 PolarHBondContact O-N 2.92Å; V167-N171 WeakPolarHBondContact O-CB 3.49Å; V167-N171 VanDerWaalsContact O-CG 3.22Å; V167-N171 PolarHBondContact O-N 3.27Å; V167-N171 PolarHBondContact O-ND2 3.5Å; V167-L191 HydrophobicContact CG2-CD1 3.77Å; V167-L191 HydrophobicContact CG2-CD2 3.83Å; V167-L191 HydrophobicContact CG2-CG 4.48Å
168	Q	73.1	Confident	68.7	Low	106 Å²	106	73.2 Å²	73.2	50%	0.495	39%	0.39	S	S	.	.	H	α-helix	trans	-63.4	-45.5	172	-64.3	176.3	13.8	0	0	111	L162 F164 P165 N171 S172	L162-Q168 PolarHBondContact O-NE2 3.18Å; F164-Q168 PolarHBondContact O-N 3.25Å; F164-Q168 VanDerWaalsContact O-N 3.09Å; P165-Q168 PolarHBondContact O-N 2.89Å; P165-Q168 VanDerWaalsContact O-N 3.08Å; Q168-N171 PolarHBondContact O-N 2.95Å; Q168-S172 PolarHBondContact O-N 3.31Å; Q168-S172 PolarHBondContact O-OG 3.42Å
169	E	67.9	Low	66.1	Low	111 Å²	111	76.9 Å²	76.9	52%	0.519	42%	0.415	S	S	.	.	H	α-helix	trans	-65.1	-37.4	173.6	-74.2	-178.4	-149.9	0	0	112.5	P165 S172 N173	P165-E169 WeakPolarHBondContact O-CB 3.45Å; P165-E169 PolarHBondContact O-N 3.22Å; E169-S172 PolarHBondContact O-OG 3.13Å; E169-S172 VanDerWaalsContact O-OG 3.12Å; E169-N173 VanDerWaalsContact O-CB 3.28Å; E169-N173 WeakPolarHBondContact O-CB 3.44Å; E169-N173 PolarHBondContact O-N 2.73Å; E169-N173 PolarHBondContact O-ND2 3.02Å
170	L	66.2	Low	63.4	Low	60 Å²	60	80 Å²	80	31%	0.314	43%	0.429	S	S	.	.	H	α-helix	trans	-61.8	-50.8	172.9	-167.5	76.6	0	0	0	110.2	E166 V167 S172 N173 M174 M178	E166-L170 WeakPolarHBondContact O-CB 3.29Å; E166-L170 PolarHBondContact O-N 3.35Å; E166-L170 VanDerWaalsContact O-N 3.09Å; V167-L170 PolarHBondContact O-N 2.92Å; L170-S172 VanDerWaalsContact C-N 3.33Å; L170-S172 PolarHBondContact O-N 2.71Å; L170-N173 PolarHBondContact O-N 2.86Å; L170-M174 WeakPolarHBondContact O-CB 3.37Å; L170-M174 PolarHBondContact O-N 3.1Å; L170-M178 HydrophobicContact CD1-CE 4.17Å
171	N	65.4	Low	60.6	Low	89 Å²	89	85.7 Å²	85.7	48%	0.476	46%	0.46	S	S	.	.	H	α-helix	trans	-64.8	-32.2	-176.8	-72.6	-17	0	0	0	113.4	V167 Q168	V167-N171 WeakPolarHBondContact O-CB 3.49Å; V167-N171 VanDerWaalsContact O-CG 3.22Å; V167-N171 PolarHBondContact O-N 3.27Å; V167-N171 PolarHBondContact O-ND2 3.5Å; Q168-N171 PolarHBondContact O-N 2.95Å
172	S	58.7	Low	58.3	Low	77 Å²	77	92.5 Å²	92.5	54%	0.538	50%	0.496	S	S	.	.	H	α-helix	trans	-74	-43.9	173.9	64.3	0	0	0	0	112.2	Q168 E169 L170	Q168-S172 PolarHBondContact O-N 3.31Å; Q168-S172 PolarHBondContact O-OG 3.42Å; E169-S172 PolarHBondContact O-OG 3.13Å; E169-S172 VanDerWaalsContact O-OG 3.12Å; L170-S172 VanDerWaalsContact C-N 3.33Å; L170-S172 PolarHBondContact O-N 2.71Å
173	N	52.9	Low	56.4	Low	60 Å²	60	95.3 Å²	95.3	32%	0.321	50%	0.499	S	S	.	.	H	α-helix	trans	-75.6	-23.4	-179.5	-71.1	-60.3	0	0	0	113.7	E169 L170 K175 S176 T177	E169-N173 VanDerWaalsContact O-CB 3.28Å; E169-N173 WeakPolarHBondContact O-CB 3.44Å; E169-N173 PolarHBondContact O-N 2.73Å; E169-N173 PolarHBondContact O-ND2 3.02Å; L170-N173 PolarHBondContact O-N 2.86Å; N173-K175 PolarHBondContact O-N 2.78Å; N173-S176 PolarHBondContact O-N 3.21Å; N173-T177 PolarHBondContact O-N 3.13Å; N173-T177 VanDerWaalsContact O-N 3.1Å
174	M	50.1	Low	54.8	Low	105 Å²	105	99.6 Å²	99.6	52%	0.517	52%	0.523	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.4	-15.6	-179.6	-166.5	172.1	-174.1	0	0	113	L170 S176 M178	L170-M174 WeakPolarHBondContact O-CB 3.37Å; L170-M174 PolarHBondContact O-N 3.1Å; M174-S176 PolarHBondContact O-N 3.35Å; M174-M178 HydrophobicContact CE-CE 4.07Å; M174-M178 HydrophobicContact CE-CG 3.97Å; M174-M178 HydrophobicContact CE-SD 4.48Å; M174-M178 HydrophobicContact CG-CG 3.86Å; M174-M178 HydrophobicContact SD-CE 4.19Å; M174-M178 HydrophobicContact SD-CG 4.47Å
175	K	48.9	Very low	53.2	Low	203 Å²	203	102.1 Å²	102.1	88%	0.883	54%	0.536	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.3	-8	165.3	-85.6	-165.9	173	-172	0	114.3	N173	N173-K175 PolarHBondContact O-N 2.78Å
176	S	37.6	Very low	52.7	Low	102 Å²	102	102.2 Å²	102.2	71%	0.713	54%	0.535	S	S	*	.	T	Hydrogen-bonded Turn	trans	-134.6	-48	-174.8	-176.5	0	0	0	0	115.1	N173 M174	N173-S176 PolarHBondContact O-N 3.21Å; M174-S176 PolarHBondContact O-N 3.35Å
177	T	34.5	Very low	52.8	Low	76 Å²	76	101.6 Å²	101.6	47%	0.466	54%	0.537	S	S	.	.			trans	-140.2	85.9	-165.9	42.5	0	0	0	0	115.5	N173	N173-T177 PolarHBondContact O-N 3.13Å; N173-T177 VanDerWaalsContact O-N 3.1Å
178	M	30.5	Very low	53.4	Low	119 Å²	119	101.9 Å²	101.9	59%	0.586	54%	0.539	S	S	*	.	S	Bend	trans	-97.2	5.7	171.2	-111.5	-75.8	165.3	0	0	114.7	L170 M174	L170-M178 HydrophobicContact CD1-CE 4.17Å; M174-M178 HydrophobicContact CE-CE 4.07Å; M174-M178 HydrophobicContact CE-CG 3.97Å; M174-M178 HydrophobicContact CE-SD 4.48Å; M174-M178 HydrophobicContact CG-CG 3.86Å; M174-M178 HydrophobicContact SD-CE 4.19Å; M174-M178 HydrophobicContact SD-CG 4.47Å
179	V	38.7	Very low	54	Low	131 Å²	131	101.3 Å²	101.3	79%	0.794	54%	0.544	S	S	*	.	S	Bend	trans	-111.2	-23.6	-170.8	-179.2	0	0	0	0	114
180	N	34.7	Very low	54.9	Low	120 Å²	120	101.8 Å²	101.8	64%	0.642	54%	0.541	S	S	*	.			trans	-106.1	99.8	-170.2	-82.1	-14.5	0	0	0	114.6
181	N	35.7	Very low	56	Low	119 Å²	119	98.9 Å²	98.9	64%	0.636	53%	0.526	S	S	*	.			trans	62.1	119.8	132.7	-53.4	-30.6	0	0	0	120.7	R183	N181-R183 PolarHBondContact O-N 2.62Å; N181-R183 VanDerWaalsContact O-N 3.1Å
182	N	42.8	Very low	57.1	Low	158 Å²	158	94.9 Å²	94.9	85%	0.845	51%	0.506	S	S	*	.			trans	51.3	41	136.4	-57.1	-4.8	0	0	0	118.7
183	R	49.6	Very low	58.6	Low	161 Å²	161	94.3 Å²	94.3	61%	0.608	49%	0.493	S	S	*	.			trans	-68.9	140.5	158.5	-64.3	-171.1	-172.5	-170.4	3.5	109.6	N181	N181-R183 PolarHBondContact O-N 2.62Å; N181-R183 VanDerWaalsContact O-N 3.1Å
184	D	53.9	Low	60.6	Low	146 Å²	146	91.4 Å²	91.4	78%	0.781	48%	0.478	S	S	*	.			trans	-57.2	148.2	-176.6	-72.6	-73.5	0	0	0	113.5	V186	D184-V186 PolarHBondContact O-N 3.26Å
185	I	52.9	Low	62.6	Low	56 Å²	56	87.1 Å²	87.1	29%	0.287	46%	0.456	S	S	.	.			trans	-71.3	93	-176.5	-55.8	174.2	0	0	0	110.1	S187	I185-S187 PolarHBondContact O-N 3.06Å
186	V	65.9	Low	64.6	Low	79 Å²	79	78.5 Å²	78.5	48%	0.479	42%	0.419	S	S	.	.			trans	-77.2	87.2	170.7	-174.2	0	0	0	0	109.2	D184 N188	D184-V186 PolarHBondContact O-N 3.26Å; V186-N188 PolarHBondContact O-N 3.3Å; V186-N188 VanDerWaalsContact O-N 3.15Å
187	S	75.4	Confident	67.2	Low	51 Å²	51	74.4 Å²	74.4	36%	0.357	39%	0.389	S	S	.	.			trans	-63.2	109.5	171.7	-167.4	0	0	0	0	110.2	I185 A223	I185-S187 PolarHBondContact O-N 3.06Å; S187-A223 WeakPolarHBondContact CB-O 3.36Å; S187-A223 PolarHBondContact OG-O 3.36Å
188	N	85.2	Confident	70	Confident	11 Å²	11	72.7 Å²	72.7	6%	0.059	37%	0.374	C	S	.	.			trans	-126.1	93.2	-179.5	-176	-16.1	0	0	0	110.4	F164 E166 V186 R190 L191 A192 Y221	F164-N188 WeakPolarHBondContact CD1-ND2 3.41Å; F164-N188 WeakPolarHBondContact CE1-ND2 3.29Å; E166-N188 VanDerWaalsContact CD-ND2 3.32Å; E166-N188 PolarHBondContact OE1-ND2 2.82Å; E166-N188 VanDerWaalsContact OE1-ND2 3.14Å; E166-N188 PolarHBondContact OE2-ND2 3.3Å; V186-N188 PolarHBondContact O-N 3.3Å; V186-N188 VanDerWaalsContact O-N 3.15Å; N188-R190 PolarHBondContact O-N 2.95Å; N188-R190 PolarHBondContact OD1-N 3.22Å; N188-R190 VanDerWaalsContact OD1-N 3.08Å; N188-L191 HydrophobicContact CB-CB 3.93Å; N188-L191 VanDerWaalsContact CG-CB 3.49Å; N188-L191 PolarHBondContact O-N 3.18Å; N188-L191 PolarHBondContact OD1-N 2.83Å; N188-L191 VanDerWaalsContact OD1-N 3.09Å; N188-A192 PolarHBondContact O-N 3Å; N188-Y221 CarbonylContact C-O 3.54Å; N188-Y221 HydrophobicContact CB-CD1 4.45Å; N188-Y221 PolarHBondContact N-O 3.47Å
189	P	86	Confident	72.9	Confident	94 Å²	94	67 Å²	67	61%	0.61	35%	0.346	S	S	*	.	H	α-helix	trans	-68.2	-16	-176.6	26.8	-34.9	0	0	0	113.8	K193	P189-K193 PolarHBondContact O-N 3.41Å
190	R	88.3	Confident	75.2	Confident	120 Å²	120	62.6 Å²	62.6	45%	0.453	32%	0.316	S	S	.	.	H	α-helix	trans	-77.1	-46.8	173.3	-54.2	-160.1	-49.5	-79.2	-2.8	110.2	D134 F164 N188 A192 K193 V194	D134-R190 IonicContact OD2-CZ 2.7Å; D134-R190 IonicContact OD2-NE 2.67Å; D134-R190 PolarHBondContact OD2-NE 2.86Å; D134-R190 IonicContact OD2-NH2 3.52Å; D134-R190 PolarHBondContact OD2-NH2 3.31Å; D134-R190 VanDerWaalsContact OD2-NH2 3.11Å; F164-R190 HydrophobicContact CE1-CB 3.96Å; F164-R190 HydrophobicContact CZ-CB 3.82Å; N188-R190 PolarHBondContact O-N 2.95Å; N188-R190 PolarHBondContact OD1-N 3.22Å; N188-R190 VanDerWaalsContact OD1-N 3.08Å; R190-A192 PolarHBondContact O-N 2.92Å; R190-K193 WeakPolarHBondContact O-CB 3.47Å; R190-K193 PolarHBondContact O-N 3.46Å; R190-K193 VanDerWaalsContact O-N 3.13Å; R190-V194 PolarHBondContact O-N 3.04Å
191	L	88.2	Confident	77.6	Confident	0 Å²	0	56.9 Å²	56.9	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-62.6	-41.8	175.6	-175.4	52.8	0	0	0	111.6	L161 F164 E166 V167 N188 K193 V194 Y195 Y221	L161-L191 HydrophobicContact CD2-CD1 3.37Å; F164-L191 HydrophobicContact CD1-CB 4.2Å; F164-L191 HydrophobicContact CD2-CD1 3.89Å; F164-L191 HydrophobicContact CE1-CB 4.08Å; F164-L191 HydrophobicContact CE2-CD1 4.25Å; F164-L191 HydrophobicContact CG-CD1 4.09Å; F164-L191 HydrophobicContact CZ-CB 4.31Å; E166-L191 VanDerWaalsContact OE2-CD2 3.31Å; E166-L191 WeakPolarHBondContact OE2-CD2 3.36Å; V167-L191 HydrophobicContact CG2-CD1 3.77Å; V167-L191 HydrophobicContact CG2-CD2 3.83Å; V167-L191 HydrophobicContact CG2-CG 4.48Å; N188-L191 HydrophobicContact CB-CB 3.93Å; N188-L191 VanDerWaalsContact CG-CB 3.49Å; N188-L191 PolarHBondContact O-N 3.18Å; N188-L191 PolarHBondContact OD1-N 2.83Å; N188-L191 VanDerWaalsContact OD1-N 3.09Å; L191-K193 VanDerWaalsContact C-N 3.31Å; L191-K193 PolarHBondContact O-N 3.44Å; L191-V194 PolarHBondContact O-N 2.93Å; L191-V194 VanDerWaalsContact O-N 3.16Å; L191-Y195 HydrophobicContact CD1-CD2 3.86Å; L191-Y195 HydrophobicContact CD1-CE2 3.46Å; L191-Y195 VanDerWaalsContact CD1-CE2 3.46Å; L191-Y195 HydrophobicContact CD2-CE2 4.35Å; L191-Y195 HydrophobicContact CG-CD2 3.96Å; L191-Y195 HydrophobicContact CG-CE2 3.71Å; L191-Y195 VanDerWaalsContact O-CD2 3.32Å; L191-Y195 WeakPolarHBondContact O-CD2 3.17Å; L191-Y195 PolarHBondContact O-N 2.9Å; L191-Y221 HydrophobicContact CB-CG 4.41Å; L191-Y221 HydrophobicContact CD2-CD1 3.75Å; L191-Y221 HydrophobicContact CD2-CD2 3.93Å; L191-Y221 HydrophobicContact CD2-CE1 3.56Å; L191-Y221 HydrophobicContact CD2-CE2 3.77Å; L191-Y221 HydrophobicContact CD2-CG 3.92Å; L191-Y221 HydrophobicContact CG-CD1 4.31Å; L191-Y221 HydrophobicContact CG-CD2 3.86Å; L191-Y221 HydrophobicContact CG-CE1 4.49Å; L191-Y221 HydrophobicContact CG-CE2 4.08Å; L191-Y221 HydrophobicContact CG-CG 3.99Å
192	A	88.8	Confident	80.2	Confident	5 Å²	5	51.2 Å²	51.2	4%	0.041	26%	0.255	C	S	.	.	H	α-helix	trans	-56	-42.6	171.3	0	0	0	0	0	112.6	N188 R190 Y195 L196 S218	N188-A192 PolarHBondContact O-N 3Å; R190-A192 PolarHBondContact O-N 2.92Å; A192-Y195 PolarHBondContact O-N 2.7Å; A192-L196 WeakPolarHBondContact O-CB 3.32Å; A192-L196 PolarHBondContact O-N 3.06Å; A192-S218 PolarHBondContact O-OG 3.05Å; A192-S218 VanDerWaalsContact O-OG 3.13Å
193	K	91.1	Very high	82.1	Confident	64 Å²	64	44.7 Å²	44.7	28%	0.278	22%	0.22	S	C	.	.	H	α-helix	trans	-65.1	-38.7	176.4	-173.5	-175.6	173.1	-173.6	0	112.4	T138 N139 P189 R190 L191 L196 H197	T138-K193 HydrophobicContact CG2-CB 4.3Å; T138-K193 HydrophobicContact CG2-CD 3.75Å; T138-K193 HydrophobicContact CG2-CG 3.83Å; N139-K193 PolarHBondContact OD1-NZ 2.67Å; P189-K193 PolarHBondContact O-N 3.41Å; R190-K193 WeakPolarHBondContact O-CB 3.47Å; R190-K193 PolarHBondContact O-N 3.46Å; R190-K193 VanDerWaalsContact O-N 3.13Å; L191-K193 VanDerWaalsContact C-N 3.31Å; L191-K193 PolarHBondContact O-N 3.44Å; K193-L196 PolarHBondContact O-N 2.95Å; K193-H197 WeakPolarHBondContact CE-NE2 2.53Å; K193-H197 PolarHBondContact NZ-NE2 3.29Å; K193-H197 PolarHBondContact O-N 2.84Å; K193-H197 VanDerWaalsContact O-N 3.15Å
194	V	93	Very high	83.5	Confident	0 Å²	0	40 Å²	40	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-61.4	-48.6	175.1	176.3	0	0	0	0	110.5	T138 C157 A160 L161 F164 R190 L191 L196 H197 R198	T138-V194 HydrophobicContact CG2-CG2 3.85Å; T138-V194 WeakPolarHBondContact OG1-CG2 3.06Å; C157-V194 HydrophobicContact CB-CG1 4.18Å; C157-V194 WeakPolarHBondContact O-CG1 3.36Å; A160-V194 HydrophobicContact CB-CG1 3.98Å; A160-V194 HydrophobicContact CB-CG2 3.83Å; L161-V194 HydrophobicContact CD2-CB 4.22Å; L161-V194 HydrophobicContact CD2-CG1 3.58Å; L161-V194 HydrophobicContact CG-CG1 3.71Å; F164-V194 HydrophobicContact CE2-CG2 4.03Å; R190-V194 PolarHBondContact O-N 3.04Å; L191-V194 PolarHBondContact O-N 2.93Å; L191-V194 VanDerWaalsContact O-N 3.16Å; V194-L196 PolarHBondContact O-N 3.12Å; V194-H197 PolarHBondContact O-N 3.09Å; V194-R198 WeakPolarHBondContact O-CB 3.09Å; V194-R198 PolarHBondContact O-N 2.85Å
195	Y	93.3	Very high	84.6	Confident	15 Å²	15	35.2 Å²	35.2	6%	0.059	19%	0.186	C	C	.	.	H	α-helix	trans	-63.1	-38.9	178.1	-80.5	-61.1	0	0	0	113.1	L161 L191 A192 H197 R198 G199 A214 L217 Y221	L161-Y195 HydrophobicContact CD1-CD1 4.44Å; L161-Y195 HydrophobicContact CD1-CE1 3.75Å; L161-Y195 HydrophobicContact CD2-CD1 4.31Å; L161-Y195 HydrophobicContact CD2-CD2 4.18Å; L161-Y195 HydrophobicContact CD2-CE1 3.83Å; L161-Y195 HydrophobicContact CD2-CE2 3.71Å; L161-Y195 HydrophobicContact CD2-CG 4.45Å; L161-Y195 HydrophobicContact CG-CE1 4.48Å; L191-Y195 HydrophobicContact CD1-CD2 3.86Å; L191-Y195 HydrophobicContact CD1-CE2 3.46Å; L191-Y195 VanDerWaalsContact CD1-CE2 3.46Å; L191-Y195 HydrophobicContact CD2-CE2 4.35Å; L191-Y195 HydrophobicContact CG-CD2 3.96Å; L191-Y195 HydrophobicContact CG-CE2 3.71Å; L191-Y195 VanDerWaalsContact O-CD2 3.32Å; L191-Y195 WeakPolarHBondContact O-CD2 3.17Å; L191-Y195 PolarHBondContact O-N 2.9Å; A192-Y195 PolarHBondContact O-N 2.7Å; Y195-H197 VanDerWaalsContact C-N 3.29Å; Y195-H197 PolarHBondContact O-N 3.14Å; Y195-R198 PolarHBondContact O-N 3.46Å; Y195-G199 PolarHBondContact O-N 3.09Å; Y195-A214 WeakPolarHBondContact CB-O 3.29Å; Y195-A214 HydrophobicContact CD1-CB 4.49Å; Y195-L217 HydrophobicContact CD1-CB 3.84Å; Y195-L217 HydrophobicContact CD1-CD1 4.02Å; Y195-L217 HydrophobicContact CD2-CB 3.88Å; Y195-L217 HydrophobicContact CE1-CB 4.03Å; Y195-L217 HydrophobicContact CE1-CD1 3.5Å; Y195-L217 HydrophobicContact CE1-CG 4.38Å; Y195-L217 HydrophobicContact CE2-CB 4.04Å; Y195-L217 HydrophobicContact CG-CB 3.78Å; Y195-Y221 AromaticContact CD2-CD2 3.8Å; Y195-Y221 HydrophobicContact CD2-CD2 3.8Å; Y195-Y221 HydrophobicContact CD2-CE2 4.08Å; Y195-Y221 AromaticContact CE2-CD2 3.73Å; Y195-Y221 HydrophobicContact CE2-CD2 3.73Å; Y195-Y221 AromaticContact CE2-CE2 3.51Å; Y195-Y221 HydrophobicContact CE2-CE2 3.51Å
196	L	91	Very high	85.6	Confident	21 Å²	21	36.9 Å²	36.9	11%	0.11	20%	0.195	C	C	.	.	H	α-helix	trans	-58.2	-39.2	172.7	179.7	62.8	0	0	0	112.7	A192 K193 V194 K200 Y215 Y242 L243	A192-L196 WeakPolarHBondContact O-CB 3.32Å; A192-L196 PolarHBondContact O-N 3.06Å; K193-L196 PolarHBondContact O-N 2.95Å; V194-L196 PolarHBondContact O-N 3.12Å; L196-K200 WeakPolarHBondContact O-CG 3.27Å; L196-K200 PolarHBondContact O-N 3.21Å; L196-Y215 HydrophobicContact CD1-CE1 4.46Å; L196-Y242 HydrophobicContact CD1-CD2 4.08Å; L196-Y242 HydrophobicContact CD1-CE2 4.14Å; L196-Y242 HydrophobicContact CD2-CD2 3.99Å; L196-Y242 HydrophobicContact CD2-CE2 4.13Å; L196-L243 HydrophobicContact CD1-CD2 3.6Å
197	H	91	Very high	86.4	Confident	17 Å²	17	37.5 Å²	37.5	8%	0.079	19%	0.189	C	C	.	.	H	α-helix	trans	-79.3	-34.6	178.5	-65.9	-14.2	0	0	0	112	T138 Q142 L145 K193 V194 Y195 K200 A201	T138-H197 PolarHBondContact O-CD2 3.39Å; Q142-H197 WeakPolarHBondContact CB-NE2 3.43Å; Q142-H197 VanDerWaalsContact CD-CE1 3.45Å; Q142-H197 WeakPolarHBondContact CG-NE2 2.86Å; Q142-H197 PolarHBondContact OE1-NE2 2.99Å; L145-H197 HydrophobicContact CD1-CB 4.34Å; K193-H197 WeakPolarHBondContact CE-NE2 2.53Å; K193-H197 PolarHBondContact NZ-NE2 3.29Å; K193-H197 PolarHBondContact O-N 2.84Å; K193-H197 VanDerWaalsContact O-N 3.15Å; V194-H197 PolarHBondContact O-N 3.09Å; Y195-H197 VanDerWaalsContact C-N 3.29Å; Y195-H197 PolarHBondContact O-N 3.14Å; H197-K200 PolarHBondContact O-N 3.35Å; H197-A201 PolarHBondContact O-N 3.05Å
198	R	93.7	Very high	86.8	Confident	40 Å²	40	35.1 Å²	35.1	15%	0.151	17%	0.172	C	C	.	.	H	α-helix	trans	-59.4	-48.1	173.1	-167.3	-179.3	-173.8	-87.8	-10.9	111.1	L154 C157 D158 V194 Y195 K200 A201 L202 A214	L154-R198 HydrophobicContact CD1-CG 3.73Å; C157-R198 HydrophobicContact CB-CB 3.91Å; C157-R198 HydrophobicContact CB-CG 4.18Å; C157-R198 PolarHBondContact SG-N 2.71Å; C157-R198 VanDerWaalsContact SG-N 3.39Å; D158-R198 IonicContact OD1-CZ 3.25Å; D158-R198 IonicContact OD1-NE 2.73Å; D158-R198 PolarHBondContact OD1-NE 2.72Å; D158-R198 IonicContact OD1-NH2 2.7Å; D158-R198 PolarHBondContact OD1-NH2 3.11Å; V194-R198 WeakPolarHBondContact O-CB 3.09Å; V194-R198 PolarHBondContact O-N 2.85Å; Y195-R198 PolarHBondContact O-N 3.46Å; R198-K200 VanDerWaalsContact C-N 3.32Å; R198-K200 PolarHBondContact O-N 3.32Å; R198-A201 PolarHBondContact O-N 3.42Å; R198-L202 HydrophobicContact CG-CD1 3.95Å; R198-L202 WeakPolarHBondContact O-CD1 3.38Å; R198-L202 VanDerWaalsContact O-CG 3.29Å; R198-L202 WeakPolarHBondContact O-CG 3.5Å; R198-L202 PolarHBondContact O-N 2.95Å; R198-A214 HydrophobicContact CB-CB 4.36Å
199	G	91.4	Very high	86.9	Confident	0 Å²	0	37.8 Å²	37.8	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-60.3	-39.7	177.1	0	0	0	0	0	112.9	Y195 L202 M203 A211 Y215	Y195-G199 PolarHBondContact O-N 3.09Å; G199-L202 PolarHBondContact O-N 2.98Å; G199-M203 PolarHBondContact O-N 2.96Å; G199-A211 WeakPolarHBondContact O-CB 3.33Å; G199-Y215 PolarHBondContact O-OH 2.73Å
200	K	86.6	Confident	87	Confident	37 Å²	37	36.4 Å²	36.4	16%	0.161	18%	0.177	C	C	.	.	H	α-helix	trans	-67.1	-40.7	176.3	-69.5	174.3	-164.1	-166	0	112.2	L145 L196 H197 R198 L202 M203 S204 Y215 Y246	L145-K200 HydrophobicContact CD1-CB 3.84Å; L145-K200 HydrophobicContact CD2-CB 4.44Å; L196-K200 WeakPolarHBondContact O-CG 3.27Å; L196-K200 PolarHBondContact O-N 3.21Å; H197-K200 PolarHBondContact O-N 3.35Å; R198-K200 VanDerWaalsContact C-N 3.32Å; R198-K200 PolarHBondContact O-N 3.32Å; K200-L202 VanDerWaalsContact C-N 3.33Å; K200-M203 PolarHBondContact O-N 3.4Å; K200-S204 PolarHBondContact O-N 3.41Å; K200-S204 PolarHBondContact O-OG 3.45Å; K200-Y215 HydrophobicContact CG-CE1 4.37Å; K200-Y215 PolarHBondContact N-OH 2.98Å; K200-Y246 HydrophobicContact CD-CD1 4.38Å; K200-Y246 HydrophobicContact CD-CE1 3.95Å; K200-Y246 VanDerWaalsContact CE-CE1 3.48Å; K200-Y246 VanDerWaalsContact CE-CE2 3.5Å; K200-Y246 HydrophobicContact CG-CD1 4.09Å; K200-Y246 HydrophobicContact CG-CE1 4.1Å; K200-Y246 PolarHBondContact NZ-OH 2.82Å
201	A	86.5	Confident	87	Confident	0 Å²	0	30.7 Å²	30.7	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-61.2	-42.9	173	0	0	0	0	0	111.5	L145 P150 L154 H197 R198 S204 L205	L145-A201 HydrophobicContact CD2-CB 3.97Å; P150-A201 HydrophobicContact CB-CB 4.5Å; L154-A201 HydrophobicContact CB-CB 4.03Å; H197-A201 PolarHBondContact O-N 3.05Å; R198-A201 PolarHBondContact O-N 3.42Å; A201-S204 CarbonylContact O-C 3.33Å; A201-S204 PolarHBondContact O-N 2.85Å; A201-L205 WeakPolarHBondContact O-CB 3.45Å; A201-L205 WeakPolarHBondContact O-CD1 3.16Å; A201-L205 VanDerWaalsContact O-CG 3.25Å; A201-L205 WeakPolarHBondContact O-CG 3.42Å; A201-L205 PolarHBondContact O-N 3.04Å
202	L	89.2	Confident	87	Confident	0 Å²	0	31.4 Å²	31.4	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-66.4	-39.6	178.1	-70.1	161.3	0	0	0	112.7	L154 R198 G199 K200 L205 N206 R207 E210 A211 A214	L154-L202 HydrophobicContact CD1-CD2 4.09Å; L154-L202 HydrophobicContact CD1-CG 4.08Å; L154-L202 HydrophobicContact CD2-CD2 3.87Å; R198-L202 HydrophobicContact CG-CD1 3.95Å; R198-L202 WeakPolarHBondContact O-CD1 3.38Å; R198-L202 VanDerWaalsContact O-CG 3.29Å; R198-L202 WeakPolarHBondContact O-CG 3.5Å; R198-L202 PolarHBondContact O-N 2.95Å; G199-L202 PolarHBondContact O-N 2.98Å; K200-L202 VanDerWaalsContact C-N 3.33Å; L202-L205 CarbonylContact O-C 3.53Å; L202-L205 WeakPolarHBondContact O-CA 3.25Å; L202-L205 PolarHBondContact O-N 3.32Å; L202-N206 PolarHBondContact O-N 3.33Å; L202-N206 VanDerWaalsContact O-N 3.16Å; L202-R207 HydrophobicContact CB-CB 4.24Å; L202-R207 HydrophobicContact CD2-CB 3.99Å; L202-R207 PolarHBondContact O-N 3.34Å; L202-E210 HydrophobicContact CD1-CB 3.83Å; L202-E210 HydrophobicContact CD2-CB 4.11Å; L202-E210 HydrophobicContact CG-CB 4.46Å; L202-A211 HydrophobicContact CB-CB 3.94Å; L202-A214 HydrophobicContact CD1-CB 4.36Å
203	M	83.7	Confident	87	Confident	22 Å²	22	34 Å²	34	11%	0.108	18%	0.177	C	C	.	.	H	α-helix	trans	-61.4	-45.1	170.8	-74.3	-55	-68.4	0	0	111.9	G199 K200 L205 N206 P208 A211 Y215 Q249 A250 A253	G199-M203 PolarHBondContact O-N 2.96Å; K200-M203 PolarHBondContact O-N 3.4Å; M203-L205 PolarHBondContact O-N 3.43Å; M203-L205 VanDerWaalsContact O-N 3.12Å; M203-N206 PolarHBondContact O-N 2.92Å; M203-P208 HydrophobicContact SD-CB 3.92Å; M203-A211 HydrophobicContact CG-CB 3.67Å; M203-A211 HydrophobicContact SD-CB 3.68Å; M203-Y215 HydrophobicContact CG-CE2 4.21Å; M203-Q249 HydrophobicContact CE-CB 4.19Å; M203-Q249 HydrophobicContact CE-CG 3.71Å; M203-A250 HydrophobicContact CE-CB 4.05Å; M203-A250 HydrophobicContact SD-CB 3.48Å; M203-A250 WeakPolarHBondContact SD-CB 3.28Å; M203-A253 HydrophobicContact CE-CB 4.04Å
204	S	77.5	Confident	86.9	Confident	61 Å²	61	30.9 Å²	30.9	43%	0.427	16%	0.164	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.5	-5.2	173.7	-60.1	0	0	0	0	114.5	K200 A201	K200-S204 PolarHBondContact O-N 3.41Å; K200-S204 PolarHBondContact O-OG 3.45Å; A201-S204 CarbonylContact O-C 3.33Å; A201-S204 PolarHBondContact O-N 2.85Å
205	L	77.1	Confident	86.8	Confident	47 Å²	47	30.9 Å²	30.9	25%	0.246	16%	0.164	C	C	.	.	T	Hydrogen-bonded Turn	trans	-114	15	173.6	-68	166.8	0	0	0	112.2	P150 L154 A201 L202 M203 R207	P150-L205 HydrophobicContact CB-CD1 4.35Å; P150-L205 HydrophobicContact CB-CD2 4.33Å; P150-L205 HydrophobicContact CB-CG 3.97Å; P150-L205 HydrophobicContact CG-CD2 3.87Å; P150-L205 HydrophobicContact CG-CG 4.02Å; L154-L205 HydrophobicContact CB-CD1 4.23Å; L154-L205 HydrophobicContact CD2-CD1 3.73Å; A201-L205 WeakPolarHBondContact O-CB 3.45Å; A201-L205 WeakPolarHBondContact O-CD1 3.16Å; A201-L205 VanDerWaalsContact O-CG 3.25Å; A201-L205 WeakPolarHBondContact O-CG 3.42Å; A201-L205 PolarHBondContact O-N 3.04Å; L202-L205 CarbonylContact O-C 3.53Å; L202-L205 WeakPolarHBondContact O-CA 3.25Å; L202-L205 PolarHBondContact O-N 3.32Å; M203-L205 PolarHBondContact O-N 3.43Å; M203-L205 VanDerWaalsContact O-N 3.12Å; L205-R207 VanDerWaalsContact C-N 3.32Å; L205-R207 PolarHBondContact O-N 2.99Å
206	N	74.5	Confident	86.4	Confident	91 Å²	91	31.9 Å²	31.9	49%	0.487	17%	0.173	S	C	.	.	T	Hydrogen-bonded Turn	trans	55.8	37.5	179.9	-159.4	7.6	0	0	0	114.5	L202 M203 P208 Q257	L202-N206 PolarHBondContact O-N 3.33Å; L202-N206 VanDerWaalsContact O-N 3.16Å; M203-N206 PolarHBondContact O-N 2.92Å; N206-P208 VanDerWaalsContact O-CD 3.24Å; N206-P208 WeakPolarHBondContact O-CD 3.43Å; N206-Q257 PolarHBondContact O-NE2 3.42Å; N206-Q257 PolarHBondContact OD1-NE2 3.34Å
207	R	83.4	Confident	86.2	Confident	92 Å²	92	33.1 Å²	33.1	35%	0.347	18%	0.179	S	C	.	.			trans	-115.8	66.7	179.4	-70.2	161.7	67.5	-178.7	-0.9	111.4	L202 L205 S209 E210 A211	L202-R207 HydrophobicContact CB-CB 4.24Å; L202-R207 HydrophobicContact CD2-CB 3.99Å; L202-R207 PolarHBondContact O-N 3.34Å; L205-R207 VanDerWaalsContact C-N 3.32Å; L205-R207 PolarHBondContact O-N 2.99Å; R207-S209 PolarHBondContact O-N 3.11Å; R207-E210 IonicContact CZ-OE1 3.81Å; R207-E210 IonicContact CZ-OE2 2.75Å; R207-E210 IonicContact NE-OE1 3.8Å; R207-E210 PolarHBondContact NE-OE1 3.11Å; R207-E210 IonicContact NE-OE2 2.68Å; R207-E210 IonicContact NH2-OE1 3.16Å; R207-E210 PolarHBondContact NH2-OE1 3.32Å; R207-E210 IonicContact NH2-OE2 3.16Å; R207-E210 PolarHBondContact NH2-OE2 3.01Å; R207-E210 PolarHBondContact O-N 3.07Å; R207-A211 PolarHBondContact O-N 3.17Å
208	P	83.8	Confident	86	Confident	1 Å²	1	32.3 Å²	32.3	1%	0.006	18%	0.175	C	C	.	.	H	α-helix	trans	-69	-34.7	-169.6	27.5	-35.1	0	0	0	114.2	M203 N206 A211 L212 A250 A253 Q257	M203-P208 HydrophobicContact SD-CB 3.92Å; N206-P208 VanDerWaalsContact O-CD 3.24Å; N206-P208 WeakPolarHBondContact O-CD 3.43Å; P208-A211 CarbonylContact O-C 3.56Å; P208-A211 WeakPolarHBondContact O-CB 3.28Å; P208-A211 PolarHBondContact O-N 3.48Å; P208-A211 VanDerWaalsContact O-N 3.14Å; P208-L212 WeakPolarHBondContact O-CG 3.35Å; P208-L212 PolarHBondContact O-N 3.09Å; P208-A250 HydrophobicContact CB-CB 4.32Å; P208-A250 WeakPolarHBondContact CB-O 3.48Å; P208-A253 HydrophobicContact CB-CB 3.89Å; P208-A253 HydrophobicContact CG-CB 4.15Å; P208-Q257 VanDerWaalsContact CD-NE2 3.25Å; P208-Q257 HydrophobicContact CG-CG 4.47Å; P208-Q257 VanDerWaalsContact CG-OE1 3.29Å
209	S	85.8	Confident	85.6	Confident	67 Å²	67	31.4 Å²	31.4	47%	0.469	17%	0.172	S	C	.	.	H	α-helix	trans	-61.4	-45.6	177.1	51.8	0	0	0	0	112.3	R207 A211 L212 S213	R207-S209 PolarHBondContact O-N 3.11Å; S209-A211 VanDerWaalsContact C-N 3.34Å; S209-L212 PolarHBondContact O-N 3.14Å; S209-S213 PolarHBondContact O-N 3.43Å; S209-S213 VanDerWaalsContact O-N 3.15Å
210	E	88.6	Confident	85	Confident	64 Å²	64	35.9 Å²	35.9	30%	0.299	19%	0.19	S	C	.	.	H	α-helix	trans	-69.2	-31.4	172.6	-67.4	-176.7	-103.8	0	0	112.5	L202 R207 S213 A214	L202-E210 HydrophobicContact CD1-CB 3.83Å; L202-E210 HydrophobicContact CD2-CB 4.11Å; L202-E210 HydrophobicContact CG-CB 4.46Å; R207-E210 IonicContact CZ-OE1 3.81Å; R207-E210 IonicContact CZ-OE2 2.75Å; R207-E210 IonicContact NE-OE1 3.8Å; R207-E210 PolarHBondContact NE-OE1 3.11Å; R207-E210 IonicContact NE-OE2 2.68Å; R207-E210 IonicContact NH2-OE1 3.16Å; R207-E210 PolarHBondContact NH2-OE1 3.32Å; R207-E210 IonicContact NH2-OE2 3.16Å; R207-E210 PolarHBondContact NH2-OE2 3.01Å; R207-E210 PolarHBondContact O-N 3.07Å; E210-S213 PolarHBondContact O-N 3.42Å; E210-A214 WeakPolarHBondContact O-CB 3.44Å; E210-A214 PolarHBondContact O-N 3.21Å
211	A	89.3	Confident	84.8	Confident	0 Å²	0	35 Å²	35	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-65.8	-42.2	174.2	0	0	0	0	0	111.8	G199 L202 M203 R207 P208 S209 S213 A214 Y215	G199-A211 WeakPolarHBondContact O-CB 3.33Å; L202-A211 HydrophobicContact CB-CB 3.94Å; M203-A211 HydrophobicContact CG-CB 3.67Å; M203-A211 HydrophobicContact SD-CB 3.68Å; R207-A211 PolarHBondContact O-N 3.17Å; P208-A211 CarbonylContact O-C 3.56Å; P208-A211 WeakPolarHBondContact O-CB 3.28Å; P208-A211 PolarHBondContact O-N 3.48Å; P208-A211 VanDerWaalsContact O-N 3.14Å; S209-A211 VanDerWaalsContact C-N 3.34Å; A211-S213 VanDerWaalsContact C-N 3.34Å; A211-S213 PolarHBondContact O-N 3.46Å; A211-A214 CarbonylContact O-C 3.46Å; A211-A214 WeakPolarHBondContact O-CB 3.2Å; A211-A214 PolarHBondContact O-N 3.04Å; A211-A214 VanDerWaalsContact O-N 3.15Å; A211-Y215 HydrophobicContact CB-CD2 4.48Å; A211-Y215 HydrophobicContact CB-CE2 3.95Å; A211-Y215 WeakPolarHBondContact O-CD2 3.34Å; A211-Y215 PolarHBondContact O-N 3.4Å
212	L	88.2	Confident	84.5	Confident	15 Å²	15	37.2 Å²	37.2	8%	0.079	20%	0.201	C	C	.	.	H	α-helix	trans	-61	-41.5	172.9	-73.3	170.9	0	0	0	112	P208 S209 Y215 S216 V247 A250 E251 L254	P208-L212 WeakPolarHBondContact O-CG 3.35Å; P208-L212 PolarHBondContact O-N 3.09Å; S209-L212 PolarHBondContact O-N 3.14Å; L212-Y215 PolarHBondContact O-N 3.29Å; L212-S216 PolarHBondContact O-N 3.43Å; L212-S216 PolarHBondContact O-OG 2.95Å; L212-V247 HydrophobicContact CD2-CB 4.4Å; L212-V247 HydrophobicContact CD2-CG1 3.81Å; L212-V247 HydrophobicContact CD2-CG2 4.5Å; L212-A250 HydrophobicContact CD1-CB 4.41Å; L212-A250 HydrophobicContact CD2-CB 3.69Å; L212-A250 HydrophobicContact CG-CB 3.69Å; L212-E251 HydrophobicContact CD1-CG 4.24Å; L212-E251 HydrophobicContact CD2-CG 4.01Å; L212-L254 HydrophobicContact CD1-CD2 4.01Å
213	S	87.6	Confident	83.4	Confident	59 Å²	59	38 Å²	38	41%	0.413	21%	0.208	S	C	.	.	H	α-helix	trans	-61	-42.5	171.8	178.4	0	0	0	0	112	S209 E210 A211 S216 L217	S209-S213 PolarHBondContact O-N 3.43Å; S209-S213 VanDerWaalsContact O-N 3.15Å; E210-S213 PolarHBondContact O-N 3.42Å; A211-S213 VanDerWaalsContact C-N 3.34Å; A211-S213 PolarHBondContact O-N 3.46Å; S213-S216 PolarHBondContact O-OG 3.45Å; S213-L217 VanDerWaalsContact O-CG 3.29Å; S213-L217 WeakPolarHBondContact O-CG 3.39Å; S213-L217 PolarHBondContact O-N 3.02Å; S213-L217 VanDerWaalsContact O-N 3.1Å
214	A	90.2	Very high	81.9	Confident	0 Å²	0	39.7 Å²	39.7	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-66.3	-37.1	174.2	0	0	0	0	0	112.3	Y195 R198 L202 E210 A211 S218	Y195-A214 WeakPolarHBondContact CB-O 3.29Å; Y195-A214 HydrophobicContact CD1-CB 4.49Å; R198-A214 HydrophobicContact CB-CB 4.36Å; L202-A214 HydrophobicContact CD1-CB 4.36Å; E210-A214 WeakPolarHBondContact O-CB 3.44Å; E210-A214 PolarHBondContact O-N 3.21Å; A211-A214 CarbonylContact O-C 3.46Å; A211-A214 WeakPolarHBondContact O-CB 3.2Å; A211-A214 PolarHBondContact O-N 3.04Å; A211-A214 VanDerWaalsContact O-N 3.15Å; A214-S218 WeakPolarHBondContact O-CB 3.45Å; A214-S218 PolarHBondContact O-N 3.01Å
215	Y	89.6	Confident	80.8	Confident	0 Å²	0	45.9 Å²	45.9	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-72.1	-35.3	177.3	-62.2	-40.1	0	0	0	112.9	L196 G199 K200 M203 A211 L212 S218 R219 L243 Y246 V247 A250	L196-Y215 HydrophobicContact CD1-CE1 4.46Å; G199-Y215 PolarHBondContact O-OH 2.73Å; K200-Y215 HydrophobicContact CG-CE1 4.37Å; K200-Y215 PolarHBondContact N-OH 2.98Å; M203-Y215 HydrophobicContact CG-CE2 4.21Å; A211-Y215 HydrophobicContact CB-CD2 4.48Å; A211-Y215 HydrophobicContact CB-CE2 3.95Å; A211-Y215 WeakPolarHBondContact O-CD2 3.34Å; A211-Y215 PolarHBondContact O-N 3.4Å; L212-Y215 PolarHBondContact O-N 3.29Å; Y215-S218 WeakPolarHBondContact O-CB 3.48Å; Y215-S218 PolarHBondContact O-N 2.9Å; Y215-R219 PolarHBondContact O-N 3.13Å; Y215-L243 HydrophobicContact CD1-CD2 3.74Å; Y215-L243 HydrophobicContact CG-CD2 4.15Å; Y215-Y246 WeakPolarHBondContact CE2-O 3.45Å; Y215-V247 HydrophobicContact CD2-CG2 3.98Å; Y215-V247 HydrophobicContact CG-CG2 4.14Å; Y215-A250 HydrophobicContact CE2-CB 4.27Å
216	S	85.6	Confident	79.3	Confident	35 Å²	35	49.5 Å²	49.5	25%	0.245	27%	0.265	C	S	.	.	H	α-helix	trans	-67.8	-38.6	173.5	68.8	0	0	0	0	111.9	L212 S213 R219 Y220	L212-S216 PolarHBondContact O-N 3.43Å; L212-S216 PolarHBondContact O-OG 2.95Å; S213-S216 PolarHBondContact O-OG 3.45Å; S216-R219 WeakPolarHBondContact O-CB 3.46Å; S216-R219 PolarHBondContact O-N 3.3Å; S216-Y220 WeakPolarHBondContact O-CB 3.49Å; S216-Y220 PolarHBondContact O-N 2.73Å
217	L	86.7	Confident	77.8	Confident	47 Å²	47	51.6 Å²	51.6	25%	0.246	27%	0.272	C	S	.	.	H	α-helix	trans	-65.6	-40	170.7	-67.5	167.7	0	0	0	111.7	Y195 S213 R219 Y220 Y221	Y195-L217 HydrophobicContact CD1-CB 3.84Å; Y195-L217 HydrophobicContact CD1-CD1 4.02Å; Y195-L217 HydrophobicContact CD2-CB 3.88Å; Y195-L217 HydrophobicContact CE1-CB 4.03Å; Y195-L217 HydrophobicContact CE1-CD1 3.5Å; Y195-L217 HydrophobicContact CE1-CG 4.38Å; Y195-L217 HydrophobicContact CE2-CB 4.04Å; Y195-L217 HydrophobicContact CG-CB 3.78Å; S213-L217 VanDerWaalsContact O-CG 3.29Å; S213-L217 WeakPolarHBondContact O-CG 3.39Å; S213-L217 PolarHBondContact O-N 3.02Å; S213-L217 VanDerWaalsContact O-N 3.1Å; L217-R219 VanDerWaalsContact C-N 3.32Å; L217-R219 PolarHBondContact O-N 2.93Å; L217-Y220 PolarHBondContact O-N 2.91Å; L217-Y221 HydrophobicContact CD2-CE2 4.25Å; L217-Y221 VanDerWaalsContact O-CD2 3.22Å; L217-Y221 WeakPolarHBondContact O-CD2 3.46Å; L217-Y221 PolarHBondContact O-N 2.98Å
218	S	88	Confident	75.7	Confident	0 Å²	0	56 Å²	56	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-59.7	-40	171.9	-177.1	0	0	0	0	112.3	A192 A214 Y215 S222 Y242	A192-S218 PolarHBondContact O-OG 3.05Å; A192-S218 VanDerWaalsContact O-OG 3.13Å; A214-S218 WeakPolarHBondContact O-CB 3.45Å; A214-S218 PolarHBondContact O-N 3.01Å; Y215-S218 WeakPolarHBondContact O-CB 3.48Å; Y215-S218 PolarHBondContact O-N 2.9Å; S218-S222 WeakPolarHBondContact O-CB 3.42Å; S218-S222 PolarHBondContact O-N 3.44Å; S218-Y242 PolarHBondContact O-OH 3.03Å
219	R	83.2	Confident	73.5	Confident	22 Å²	22	57.5 Å²	57.5	8%	0.083	30%	0.304	C	S	.	.	H	α-helix	trans	-63.1	-51.1	173.7	-179.7	176.2	83.2	-163.7	14.1	110.6	Y215 S216 L217 S222 A223 S231 W239 P240 L243	Y215-R219 PolarHBondContact O-N 3.13Å; S216-R219 WeakPolarHBondContact O-CB 3.46Å; S216-R219 PolarHBondContact O-N 3.3Å; L217-R219 VanDerWaalsContact C-N 3.32Å; L217-R219 PolarHBondContact O-N 2.93Å; R219-S222 PolarHBondContact O-N 3.2Å; R219-S222 VanDerWaalsContact O-N 3.14Å; R219-A223 PolarHBondContact O-N 2.89Å; R219-S231 PolarHBondContact NH2-O 3.03Å; R219-W239 HydrophobicContact CB-CE3 4.29Å; R219-W239 HydrophobicContact CB-CZ3 3.87Å; R219-W239 HydrophobicContact CG-CE3 4.49Å; R219-W239 HydrophobicContact CG-CZ3 4.42Å; R219-W239 VanDerWaalsContact NH1-CZ2 3.34Å; R219-P240 HydrophobicContact CG-CG 4.1Å; R219-L243 HydrophobicContact CB-CD1 3.88Å
220	Y	79	Confident	71.3	Confident	94 Å²	94	60.5 Å²	60.5	37%	0.369	32%	0.319	S	S	.	.	H	α-helix	trans	-56.2	-54.8	-177	-179.8	-101.4	0	0	0	112.5	S216 L217 S222 A223	S216-Y220 WeakPolarHBondContact O-CB 3.49Å; S216-Y220 PolarHBondContact O-N 2.73Å; L217-Y220 PolarHBondContact O-N 2.91Å; Y220-S222 PolarHBondContact O-N 3.25Å; Y220-A223 WeakPolarHBondContact O-CB 3.4Å; Y220-A223 PolarHBondContact O-N 3.15Å
221	Y	82.3	Confident	68.8	Low	17 Å²	17	58.8 Å²	58.8	7%	0.067	32%	0.315	C	S	.	.	H	α-helix	trans	-72.6	-10.8	179.8	-66.9	-68.2	0	0	0	114.2	N188 L191 Y195 L217	N188-Y221 CarbonylContact C-O 3.54Å; N188-Y221 HydrophobicContact CB-CD1 4.45Å; N188-Y221 PolarHBondContact N-O 3.47Å; L191-Y221 HydrophobicContact CB-CG 4.41Å; L191-Y221 HydrophobicContact CD2-CD1 3.75Å; L191-Y221 HydrophobicContact CD2-CD2 3.93Å; L191-Y221 HydrophobicContact CD2-CE1 3.56Å; L191-Y221 HydrophobicContact CD2-CE2 3.77Å; L191-Y221 HydrophobicContact CD2-CG 3.92Å; L191-Y221 HydrophobicContact CG-CD1 4.31Å; L191-Y221 HydrophobicContact CG-CD2 3.86Å; L191-Y221 HydrophobicContact CG-CE1 4.49Å; L191-Y221 HydrophobicContact CG-CE2 4.08Å; L191-Y221 HydrophobicContact CG-CG 3.99Å; Y195-Y221 AromaticContact CD2-CD2 3.8Å; Y195-Y221 HydrophobicContact CD2-CD2 3.8Å; Y195-Y221 HydrophobicContact CD2-CE2 4.08Å; Y195-Y221 AromaticContact CE2-CD2 3.73Å; Y195-Y221 HydrophobicContact CE2-CD2 3.73Å; Y195-Y221 AromaticContact CE2-CE2 3.51Å; Y195-Y221 HydrophobicContact CE2-CE2 3.51Å; L217-Y221 HydrophobicContact CD2-CE2 4.25Å; L217-Y221 VanDerWaalsContact O-CD2 3.22Å; L217-Y221 WeakPolarHBondContact O-CD2 3.46Å; L217-Y221 PolarHBondContact O-N 2.98Å
222	S	81.1	Confident	66.6	Low	48 Å²	48	65 Å²	65	34%	0.336	35%	0.353	S	S	.	.	H	α-helix	trans	-92.5	-11.3	175.2	-177.9	0	0	0	0	113.6	S218 R219 Y220 S224 Y242	S218-S222 WeakPolarHBondContact O-CB 3.42Å; S218-S222 PolarHBondContact O-N 3.44Å; R219-S222 PolarHBondContact O-N 3.2Å; R219-S222 VanDerWaalsContact O-N 3.14Å; Y220-S222 PolarHBondContact O-N 3.25Å; S222-S224 PolarHBondContact O-N 2.97Å; S222-Y242 WeakPolarHBondContact CB-OH 3.5Å; S222-Y242 PolarHBondContact OG-OH 2.95Å; S222-Y242 VanDerWaalsContact OG-OH 3.13Å
223	A	65.5	Low	64.2	Low	17 Å²	17	72.1 Å²	72.1	14%	0.14	38%	0.383	C	S	.	.			trans	-63.6	132.1	178.8	0	0	0	0	0	110.1	S187 R219 Y220	S187-A223 WeakPolarHBondContact CB-O 3.36Å; S187-A223 PolarHBondContact OG-O 3.36Å; R219-A223 PolarHBondContact O-N 2.89Å; Y220-A223 WeakPolarHBondContact O-CB 3.4Å; Y220-A223 PolarHBondContact O-N 3.15Å
224	S	53.8	Low	62.2	Low	57 Å²	57	72.7 Å²	72.7	40%	0.399	38%	0.381	S	S	.	.			trans	-87.3	159.9	174	76.8	0	0	0	0	110.5	S222 T226 E227	S222-S224 PolarHBondContact O-N 2.97Å; S224-T226 PolarHBondContact O-N 3.4Å; S224-T226 PolarHBondContact OG-OG1 2.93Å; S224-E227 PolarHBondContact O-N 3.04Å
225	K	52.6	Low	59.9	Low	191 Å²	191	79.6 Å²	79.6	83%	0.83	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.9	-11	-172.5	-71	-170.1	174.1	-171.6	0	115.7
226	T	46.8	Very low	57.8	Low	122 Å²	122	84.1 Å²	84.1	75%	0.748	45%	0.45	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.8	-15.9	-177.2	48.7	0	0	0	0	114.7	S224	S224-T226 PolarHBondContact O-N 3.4Å; S224-T226 PolarHBondContact OG-OG1 2.93Å
227	E	43	Very low	56.4	Low	136 Å²	136	86 Å²	86	64%	0.636	46%	0.455	S	S	*	.			trans	-113.5	110.1	-176.5	-68.7	-176.4	149.5	0	0	111.7	S224 C229	S224-E227 PolarHBondContact O-N 3.04Å; E227-C229 PolarHBondContact O-N 2.99Å
228	K	37.9	Very low	55.5	Low	183 Å²	183	92.7 Å²	92.7	80%	0.796	48%	0.482	S	S	*	.			trans	-78.4	61.8	179.7	-69.8	-174.4	175.8	-178.9	0	112.6	T230	K228-T230 PolarHBondContact O-N 3.23Å
229	C	37.9	Very low	54.9	Low	34 Å²	34	94 Å²	94	23%	0.23	49%	0.487	C	S	.	.			trans	-71.5	94.2	170.6	-179.5	0	0	0	0	109.5	E227 E237	E227-C229 PolarHBondContact O-N 2.99Å; C229-E237 PolarHBondContact SG-OE2 3.18Å
230	T	40.1	Very low	54.5	Low	129 Å²	129	95 Å²	95	79%	0.791	50%	0.496	S	S	*	.			trans	-95.5	0.6	-179.1	52.8	0	0	0	0	113.6	K228	K228-T230 PolarHBondContact O-N 3.23Å
231	S	37.4	Very low	54.2	Low	29 Å²	29	97.4 Å²	97.4	20%	0.203	52%	0.515	C	S	.	.			trans	-98.6	115.6	-176.1	-167.5	0	0	0	0	113.4	R219 K233 E237	R219-S231 PolarHBondContact NH2-O 3.03Å; S231-K233 VanDerWaalsContact C-N 3.31Å; S231-K233 PolarHBondContact OG-N 3.42Å; S231-K233 VanDerWaalsContact OG-N 3.16Å; S231-K233 PolarHBondContact OG-O 3Å; S231-E237 WeakPolarHBondContact CB-OE2 3.42Å
232	T	43.1	Very low	54	Low	130 Å²	130	100.6 Å²	100.6	80%	0.798	53%	0.528	S	S	*	.			trans	-82.1	-9.2	159.5	51.9	0	0	0	0	112.7
233	K	37.6	Very low	54	Low	164 Å²	164	98.3 Å²	98.3	71%	0.713	51%	0.512	S	S	*	.	S	Bend	trans	-74.6	141.2	175.8	-67.1	-176.1	177.2	-179.5	0	109.9	S231 N235	S231-K233 VanDerWaalsContact C-N 3.31Å; S231-K233 PolarHBondContact OG-N 3.42Å; S231-K233 VanDerWaalsContact OG-N 3.16Å; S231-K233 PolarHBondContact OG-O 3Å; K233-N235 VanDerWaalsContact C-N 3.32Å; K233-N235 PolarHBondContact O-N 3.26Å
234	L	45.2	Very low	54.6	Low	71 Å²	71	99.3 Å²	99.3	37%	0.372	51%	0.514	S	S	.	.	S	Bend	trans	-64.8	-34.7	-171.8	-154.5	76.1	0	0	0	112.8	W239	L234-W239 HydrophobicContact CD1-CZ2 3.9Å
235	N	42	Very low	55.2	Low	145 Å²	145	98 Å²	98	78%	0.775	50%	0.502	S	S	*	.	S	Bend	trans	-110.6	83.3	-164.3	-61.3	3.1	0	0	0	113	K233	K233-N235 VanDerWaalsContact C-N 3.32Å; K233-N235 PolarHBondContact O-N 3.26Å
236	S	46	Very low	56.5	Low	96 Å²	96	91 Å²	91	67%	0.671	47%	0.47	S	S	*	.	S	Bend	trans	-170.1	-31.1	154.7	57.9	0	0	0	0	114.1
237	E	54.9	Low	58.1	Low	74 Å²	74	85.1 Å²	85.1	35%	0.346	44%	0.435	S	S	.	.	S	Bend	trans	-109.4	136	-171.8	-68.8	178.7	116.7	0	0	112.5	C229 S231 W239	C229-E237 PolarHBondContact SG-OE2 3.18Å; S231-E237 WeakPolarHBondContact CB-OE2 3.42Å; E237-W239 PolarHBondContact O-N 3.49Å
238	K	68.8	Low	59.7	Low	188 Å²	188	80.8 Å²	80.8	82%	0.817	42%	0.416	S	S	*	.	P	Polyproline II helix	trans	-66.8	122.2	-175.2	-174.8	178.2	-179.3	179.1	0	111.1
239	W	73.8	Confident	61.1	Low	28 Å²	28	73.5 Å²	73.5	11%	0.106	38%	0.384	C	S	.	.	P	Polyproline II helix	trans	-59	142.6	178.2	-73.4	100	0	0	0	112.8	R219 L234 E237 L243 I244 V247	R219-W239 HydrophobicContact CB-CE3 4.29Å; R219-W239 HydrophobicContact CB-CZ3 3.87Å; R219-W239 HydrophobicContact CG-CE3 4.49Å; R219-W239 HydrophobicContact CG-CZ3 4.42Å; R219-W239 VanDerWaalsContact NH1-CZ2 3.34Å; L234-W239 HydrophobicContact CD1-CZ2 3.9Å; E237-W239 PolarHBondContact O-N 3.49Å; W239-L243 HydrophobicContact CE3-CB 4.18Å; W239-L243 HydrophobicContact CE3-CD1 3.98Å; W239-L243 HydrophobicContact CZ3-CD1 4.1Å; W239-I244 HydrophobicContact CB-CG1 3.84Å; W239-I244 WeakPolarHBondContact O-CD1 3.5Å; W239-I244 WeakPolarHBondContact O-CG1 3.02Å; W239-V247 HydrophobicContact CD2-CB 4.37Å; W239-V247 HydrophobicContact CD2-CG1 4.19Å; W239-V247 HydrophobicContact CD2-CG2 3.89Å; W239-V247 HydrophobicContact CE3-CG2 3.87Å; W239-V247 HydrophobicContact CG-CG1 4.42Å; W239-V247 HydrophobicContact CH2-CG2 4.04Å; W239-V247 HydrophobicContact CZ2-CG1 3.92Å; W239-V247 HydrophobicContact CZ2-CG2 4.07Å; W239-V247 HydrophobicContact CZ3-CG2 3.95Å
240	P	76.2	Confident	63	Low	41 Å²	41	71.9 Å²	71.9	27%	0.266	37%	0.373	S	S	.	.	P	Polyproline II helix	trans	-57.3	143.9	173.3	-25.4	34.4	0	0	0	112	R219 Y242 L243 I244	R219-P240 HydrophobicContact CG-CG 4.1Å; P240-Y242 HydrophobicContact CB-CD1 3.72Å; P240-Y242 HydrophobicContact CB-CE1 3.55Å; P240-Y242 HydrophobicContact CG-CE1 4.21Å; P240-Y242 PolarHBondContact O-N 3.18Å; P240-L243 HydrophobicContact CG-CD1 4.36Å; P240-L243 PolarHBondContact O-N 2.81Å; P240-I244 PolarHBondContact O-N 3.06Å
241	N	72.1	Confident	64.9	Low	145 Å²	145	67.5 Å²	67.5	78%	0.775	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.3	-26.6	-175.7	-70.1	-16.6	0	0	0	114.7	L243	N241-L243 VanDerWaalsContact C-N 3.35Å
242	Y	78	Confident	66.3	Low	84 Å²	84	66.6 Å²	66.6	33%	0.329	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.6	-6.8	177.7	78.2	-91.1	0	0	0	114.6	L196 S218 S222 P240 Y246	L196-Y242 HydrophobicContact CD1-CD2 4.08Å; L196-Y242 HydrophobicContact CD1-CE2 4.14Å; L196-Y242 HydrophobicContact CD2-CD2 3.99Å; L196-Y242 HydrophobicContact CD2-CE2 4.13Å; S218-Y242 PolarHBondContact O-OH 3.03Å; S222-Y242 WeakPolarHBondContact CB-OH 3.5Å; S222-Y242 PolarHBondContact OG-OH 2.95Å; S222-Y242 VanDerWaalsContact OG-OH 3.13Å; P240-Y242 HydrophobicContact CB-CD1 3.72Å; P240-Y242 HydrophobicContact CB-CE1 3.55Å; P240-Y242 HydrophobicContact CG-CE1 4.21Å; P240-Y242 PolarHBondContact O-N 3.18Å; Y242-Y246 WeakPolarHBondContact O-CD2 3.27Å; Y242-Y246 WeakPolarHBondContact O-CE2 3.4Å
243	L	81.7	Confident	67.7	Low	0 Å²	0	60.6 Å²	60.6	0%	0	30%	0.302	C	S	.	.	T	Hydrogen-bonded Turn	trans	-113	-29.5	179.2	-74	174.6	0	0	0	114	L196 Y215 R219 W239 P240 N241 E245 Y246 V247	L196-L243 HydrophobicContact CD1-CD2 3.6Å; Y215-L243 HydrophobicContact CD1-CD2 3.74Å; Y215-L243 HydrophobicContact CG-CD2 4.15Å; R219-L243 HydrophobicContact CB-CD1 3.88Å; W239-L243 HydrophobicContact CE3-CB 4.18Å; W239-L243 HydrophobicContact CE3-CD1 3.98Å; W239-L243 HydrophobicContact CZ3-CD1 4.1Å; P240-L243 HydrophobicContact CG-CD1 4.36Å; P240-L243 PolarHBondContact O-N 2.81Å; N241-L243 VanDerWaalsContact C-N 3.35Å; L243-E245 VanDerWaalsContact C-N 3.29Å; L243-E245 PolarHBondContact O-N 3.28Å; L243-E245 VanDerWaalsContact O-N 3.13Å; L243-Y246 PolarHBondContact O-N 3.1Å; L243-V247 HydrophobicContact CB-CG2 4.33Å; L243-V247 PolarHBondContact O-N 2.78Å
244	I	77.1	Confident	69.6	Low	38 Å²	38	54.9 Å²	54.9	20%	0.195	28%	0.279	C	S	.	.	H	α-helix	trans	-44.5	-51.7	-173.4	-65.9	170	0	0	0	112.5	W239 P240 V247 L248	W239-I244 HydrophobicContact CB-CG1 3.84Å; W239-I244 WeakPolarHBondContact O-CD1 3.5Å; W239-I244 WeakPolarHBondContact O-CG1 3.02Å; P240-I244 PolarHBondContact O-N 3.06Å; I244-V247 PolarHBondContact O-N 2.73Å; I244-L248 HydrophobicContact CG2-CD1 3.72Å; I244-L248 HydrophobicContact CG2-CG 4.39Å; I244-L248 WeakPolarHBondContact O-CB 3.5Å; I244-L248 VanDerWaalsContact O-CG 3.31Å; I244-L248 WeakPolarHBondContact O-CG 3.39Å; I244-L248 PolarHBondContact O-N 3.03Å
245	E	67.1	Low	70.9	Confident	30 Å²	30	55 Å²	55	14%	0.14	28%	0.279	C	S	.	.	H	α-helix	trans	-62.5	-45.1	-177.7	-165.9	-163.6	149.4	0	0	112.5	L243 Q249 L641 I642	L243-E245 VanDerWaalsContact C-N 3.29Å; L243-E245 PolarHBondContact O-N 3.28Å; L243-E245 VanDerWaalsContact O-N 3.13Å; E245-Q249 WeakPolarHBondContact O-CB 3.45Å; E245-Q249 PolarHBondContact O-N 3.5Å; E245-L641 VanDerWaalsContact OE1-CB 3.23Å; E245-L641 WeakPolarHBondContact OE1-CB 3.01Å; E245-I642 HydrophobicContact CG-CD1 3.77Å; E245-I642 WeakPolarHBondContact OE1-CD1 3.38Å; E245-I642 VanDerWaalsContact OE1-CG1 3.26Å; E245-I642 WeakPolarHBondContact OE1-CG1 3.36Å; E245-I642 PolarHBondContact OE1-N 3.43Å
246	Y	79.9	Confident	71.9	Confident	43 Å²	43	49 Å²	49	17%	0.169	25%	0.25	C	S	.	.	H	α-helix	trans	-70.5	-33	-178.5	-60.4	-70.2	0	0	0	113	K200 Y215 Y242 L243 A250	K200-Y246 HydrophobicContact CD-CD1 4.38Å; K200-Y246 HydrophobicContact CD-CE1 3.95Å; K200-Y246 VanDerWaalsContact CE-CE1 3.48Å; K200-Y246 VanDerWaalsContact CE-CE2 3.5Å; K200-Y246 HydrophobicContact CG-CD1 4.09Å; K200-Y246 HydrophobicContact CG-CE1 4.1Å; K200-Y246 PolarHBondContact NZ-OH 2.82Å; Y215-Y246 WeakPolarHBondContact CE2-O 3.45Å; Y242-Y246 WeakPolarHBondContact O-CD2 3.27Å; Y242-Y246 WeakPolarHBondContact O-CE2 3.4Å; L243-Y246 PolarHBondContact O-N 3.1Å; Y246-A250 WeakPolarHBondContact O-CB 3.14Å; Y246-A250 PolarHBondContact O-N 3.5Å; Y246-A250 VanDerWaalsContact O-N 3.14Å
247	V	81.5	Confident	73.1	Confident	0 Å²	0	47.5 Å²	47.5	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-73.4	-48.7	176.1	169.9	0	0	0	0	110.6	L212 Y215 W239 L243 I244 Q249 A250 E251	L212-V247 HydrophobicContact CD2-CB 4.4Å; L212-V247 HydrophobicContact CD2-CG1 3.81Å; L212-V247 HydrophobicContact CD2-CG2 4.5Å; Y215-V247 HydrophobicContact CD2-CG2 3.98Å; Y215-V247 HydrophobicContact CG-CG2 4.14Å; W239-V247 HydrophobicContact CD2-CB 4.37Å; W239-V247 HydrophobicContact CD2-CG1 4.19Å; W239-V247 HydrophobicContact CD2-CG2 3.89Å; W239-V247 HydrophobicContact CE3-CG2 3.87Å; W239-V247 HydrophobicContact CG-CG1 4.42Å; W239-V247 HydrophobicContact CH2-CG2 4.04Å; W239-V247 HydrophobicContact CZ2-CG1 3.92Å; W239-V247 HydrophobicContact CZ2-CG2 4.07Å; W239-V247 HydrophobicContact CZ3-CG2 3.95Å; L243-V247 HydrophobicContact CB-CG2 4.33Å; L243-V247 PolarHBondContact O-N 2.78Å; I244-V247 PolarHBondContact O-N 2.73Å; V247-Q249 PolarHBondContact O-N 3.34Å; V247-A250 CarbonylContact O-C 3.58Å; V247-A250 WeakPolarHBondContact O-CA 3.48Å; V247-A250 PolarHBondContact O-N 2.89Å; V247-E251 VanDerWaalsContact CG1-CD 3.49Å; V247-E251 HydrophobicContact CG1-CG 4.2Å; V247-E251 WeakPolarHBondContact CG1-OE1 3.44Å; V247-E251 WeakPolarHBondContact O-CB 3.25Å; V247-E251 WeakPolarHBondContact O-CG 3.37Å; V247-E251 PolarHBondContact O-N 3.45Å
248	L	75	Confident	74	Confident	45 Å²	45	49.5 Å²	49.5	24%	0.236	24%	0.242	C	C	.	.	H	α-helix	trans	-58.7	-37.4	175.9	-72.4	172.1	0	0	0	111.9	I244 A252	I244-L248 HydrophobicContact CG2-CD1 3.72Å; I244-L248 HydrophobicContact CG2-CG 4.39Å; I244-L248 WeakPolarHBondContact O-CB 3.5Å; I244-L248 VanDerWaalsContact O-CG 3.31Å; I244-L248 WeakPolarHBondContact O-CG 3.39Å; I244-L248 PolarHBondContact O-N 3.03Å; L248-A252 VanDerWaalsContact O-CB 3.28Å; L248-A252 WeakPolarHBondContact O-CB 3.32Å; L248-A252 PolarHBondContact O-N 3.15Å
249	Q	68.3	Low	73.8	Confident	29 Å²	29	42.5 Å²	42.5	14%	0.136	22%	0.219	C	C	.	.	H	α-helix	trans	-63.2	-43.4	172.4	-165.8	-159.4	-7.5	0	0	112	M203 E245 V247 A252 A253 I642	M203-Q249 HydrophobicContact CE-CB 4.19Å; M203-Q249 HydrophobicContact CE-CG 3.71Å; E245-Q249 WeakPolarHBondContact O-CB 3.45Å; E245-Q249 PolarHBondContact O-N 3.5Å; V247-Q249 PolarHBondContact O-N 3.34Å; Q249-A252 PolarHBondContact O-N 2.84Å; Q249-A253 VanDerWaalsContact O-CB 3.24Å; Q249-A253 WeakPolarHBondContact O-CB 3.33Å; Q249-A253 PolarHBondContact O-N 3.14Å; Q249-I642 HydrophobicContact CB-CD1 3.65Å; Q249-I642 HydrophobicContact CG-CD1 3.76Å
250	A	77.4	Confident	73.3	Confident	0 Å²	0	43.2 Å²	43.2	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-72.3	-33.5	-179.2	0	0	0	0	0	112.4	M203 P208 L212 Y215 Y246 V247 L254	M203-A250 HydrophobicContact CE-CB 4.05Å; M203-A250 HydrophobicContact SD-CB 3.48Å; M203-A250 WeakPolarHBondContact SD-CB 3.28Å; P208-A250 HydrophobicContact CB-CB 4.32Å; P208-A250 WeakPolarHBondContact CB-O 3.48Å; L212-A250 HydrophobicContact CD1-CB 4.41Å; L212-A250 HydrophobicContact CD2-CB 3.69Å; L212-A250 HydrophobicContact CG-CB 3.69Å; Y215-A250 HydrophobicContact CE2-CB 4.27Å; Y246-A250 WeakPolarHBondContact O-CB 3.14Å; Y246-A250 PolarHBondContact O-N 3.5Å; Y246-A250 VanDerWaalsContact O-N 3.14Å; V247-A250 CarbonylContact O-C 3.58Å; V247-A250 WeakPolarHBondContact O-CA 3.48Å; V247-A250 PolarHBondContact O-N 2.89Å; A250-L254 VanDerWaalsContact O-CB 3.24Å; A250-L254 WeakPolarHBondContact O-CB 3.23Å; A250-L254 PolarHBondContact O-N 3.06Å
251	E	80.7	Confident	72.9	Confident	37 Å²	37	43.6 Å²	43.6	17%	0.173	23%	0.231	C	C	.	.	H	α-helix	trans	-65.6	-47.8	170.1	-74.3	164.5	174.8	0	0	110.7	L212 V247 A253 L254 I255	L212-E251 HydrophobicContact CD1-CG 4.24Å; L212-E251 HydrophobicContact CD2-CG 4.01Å; V247-E251 VanDerWaalsContact CG1-CD 3.49Å; V247-E251 HydrophobicContact CG1-CG 4.2Å; V247-E251 WeakPolarHBondContact CG1-OE1 3.44Å; V247-E251 WeakPolarHBondContact O-CB 3.25Å; V247-E251 WeakPolarHBondContact O-CG 3.37Å; V247-E251 PolarHBondContact O-N 3.45Å; E251-A253 PolarHBondContact O-N 3.47Å; E251-L254 PolarHBondContact O-N 2.87Å; E251-I255 WeakPolarHBondContact O-CB 3.37Å; E251-I255 VanDerWaalsContact O-CG1 3.27Å; E251-I255 WeakPolarHBondContact O-CG1 3.39Å; E251-I255 PolarHBondContact O-N 2.89Å
252	A	66.8	Low	72.7	Confident	10 Å²	10	43.5 Å²	43.5	8%	0.083	22%	0.224	C	C	.	.	H	α-helix	trans	-62.7	-39.2	175.9	0	0	0	0	0	112.8	L248 Q249 A256	L248-A252 VanDerWaalsContact O-CB 3.28Å; L248-A252 WeakPolarHBondContact O-CB 3.32Å; L248-A252 PolarHBondContact O-N 3.15Å; Q249-A252 PolarHBondContact O-N 2.84Å; A252-A256 PolarHBondContact O-N 3.49Å
253	A	71.9	Confident	72	Confident	4 Å²	4	40.6 Å²	40.6	3%	0.033	22%	0.218	C	C	.	.	H	α-helix	trans	-69.1	-35.9	174.5	0	0	0	0	0	112.3	M203 P208 Q249 E251 A256 Q257	M203-A253 HydrophobicContact CE-CB 4.04Å; P208-A253 HydrophobicContact CB-CB 3.89Å; P208-A253 HydrophobicContact CG-CB 4.15Å; Q249-A253 VanDerWaalsContact O-CB 3.24Å; Q249-A253 WeakPolarHBondContact O-CB 3.33Å; Q249-A253 PolarHBondContact O-N 3.14Å; E251-A253 PolarHBondContact O-N 3.47Å; A253-A256 PolarHBondContact O-N 2.9Å; A253-Q257 WeakPolarHBondContact O-CG 3.27Å; A253-Q257 PolarHBondContact O-N 3.45Å
254	L	77.3	Confident	71.1	Confident	45 Å²	45	41.3 Å²	41.3	24%	0.236	22%	0.221	C	C	.	.	H	α-helix	trans	-67.6	-44.2	173.8	-174.7	66.8	0	0	0	111.3	L212 A250 E251 A256 Q257 E258	L212-L254 HydrophobicContact CD1-CD2 4.01Å; A250-L254 VanDerWaalsContact O-CB 3.24Å; A250-L254 WeakPolarHBondContact O-CB 3.23Å; A250-L254 PolarHBondContact O-N 3.06Å; E251-L254 PolarHBondContact O-N 2.87Å; L254-A256 VanDerWaalsContact C-N 3.27Å; L254-A256 PolarHBondContact O-N 3.21Å; L254-Q257 CarbonylContact O-C 3.56Å; L254-Q257 PolarHBondContact O-N 2.78Å; L254-Q257 VanDerWaalsContact O-N 3.1Å; L254-E258 HydrophobicContact CG-CG 4.45Å; L254-E258 WeakPolarHBondContact O-CB 3.31Å; L254-E258 WeakPolarHBondContact O-CG 3.46Å; L254-E258 PolarHBondContact O-N 2.68Å
255	I	71.7	Confident	70.5	Confident	73 Å²	73	41.6 Å²	41.6	37%	0.374	23%	0.229	S	C	.	.	H	α-helix	trans	-58.7	-39.9	174.9	-69.8	163.1	0	0	0	110.9	E251 A259 M535	E251-I255 WeakPolarHBondContact O-CB 3.37Å; E251-I255 VanDerWaalsContact O-CG1 3.27Å; E251-I255 WeakPolarHBondContact O-CG1 3.39Å; E251-I255 PolarHBondContact O-N 2.89Å; I255-A259 WeakPolarHBondContact O-CB 3.49Å; I255-A259 PolarHBondContact O-N 2.65Å; I255-M535 HydrophobicContact CD1-SD 4.42Å
256	A	64.7	Low	70.4	Confident	20 Å²	20	44.7 Å²	44.7	17%	0.165	25%	0.246	C	C	.	.	H	α-helix	trans	-64.4	-48.4	172.2	0	0	0	0	0	111.7	A252 A253 L254 E258 A259 D260	A252-A256 PolarHBondContact O-N 3.49Å; A253-A256 PolarHBondContact O-N 2.9Å; L254-A256 VanDerWaalsContact C-N 3.27Å; L254-A256 PolarHBondContact O-N 3.21Å; A256-E258 VanDerWaalsContact C-N 3.3Å; A256-E258 PolarHBondContact O-N 3.1Å; A256-A259 PolarHBondContact O-N 2.93Å; A256-D260 WeakPolarHBondContact O-CB 3.36Å; A256-D260 PolarHBondContact O-N 3.37Å; A256-D260 VanDerWaalsContact O-OD1 3.06Å
257	Q	71.3	Confident	69.6	Low	63 Å²	63	42.9 Å²	42.9	29%	0.294	24%	0.239	S	C	.	.	H	α-helix	trans	-62.2	-33.4	177.1	-73.3	-174.4	0.8	0	0	113.3	N206 P208 A253 L254 A261	N206-Q257 PolarHBondContact O-NE2 3.42Å; N206-Q257 PolarHBondContact OD1-NE2 3.34Å; P208-Q257 VanDerWaalsContact CD-NE2 3.25Å; P208-Q257 HydrophobicContact CG-CG 4.47Å; P208-Q257 VanDerWaalsContact CG-OE1 3.29Å; A253-Q257 WeakPolarHBondContact O-CG 3.27Å; A253-Q257 PolarHBondContact O-N 3.45Å; L254-Q257 CarbonylContact O-C 3.56Å; L254-Q257 PolarHBondContact O-N 2.78Å; L254-Q257 VanDerWaalsContact O-N 3.1Å; Q257-A261 WeakPolarHBondContact O-CB 3.44Å; Q257-A261 PolarHBondContact O-N 3.17Å
258	E	72.9	Confident	68.6	Low	117 Å²	117	44.2 Å²	44.2	55%	0.547	25%	0.251	S	S	.	.	H	α-helix	trans	-73	-39.1	174.5	-74.3	-179	-172	0	0	112.2	L254 A256 K262	L254-E258 HydrophobicContact CG-CG 4.45Å; L254-E258 WeakPolarHBondContact O-CB 3.31Å; L254-E258 WeakPolarHBondContact O-CG 3.46Å; L254-E258 PolarHBondContact O-N 2.68Å; A256-E258 VanDerWaalsContact C-N 3.3Å; A256-E258 PolarHBondContact O-N 3.1Å; E258-K262 WeakPolarHBondContact O-CB 3.44Å; E258-K262 PolarHBondContact O-N 3.48Å
259	A	65	Low	67.9	Low	41 Å²	41	48.6 Å²	48.6	34%	0.339	27%	0.27	S	S	.	.	H	α-helix	trans	-63.3	-45.1	172.4	0	0	0	0	0	111.4	I255 A256 K262 A263	I255-A259 WeakPolarHBondContact O-CB 3.49Å; I255-A259 PolarHBondContact O-N 2.65Å; A256-A259 PolarHBondContact O-N 2.93Å; A259-K262 PolarHBondContact O-N 3.28Å; A259-A263 WeakPolarHBondContact O-CB 3.49Å; A259-A263 PolarHBondContact O-N 3.18Å
260	D	62.4	Low	67.4	Low	42 Å²	42	50.1 Å²	50.1	23%	0.225	28%	0.284	C	S	.	.	H	α-helix	trans	-57	-54.9	173	-78.5	28.4	0	0	0	111	A256 K262 A263 E264 R314	A256-D260 WeakPolarHBondContact O-CB 3.36Å; A256-D260 PolarHBondContact O-N 3.37Å; A256-D260 VanDerWaalsContact O-OD1 3.06Å; D260-K262 VanDerWaalsContact C-N 3.31Å; D260-K262 PolarHBondContact O-N 2.93Å; D260-A263 PolarHBondContact O-N 2.95Å; D260-E264 WeakPolarHBondContact O-CB 3.46Å; D260-E264 WeakPolarHBondContact O-CG 3.47Å; D260-E264 PolarHBondContact O-N 2.88Å; D260-R314 VanDerWaalsContact CG-CZ 3.41Å; D260-R314 VanDerWaalsContact CG-NH2 3.27Å; D260-R314 IonicContact OD1-CZ 3.37Å; D260-R314 IonicContact OD1-NE 2.7Å; D260-R314 PolarHBondContact OD1-NE 2.91Å; D260-R314 IonicContact OD1-NH2 3.37Å; D260-R314 PolarHBondContact OD1-NH2 3.05Å; D260-R314 WeakPolarHBondContact OD2-CD 3.39Å; D260-R314 IonicContact OD2-CZ 3.79Å; D260-R314 IonicContact OD2-NE 3.6Å; D260-R314 PolarHBondContact OD2-NE 3.38Å; D260-R314 IonicContact OD2-NH2 2.9Å; D260-R314 PolarHBondContact OD2-NH2 3.45Å
261	A	68.4	Low	66	Low	49 Å²	49	51 Å²	51	41%	0.405	29%	0.292	S	S	.	.	H	α-helix	trans	-63	-35.1	-178.7	0	0	0	0	0	112.6	Q257 A265	Q257-A261 WeakPolarHBondContact O-CB 3.44Å; Q257-A261 PolarHBondContact O-N 3.17Å; A261-A265 VanDerWaalsContact O-CB 3.24Å; A261-A265 WeakPolarHBondContact O-CB 3.47Å; A261-A265 PolarHBondContact O-N 2.96Å
262	K	68	Low	64.3	Low	143 Å²	143	54.3 Å²	54.3	62%	0.622	31%	0.309	S	S	*	.	H	α-helix	trans	-70	-40.8	174.3	-174.6	174.8	-178.8	177.2	0	111.9	E258 A259 D260 A265 N266	E258-K262 WeakPolarHBondContact O-CB 3.44Å; E258-K262 PolarHBondContact O-N 3.48Å; A259-K262 PolarHBondContact O-N 3.28Å; D260-K262 VanDerWaalsContact C-N 3.31Å; D260-K262 PolarHBondContact O-N 2.93Å; K262-A265 PolarHBondContact O-N 3.32Å; K262-N266 WeakPolarHBondContact O-CB 3.35Å; K262-N266 PolarHBondContact O-N 2.88Å; K262-N266 PolarHBondContact O-ND2 3.43Å; K262-N266 PolarHBondContact O-OD1 2.9Å
263	A	62.5	Low	63.2	Low	24 Å²	24	57 Å²	57	20%	0.198	34%	0.338	C	S	.	.	H	α-helix	trans	-64.6	-43.2	174.4	0	0	0	0	0	111.4	A259 D260 F267 A311	A259-A263 WeakPolarHBondContact O-CB 3.49Å; A259-A263 PolarHBondContact O-N 3.18Å; D260-A263 PolarHBondContact O-N 2.95Å; A263-F267 VanDerWaalsContact O-CB 3.26Å; A263-F267 WeakPolarHBondContact O-CB 3.47Å; A263-F267 PolarHBondContact O-N 3.49Å; A263-A311 HydrophobicContact CB-CB 4.11Å; A263-A311 WeakPolarHBondContact O-CB 3.2Å
264	E	62.9	Low	61.7	Low	14 Å²	14	62.5 Å²	62.5	7%	0.065	36%	0.361	C	S	.	.	H	α-helix	trans	-63.2	-40.9	173	-73.9	176.9	173.2	0	0	113.2	D260 F267 A268 R314 R318	D260-E264 WeakPolarHBondContact O-CB 3.46Å; D260-E264 WeakPolarHBondContact O-CG 3.47Å; D260-E264 PolarHBondContact O-N 2.88Å; E264-F267 PolarHBondContact O-N 3.15Å; E264-A268 VanDerWaalsContact O-CB 3.25Å; E264-A268 WeakPolarHBondContact O-CB 3.24Å; E264-A268 PolarHBondContact O-N 3.03Å; E264-R314 HydrophobicContact CG-CB 4.23Å; E264-R314 VanDerWaalsContact OE1-CB 3.26Å; E264-R314 WeakPolarHBondContact OE1-CB 3.42Å; E264-R318 IonicContact OE1-CZ 3.58Å; E264-R318 IonicContact OE1-NH1 3.7Å; E264-R318 IonicContact OE1-NH2 2.72Å; E264-R318 PolarHBondContact OE1-NH2 2.93Å; E264-R318 IonicContact OE2-CZ 3.16Å; E264-R318 IonicContact OE2-NH1 2.68Å; E264-R318 PolarHBondContact OE2-NH1 3.4Å; E264-R318 IonicContact OE2-NH2 2.7Å; E264-R318 PolarHBondContact OE2-NH2 3.48Å
265	A	65.6	Low	60.1	Low	45 Å²	45	67.1 Å²	67.1	37%	0.372	38%	0.379	S	S	.	.	H	α-helix	trans	-65.8	-44.7	177.9	0	0	0	0	0	111.4	A261 K262 F267 A268 Q269	A261-A265 VanDerWaalsContact O-CB 3.24Å; A261-A265 WeakPolarHBondContact O-CB 3.47Å; A261-A265 PolarHBondContact O-N 2.96Å; K262-A265 PolarHBondContact O-N 3.32Å; A265-F267 VanDerWaalsContact C-N 3.34Å; A265-A268 PolarHBondContact O-N 3.49Å; A265-Q269 WeakPolarHBondContact O-CG 3.46Å; A265-Q269 PolarHBondContact O-N 3.31Å
266	N	64.2	Low	58.3	Low	94 Å²	94	71.9 Å²	71.9	50%	0.503	40%	0.398	S	S	.	.	H	α-helix	trans	-61.3	-43.7	173.8	-67.9	-11.1	0	0	0	111.2	K262 Q269 S270	K262-N266 WeakPolarHBondContact O-CB 3.35Å; K262-N266 PolarHBondContact O-N 2.88Å; K262-N266 PolarHBondContact O-ND2 3.43Å; K262-N266 PolarHBondContact O-OD1 2.9Å; N266-Q269 PolarHBondContact O-N 3.19Å; N266-S270 PolarHBondContact O-N 3.25Å; N266-S270 VanDerWaalsContact O-N 3.1Å
267	F	62.1	Low	56.9	Low	5 Å²	5	77.7 Å²	77.7	2%	0.022	43%	0.426	C	S	.	.	H	α-helix	trans	-60.6	-49.2	174.8	178.8	-81	0	0	0	111.1	A263 E264 A265 Q269 S270 A271 L295 Y308 A311 G312	A263-F267 VanDerWaalsContact O-CB 3.26Å; A263-F267 WeakPolarHBondContact O-CB 3.47Å; A263-F267 PolarHBondContact O-N 3.49Å; E264-F267 PolarHBondContact O-N 3.15Å; A265-F267 VanDerWaalsContact C-N 3.34Å; F267-Q269 PolarHBondContact O-N 3.24Å; F267-S270 PolarHBondContact O-N 2.85Å; F267-S270 VanDerWaalsContact O-N 3.11Å; F267-S270 PolarHBondContact O-OG 3.48Å; F267-A271 HydrophobicContact CE1-CB 4.32Å; F267-A271 WeakPolarHBondContact O-CB 3.04Å; F267-A271 PolarHBondContact O-N 3.37Å; F267-L295 HydrophobicContact CE1-CD2 3.47Å; F267-L295 VanDerWaalsContact CE1-CD2 3.47Å; F267-L295 HydrophobicContact CZ-CD2 3.79Å; F267-Y308 HydrophobicContact CD2-CD1 4.03Å; F267-Y308 AromaticContact CD2-CD2 3.75Å; F267-Y308 HydrophobicContact CD2-CD2 3.75Å; F267-Y308 AromaticContact CD2-CE1 3.98Å; F267-Y308 HydrophobicContact CD2-CE1 3.98Å; F267-Y308 AromaticContact CD2-CE2 3.69Å; F267-Y308 HydrophobicContact CD2-CE2 3.69Å; F267-Y308 AromaticContact CD2-CG 3.92Å; F267-Y308 HydrophobicContact CD2-CG 3.92Å; F267-Y308 AromaticContact CD2-CZ 3.8Å; F267-Y308 VanDerWaalsContact CD2-O 3.24Å; F267-Y308 WeakPolarHBondContact CD2-O 3.38Å; F267-Y308 AromaticContact CE2-CD1 3.81Å; F267-Y308 HydrophobicContact CE2-CD1 3.81Å; F267-Y308 HydrophobicContact CE2-CD2 4.22Å; F267-Y308 AromaticContact CE2-CE1 3.44Å; F267-Y308 HydrophobicContact CE2-CE1 3.44Å; F267-Y308 VanDerWaalsContact CE2-CE1 3.44Å; F267-Y308 AromaticContact CE2-CE2 3.88Å; F267-Y308 HydrophobicContact CE2-CE2 3.88Å; F267-Y308 HydrophobicContact CE2-CG 4.19Å; F267-Y308 AromaticContact CE2-CZ 3.46Å; F267-Y308 VanDerWaalsContact CE2-CZ 3.46Å; F267-Y308 WeakPolarHBondContact CE2-O 3.24Å; F267-Y308 HydrophobicContact CZ-CE1 4.42Å; F267-A311 HydrophobicContact CB-CB 3.64Å; F267-A311 HydrophobicContact CD2-CB 4.07Å; F267-A311 HydrophobicContact CG-CB 3.99Å; F267-G312 VanDerWaalsContact CE2-CA 3.43Å; F267-G312 VanDerWaalsContact CZ-CA 3.42Å
268	A	60.7	Low	55	Low	29 Å²	29	79.9 Å²	79.9	24%	0.24	44%	0.444	C	S	.	.	H	α-helix	trans	-61.2	-41.1	179.7	0	0	0	0	0	112.1	E264 A265 S270 A271 I272	E264-A268 VanDerWaalsContact O-CB 3.25Å; E264-A268 WeakPolarHBondContact O-CB 3.24Å; E264-A268 PolarHBondContact O-N 3.03Å; A265-A268 PolarHBondContact O-N 3.49Å; A268-S270 VanDerWaalsContact C-N 3.35Å; A268-S270 PolarHBondContact O-N 2.96Å; A268-A271 PolarHBondContact O-N 2.99Å; A268-I272 WeakPolarHBondContact O-CB 3.16Å; A268-I272 WeakPolarHBondContact O-CD1 3.34Å; A268-I272 WeakPolarHBondContact O-CG1 3.5Å; A268-I272 PolarHBondContact O-N 2.8Å
269	Q	60.9	Low	53.2	Low	136 Å²	136	81.7 Å²	81.7	64%	0.636	46%	0.457	S	S	*	.	H	α-helix	trans	-59.9	-43.9	173.2	-73.1	174.8	9	0	0	111.8	A265 N266 F267 I272 G273	A265-Q269 WeakPolarHBondContact O-CG 3.46Å; A265-Q269 PolarHBondContact O-N 3.31Å; N266-Q269 PolarHBondContact O-N 3.19Å; F267-Q269 PolarHBondContact O-N 3.24Å; Q269-I272 PolarHBondContact O-N 2.95Å; Q269-G273 PolarHBondContact O-N 2.94Å
270	S	57.6	Low	51.7	Low	61 Å²	61	83.4 Å²	83.4	43%	0.427	47%	0.467	S	S	.	.	H	α-helix	trans	-66.9	-34.8	175.6	76.6	0	0	0	0	113.1	N266 F267 A268 G273 Y308	N266-S270 PolarHBondContact O-N 3.25Å; N266-S270 VanDerWaalsContact O-N 3.1Å; F267-S270 PolarHBondContact O-N 2.85Å; F267-S270 VanDerWaalsContact O-N 3.11Å; F267-S270 PolarHBondContact O-OG 3.48Å; A268-S270 VanDerWaalsContact C-N 3.35Å; A268-S270 PolarHBondContact O-N 2.96Å; S270-G273 PolarHBondContact O-N 3.41Å; S270-Y308 WeakPolarHBondContact OG-CE2 3.47Å
271	A	48.8	Very low	50.7	Low	20 Å²	20	90.8 Å²	90.8	17%	0.165	50%	0.5	C	S	.	.	H	α-helix	trans	-69.1	-37	176.8	0	0	0	0	0	112.3	F267 A268 G273 F274 Q298	F267-A271 HydrophobicContact CE1-CB 4.32Å; F267-A271 WeakPolarHBondContact O-CB 3.04Å; F267-A271 PolarHBondContact O-N 3.37Å; A268-A271 PolarHBondContact O-N 2.99Å; A271-G273 PolarHBondContact O-N 3.41Å; A271-F274 PolarHBondContact O-N 3.07Å; A271-Q298 VanDerWaalsContact CB-OE1 3.23Å
272	I	45.3	Very low	49.3	Very low	106 Å²	106	95.3 Å²	95.3	54%	0.544	52%	0.517	S	S	.	.	H	α-helix	trans	-63	-24.8	173.9	-71.2	160.8	0	0	0	111.5	A268 Q269 F274 K275	A268-I272 WeakPolarHBondContact O-CB 3.16Å; A268-I272 WeakPolarHBondContact O-CD1 3.34Å; A268-I272 WeakPolarHBondContact O-CG1 3.5Å; A268-I272 PolarHBondContact O-N 2.8Å; Q269-I272 PolarHBondContact O-N 2.95Å; I272-F274 PolarHBondContact O-N 3.45Å; I272-F274 VanDerWaalsContact O-N 3.13Å; I272-K275 WeakPolarHBondContact O-CG 3.1Å; I272-K275 PolarHBondContact O-N 3.29Å; I272-K275 VanDerWaalsContact O-N 3.09Å
273	G	43.2	Very low	48	Very low	67 Å²	67	91.2 Å²	91.2	69%	0.691	51%	0.506	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59	-18.2	169	0	0	0	0	0	114.2	Q269 S270 A271	Q269-G273 PolarHBondContact O-N 2.94Å; S270-G273 PolarHBondContact O-N 3.41Å; A271-G273 PolarHBondContact O-N 3.41Å
274	F	40.5	Very low	47.1	Very low	119 Å²	119	96.9 Å²	96.9	52%	0.522	53%	0.534	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.1	31.7	174.1	-132.7	-98.5	0	0	0	113.3	A271 I272 F276 R301	A271-F274 PolarHBondContact O-N 3.07Å; I272-F274 PolarHBondContact O-N 3.45Å; I272-F274 VanDerWaalsContact O-N 3.13Å; F274-F276 PolarHBondContact O-N 3.25Å; F274-R301 VanDerWaalsContact CE2-NH2 3.27Å
275	K	43.2	Very low	46.8	Very low	141 Å²	141	102.4 Å²	102.4	61%	0.613	56%	0.563	S	S	*	*			trans	-48.1	121.7	166.1	-95	-177.8	175.1	-172.7	0	110.1	I272 N277	I272-K275 WeakPolarHBondContact O-CG 3.1Å; I272-K275 PolarHBondContact O-N 3.29Å; I272-K275 VanDerWaalsContact O-N 3.09Å; K275-N277 PolarHBondContact O-N 2.83Å
276	F	35	Very low	46.7	Very low	173 Å²	173	104.4 Å²	104.4	76%	0.759	57%	0.567	S	S	*	*			trans	-54.7	128.5	162.3	-77.8	-93.6	0	0	0	108.4	F274 V278	F274-F276 PolarHBondContact O-N 3.25Å; F276-V278 HydrophobicContact CB-CG2 4.39Å; F276-V278 PolarHBondContact O-N 3.15Å
277	N	34	Very low	47.2	Very low	142 Å²	142	101.7 Å²	101.7	76%	0.759	56%	0.555	S	S	*	*			trans	-76.7	67.8	-176.3	-170	9.9	0	0	0	111.4	K275	K275-N277 PolarHBondContact O-N 2.83Å
278	V	31.8	Very low	48	Very low	110 Å²	110	102.8 Å²	102.8	67%	0.667	56%	0.563	S	S	*	*			trans	-114	100.2	175.5	-178.8	0	0	0	0	107.3	F276 S280	F276-V278 HydrophobicContact CB-CG2 4.39Å; F276-V278 PolarHBondContact O-N 3.15Å; V278-S280 PolarHBondContact O-N 2.94Å
279	N	35	Very low	48.8	Very low	154 Å²	154	102.9 Å²	102.9	82%	0.824	56%	0.562	S	S	*	*			trans	-65.6	92	-176.1	-66.7	-52.1	0	0	0	111.9
280	S	34.1	Very low	49.7	Very low	78 Å²	78	101.7 Å²	101.7	55%	0.545	56%	0.556	S	S	.	*			trans	-158.5	148.1	164.7	63.6	0	0	0	0	110.3	V278 N282	V278-S280 PolarHBondContact O-N 2.94Å; S280-N282 PolarHBondContact O-N 3.35Å; S280-N282 VanDerWaalsContact O-N 3.17Å
281	E	40.3	Very low	50.7	Low	196 Å²	196	101.2 Å²	101.2	92%	0.916	55%	0.547	S	S	*	.	S	Bend	trans	-80.5	7.5	-169.1	-62.3	177.8	122.2	0	0	114.2	S283	E281-S283 VanDerWaalsContact C-N 3.27Å; E281-S283 PolarHBondContact O-N 3.13Å; E281-S283 VanDerWaalsContact O-N 3.12Å
282	N	39.8	Very low	52.4	Low	144 Å²	144	100.2 Å²	100.2	77%	0.77	54%	0.539	S	S	*	.			trans	-85.7	37.2	-176.5	-71.9	-15	0	0	0	113.9	S280 N284	S280-N282 PolarHBondContact O-N 3.35Å; S280-N282 VanDerWaalsContact O-N 3.17Å; N282-N284 PolarHBondContact O-N 3.32Å
283	S	39.6	Very low	54.1	Low	57 Å²	57	99.1 Å²	99.1	40%	0.399	53%	0.534	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.4	5.5	-166.7	65.4	0	0	0	0	117	E281	E281-S283 VanDerWaalsContact C-N 3.27Å; E281-S283 PolarHBondContact O-N 3.13Å; E281-S283 VanDerWaalsContact O-N 3.12Å
284	N	44.2	Very low	55.7	Low	144 Å²	144	97.5 Å²	97.5	77%	0.77	51%	0.512	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.3	-12.8	-169.3	-66	2.9	0	0	0	114.7	N282	N282-N284 PolarHBondContact O-N 3.32Å
285	N	56.8	Low	57.5	Low	129 Å²	129	92.2 Å²	92.2	69%	0.69	49%	0.489	S	S	*	.			trans	-119.1	60.1	-172.6	-69.2	-14.2	0	0	0	112.7
286	I	64.1	Low	59.3	Low	88 Å²	88	85.9 Å²	85.9	45%	0.451	46%	0.462	S	S	.	.			trans	-79.9	125.8	173.3	-55.6	176.5	0	0	0	109.2	Q290 Q291	I286-Q290 HydrophobicContact CG2-CB 3.73Å; I286-Q291 HydrophobicContact CB-CG 4.1Å; I286-Q291 HydrophobicContact CG2-CG 3.79Å; I286-Q291 PolarHBondContact O-NE2 3.4Å
287	P	74.4	Confident	61.4	Low	37 Å²	37	80.1 Å²	80.1	24%	0.24	45%	0.446	C	S	.	.			trans	-59.2	147.9	176.2	-25.1	34.7	0	0	0	113.6	S289 Q290 Q291 E387	P287-S289 PolarHBondContact O-N 2.84Å; P287-Q290 PolarHBondContact O-N 3.06Å; P287-Q291 WeakPolarHBondContact O-CG 3.47Å; P287-Q291 PolarHBondContact O-N 3.24Å; P287-E387 WeakPolarHBondContact CB-OE1 3.04Å
288	S	78.1	Confident	63.3	Low	28 Å²	28	73.8 Å²	73.8	20%	0.196	41%	0.412	C	S	.	.	H	α-helix	trans	-59.3	-29.8	-176.1	37.4	0	0	0	0	113.7	Q291 L292 E387	S288-Q291 PolarHBondContact O-N 3.18Å; S288-L292 VanDerWaalsContact O-CB 3.27Å; S288-L292 WeakPolarHBondContact O-CB 3.24Å; S288-L292 PolarHBondContact O-N 3.05Å; S288-E387 WeakPolarHBondContact CB-OE2 3.47Å; S288-E387 PolarHBondContact OG-OE2 3.33Å
289	S	78.6	Confident	65.5	Low	30 Å²	30	69 Å²	69	21%	0.21	38%	0.383	C	S	.	.	H	α-helix	trans	-66.8	-39.7	175.4	53.5	0	0	0	0	112.2	P287 L293 E387 I395	P287-S289 PolarHBondContact O-N 2.84Å; S289-L293 VanDerWaalsContact O-CB 3.27Å; S289-L293 WeakPolarHBondContact O-CB 3.48Å; S289-L293 PolarHBondContact O-N 3.07Å; S289-E387 WeakPolarHBondContact CA-OE2 3.37Å; S289-E387 WeakPolarHBondContact CB-OE1 3.26Å; S289-E387 VanDerWaalsContact CB-OE2 3.3Å; S289-E387 WeakPolarHBondContact CB-OE2 3.38Å; S289-E387 VanDerWaalsContact N-CD 3.35Å; S289-E387 PolarHBondContact N-OE1 3.42Å; S289-E387 PolarHBondContact N-OE2 2.99Å; S289-E387 PolarHBondContact OG-OE1 3.28Å; S289-I395 VanDerWaalsContact CB-CD1 3.48Å
290	Q	78.4	Confident	67.3	Low	111 Å²	111	64.2 Å²	64.2	52%	0.519	36%	0.364	S	S	.	.	H	α-helix	trans	-73.3	-37.6	176.2	-63.6	-174.7	1.3	0	0	111	I286 P287 S294	I286-Q290 HydrophobicContact CG2-CB 3.73Å; P287-Q290 PolarHBondContact O-N 3.06Å; Q290-S294 VanDerWaalsContact O-CB 3.32Å; Q290-S294 WeakPolarHBondContact O-CB 3.43Å; Q290-S294 PolarHBondContact O-N 2.94Å
291	Q	79.8	Confident	69	Low	51 Å²	51	65.5 Å²	65.5	24%	0.238	36%	0.357	C	S	.	.	H	α-helix	trans	-60.6	-51.1	170.7	-61.7	-177	19	0	0	110.6	I286 P287 S288 L293 S294 L295 Y315 L319	I286-Q291 HydrophobicContact CB-CG 4.1Å; I286-Q291 HydrophobicContact CG2-CG 3.79Å; I286-Q291 PolarHBondContact O-NE2 3.4Å; P287-Q291 WeakPolarHBondContact O-CG 3.47Å; P287-Q291 PolarHBondContact O-N 3.24Å; S288-Q291 PolarHBondContact O-N 3.18Å; Q291-L293 PolarHBondContact O-N 2.99Å; Q291-S294 WeakPolarHBondContact O-CB 3.2Å; Q291-S294 PolarHBondContact O-N 3.38Å; Q291-L295 WeakPolarHBondContact O-CD1 3.25Å; Q291-L295 VanDerWaalsContact O-CG 3.22Å; Q291-L295 WeakPolarHBondContact O-CG 3.4Å; Q291-L295 PolarHBondContact O-N 2.87Å; Q291-Y315 PolarHBondContact OE1-OH 3.18Å; Q291-L319 HydrophobicContact CB-CD1 3.93Å; Q291-L319 VanDerWaalsContact OE1-CD2 3.27Å
292	L	83.8	Confident	69.7	Low	0 Å²	0	65.4 Å²	65.4	0%	0	35%	0.348	C	S	.	.	H	α-helix	trans	-58.2	-46	177.4	-176.4	61.6	0	0	0	112.1	S288 S294 L295 L296 M316 L319 F320 L392 I395 F396	S288-L292 VanDerWaalsContact O-CB 3.27Å; S288-L292 WeakPolarHBondContact O-CB 3.24Å; S288-L292 PolarHBondContact O-N 3.05Å; L292-S294 VanDerWaalsContact C-N 3.33Å; L292-S294 PolarHBondContact O-N 3.16Å; L292-L295 PolarHBondContact O-N 3.27Å; L292-L296 HydrophobicContact CG-CD1 4.27Å; L292-L296 VanDerWaalsContact O-CG 3.29Å; L292-L296 WeakPolarHBondContact O-CG 3.28Å; L292-L296 PolarHBondContact O-N 2.87Å; L292-M316 HydrophobicContact CD1-CG 4.08Å; L292-M316 HydrophobicContact CD1-SD 4Å; L292-L319 HydrophobicContact CB-CD1 4.22Å; L292-F320 HydrophobicContact CD1-CE2 4.15Å; L292-F320 HydrophobicContact CD1-CZ 4.01Å; L292-F320 HydrophobicContact CD2-CE1 4.41Å; L292-F320 HydrophobicContact CD2-CZ 3.98Å; L292-L392 HydrophobicContact CD2-CB 4.12Å; L292-L392 HydrophobicContact CD2-CD2 4Å; L292-I395 HydrophobicContact CD2-CB 4.35Å; L292-I395 HydrophobicContact CD2-CG2 4.12Å; L292-F396 HydrophobicContact CD1-CD2 4.39Å
293	L	81.1	Confident	70.5	Confident	83 Å²	83	66.5 Å²	66.5	44%	0.435	35%	0.354	S	S	.	.	H	α-helix	trans	-64.5	-37.4	178.1	-173	63.2	0	0	0	112.3	S289 Q291 A297 K399	S289-L293 VanDerWaalsContact O-CB 3.27Å; S289-L293 WeakPolarHBondContact O-CB 3.48Å; S289-L293 PolarHBondContact O-N 3.07Å; Q291-L293 PolarHBondContact O-N 2.99Å; L293-A297 WeakPolarHBondContact O-CB 3.43Å; L293-A297 PolarHBondContact O-N 2.99Å; L293-K399 HydrophobicContact CD1-CD 4.38Å; L293-K399 HydrophobicContact CD1-CG 4.15Å
294	S	77.5	Confident	71.7	Confident	33 Å²	33	67.9 Å²	67.9	23%	0.231	36%	0.355	C	S	.	.	H	α-helix	trans	-64.6	-43.2	173.8	-171	0	0	0	0	111.7	Q290 Q291 L292 A297 Q298	Q290-S294 VanDerWaalsContact O-CB 3.32Å; Q290-S294 WeakPolarHBondContact O-CB 3.43Å; Q290-S294 PolarHBondContact O-N 2.94Å; Q291-S294 WeakPolarHBondContact O-CB 3.2Å; Q291-S294 PolarHBondContact O-N 3.38Å; L292-S294 VanDerWaalsContact C-N 3.33Å; L292-S294 PolarHBondContact O-N 3.16Å; S294-A297 CarbonylContact O-C 3.54Å; S294-A297 PolarHBondContact O-N 3.28Å; S294-Q298 VanDerWaalsContact O-CG 3.27Å; S294-Q298 WeakPolarHBondContact O-CG 3.19Å; S294-Q298 PolarHBondContact O-N 3.47Å; S294-Q298 PolarHBondContact OG-NE2 3.34Å
295	L	78.6	Confident	72.8	Confident	7 Å²	7	65.6 Å²	65.6	4%	0.037	34%	0.342	C	S	.	.	H	α-helix	trans	-63.1	-45	177.1	-67.4	158.6	0	0	0	111.9	F267 Q291 L292 A297 Q298 L299 Y315 M316 L319	F267-L295 HydrophobicContact CE1-CD2 3.47Å; F267-L295 VanDerWaalsContact CE1-CD2 3.47Å; F267-L295 HydrophobicContact CZ-CD2 3.79Å; Q291-L295 WeakPolarHBondContact O-CD1 3.25Å; Q291-L295 VanDerWaalsContact O-CG 3.22Å; Q291-L295 WeakPolarHBondContact O-CG 3.4Å; Q291-L295 PolarHBondContact O-N 2.87Å; L292-L295 PolarHBondContact O-N 3.27Å; L295-A297 VanDerWaalsContact C-N 3.29Å; L295-A297 PolarHBondContact O-N 2.56Å; L295-Q298 PolarHBondContact O-N 3.11Å; L295-Q298 VanDerWaalsContact O-N 3.09Å; L295-L299 WeakPolarHBondContact O-CG 3.45Å; L295-L299 PolarHBondContact O-N 3.5Å; L295-Y315 HydrophobicContact CD1-CD1 3.47Å; L295-Y315 VanDerWaalsContact CD1-CD1 3.47Å; L295-Y315 HydrophobicContact CD1-CE1 3.81Å; L295-Y315 HydrophobicContact CD2-CD1 3.82Å; L295-Y315 HydrophobicContact CD2-CE1 4.38Å; L295-Y315 HydrophobicContact CD2-CG 4.47Å; L295-Y315 HydrophobicContact CG-CD1 4.26Å; L295-M316 HydrophobicContact CB-CG 3.84Å; L295-M316 HydrophobicContact CB-SD 4.2Å; L295-M316 HydrophobicContact CD1-CG 3.71Å; L295-M316 HydrophobicContact CG-CG 4.28Å; L295-L319 HydrophobicContact CD1-CD1 3.59Å
296	L	80.5	Confident	73.5	Confident	8 Å²	8	61 Å²	61	4%	0.042	32%	0.32	C	S	.	.	H	α-helix	trans	-60.2	-40.4	174.6	-66.3	172	0	0	0	111.2	L292 Q298 A300 M316 F396 K399 L404	L292-L296 HydrophobicContact CG-CD1 4.27Å; L292-L296 VanDerWaalsContact O-CG 3.29Å; L292-L296 WeakPolarHBondContact O-CG 3.28Å; L292-L296 PolarHBondContact O-N 2.87Å; L296-Q298 VanDerWaalsContact C-N 3.29Å; L296-Q298 PolarHBondContact O-N 3.38Å; L296-A300 WeakPolarHBondContact O-CB 3.38Å; L296-A300 PolarHBondContact O-N 2.96Å; L296-M316 HydrophobicContact CD2-SD 3.99Å; L296-F396 HydrophobicContact CD1-CD2 4.39Å; L296-F396 HydrophobicContact CD2-CD2 3.86Å; L296-F396 HydrophobicContact CD2-CE2 3.65Å; L296-K399 HydrophobicContact CD1-CB 4.38Å; L296-L404 HydrophobicContact CB-CD1 4.04Å; L296-L404 HydrophobicContact CD2-CD1 4.1Å
297	A	77.9	Confident	73.8	Confident	53 Å²	53	62.8 Å²	62.8	44%	0.438	32%	0.321	S	S	.	.	H	α-helix	trans	-73.2	-14.9	176	0	0	0	0	0	114.6	L293 S294 L295 R301	L293-A297 WeakPolarHBondContact O-CB 3.43Å; L293-A297 PolarHBondContact O-N 2.99Å; S294-A297 CarbonylContact O-C 3.54Å; S294-A297 PolarHBondContact O-N 3.28Å; L295-A297 VanDerWaalsContact C-N 3.29Å; L295-A297 PolarHBondContact O-N 2.56Å; A297-R301 PolarHBondContact O-NE 2.89Å
298	Q	75	Confident	73.8	Confident	8 Å²	8	63 Å²	63	4%	0.037	32%	0.317	C	S	.	.	H	α-helix	trans	-88.3	-49.5	172.3	-72.6	168.9	39.5	0	0	110.9	A271 S294 L295 L296 A300 R301	A271-Q298 VanDerWaalsContact CB-OE1 3.23Å; S294-Q298 VanDerWaalsContact O-CG 3.27Å; S294-Q298 WeakPolarHBondContact O-CG 3.19Å; S294-Q298 PolarHBondContact O-N 3.47Å; S294-Q298 PolarHBondContact OG-NE2 3.34Å; L295-Q298 PolarHBondContact O-N 3.11Å; L295-Q298 VanDerWaalsContact O-N 3.09Å; L296-Q298 VanDerWaalsContact C-N 3.29Å; L296-Q298 PolarHBondContact O-N 3.38Å; Q298-A300 VanDerWaalsContact C-N 3.25Å; Q298-A300 PolarHBondContact O-N 3.43Å; Q298-R301 VanDerWaalsContact O-CB 3.29Å; Q298-R301 WeakPolarHBondContact O-CB 3.43Å; Q298-R301 WeakPolarHBondContact O-CG 3.3Å; Q298-R301 PolarHBondContact O-N 3.38Å
299	L	77.7	Confident	73.7	Confident	11 Å²	11	62.4 Å²	62.4	6%	0.058	31%	0.311	C	S	.	.	H	α-helix	trans	-66	-25.2	178	-66.1	171.6	0	0	0	113	L295 R301 Y309 M316	L295-L299 WeakPolarHBondContact O-CG 3.45Å; L295-L299 PolarHBondContact O-N 3.5Å; L299-R301 PolarHBondContact O-N 3.01Å; L299-Y309 HydrophobicContact CB-CE2 4.16Å; L299-Y309 HydrophobicContact CD2-CD1 4.27Å; L299-Y309 HydrophobicContact CD2-CD2 3.68Å; L299-Y309 HydrophobicContact CD2-CE1 4.45Å; L299-Y309 HydrophobicContact CD2-CE2 3.89Å; L299-Y309 HydrophobicContact CD2-CG 3.9Å; L299-M316 HydrophobicContact CD1-CE 3.36Å; L299-M316 HydrophobicContact CD1-SD 3.91Å
300	A	73.1	Confident	73.7	Confident	52 Å²	52	61.1 Å²	61.1	43%	0.43	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.2	-14	170.5	0	0	0	0	0	114.1	L296 Q298 R302 L404	L296-A300 WeakPolarHBondContact O-CB 3.38Å; L296-A300 PolarHBondContact O-N 2.96Å; Q298-A300 VanDerWaalsContact C-N 3.25Å; Q298-A300 PolarHBondContact O-N 3.43Å; A300-R302 PolarHBondContact O-N 3.05Å; A300-L404 HydrophobicContact CB-CD1 4.44Å; A300-L404 HydrophobicContact CB-CD2 3.97Å
301	R	69.4	Low	73.6	Confident	105 Å²	105	55.8 Å²	55.8	40%	0.396	28%	0.277	S	S	.	.	S	Bend	trans	-80.8	116.2	178.5	-56.9	-177.3	-167.9	-169.8	3.4	109.4	F274 A297 Q298 L299	F274-R301 VanDerWaalsContact CE2-NH2 3.27Å; A297-R301 PolarHBondContact O-NE 2.89Å; Q298-R301 VanDerWaalsContact O-CB 3.29Å; Q298-R301 WeakPolarHBondContact O-CB 3.43Å; Q298-R301 WeakPolarHBondContact O-CG 3.3Å; Q298-R301 PolarHBondContact O-N 3.38Å; L299-R301 PolarHBondContact O-N 3.01Å
302	R	55.2	Low	73.6	Confident	194 Å²	194	53.4 Å²	53.4	73%	0.732	27%	0.266	S	S	*	.	S	Bend	trans	-62.1	155.5	179.9	-58.4	179.8	-176.1	-177.5	2.3	111.2	A300	A300-R302 PolarHBondContact O-N 3.05Å
303	N	56.5	Low	73.7	Confident	167 Å²	167	53.4 Å²	53.4	89%	0.893	27%	0.266	S	S	*	.	S	Bend	trans	70.8	32.9	173.4	-50.9	7.1	0	0	0	115.6
304	Q	64	Low	73.8	Confident	87 Å²	87	50.1 Å²	50.1	41%	0.407	25%	0.248	S	C	.	.			trans	-81.2	154.2	166.3	-66.6	-62.7	-16.4	0	0	111.9	Y308	Q304-Y308 HydrophobicContact CB-CD1 3.56Å; Q304-Y308 HydrophobicContact CB-CE1 4.11Å; Q304-Y308 HydrophobicContact CB-CG 4.2Å; Q304-Y308 HydrophobicContact CG-CD1 3.62Å; Q304-Y308 HydrophobicContact CG-CE1 3.62Å; Q304-Y308 HydrophobicContact CG-CG 4.43Å
305	N	69	Low	73.9	Confident	96 Å²	96	51.8 Å²	51.8	51%	0.513	25%	0.25	S	C	.	.			trans	-69.1	148.2	177	-177.3	-71.9	0	0	0	111.4	R307 Y308 Y309	N305-R307 VanDerWaalsContact C-N 3.26Å; N305-R307 PolarHBondContact O-N 3.37Å; N305-R307 WeakPolarHBondContact OD1-CB 3.18Å; N305-R307 PolarHBondContact OD1-N 2.89Å; N305-Y308 WeakPolarHBondContact O-CA 3.29Å; N305-Y308 VanDerWaalsContact O-CB 3.31Å; N305-Y308 WeakPolarHBondContact O-CB 3.33Å; N305-Y308 PolarHBondContact O-N 2.89Å; N305-Y309 PolarHBondContact O-N 3.4Å
306	S	70.6	Confident	74.2	Confident	31 Å²	31	51.5 Å²	51.5	22%	0.217	25%	0.248	C	C	.	.	H	α-helix	trans	-48.8	-44.5	175.9	46.7	0	0	0	0	113.2	Y308 Y309 S310 R468	S306-Y308 PolarHBondContact O-N 2.73Å; S306-Y309 PolarHBondContact O-N 3.08Å; S306-S310 WeakPolarHBondContact O-CB 3.45Å; S306-S310 PolarHBondContact O-N 2.92Å; S306-R468 VanDerWaalsContact CB-NH1 3.26Å; S306-R468 WeakPolarHBondContact O-CD 3.48Å
307	R	71.4	Confident	74.4	Confident	126 Å²	126	52.5 Å²	52.5	48%	0.475	25%	0.253	S	S	.	.	H	α-helix	trans	-65.6	-36.6	177.9	-62.8	-178.2	177	177.3	-1.9	112.6	N305 A311 D464	N305-R307 VanDerWaalsContact C-N 3.26Å; N305-R307 PolarHBondContact O-N 3.37Å; N305-R307 WeakPolarHBondContact OD1-CB 3.18Å; N305-R307 PolarHBondContact OD1-N 2.89Å; R307-A311 WeakPolarHBondContact O-CB 3.39Å; R307-A311 PolarHBondContact O-N 3.26Å; R307-D464 IonicContact CZ-OD1 3.15Å; R307-D464 IonicContact CZ-OD2 3.33Å; R307-D464 IonicContact NE-OD1 3.77Å; R307-D464 IonicContact NE-OD2 3.25Å; R307-D464 PolarHBondContact NE-OD2 3.46Å; R307-D464 IonicContact NH2-OD1 3.39Å; R307-D464 IonicContact NH2-OD2 2.75Å; R307-D464 PolarHBondContact NH2-OD2 3.42Å
308	Y	73	Confident	74.6	Confident	42 Å²	42	55.2 Å²	55.2	17%	0.165	25%	0.252	C	S	.	.	H	α-helix	trans	-65.6	-48.7	176.2	179.4	-82.5	0	0	0	111	F267 S270 Q304 N305 S306 S310 A311 G312	F267-Y308 HydrophobicContact CD2-CD1 4.03Å; F267-Y308 AromaticContact CD2-CD2 3.75Å; F267-Y308 HydrophobicContact CD2-CD2 3.75Å; F267-Y308 AromaticContact CD2-CE1 3.98Å; F267-Y308 HydrophobicContact CD2-CE1 3.98Å; F267-Y308 AromaticContact CD2-CE2 3.69Å; F267-Y308 HydrophobicContact CD2-CE2 3.69Å; F267-Y308 AromaticContact CD2-CG 3.92Å; F267-Y308 HydrophobicContact CD2-CG 3.92Å; F267-Y308 AromaticContact CD2-CZ 3.8Å; F267-Y308 VanDerWaalsContact CD2-O 3.24Å; F267-Y308 WeakPolarHBondContact CD2-O 3.38Å; F267-Y308 AromaticContact CE2-CD1 3.81Å; F267-Y308 HydrophobicContact CE2-CD1 3.81Å; F267-Y308 HydrophobicContact CE2-CD2 4.22Å; F267-Y308 AromaticContact CE2-CE1 3.44Å; F267-Y308 HydrophobicContact CE2-CE1 3.44Å; F267-Y308 VanDerWaalsContact CE2-CE1 3.44Å; F267-Y308 AromaticContact CE2-CE2 3.88Å; F267-Y308 HydrophobicContact CE2-CE2 3.88Å; F267-Y308 HydrophobicContact CE2-CG 4.19Å; F267-Y308 AromaticContact CE2-CZ 3.46Å; F267-Y308 VanDerWaalsContact CE2-CZ 3.46Å; F267-Y308 WeakPolarHBondContact CE2-O 3.24Å; F267-Y308 HydrophobicContact CZ-CE1 4.42Å; S270-Y308 WeakPolarHBondContact OG-CE2 3.47Å; Q304-Y308 HydrophobicContact CB-CD1 3.56Å; Q304-Y308 HydrophobicContact CB-CE1 4.11Å; Q304-Y308 HydrophobicContact CB-CG 4.2Å; Q304-Y308 HydrophobicContact CG-CD1 3.62Å; Q304-Y308 HydrophobicContact CG-CE1 3.62Å; Q304-Y308 HydrophobicContact CG-CG 4.43Å; N305-Y308 WeakPolarHBondContact O-CA 3.29Å; N305-Y308 VanDerWaalsContact O-CB 3.31Å; N305-Y308 WeakPolarHBondContact O-CB 3.33Å; N305-Y308 PolarHBondContact O-N 2.89Å; S306-Y308 PolarHBondContact O-N 2.73Å; Y308-S310 VanDerWaalsContact C-N 3.35Å; Y308-S310 PolarHBondContact O-N 2.78Å; Y308-A311 PolarHBondContact O-N 3.08Å; Y308-G312 PolarHBondContact O-N 3.04Å
309	Y	77.1	Confident	74.9	Confident	16 Å²	16	55.7 Å²	55.7	6%	0.063	26%	0.255	C	S	.	.	H	α-helix	trans	-63.9	-42.8	179.3	-160.3	-73.8	0	0	0	110.9	L299 N305 S306 A311 G312 L313 L404 L405 E408	L299-Y309 HydrophobicContact CB-CE2 4.16Å; L299-Y309 HydrophobicContact CD2-CD1 4.27Å; L299-Y309 HydrophobicContact CD2-CD2 3.68Å; L299-Y309 HydrophobicContact CD2-CE1 4.45Å; L299-Y309 HydrophobicContact CD2-CE2 3.89Å; L299-Y309 HydrophobicContact CD2-CG 3.9Å; N305-Y309 PolarHBondContact O-N 3.4Å; S306-Y309 PolarHBondContact O-N 3.08Å; Y309-A311 PolarHBondContact O-N 3.36Å; Y309-G312 PolarHBondContact O-N 3.12Å; Y309-L313 HydrophobicContact CD1-CD1 3.65Å; Y309-L313 HydrophobicContact CD1-CD2 4.28Å; Y309-L313 HydrophobicContact CD1-CG 3.71Å; Y309-L313 HydrophobicContact CE1-CD1 3.74Å; Y309-L313 HydrophobicContact CE1-CD2 3.74Å; Y309-L313 HydrophobicContact CE1-CG 3.69Å; Y309-L313 WeakPolarHBondContact O-CG 3.42Å; Y309-L313 PolarHBondContact O-N 3.32Å; Y309-L404 PolarHBondContact OH-O 3.19Å; Y309-L405 WeakPolarHBondContact OH-CD2 3.1Å; Y309-E408 HydrophobicContact CD1-CB 4.47Å; Y309-E408 HydrophobicContact CD1-CG 3.73Å; Y309-E408 WeakPolarHBondContact CD2-OE2 3.47Å; Y309-E408 HydrophobicContact CE1-CB 3.82Å; Y309-E408 HydrophobicContact CE1-CG 3.49Å; Y309-E408 VanDerWaalsContact CE1-CG 3.49Å; Y309-E408 HydrophobicContact CE2-CB 4.24Å; Y309-E408 HydrophobicContact CE2-CG 4.41Å; Y309-E408 HydrophobicContact CG-CG 4.29Å
310	S	78.5	Confident	75.3	Confident	2 Å²	2	55.2 Å²	55.2	1%	0.014	25%	0.252	C	S	.	.	H	α-helix	trans	-59	-44.5	174.9	-164.5	0	0	0	0	112.8	S306 Y308 L313 R314 R468	S306-S310 WeakPolarHBondContact O-CB 3.45Å; S306-S310 PolarHBondContact O-N 2.92Å; Y308-S310 VanDerWaalsContact C-N 3.35Å; Y308-S310 PolarHBondContact O-N 2.78Å; S310-L313 PolarHBondContact O-N 2.76Å; S310-R314 WeakPolarHBondContact O-CG 3.44Å; S310-R314 PolarHBondContact O-N 3.36Å; S310-R314 PolarHBondContact OG-NH1 2.99Å; S310-R468 WeakPolarHBondContact OG-CA 3.48Å
311	A	76.5	Confident	75.6	Confident	0 Å²	0	56.8 Å²	56.8	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-61.9	-42.4	174.3	0	0	0	0	0	113	A263 F267 R307 Y308 Y309 L313 R314 Y315	A263-A311 HydrophobicContact CB-CB 4.11Å; A263-A311 WeakPolarHBondContact O-CB 3.2Å; F267-A311 HydrophobicContact CB-CB 3.64Å; F267-A311 HydrophobicContact CD2-CB 4.07Å; F267-A311 HydrophobicContact CG-CB 3.99Å; R307-A311 WeakPolarHBondContact O-CB 3.39Å; R307-A311 PolarHBondContact O-N 3.26Å; Y308-A311 PolarHBondContact O-N 3.08Å; Y309-A311 PolarHBondContact O-N 3.36Å; A311-L313 PolarHBondContact O-N 2.94Å; A311-R314 PolarHBondContact O-N 3.4Å; A311-Y315 WeakPolarHBondContact O-CB 3.19Å; A311-Y315 PolarHBondContact O-N 3.36Å
312	G	80.2	Confident	76.1	Confident	0 Å²	0	57.7 Å²	57.7	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-64.1	-37.6	175.9	0	0	0	0	0	113.4	F267 Y308 Y309 Y315 M316	F267-G312 VanDerWaalsContact CE2-CA 3.43Å; F267-G312 VanDerWaalsContact CZ-CA 3.42Å; Y308-G312 PolarHBondContact O-N 3.04Å; Y309-G312 PolarHBondContact O-N 3.12Å; G312-Y315 PolarHBondContact O-N 3.09Å; G312-M316 WeakPolarHBondContact O-CG 3.44Å; G312-M316 PolarHBondContact O-N 3.26Å
313	L	85.9	Confident	77.2	Confident	0 Å²	0	48.9 Å²	48.9	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-62.5	-49.9	171.8	-69.4	173.9	0	0	0	111.8	Y309 S310 A311 Y315 M316 N317 L405 R468 A471 L472 L475	Y309-L313 HydrophobicContact CD1-CD1 3.65Å; Y309-L313 HydrophobicContact CD1-CD2 4.28Å; Y309-L313 HydrophobicContact CD1-CG 3.71Å; Y309-L313 HydrophobicContact CE1-CD1 3.74Å; Y309-L313 HydrophobicContact CE1-CD2 3.74Å; Y309-L313 HydrophobicContact CE1-CG 3.69Å; Y309-L313 WeakPolarHBondContact O-CG 3.42Å; Y309-L313 PolarHBondContact O-N 3.32Å; S310-L313 PolarHBondContact O-N 2.76Å; A311-L313 PolarHBondContact O-N 2.94Å; L313-Y315 VanDerWaalsContact C-N 3.3Å; L313-Y315 PolarHBondContact O-N 2.98Å; L313-M316 HydrophobicContact CD2-CE 3.85Å; L313-M316 PolarHBondContact O-N 3.2Å; L313-N317 VanDerWaalsContact O-CB 3.25Å; L313-N317 WeakPolarHBondContact O-CB 3.4Å; L313-N317 PolarHBondContact O-N 3.44Å; L313-L405 HydrophobicContact CD2-CD2 4.11Å; L313-R468 HydrophobicContact CD1-CG 3.98Å; L313-A471 HydrophobicContact CB-CB 3.9Å; L313-A471 HydrophobicContact CD1-CB 4.21Å; L313-L472 HydrophobicContact CD1-CD2 3.6Å; L313-L472 HydrophobicContact CD1-CG 3.62Å; L313-L472 HydrophobicContact CD2-CD2 3.77Å; L313-L472 HydrophobicContact CG-CD2 4.35Å; L313-L475 HydrophobicContact CB-CD2 4.25Å; L313-L475 HydrophobicContact CD2-CD2 3.45Å; L313-L475 VanDerWaalsContact CD2-CD2 3.45Å; L313-L475 HydrophobicContact CG-CD2 4.44Å
314	R	82.5	Confident	78.3	Confident	15 Å²	15	43.8 Å²	43.8	6%	0.057	21%	0.209	C	C	.	.	H	α-helix	trans	-57.4	-41.8	176.7	-67.8	171	175.4	118.6	-11.9	111.8	D260 E264 S310 A311 N317 R318 E467 A471	D260-R314 VanDerWaalsContact CG-CZ 3.41Å; D260-R314 VanDerWaalsContact CG-NH2 3.27Å; D260-R314 IonicContact OD1-CZ 3.37Å; D260-R314 IonicContact OD1-NE 2.7Å; D260-R314 PolarHBondContact OD1-NE 2.91Å; D260-R314 IonicContact OD1-NH2 3.37Å; D260-R314 PolarHBondContact OD1-NH2 3.05Å; D260-R314 WeakPolarHBondContact OD2-CD 3.39Å; D260-R314 IonicContact OD2-CZ 3.79Å; D260-R314 IonicContact OD2-NE 3.6Å; D260-R314 PolarHBondContact OD2-NE 3.38Å; D260-R314 IonicContact OD2-NH2 2.9Å; D260-R314 PolarHBondContact OD2-NH2 3.45Å; E264-R314 HydrophobicContact CG-CB 4.23Å; E264-R314 VanDerWaalsContact OE1-CB 3.26Å; E264-R314 WeakPolarHBondContact OE1-CB 3.42Å; S310-R314 WeakPolarHBondContact O-CG 3.44Å; S310-R314 PolarHBondContact O-N 3.36Å; S310-R314 PolarHBondContact OG-NH1 2.99Å; A311-R314 PolarHBondContact O-N 3.4Å; R314-N317 WeakPolarHBondContact O-CB 3.49Å; R314-N317 PolarHBondContact O-N 2.85Å; R314-R318 PolarHBondContact O-N 3.29Å; R314-E467 IonicContact CZ-OE2 3.11Å; R314-E467 IonicContact NH2-OE2 2.72Å; R314-E467 PolarHBondContact NH2-OE2 3.36Å; R314-A471 HydrophobicContact CG-CB 3.95Å
315	Y	79.8	Confident	78.6	Confident	68 Å²	68	45 Å²	45	27%	0.267	21%	0.213	S	C	.	.	H	α-helix	trans	-67.2	-45.8	177.8	-168	-79.1	0	0	0	112.5	Q291 L295 A311 G312 L313 N317 R318 L319	Q291-Y315 PolarHBondContact OE1-OH 3.18Å; L295-Y315 HydrophobicContact CD1-CD1 3.47Å; L295-Y315 VanDerWaalsContact CD1-CD1 3.47Å; L295-Y315 HydrophobicContact CD1-CE1 3.81Å; L295-Y315 HydrophobicContact CD2-CD1 3.82Å; L295-Y315 HydrophobicContact CD2-CE1 4.38Å; L295-Y315 HydrophobicContact CD2-CG 4.47Å; L295-Y315 HydrophobicContact CG-CD1 4.26Å; A311-Y315 WeakPolarHBondContact O-CB 3.19Å; A311-Y315 PolarHBondContact O-N 3.36Å; G312-Y315 PolarHBondContact O-N 3.09Å; L313-Y315 VanDerWaalsContact C-N 3.3Å; L313-Y315 PolarHBondContact O-N 2.98Å; Y315-N317 VanDerWaalsContact C-N 3.28Å; Y315-N317 PolarHBondContact O-N 3.1Å; Y315-R318 PolarHBondContact O-N 2.8Å; Y315-R318 VanDerWaalsContact O-N 3.13Å; Y315-L319 HydrophobicContact CD1-CG 4.43Å; Y315-L319 HydrophobicContact CE1-CD1 4.35Å; Y315-L319 HydrophobicContact CE1-CD2 4.09Å; Y315-L319 HydrophobicContact CE1-CG 4.29Å; Y315-L319 PolarHBondContact O-N 2.9Å
316	M	84.5	Confident	78.1	Confident	0 Å²	0	44.9 Å²	44.9	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-57.4	-43.6	171.9	-75.6	-167	-55.6	0	0	111.4	L292 L295 L296 L299 G312 L313 R318 L319 F320 F396 L475	L292-M316 HydrophobicContact CD1-CG 4.08Å; L292-M316 HydrophobicContact CD1-SD 4Å; L295-M316 HydrophobicContact CB-CG 3.84Å; L295-M316 HydrophobicContact CB-SD 4.2Å; L295-M316 HydrophobicContact CD1-CG 3.71Å; L295-M316 HydrophobicContact CG-CG 4.28Å; L296-M316 HydrophobicContact CD2-SD 3.99Å; L299-M316 HydrophobicContact CD1-CE 3.36Å; L299-M316 HydrophobicContact CD1-SD 3.91Å; G312-M316 WeakPolarHBondContact O-CG 3.44Å; G312-M316 PolarHBondContact O-N 3.26Å; L313-M316 HydrophobicContact CD2-CE 3.85Å; L313-M316 PolarHBondContact O-N 3.2Å; M316-R318 VanDerWaalsContact C-N 3.3Å; M316-R318 PolarHBondContact O-N 3.18Å; M316-L319 WeakPolarHBondContact O-CB 3.24Å; M316-L319 PolarHBondContact O-N 3.15Å; M316-L319 VanDerWaalsContact O-N 3.08Å; M316-F320 HydrophobicContact CB-CE2 4.42Å; M316-F320 WeakPolarHBondContact O-CD2 3.31Å; M316-F320 PolarHBondContact O-N 3.42Å; M316-F396 HydrophobicContact SD-CE2 4.3Å; M316-L475 HydrophobicContact CB-CD1 4.11Å; M316-L475 HydrophobicContact CE-CD2 4.05Å
317	N	85.5	Confident	76.7	Confident	30 Å²	30	52.4 Å²	52.4	16%	0.16	25%	0.245	C	C	.	.	H	α-helix	trans	-51.2	-47.4	173.8	142.2	7.3	0	0	0	111.3	L313 R314 Y315 L319 F320 M321 L475 H478	L313-N317 VanDerWaalsContact O-CB 3.25Å; L313-N317 WeakPolarHBondContact O-CB 3.4Å; L313-N317 PolarHBondContact O-N 3.44Å; R314-N317 WeakPolarHBondContact O-CB 3.49Å; R314-N317 PolarHBondContact O-N 2.85Å; Y315-N317 VanDerWaalsContact C-N 3.28Å; Y315-N317 PolarHBondContact O-N 3.1Å; N317-L319 VanDerWaalsContact C-N 3.32Å; N317-L319 PolarHBondContact O-N 3.41Å; N317-F320 PolarHBondContact O-N 3.1Å; N317-F320 VanDerWaalsContact O-N 3.17Å; N317-M321 PolarHBondContact O-N 3.16Å; N317-L475 HydrophobicContact CB-CB 4.12Å; N317-L475 HydrophobicContact CB-CD1 4.33Å; N317-H478 WeakPolarHBondContact CB-ND1 3.35Å; N317-H478 PolarHBondContact ND2-CE1 3.26Å; N317-H478 PolarHBondContact OD1-CE1 2.75Å; N317-H478 PolarHBondContact OD1-ND1 3.4Å; N317-H478 VanDerWaalsContact OD1-ND1 3.13Å
318	R	80.9	Confident	74.8	Confident	109 Å²	109	52.2 Å²	52.2	41%	0.411	26%	0.26	S	S	.	.	H	α-helix	trans	-63.4	-34.2	178	-170	172.7	-64.5	135.8	11	113.2	E264 R314 Y315 M316 M321 N322	E264-R318 IonicContact OE1-CZ 3.58Å; E264-R318 IonicContact OE1-NH1 3.7Å; E264-R318 IonicContact OE1-NH2 2.72Å; E264-R318 PolarHBondContact OE1-NH2 2.93Å; E264-R318 IonicContact OE2-CZ 3.16Å; E264-R318 IonicContact OE2-NH1 2.68Å; E264-R318 PolarHBondContact OE2-NH1 3.4Å; E264-R318 IonicContact OE2-NH2 2.7Å; E264-R318 PolarHBondContact OE2-NH2 3.48Å; R314-R318 PolarHBondContact O-N 3.29Å; Y315-R318 PolarHBondContact O-N 2.8Å; Y315-R318 VanDerWaalsContact O-N 3.13Å; M316-R318 VanDerWaalsContact C-N 3.3Å; M316-R318 PolarHBondContact O-N 3.18Å; R318-M321 PolarHBondContact O-N 3.35Å; R318-N322 WeakPolarHBondContact O-CB 3.47Å; R318-N322 VanDerWaalsContact O-CG 3.28Å; R318-N322 PolarHBondContact O-N 3.24Å
319	L	81.7	Confident	72.7	Confident	18 Å²	18	56.4 Å²	56.4	9%	0.094	29%	0.29	C	S	.	.	H	α-helix	trans	-62.3	-44.7	173.2	-57.3	-176	0	0	0	111.5	Q291 L292 L295 Y315 M316 N317 N322 A323 L392	Q291-L319 HydrophobicContact CB-CD1 3.93Å; Q291-L319 VanDerWaalsContact OE1-CD2 3.27Å; L292-L319 HydrophobicContact CB-CD1 4.22Å; L295-L319 HydrophobicContact CD1-CD1 3.59Å; Y315-L319 HydrophobicContact CD1-CG 4.43Å; Y315-L319 HydrophobicContact CE1-CD1 4.35Å; Y315-L319 HydrophobicContact CE1-CD2 4.09Å; Y315-L319 HydrophobicContact CE1-CG 4.29Å; Y315-L319 PolarHBondContact O-N 2.9Å; M316-L319 WeakPolarHBondContact O-CB 3.24Å; M316-L319 PolarHBondContact O-N 3.15Å; M316-L319 VanDerWaalsContact O-N 3.08Å; N317-L319 VanDerWaalsContact C-N 3.32Å; N317-L319 PolarHBondContact O-N 3.41Å; L319-N322 PolarHBondContact O-N 3.02Å; L319-A323 PolarHBondContact O-N 2.96Å; L319-L392 HydrophobicContact CB-CD1 4.41Å
320	F	85.7	Confident	70.3	Confident	1 Å²	1	61.5 Å²	61.5	0%	0.004	32%	0.323	C	S	.	.	H	α-helix	trans	-68.1	-34.8	176.7	-66	-70.2	0	0	0	113.1	L292 M316 N317 L389 L392 Q393 F396 L475 H478 L479	L292-F320 HydrophobicContact CD1-CE2 4.15Å; L292-F320 HydrophobicContact CD1-CZ 4.01Å; L292-F320 HydrophobicContact CD2-CE1 4.41Å; L292-F320 HydrophobicContact CD2-CZ 3.98Å; M316-F320 HydrophobicContact CB-CE2 4.42Å; M316-F320 WeakPolarHBondContact O-CD2 3.31Å; M316-F320 PolarHBondContact O-N 3.42Å; N317-F320 PolarHBondContact O-N 3.1Å; N317-F320 VanDerWaalsContact O-N 3.17Å; F320-L389 HydrophobicContact CB-CD1 4.13Å; F320-L389 HydrophobicContact CD1-CD1 3.89Å; F320-L389 HydrophobicContact CG-CD1 4.5Å; F320-L392 HydrophobicContact CD1-CB 3.86Å; F320-L392 HydrophobicContact CD1-CD1 4.36Å; F320-L392 HydrophobicContact CE1-CB 3.51Å; F320-L392 HydrophobicContact CZ-CB 4.44Å; F320-Q393 HydrophobicContact CE1-CG 4.46Å; F320-F396 HydrophobicContact CZ-CB 4.27Å; F320-F396 HydrophobicContact CZ-CD2 4.11Å; F320-F396 HydrophobicContact CZ-CG 4.42Å; F320-L475 HydrophobicContact CD2-CD1 3.65Å; F320-L475 HydrophobicContact CE2-CD1 3.72Å; F320-H478 HydrophobicContact CB-CB 4.2Å; F320-L479 HydrophobicContact CD1-CD2 4.48Å; F320-L479 HydrophobicContact CE1-CD2 3.7Å; F320-L479 HydrophobicContact CE2-CD2 3.84Å; F320-L479 HydrophobicContact CE2-CG 4.29Å; F320-L479 HydrophobicContact CZ-CD2 3.36Å; F320-L479 HydrophobicContact CZ-CG 4.27Å
321	M	79.7	Confident	67.9	Low	86 Å²	86	69.2 Å²	69.2	42%	0.424	36%	0.363	S	S	.	.	H	α-helix	trans	-67.8	-38.1	175.8	-79.6	-68.4	102.5	0	0	113	N317 R318 N474 H478	N317-M321 PolarHBondContact O-N 3.16Å; R318-M321 PolarHBondContact O-N 3.35Å; M321-N474 WeakPolarHBondContact CE-O 3.29Å; M321-H478 HydrophobicContact CE-CB 4.45Å
322	N	79.3	Confident	65.5	Low	124 Å²	124	74.6 Å²	74.6	66%	0.663	40%	0.395	S	S	*	.	H	α-helix	trans	-80.8	-16	-178.4	-70.1	-4.9	0	0	0	113.6	R318 L319	R318-N322 WeakPolarHBondContact O-CB 3.47Å; R318-N322 VanDerWaalsContact O-CG 3.28Å; R318-N322 PolarHBondContact O-N 3.24Å; L319-N322 PolarHBondContact O-N 3.02Å
323	A	79.2	Confident	63	Low	9 Å²	9	83 Å²	83	7%	0.074	43%	0.434	C	S	.	.	S	Bend	trans	-74	131.2	-177.4	0	0	0	0	0	112.2	L319 K325 L389 L392	L319-A323 PolarHBondContact O-N 2.96Å; A323-K325 PolarHBondContact O-N 3.06Å; A323-L389 HydrophobicContact CB-CB 4.33Å; A323-L392 HydrophobicContact CB-CD1 3.72Å
324	P	79.4	Confident	60.2	Low	59 Å²	59	91.4 Å²	91.4	38%	0.383	48%	0.479	S	S	.	.	P	Polyproline II helix	trans	-60.9	131.2	179.2	23.6	-34	0	0	0	111.8	E387 T388 L389	P324-E387 WeakPolarHBondContact CD-O 3.2Å; P324-T388 WeakPolarHBondContact O-CA 3.41Å; P324-L389 PolarHBondContact O-N 3.43Å
325	K	70.3	Confident	57.5	Low	113 Å²	113	97.4 Å²	97.4	49%	0.491	51%	0.512	S	S	.	.	P	Polyproline II helix	trans	-82.6	119.4	174.1	-54.3	-170.8	-176.7	-176.4	0	108.3	A323 K327 L389	A323-K325 PolarHBondContact O-N 3.06Å; K325-K327 PolarHBondContact O-N 3.12Å; K325-L389 HydrophobicContact CD-CD2 4.04Å; K325-L389 HydrophobicContact CG-CB 4.4Å; K325-L389 HydrophobicContact CG-CD2 3.85Å
326	T	59.2	Low	55	Low	93 Å²	93	101.3 Å²	101.3	57%	0.571	54%	0.538	S	S	*	.	P	Polyproline II helix	trans	-56.5	131.1	177	46.1	0	0	0	0	110.6	T388	T326-T388 HydrophobicContact CG2-CG2 3.75Å
327	K	39.9	Very low	52.2	Low	189 Å²	189	107.7 Å²	107.7	82%	0.822	58%	0.576	S	S	*	*	P	Polyproline II helix	trans	-63.8	138.9	169.9	-73.9	-179.3	179.1	173.2	0	108.9	K325 T329	K325-K327 PolarHBondContact O-N 3.12Å; K327-T329 PolarHBondContact O-N 3.07Å
328	P	32	Very low	49.3	Very low	123 Å²	123	112.2 Å²	112.2	80%	0.799	61%	0.605	S	S	*	*			trans	-68.3	104.4	175.3	27.9	-33.2	0	0	0	109.4	T330	P328-T330 PolarHBondContact O-N 2.9Å
329	T	29.7	Very low	46.8	Very low	129 Å²	129	115.5 Å²	115.5	79%	0.791	63%	0.625	S	S	*	*			trans	-59.4	125.4	172.2	-38.4	0	0	0	0	108.7	K327 I331	K327-T329 PolarHBondContact O-N 3.07Å; T329-I331 PolarHBondContact O-N 3.29Å; T329-I331 VanDerWaalsContact O-N 3.11Å
330	T	26.6	Very low	44.1	Very low	124 Å²	124	121.7 Å²	121.7	76%	0.761	66%	0.658	S	S	*	*			trans	-69.4	110.8	-176.8	-34.6	0	0	0	0	109.1	P328 T332	P328-T330 PolarHBondContact O-N 2.9Å; T330-T332 PolarHBondContact O-N 3.43Å
331	I	28.1	Very low	41.1	Very low	164 Å²	164	126.5 Å²	126.5	84%	0.841	69%	0.692	S	S	*	*			trans	-76.7	89.7	-177.1	-54.5	177.7	0	0	0	109.2	T329	T329-I331 PolarHBondContact O-N 3.29Å; T329-I331 VanDerWaalsContact O-N 3.11Å
332	T	26.4	Very low	38.6	Very low	112 Å²	112	132.4 Å²	132.4	69%	0.687	72%	0.715	S	S	*	*			trans	-101.5	118.4	160.4	44.5	0	0	0	0	109.4	T330	T330-T332 PolarHBondContact O-N 3.43Å
333	E	27.4	Very low	35.9	Very low	176 Å²	176	134.6 Å²	134.6	82%	0.822	73%	0.725	S	S	*	*			trans	60.7	76.9	152.3	-59.3	179.2	173	0	0	117.6
334	L	27.3	Very low	33.5	Very low	177 Å²	177	137.4 Å²	137.4	93%	0.927	76%	0.755	S	S	*	*			trans	-124.4	69.1	147.2	-76.7	178.7	0	0	0	110
335	N	25.3	Very low	31.4	Very low	142 Å²	142	140.1 Å²	140.1	76%	0.759	77%	0.773	S	S	*	*			trans	-84.4	154.5	162.3	-80.7	-23.2	0	0	0	109.8
336	N	26.5	Very low	29.1	Very low	150 Å²	150	140 Å²	140	80%	0.802	79%	0.786	S	S	*	*			trans	68	73.6	162.3	-54.2	-13.4	0	0	0	118.2
337	T	25.5	Very low	27.5	Very low	133 Å²	133	145.1 Å²	145.1	82%	0.816	80%	0.803	S	S	*	*			trans	-135.2	93.8	132.7	52.9	0	0	0	0	110
338	V	25.1	Very low	26.8	Very low	126 Å²	126	141.5 Å²	141.5	76%	0.764	80%	0.802	S	S	*	*			trans	-81.2	117.2	162.2	176.1	0	0	0	0	107
339	H	27.6	Very low	26.4	Very low	178 Å²	178	144 Å²	144	82%	0.824	81%	0.808	S	S	*	*			trans	-140.5	133.8	164.9	-93.1	-57	0	0	0	110.2
340	D	25.8	Very low	26	Very low	147 Å²	147	144.6 Å²	144.6	79%	0.786	81%	0.806	S	S	*	*			trans	-72.4	159.1	-166.1	-73.2	-68	0	0	0	115.1
341	S	22.8	Very low	25.7	Very low	103 Å²	103	144.2 Å²	144.2	72%	0.72	81%	0.808	S	S	*	*			trans	-62.2	133.9	175.5	48.7	0	0	0	0	112.8
342	K	27.3	Very low	25.3	Very low	209 Å²	209	143 Å²	143	91%	0.909	80%	0.802	S	S	*	*			trans	-129.3	129.4	147.3	-76.3	-166.2	174.9	-178.9	0	109.9
343	I	23.3	Very low	25.1	Very low	170 Å²	170	142.8 Å²	142.8	87%	0.872	81%	0.806	S	S	*	*			trans	-92.7	132.1	-179.2	-64.3	166.5	0	0	0	108
344	G	28.1	Very low	25	Very low	69 Å²	69	143.1 Å²	143.1	71%	0.711	81%	0.808	S	S	*	*			trans	-149.1	126.8	173.1	0	0	0	0	0	109.1
345	P	34.8	Very low	24.6	Very low	116 Å²	116	140.6 Å²	140.6	75%	0.753	80%	0.799	S	S	*	*			trans	-98.4	155.2	-167.1	37.5	-36	0	0	0	114.6
346	S	22.3	Very low	24.6	Very low	111 Å²	111	143.9 Å²	143.9	78%	0.776	81%	0.807	S	S	*	*			trans	45.7	111.2	147.1	61.6	0	0	0	0	119.9
347	E	26.1	Very low	24.3	Very low	199 Å²	199	146 Å²	146	93%	0.93	81%	0.809	S	S	*	*			trans	-141.8	144.9	145.7	-129.9	169.5	-137.3	0	0	110.5
348	S	24	Very low	24.3	Very low	114 Å²	114	145.2 Å²	145.2	80%	0.797	81%	0.809	S	S	*	*			trans	-101.2	111.4	-166	44.4	0	0	0	0	112.8	N350	S348-N350 PolarHBondContact O-N 3.16Å
349	L	25.4	Very low	24.1	Very low	174 Å²	174	146.9 Å²	146.9	91%	0.911	81%	0.814	S	S	*	*			trans	-73.5	108.6	177.7	-70.3	172.5	0	0	0	111.7
350	N	20.8	Very low	24.1	Very low	142 Å²	142	148.3 Å²	148.3	76%	0.759	82%	0.818	S	S	*	*			trans	-104.2	103.1	177	-174.9	15.7	0	0	0	109.9	S348	S348-N350 PolarHBondContact O-N 3.16Å
351	C	19.4	Very low	23.8	Very low	117 Å²	117	151.4 Å²	151.4	79%	0.791	82%	0.824	S	S	*	*			trans	-95.4	118	-175.6	-67.9	0	0	0	0	112
352	N	20.5	Very low	24	Very low	137 Å²	137	152.1 Å²	152.1	73%	0.733	83%	0.829	S	S	*	*			trans	-144.9	157.1	174.7	-108.8	-36.3	0	0	0	110.3
353	S	22.2	Very low	23.7	Very low	109 Å²	109	152.2 Å²	152.2	76%	0.762	83%	0.829	S	S	*	*			trans	67.5	151.5	-177.8	84.4	0	0	0	0	114.9
354	E	24.1	Very low	23.6	Very low	183 Å²	183	148 Å²	148	86%	0.855	83%	0.828	S	S	*	*			cis	-149.6	157.9	-2.8	-144.1	168.7	-127.5	0	0	112.7
355	T	20.5	Very low	23.5	Very low	123 Å²	123	149.2 Å²	149.2	76%	0.755	83%	0.831	S	S	*	*			trans	-88.6	133.1	-176	59.1	0	0	0	0	113.2
356	K	24.6	Very low	22.8	Very low	211 Å²	211	152.5 Å²	152.5	92%	0.917	84%	0.836	S	S	*	*			trans	-113.5	112.5	165.2	-78.3	-176.5	176	175.1	0	111.8
357	K	19.7	Very low	23	Very low	194 Å²	194	156.1 Å²	156.1	84%	0.843	84%	0.84	S	S	*	*			trans	-86.8	137.4	168.7	-67.9	173.7	178.7	170.9	0	109.6
358	S	25.5	Very low	22.9	Very low	118 Å²	118	153.5 Å²	153.5	83%	0.825	83%	0.833	S	S	*	*			trans	-143.9	87.5	166.6	55.5	0	0	0	0	111.1
359	N	21.5	Very low	22.8	Very low	160 Å²	160	153.5 Å²	153.5	86%	0.856	83%	0.833	S	S	*	*			trans	-69.7	129.1	171.3	-77.4	-31.1	0	0	0	110.5
360	K	27	Very low	22.7	Very low	209 Å²	209	150.5 Å²	150.5	91%	0.909	83%	0.827	S	S	*	*			trans	-137.2	117.2	152.9	-98.1	-176.2	176.6	178.5	0	110.2
361	K	20.8	Very low	22.6	Very low	212 Å²	212	152.2 Å²	152.2	92%	0.922	83%	0.832	S	S	*	*			trans	-88.6	137.4	166	-69.5	177	175.7	177.2	0	108.4
362	S	25.7	Very low	22.9	Very low	117 Å²	117	151.3 Å²	151.3	82%	0.818	83%	0.827	S	S	*	*			trans	-131.6	130.4	159.6	44.3	0	0	0	0	108.2
363	K	22.3	Very low	23.1	Very low	212 Å²	212	152.3 Å²	152.3	92%	0.922	83%	0.832	S	S	*	*			trans	-81.2	149.8	176.8	-70.7	-178.1	175.7	-177.9	0	109.6
364	G	20.4	Very low	23.3	Very low	82 Å²	82	153.5 Å²	153.5	85%	0.845	83%	0.83	S	S	*	*			trans	-76.9	176.1	-175.7	0	0	0	0	0	114.8
365	A	25.2	Very low	23.4	Very low	93 Å²	93	150.2 Å²	150.2	77%	0.769	83%	0.828	S	S	*	*			trans	-132.5	135.7	161.2	0	0	0	0	0	107.6
366	Q	21.2	Very low	23.6	Very low	185 Å²	185	151.1 Å²	151.1	86%	0.864	83%	0.828	S	S	*	*			trans	-87.6	128.9	171	-64.5	168	-74.6	0	0	108.3
367	H	26.7	Very low	23.6	Very low	187 Å²	187	148.1 Å²	148.1	87%	0.866	82%	0.82	S	S	*	*			trans	-140.7	146.1	159.9	-92.7	-79.4	0	0	0	109.9
368	N	24	Very low	23.9	Very low	144 Å²	144	145.8 Å²	145.8	77%	0.77	82%	0.815	S	S	*	*			trans	-96	145.9	-162.1	-62.6	-27.7	0	0	0	113
369	S	21.9	Very low	23.8	Very low	114 Å²	114	145.8 Å²	145.8	80%	0.797	81%	0.806	S	S	*	*			trans	30.6	112.3	143.2	63.7	0	0	0	0	119.8
370	S	22.2	Very low	24	Very low	112 Å²	112	142.6 Å²	142.6	78%	0.783	80%	0.796	S	S	*	*			trans	-140.7	130.5	136.8	57.2	0	0	0	0	108.2
371	M	19.2	Very low	23.8	Very low	178 Å²	178	138.1 Å²	138.1	88%	0.877	78%	0.782	S	S	*	*			trans	-85.9	136.6	178	-59.5	-166.6	76.4	0	0	110.4
372	S	26.2	Very low	24.2	Very low	98 Å²	98	134.7 Å²	134.7	69%	0.685	77%	0.773	S	S	*	*			trans	-148.5	106	169.2	55.5	0	0	0	0	108.3	D374	S372-D374 VanDerWaalsContact C-N 3.27Å; S372-D374 PolarHBondContact O-N 3.3Å
373	D	25.1	Very low	24.3	Very low	157 Å²	157	138.3 Å²	138.3	84%	0.84	78%	0.777	S	S	*	*			trans	-75.2	74.4	179.3	-73.4	-57.1	0	0	0	111.5
374	D	26.5	Very low	25.1	Very low	135 Å²	135	133.3 Å²	133.3	72%	0.722	76%	0.76	S	S	*	*			trans	-103.5	111.1	164.2	-93.4	-53.2	0	0	0	110	S372 N376	S372-D374 VanDerWaalsContact C-N 3.27Å; S372-D374 PolarHBondContact O-N 3.3Å; D374-N376 PolarHBondContact O-N 3.18Å
375	S	24.7	Very low	26.5	Very low	114 Å²	114	132.8 Å²	132.8	80%	0.797	74%	0.743	S	S	*	*			trans	-78.8	64.5	-174.3	46.3	0	0	0	0	111.8	I377	S375-I377 PolarHBondContact O-N 2.8Å
376	N	25.4	Very low	28.2	Very low	142 Å²	142	133 Å²	133	76%	0.759	74%	0.735	S	S	*	*			trans	-58.4	98.8	166.8	-85.6	-57	0	0	0	109.4	D374 I378	D374-N376 PolarHBondContact O-N 3.18Å; N376-I378 PolarHBondContact O-N 2.87Å
377	I	25.3	Very low	30.8	Very low	147 Å²	147	125.7 Å²	125.7	75%	0.754	70%	0.701	S	S	*	*			trans	-57.7	107.2	173.9	-64.2	169.4	0	0	0	107.1	S375 N379	S375-I377 PolarHBondContact O-N 2.8Å; I377-N379 VanDerWaalsContact C-N 3.34Å; I377-N379 PolarHBondContact O-N 3.48Å
378	I	25.1	Very low	33.5	Very low	145 Å²	145	118.3 Å²	118.3	74%	0.744	67%	0.669	S	S	*	*			trans	-68.5	97.7	176.5	-55.6	179.8	0	0	0	106.8	N376 C380	N376-I378 PolarHBondContact O-N 2.87Å; I378-C380 VanDerWaalsContact C-N 3.27Å; I378-C380 PolarHBondContact O-N 3.25Å
379	N	23.6	Very low	36.5	Very low	118 Å²	118	112 Å²	112	63%	0.631	64%	0.635	S	S	*	*			trans	-71	88.5	177.4	-137.1	58.2	0	0	0	107.9	I377 D381	I377-N379 VanDerWaalsContact C-N 3.34Å; I377-N379 PolarHBondContact O-N 3.48Å; N379-D381 PolarHBondContact ND2-OD2 3.37Å; N379-D381 PolarHBondContact O-N 3.27Å
380	C	24.6	Very low	39.5	Very low	94 Å²	94	109 Å²	109	64%	0.635	61%	0.614	S	S	*	*			trans	-72.8	56.9	-178.9	-75.3	0	0	0	0	112	I378 N382	I378-C380 VanDerWaalsContact C-N 3.27Å; I378-C380 PolarHBondContact O-N 3.25Å; C380-N382 PolarHBondContact O-N 3.04Å
381	D	24.6	Very low	42.5	Very low	115 Å²	115	107.2 Å²	107.2	62%	0.615	60%	0.596	S	S	*	*			trans	-71.6	53.9	166.6	-67.9	-45.8	0	0	0	110.5	N379 H383	N379-D381 PolarHBondContact ND2-OD2 3.37Å; N379-D381 PolarHBondContact O-N 3.27Å; D381-H383 VanDerWaalsContact C-N 3.34Å; D381-H383 PolarHBondContact O-N 2.69Å
382	N	28.8	Very low	45.8	Very low	139 Å²	139	98.8 Å²	98.8	74%	0.743	55%	0.554	S	S	*	*			trans	-62.3	100.7	163	-84.4	-35.4	0	0	0	107	C380 L384	C380-N382 PolarHBondContact O-N 3.04Å; N382-L384 PolarHBondContact O-N 3.17Å
383	H	27.9	Very low	48.9	Very low	193 Å²	193	94.4 Å²	94.4	89%	0.894	52%	0.523	S	S	*	.			trans	-64.3	69.7	171.1	-89.5	-89.6	0	0	0	110.9	D381	D381-H383 VanDerWaalsContact C-N 3.34Å; D381-H383 PolarHBondContact O-N 2.69Å
384	L	39.1	Very low	51.9	Low	108 Å²	108	88.8 Å²	88.8	57%	0.565	50%	0.495	S	S	*	.			trans	-61.2	138.6	167.5	-170	70.3	0	0	0	108.2	N382 T386	N382-L384 PolarHBondContact O-N 3.17Å; L384-T386 VanDerWaalsContact C-N 3.29Å; L384-T386 PolarHBondContact O-N 3.14Å
385	S	48.5	Very low	54.7	Low	70 Å²	70	84.5 Å²	84.5	49%	0.49	47%	0.471	S	S	.	.			trans	-69.6	86.6	175.8	56.2	0	0	0	0	110.1	E387	S385-E387 PolarHBondContact O-N 3.28Å
386	T	61.2	Low	57.8	Low	98 Å²	98	79.1 Å²	79.1	60%	0.601	43%	0.433	S	S	*	.			trans	-76.6	73.3	-179.9	46.8	0	0	0	0	111	L384 T388	L384-T386 VanDerWaalsContact C-N 3.29Å; L384-T386 PolarHBondContact O-N 3.14Å; T386-T388 PolarHBondContact O-N 2.98Å
387	E	76.7	Confident	60.6	Low	32 Å²	32	75.5 Å²	75.5	15%	0.15	41%	0.409	C	S	.	.			trans	-47.8	132.3	171.5	-63.6	166.4	-171.8	0	0	110.5	P287 S288 S289 P324 S385 D391 L392	P287-E387 WeakPolarHBondContact CB-OE1 3.04Å; S288-E387 WeakPolarHBondContact CB-OE2 3.47Å; S288-E387 PolarHBondContact OG-OE2 3.33Å; S289-E387 WeakPolarHBondContact CA-OE2 3.37Å; S289-E387 WeakPolarHBondContact CB-OE1 3.26Å; S289-E387 VanDerWaalsContact CB-OE2 3.3Å; S289-E387 WeakPolarHBondContact CB-OE2 3.38Å; S289-E387 VanDerWaalsContact N-CD 3.35Å; S289-E387 PolarHBondContact N-OE1 3.42Å; S289-E387 PolarHBondContact N-OE2 2.99Å; S289-E387 PolarHBondContact OG-OE1 3.28Å; P324-E387 WeakPolarHBondContact CD-O 3.2Å; S385-E387 PolarHBondContact O-N 3.28Å; E387-D391 HydrophobicContact CB-CB 4.43Å; E387-L392 VanDerWaalsContact OE2-CD2 3.29Å; E387-L392 WeakPolarHBondContact OE2-CD2 3.49Å
388	T	82.6	Confident	63.3	Low	32 Å²	32	74.1 Å²	74.1	20%	0.196	40%	0.402	C	S	.	.			trans	-76.6	162.5	-174.2	74.1	0	0	0	0	111.1	P324 T326 T386 S390 D391 L392	P324-T388 WeakPolarHBondContact O-CA 3.41Å; T326-T388 HydrophobicContact CG2-CG2 3.75Å; T386-T388 PolarHBondContact O-N 2.98Å; T388-S390 PolarHBondContact O-N 3.47Å; T388-S390 VanDerWaalsContact O-N 3.12Å; T388-S390 WeakPolarHBondContact OG1-CB 3.43Å; T388-S390 PolarHBondContact OG1-N 3.37Å; T388-D391 WeakPolarHBondContact CA-OD2 3.42Å; T388-D391 VanDerWaalsContact CB-OD2 3.27Å; T388-D391 WeakPolarHBondContact CB-OD2 3.28Å; T388-D391 WeakPolarHBondContact CG2-OD2 3.32Å; T388-D391 PolarHBondContact N-OD2 3.1Å; T388-D391 PolarHBondContact O-N 3.44Å; T388-D391 VanDerWaalsContact OG1-CG 3.31Å; T388-D391 PolarHBondContact OG1-N 2.87Å; T388-D391 PolarHBondContact OG1-OD2 3.49Å; T388-L392 PolarHBondContact O-N 3.11Å
389	L	86.3	Confident	65.9	Low	10 Å²	10	72.8 Å²	72.8	5%	0.052	39%	0.391	C	S	.	.	H	α-helix	trans	-52	-34.9	170.6	176.9	60	0	0	0	111.8	F320 A323 P324 K325 Q393 T481	F320-L389 HydrophobicContact CB-CD1 4.13Å; F320-L389 HydrophobicContact CD1-CD1 3.89Å; F320-L389 HydrophobicContact CG-CD1 4.5Å; A323-L389 HydrophobicContact CB-CB 4.33Å; P324-L389 PolarHBondContact O-N 3.43Å; K325-L389 HydrophobicContact CD-CD2 4.04Å; K325-L389 HydrophobicContact CG-CB 4.4Å; K325-L389 HydrophobicContact CG-CD2 3.85Å; L389-Q393 HydrophobicContact CD1-CG 4.08Å; L389-Q393 HydrophobicContact CG-CG 4.31Å; L389-Q393 WeakPolarHBondContact O-CB 3.36Å; L389-Q393 WeakPolarHBondContact O-CG 3.28Å; L389-Q393 PolarHBondContact O-N 2.96Å; L389-T481 HydrophobicContact CD2-CG2 3.99Å
390	S	86	Confident	68.4	Low	53 Å²	53	70.6 Å²	70.6	37%	0.371	38%	0.384	S	S	.	.	H	α-helix	trans	-68.3	-35.9	179.2	-164.1	0	0	0	0	112.8	T388 T394	T388-S390 PolarHBondContact O-N 3.47Å; T388-S390 VanDerWaalsContact O-N 3.12Å; T388-S390 WeakPolarHBondContact OG1-CB 3.43Å; T388-S390 PolarHBondContact OG1-N 3.37Å; S390-T394 WeakPolarHBondContact O-CB 3.46Å; S390-T394 PolarHBondContact O-N 3.24Å; S390-T394 PolarHBondContact O-OG1 3.3Å
391	D	85.6	Confident	71.1	Confident	74 Å²	74	66.1 Å²	66.1	40%	0.396	35%	0.354	S	S	.	.	H	α-helix	trans	-68.7	-49.1	179.2	-57.8	-56.1	0	0	0	110.4	E387 T388 Q393 T394 I395	E387-D391 HydrophobicContact CB-CB 4.43Å; T388-D391 WeakPolarHBondContact CA-OD2 3.42Å; T388-D391 VanDerWaalsContact CB-OD2 3.27Å; T388-D391 WeakPolarHBondContact CB-OD2 3.28Å; T388-D391 WeakPolarHBondContact CG2-OD2 3.32Å; T388-D391 PolarHBondContact N-OD2 3.1Å; T388-D391 PolarHBondContact O-N 3.44Å; T388-D391 VanDerWaalsContact OG1-CG 3.31Å; T388-D391 PolarHBondContact OG1-N 2.87Å; T388-D391 PolarHBondContact OG1-OD2 3.49Å; D391-Q393 PolarHBondContact O-N 3.31Å; D391-T394 PolarHBondContact O-N 3.08Å; D391-T394 VanDerWaalsContact O-N 3.15Å; D391-I395 WeakPolarHBondContact O-CG1 3.45Å; D391-I395 PolarHBondContact O-N 2.94Å
392	L	87.5	Confident	74.1	Confident	0 Å²	0	61.1 Å²	61.1	0%	0	33%	0.327	C	S	.	.	H	α-helix	trans	-61.6	-44.4	175.3	-63.2	-177.6	0	0	0	111.9	L292 L319 F320 A323 E387 T388 T394 I395 F396	L292-L392 HydrophobicContact CD2-CB 4.12Å; L292-L392 HydrophobicContact CD2-CD2 4Å; L319-L392 HydrophobicContact CB-CD1 4.41Å; F320-L392 HydrophobicContact CD1-CB 3.86Å; F320-L392 HydrophobicContact CD1-CD1 4.36Å; F320-L392 HydrophobicContact CE1-CB 3.51Å; F320-L392 HydrophobicContact CZ-CB 4.44Å; A323-L392 HydrophobicContact CB-CD1 3.72Å; E387-L392 VanDerWaalsContact OE2-CD2 3.29Å; E387-L392 WeakPolarHBondContact OE2-CD2 3.49Å; T388-L392 PolarHBondContact O-N 3.11Å; L392-T394 PolarHBondContact O-N 3.01Å; L392-I395 PolarHBondContact O-N 3.17Å; L392-F396 WeakPolarHBondContact O-CB 3.42Å; L392-F396 PolarHBondContact O-N 3.02Å
393	Q	91.3	Very high	76.7	Confident	7 Å²	7	57.2 Å²	57.2	3%	0.033	31%	0.311	C	S	.	.	H	α-helix	trans	-59.8	-35.5	175	-82.1	176.3	-10.7	0	0	112.1	F320 L389 D391 R397 H478 L479 T481 C483 N486	F320-Q393 HydrophobicContact CE1-CG 4.46Å; L389-Q393 HydrophobicContact CD1-CG 4.08Å; L389-Q393 HydrophobicContact CG-CG 4.31Å; L389-Q393 WeakPolarHBondContact O-CB 3.36Å; L389-Q393 WeakPolarHBondContact O-CG 3.28Å; L389-Q393 PolarHBondContact O-N 2.96Å; D391-Q393 PolarHBondContact O-N 3.31Å; Q393-R397 WeakPolarHBondContact O-CB 3.44Å; Q393-R397 PolarHBondContact O-N 2.89Å; Q393-R397 VanDerWaalsContact O-N 3.09Å; Q393-H478 PolarHBondContact NE2-O 3.26Å; Q393-L479 PolarHBondContact NE2-O 3.24Å; Q393-T481 PolarHBondContact NE2-O 3.45Å; Q393-C483 VanDerWaalsContact OE1-CB 3.28Å; Q393-N486 PolarHBondContact O-ND2 3.46Å
394	T	88.4	Confident	79.1	Confident	39 Å²	39	50.7 Å²	50.7	24%	0.239	28%	0.282	C	S	.	.	H	α-helix	trans	-76.2	-40.8	179	-66.7	0	0	0	0	111.8	S390 D391 L392 R397 I398	S390-T394 WeakPolarHBondContact O-CB 3.46Å; S390-T394 PolarHBondContact O-N 3.24Å; S390-T394 PolarHBondContact O-OG1 3.3Å; D391-T394 PolarHBondContact O-N 3.08Å; D391-T394 VanDerWaalsContact O-N 3.15Å; L392-T394 PolarHBondContact O-N 3.01Å; T394-R397 PolarHBondContact O-N 2.88Å; T394-R397 PolarHBondContact OG1-NH2 3.34Å; T394-R397 VanDerWaalsContact OG1-NH2 3.15Å; T394-I398 HydrophobicContact CG2-CD1 3.56Å; T394-I398 HydrophobicContact CG2-CG1 4.26Å; T394-I398 WeakPolarHBondContact O-CB 3.29Å; T394-I398 VanDerWaalsContact O-CG1 3.28Å; T394-I398 WeakPolarHBondContact O-CG1 3.48Å; T394-I398 PolarHBondContact O-N 3.11Å
395	I	86	Confident	81.2	Confident	45 Å²	45	45.8 Å²	45.8	23%	0.231	26%	0.256	C	S	.	.	H	α-helix	trans	-59.2	-47.8	172.1	-69.4	160.1	0	0	0	110.3	S289 L292 D391 L392 R397 I398 K399	S289-I395 VanDerWaalsContact CB-CD1 3.48Å; L292-I395 HydrophobicContact CD2-CB 4.35Å; L292-I395 HydrophobicContact CD2-CG2 4.12Å; D391-I395 WeakPolarHBondContact O-CG1 3.45Å; D391-I395 PolarHBondContact O-N 2.94Å; L392-I395 PolarHBondContact O-N 3.17Å; I395-R397 PolarHBondContact O-N 3.44Å; I395-I398 PolarHBondContact O-N 3.12Å; I395-K399 HydrophobicContact CG2-CG 4.47Å; I395-K399 WeakPolarHBondContact O-CB 3.46Å; I395-K399 WeakPolarHBondContact O-CG 3.44Å; I395-K399 PolarHBondContact O-N 3.39Å
396	F	88.6	Confident	82.9	Confident	0 Å²	0	45.2 Å²	45.2	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-59.9	-45.1	178.1	-168.3	-83.6	0	0	0	111.8	L292 L296 M316 F320 L392 G401 F402 L405 L479	L292-F396 HydrophobicContact CD1-CD2 4.39Å; L296-F396 HydrophobicContact CD1-CD2 4.39Å; L296-F396 HydrophobicContact CD2-CD2 3.86Å; L296-F396 HydrophobicContact CD2-CE2 3.65Å; M316-F396 HydrophobicContact SD-CE2 4.3Å; F320-F396 HydrophobicContact CZ-CB 4.27Å; F320-F396 HydrophobicContact CZ-CD2 4.11Å; F320-F396 HydrophobicContact CZ-CG 4.42Å; L392-F396 WeakPolarHBondContact O-CB 3.42Å; L392-F396 PolarHBondContact O-N 3.02Å; F396-G401 VanDerWaalsContact CZ-C 3.44Å; F396-G401 WeakPolarHBondContact CZ-O 3.49Å; F396-G401 WeakPolarHBondContact O-CA 3.31Å; F396-G401 PolarHBondContact O-N 3.48Å; F396-F402 HydrophobicContact CD1-CD1 4.4Å; F396-F402 HydrophobicContact CD1-CD2 4.33Å; F396-F402 HydrophobicContact CD1-CE1 4.22Å; F396-F402 HydrophobicContact CD1-CE2 4.17Å; F396-F402 HydrophobicContact CD1-CG 4.44Å; F396-F402 HydrophobicContact CD1-CZ 4.11Å; F396-F402 AromaticContact CE1-CD1 3.67Å; F396-F402 HydrophobicContact CE1-CD1 3.67Å; F396-F402 HydrophobicContact CE1-CD2 4.24Å; F396-F402 AromaticContact CE1-CE1 3.79Å; F396-F402 HydrophobicContact CE1-CE1 3.79Å; F396-F402 HydrophobicContact CE1-CE2 4.36Å; F396-F402 AromaticContact CE1-CG 3.9Å; F396-F402 HydrophobicContact CE1-CG 3.9Å; F396-F402 HydrophobicContact CE1-CZ 4.14Å; F396-F402 VanDerWaalsContact CE1-N 3.3Å; F396-L405 HydrophobicContact CZ-CD1 4.26Å; F396-L479 HydrophobicContact CB-CD2 3.82Å; F396-L479 HydrophobicContact CD1-CD1 3.95Å; F396-L479 HydrophobicContact CD1-CD2 3.54Å; F396-L479 HydrophobicContact CD1-CG 4.39Å; F396-L479 HydrophobicContact CD2-CD1 4.46Å; F396-L479 HydrophobicContact CD2-CD2 3.91Å; F396-L479 HydrophobicContact CE1-CD1 3.53Å; F396-L479 HydrophobicContact CE1-CD2 4.03Å; F396-L479 HydrophobicContact CE1-CG 4.44Å; F396-L479 HydrophobicContact CE2-CD1 4.08Å; F396-L479 HydrophobicContact CE2-CD2 4.36Å; F396-L479 HydrophobicContact CG-CD1 4.41Å; F396-L479 HydrophobicContact CG-CD2 3.48Å; F396-L479 VanDerWaalsContact CG-CD2 3.48Å; F396-L479 HydrophobicContact CZ-CD1 3.61Å; F396-L479 HydrophobicContact CZ-CD2 4.42Å
397	R	85	Confident	83.8	Confident	66 Å²	66	47.2 Å²	47.2	25%	0.249	25%	0.248	C	C	.	.	H	α-helix	trans	-61.8	-50.8	175.6	179.5	175	61.6	-111.1	-0.1	112.2	Q393 T394 I395 K399 S400 N486 L489	Q393-R397 WeakPolarHBondContact O-CB 3.44Å; Q393-R397 PolarHBondContact O-N 2.89Å; Q393-R397 VanDerWaalsContact O-N 3.09Å; T394-R397 PolarHBondContact O-N 2.88Å; T394-R397 PolarHBondContact OG1-NH2 3.34Å; T394-R397 VanDerWaalsContact OG1-NH2 3.15Å; I395-R397 PolarHBondContact O-N 3.44Å; R397-K399 VanDerWaalsContact C-N 3.35Å; R397-K399 PolarHBondContact O-N 3.48Å; R397-S400 PolarHBondContact O-N 3.04Å; R397-N486 WeakPolarHBondContact CD-OD1 3.43Å; R397-N486 PolarHBondContact NH1-OD1 3.49Å; R397-L489 VanDerWaalsContact CD-CD1 3.44Å; R397-L489 HydrophobicContact CG-CD1 3.69Å
398	I	81.3	Confident	83.9	Confident	118 Å²	118	47 Å²	47	61%	0.605	25%	0.248	S	C	*	.	H	α-helix	trans	-67.9	-32.4	-174.5	-70.5	174.8	0	0	0	112.2	T394 I395 S400	T394-I398 HydrophobicContact CG2-CD1 3.56Å; T394-I398 HydrophobicContact CG2-CG1 4.26Å; T394-I398 WeakPolarHBondContact O-CB 3.29Å; T394-I398 VanDerWaalsContact O-CG1 3.28Å; T394-I398 WeakPolarHBondContact O-CG1 3.48Å; T394-I398 PolarHBondContact O-N 3.11Å; I395-I398 PolarHBondContact O-N 3.12Å; I398-S400 PolarHBondContact O-N 3.22Å
399	K	81	Confident	84.1	Confident	118 Å²	118	45.5 Å²	45.5	51%	0.513	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.4	19.8	176	-61.7	-60.8	-175.4	-177.9	0	113.5	L293 L296 I395 R397 G401	L293-K399 HydrophobicContact CD1-CD 4.38Å; L293-K399 HydrophobicContact CD1-CG 4.15Å; L296-K399 HydrophobicContact CD1-CB 4.38Å; I395-K399 HydrophobicContact CG2-CG 4.47Å; I395-K399 WeakPolarHBondContact O-CB 3.46Å; I395-K399 WeakPolarHBondContact O-CG 3.44Å; I395-K399 PolarHBondContact O-N 3.39Å; R397-K399 VanDerWaalsContact C-N 3.35Å; R397-K399 PolarHBondContact O-N 3.48Å; K399-G401 PolarHBondContact O-N 2.98Å; K399-G401 VanDerWaalsContact O-N 3.14Å
400	S	76.4	Confident	84	Confident	71 Å²	71	48.1 Å²	48.1	50%	0.497	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.6	31	-178.9	-54.9	0	0	0	0	113.5	R397 I398 F402 S403 L404	R397-S400 PolarHBondContact O-N 3.04Å; I398-S400 PolarHBondContact O-N 3.22Å; S400-F402 PolarHBondContact O-N 2.89Å; S400-F402 VanDerWaalsContact O-N 3.11Å; S400-S403 WeakPolarHBondContact CB-OG 3.29Å; S400-S403 PolarHBondContact O-N 3.08Å; S400-S403 PolarHBondContact O-OG 2.83Å; S400-L404 PolarHBondContact O-N 3.32Å
401	G	81.3	Confident	83.8	Confident	0 Å²	0	47.5 Å²	47.5	0%	0	25%	0.25	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.4	-31.3	-171.7	0	0	0	0	0	113.5	F396 K399 S403 L404	F396-G401 VanDerWaalsContact CZ-C 3.44Å; F396-G401 WeakPolarHBondContact CZ-O 3.49Å; F396-G401 WeakPolarHBondContact O-CA 3.31Å; F396-G401 PolarHBondContact O-N 3.48Å; K399-G401 PolarHBondContact O-N 2.98Å; K399-G401 VanDerWaalsContact O-N 3.14Å; G401-S403 VanDerWaalsContact C-N 3.34Å; G401-S403 PolarHBondContact O-N 3.24Å; G401-L404 WeakPolarHBondContact O-CB 3.49Å; G401-L404 PolarHBondContact O-N 3.4Å
402	F	87.3	Confident	83.6	Confident	10 Å²	10	44 Å²	44	4%	0.044	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.8	-41.6	172.7	-64.9	-66.5	0	0	0	112.2	F396 S400 L404 L405 L479 N486 L489 L490 Q494	F396-F402 HydrophobicContact CD1-CD1 4.4Å; F396-F402 HydrophobicContact CD1-CD2 4.33Å; F396-F402 HydrophobicContact CD1-CE1 4.22Å; F396-F402 HydrophobicContact CD1-CE2 4.17Å; F396-F402 HydrophobicContact CD1-CG 4.44Å; F396-F402 HydrophobicContact CD1-CZ 4.11Å; F396-F402 AromaticContact CE1-CD1 3.67Å; F396-F402 HydrophobicContact CE1-CD1 3.67Å; F396-F402 HydrophobicContact CE1-CD2 4.24Å; F396-F402 AromaticContact CE1-CE1 3.79Å; F396-F402 HydrophobicContact CE1-CE1 3.79Å; F396-F402 HydrophobicContact CE1-CE2 4.36Å; F396-F402 AromaticContact CE1-CG 3.9Å; F396-F402 HydrophobicContact CE1-CG 3.9Å; F396-F402 HydrophobicContact CE1-CZ 4.14Å; F396-F402 VanDerWaalsContact CE1-N 3.3Å; S400-F402 PolarHBondContact O-N 2.89Å; S400-F402 VanDerWaalsContact O-N 3.11Å; F402-L404 VanDerWaalsContact C-N 3.28Å; F402-L404 PolarHBondContact O-N 3.49Å; F402-L405 WeakPolarHBondContact O-CB 3.45Å; F402-L405 PolarHBondContact O-N 3.22Å; F402-L405 VanDerWaalsContact O-N 3.08Å; F402-L479 HydrophobicContact CE1-CB 4.23Å; F402-L479 HydrophobicContact CE1-CD1 3.93Å; F402-L479 HydrophobicContact CZ-CB 4.29Å; F402-N486 HydrophobicContact CZ-CB 4.11Å; F402-L489 HydrophobicContact CD2-CB 4.43Å; F402-L489 HydrophobicContact CE2-CB 4.36Å; F402-L490 HydrophobicContact CD1-CD1 3.62Å; F402-L490 HydrophobicContact CE1-CB 4.23Å; F402-L490 HydrophobicContact CE1-CD1 3.65Å; F402-Q494 PolarHBondContact O-NE2 2.92Å
403	S	82	Confident	83.4	Confident	57 Å²	57	45.5 Å²	45.5	40%	0.399	24%	0.237	S	C	.	.	G	3₁₀ helix	trans	-72.1	-18.4	178.8	66	0	0	0	0	114.2	S400 G401 L405 D406	S400-S403 WeakPolarHBondContact CB-OG 3.29Å; S400-S403 PolarHBondContact O-N 3.08Å; S400-S403 PolarHBondContact O-OG 2.83Å; G401-S403 VanDerWaalsContact C-N 3.34Å; G401-S403 PolarHBondContact O-N 3.24Å; S403-L405 PolarHBondContact O-N 3.22Å; S403-D406 WeakPolarHBondContact CA-OD1 3.35Å; S403-D406 WeakPolarHBondContact CA-OD2 3.25Å; S403-D406 WeakPolarHBondContact CB-OD2 3.46Å; S403-D406 WeakPolarHBondContact O-CB 3.25Å; S403-D406 VanDerWaalsContact O-CG 3.26Å; S403-D406 PolarHBondContact O-N 3Å
404	L	79	Confident	82.9	Confident	56 Å²	56	50.1 Å²	50.1	29%	0.293	26%	0.259	S	S	.	.	G	3₁₀ helix	trans	-71.4	-15.2	170.8	-60.5	179.4	0	0	0	112.2	L296 A300 Y309 S400 G401 F402	L296-L404 HydrophobicContact CB-CD1 4.04Å; L296-L404 HydrophobicContact CD2-CD1 4.1Å; A300-L404 HydrophobicContact CB-CD1 4.44Å; A300-L404 HydrophobicContact CB-CD2 3.97Å; Y309-L404 PolarHBondContact OH-O 3.19Å; S400-L404 PolarHBondContact O-N 3.32Å; G401-L404 WeakPolarHBondContact O-CB 3.49Å; G401-L404 PolarHBondContact O-N 3.4Å; F402-L404 VanDerWaalsContact C-N 3.28Å; F402-L404 PolarHBondContact O-N 3.49Å
405	L	83.3	Confident	82.3	Confident	5 Å²	5	51.4 Å²	51.4	3%	0.026	26%	0.264	C	S	.	.	G	3₁₀ helix	trans	-89.2	-17.1	174	-49.4	-177.3	0	0	0	113.1	Y309 L313 F396 F402 S403 K407 E408 V409 L472	Y309-L405 WeakPolarHBondContact OH-CD2 3.1Å; L313-L405 HydrophobicContact CD2-CD2 4.11Å; F396-L405 HydrophobicContact CZ-CD1 4.26Å; F402-L405 WeakPolarHBondContact O-CB 3.45Å; F402-L405 PolarHBondContact O-N 3.22Å; F402-L405 VanDerWaalsContact O-N 3.08Å; S403-L405 PolarHBondContact O-N 3.22Å; L405-K407 VanDerWaalsContact C-N 3.33Å; L405-K407 PolarHBondContact O-N 2.87Å; L405-E408 PolarHBondContact O-N 3.25Å; L405-V409 HydrophobicContact CB-CG2 4.12Å; L405-V409 WeakPolarHBondContact O-CG2 3.38Å; L405-V409 PolarHBondContact O-N 3.44Å; L405-L472 HydrophobicContact CD1-CD2 4.32Å; L405-L472 HydrophobicContact CD2-CD2 4.47Å
406	D	83.6	Confident	81.7	Confident	59 Å²	59	50 Å²	50	32%	0.316	26%	0.256	S	S	.	.	H	α-helix	trans	-47.4	-53.6	-171.2	-69	-15.8	0	0	0	112.3	S403 E408 V409 D410 Q494	S403-D406 WeakPolarHBondContact CA-OD1 3.35Å; S403-D406 WeakPolarHBondContact CA-OD2 3.25Å; S403-D406 WeakPolarHBondContact CB-OD2 3.46Å; S403-D406 WeakPolarHBondContact O-CB 3.25Å; S403-D406 VanDerWaalsContact O-CG 3.26Å; S403-D406 PolarHBondContact O-N 3Å; D406-E408 VanDerWaalsContact C-N 3.27Å; D406-E408 PolarHBondContact O-N 3.39Å; D406-V409 PolarHBondContact O-N 3.31Å; D406-D410 VanDerWaalsContact O-CB 3.29Å; D406-D410 WeakPolarHBondContact O-CB 3.09Å; D406-D410 PolarHBondContact O-N 2.74Å; D406-Q494 PolarHBondContact OD1-NE2 3.13Å
407	K	79.8	Confident	80.7	Confident	140 Å²	140	50.8 Å²	50.8	61%	0.609	26%	0.26	S	S	*	.	H	α-helix	trans	-63.9	-30.2	-177.3	-70.2	178.6	169	-69.7	0	113.7	L405 A411	L405-K407 VanDerWaalsContact C-N 3.33Å; L405-K407 PolarHBondContact O-N 2.87Å; K407-A411 WeakPolarHBondContact O-CB 3.48Å; K407-A411 PolarHBondContact O-N 3.46Å
408	E	79.5	Confident	79.3	Confident	28 Å²	28	50.7 Å²	50.7	13%	0.131	27%	0.268	C	S	.	.	H	α-helix	trans	-84.4	-44.1	-178.6	-170.7	63.9	-116.2	0	0	111.2	Y309 L405 D406 D410 A411 I412 R468	Y309-E408 HydrophobicContact CD1-CB 4.47Å; Y309-E408 HydrophobicContact CD1-CG 3.73Å; Y309-E408 WeakPolarHBondContact CD2-OE2 3.47Å; Y309-E408 HydrophobicContact CE1-CB 3.82Å; Y309-E408 HydrophobicContact CE1-CG 3.49Å; Y309-E408 VanDerWaalsContact CE1-CG 3.49Å; Y309-E408 HydrophobicContact CE2-CB 4.24Å; Y309-E408 HydrophobicContact CE2-CG 4.41Å; Y309-E408 HydrophobicContact CG-CG 4.29Å; L405-E408 PolarHBondContact O-N 3.25Å; D406-E408 VanDerWaalsContact C-N 3.27Å; D406-E408 PolarHBondContact O-N 3.39Å; E408-D410 PolarHBondContact O-N 3.25Å; E408-A411 PolarHBondContact O-N 3.2Å; E408-A411 VanDerWaalsContact O-N 3.15Å; E408-I412 HydrophobicContact CG-CD1 4.1Å; E408-I412 WeakPolarHBondContact O-CG1 3.39Å; E408-I412 PolarHBondContact O-N 3.2Å; E408-R468 IonicContact OE1-CZ 2.72Å; E408-R468 IonicContact OE1-NE 3.73Å; E408-R468 PolarHBondContact OE1-NE 3.13Å; E408-R468 IonicContact OE1-NH2 2.76Å; E408-R468 PolarHBondContact OE1-NH2 2.93Å; E408-R468 IonicContact OE2-NE 2.84Å
409	V	87.5	Confident	78	Confident	0 Å²	0	50.7 Å²	50.7	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-58.6	-40.9	172	174	0	0	0	0	109.9	L405 D406 Y413 L472 N496 L497 I500	L405-V409 HydrophobicContact CB-CG2 4.12Å; L405-V409 WeakPolarHBondContact O-CG2 3.38Å; L405-V409 PolarHBondContact O-N 3.44Å; D406-V409 PolarHBondContact O-N 3.31Å; V409-Y413 WeakPolarHBondContact O-CB 3.5Å; V409-Y413 PolarHBondContact O-N 3.44Å; V409-L472 HydrophobicContact CG2-CD1 4.12Å; V409-N496 HydrophobicContact CG1-CB 3.84Å; V409-L497 HydrophobicContact CG1-CB 3.77Å; V409-L497 VanDerWaalsContact CG1-N 3.26Å; V409-L497 HydrophobicContact CG2-CB 4.33Å; V409-L497 HydrophobicContact CG2-CD1 4.41Å; V409-I500 HydrophobicContact CG1-CD1 4.43Å
410	D	84.3	Confident	76.6	Confident	65 Å²	65	47.4 Å²	47.4	35%	0.348	26%	0.257	S	S	.	.	H	α-helix	trans	-63.8	-47.5	172	-79.8	-15.7	0	0	0	112.2	D406 E408 I412 Y413 Q414 N496	D406-D410 VanDerWaalsContact O-CB 3.29Å; D406-D410 WeakPolarHBondContact O-CB 3.09Å; D406-D410 PolarHBondContact O-N 2.74Å; E408-D410 PolarHBondContact O-N 3.25Å; D410-I412 PolarHBondContact O-N 3.4Å; D410-Y413 PolarHBondContact O-N 2.87Å; D410-Q414 VanDerWaalsContact O-CG 3.29Å; D410-Q414 WeakPolarHBondContact O-CG 3.43Å; D410-Q414 PolarHBondContact O-N 3.22Å; D410-N496 PolarHBondContact OD1-ND2 3.02Å
411	A	81.2	Confident	75.1	Confident	40 Å²	40	45.3 Å²	45.3	33%	0.331	24%	0.24	S	C	.	.	H	α-helix	trans	-57.2	-50.5	179.4	0	0	0	0	0	112.1	K407 E408 Y413 Q414 I415	K407-A411 WeakPolarHBondContact O-CB 3.48Å; K407-A411 PolarHBondContact O-N 3.46Å; E408-A411 PolarHBondContact O-N 3.2Å; E408-A411 VanDerWaalsContact O-N 3.15Å; A411-Y413 PolarHBondContact O-N 2.73Å; A411-Q414 PolarHBondContact O-N 3.06Å; A411-I415 WeakPolarHBondContact O-CG1 3.49Å; A411-I415 PolarHBondContact O-N 3.46Å
412	I	81.9	Confident	73.1	Confident	0 Å²	0	49.3 Å²	49.3	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-63.2	-42.2	176.4	-67	167.5	0	0	0	110.4	E408 D410 Q414 I415 F416 R468 M469 L472 I500	E408-I412 HydrophobicContact CG-CD1 4.1Å; E408-I412 WeakPolarHBondContact O-CG1 3.39Å; E408-I412 PolarHBondContact O-N 3.2Å; D410-I412 PolarHBondContact O-N 3.4Å; I412-Q414 PolarHBondContact O-N 3.22Å; I412-I415 PolarHBondContact O-N 2.75Å; I412-F416 HydrophobicContact CG2-CD2 3.88Å; I412-F416 HydrophobicContact CG2-CE2 4.11Å; I412-F416 WeakPolarHBondContact O-CD2 3.21Å; I412-F416 PolarHBondContact O-N 3.37Å; I412-F416 VanDerWaalsContact O-N 3.11Å; I412-R468 HydrophobicContact CD1-CB 4.29Å; I412-R468 HydrophobicContact CD1-CG 4.01Å; I412-M469 HydrophobicContact CG2-CB 4.19Å; I412-M469 HydrophobicContact CG2-CE 3.55Å; I412-M469 HydrophobicContact CG2-CG 4.4Å; I412-L472 HydrophobicContact CD1-CD1 3.56Å; I412-I500 HydrophobicContact CB-CD1 4.48Å; I412-I500 HydrophobicContact CG2-CD1 3.95Å
413	Y	83.4	Confident	70.9	Confident	32 Å²	32	56.1 Å²	56.1	13%	0.125	30%	0.297	C	S	.	.	H	α-helix	trans	-61.4	-44.4	176.8	-179.3	-120.2	0	0	0	111.6	V409 D410 A411 I415 F416 N417 N496 K499 I500	V409-Y413 WeakPolarHBondContact O-CB 3.5Å; V409-Y413 PolarHBondContact O-N 3.44Å; D410-Y413 PolarHBondContact O-N 2.87Å; A411-Y413 PolarHBondContact O-N 2.73Å; Y413-I415 PolarHBondContact O-N 3.14Å; Y413-F416 PolarHBondContact O-N 3.4Å; Y413-N417 HydrophobicContact CD2-CB 4.09Å; Y413-N417 HydrophobicContact CE1-CB 4.45Å; Y413-N417 HydrophobicContact CE2-CB 3.78Å; Y413-N417 WeakPolarHBondContact O-CA 3.49Å; Y413-N417 WeakPolarHBondContact O-CB 3.32Å; Y413-N417 PolarHBondContact O-N 2.96Å; Y413-N417 PolarHBondContact OH-OD1 3.14Å; Y413-N417 VanDerWaalsContact OH-OD1 3.05Å; Y413-N496 HydrophobicContact CD1-CB 3.95Å; Y413-N496 HydrophobicContact CG-CB 3.95Å; Y413-K499 HydrophobicContact CE1-CD 4.31Å; Y413-K499 HydrophobicContact CE2-CB 4.07Å; Y413-K499 HydrophobicContact CE2-CD 3.8Å; Y413-K499 WeakPolarHBondContact OH-CD 3.48Å; Y413-K499 PolarHBondContact OH-NZ 3.01Å; Y413-I500 HydrophobicContact CD2-CG1 4.19Å
414	Q	80.8	Confident	68.7	Low	104 Å²	104	60.6 Å²	60.6	49%	0.486	31%	0.309	S	S	.	.	H	α-helix	trans	-61.5	-29.4	177.1	-65	-58.2	-28.6	0	0	112.9	D410 A411 I412 N420	D410-Q414 VanDerWaalsContact O-CG 3.29Å; D410-Q414 WeakPolarHBondContact O-CG 3.43Å; D410-Q414 PolarHBondContact O-N 3.22Å; A411-Q414 PolarHBondContact O-N 3.06Å; I412-Q414 PolarHBondContact O-N 3.22Å; Q414-N420 PolarHBondContact OE1-ND2 3.28Å
415	I	75	Confident	66.6	Low	65 Å²	65	63.4 Å²	63.4	33%	0.333	32%	0.321	S	S	.	.	H	α-helix	trans	-75.9	-41.7	178.7	-69.9	164.9	0	0	0	112.1	A411 I412 Y413 E465	A411-I415 WeakPolarHBondContact O-CG1 3.49Å; A411-I415 PolarHBondContact O-N 3.46Å; I412-I415 PolarHBondContact O-N 2.75Å; Y413-I415 PolarHBondContact O-N 3.14Å; I415-E465 HydrophobicContact CD1-CG 4.01Å; I415-E465 VanDerWaalsContact CD1-OE2 3.24Å; I415-E465 WeakPolarHBondContact CD1-OE2 3.34Å; I415-E465 HydrophobicContact CG2-CG 4.49Å
416	F	72.6	Confident	64.2	Low	16 Å²	16	68.7 Å²	68.7	7%	0.07	35%	0.347	C	S	.	.	H	α-helix	trans	-99.6	-16.5	-174.8	-67.4	-80.4	0	0	0	115.2	I412 Y413 I462 E465 M469 F511 R514 I515	I412-F416 HydrophobicContact CG2-CD2 3.88Å; I412-F416 HydrophobicContact CG2-CE2 4.11Å; I412-F416 WeakPolarHBondContact O-CD2 3.21Å; I412-F416 PolarHBondContact O-N 3.37Å; I412-F416 VanDerWaalsContact O-N 3.11Å; Y413-F416 PolarHBondContact O-N 3.4Å; F416-I462 HydrophobicContact CE1-CG2 4.34Å; F416-E465 HydrophobicContact CE2-CB 3.81Å; F416-E465 HydrophobicContact CZ-CB 3.91Å; F416-M469 HydrophobicContact CB-CE 4.21Å; F416-M469 HydrophobicContact CD1-CE 4.33Å; F416-M469 HydrophobicContact CD2-CE 3.2Å; F416-M469 HydrophobicContact CE2-CE 3.49Å; F416-M469 VanDerWaalsContact CE2-CE 3.49Å; F416-M469 HydrophobicContact CG-CE 3.67Å; F416-M469 HydrophobicContact CZ-CE 4.18Å; F416-F511 HydrophobicContact CB-CE2 4.21Å; F416-F511 HydrophobicContact CD1-CD2 4.03Å; F416-F511 AromaticContact CD1-CE2 3.52Å; F416-F511 HydrophobicContact CD1-CE2 3.52Å; F416-F511 HydrophobicContact CD1-CZ 4.45Å; F416-F511 HydrophobicContact CE1-CE2 4.13Å; F416-F511 HydrophobicContact CG-CE2 4.05Å; F416-R514 PolarHBondContact O-NH1 2.92Å; F416-I515 HydrophobicContact CE1-CD1 4.32Å; F416-I515 HydrophobicContact CE1-CG1 4.45Å
417	N	68.1	Low	62	Low	16 Å²	16	71.4 Å²	71.4	9%	0.086	36%	0.361	C	S	.	.			trans	-59.1	120.2	-178.5	-179.6	48.9	0	0	0	112.1	Y413 D419 N420 I421	Y413-N417 HydrophobicContact CD2-CB 4.09Å; Y413-N417 HydrophobicContact CE1-CB 4.45Å; Y413-N417 HydrophobicContact CE2-CB 3.78Å; Y413-N417 WeakPolarHBondContact O-CA 3.49Å; Y413-N417 WeakPolarHBondContact O-CB 3.32Å; Y413-N417 PolarHBondContact O-N 2.96Å; Y413-N417 PolarHBondContact OH-OD1 3.14Å; Y413-N417 VanDerWaalsContact OH-OD1 3.05Å; N417-D419 PolarHBondContact O-N 2.9Å; N417-N420 PolarHBondContact ND2-ND2 2.81Å; N417-N420 PolarHBondContact O-N 2.67Å; N417-I421 WeakPolarHBondContact O-CD1 3.42Å; N417-I421 WeakPolarHBondContact O-CG1 3.43Å
418	P	55.4	Low	60	Low	64 Å²	64	69.7 Å²	69.7	42%	0.416	36%	0.357	S	S	.	.	H	α-helix	trans	-57.7	-42.8	-175.9	21.9	-33.3	0	0	0	113.4	N420 I421	P418-N420 PolarHBondContact O-N 2.9Å; P418-I421 PolarHBondContact O-N 2.86Å
419	D	54.6	Low	57.8	Low	118 Å²	118	75.3 Å²	75.3	63%	0.631	38%	0.383	S	S	*	.	H	α-helix	trans	-61.4	-22.7	-172.5	-52.1	-29.1	0	0	0	114.3	N417	N417-D419 PolarHBondContact O-N 2.9Å
420	N	50.8	Low	55.3	Low	49 Å²	49	81.6 Å²	81.6	26%	0.262	41%	0.413	S	S	.	.	H	α-helix	trans	-83.1	-23.9	177.8	-73.6	-32.2	0	0	0	113.2	Q414 N417 P418 K423	Q414-N420 PolarHBondContact OE1-ND2 3.28Å; N417-N420 PolarHBondContact ND2-ND2 2.81Å; N417-N420 PolarHBondContact O-N 2.67Å; P418-N420 PolarHBondContact O-N 2.9Å; N420-K423 PolarHBondContact O-N 3.31Å
421	I	45.2	Very low	53	Low	28 Å²	28	81.9 Å²	81.9	14%	0.144	42%	0.42	C	S	.	.	H	α-helix	trans	-82.9	-37.8	-160.9	-68.3	167.5	0	0	0	111.3	N417 P418 K423 K424 E425 R514	N417-I421 WeakPolarHBondContact O-CD1 3.42Å; N417-I421 WeakPolarHBondContact O-CG1 3.43Å; P418-I421 PolarHBondContact O-N 2.86Å; I421-K423 PolarHBondContact O-N 3.26Å; I421-K423 VanDerWaalsContact O-N 3.11Å; I421-K424 PolarHBondContact O-N 3.31Å; I421-E425 HydrophobicContact CG2-CG 4.33Å; I421-E425 PolarHBondContact O-N 2.95Å; I421-R514 VanDerWaalsContact CD1-CZ 3.4Å
422	C	39.4	Very low	50.8	Low	84 Å²	84	86.2 Å²	86.2	57%	0.568	44%	0.438	S	S	*	.	H	α-helix	trans	-54.8	-32.4	171.5	-57.9	0	0	0	0	112.6	M426	C422-M426 WeakPolarHBondContact O-CB 3.46Å; C422-M426 WeakPolarHBondContact O-CG 3.46Å; C422-M426 PolarHBondContact O-N 3.14Å; C422-M426 VanDerWaalsContact O-N 3.11Å
423	K	40.5	Very low	48.4	Very low	152 Å²	152	91.7 Å²	91.7	66%	0.661	47%	0.471	S	S	*	.	H	α-helix	trans	-70.1	-34.4	175.8	-65.2	-179.5	-180	174.1	0	112.9	N420 I421 L427	N420-K423 PolarHBondContact O-N 3.31Å; I421-K423 PolarHBondContact O-N 3.26Å; I421-K423 VanDerWaalsContact O-N 3.11Å; K423-L427 PolarHBondContact O-N 2.66Å
424	K	37.7	Very low	45.9	Very low	151 Å²	151	96.1 Å²	96.1	66%	0.657	50%	0.501	S	S	*	.	H	α-helix	trans	-74.1	-43.2	175.4	-83	-173.3	171.2	-178.3	0	111.8	I421 M426 L427 I428	I421-K424 PolarHBondContact O-N 3.31Å; K424-M426 PolarHBondContact O-N 2.82Å; K424-L427 PolarHBondContact O-N 2.84Å; K424-L427 VanDerWaalsContact O-N 3.17Å; K424-I428 WeakPolarHBondContact O-CG1 3.42Å; K424-I428 PolarHBondContact O-N 2.66Å
425	E	33.8	Very low	43.4	Very low	115 Å²	115	96.7 Å²	96.7	54%	0.537	52%	0.516	S	S	.	.	H	α-helix	trans	-63.9	-40.2	179.1	-68.5	179.7	157.6	0	0	111.9	I421 L427 I428 Q429	I421-E425 HydrophobicContact CG2-CG 4.33Å; I421-E425 PolarHBondContact O-N 2.95Å; E425-L427 PolarHBondContact O-N 3.37Å; E425-I428 PolarHBondContact O-N 3.47Å; E425-Q429 PolarHBondContact O-N 3.39Å; E425-Q429 VanDerWaalsContact O-N 3.11Å
426	M	33.8	Very low	41	Very low	116 Å²	116	98.6 Å²	98.6	57%	0.571	54%	0.535	S	S	*	.	H	α-helix	trans	-64.1	-35.3	172.6	-72.9	-166	78.2	0	0	113.3	C422 K424 Q429 Q430	C422-M426 WeakPolarHBondContact O-CB 3.46Å; C422-M426 WeakPolarHBondContact O-CG 3.46Å; C422-M426 PolarHBondContact O-N 3.14Å; C422-M426 VanDerWaalsContact O-N 3.11Å; K424-M426 PolarHBondContact O-N 2.82Å; M426-Q429 PolarHBondContact O-N 2.9Å; M426-Q430 WeakPolarHBondContact O-CG 3.31Å; M426-Q430 PolarHBondContact O-N 3.23Å; M426-Q430 VanDerWaalsContact O-N 3.14Å
427	L	37.7	Very low	38.8	Very low	117 Å²	117	103.1 Å²	103.1	61%	0.613	57%	0.569	S	S	*	*	H	α-helix	trans	-65.7	-41.1	174.9	-112.8	80.6	0	0	0	112.1	K423 K424 E425 Q429 Q430 S431	K423-L427 PolarHBondContact O-N 2.66Å; K424-L427 PolarHBondContact O-N 2.84Å; K424-L427 VanDerWaalsContact O-N 3.17Å; E425-L427 PolarHBondContact O-N 3.37Å; L427-Q429 VanDerWaalsContact C-N 3.28Å; L427-Q429 PolarHBondContact O-N 2.96Å; L427-Q430 PolarHBondContact O-N 3.38Å; L427-Q430 VanDerWaalsContact O-N 3.09Å; L427-S431 PolarHBondContact O-N 3.08Å
428	I	36.8	Very low	36.8	Very low	104 Å²	104	109.1 Å²	109.1	53%	0.533	61%	0.606	S	S	.	*	H	α-helix	trans	-65.5	-33.3	178.5	-66.1	164.1	0	0	0	111.1	K424 E425 S431	K424-I428 WeakPolarHBondContact O-CG1 3.42Å; K424-I428 PolarHBondContact O-N 2.66Å; E425-I428 PolarHBondContact O-N 3.47Å; I428-S431 PolarHBondContact O-OG 3.25Å
429	Q	32.3	Very low	35.4	Very low	145 Å²	145	114.7 Å²	114.7	68%	0.678	63%	0.627	S	S	*	*	H	α-helix	trans	-69.9	-32	171.8	-70.3	-177.2	2.1	0	0	112.8	E425 M426 L427	E425-Q429 PolarHBondContact O-N 3.39Å; E425-Q429 VanDerWaalsContact O-N 3.11Å; M426-Q429 PolarHBondContact O-N 2.9Å; L427-Q429 VanDerWaalsContact C-N 3.28Å; L427-Q429 PolarHBondContact O-N 2.96Å
430	Q	35.7	Very low	34.1	Very low	132 Å²	132	116.2 Å²	116.2	62%	0.617	64%	0.635	S	S	*	*	H	α-helix	trans	-76.1	-34.4	177.8	-73.6	-179.3	-9.6	0	0	113.3	M426 L427 N432	M426-Q430 WeakPolarHBondContact O-CG 3.31Å; M426-Q430 PolarHBondContact O-N 3.23Å; M426-Q430 VanDerWaalsContact O-N 3.14Å; L427-Q430 PolarHBondContact O-N 3.38Å; L427-Q430 VanDerWaalsContact O-N 3.09Å; Q430-N432 VanDerWaalsContact C-N 3.31Å; Q430-N432 PolarHBondContact O-N 3.39Å
431	S	37.3	Very low	33	Very low	72 Å²	72	121 Å²	121	50%	0.503	66%	0.66	S	S	.	*	H	α-helix	trans	-65.2	-32.1	178.9	52.8	0	0	0	0	113.5	L427 I428 V433	L427-S431 PolarHBondContact O-N 3.08Å; I428-S431 PolarHBondContact O-OG 3.25Å; S431-V433 PolarHBondContact O-N 3.04Å
432	N	33.2	Very low	32.2	Very low	131 Å²	131	127 Å²	127	70%	0.701	69%	0.693	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.9	2.6	-172.1	-73.3	10.4	0	0	0	115.1	Q430	Q430-N432 VanDerWaalsContact C-N 3.31Å; Q430-N432 PolarHBondContact O-N 3.39Å
433	V	32.2	Very low	31.5	Very low	114 Å²	114	130.7 Å²	130.7	69%	0.691	71%	0.705	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.7	-18.4	-178.2	-176.1	0	0	0	0	112.8	S431	S431-V433 PolarHBondContact O-N 3.04Å
434	V	31.6	Very low	30.8	Very low	126 Å²	126	129.7 Å²	129.7	76%	0.764	71%	0.712	S	S	*	*			trans	-106.8	70.4	-175.6	-168.5	0	0	0	0	110.9
435	S	28.7	Very low	30.1	Very low	116 Å²	116	131 Å²	131	81%	0.811	72%	0.721	S	S	*	*			trans	-154	57.9	174.4	-76.3	0	0	0	0	112.1
436	S	24.6	Very low	29.6	Very low	104 Å²	104	131.5 Å²	131.5	73%	0.727	74%	0.737	S	S	*	*			trans	-140	148.1	168.5	62.7	0	0	0	0	111
437	S	24.8	Very low	29.1	Very low	112 Å²	112	129.6 Å²	129.6	78%	0.783	75%	0.747	S	S	*	*			trans	58.8	81.7	-179.1	62.5	0	0	0	0	117.7
438	T	27.7	Very low	28.5	Very low	141 Å²	141	135.4 Å²	135.4	87%	0.865	76%	0.761	S	S	*	*				-160.9	114.2	110.3	5.4	0	0	0	0	110.8
439	Q	25	Very low	27.9	Very low	181 Å²	181	139.9 Å²	139.9	85%	0.846	78%	0.779	S	S	*	*			trans	-84.2	133.2	163.6	-71.7	177.1	-36	0	0	108.5
440	N	27.9	Very low	27.6	Very low	150 Å²	150	141 Å²	141	80%	0.802	79%	0.785	S	S	*	*			trans	-155.7	97.6	157.9	-103.8	-29.3	0	0	0	109	N442	N440-N442 PolarHBondContact O-N 2.64Å
441	N	26.7	Very low	27.1	Very low	149 Å²	149	142.3 Å²	142.3	80%	0.797	80%	0.795	S	S	*	*			trans	-76.8	117.4	174.8	-64.2	-16.9	0	0	0	108.9
442	N	28.5	Very low	26.6	Very low	155 Å²	155	145.6 Å²	145.6	83%	0.829	81%	0.808	S	S	*	*			trans	-135.2	109.5	159.5	-91.1	-40.4	0	0	0	108.4	N440	N440-N442 PolarHBondContact O-N 2.64Å
443	I	25.7	Very low	26.3	Very low	161 Å²	161	142.4 Å²	142.4	83%	0.826	81%	0.806	S	S	*	*			trans	-93.5	121.3	178.6	-61.1	168.6	0	0	0	107.5
444	T	24.6	Very low	26.2	Very low	132 Å²	132	140.3 Å²	140.3	81%	0.81	80%	0.8	S	S	*	*			trans	-158.4	143.6	152.7	-10.1	0	0	0	0	110.6
445	E	23.2	Very low	26.1	Very low	179 Å²	179	141.2 Å²	141.2	84%	0.836	80%	0.801	S	S	*	*			trans	-73.9	137.5	-166.7	-58.2	147.7	122.2	0	0	112.7
446	S	22.6	Very low	26.1	Very low	125 Å²	125	144 Å²	144	87%	0.874	80%	0.801	S	S	*	*				154.6	128.8	116	55.3	0	0	0	0	112.3
447	G	24	Very low	26.5	Very low	75 Å²	75	144.6 Å²	144.6	77%	0.773	80%	0.8	S	S	*	*	S	Bend	trans	136.3	77.6	169.7	0	0	0	0	0	115.6
448	R	25.7	Very low	27.3	Very low	240 Å²	240	144.9 Å²	144.9	91%	0.906	79%	0.793	S	S	*	*			trans	35.7	95.8	157.7	-64.6	180	-178.9	164.4	1.5	116.1	E450	R448-E450 PolarHBondContact O-N 3.13Å; R448-E450 VanDerWaalsContact O-N 3.08Å
449	E	23.4	Very low	28.1	Very low	197 Å²	197	144.3 Å²	144.3	92%	0.921	78%	0.776	S	S	*	*			trans	-60.3	108.9	163.3	-64.1	169.6	144.1	0	0	109.6	D451	E449-D451 PolarHBondContact O-N 3.08Å
450	E	26.5	Very low	29.4	Very low	170 Å²	170	143.1 Å²	143.1	79%	0.794	77%	0.765	S	S	*	*			trans	-74.2	117.2	157.3	-70.7	-168.6	156.8	0	0	107.2	R448 N452	R448-E450 PolarHBondContact O-N 3.13Å; R448-E450 VanDerWaalsContact O-N 3.08Å; E450-N452 PolarHBondContact O-N 3.08Å; E450-N452 PolarHBondContact O-ND2 2.8Å
451	D	26	Very low	31.3	Very low	158 Å²	158	138 Å²	138	85%	0.845	74%	0.741	S	S	*	*			trans	-67	97.8	-170.1	-171	3.6	0	0	0	111.1	E449 G453	E449-D451 PolarHBondContact O-N 3.08Å; D451-G453 PolarHBondContact O-N 3.09Å
452	N	26	Very low	33.4	Very low	142 Å²	142	133 Å²	133	76%	0.759	71%	0.713	S	S	*	*			trans	-80.3	59.1	-173.9	-87.5	-85.4	0	0	0	111.8	E450 A454	E450-N452 PolarHBondContact O-N 3.08Å; E450-N452 PolarHBondContact O-ND2 2.8Å; N452-A454 PolarHBondContact O-N 3.27Å
453	G	26.1	Very low	35.5	Very low	64 Å²	64	127.4 Å²	127.4	66%	0.66	68%	0.684	S	S	*	*			trans	-67.9	43.7	172.5	0	0	0	0	0	114.4	D451 N455	D451-G453 PolarHBondContact O-N 3.09Å; G453-N455 PolarHBondContact O-N 3Å
454	A	29.9	Very low	37.7	Very low	69 Å²	69	120.8 Å²	120.8	57%	0.57	65%	0.65	S	S	*	*			trans	-97.3	83.1	-170.5	0	0	0	0	0	112.3	N452	N452-A454 PolarHBondContact O-N 3.27Å
455	N	31.3	Very low	40.3	Very low	146 Å²	146	114.9 Å²	114.9	78%	0.781	61%	0.613	S	S	*	*	S	Bend	trans	-165.2	-26.7	150.9	-101.3	-39.2	0	0	0	115.8	G453 T457	G453-N455 PolarHBondContact O-N 3Å; N455-T457 VanDerWaalsContact C-N 3.33Å; N455-T457 PolarHBondContact O-N 2.83Å
456	E	27.9	Very low	43	Very low	173 Å²	173	106.4 Å²	106.4	81%	0.808	57%	0.573	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72	-22.6	-175.2	-64	-166.4	148.7	0	0	114.6	N458	E456-N458 PolarHBondContact O-N 3.16Å; E456-N458 VanDerWaalsContact O-N 3.1Å
457	T	33.7	Very low	45.8	Very low	117 Å²	117	101.2 Å²	101.2	72%	0.718	54%	0.535	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.7	-12.2	-170.5	42	0	0	0	0	115.6	N455	N455-T457 VanDerWaalsContact C-N 3.33Å; N455-T457 PolarHBondContact O-N 2.83Å
458	N	41.6	Very low	48.7	Very low	119 Å²	119	98 Å²	98	64%	0.636	50%	0.5	S	S	*	.	H	α-helix	trans	-79.8	-29.7	-171.5	-137.5	-1.7	0	0	0	113.7	E456 S461	E456-N458 PolarHBondContact O-N 3.16Å; E456-N458 VanDerWaalsContact O-N 3.1Å; N458-S461 VanDerWaalsContact O-CB 3.31Å; N458-S461 WeakPolarHBondContact O-CB 3.15Å; N458-S461 PolarHBondContact O-N 3.38Å
459	Y	44.3	Very low	51.7	Low	129 Å²	129	86.7 Å²	86.7	51%	0.506	46%	0.457	S	S	.	.	H	α-helix	trans	-71.2	-46.2	-172.2	-76.8	-96.4	0	0	0	113.4	S461 I462 H518	Y459-S461 PolarHBondContact O-N 2.91Å; Y459-I462 PolarHBondContact O-N 3.41Å; Y459-H518 HydrophobicContact CD1-CB 3.85Å; Y459-H518 AromaticContact CD1-CG 3.83Å; Y459-H518 AromaticContact CD1-ND1 3.25Å; Y459-H518 WeakPolarHBondContact CD1-ND1 3.34Å; Y459-H518 WeakPolarHBondContact CD1-O 3.3Å; Y459-H518 HydrophobicContact CE1-CB 4.4Å; Y459-H518 AromaticContact CE1-ND1 3.4Å; Y459-H518 WeakPolarHBondContact CE1-ND1 3.37Å
460	Y	52.8	Low	54.7	Low	155 Å²	155	78.8 Å²	78.8	61%	0.608	42%	0.421	S	S	*	.	H	α-helix	trans	-59.9	-27.8	178.6	-79.6	-83.6	0	0	0	113.1	I462 L463 D464	Y460-I462 PolarHBondContact O-N 2.86Å; Y460-L463 PolarHBondContact O-N 3.13Å; Y460-D464 PolarHBondContact O-N 3.22Å
461	S	66.9	Low	57.7	Low	42 Å²	42	70.9 Å²	70.9	29%	0.294	39%	0.385	S	S	.	.	H	α-helix	trans	-55.1	-53.7	179.5	-167	0	0	0	0	111.6	N458 Y459 L463 D464 E465	N458-S461 VanDerWaalsContact O-CB 3.31Å; N458-S461 WeakPolarHBondContact O-CB 3.15Å; N458-S461 PolarHBondContact O-N 3.38Å; Y459-S461 PolarHBondContact O-N 2.91Å; S461-L463 VanDerWaalsContact C-N 3.27Å; S461-L463 PolarHBondContact O-N 3.45Å; S461-L463 VanDerWaalsContact O-N 3.17Å; S461-D464 CarbonylContact O-C 3.53Å; S461-D464 PolarHBondContact O-N 3.42Å; S461-E465 VanDerWaalsContact O-CG 3.26Å; S461-E465 WeakPolarHBondContact O-CG 3.45Å; S461-E465 PolarHBondContact O-N 2.9Å
462	I	71.2	Confident	60.8	Low	44 Å²	44	63.5 Å²	63.5	23%	0.226	35%	0.345	C	S	.	.	H	α-helix	trans	-66.2	-27.1	-170	-70	166.9	0	0	0	112.9	F416 Y459 Y460 S466 H518	F416-I462 HydrophobicContact CE1-CG2 4.34Å; Y459-I462 PolarHBondContact O-N 3.41Å; Y460-I462 PolarHBondContact O-N 2.86Å; I462-S466 WeakPolarHBondContact O-CB 3.43Å; I462-S466 PolarHBondContact O-N 2.84Å; I462-S466 VanDerWaalsContact O-N 3.09Å; I462-S466 PolarHBondContact O-OG 3.41Å; I462-H518 VanDerWaalsContact CD1-NE2 3.27Å; I462-H518 WeakPolarHBondContact CD1-NE2 3.46Å
463	L	71.3	Confident	64	Low	39 Å²	39	56.7 Å²	56.7	20%	0.204	31%	0.309	C	S	.	.	H	α-helix	trans	-75.8	-42.9	172.9	-160.5	68.1	0	0	0	111.7	Y460 S461 E465 S466 E467 I543	Y460-L463 PolarHBondContact O-N 3.13Å; S461-L463 VanDerWaalsContact C-N 3.27Å; S461-L463 PolarHBondContact O-N 3.45Å; S461-L463 VanDerWaalsContact O-N 3.17Å; L463-E465 VanDerWaalsContact C-N 3.3Å; L463-E465 PolarHBondContact O-N 3.13Å; L463-S466 WeakPolarHBondContact O-CB 3.43Å; L463-S466 PolarHBondContact O-N 2.69Å; L463-S466 VanDerWaalsContact O-N 3.11Å; L463-E467 PolarHBondContact O-N 2.93Å; L463-I543 HydrophobicContact CD1-CD1 3.79Å; L463-I543 HydrophobicContact CG-CD1 4.18Å
464	D	72.1	Confident	67.1	Low	21 Å²	21	54.9 Å²	54.9	11%	0.112	28%	0.284	C	S	.	.	H	α-helix	trans	-63.7	-34.9	174.5	-65.2	-23.7	0	0	0	112.1	R307 Y460 S461 R468	R307-D464 IonicContact CZ-OD1 3.15Å; R307-D464 IonicContact CZ-OD2 3.33Å; R307-D464 IonicContact NE-OD1 3.77Å; R307-D464 IonicContact NE-OD2 3.25Å; R307-D464 PolarHBondContact NE-OD2 3.46Å; R307-D464 IonicContact NH2-OD1 3.39Å; R307-D464 IonicContact NH2-OD2 2.75Å; R307-D464 PolarHBondContact NH2-OD2 3.42Å; Y460-D464 PolarHBondContact O-N 3.22Å; S461-D464 CarbonylContact O-C 3.53Å; S461-D464 PolarHBondContact O-N 3.42Å; D464-R468 WeakPolarHBondContact O-CB 3.31Å; D464-R468 PolarHBondContact O-N 3.14Å
465	E	79.7	Confident	70.1	Confident	9 Å²	9	51.7 Å²	51.7	4%	0.042	26%	0.258	C	S	.	.	H	α-helix	trans	-62.9	-42.8	170	-68.4	-59.2	122.5	0	0	111.6	I415 F416 S461 L463 R468 M469	I415-E465 HydrophobicContact CD1-CG 4.01Å; I415-E465 VanDerWaalsContact CD1-OE2 3.24Å; I415-E465 WeakPolarHBondContact CD1-OE2 3.34Å; I415-E465 HydrophobicContact CG2-CG 4.49Å; F416-E465 HydrophobicContact CE2-CB 3.81Å; F416-E465 HydrophobicContact CZ-CB 3.91Å; S461-E465 VanDerWaalsContact O-CG 3.26Å; S461-E465 WeakPolarHBondContact O-CG 3.45Å; S461-E465 PolarHBondContact O-N 2.9Å; L463-E465 VanDerWaalsContact C-N 3.3Å; L463-E465 PolarHBondContact O-N 3.13Å; E465-R468 PolarHBondContact O-N 3.16Å; E465-R468 IonicContact OE1-CZ 2.72Å; E465-R468 VanDerWaalsContact OE1-CZ 3.25Å; E465-R468 IonicContact OE1-NH1 2.88Å; E465-R468 PolarHBondContact OE1-NH1 3.35Å; E465-R468 IonicContact OE1-NH2 3.97Å; E465-R468 PolarHBondContact OE1-NH2 2.86Å; E465-R468 IonicContact OE2-CZ 3.76Å; E465-R468 IonicContact OE2-NH1 2.92Å; E465-R468 PolarHBondContact OE2-NH1 3.19Å; E465-R468 IonicContact OE2-NH2 3.15Å; E465-R468 PolarHBondContact OE2-NH2 3.39Å; E465-M469 WeakPolarHBondContact O-CB 3.29Å; E465-M469 PolarHBondContact O-N 3.28Å
466	S	81	Confident	73.1	Confident	0 Å²	0	44.8 Å²	44.8	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-66.5	-39	178.6	-59.6	0	0	0	0	112	I462 L463 M469 L470	I462-S466 WeakPolarHBondContact O-CB 3.43Å; I462-S466 PolarHBondContact O-N 2.84Å; I462-S466 VanDerWaalsContact O-N 3.09Å; I462-S466 PolarHBondContact O-OG 3.41Å; L463-S466 WeakPolarHBondContact O-CB 3.43Å; L463-S466 PolarHBondContact O-N 2.69Å; L463-S466 VanDerWaalsContact O-N 3.11Å; S466-M469 WeakPolarHBondContact O-CB 3.3Å; S466-M469 PolarHBondContact O-N 3.18Å; S466-L470 PolarHBondContact O-N 3.36Å
467	E	81	Confident	76.2	Confident	17 Å²	17	37.3 Å²	37.3	8%	0.079	19%	0.187	C	C	.	.	H	α-helix	trans	-67.2	-37.9	172.1	-72.8	-175.4	-176.3	0	0	112.6	R314 L463 M469 L470 A471 R539 I543	R314-E467 IonicContact CZ-OE2 3.11Å; R314-E467 IonicContact NH2-OE2 2.72Å; R314-E467 PolarHBondContact NH2-OE2 3.36Å; L463-E467 PolarHBondContact O-N 2.93Å; E467-M469 VanDerWaalsContact C-N 3.35Å; E467-L470 WeakPolarHBondContact O-CB 3.39Å; E467-L470 PolarHBondContact O-N 3.47Å; E467-A471 PolarHBondContact O-N 3.47Å; E467-R539 IonicContact OE1-CZ 2.81Å; E467-R539 IonicContact OE1-NE 3.55Å; E467-R539 IonicContact OE1-NH2 2.91Å; E467-R539 PolarHBondContact OE1-NH2 2.96Å; E467-I543 HydrophobicContact CG-CD1 3.98Å
468	R	84.1	Confident	79	Confident	8 Å²	8	32.9 Å²	32.9	3%	0.03	16%	0.158	C	C	.	.	H	α-helix	trans	-66.9	-37	175.8	-166	162.5	75.2	-91.7	7.8	112.3	S306 S310 L313 E408 I412 D464 E465 A471 L472	S306-R468 VanDerWaalsContact CB-NH1 3.26Å; S306-R468 WeakPolarHBondContact O-CD 3.48Å; S310-R468 WeakPolarHBondContact OG-CA 3.48Å; L313-R468 HydrophobicContact CD1-CG 3.98Å; E408-R468 IonicContact OE1-CZ 2.72Å; E408-R468 IonicContact OE1-NE 3.73Å; E408-R468 PolarHBondContact OE1-NE 3.13Å; E408-R468 IonicContact OE1-NH2 2.76Å; E408-R468 PolarHBondContact OE1-NH2 2.93Å; E408-R468 IonicContact OE2-NE 2.84Å; I412-R468 HydrophobicContact CD1-CB 4.29Å; I412-R468 HydrophobicContact CD1-CG 4.01Å; D464-R468 WeakPolarHBondContact O-CB 3.31Å; D464-R468 PolarHBondContact O-N 3.14Å; E465-R468 PolarHBondContact O-N 3.16Å; E465-R468 IonicContact OE1-CZ 2.72Å; E465-R468 VanDerWaalsContact OE1-CZ 3.25Å; E465-R468 IonicContact OE1-NH1 2.88Å; E465-R468 PolarHBondContact OE1-NH1 3.35Å; E465-R468 IonicContact OE1-NH2 3.97Å; E465-R468 PolarHBondContact OE1-NH2 2.86Å; E465-R468 IonicContact OE2-CZ 3.76Å; E465-R468 IonicContact OE2-NH1 2.92Å; E465-R468 PolarHBondContact OE2-NH1 3.19Å; E465-R468 IonicContact OE2-NH2 3.15Å; E465-R468 PolarHBondContact OE2-NH2 3.39Å; R468-A471 PolarHBondContact O-N 3.45Å; R468-L472 PolarHBondContact O-N 3.4Å
469	M	88.2	Confident	81.3	Confident	2 Å²	2	27.2 Å²	27.2	1%	0.01	13%	0.128	C	C	.	.	H	α-helix	trans	-60	-44.2	169.6	-176.8	-171.9	-68.9	0	0	111.5	I412 F416 E465 S466 E467 A471 L472 L473 I500 C504 F511 L547	I412-M469 HydrophobicContact CG2-CB 4.19Å; I412-M469 HydrophobicContact CG2-CE 3.55Å; I412-M469 HydrophobicContact CG2-CG 4.4Å; F416-M469 HydrophobicContact CB-CE 4.21Å; F416-M469 HydrophobicContact CD1-CE 4.33Å; F416-M469 HydrophobicContact CD2-CE 3.2Å; F416-M469 HydrophobicContact CE2-CE 3.49Å; F416-M469 VanDerWaalsContact CE2-CE 3.49Å; F416-M469 HydrophobicContact CG-CE 3.67Å; F416-M469 HydrophobicContact CZ-CE 4.18Å; E465-M469 WeakPolarHBondContact O-CB 3.29Å; E465-M469 PolarHBondContact O-N 3.28Å; S466-M469 WeakPolarHBondContact O-CB 3.3Å; S466-M469 PolarHBondContact O-N 3.18Å; E467-M469 VanDerWaalsContact C-N 3.35Å; M469-A471 PolarHBondContact O-N 2.94Å; M469-L472 PolarHBondContact O-N 3.42Å; M469-L473 WeakPolarHBondContact O-CG 3.46Å; M469-L473 PolarHBondContact O-N 3.28Å; M469-I500 HydrophobicContact CE-CG2 3.87Å; M469-I500 HydrophobicContact CG-CG2 3.72Å; M469-I500 HydrophobicContact SD-CG2 3.63Å; M469-C504 PolarHBondContact SD-SG 3.15Å; M469-F511 HydrophobicContact SD-CZ 4.33Å; M469-L547 HydrophobicContact CB-CD2 4.07Å; M469-L547 HydrophobicContact CG-CD2 3.78Å; M469-L547 HydrophobicContact SD-CD1 4.31Å; M469-L547 HydrophobicContact SD-CD2 3.81Å
470	L	88.2	Confident	83.7	Confident	30 Å²	30	21.1 Å²	21.1	16%	0.157	10%	0.103	C	C	.	.	H	α-helix	trans	-63.1	-41.4	176	-175.7	62	0	0	0	112	S466 E467 L472 L473 N474 E546 L547 A550	S466-L470 PolarHBondContact O-N 3.36Å; E467-L470 WeakPolarHBondContact O-CB 3.39Å; E467-L470 PolarHBondContact O-N 3.47Å; L470-L472 PolarHBondContact O-N 2.88Å; L470-L473 PolarHBondContact O-N 2.86Å; L470-N474 VanDerWaalsContact CD1-ND2 3.33Å; L470-N474 WeakPolarHBondContact CD1-ND2 3.32Å; L470-N474 PolarHBondContact O-ND2 2.93Å; L470-E546 HydrophobicContact CD1-CB 3.98Å; L470-E546 HydrophobicContact CD2-CB 3.84Å; L470-L547 HydrophobicContact CB-CD2 3.8Å; L470-L547 HydrophobicContact CB-CG 4.43Å; L470-L547 HydrophobicContact CD1-CD2 4.21Å; L470-L547 HydrophobicContact CD1-CG 4.5Å; L470-A550 HydrophobicContact CD1-CB 3.66Å
471	A	87.8	Confident	85.6	Confident	5 Å²	5	14.2 Å²	14.2	4%	0.041	8%	0.078	C	C	.	.	H	α-helix	trans	-63	-37.7	176.6	0	0	0	0	0	112.7	L313 R314 E467 R468 M469 L473 L475	L313-A471 HydrophobicContact CB-CB 3.9Å; L313-A471 HydrophobicContact CD1-CB 4.21Å; R314-A471 HydrophobicContact CG-CB 3.95Å; E467-A471 PolarHBondContact O-N 3.47Å; R468-A471 PolarHBondContact O-N 3.45Å; M469-A471 PolarHBondContact O-N 2.94Å; A471-L473 VanDerWaalsContact C-N 3.35Å; A471-L473 PolarHBondContact O-N 3.32Å; A471-L475 VanDerWaalsContact O-CB 3.27Å; A471-L475 WeakPolarHBondContact O-CB 3.21Å
472	L	91.2	Very high	86.5	Confident	2 Å²	2	18.1 Å²	18.1	1%	0.01	10%	0.095	C	C	.	.	H	α-helix	trans	-61.5	-38.3	173.9	-79.6	173.3	0	0	0	112.7	L313 L405 V409 I412 R468 M469 L470 A476 L497	L313-L472 HydrophobicContact CD1-CD2 3.6Å; L313-L472 HydrophobicContact CD1-CG 3.62Å; L313-L472 HydrophobicContact CD2-CD2 3.77Å; L313-L472 HydrophobicContact CG-CD2 4.35Å; L405-L472 HydrophobicContact CD1-CD2 4.32Å; L405-L472 HydrophobicContact CD2-CD2 4.47Å; V409-L472 HydrophobicContact CG2-CD1 4.12Å; I412-L472 HydrophobicContact CD1-CD1 3.56Å; R468-L472 PolarHBondContact O-N 3.4Å; M469-L472 PolarHBondContact O-N 3.42Å; L470-L472 PolarHBondContact O-N 2.88Å; L472-A476 WeakPolarHBondContact O-CB 3.08Å; L472-A476 PolarHBondContact O-N 3.48Å; L472-L497 HydrophobicContact CB-CD1 4.26Å; L472-L497 HydrophobicContact CD1-CD1 4.37Å
473	L	93.8	Very high	87.5	Confident	0 Å²	0	16.8 Å²	16.8	0%	0	9%	0.09	C	C	.	.	H	α-helix	trans	-73.8	-32.7	-172.2	-67.9	168.7	0	0	0	113.8	M469 L470 A471 L475 A476 D477 L497 L547 A550 A551 L554	M469-L473 WeakPolarHBondContact O-CG 3.46Å; M469-L473 PolarHBondContact O-N 3.28Å; L470-L473 PolarHBondContact O-N 2.86Å; A471-L473 VanDerWaalsContact C-N 3.35Å; A471-L473 PolarHBondContact O-N 3.32Å; L473-L475 VanDerWaalsContact C-N 3.34Å; L473-A476 PolarHBondContact O-N 2.91Å; L473-A476 VanDerWaalsContact O-N 3.16Å; L473-D477 WeakPolarHBondContact O-CB 3.33Å; L473-D477 PolarHBondContact O-N 3.25Å; L473-L497 HydrophobicContact CD2-CD1 4.34Å; L473-L547 HydrophobicContact CD1-CD2 4.16Å; L473-A550 HydrophobicContact CB-CB 3.82Å; L473-A550 HydrophobicContact CD1-CB 3.88Å; L473-A551 HydrophobicContact CD1-CB 4.42Å; L473-L554 HydrophobicContact CD2-CD2 3.66Å
474	N	92	Very high	88.4	Confident	26 Å²	26	17 Å²	17	14%	0.139	10%	0.097	C	C	.	.	H	α-helix	trans	-91.8	0	-161.7	-81.3	-12.5	0	0	0	123.5	M321 L470 H478 A550	M321-N474 WeakPolarHBondContact CE-O 3.29Å; L470-N474 VanDerWaalsContact CD1-ND2 3.33Å; L470-N474 WeakPolarHBondContact CD1-ND2 3.32Å; L470-N474 PolarHBondContact O-ND2 2.93Å; N474-H478 WeakPolarHBondContact CA-CD2 3.43Å; N474-H478 WeakPolarHBondContact CA-CE1 3.35Å; N474-H478 WeakPolarHBondContact CA-NE2 3.28Å; N474-H478 WeakPolarHBondContact CB-CE1 3.44Å; N474-H478 WeakPolarHBondContact CB-NE2 3.39Å; N474-H478 WeakPolarHBondContact O-CB 3.22Å; N474-H478 PolarHBondContact O-CD2 3.27Å; N474-H478 PolarHBondContact O-CE1 3.11Å; N474-H478 PolarHBondContact O-ND1 2.92Å; N474-H478 PolarHBondContact O-NE2 3.04Å; N474-A550 WeakPolarHBondContact OD1-CB 3.41Å
475	L	91.9	Very high	89.3	Confident	1 Å²	1	19.4 Å²	19.4	1%	0.005	11%	0.108	C	C	.	.	H	α-helix		0	-55.3	0	-179.7	64.5	0	0	0	113.8	L313 M316 N317 F320 A471 L473 H478 L479	L313-L475 HydrophobicContact CB-CD2 4.25Å; L313-L475 HydrophobicContact CD2-CD2 3.45Å; L313-L475 VanDerWaalsContact CD2-CD2 3.45Å; L313-L475 HydrophobicContact CG-CD2 4.44Å; M316-L475 HydrophobicContact CB-CD1 4.11Å; M316-L475 HydrophobicContact CE-CD2 4.05Å; N317-L475 HydrophobicContact CB-CB 4.12Å; N317-L475 HydrophobicContact CB-CD1 4.33Å; F320-L475 HydrophobicContact CD2-CD1 3.65Å; F320-L475 HydrophobicContact CE2-CD1 3.72Å; A471-L475 VanDerWaalsContact O-CB 3.27Å; A471-L475 WeakPolarHBondContact O-CB 3.21Å; L473-L475 VanDerWaalsContact C-N 3.34Å; L475-H478 WeakPolarHBondContact CA-ND1 3.5Å; L475-H478 PolarHBondContact N-CD2 3.48Å; L475-H478 PolarHBondContact N-CE1 3.42Å; L475-H478 VanDerWaalsContact N-CE1 3.25Å; L475-H478 PolarHBondContact N-ND1 3.29Å; L475-H478 CarbonylContact O-C 3.51Å; L475-H478 WeakPolarHBondContact O-CA 3.25Å; L475-H478 WeakPolarHBondContact O-CB 3.48Å; L475-H478 PolarHBondContact O-N 2.95Å; L475-L479 HydrophobicContact CD1-CD1 4.22Å; L475-L479 HydrophobicContact CD1-CG 4.43Å; L475-L479 HydrophobicContact CG-CD1 4.19Å; L475-L479 WeakPolarHBondContact O-CB 3.42Å; L475-L479 WeakPolarHBondContact O-CG 3.48Å; L475-L479 PolarHBondContact O-N 2.72Å
476	A	94	Very high	89.9	Confident	2 Å²	2	19 Å²	19	2%	0.017	11%	0.106	C	C	.	.	H	α-helix	trans	-67.7	-42.5	179.7	0	0	0	0	0	111.6	L472 L473 H478 L479 T480 L490 L497 L554	L472-A476 WeakPolarHBondContact O-CB 3.08Å; L472-A476 PolarHBondContact O-N 3.48Å; L473-A476 PolarHBondContact O-N 2.91Å; L473-A476 VanDerWaalsContact O-N 3.16Å; A476-H478 PolarHBondContact O-N 3.18Å; A476-L479 PolarHBondContact O-N 2.64Å; A476-T480 WeakPolarHBondContact O-CB 3.39Å; A476-T480 VanDerWaalsContact O-CG2 3.27Å; A476-T480 WeakPolarHBondContact O-CG2 3.39Å; A476-T480 PolarHBondContact O-N 3.21Å; A476-T480 VanDerWaalsContact O-N 3.11Å; A476-T480 PolarHBondContact O-OG1 3.12Å; A476-L490 HydrophobicContact CB-CD1 4.49Å; A476-L490 HydrophobicContact CB-CD2 3.97Å; A476-L497 HydrophobicContact CB-CD2 3.85Å; A476-L554 HydrophobicContact CB-CD1 4.25Å; A476-L554 HydrophobicContact CB-CD2 4.18Å
477	D	94.4	Very high	90.5	Very high	16 Å²	16	19 Å²	19	9%	0.086	11%	0.106	C	C	.	.	H	α-helix	trans	-60.8	-28.4	169	177.5	71.2	0	0	0	111.2	L473 T480 T481 L554 N557	L473-D477 WeakPolarHBondContact O-CB 3.33Å; L473-D477 PolarHBondContact O-N 3.25Å; D477-T480 WeakPolarHBondContact CA-OG1 3.37Å; D477-T480 PolarHBondContact O-OG1 3Å; D477-T481 WeakPolarHBondContact O-CB 3.18Å; D477-T481 PolarHBondContact O-N 2.93Å; D477-T481 PolarHBondContact O-OG1 3.2Å; D477-L554 HydrophobicContact CB-CB 4.11Å; D477-L554 HydrophobicContact CB-CD1 4.19Å; D477-L554 VanDerWaalsContact OD1-CA 3.29Å; D477-L554 WeakPolarHBondContact OD1-CA 3.13Å; D477-L554 PolarHBondContact OD1-N 3.43Å; D477-N557 VanDerWaalsContact CG-ND2 3.27Å; D477-N557 PolarHBondContact O-ND2 2.93Å; D477-N557 WeakPolarHBondContact OD1-CB 3.45Å; D477-N557 PolarHBondContact OD1-ND2 2.93Å; D477-N557 PolarHBondContact OD2-ND2 2.88Å
478	H	90.8	Very high	91.1	Very high	23 Å²	23	21.9 Å²	21.9	11%	0.106	12%	0.116	C	C	.	.	H	α-helix	trans	-78.4	-43.1	-177.4	-31.3	-172.4	0	0	0	111.3	N317 F320 M321 Q393 N474 L475 A476 T480	N317-H478 WeakPolarHBondContact CB-ND1 3.35Å; N317-H478 PolarHBondContact ND2-CE1 3.26Å; N317-H478 PolarHBondContact OD1-CE1 2.75Å; N317-H478 PolarHBondContact OD1-ND1 3.4Å; N317-H478 VanDerWaalsContact OD1-ND1 3.13Å; F320-H478 HydrophobicContact CB-CB 4.2Å; M321-H478 HydrophobicContact CE-CB 4.45Å; Q393-H478 PolarHBondContact NE2-O 3.26Å; N474-H478 WeakPolarHBondContact CA-CD2 3.43Å; N474-H478 WeakPolarHBondContact CA-CE1 3.35Å; N474-H478 WeakPolarHBondContact CA-NE2 3.28Å; N474-H478 WeakPolarHBondContact CB-CE1 3.44Å; N474-H478 WeakPolarHBondContact CB-NE2 3.39Å; N474-H478 WeakPolarHBondContact O-CB 3.22Å; N474-H478 PolarHBondContact O-CD2 3.27Å; N474-H478 PolarHBondContact O-CE1 3.11Å; N474-H478 PolarHBondContact O-ND1 2.92Å; N474-H478 PolarHBondContact O-NE2 3.04Å; L475-H478 WeakPolarHBondContact CA-ND1 3.5Å; L475-H478 PolarHBondContact N-CD2 3.48Å; L475-H478 PolarHBondContact N-CE1 3.42Å; L475-H478 VanDerWaalsContact N-CE1 3.25Å; L475-H478 PolarHBondContact N-ND1 3.29Å; L475-H478 CarbonylContact O-C 3.51Å; L475-H478 WeakPolarHBondContact O-CA 3.25Å; L475-H478 WeakPolarHBondContact O-CB 3.48Å; L475-H478 PolarHBondContact O-N 2.95Å; A476-H478 PolarHBondContact O-N 3.18Å; H478-T480 VanDerWaalsContact C-N 3.27Å; H478-T480 PolarHBondContact O-N 3.01Å
479	L	91.7	Very high	91.5	Very high	1 Å²	1	22.6 Å²	22.6	1%	0.005	12%	0.12	C	C	.	.	H	α-helix	trans	-67.2	-26.1	173.1	-75	164.6	0	0	0	112.8	F320 Q393 F396 F402 L475 A476 N486	F320-L479 HydrophobicContact CD1-CD2 4.48Å; F320-L479 HydrophobicContact CE1-CD2 3.7Å; F320-L479 HydrophobicContact CE2-CD2 3.84Å; F320-L479 HydrophobicContact CE2-CG 4.29Å; F320-L479 HydrophobicContact CZ-CD2 3.36Å; F320-L479 HydrophobicContact CZ-CG 4.27Å; Q393-L479 PolarHBondContact NE2-O 3.24Å; F396-L479 HydrophobicContact CB-CD2 3.82Å; F396-L479 HydrophobicContact CD1-CD1 3.95Å; F396-L479 HydrophobicContact CD1-CD2 3.54Å; F396-L479 HydrophobicContact CD1-CG 4.39Å; F396-L479 HydrophobicContact CD2-CD1 4.46Å; F396-L479 HydrophobicContact CD2-CD2 3.91Å; F396-L479 HydrophobicContact CE1-CD1 3.53Å; F396-L479 HydrophobicContact CE1-CD2 4.03Å; F396-L479 HydrophobicContact CE1-CG 4.44Å; F396-L479 HydrophobicContact CE2-CD1 4.08Å; F396-L479 HydrophobicContact CE2-CD2 4.36Å; F396-L479 HydrophobicContact CG-CD1 4.41Å; F396-L479 HydrophobicContact CG-CD2 3.48Å; F396-L479 VanDerWaalsContact CG-CD2 3.48Å; F396-L479 HydrophobicContact CZ-CD1 3.61Å; F396-L479 HydrophobicContact CZ-CD2 4.42Å; F402-L479 HydrophobicContact CE1-CB 4.23Å; F402-L479 HydrophobicContact CE1-CD1 3.93Å; F402-L479 HydrophobicContact CZ-CB 4.29Å; L475-L479 HydrophobicContact CD1-CD1 4.22Å; L475-L479 HydrophobicContact CD1-CG 4.43Å; L475-L479 HydrophobicContact CG-CD1 4.19Å; L475-L479 WeakPolarHBondContact O-CB 3.42Å; L475-L479 WeakPolarHBondContact O-CG 3.48Å; L475-L479 PolarHBondContact O-N 2.72Å; A476-L479 PolarHBondContact O-N 2.64Å; L479-N486 WeakPolarHBondContact O-CB 3.25Å; L479-N486 PolarHBondContact O-ND2 3.25Å
480	T	93	Very high	91.7	Very high	0 Å²	0	22.6 Å²	22.6	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-102.2	-13.4	-177.1	57.1	0	0	0	0	114.1	A476 D477 H478 N482 C483 Q487 L490 L558	A476-T480 WeakPolarHBondContact O-CB 3.39Å; A476-T480 VanDerWaalsContact O-CG2 3.27Å; A476-T480 WeakPolarHBondContact O-CG2 3.39Å; A476-T480 PolarHBondContact O-N 3.21Å; A476-T480 VanDerWaalsContact O-N 3.11Å; A476-T480 PolarHBondContact O-OG1 3.12Å; D477-T480 WeakPolarHBondContact CA-OG1 3.37Å; D477-T480 PolarHBondContact O-OG1 3Å; H478-T480 VanDerWaalsContact C-N 3.27Å; H478-T480 PolarHBondContact O-N 3.01Å; T480-N482 PolarHBondContact O-N 3.13Å; T480-N482 VanDerWaalsContact O-N 3.13Å; T480-C483 PolarHBondContact O-N 3.37Å; T480-Q487 HydrophobicContact CG2-CG 4.31Å; T480-Q487 WeakPolarHBondContact O-CG 3.4Å; T480-Q487 PolarHBondContact O-NE2 2.78Å; T480-L490 HydrophobicContact CG2-CB 3.91Å; T480-L490 HydrophobicContact CG2-CD2 3.7Å; T480-L490 HydrophobicContact CG2-CG 4.4Å; T480-L558 HydrophobicContact CG2-CD2 3.86Å
481	T	92.4	Very high	91.9	Very high	11 Å²	11	21.1 Å²	21.1	7%	0.067	11%	0.113	C	C	.	.	T	Hydrogen-bonded Turn	trans	-48.2	117.4	172.1	-73.6	0	0	0	0	110.6	L389 Q393 D477 C483 N557	L389-T481 HydrophobicContact CD2-CG2 3.99Å; Q393-T481 PolarHBondContact NE2-O 3.45Å; D477-T481 WeakPolarHBondContact O-CB 3.18Å; D477-T481 PolarHBondContact O-N 2.93Å; D477-T481 PolarHBondContact O-OG1 3.2Å; T481-C483 PolarHBondContact O-N 3.28Å; T481-N557 PolarHBondContact OG1-ND2 2.7Å
482	N	87.3	Confident	92.1	Very high	123 Å²	123	24.2 Å²	24.2	66%	0.658	13%	0.126	S	C	*	.	T	Hydrogen-bonded Turn	trans	54	11.4	178.6	-61.5	-14.1	0	0	0	116.8	T480	T480-N482 PolarHBondContact O-N 3.13Å; T480-N482 VanDerWaalsContact O-N 3.13Å
483	C	90.7	Very high	92	Very high	17 Å²	17	31.6 Å²	31.6	12%	0.115	15%	0.154	C	C	.	.			trans	-115.6	91.3	-173.4	-175.3	0	0	0	0	111.7	Q393 T480 T481 E485 N486 Q487	Q393-C483 VanDerWaalsContact OE1-CB 3.28Å; T480-C483 PolarHBondContact O-N 3.37Å; T481-C483 PolarHBondContact O-N 3.28Å; C483-E485 VanDerWaalsContact C-N 3.25Å; C483-E485 PolarHBondContact O-N 3.24Å; C483-E485 VanDerWaalsContact O-N 3.13Å; C483-N486 HydrophobicContact CB-CB 4.02Å; C483-N486 PolarHBondContact O-N 3.08Å; C483-N486 VanDerWaalsContact SG-CG 3.51Å; C483-Q487 WeakPolarHBondContact O-CG 3.11Å; C483-Q487 PolarHBondContact O-N 2.94Å
484	A	91.3	Very high	91.9	Very high	44 Å²	44	31.8 Å²	31.8	36%	0.364	16%	0.155	S	C	.	.	H	α-helix	trans	-48.4	-41	-176	0	0	0	0	0	114.5	R488 L561 S563	A484-R488 PolarHBondContact O-N 2.81Å; A484-L561 HydrophobicContact CB-CD1 3.86Å; A484-S563 WeakPolarHBondContact CA-OG 3.48Å; A484-S563 WeakPolarHBondContact CB-OG 3.47Å; A484-S563 PolarHBondContact O-OG 3.08Å
485	E	90	Very high	91.8	Very high	70 Å²	70	32.7 Å²	32.7	33%	0.327	16%	0.162	S	C	.	.	H	α-helix	trans	-77.5	-32.3	-179.4	179.8	62.4	179.9	0	0	112.5	C483 R488 L489	C483-E485 VanDerWaalsContact C-N 3.25Å; C483-E485 PolarHBondContact O-N 3.24Å; C483-E485 VanDerWaalsContact O-N 3.13Å; E485-R488 IonicContact OE1-CZ 2.77Å; E485-R488 IonicContact OE1-NE 3Å; E485-R488 IonicContact OE1-NH2 3.25Å; E485-R488 PolarHBondContact OE1-NH2 2.99Å; E485-R488 IonicContact OE2-CZ 3.02Å; E485-R488 IonicContact OE2-NE 2.69Å; E485-R488 PolarHBondContact OE2-NE 3.43Å; E485-R488 IonicContact OE2-NH2 3Å; E485-R488 PolarHBondContact OE2-NH2 2.92Å; E485-L489 HydrophobicContact CG-CD1 3.96Å; E485-L489 HydrophobicContact CG-CG 4.48Å; E485-L489 WeakPolarHBondContact O-CB 3.39Å; E485-L489 VanDerWaalsContact O-CG 3.29Å; E485-L489 WeakPolarHBondContact O-CG 3.46Å; E485-L489 PolarHBondContact O-N 2.87Å
486	N	92.9	Very high	91.8	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-74.1	-33.8	174.6	-77.3	11.6	0	0	0	111.2	Q393 R397 F402 L479 C483 L490	Q393-N486 PolarHBondContact O-ND2 3.46Å; R397-N486 WeakPolarHBondContact CD-OD1 3.43Å; R397-N486 PolarHBondContact NH1-OD1 3.49Å; F402-N486 HydrophobicContact CZ-CB 4.11Å; L479-N486 WeakPolarHBondContact O-CB 3.25Å; L479-N486 PolarHBondContact O-ND2 3.25Å; C483-N486 HydrophobicContact CB-CB 4.02Å; C483-N486 PolarHBondContact O-N 3.08Å; C483-N486 VanDerWaalsContact SG-CG 3.51Å; N486-L490 VanDerWaalsContact O-CB 3.3Å; N486-L490 WeakPolarHBondContact O-CB 3.27Å; N486-L490 PolarHBondContact O-N 3.27Å
487	Q	94.4	Very high	91.7	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-58	-53.8	171.1	-67.7	170	10	0	0	110.1	T480 C483 L489 L490 I491 N557 L558 S560	T480-Q487 HydrophobicContact CG2-CG 4.31Å; T480-Q487 WeakPolarHBondContact O-CG 3.4Å; T480-Q487 PolarHBondContact O-NE2 2.78Å; C483-Q487 WeakPolarHBondContact O-CG 3.11Å; C483-Q487 PolarHBondContact O-N 2.94Å; Q487-L489 PolarHBondContact O-N 3.44Å; Q487-L490 PolarHBondContact O-N 3.18Å; Q487-I491 VanDerWaalsContact O-CD1 3.23Å; Q487-I491 WeakPolarHBondContact O-CD1 3.48Å; Q487-I491 VanDerWaalsContact O-CG1 3.28Å; Q487-I491 WeakPolarHBondContact O-CG1 3.4Å; Q487-I491 PolarHBondContact O-N 3.34Å; Q487-N557 PolarHBondContact NE2-O 2.95Å; Q487-N557 VanDerWaalsContact NE2-O 3.13Å; Q487-L558 HydrophobicContact CB-CD2 3.86Å; Q487-L558 HydrophobicContact CG-CD2 4.04Å; Q487-S560 PolarHBondContact NE2-OG 2.91Å
488	R	93.5	Very high	91.6	Very high	79 Å²	79	33 Å²	33	30%	0.298	16%	0.163	S	C	.	.	H	α-helix	trans	-53.5	-54.2	175.8	-178.3	173.9	86.3	81.4	2.5	112.1	A484 E485 L490 I491 E492 S567	A484-R488 PolarHBondContact O-N 2.81Å; E485-R488 IonicContact OE1-CZ 2.77Å; E485-R488 IonicContact OE1-NE 3Å; E485-R488 IonicContact OE1-NH2 3.25Å; E485-R488 PolarHBondContact OE1-NH2 2.99Å; E485-R488 IonicContact OE2-CZ 3.02Å; E485-R488 IonicContact OE2-NE 2.69Å; E485-R488 PolarHBondContact OE2-NE 3.43Å; E485-R488 IonicContact OE2-NH2 3Å; E485-R488 PolarHBondContact OE2-NH2 2.92Å; R488-L490 PolarHBondContact O-N 3.37Å; R488-I491 PolarHBondContact O-N 3.22Å; R488-E492 WeakPolarHBondContact CD-OE1 3.31Å; R488-E492 HydrophobicContact CG-CG 4.43Å; R488-E492 WeakPolarHBondContact CG-OE1 3.44Å; R488-E492 IonicContact CZ-OE1 2.77Å; R488-E492 IonicContact CZ-OE2 3.43Å; R488-E492 IonicContact NE-OE1 2.75Å; R488-E492 IonicContact NH1-OE1 3.62Å; R488-E492 PolarHBondContact NH1-OE1 3.26Å; R488-E492 IonicContact NH1-OE2 3.67Å; R488-E492 PolarHBondContact NH1-OE2 3.45Å; R488-E492 WeakPolarHBondContact O-CB 3.15Å; R488-E492 WeakPolarHBondContact O-CG 3.41Å; R488-E492 PolarHBondContact O-N 2.78Å; R488-S567 WeakPolarHBondContact CG-OG 3.46Å
489	L	91.3	Very high	91.5	Very high	23 Å²	23	35.8 Å²	35.8	12%	0.12	18%	0.175	C	C	.	.	H	α-helix	trans	-68.6	-32.6	-176.9	-71.6	172.6	0	0	0	113.8	R397 F402 E485 Q487 I491 R493	R397-L489 VanDerWaalsContact CD-CD1 3.44Å; R397-L489 HydrophobicContact CG-CD1 3.69Å; F402-L489 HydrophobicContact CD2-CB 4.43Å; F402-L489 HydrophobicContact CE2-CB 4.36Å; E485-L489 HydrophobicContact CG-CD1 3.96Å; E485-L489 HydrophobicContact CG-CG 4.48Å; E485-L489 WeakPolarHBondContact O-CB 3.39Å; E485-L489 VanDerWaalsContact O-CG 3.29Å; E485-L489 WeakPolarHBondContact O-CG 3.46Å; E485-L489 PolarHBondContact O-N 2.87Å; Q487-L489 PolarHBondContact O-N 3.44Å; L489-I491 VanDerWaalsContact C-N 3.32Å; L489-R493 WeakPolarHBondContact O-CB 3.41Å; L489-R493 VanDerWaalsContact O-CG 3.22Å; L489-R493 WeakPolarHBondContact O-CG 3.41Å; L489-R493 PolarHBondContact O-N 2.96Å
490	L	93	Very high	91.3	Very high	1 Å²	1	36.1 Å²	36.1	1%	0.005	18%	0.177	C	C	.	.	H	α-helix	trans	-63.2	-42.7	173.5	-173.9	74.5	0	0	0	110.4	F402 A476 T480 N486 Q487 R488 Q494 L497 L554 L558	F402-L490 HydrophobicContact CD1-CD1 3.62Å; F402-L490 HydrophobicContact CE1-CB 4.23Å; F402-L490 HydrophobicContact CE1-CD1 3.65Å; A476-L490 HydrophobicContact CB-CD1 4.49Å; A476-L490 HydrophobicContact CB-CD2 3.97Å; T480-L490 HydrophobicContact CG2-CB 3.91Å; T480-L490 HydrophobicContact CG2-CD2 3.7Å; T480-L490 HydrophobicContact CG2-CG 4.4Å; N486-L490 VanDerWaalsContact O-CB 3.3Å; N486-L490 WeakPolarHBondContact O-CB 3.27Å; N486-L490 PolarHBondContact O-N 3.27Å; Q487-L490 PolarHBondContact O-N 3.18Å; R488-L490 PolarHBondContact O-N 3.37Å; L490-Q494 HydrophobicContact CD1-CB 4.01Å; L490-Q494 HydrophobicContact CD1-CG 4.1Å; L490-Q494 HydrophobicContact CG-CB 4.48Å; L490-Q494 WeakPolarHBondContact O-CA 3.41Å; L490-Q494 WeakPolarHBondContact O-CB 3.32Å; L490-Q494 PolarHBondContact O-N 3.29Å; L490-L497 HydrophobicContact CD1-CD2 4.01Å; L490-L497 HydrophobicContact CD2-CD2 4.42Å; L490-L554 HydrophobicContact CD2-CD1 3.87Å; L490-L558 HydrophobicContact CD2-CD2 4.34Å
491	I	93	Very high	91.2	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-67.5	-48.8	179.2	-58.9	154.1	0	0	0	110.5	Q487 R488 L489 R493 I498 L558 G564 L568 M571 Y572	Q487-I491 VanDerWaalsContact O-CD1 3.23Å; Q487-I491 WeakPolarHBondContact O-CD1 3.48Å; Q487-I491 VanDerWaalsContact O-CG1 3.28Å; Q487-I491 WeakPolarHBondContact O-CG1 3.4Å; Q487-I491 PolarHBondContact O-N 3.34Å; R488-I491 PolarHBondContact O-N 3.22Å; L489-I491 VanDerWaalsContact C-N 3.32Å; I491-R493 VanDerWaalsContact C-N 3.33Å; I491-R493 PolarHBondContact O-N 3.35Å; I491-I498 HydrophobicContact CG1-CD1 4.26Å; I491-L558 HydrophobicContact CD1-CD2 4.04Å; I491-L558 HydrophobicContact CG1-CD1 4.14Å; I491-L558 HydrophobicContact CG1-CD2 4.07Å; I491-G564 VanDerWaalsContact CD1-O 3.25Å; I491-G564 WeakPolarHBondContact CD1-O 3.44Å; I491-L568 HydrophobicContact CD1-CD2 4.27Å; I491-L568 HydrophobicContact CD1-CG 3.72Å; I491-L568 HydrophobicContact CG1-CD2 4.15Å; I491-L568 HydrophobicContact CG1-CG 4.17Å; I491-L568 HydrophobicContact CG2-CD2 4.39Å; I491-M571 HydrophobicContact CG2-CB 4.45Å; I491-M571 HydrophobicContact CG2-CG 4.43Å; I491-M571 HydrophobicContact CG2-SD 3.93Å; I491-M571 VanDerWaalsContact O-SD 3.38Å; I491-Y572 HydrophobicContact CG2-CE2 4.13Å
492	E	90.7	Very high	91	Very high	69 Å²	69	36.3 Å²	36.3	32%	0.322	18%	0.177	S	C	.	.	H	α-helix	trans	-65.5	-29.7	-179.5	-73.5	175.2	-164.2	0	0	114.1	R488	R488-E492 WeakPolarHBondContact CD-OE1 3.31Å; R488-E492 HydrophobicContact CG-CG 4.43Å; R488-E492 WeakPolarHBondContact CG-OE1 3.44Å; R488-E492 IonicContact CZ-OE1 2.77Å; R488-E492 IonicContact CZ-OE2 3.43Å; R488-E492 IonicContact NE-OE1 2.75Å; R488-E492 IonicContact NH1-OE1 3.62Å; R488-E492 PolarHBondContact NH1-OE1 3.26Å; R488-E492 IonicContact NH1-OE2 3.67Å; R488-E492 PolarHBondContact NH1-OE2 3.45Å; R488-E492 WeakPolarHBondContact O-CB 3.15Å; R488-E492 WeakPolarHBondContact O-CG 3.41Å; R488-E492 PolarHBondContact O-N 2.78Å
493	R	90	Very high	90.8	Very high	158 Å²	158	32.5 Å²	32.5	60%	0.596	16%	0.163	S	C	*	.	H	α-helix	trans	-108.4	-25.3	-173.6	-55.6	-61	178.9	156.5	-2.1	114.6	L489 I491 P495	L489-R493 WeakPolarHBondContact O-CB 3.41Å; L489-R493 VanDerWaalsContact O-CG 3.22Å; L489-R493 WeakPolarHBondContact O-CG 3.41Å; L489-R493 PolarHBondContact O-N 2.96Å; I491-R493 VanDerWaalsContact C-N 3.33Å; I491-R493 PolarHBondContact O-N 3.35Å; R493-P495 VanDerWaalsContact O-CD 3.23Å; R493-P495 WeakPolarHBondContact O-CD 3.44Å
494	Q	91.5	Very high	90.5	Very high	4 Å²	4	31.7 Å²	31.7	2%	0.019	16%	0.157	C	C	.	.			trans	-116.6	58.3	178.6	-71.3	-60.4	-15.3	0	0	113.1	F402 D406 L490 N496 L497 I498	F402-Q494 PolarHBondContact O-NE2 2.92Å; D406-Q494 PolarHBondContact OD1-NE2 3.13Å; L490-Q494 HydrophobicContact CD1-CB 4.01Å; L490-Q494 HydrophobicContact CD1-CG 4.1Å; L490-Q494 HydrophobicContact CG-CB 4.48Å; L490-Q494 WeakPolarHBondContact O-CA 3.41Å; L490-Q494 WeakPolarHBondContact O-CB 3.32Å; L490-Q494 PolarHBondContact O-N 3.29Å; Q494-N496 PolarHBondContact O-N 3.23Å; Q494-L497 HydrophobicContact CB-CB 3.88Å; Q494-L497 HydrophobicContact CB-CD2 4.45Å; Q494-L497 WeakPolarHBondContact O-CB 3.22Å; Q494-L497 PolarHBondContact O-N 3.48Å; Q494-I498 PolarHBondContact O-N 3.5Å
495	P	90.7	Very high	90.1	Very high	44 Å²	44	29.6 Å²	29.6	29%	0.286	14%	0.14	S	C	.	.	H	α-helix	trans	-65.4	-27.4	-175	27.7	-35.7	0	0	0	113.2	R493 K499 M571 Y572	R493-P495 VanDerWaalsContact O-CD 3.23Å; R493-P495 WeakPolarHBondContact O-CD 3.44Å; P495-K499 WeakPolarHBondContact O-CG 3.34Å; P495-K499 PolarHBondContact O-N 3.17Å; P495-M571 HydrophobicContact CB-CE 4.06Å; P495-Y572 VanDerWaalsContact C-OH 3.27Å; P495-Y572 WeakPolarHBondContact CA-OH 3.36Å; P495-Y572 VanDerWaalsContact CB-OH 3.26Å; P495-Y572 WeakPolarHBondContact CB-OH 3.44Å; P495-Y572 PolarHBondContact O-OH 3.23Å
496	N	90.7	Very high	89.5	Confident	25 Å²	25	28.4 Å²	28.4	13%	0.134	14%	0.136	C	C	.	.	H	α-helix	trans	-74.7	-28.7	175.4	-71.7	-21.2	0	0	0	112.1	V409 D410 Y413 Q494 K499 I500	V409-N496 HydrophobicContact CG1-CB 3.84Å; D410-N496 PolarHBondContact OD1-ND2 3.02Å; Y413-N496 HydrophobicContact CD1-CB 3.95Å; Y413-N496 HydrophobicContact CG-CB 3.95Å; Q494-N496 PolarHBondContact O-N 3.23Å; N496-K499 WeakPolarHBondContact O-CB 3.04Å; N496-K499 PolarHBondContact O-N 2.88Å; N496-K499 WeakPolarHBondContact OD1-CE 3.39Å; N496-K499 PolarHBondContact OD1-NZ 2.91Å; N496-I500 WeakPolarHBondContact O-CG1 3.44Å; N496-I500 PolarHBondContact O-N 2.84Å
497	L	92	Very high	88.6	Confident	1 Å²	1	29.5 Å²	29.5	1%	0.005	14%	0.142	C	C	.	.	H	α-helix	trans	-68.4	-37.8	172.4	-172.6	66.1	0	0	0	111.6	V409 L472 L473 A476 L490 Q494 K499 I500 T501	V409-L497 HydrophobicContact CG1-CB 3.77Å; V409-L497 VanDerWaalsContact CG1-N 3.26Å; V409-L497 HydrophobicContact CG2-CB 4.33Å; V409-L497 HydrophobicContact CG2-CD1 4.41Å; L472-L497 HydrophobicContact CB-CD1 4.26Å; L472-L497 HydrophobicContact CD1-CD1 4.37Å; L473-L497 HydrophobicContact CD2-CD1 4.34Å; A476-L497 HydrophobicContact CB-CD2 3.85Å; L490-L497 HydrophobicContact CD1-CD2 4.01Å; L490-L497 HydrophobicContact CD2-CD2 4.42Å; Q494-L497 HydrophobicContact CB-CB 3.88Å; Q494-L497 HydrophobicContact CB-CD2 4.45Å; Q494-L497 WeakPolarHBondContact O-CB 3.22Å; Q494-L497 PolarHBondContact O-N 3.48Å; L497-K499 VanDerWaalsContact C-N 3.35Å; L497-I500 WeakPolarHBondContact O-CB 3.44Å; L497-I500 PolarHBondContact O-N 3.38Å; L497-T501 WeakPolarHBondContact O-CB 3.44Å; L497-T501 PolarHBondContact O-N 3.19Å; L497-T501 PolarHBondContact O-OG1 3.15Å
498	I	92.5	Very high	87.2	Confident	0 Å²	0	31.7 Å²	31.7	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-67.1	-36.7	175.1	-53.3	-56.5	0	0	0	111	I491 Q494 T501 L502 L558 L568 Y572	I491-I498 HydrophobicContact CG1-CD1 4.26Å; Q494-I498 PolarHBondContact O-N 3.5Å; I498-T501 WeakPolarHBondContact O-CB 3.45Å; I498-T501 PolarHBondContact O-N 3.45Å; I498-L502 HydrophobicContact CG2-CD1 4.47Å; I498-L502 WeakPolarHBondContact O-CG 3.35Å; I498-L502 PolarHBondContact O-N 3.25Å; I498-L558 HydrophobicContact CD1-CD1 3.52Å; I498-L568 HydrophobicContact CG2-CD2 3.79Å; I498-Y572 HydrophobicContact CB-CE1 4.29Å; I498-Y572 HydrophobicContact CB-CE2 3.99Å; I498-Y572 HydrophobicContact CG1-CE2 4.37Å; I498-Y572 HydrophobicContact CG2-CD1 4.44Å; I498-Y572 HydrophobicContact CG2-CD2 4.06Å; I498-Y572 HydrophobicContact CG2-CE1 4.02Å; I498-Y572 HydrophobicContact CG2-CE2 3.65Å; I498-Y572 HydrophobicContact CG2-CG 4.47Å
499	K	88.7	Confident	85.8	Confident	82 Å²	82	33.1 Å²	33.1	36%	0.357	18%	0.177	S	C	.	.	H	α-helix	trans	-61.6	-46.1	170.9	-66.9	174.5	-168	167.9	0	112	Y413 P495 N496 L497 T501 L502 A503 Y572	Y413-K499 HydrophobicContact CE1-CD 4.31Å; Y413-K499 HydrophobicContact CE2-CB 4.07Å; Y413-K499 HydrophobicContact CE2-CD 3.8Å; Y413-K499 WeakPolarHBondContact OH-CD 3.48Å; Y413-K499 PolarHBondContact OH-NZ 3.01Å; P495-K499 WeakPolarHBondContact O-CG 3.34Å; P495-K499 PolarHBondContact O-N 3.17Å; N496-K499 WeakPolarHBondContact O-CB 3.04Å; N496-K499 PolarHBondContact O-N 2.88Å; N496-K499 WeakPolarHBondContact OD1-CE 3.39Å; N496-K499 PolarHBondContact OD1-NZ 2.91Å; L497-K499 VanDerWaalsContact C-N 3.35Å; K499-T501 VanDerWaalsContact C-N 3.31Å; K499-T501 PolarHBondContact O-N 3.3Å; K499-L502 PolarHBondContact O-N 3.23Å; K499-A503 PolarHBondContact O-N 2.94Å; K499-Y572 HydrophobicContact CG-CE1 4.17Å
500	I	88.1	Confident	84.3	Confident	8 Å²	8	37.1 Å²	37.1	4%	0.041	20%	0.195	C	C	.	.	H	α-helix	trans	-56.1	-48.3	173.4	-71.2	165.2	0	0	0	109.8	V409 I412 Y413 M469 N496 L497 L502 A503 C504	V409-I500 HydrophobicContact CG1-CD1 4.43Å; I412-I500 HydrophobicContact CB-CD1 4.48Å; I412-I500 HydrophobicContact CG2-CD1 3.95Å; Y413-I500 HydrophobicContact CD2-CG1 4.19Å; M469-I500 HydrophobicContact CE-CG2 3.87Å; M469-I500 HydrophobicContact CG-CG2 3.72Å; M469-I500 HydrophobicContact SD-CG2 3.63Å; N496-I500 WeakPolarHBondContact O-CG1 3.44Å; N496-I500 PolarHBondContact O-N 2.84Å; L497-I500 WeakPolarHBondContact O-CB 3.44Å; L497-I500 PolarHBondContact O-N 3.38Å; I500-L502 VanDerWaalsContact C-N 3.35Å; I500-L502 PolarHBondContact O-N 3.46Å; I500-A503 CarbonylContact O-C 3.6Å; I500-A503 WeakPolarHBondContact O-CA 3.45Å; I500-A503 WeakPolarHBondContact O-CB 3.45Å; I500-A503 PolarHBondContact O-N 3.45Å; I500-C504 PolarHBondContact O-N 2.94Å; I500-C504 PolarHBondContact O-SG 3.01Å
501	T	90.7	Very high	83.2	Confident	0 Å²	0	37.4 Å²	37.4	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-55.3	-47.2	179	-54.4	0	0	0	0	111.8	L497 I498 K499 C504 I505 A551 L554 L555	L497-T501 WeakPolarHBondContact O-CB 3.44Å; L497-T501 PolarHBondContact O-N 3.19Å; L497-T501 PolarHBondContact O-OG1 3.15Å; I498-T501 WeakPolarHBondContact O-CB 3.45Å; I498-T501 PolarHBondContact O-N 3.45Å; K499-T501 VanDerWaalsContact C-N 3.31Å; K499-T501 PolarHBondContact O-N 3.3Å; T501-C504 PolarHBondContact O-N 2.9Å; T501-I505 WeakPolarHBondContact O-CG1 3.4Å; T501-I505 PolarHBondContact O-N 3.47Å; T501-I505 VanDerWaalsContact O-N 3.13Å; T501-A551 HydrophobicContact CG2-CB 3.79Å; T501-A551 WeakPolarHBondContact O-CB 3.3Å; T501-L554 HydrophobicContact CG2-CB 4.36Å; T501-L554 HydrophobicContact CG2-CD2 4.04Å; T501-L554 HydrophobicContact CG2-CG 4.33Å; T501-L554 WeakPolarHBondContact OG1-CD2 3.22Å; T501-L555 HydrophobicContact CG2-CD2 3.91Å; T501-L555 HydrophobicContact CG2-CG 3.88Å
502	L	88.8	Confident	82	Confident	15 Å²	15	39.5 Å²	39.5	8%	0.079	21%	0.209	C	C	.	.	H	α-helix	trans	-65.2	-38.4	176.4	-69.1	167.8	0	0	0	112.2	I498 K499 I500 I505 N506 L555 Y572 I577	I498-L502 HydrophobicContact CG2-CD1 4.47Å; I498-L502 WeakPolarHBondContact O-CG 3.35Å; I498-L502 PolarHBondContact O-N 3.25Å; K499-L502 PolarHBondContact O-N 3.23Å; I500-L502 VanDerWaalsContact C-N 3.35Å; I500-L502 PolarHBondContact O-N 3.46Å; L502-I505 PolarHBondContact O-N 3.4Å; L502-N506 VanDerWaalsContact O-CG 3.32Å; L502-N506 PolarHBondContact O-N 3.2Å; L502-N506 PolarHBondContact O-ND2 2.79Å; L502-N506 VanDerWaalsContact O-ND2 3.14Å; L502-L555 HydrophobicContact CD2-CD1 4.03Å; L502-Y572 HydrophobicContact CD1-CD1 4.22Å; L502-I577 HydrophobicContact CD2-CG1 4.45Å
503	A	82.6	Confident	80.7	Confident	42 Å²	42	41.3 Å²	41.3	35%	0.347	22%	0.217	S	C	.	.	H	α-helix	trans	-65.3	-41.3	175.2	0	0	0	0	0	112.7	K499 I500 I505 N506 L507	K499-A503 PolarHBondContact O-N 2.94Å; I500-A503 CarbonylContact O-C 3.6Å; I500-A503 WeakPolarHBondContact O-CA 3.45Å; I500-A503 WeakPolarHBondContact O-CB 3.45Å; I500-A503 PolarHBondContact O-N 3.45Å; A503-I505 VanDerWaalsContact C-N 3.31Å; A503-I505 PolarHBondContact O-N 3.29Å; A503-N506 PolarHBondContact O-N 3.02Å; A503-L507 PolarHBondContact O-N 3.26Å
504	C	84.3	Confident	79.5	Confident	1 Å²	1	36.2 Å²	36.2	1%	0.007	20%	0.198	C	C	.	.	H	α-helix	trans	-65.2	-30.4	175.8	-66.2	0	0	0	0	113.1	M469 I500 T501 L507 R548 A551	M469-C504 PolarHBondContact SD-SG 3.15Å; I500-C504 PolarHBondContact O-N 2.94Å; I500-C504 PolarHBondContact O-SG 3.01Å; T501-C504 PolarHBondContact O-N 2.9Å; C504-L507 WeakPolarHBondContact O-CD2 3.49Å; C504-L507 WeakPolarHBondContact O-CG 3.36Å; C504-R548 WeakPolarHBondContact O-CA 3.17Å; C504-R548 WeakPolarHBondContact O-CB 3.48Å; C504-A551 HydrophobicContact CB-CB 3.63Å
505	I	83.8	Confident	78.3	Confident	0 Å²	0	36.4 Å²	36.4	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-68.1	-45.6	172.6	-71	170.8	0	0	0	110.1	T501 L502 A503 R548 A551 L555 C584	T501-I505 WeakPolarHBondContact O-CG1 3.4Å; T501-I505 PolarHBondContact O-N 3.47Å; T501-I505 VanDerWaalsContact O-N 3.13Å; L502-I505 PolarHBondContact O-N 3.4Å; A503-I505 VanDerWaalsContact C-N 3.31Å; A503-I505 PolarHBondContact O-N 3.29Å; I505-R548 PolarHBondContact O-NE 3.42Å; I505-R548 PolarHBondContact O-NH2 3.03Å; I505-A551 HydrophobicContact CD1-CB 4.38Å; I505-A551 HydrophobicContact CG1-CB 3.79Å; I505-L555 HydrophobicContact CD1-CB 4.46Å; I505-L555 HydrophobicContact CD1-CD1 3.34Å; I505-L555 HydrophobicContact CD1-CG 3.81Å; I505-C584 HydrophobicContact CG2-CB 3.78Å
506	N	75.9	Confident	77	Confident	45 Å²	45	35.7 Å²	35.7	24%	0.241	19%	0.194	C	C	.	.	H	α-helix	trans	-63.2	-48.6	179.9	-67	-27.8	0	0	0	112.2	L502 A503 R548 S580 S583	L502-N506 VanDerWaalsContact O-CG 3.32Å; L502-N506 PolarHBondContact O-N 3.2Å; L502-N506 PolarHBondContact O-ND2 2.79Å; L502-N506 VanDerWaalsContact O-ND2 3.14Å; A503-N506 PolarHBondContact O-N 3.02Å; N506-R548 PolarHBondContact O-NH2 3.21Å; N506-S580 PolarHBondContact ND2-OG 3.44Å; N506-S580 WeakPolarHBondContact OD1-CA 3.43Å; N506-S580 WeakPolarHBondContact OD1-CB 3.38Å; N506-S580 PolarHBondContact OD1-OG 2.72Å; N506-S583 WeakPolarHBondContact OD1-CB 3.26Å
507	L	74	Confident	75.3	Confident	22 Å²	22	39.2 Å²	39.2	12%	0.115	21%	0.212	C	C	.	.			trans	46	69.3	-164.9	-55.6	-174.5	0	0	0	110.5	A503 C504 F511 V512 L544 R548	A503-L507 PolarHBondContact O-N 3.26Å; C504-L507 WeakPolarHBondContact O-CD2 3.49Å; C504-L507 WeakPolarHBondContact O-CG 3.36Å; L507-F511 HydrophobicContact CD2-CD1 3.73Å; L507-F511 HydrophobicContact CD2-CE1 3.56Å; L507-V512 HydrophobicContact CB-CG2 3.78Å; L507-L544 HydrophobicContact CD1-CB 4.32Å; L507-L544 HydrophobicContact CD1-CD2 4.38Å; L507-L544 HydrophobicContact CD2-CD2 3.93Å; L507-R548 HydrophobicContact CD1-CB 4.07Å; L507-R548 HydrophobicContact CG-CB 4.31Å
508	S	65.5	Low	73.2	Confident	46 Å²	46	42.5 Å²	42.5	32%	0.322	23%	0.227	S	C	.	.			trans	-55.8	151.3	178.3	65.3	0	0	0	0	110.9	E510 F511 V512	S508-E510 PolarHBondContact O-N 3.21Å; S508-E510 VanDerWaalsContact O-N 3.14Å; S508-F511 WeakPolarHBondContact O-CB 3.47Å; S508-F511 PolarHBondContact O-N 3.49Å; S508-F511 WeakPolarHBondContact OG-CB 3.41Å; S508-F511 PolarHBondContact OG-N 3.48Å; S508-V512 PolarHBondContact O-N 2.87Å
509	P	63.2	Low	70.8	Confident	110 Å²	110	44 Å²	44	71%	0.714	24%	0.238	S	C	*	.	H	α-helix	trans	-52.6	-38.6	179.7	-29	36.4	0	0	0	112.9	Q513	P509-Q513 WeakPolarHBondContact O-CB 3.23Å; P509-Q513 PolarHBondContact O-N 3.04Å
510	E	61.7	Low	68.1	Low	107 Å²	107	44.3 Å²	44.3	50%	0.5	25%	0.25	S	S	.	.	H	α-helix	trans	-61.2	-45.6	172.1	-62	166.4	-143.8	0	0	113.6	S508 Q513 R514	S508-E510 PolarHBondContact O-N 3.21Å; S508-E510 VanDerWaalsContact O-N 3.14Å; E510-Q513 PolarHBondContact O-N 3.31Å; E510-R514 WeakPolarHBondContact O-CB 3.34Å; E510-R514 VanDerWaalsContact O-CG 3.26Å; E510-R514 WeakPolarHBondContact O-CG 3.15Å; E510-R514 PolarHBondContact O-N 2.86Å; E510-R514 IonicContact OE2-NH2 2.82Å; E510-R514 PolarHBondContact OE2-NH2 3.48Å
511	F	68.5	Low	65.6	Low	7 Å²	7	49.6 Å²	49.6	3%	0.031	28%	0.277	C	S	.	.	H	α-helix	trans	-65.5	-41.2	-179.7	-178.4	-93.7	0	0	0	111	F416 M469 L507 S508 I515 L544 L547	F416-F511 HydrophobicContact CB-CE2 4.21Å; F416-F511 HydrophobicContact CD1-CD2 4.03Å; F416-F511 AromaticContact CD1-CE2 3.52Å; F416-F511 HydrophobicContact CD1-CE2 3.52Å; F416-F511 HydrophobicContact CD1-CZ 4.45Å; F416-F511 HydrophobicContact CE1-CE2 4.13Å; F416-F511 HydrophobicContact CG-CE2 4.05Å; M469-F511 HydrophobicContact SD-CZ 4.33Å; L507-F511 HydrophobicContact CD2-CD1 3.73Å; L507-F511 HydrophobicContact CD2-CE1 3.56Å; S508-F511 WeakPolarHBondContact O-CB 3.47Å; S508-F511 PolarHBondContact O-N 3.49Å; S508-F511 WeakPolarHBondContact OG-CB 3.41Å; S508-F511 PolarHBondContact OG-N 3.48Å; F511-I515 HydrophobicContact CD1-CD1 4Å; F511-I515 HydrophobicContact CE1-CD1 3.5Å; F511-I515 HydrophobicContact CE2-CD1 4.14Å; F511-I515 HydrophobicContact CZ-CD1 3.58Å; F511-I515 PolarHBondContact O-N 3.29Å; F511-I515 VanDerWaalsContact O-N 3.16Å; F511-L544 HydrophobicContact CD1-CD2 3.93Å; F511-L544 HydrophobicContact CE1-CD2 3.81Å; F511-L547 HydrophobicContact CZ-CD1 4.46Å
512	V	68.2	Low	62.8	Low	44 Å²	44	54.6 Å²	54.6	27%	0.267	31%	0.308	S	S	.	.	H	α-helix	trans	-63	-46	171.6	175.2	0	0	0	0	110.8	L507 S508 I515 T516 L544	L507-V512 HydrophobicContact CB-CG2 3.78Å; S508-V512 PolarHBondContact O-N 2.87Å; V512-I515 PolarHBondContact O-N 2.83Å; V512-T516 HydrophobicContact CG1-CG2 4.25Å; V512-T516 WeakPolarHBondContact O-CB 3.34Å; V512-T516 WeakPolarHBondContact O-CG2 3.46Å; V512-T516 PolarHBondContact O-N 3.44Å; V512-T516 PolarHBondContact O-OG1 2.87Å; V512-L544 HydrophobicContact CB-CD1 4.41Å; V512-L544 HydrophobicContact CG1-CD1 3.99Å; V512-L544 HydrophobicContact CG2-CD1 4.41Å; V512-L544 HydrophobicContact CG2-CD2 4.32Å
513	Q	63.6	Low	60.2	Low	107 Å²	107	60.2 Å²	60.2	50%	0.5	35%	0.345	S	S	.	.	H	α-helix	trans	-64	-43.6	-179.2	-175.4	175.8	-9	0	0	111.6	P509 E510 I515 T516 L517	P509-Q513 WeakPolarHBondContact O-CB 3.23Å; P509-Q513 PolarHBondContact O-N 3.04Å; E510-Q513 PolarHBondContact O-N 3.31Å; Q513-I515 PolarHBondContact O-N 3.39Å; Q513-T516 PolarHBondContact O-N 3.25Å; Q513-L517 HydrophobicContact CG-CB 4.15Å; Q513-L517 HydrophobicContact CG-CD1 4.07Å; Q513-L517 WeakPolarHBondContact O-CB 3.41Å; Q513-L517 PolarHBondContact O-N 3.19Å
514	R	64.5	Low	57.8	Low	50 Å²	50	63.3 Å²	63.3	19%	0.189	37%	0.365	C	S	.	.	H	α-helix	trans	-53.7	-53.8	171.7	-71.5	174.2	-133.7	157.8	1	110.4	F416 I421 E510 T516 H518	F416-R514 PolarHBondContact O-NH1 2.92Å; I421-R514 VanDerWaalsContact CD1-CZ 3.4Å; E510-R514 WeakPolarHBondContact O-CB 3.34Å; E510-R514 VanDerWaalsContact O-CG 3.26Å; E510-R514 WeakPolarHBondContact O-CG 3.15Å; E510-R514 PolarHBondContact O-N 2.86Å; E510-R514 IonicContact OE2-NH2 2.82Å; E510-R514 PolarHBondContact OE2-NH2 3.48Å; R514-T516 VanDerWaalsContact C-N 3.33Å; R514-T516 PolarHBondContact O-N 3.02Å; R514-H518 PolarHBondContact O-CD2 3.37Å; R514-H518 PolarHBondContact O-NE2 2.84Å
515	I	65.7	Low	55.4	Low	8 Å²	8	66.3 Å²	66.3	4%	0.041	39%	0.386	C	S	.	.	H	α-helix	trans	-70.2	-24.7	-176.3	-70	165.4	0	0	0	113.3	F416 F511 V512 Q513 S540 L544	F416-I515 HydrophobicContact CE1-CD1 4.32Å; F416-I515 HydrophobicContact CE1-CG1 4.45Å; F511-I515 HydrophobicContact CD1-CD1 4Å; F511-I515 HydrophobicContact CE1-CD1 3.5Å; F511-I515 HydrophobicContact CE2-CD1 4.14Å; F511-I515 HydrophobicContact CZ-CD1 3.58Å; F511-I515 PolarHBondContact O-N 3.29Å; F511-I515 VanDerWaalsContact O-N 3.16Å; V512-I515 PolarHBondContact O-N 2.83Å; Q513-I515 PolarHBondContact O-N 3.39Å; I515-S540 WeakPolarHBondContact O-CB 3.35Å; I515-L544 HydrophobicContact CB-CD1 4.31Å; I515-L544 HydrophobicContact CB-CD2 4.17Å; I515-L544 HydrophobicContact CB-CG 4.25Å; I515-L544 HydrophobicContact CD1-CD2 3.72Å; I515-L544 HydrophobicContact CD1-CG 4.45Å; I515-L544 HydrophobicContact CG2-CD1 3.97Å; I515-L544 HydrophobicContact CG2-CD2 4.15Å; I515-L544 HydrophobicContact CG2-CG 3.75Å
516	T	64.1	Low	52.8	Low	29 Å²	29	73.7 Å²	73.7	18%	0.178	42%	0.424	C	S	.	.	H	α-helix	trans	-105.7	-19.8	-174.2	56.4	0	0	0	0	116.5	V512 Q513 R514 L541 L544	V512-T516 HydrophobicContact CG1-CG2 4.25Å; V512-T516 WeakPolarHBondContact O-CB 3.34Å; V512-T516 WeakPolarHBondContact O-CG2 3.46Å; V512-T516 PolarHBondContact O-N 3.44Å; V512-T516 PolarHBondContact O-OG1 2.87Å; Q513-T516 PolarHBondContact O-N 3.25Å; R514-T516 VanDerWaalsContact C-N 3.33Å; R514-T516 PolarHBondContact O-N 3.02Å; T516-L541 HydrophobicContact CG2-CD2 3.92Å; T516-L541 HydrophobicContact CG2-CG 4.26Å; T516-L544 HydrophobicContact CG2-CD1 3.62Å
517	L	56.1	Low	51.2	Low	99 Å²	99	76.7 Å²	76.7	52%	0.518	45%	0.448	S	S	.	.	H	α-helix	trans	-90.8	-3.8	-173	-158	116.6	0	0	0	113.7	Q513 S519	Q513-L517 HydrophobicContact CG-CB 4.15Å; Q513-L517 HydrophobicContact CG-CD1 4.07Å; Q513-L517 WeakPolarHBondContact O-CB 3.41Å; Q513-L517 PolarHBondContact O-N 3.19Å; L517-S519 PolarHBondContact O-N 3.4Å
518	H	46.3	Very low	49.4	Very low	71 Å²	71	79.6 Å²	79.6	33%	0.329	47%	0.471	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.7	7.5	-177.3	-82.2	-50.6	0	0	0	116.2	Y459 I462 R514	Y459-H518 HydrophobicContact CD1-CB 3.85Å; Y459-H518 AromaticContact CD1-CG 3.83Å; Y459-H518 AromaticContact CD1-ND1 3.25Å; Y459-H518 WeakPolarHBondContact CD1-ND1 3.34Å; Y459-H518 WeakPolarHBondContact CD1-O 3.3Å; Y459-H518 HydrophobicContact CE1-CB 4.4Å; Y459-H518 AromaticContact CE1-ND1 3.4Å; Y459-H518 WeakPolarHBondContact CE1-ND1 3.37Å; I462-H518 VanDerWaalsContact CD1-NE2 3.27Å; I462-H518 WeakPolarHBondContact CD1-NE2 3.46Å; R514-H518 PolarHBondContact O-CD2 3.37Å; R514-H518 PolarHBondContact O-NE2 2.84Å
519	S	41.7	Very low	48.1	Very low	31 Å²	31	80.4 Å²	80.4	22%	0.217	47%	0.469	C	S	.	.	T	Hydrogen-bonded Turn	trans	-107.8	11.9	-178.1	82.7	0	0	0	0	114.6	L517 I521 L533	L517-S519 PolarHBondContact O-N 3.4Å; S519-I521 PolarHBondContact O-N 2.94Å; S519-I521 VanDerWaalsContact O-N 3.14Å; S519-L533 WeakPolarHBondContact O-CD2 3.34Å
520	S	32.6	Very low	46.9	Very low	89 Å²	89	79.9 Å²	79.9	62%	0.622	46%	0.461	S	S	*	.			trans	-87.6	70.1	-177.5	65.7	0	0	0	0	113
521	I	35.2	Very low	46	Very low	119 Å²	119	79.3 Å²	79.3	61%	0.61	46%	0.464	S	S	*	.			trans	-67.3	142.5	163	-62.1	177.2	0	0	0	108.6	S519	S519-I521 PolarHBondContact O-N 2.94Å; S519-I521 VanDerWaalsContact O-N 3.14Å
522	T	31.5	Very low	44.9	Very low	105 Å²	105	83.4 Å²	83.4	64%	0.644	49%	0.487	S	S	*	.			trans	-64.7	140.6	-174.9	41.7	0	0	0	0	112.7	S524	T522-S524 VanDerWaalsContact C-N 3.32Å; T522-S524 PolarHBondContact O-N 2.87Å
523	P	34.7	Very low	44.1	Very low	133 Å²	133	83.6 Å²	83.6	86%	0.864	49%	0.486	S	S	*	.	S	Bend	trans	-78.8	73	-169.5	33.2	-37.7	0	0	0	113.1
524	S	33.3	Very low	43.7	Very low	107 Å²	107	81.8 Å²	81.8	75%	0.748	48%	0.482	S	S	*	.			trans	-135.6	28.1	175.4	61.3	0	0	0	0	113.2	T522	T522-S524 VanDerWaalsContact C-N 3.32Å; T522-S524 PolarHBondContact O-N 2.87Å
525	S	32.4	Very low	43.3	Very low	64 Å²	64	82.6 Å²	82.6	45%	0.448	49%	0.489	S	S	.	.			trans	-147.7	125.6	172.9	164.7	0	0	0	0	108.2	E529	S525-E529 WeakPolarHBondContact CB-OE2 3.02Å; S525-E529 PolarHBondContact OG-OE2 3.37Å
526	L	29.7	Very low	43.1	Very low	154 Å²	154	86.4 Å²	86.4	81%	0.806	51%	0.506	S	S	*	.			trans	-137	92.8	-168.4	-81.8	170.4	0	0	0	111.8
527	S	42.3	Very low	43.1	Very low	108 Å²	108	90.6 Å²	90.6	76%	0.755	52%	0.522	S	S	*	.	S	Bend	trans	-177.8	-42.6	143.7	40.6	0	0	0	0	113.2
528	S	37.5	Very low	43.4	Very low	83 Å²	83	88.3 Å²	88.3	58%	0.58	51%	0.509	S	S	*	.	S	Bend	trans	-96.6	-37.9	-169.2	50.1	0	0	0	0	115.3	N530 V531	S528-N530 VanDerWaalsContact C-N 3.29Å; S528-N530 PolarHBondContact O-N 3.24Å; S528-V531 PolarHBondContact O-N 3.42Å
529	E	38.1	Very low	44.3	Very low	63 Å²	63	87.6 Å²	87.6	29%	0.294	50%	0.503	S	S	.	.	H	α-helix	trans	-64.3	-28.1	-168.1	-70	168.1	117.8	0	0	114.5	S525 V531 N532 L533	S525-E529 WeakPolarHBondContact CB-OE2 3.02Å; S525-E529 PolarHBondContact OG-OE2 3.37Å; E529-V531 PolarHBondContact O-N 2.93Å; E529-N532 PolarHBondContact O-N 3.49Å; E529-L533 HydrophobicContact CB-CD1 4.34Å; E529-L533 WeakPolarHBondContact O-CG 3.28Å; E529-L533 PolarHBondContact O-N 2.76Å
530	N	38	Very low	45.6	Very low	99 Å²	99	86.4 Å²	86.4	53%	0.529	50%	0.495	S	S	.	.	H	α-helix	trans	-52.5	-31	-178.7	-74.1	-27.9	0	0	0	114	S528 T534	S528-N530 VanDerWaalsContact C-N 3.29Å; S528-N530 PolarHBondContact O-N 3.24Å; N530-T534 WeakPolarHBondContact O-CB 3.44Å; N530-T534 PolarHBondContact O-N 3.14Å; N530-T534 PolarHBondContact O-OG1 2.91Å
531	V	41.7	Very low	47.4	Very low	96 Å²	96	85.6 Å²	85.6	58%	0.582	48%	0.483	S	S	*	.	H	α-helix	trans	-73.7	-46.4	179.4	-177.8	0	0	0	0	111.1	S528 E529 T534 M535	S528-V531 PolarHBondContact O-N 3.42Å; E529-V531 PolarHBondContact O-N 2.93Å; V531-T534 PolarHBondContact O-N 3.31Å; V531-M535 PolarHBondContact O-N 3.05Å; V531-M535 VanDerWaalsContact O-N 3.11Å
532	N	45.4	Very low	49.1	Very low	93 Å²	93	81.4 Å²	81.4	50%	0.497	46%	0.461	S	S	.	.	H	α-helix	trans	-62.5	-47.7	178	-71.2	-2.8	0	0	0	110.8	E529 T534 M535 E536	E529-N532 PolarHBondContact O-N 3.49Å; N532-T534 PolarHBondContact O-N 3.17Å; N532-M535 PolarHBondContact O-N 2.68Å; N532-E536 WeakPolarHBondContact O-CG 3.43Å; N532-E536 PolarHBondContact O-N 2.77Å
533	L	51.6	Low	51.3	Low	47 Å²	47	76.8 Å²	76.8	25%	0.246	43%	0.432	C	S	.	.	H	α-helix	trans	-54.8	-36.2	176.3	-66.4	174.4	0	0	0	112.5	S519 E529 K537	S519-L533 WeakPolarHBondContact O-CD2 3.34Å; E529-L533 HydrophobicContact CB-CD1 4.34Å; E529-L533 WeakPolarHBondContact O-CG 3.28Å; E529-L533 PolarHBondContact O-N 2.76Å; L533-K537 WeakPolarHBondContact O-CB 3.23Å; L533-K537 PolarHBondContact O-N 3.44Å
534	T	55.6	Low	53.3	Low	70 Å²	70	70.8 Å²	70.8	43%	0.429	39%	0.393	S	S	.	.	H	α-helix	trans	-70.9	-43.3	177	-56.9	0	0	0	0	111.7	N530 V531 N532 Q538	N530-T534 WeakPolarHBondContact O-CB 3.44Å; N530-T534 PolarHBondContact O-N 3.14Å; N530-T534 PolarHBondContact O-OG1 2.91Å; V531-T534 PolarHBondContact O-N 3.31Å; N532-T534 PolarHBondContact O-N 3.17Å; T534-Q538 VanDerWaalsContact O-CG 3.31Å; T534-Q538 WeakPolarHBondContact O-CG 3.4Å; T534-Q538 PolarHBondContact O-N 3.15Å; T534-Q538 VanDerWaalsContact O-N 3.12Å
535	M	55.5	Low	55.4	Low	67 Å²	67	66.2 Å²	66.2	33%	0.33	36%	0.363	S	S	.	.	H	α-helix	trans	-67.2	-40.2	177.1	-67.1	-158.5	-56.4	0	0	112.7	I255 V531 N532 Q538 R539	I255-M535 HydrophobicContact CD1-SD 4.42Å; V531-M535 PolarHBondContact O-N 3.05Å; V531-M535 VanDerWaalsContact O-N 3.11Å; N532-M535 PolarHBondContact O-N 2.68Å; M535-Q538 CarbonylContact O-C 3.51Å; M535-Q538 WeakPolarHBondContact O-CB 3.46Å; M535-Q538 PolarHBondContact O-N 2.89Å; M535-Q538 VanDerWaalsContact O-N 3.15Å; M535-R539 PolarHBondContact O-N 3.34Å
536	E	61.2	Low	57.7	Low	87 Å²	87	65.1 Å²	65.1	41%	0.407	35%	0.351	S	S	.	.	H	α-helix	trans	-64	-43.1	178.2	-73.4	172.6	-179.4	0	0	111.8	N532 Q538 R539 S540	N532-E536 WeakPolarHBondContact O-CG 3.43Å; N532-E536 PolarHBondContact O-N 2.77Å; E536-Q538 VanDerWaalsContact C-N 3.26Å; E536-Q538 PolarHBondContact O-N 3.38Å; E536-R539 PolarHBondContact O-N 3.26Å; E536-S540 PolarHBondContact O-N 3.45Å; E536-S540 PolarHBondContact O-OG 3.5Å
537	K	64.1	Low	60.4	Low	118 Å²	118	57.8 Å²	57.8	51%	0.513	31%	0.312	S	S	.	.	H	α-helix	trans	-63.3	-31.2	173	-170.6	174.1	-177.5	177.5	0	112.6	L533 S540 L541	L533-K537 WeakPolarHBondContact O-CB 3.23Å; L533-K537 PolarHBondContact O-N 3.44Å; K537-S540 PolarHBondContact O-OG 2.71Å; K537-S540 VanDerWaalsContact O-OG 3.13Å; K537-L541 WeakPolarHBondContact O-CB 3.01Å; K537-L541 WeakPolarHBondContact O-CD1 3.3Å; K537-L541 VanDerWaalsContact O-CG 3.25Å; K537-L541 WeakPolarHBondContact O-CG 3.44Å; K537-L541 PolarHBondContact O-N 3.26Å
538	Q	62.3	Low	62.5	Low	50 Å²	50	53.8 Å²	53.8	23%	0.234	28%	0.281	C	S	.	.	H	α-helix	trans	-74.6	-40.6	173.2	-73.8	172.2	-15.6	0	0	112.2	T534 M535 E536 L541 H542	T534-Q538 VanDerWaalsContact O-CG 3.31Å; T534-Q538 WeakPolarHBondContact O-CG 3.4Å; T534-Q538 PolarHBondContact O-N 3.15Å; T534-Q538 VanDerWaalsContact O-N 3.12Å; M535-Q538 CarbonylContact O-C 3.51Å; M535-Q538 WeakPolarHBondContact O-CB 3.46Å; M535-Q538 PolarHBondContact O-N 2.89Å; M535-Q538 VanDerWaalsContact O-N 3.15Å; E536-Q538 VanDerWaalsContact C-N 3.26Å; E536-Q538 PolarHBondContact O-N 3.38Å; Q538-L541 PolarHBondContact O-N 3.01Å; Q538-H542 WeakPolarHBondContact O-CB 3.49Å; Q538-H542 PolarHBondContact O-N 3.16Å
539	R	66.9	Low	64.8	Low	56 Å²	56	51.4 Å²	51.4	21%	0.211	26%	0.261	C	S	.	.	H	α-helix	trans	-62.8	-43.1	175.8	-178.2	176.6	173	-162.9	0.1	112	E467 M535 E536 H542 I543	E467-R539 IonicContact OE1-CZ 2.81Å; E467-R539 IonicContact OE1-NE 3.55Å; E467-R539 IonicContact OE1-NH2 2.91Å; E467-R539 PolarHBondContact OE1-NH2 2.96Å; M535-R539 PolarHBondContact O-N 3.34Å; E536-R539 PolarHBondContact O-N 3.26Å; R539-H542 WeakPolarHBondContact O-CB 3.44Å; R539-H542 PolarHBondContact O-N 2.84Å; R539-I543 HydrophobicContact CG-CD1 3.89Å; R539-I543 WeakPolarHBondContact O-CG1 3.15Å; R539-I543 PolarHBondContact O-N 3.05Å
540	S	68.2	Low	67.3	Low	6 Å²	6	48.4 Å²	48.4	4%	0.042	25%	0.247	C	C	.	.	H	α-helix	trans	-66.2	-41.7	177.1	57.9	0	0	0	0	112.6	I515 E536 K537 H542 I543 L544	I515-S540 WeakPolarHBondContact O-CB 3.35Å; E536-S540 PolarHBondContact O-N 3.45Å; E536-S540 PolarHBondContact O-OG 3.5Å; K537-S540 PolarHBondContact O-OG 2.71Å; K537-S540 VanDerWaalsContact O-OG 3.13Å; S540-H542 VanDerWaalsContact C-N 3.34Å; S540-H542 PolarHBondContact O-N 3.36Å; S540-I543 PolarHBondContact O-N 3.13Å; S540-L544 WeakPolarHBondContact O-CG 3.42Å; S540-L544 PolarHBondContact O-N 2.95Å
541	L	70.2	Confident	69.9	Low	73 Å²	73	43.7 Å²	43.7	38%	0.382	22%	0.222	S	C	.	.	H	α-helix	trans	-63.9	-35.8	172	-72.8	172.1	0	0	0	112.8	T516 K537 Q538 L544 G545	T516-L541 HydrophobicContact CG2-CD2 3.92Å; T516-L541 HydrophobicContact CG2-CG 4.26Å; K537-L541 WeakPolarHBondContact O-CB 3.01Å; K537-L541 WeakPolarHBondContact O-CD1 3.3Å; K537-L541 VanDerWaalsContact O-CG 3.25Å; K537-L541 WeakPolarHBondContact O-CG 3.44Å; K537-L541 PolarHBondContact O-N 3.26Å; Q538-L541 PolarHBondContact O-N 3.01Å; L541-L544 HydrophobicContact CD2-CD1 4.4Å; L541-G545 PolarHBondContact O-N 3.18Å
542	H	71.2	Confident	72.2	Confident	30 Å²	30	39.1 Å²	39.1	14%	0.139	20%	0.195	C	C	.	.	H	α-helix	trans	-64.4	-49.4	174.2	-167.9	-80.1	0	0	0	111.4	Q538 R539 S540 L544 G545 E546	Q538-H542 WeakPolarHBondContact O-CB 3.49Å; Q538-H542 PolarHBondContact O-N 3.16Å; R539-H542 WeakPolarHBondContact O-CB 3.44Å; R539-H542 PolarHBondContact O-N 2.84Å; S540-H542 VanDerWaalsContact C-N 3.34Å; S540-H542 PolarHBondContact O-N 3.36Å; H542-L544 VanDerWaalsContact C-N 3.33Å; H542-L544 PolarHBondContact O-N 3.04Å; H542-G545 WeakPolarHBondContact O-CA 3.48Å; H542-G545 PolarHBondContact O-N 3.22Å; H542-G545 VanDerWaalsContact O-N 3.07Å; H542-E546 PolarHBondContact O-N 2.95Å
543	I	77.3	Confident	74.4	Confident	8 Å²	8	36.5 Å²	36.5	4%	0.041	18%	0.181	C	C	.	.	H	α-helix	trans	-62.7	-37.9	179.2	-70.7	164.9	0	0	0	111.4	L463 E467 R539 S540 G545 E546 L547	L463-I543 HydrophobicContact CD1-CD1 3.79Å; L463-I543 HydrophobicContact CG-CD1 4.18Å; E467-I543 HydrophobicContact CG-CD1 3.98Å; R539-I543 HydrophobicContact CG-CD1 3.89Å; R539-I543 WeakPolarHBondContact O-CG1 3.15Å; R539-I543 PolarHBondContact O-N 3.05Å; S540-I543 PolarHBondContact O-N 3.13Å; I543-G545 VanDerWaalsContact C-N 3.33Å; I543-G545 PolarHBondContact O-N 3.5Å; I543-E546 PolarHBondContact O-N 3.03Å; I543-L547 HydrophobicContact CG2-CD1 3.91Å; I543-L547 HydrophobicContact CG2-CG 4.27Å; I543-L547 WeakPolarHBondContact O-CB 3.32Å; I543-L547 VanDerWaalsContact O-CG 3.29Å; I543-L547 WeakPolarHBondContact O-CG 3.41Å; I543-L547 PolarHBondContact O-N 3.23Å
544	L	77.5	Confident	76.5	Confident	7 Å²	7	34.3 Å²	34.3	4%	0.037	17%	0.169	C	C	.	.	H	α-helix	trans	-59.5	-41.4	171.4	-79.2	166.6	0	0	0	112.7	L507 F511 V512 I515 T516 S540 L541 H542 R548	L507-L544 HydrophobicContact CD1-CB 4.32Å; L507-L544 HydrophobicContact CD1-CD2 4.38Å; L507-L544 HydrophobicContact CD2-CD2 3.93Å; F511-L544 HydrophobicContact CD1-CD2 3.93Å; F511-L544 HydrophobicContact CE1-CD2 3.81Å; V512-L544 HydrophobicContact CB-CD1 4.41Å; V512-L544 HydrophobicContact CG1-CD1 3.99Å; V512-L544 HydrophobicContact CG2-CD1 4.41Å; V512-L544 HydrophobicContact CG2-CD2 4.32Å; I515-L544 HydrophobicContact CB-CD1 4.31Å; I515-L544 HydrophobicContact CB-CD2 4.17Å; I515-L544 HydrophobicContact CB-CG 4.25Å; I515-L544 HydrophobicContact CD1-CD2 3.72Å; I515-L544 HydrophobicContact CD1-CG 4.45Å; I515-L544 HydrophobicContact CG2-CD1 3.97Å; I515-L544 HydrophobicContact CG2-CD2 4.15Å; I515-L544 HydrophobicContact CG2-CG 3.75Å; T516-L544 HydrophobicContact CG2-CD1 3.62Å; S540-L544 WeakPolarHBondContact O-CG 3.42Å; S540-L544 PolarHBondContact O-N 2.95Å; L541-L544 HydrophobicContact CD2-CD1 4.4Å; H542-L544 VanDerWaalsContact C-N 3.33Å; H542-L544 PolarHBondContact O-N 3.04Å; L544-R548 PolarHBondContact O-N 3.1Å
545	G	76	Confident	78.4	Confident	11 Å²	11	31.1 Å²	31.1	11%	0.113	15%	0.149	C	C	.	.	H	α-helix	trans	-62.5	-50.9	174.7	0	0	0	0	0	112.2	L541 H542 I543 L547 R548 L549 I646	L541-G545 PolarHBondContact O-N 3.18Å; H542-G545 WeakPolarHBondContact O-CA 3.48Å; H542-G545 PolarHBondContact O-N 3.22Å; H542-G545 VanDerWaalsContact O-N 3.07Å; I543-G545 VanDerWaalsContact C-N 3.33Å; I543-G545 PolarHBondContact O-N 3.5Å; G545-L547 PolarHBondContact O-N 2.86Å; G545-R548 PolarHBondContact O-N 3.04Å; G545-L549 WeakPolarHBondContact O-CB 3.38Å; G545-L549 PolarHBondContact O-N 3.09Å; G545-I646 WeakPolarHBondContact O-CG2 3.5Å
546	E	81.9	Confident	80.2	Confident	42 Å²	42	29.1 Å²	29.1	20%	0.196	14%	0.141	C	C	.	.	H	α-helix	trans	-63.5	-39	179.2	-69.9	-58	113.2	0	0	112.6	L470 H542 I543 L549 A550	L470-E546 HydrophobicContact CD1-CB 3.98Å; L470-E546 HydrophobicContact CD2-CB 3.84Å; H542-E546 PolarHBondContact O-N 2.95Å; I543-E546 PolarHBondContact O-N 3.03Å; E546-L549 PolarHBondContact O-N 3.25Å; E546-A550 WeakPolarHBondContact O-CB 3.42Å; E546-A550 PolarHBondContact O-N 3.32Å
547	L	85.9	Confident	81.7	Confident	0 Å²	0	26.3 Å²	26.3	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-61.4	-44.5	174.8	-79.8	171	0	0	0	112.2	M469 L470 L473 F511 I543 G545 A551	M469-L547 HydrophobicContact CB-CD2 4.07Å; M469-L547 HydrophobicContact CG-CD2 3.78Å; M469-L547 HydrophobicContact SD-CD1 4.31Å; M469-L547 HydrophobicContact SD-CD2 3.81Å; L470-L547 HydrophobicContact CB-CD2 3.8Å; L470-L547 HydrophobicContact CB-CG 4.43Å; L470-L547 HydrophobicContact CD1-CD2 4.21Å; L470-L547 HydrophobicContact CD1-CG 4.5Å; L473-L547 HydrophobicContact CD1-CD2 4.16Å; F511-L547 HydrophobicContact CZ-CD1 4.46Å; I543-L547 HydrophobicContact CG2-CD1 3.91Å; I543-L547 HydrophobicContact CG2-CG 4.27Å; I543-L547 WeakPolarHBondContact O-CB 3.32Å; I543-L547 VanDerWaalsContact O-CG 3.29Å; I543-L547 WeakPolarHBondContact O-CG 3.41Å; I543-L547 PolarHBondContact O-N 3.23Å; G545-L547 PolarHBondContact O-N 2.86Å; L547-A551 VanDerWaalsContact O-CB 3.3Å; L547-A551 WeakPolarHBondContact O-CB 3.25Å; L547-A551 PolarHBondContact O-N 2.99Å
548	R	86.8	Confident	83.2	Confident	23 Å²	23	20.7 Å²	20.7	9%	0.087	10%	0.104	C	C	.	.	H	α-helix	trans	-64.6	-40.7	174.7	179.7	-178.8	-89.8	167.8	-7	111.2	C504 I505 N506 L507 L544 G545 C552 T587 C650	C504-R548 WeakPolarHBondContact O-CA 3.17Å; C504-R548 WeakPolarHBondContact O-CB 3.48Å; I505-R548 PolarHBondContact O-NE 3.42Å; I505-R548 PolarHBondContact O-NH2 3.03Å; N506-R548 PolarHBondContact O-NH2 3.21Å; L507-R548 HydrophobicContact CD1-CB 4.07Å; L507-R548 HydrophobicContact CG-CB 4.31Å; L544-R548 PolarHBondContact O-N 3.1Å; G545-R548 PolarHBondContact O-N 3.04Å; R548-C552 WeakPolarHBondContact O-CB 3.25Å; R548-C552 PolarHBondContact O-N 3.38Å; R548-C552 PolarHBondContact O-SG 3.17Å; R548-C552 VanDerWaalsContact O-SG 3.34Å; R548-T587 PolarHBondContact NH1-OG1 3.21Å; R548-T587 PolarHBondContact NH2-OG1 2.98Å; R548-C650 HydrophobicContact CG-CB 4.23Å
549	L	85.5	Confident	84.7	Confident	33 Å²	33	18.4 Å²	18.4	17%	0.173	9%	0.093	C	C	.	.	H	α-helix	trans	-65.6	-45.4	179.3	-176	60.7	0	0	0	112.1	G545 E546 C552 N553 I646 V649 K653	G545-L549 WeakPolarHBondContact O-CB 3.38Å; G545-L549 PolarHBondContact O-N 3.09Å; E546-L549 PolarHBondContact O-N 3.25Å; L549-C552 WeakPolarHBondContact O-CB 3.46Å; L549-C552 PolarHBondContact O-N 3.37Å; L549-N553 VanDerWaalsContact O-CG 3.26Å; L549-N553 PolarHBondContact O-N 3.31Å; L549-N553 PolarHBondContact O-ND2 3.14Å; L549-N553 PolarHBondContact O-OD1 2.97Å; L549-I646 HydrophobicContact CB-CG2 4.4Å; L549-V649 HydrophobicContact CD1-CG1 3.65Å; L549-K653 HydrophobicContact CD1-CD 3.96Å
550	A	89.8	Confident	85.9	Confident	1 Å²	1	16.9 Å²	16.9	1%	0.008	9%	0.091	C	C	.	.	H	α-helix	trans	-60.8	-45.6	175.3	0	0	0	0	0	112.2	L470 L473 N474 E546 C552 N553 L554	L470-A550 HydrophobicContact CD1-CB 3.66Å; L473-A550 HydrophobicContact CB-CB 3.82Å; L473-A550 HydrophobicContact CD1-CB 3.88Å; N474-A550 WeakPolarHBondContact OD1-CB 3.41Å; E546-A550 WeakPolarHBondContact O-CB 3.42Å; E546-A550 PolarHBondContact O-N 3.32Å; A550-C552 PolarHBondContact O-N 3.13Å; A550-N553 WeakPolarHBondContact O-CB 3.31Å; A550-N553 PolarHBondContact O-N 3.17Å; A550-L554 PolarHBondContact O-N 3.45Å
551	A	92.6	Very high	87.1	Confident	0 Å²	0	19.1 Å²	19.1	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-65.8	-37.5	176.4	0	0	0	0	0	112.5	L473 T501 C504 I505 L547 L554 L555	L473-A551 HydrophobicContact CD1-CB 4.42Å; T501-A551 HydrophobicContact CG2-CB 3.79Å; T501-A551 WeakPolarHBondContact O-CB 3.3Å; C504-A551 HydrophobicContact CB-CB 3.63Å; I505-A551 HydrophobicContact CD1-CB 4.38Å; I505-A551 HydrophobicContact CG1-CB 3.79Å; L547-A551 VanDerWaalsContact O-CB 3.3Å; L547-A551 WeakPolarHBondContact O-CB 3.25Å; L547-A551 PolarHBondContact O-N 2.99Å; A551-L554 PolarHBondContact O-N 3.02Å; A551-L555 PolarHBondContact O-N 3.39Å
552	C	90.8	Very high	88.1	Confident	0 Å²	0	19.9 Å²	19.9	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-64.7	-36.8	170.4	-79.2	0	0	0	0	112.9	R548 L549 A550 V556 K653	R548-C552 WeakPolarHBondContact O-CB 3.25Å; R548-C552 PolarHBondContact O-N 3.38Å; R548-C552 PolarHBondContact O-SG 3.17Å; R548-C552 VanDerWaalsContact O-SG 3.34Å; L549-C552 WeakPolarHBondContact O-CB 3.46Å; L549-C552 PolarHBondContact O-N 3.37Å; A550-C552 PolarHBondContact O-N 3.13Å; C552-V556 WeakPolarHBondContact O-CB 3.43Å; C552-V556 VanDerWaalsContact O-CG2 3.25Å; C552-V556 WeakPolarHBondContact O-CG2 3.39Å; C552-V556 PolarHBondContact O-N 3.11Å; C552-K653 HydrophobicContact CB-CB 3.93Å; C552-K653 HydrophobicContact CB-CD 3.82Å
553	N	91.6	Very high	89	Confident	38 Å²	38	20 Å²	20	20%	0.203	12%	0.117	C	C	.	.	H	α-helix	trans	-61.1	-54.1	172.4	-67.1	-24.7	0	0	0	110.1	L549 A550 L555 V556 N557 K653	L549-N553 VanDerWaalsContact O-CG 3.26Å; L549-N553 PolarHBondContact O-N 3.31Å; L549-N553 PolarHBondContact O-ND2 3.14Å; L549-N553 PolarHBondContact O-OD1 2.97Å; A550-N553 WeakPolarHBondContact O-CB 3.31Å; A550-N553 PolarHBondContact O-N 3.17Å; N553-L555 VanDerWaalsContact C-N 3.32Å; N553-L555 PolarHBondContact O-N 3.13Å; N553-V556 WeakPolarHBondContact O-CA 3.47Å; N553-V556 WeakPolarHBondContact O-CB 3.48Å; N553-V556 PolarHBondContact O-N 3.46Å; N553-N557 PolarHBondContact O-N 3.5Å; N553-K653 WeakPolarHBondContact OD1-CE 3.33Å; N553-K653 PolarHBondContact OD1-NZ 2.61Å
554	L	95.8	Very high	89.7	Confident	0 Å²	0	19.7 Å²	19.7	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-55.7	-44.4	-178.7	178.7	56.2	0	0	0	112	L473 A476 D477 L490 T501 A550 A551 N557 L558	L473-L554 HydrophobicContact CD2-CD2 3.66Å; A476-L554 HydrophobicContact CB-CD1 4.25Å; A476-L554 HydrophobicContact CB-CD2 4.18Å; D477-L554 HydrophobicContact CB-CB 4.11Å; D477-L554 HydrophobicContact CB-CD1 4.19Å; D477-L554 VanDerWaalsContact OD1-CA 3.29Å; D477-L554 WeakPolarHBondContact OD1-CA 3.13Å; D477-L554 PolarHBondContact OD1-N 3.43Å; L490-L554 HydrophobicContact CD2-CD1 3.87Å; T501-L554 HydrophobicContact CG2-CB 4.36Å; T501-L554 HydrophobicContact CG2-CD2 4.04Å; T501-L554 HydrophobicContact CG2-CG 4.33Å; T501-L554 WeakPolarHBondContact OG1-CD2 3.22Å; A550-L554 PolarHBondContact O-N 3.45Å; A551-L554 PolarHBondContact O-N 3.02Å; L554-N557 PolarHBondContact O-N 3.49Å; L554-L558 HydrophobicContact CD1-CD1 3.84Å; L554-L558 HydrophobicContact CD1-CD2 4.42Å; L554-L558 HydrophobicContact CD1-CG 3.81Å; L554-L558 HydrophobicContact CG-CD1 3.93Å; L554-L558 HydrophobicContact CG-CG 4.29Å; L554-L558 WeakPolarHBondContact O-CB 3.39Å; L554-L558 VanDerWaalsContact O-CG 3.28Å; L554-L558 WeakPolarHBondContact O-CG 3.42Å; L554-L558 PolarHBondContact O-N 2.98Å
555	L	94.7	Very high	90.4	Very high	3 Å²	3	20.2 Å²	20.2	2%	0.016	12%	0.116	C	C	.	.	H	α-helix	trans	-69.5	-33.3	175	-71	-159.2	0	0	0	113.7	T501 L502 I505 A551 N553 N557 L558 T559 L568 I657	T501-L555 HydrophobicContact CG2-CD2 3.91Å; T501-L555 HydrophobicContact CG2-CG 3.88Å; L502-L555 HydrophobicContact CD2-CD1 4.03Å; I505-L555 HydrophobicContact CD1-CB 4.46Å; I505-L555 HydrophobicContact CD1-CD1 3.34Å; I505-L555 HydrophobicContact CD1-CG 3.81Å; A551-L555 PolarHBondContact O-N 3.39Å; N553-L555 VanDerWaalsContact C-N 3.32Å; N553-L555 PolarHBondContact O-N 3.13Å; L555-N557 VanDerWaalsContact C-N 3.33Å; L555-L558 HydrophobicContact CD2-CD1 4.29Å; L555-T559 WeakPolarHBondContact O-CB 3.47Å; L555-T559 WeakPolarHBondContact O-CG2 3.1Å; L555-T559 PolarHBondContact O-N 2.82Å; L555-T559 PolarHBondContact O-OG1 2.94Å; L555-L568 HydrophobicContact CD2-CD1 4.41Å; L555-I657 HydrophobicContact CB-CD1 3.54Å; L555-I657 HydrophobicContact CB-CG1 4.17Å
556	V	93.2	Very high	91.2	Very high	25 Å²	25	24.2 Å²	24.2	15%	0.152	13%	0.132	C	C	.	.	H	α-helix	trans	-61	-42.9	172.1	165.5	0	0	0	0	110.6	C552 N553 S560 K653 I657 Y660	C552-V556 WeakPolarHBondContact O-CB 3.43Å; C552-V556 VanDerWaalsContact O-CG2 3.25Å; C552-V556 WeakPolarHBondContact O-CG2 3.39Å; C552-V556 PolarHBondContact O-N 3.11Å; N553-V556 WeakPolarHBondContact O-CA 3.47Å; N553-V556 WeakPolarHBondContact O-CB 3.48Å; N553-V556 PolarHBondContact O-N 3.46Å; V556-S560 WeakPolarHBondContact O-CB 3.07Å; V556-S560 PolarHBondContact O-N 3.5Å; V556-S560 VanDerWaalsContact O-N 3.1Å; V556-K653 HydrophobicContact CG2-CB 3.98Å; V556-K653 HydrophobicContact CG2-CG 4.3Å; V556-I657 HydrophobicContact CB-CG1 4.41Å; V556-I657 HydrophobicContact CG2-CD1 4.02Å; V556-I657 HydrophobicContact CG2-CG1 3.61Å; V556-Y660 HydrophobicContact CG1-CE2 4.15Å
557	N	92.7	Very high	91.7	Very high	29 Å²	29	22.9 Å²	22.9	16%	0.155	13%	0.127	C	C	.	.	H	α-helix	trans	-73.6	-44.6	177.3	-89.8	-30.1	0	0	0	112.6	D477 T481 Q487 N553 L554 L555 T559 S560	D477-N557 VanDerWaalsContact CG-ND2 3.27Å; D477-N557 PolarHBondContact O-ND2 2.93Å; D477-N557 WeakPolarHBondContact OD1-CB 3.45Å; D477-N557 PolarHBondContact OD1-ND2 2.93Å; D477-N557 PolarHBondContact OD2-ND2 2.88Å; T481-N557 PolarHBondContact OG1-ND2 2.7Å; Q487-N557 PolarHBondContact NE2-O 2.95Å; Q487-N557 VanDerWaalsContact NE2-O 3.13Å; N553-N557 PolarHBondContact O-N 3.5Å; L554-N557 PolarHBondContact O-N 3.49Å; L555-N557 VanDerWaalsContact C-N 3.33Å; N557-T559 PolarHBondContact O-N 2.81Å; N557-S560 WeakPolarHBondContact O-CB 3.41Å; N557-S560 PolarHBondContact O-N 3.21Å; N557-S560 PolarHBondContact O-OG 3.08Å
558	L	95.5	Very high	92	Very high	0 Å²	0	23 Å²	23	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-62.8	-26.5	175.7	-70.7	179.6	0	0	0	113.2	T480 Q487 L490 I491 I498 L554 L555 G564 R565 L568	T480-L558 HydrophobicContact CG2-CD2 3.86Å; Q487-L558 HydrophobicContact CB-CD2 3.86Å; Q487-L558 HydrophobicContact CG-CD2 4.04Å; L490-L558 HydrophobicContact CD2-CD2 4.34Å; I491-L558 HydrophobicContact CD1-CD2 4.04Å; I491-L558 HydrophobicContact CG1-CD1 4.14Å; I491-L558 HydrophobicContact CG1-CD2 4.07Å; I498-L558 HydrophobicContact CD1-CD1 3.52Å; L554-L558 HydrophobicContact CD1-CD1 3.84Å; L554-L558 HydrophobicContact CD1-CD2 4.42Å; L554-L558 HydrophobicContact CD1-CG 3.81Å; L554-L558 HydrophobicContact CG-CD1 3.93Å; L554-L558 HydrophobicContact CG-CG 4.29Å; L554-L558 WeakPolarHBondContact O-CB 3.39Å; L554-L558 VanDerWaalsContact O-CG 3.28Å; L554-L558 WeakPolarHBondContact O-CG 3.42Å; L554-L558 PolarHBondContact O-N 2.98Å; L555-L558 HydrophobicContact CD2-CD1 4.29Å; L558-G564 CarbonylContact O-C 3.6Å; L558-G564 WeakPolarHBondContact O-CA 3.34Å; L558-R565 PolarHBondContact O-N 2.77Å; L558-L568 HydrophobicContact CB-CD1 3.83Å
559	T	93.7	Very high	92.2	Very high	1 Å²	1	22.2 Å²	22.2	1%	0.006	13%	0.125	C	C	.	.	H	α-helix	trans	-92.8	-6	173.4	57.6	0	0	0	0	114.2	L555 N557 L561 R565 L568 I657 Y660 L661	L555-T559 WeakPolarHBondContact O-CB 3.47Å; L555-T559 WeakPolarHBondContact O-CG2 3.1Å; L555-T559 PolarHBondContact O-N 2.82Å; L555-T559 PolarHBondContact O-OG1 2.94Å; N557-T559 PolarHBondContact O-N 2.81Å; T559-L561 VanDerWaalsContact C-N 3.34Å; T559-L561 PolarHBondContact O-N 2.98Å; T559-R565 HydrophobicContact CG2-CG 4.34Å; T559-R565 WeakPolarHBondContact O-CD 3.44Å; T559-R565 WeakPolarHBondContact O-CG 3.34Å; T559-R565 PolarHBondContact O-NH1 2.69Å; T559-L568 HydrophobicContact CG2-CD1 3.73Å; T559-I657 HydrophobicContact CG2-CG2 4.1Å; T559-Y660 WeakPolarHBondContact O-CB 3.46Å; T559-L661 HydrophobicContact CG2-CD2 3.87Å; T559-L661 HydrophobicContact CG2-CG 4.14Å
560	S	92.6	Very high	92.4	Very high	24 Å²	24	24.4 Å²	24.4	17%	0.168	14%	0.137	C	C	.	.	H	α-helix	trans	-64.9	-31.9	-176.6	66.7	0	0	0	0	114.4	Q487 V556 N557 R565	Q487-S560 PolarHBondContact NE2-OG 2.91Å; V556-S560 WeakPolarHBondContact O-CB 3.07Å; V556-S560 PolarHBondContact O-N 3.5Å; V556-S560 VanDerWaalsContact O-N 3.1Å; N557-S560 WeakPolarHBondContact O-CB 3.41Å; N557-S560 PolarHBondContact O-N 3.21Å; N557-S560 PolarHBondContact O-OG 3.08Å; S560-R565 PolarHBondContact O-NH1 3.34Å
561	L	92.9	Very high	92.4	Very high	53 Å²	53	28.7 Å²	28.7	28%	0.277	16%	0.158	S	C	.	.	S	Bend	trans	-120.4	154.9	-178.2	-52.1	175.6	0	0	0	111.8	A484 T559 S563 G564 R565	A484-L561 HydrophobicContact CB-CD1 3.86Å; T559-L561 VanDerWaalsContact C-N 3.34Å; T559-L561 PolarHBondContact O-N 2.98Å; L561-S563 VanDerWaalsContact C-N 3.29Å; L561-S563 PolarHBondContact O-N 3.49Å; L561-G564 PolarHBondContact O-N 2.99Å; L561-R565 WeakPolarHBondContact O-CG 3.41Å; L561-R565 PolarHBondContact O-N 3.26Å; L561-R565 VanDerWaalsContact O-N 3.17Å
562	P	91.8	Very high	92.3	Very high	90 Å²	90	30.7 Å²	30.7	58%	0.584	17%	0.166	S	C	*	.	H	α-helix	trans	-57.9	-33.6	-176.7	-27.7	36.1	0	0	0	115.3	Q566	P562-Q566 WeakPolarHBondContact O-CB 3.44Å; P562-Q566 PolarHBondContact O-N 2.65Å
563	S	89.7	Confident	92.3	Very high	33 Å²	33	31.7 Å²	31.7	23%	0.231	18%	0.176	C	C	.	.	H	α-helix	trans	-66.1	-51.9	-179.3	55.9	0	0	0	0	112.1	A484 L561 R565 Q566 S567	A484-S563 WeakPolarHBondContact CA-OG 3.48Å; A484-S563 WeakPolarHBondContact CB-OG 3.47Å; A484-S563 PolarHBondContact O-OG 3.08Å; L561-S563 VanDerWaalsContact C-N 3.29Å; L561-S563 PolarHBondContact O-N 3.49Å; S563-R565 VanDerWaalsContact C-N 3.33Å; S563-R565 PolarHBondContact O-N 3.29Å; S563-Q566 PolarHBondContact O-N 2.96Å; S563-S567 PolarHBondContact O-N 3.05Å; S563-S567 PolarHBondContact O-OG 3.09Å
564	G	92.6	Very high	92.2	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-62.7	-39.2	177.2	0	0	0	0	0	112.3	I491 L558 L561 L568	I491-G564 VanDerWaalsContact CD1-O 3.25Å; I491-G564 WeakPolarHBondContact CD1-O 3.44Å; L558-G564 CarbonylContact O-C 3.6Å; L558-G564 WeakPolarHBondContact O-CA 3.34Å; L561-G564 PolarHBondContact O-N 2.99Å; G564-L568 WeakPolarHBondContact O-CB 3.42Å; G564-L568 WeakPolarHBondContact O-CG 3.44Å; G564-L568 PolarHBondContact O-N 3.3Å
565	R	93.1	Very high	92	Very high	18 Å²	18	30.2 Å²	30.2	7%	0.068	17%	0.169	C	C	.	.	H	α-helix	trans	-58.3	-48.8	171	-71.5	-166.3	-69.6	-121.7	26.5	112.1	L558 T559 S560 L561 S563 L569 Y660 E663	L558-R565 PolarHBondContact O-N 2.77Å; T559-R565 HydrophobicContact CG2-CG 4.34Å; T559-R565 WeakPolarHBondContact O-CD 3.44Å; T559-R565 WeakPolarHBondContact O-CG 3.34Å; T559-R565 PolarHBondContact O-NH1 2.69Å; S560-R565 PolarHBondContact O-NH1 3.34Å; L561-R565 WeakPolarHBondContact O-CG 3.41Å; L561-R565 PolarHBondContact O-N 3.26Å; L561-R565 VanDerWaalsContact O-N 3.17Å; S563-R565 VanDerWaalsContact C-N 3.33Å; S563-R565 PolarHBondContact O-N 3.29Å; R565-L569 WeakPolarHBondContact O-CD1 3.32Å; R565-L569 WeakPolarHBondContact O-CG 3.48Å; R565-L569 PolarHBondContact O-N 3.14Å; R565-L569 VanDerWaalsContact O-N 3.15Å; R565-Y660 WeakPolarHBondContact CD-O 3.5Å; R565-Y660 PolarHBondContact NE-O 3.46Å; R565-Y660 PolarHBondContact NH1-O 3.34Å; R565-E663 IonicContact CZ-OE2 2.64Å; R565-E663 IonicContact NH1-OE2 4Å; R565-E663 PolarHBondContact NH1-OE2 3.43Å; R565-E663 IonicContact NH2-OE2 3.94Å; R565-E663 PolarHBondContact NH2-OE2 2.98Å
566	Q	91.8	Very high	91.7	Very high	96 Å²	96	32.2 Å²	32.2	45%	0.449	18%	0.182	S	C	.	.	H	α-helix	trans	-65.2	-47.5	-178.2	-178.3	169.5	-17.2	0	0	111.3	P562 S563 L568 L569 D570	P562-Q566 WeakPolarHBondContact O-CB 3.44Å; P562-Q566 PolarHBondContact O-N 2.65Å; S563-Q566 PolarHBondContact O-N 2.96Å; Q566-L568 VanDerWaalsContact C-N 3.34Å; Q566-L568 PolarHBondContact O-N 3.18Å; Q566-L569 PolarHBondContact O-N 2.99Å; Q566-L569 VanDerWaalsContact O-N 3.14Å; Q566-D570 WeakPolarHBondContact CG-OD2 3.44Å; Q566-D570 PolarHBondContact NE2-OD2 3.39Å; Q566-D570 WeakPolarHBondContact O-CB 3.23Å; Q566-D570 VanDerWaalsContact O-CG 3.24Å; Q566-D570 PolarHBondContact O-N 3.16Å
567	S	92.5	Very high	91.6	Very high	13 Å²	13	31.2 Å²	31.2	9%	0.091	18%	0.176	C	C	.	.	H	α-helix	trans	-62.5	-37.6	179	-62.2	0	0	0	0	113	R488 S563 M571	R488-S567 WeakPolarHBondContact CG-OG 3.46Å; S563-S567 PolarHBondContact O-N 3.05Å; S563-S567 PolarHBondContact O-OG 3.09Å; S567-M571 WeakPolarHBondContact O-CB 3.42Å; S567-M571 PolarHBondContact O-N 3.44Å; S567-M571 VanDerWaalsContact O-N 3.09Å
568	L	92.6	Very high	91.5	Very high	3 Å²	3	29.8 Å²	29.8	2%	0.016	17%	0.168	C	C	.	.	H	α-helix	trans	-61	-44.5	173.2	-82.8	172.7	0	0	0	111.4	I491 I498 L555 L558 T559 G564 Q566 Y572 I577	I491-L568 HydrophobicContact CD1-CD2 4.27Å; I491-L568 HydrophobicContact CD1-CG 3.72Å; I491-L568 HydrophobicContact CG1-CD2 4.15Å; I491-L568 HydrophobicContact CG1-CG 4.17Å; I491-L568 HydrophobicContact CG2-CD2 4.39Å; I498-L568 HydrophobicContact CG2-CD2 3.79Å; L555-L568 HydrophobicContact CD2-CD1 4.41Å; L558-L568 HydrophobicContact CB-CD1 3.83Å; T559-L568 HydrophobicContact CG2-CD1 3.73Å; G564-L568 WeakPolarHBondContact O-CB 3.42Å; G564-L568 WeakPolarHBondContact O-CG 3.44Å; G564-L568 PolarHBondContact O-N 3.3Å; Q566-L568 VanDerWaalsContact C-N 3.34Å; Q566-L568 PolarHBondContact O-N 3.18Å; L568-Y572 HydrophobicContact CD2-CD2 4.37Å; L568-Y572 WeakPolarHBondContact O-CB 3.46Å; L568-Y572 PolarHBondContact O-N 3.46Å; L568-I577 HydrophobicContact CB-CD1 4.13Å
569	L	90.2	Very high	91.3	Very high	6 Å²	6	36.4 Å²	36.4	3%	0.031	19%	0.193	C	C	.	.	H	α-helix	trans	-71.5	-37.1	-178.8	-65.5	169.2	0	0	0	112.6	R565 Q566 M571 G573 P574 F667 L670	R565-L569 WeakPolarHBondContact O-CD1 3.32Å; R565-L569 WeakPolarHBondContact O-CG 3.48Å; R565-L569 PolarHBondContact O-N 3.14Å; R565-L569 VanDerWaalsContact O-N 3.15Å; Q566-L569 PolarHBondContact O-N 2.99Å; Q566-L569 VanDerWaalsContact O-N 3.14Å; L569-M571 VanDerWaalsContact C-N 3.34Å; L569-G573 VanDerWaalsContact O-CA 3.24Å; L569-G573 WeakPolarHBondContact O-CA 3.48Å; L569-G573 PolarHBondContact O-N 3.42Å; L569-P574 HydrophobicContact CD2-CB 4.48Å; L569-F667 HydrophobicContact CD1-CB 3.78Å; L569-F667 HydrophobicContact CD1-CD2 4.44Å; L569-F667 HydrophobicContact CD2-CB 4.43Å; L569-F667 HydrophobicContact CD2-CD2 3.56Å; L569-F667 HydrophobicContact CD2-CE2 4.29Å; L569-F667 HydrophobicContact CD2-CG 4.43Å; L569-L670 HydrophobicContact CB-CD1 4.48Å
570	D	90.5	Very high	90.9	Very high	79 Å²	79	36.7 Å²	36.7	42%	0.422	20%	0.195	S	C	.	.	H	α-helix	trans	-77.1	-21.6	-177.4	-68.1	-4.1	0	0	0	111.9	Q566 R666	Q566-D570 WeakPolarHBondContact CG-OD2 3.44Å; Q566-D570 PolarHBondContact NE2-OD2 3.39Å; Q566-D570 WeakPolarHBondContact O-CB 3.23Å; Q566-D570 VanDerWaalsContact O-CG 3.24Å; Q566-D570 PolarHBondContact O-N 3.16Å; D570-R666 IonicContact OD1-CZ 3.57Å; D570-R666 VanDerWaalsContact OD1-CZ 3.23Å; D570-R666 IonicContact OD1-NE 2.73Å; D570-R666 PolarHBondContact OD1-NE 3.49Å; D570-R666 IonicContact OD1-NH2 3.45Å; D570-R666 PolarHBondContact OD1-NH2 3.36Å; D570-R666 IonicContact OD2-CZ 3.49Å; D570-R666 IonicContact OD2-NE 2.8Å; D570-R666 IonicContact OD2-NH2 3.46Å; D570-R666 PolarHBondContact OD2-NH2 3.46Å; D570-R666 VanDerWaalsContact OD2-NH2 3.12Å
571	M	90.7	Very high	90.7	Very high	92 Å²	92	35.6 Å²	35.6	45%	0.453	19%	0.187	S	C	.	.	H	α-helix	trans	-99.6	-34.3	174.6	-69.9	-163.4	70.8	0	0	115.7	I491 P495 S567 L569	I491-M571 HydrophobicContact CG2-CB 4.45Å; I491-M571 HydrophobicContact CG2-CG 4.43Å; I491-M571 HydrophobicContact CG2-SD 3.93Å; I491-M571 VanDerWaalsContact O-SD 3.38Å; P495-M571 HydrophobicContact CB-CE 4.06Å; S567-M571 WeakPolarHBondContact O-CB 3.42Å; S567-M571 PolarHBondContact O-N 3.44Å; S567-M571 VanDerWaalsContact O-N 3.09Å; L569-M571 VanDerWaalsContact C-N 3.34Å
572	Y	90.1	Very high	90.4	Very high	42 Å²	42	33.3 Å²	33.3	17%	0.165	18%	0.176	C	C	.	.	H	α-helix	trans	-114.5	-16	-173.8	-63.4	-90.4	0	0	0	113.9	I491 P495 I498 K499 L502 L568 P576	I491-Y572 HydrophobicContact CG2-CE2 4.13Å; P495-Y572 VanDerWaalsContact C-OH 3.27Å; P495-Y572 WeakPolarHBondContact CA-OH 3.36Å; P495-Y572 VanDerWaalsContact CB-OH 3.26Å; P495-Y572 WeakPolarHBondContact CB-OH 3.44Å; P495-Y572 PolarHBondContact O-OH 3.23Å; I498-Y572 HydrophobicContact CB-CE1 4.29Å; I498-Y572 HydrophobicContact CB-CE2 3.99Å; I498-Y572 HydrophobicContact CG1-CE2 4.37Å; I498-Y572 HydrophobicContact CG2-CD1 4.44Å; I498-Y572 HydrophobicContact CG2-CD2 4.06Å; I498-Y572 HydrophobicContact CG2-CE1 4.02Å; I498-Y572 HydrophobicContact CG2-CE2 3.65Å; I498-Y572 HydrophobicContact CG2-CG 4.47Å; K499-Y572 HydrophobicContact CG-CE1 4.17Å; L502-Y572 HydrophobicContact CD1-CD1 4.22Å; L568-Y572 HydrophobicContact CD2-CD2 4.37Å; L568-Y572 WeakPolarHBondContact O-CB 3.46Å; L568-Y572 PolarHBondContact O-N 3.46Å; Y572-P576 VanDerWaalsContact O-CD 3.31Å; Y572-P576 WeakPolarHBondContact O-CD 3.44Å; Y572-P576 WeakPolarHBondContact O-CG 3.31Å
573	G	89.6	Confident	89.9	Confident	20 Å²	20	30.7 Å²	30.7	21%	0.206	16%	0.16	C	C	.	.			trans	65.9	175.9	-169.3	0	0	0	0	0	113.5	L569 I577	L569-G573 VanDerWaalsContact O-CA 3.24Å; L569-G573 WeakPolarHBondContact O-CA 3.48Å; L569-G573 PolarHBondContact O-N 3.42Å; G573-I577 WeakPolarHBondContact O-CD1 3.31Å
574	P	91.1	Very high	89.3	Confident	7 Å²	7	29.2 Å²	29.2	5%	0.045	15%	0.149	C	C	.	.	H	α-helix	trans	-76.5	-30.7	-178.8	30.1	-35.2	0	0	0	113.3	L569 I577 L578 F667 L670 A671	L569-P574 HydrophobicContact CD2-CB 4.48Å; P574-I577 PolarHBondContact O-N 2.78Å; P574-L578 HydrophobicContact CB-CD1 3.99Å; P574-L578 VanDerWaalsContact O-CB 3.28Å; P574-L578 WeakPolarHBondContact O-CB 3.43Å; P574-L578 WeakPolarHBondContact O-CD1 3.22Å; P574-L578 VanDerWaalsContact O-CG 3.3Å; P574-L578 WeakPolarHBondContact O-CG 3.39Å; P574-L578 PolarHBondContact O-N 3.31Å; P574-F667 HydrophobicContact CB-CD2 3.9Å; P574-F667 HydrophobicContact CB-CE2 3.7Å; P574-L670 HydrophobicContact CG-CB 4.02Å; P574-A671 HydrophobicContact CB-CB 3.93Å; P574-A671 HydrophobicContact CG-CB 4.21Å
575	G	90.1	Very high	88.5	Confident	1 Å²	1	30.3 Å²	30.3	1%	0.01	16%	0.155	C	C	.	.	H	α-helix	trans	-60.8	-55.1	-169.5	0	0	0	0	0	114.8	I577 L578 R579 D676	G575-I577 VanDerWaalsContact C-N 3.31Å; G575-I577 PolarHBondContact O-N 3.42Å; G575-L578 PolarHBondContact O-N 3.16Å; G575-R579 VanDerWaalsContact O-CB 3.28Å; G575-R579 WeakPolarHBondContact O-CB 3.3Å; G575-R579 PolarHBondContact O-N 2.65Å; G575-D676 WeakPolarHBondContact CA-OD2 3.49Å
576	P	88.2	Confident	87.4	Confident	45 Å²	45	31.5 Å²	31.5	29%	0.292	17%	0.166	S	C	.	.	H	α-helix	trans	-63.2	-36	179.1	-24.4	35.8	0	0	0	113.1	Y572 S580 D676	Y572-P576 VanDerWaalsContact O-CD 3.31Å; Y572-P576 WeakPolarHBondContact O-CD 3.44Å; Y572-P576 WeakPolarHBondContact O-CG 3.31Å; P576-S580 WeakPolarHBondContact O-CB 3.31Å; P576-S580 PolarHBondContact O-N 3.16Å; P576-S580 PolarHBondContact O-OG 3.4Å; P576-D676 WeakPolarHBondContact CD-OD2 3.5Å
577	I	91.4	Very high	86.1	Confident	3 Å²	3	28.6 Å²	28.6	2%	0.015	16%	0.155	C	C	.	.	H	α-helix	trans	-66.9	-52.4	178.2	-56.9	177	0	0	0	109.8	L502 L568 G573 P574 G575 R579 S580 L581 L661	L502-I577 HydrophobicContact CD2-CG1 4.45Å; L568-I577 HydrophobicContact CB-CD1 4.13Å; G573-I577 WeakPolarHBondContact O-CD1 3.31Å; P574-I577 PolarHBondContact O-N 2.78Å; G575-I577 VanDerWaalsContact C-N 3.31Å; G575-I577 PolarHBondContact O-N 3.42Å; I577-R579 PolarHBondContact O-N 2.96Å; I577-S580 PolarHBondContact O-N 3.26Å; I577-L581 HydrophobicContact CG2-CD1 3.93Å; I577-L581 WeakPolarHBondContact O-CG 3.24Å; I577-L581 PolarHBondContact O-N 3.34Å; I577-L661 HydrophobicContact CG2-CD1 3.86Å
578	L	92.1	Very high	84.1	Confident	0 Å²	0	29.2 Å²	29.2	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-58.1	-48.6	176.2	-78.4	163.6	0	0	0	111.6	P574 G575 S580 L581 A582 L658 F667 A671 L681 V684	P574-L578 HydrophobicContact CB-CD1 3.99Å; P574-L578 VanDerWaalsContact O-CB 3.28Å; P574-L578 WeakPolarHBondContact O-CB 3.43Å; P574-L578 WeakPolarHBondContact O-CD1 3.22Å; P574-L578 VanDerWaalsContact O-CG 3.3Å; P574-L578 WeakPolarHBondContact O-CG 3.39Å; P574-L578 PolarHBondContact O-N 3.31Å; G575-L578 PolarHBondContact O-N 3.16Å; L578-S580 PolarHBondContact O-N 3.32Å; L578-L581 PolarHBondContact O-N 2.85Å; L578-L581 VanDerWaalsContact O-N 3.15Å; L578-A582 PolarHBondContact O-N 3.36Å; L578-L658 HydrophobicContact CD2-CD2 3.97Å; L578-F667 HydrophobicContact CD1-CE2 4.11Å; L578-F667 HydrophobicContact CD1-CZ 4.07Å; L578-F667 HydrophobicContact CD2-CE2 4.5Å; L578-F667 HydrophobicContact CD2-CZ 3.81Å; L578-F667 HydrophobicContact CG-CE2 4.18Å; L578-F667 HydrophobicContact CG-CZ 3.98Å; L578-A671 HydrophobicContact CD1-CB 4.06Å; L578-L681 HydrophobicContact CD1-CB 4.19Å; L578-V684 HydrophobicContact CB-CG2 4Å; L578-V684 HydrophobicContact CD2-CB 4.16Å; L578-V684 HydrophobicContact CD2-CG2 3.66Å; L578-V684 HydrophobicContact CG-CG2 4.48Å; L578-V684 WeakPolarHBondContact O-CG2 3.46Å
579	R	89.5	Confident	81.3	Confident	139 Å²	139	31.4 Å²	31.4	53%	0.525	17%	0.17	S	C	.	.	H	α-helix	trans	-57.2	-36.9	178.3	-162.1	-169.7	-58.6	-176.2	2.9	111.8	G575 I577 S583 D676	G575-R579 VanDerWaalsContact O-CB 3.28Å; G575-R579 WeakPolarHBondContact O-CB 3.3Å; G575-R579 PolarHBondContact O-N 2.65Å; I577-R579 PolarHBondContact O-N 2.96Å; R579-S583 PolarHBondContact O-N 2.95Å; R579-D676 IonicContact CZ-OD1 2.77Å; R579-D676 IonicContact NH2-OD1 3.47Å; R579-D676 PolarHBondContact NH2-OD1 3.02Å; R579-D676 IonicContact NH2-OD2 2.59Å
580	S	86.8	Confident	78.7	Confident	6 Å²	6	34.8 Å²	34.8	4%	0.042	20%	0.195	C	C	.	.	H	α-helix	trans	-74.7	-37.9	178.8	-52.2	0	0	0	0	113	N506 P576 I577 L578 A582 S583 C584	N506-S580 PolarHBondContact ND2-OG 3.44Å; N506-S580 WeakPolarHBondContact OD1-CA 3.43Å; N506-S580 WeakPolarHBondContact OD1-CB 3.38Å; N506-S580 PolarHBondContact OD1-OG 2.72Å; P576-S580 WeakPolarHBondContact O-CB 3.31Å; P576-S580 PolarHBondContact O-N 3.16Å; P576-S580 PolarHBondContact O-OG 3.4Å; I577-S580 PolarHBondContact O-N 3.26Å; L578-S580 PolarHBondContact O-N 3.32Å; S580-A582 VanDerWaalsContact C-N 3.33Å; S580-A582 PolarHBondContact O-N 3.36Å; S580-S583 WeakPolarHBondContact O-CB 3.39Å; S580-S583 PolarHBondContact O-N 2.78Å; S580-C584 PolarHBondContact O-N 3.4Å
581	L	88.3	Confident	75.8	Confident	1 Å²	1	33.7 Å²	33.7	1%	0.005	19%	0.188	C	C	.	.	H	α-helix	trans	-65	-36.1	173	-65.2	165.2	0	0	0	111.6	I577 L578 C584 L585 A654 I657 L658 L661 V684	I577-L581 HydrophobicContact CG2-CD1 3.93Å; I577-L581 WeakPolarHBondContact O-CG 3.24Å; I577-L581 PolarHBondContact O-N 3.34Å; L578-L581 PolarHBondContact O-N 2.85Å; L578-L581 VanDerWaalsContact O-N 3.15Å; L581-C584 PolarHBondContact O-N 2.96Å; L581-L585 VanDerWaalsContact O-CG 3.31Å; L581-L585 WeakPolarHBondContact O-CG 3.37Å; L581-L585 PolarHBondContact O-N 3.41Å; L581-A654 HydrophobicContact CD2-CB 3.74Å; L581-I657 HydrophobicContact CD1-CB 4.44Å; L581-I657 HydrophobicContact CD1-CG2 3.76Å; L581-I657 HydrophobicContact CD2-CB 3.98Å; L581-I657 HydrophobicContact CD2-CD1 3.9Å; L581-I657 HydrophobicContact CD2-CG2 3.94Å; L581-I657 HydrophobicContact CG-CG2 4.49Å; L581-L658 HydrophobicContact CB-CD2 4.49Å; L581-L658 HydrophobicContact CD1-CD2 3.67Å; L581-L658 HydrophobicContact CD1-CG 4.04Å; L581-L661 HydrophobicContact CD1-CD1 4.04Å; L581-V684 HydrophobicContact CB-CG2 4.4Å
582	A	85.9	Confident	72.7	Confident	6 Å²	6	32.7 Å²	32.7	5%	0.05	19%	0.191	C	C	.	.	H	α-helix	trans	-62.1	-41.3	172.4	0	0	0	0	0	112.6	L578 S580 L585 S586 V684 S687	L578-A582 PolarHBondContact O-N 3.36Å; S580-A582 VanDerWaalsContact C-N 3.33Å; S580-A582 PolarHBondContact O-N 3.36Å; A582-L585 PolarHBondContact O-N 2.96Å; A582-S586 WeakPolarHBondContact O-CB 3.35Å; A582-S586 PolarHBondContact O-N 2.97Å; A582-S586 PolarHBondContact O-OG 3.42Å; A582-V684 HydrophobicContact CB-CG2 3.91Å; A582-S687 PolarHBondContact O-OG 3.29Å
583	S	81.3	Confident	69.5	Low	35 Å²	35	36.4 Å²	36.4	25%	0.245	21%	0.205	C	C	.	.	H	α-helix	trans	-62.4	-43.2	173.3	-173.9	0	0	0	0	111.9	N506 R579 S580 L585 S586 T587	N506-S583 WeakPolarHBondContact OD1-CB 3.26Å; R579-S583 PolarHBondContact O-N 2.95Å; S580-S583 WeakPolarHBondContact O-CB 3.39Å; S580-S583 PolarHBondContact O-N 2.78Å; S583-L585 PolarHBondContact O-N 3.05Å; S583-S586 PolarHBondContact O-OG 2.96Å; S583-T587 WeakPolarHBondContact O-CB 3.45Å; S583-T587 WeakPolarHBondContact O-CG2 3.42Å; S583-T587 PolarHBondContact O-N 3.42Å; S583-T587 PolarHBondContact O-OG1 3.24Å
584	C	76.2	Confident	66.2	Low	1 Å²	1	42.5 Å²	42.5	1%	0.007	23%	0.229	C	C	.	.	H	α-helix	trans	-65.4	-36.5	177.1	-168.2	0	0	0	0	113.3	I505 S580 L581 T587 C650 A654	I505-C584 HydrophobicContact CG2-CB 3.78Å; S580-C584 PolarHBondContact O-N 3.4Å; L581-C584 PolarHBondContact O-N 2.96Å; C584-T587 PolarHBondContact O-OG1 3.39Å; C584-C650 VanDerWaalsContact SG-C 3.6Å; C584-A654 HydrophobicContact CB-CB 4.13Å
585	L	76	Confident	63.1	Low	24 Å²	24	48.2 Å²	48.2	13%	0.126	26%	0.263	C	S	.	.	H	α-helix	trans	-70.7	-49.2	176.5	-70.7	169.9	0	0	0	111.3	L581 A582 S583 S588 A651 A654 L658 V684	L581-L585 VanDerWaalsContact O-CG 3.31Å; L581-L585 WeakPolarHBondContact O-CG 3.37Å; L581-L585 PolarHBondContact O-N 3.41Å; A582-L585 PolarHBondContact O-N 2.96Å; S583-L585 PolarHBondContact O-N 3.05Å; L585-S588 PolarHBondContact O-N 3.47Å; L585-S588 PolarHBondContact O-OG 2.89Å; L585-A651 HydrophobicContact CD2-CB 4.29Å; L585-A654 HydrophobicContact CD2-CB 4.31Å; L585-A654 HydrophobicContact CG-CB 4.39Å; L585-L658 HydrophobicContact CD1-CD1 4.1Å; L585-V684 HydrophobicContact CD1-CG1 4.42Å
586	S	71.1	Confident	59.8	Low	42 Å²	42	56 Å²	56	29%	0.294	30%	0.304	S	S	.	.	H	α-helix	trans	-66.4	-39.6	-177.3	52.3	0	0	0	0	113.4	A582 S583 S588 M589 S590	A582-S586 WeakPolarHBondContact O-CB 3.35Å; A582-S586 PolarHBondContact O-N 2.97Å; A582-S586 PolarHBondContact O-OG 3.42Å; S583-S586 PolarHBondContact O-OG 2.96Å; S586-S588 PolarHBondContact O-N 3.15Å; S586-M589 PolarHBondContact O-N 3.34Å; S586-S590 PolarHBondContact O-N 2.95Å
587	T	63.7	Low	56.7	Low	35 Å²	35	58.5 Å²	58.5	22%	0.215	32%	0.323	C	S	.	.	H	α-helix	trans	-64.2	-20.6	178.5	50.2	0	0	0	0	114	R548 S583 C584 M589	R548-T587 PolarHBondContact NH1-OG1 3.21Å; R548-T587 PolarHBondContact NH2-OG1 2.98Å; S583-T587 WeakPolarHBondContact O-CB 3.45Å; S583-T587 WeakPolarHBondContact O-CG2 3.42Å; S583-T587 PolarHBondContact O-N 3.42Å; S583-T587 PolarHBondContact O-OG1 3.24Å; C584-T587 PolarHBondContact O-OG1 3.39Å; T587-M589 VanDerWaalsContact C-N 3.27Å; T587-M589 PolarHBondContact O-N 2.88Å
588	S	50.9	Low	53.8	Low	27 Å²	27	64.2 Å²	64.2	19%	0.189	36%	0.36	C	S	.	.	H	α-helix	trans	-69	-22.1	171.7	77.5	0	0	0	0	113.9	L585 S586	L585-S588 PolarHBondContact O-N 3.47Å; L585-S588 PolarHBondContact O-OG 2.89Å; S586-S588 PolarHBondContact O-N 3.15Å
589	M	33.4	Very low	50.5	Low	49 Å²	49	70.7 Å²	70.7	24%	0.241	40%	0.4	C	S	.	.	H	α-helix	trans	-92.7	-36	-179.3	-65.2	-87.5	79.2	0	0	113.2	S586 T587 N591 S592	S586-M589 PolarHBondContact O-N 3.34Å; T587-M589 VanDerWaalsContact C-N 3.27Å; T587-M589 PolarHBondContact O-N 2.88Å; M589-N591 PolarHBondContact O-N 3.43Å; M589-S592 PolarHBondContact O-N 3.14Å; M589-S592 PolarHBondContact O-OG 3.15Å
590	S	36.3	Very low	47.3	Very low	77 Å²	77	72.3 Å²	72.3	54%	0.538	42%	0.418	S	S	.	.	H	α-helix	trans	-56.7	-40	-178.8	-55.5	0	0	0	0	112.3	S586 S592 Y593	S586-S590 PolarHBondContact O-N 2.95Å; S590-S592 PolarHBondContact O-N 3.38Å; S590-Y593 PolarHBondContact O-N 2.73Å
591	N	29.4	Very low	44.2	Very low	55 Å²	55	78.2 Å²	78.2	29%	0.294	45%	0.454	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.8	-6.5	-178.6	-65.5	-1.5	0	0	0	113.9	M589 S643	M589-N591 PolarHBondContact O-N 3.43Å; N591-S643 PolarHBondContact ND2-OG 3.35Å
592	S	24.9	Very low	41	Very low	72 Å²	72	83.8 Å²	83.8	50%	0.503	49%	0.493	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.1	-11	172	60.5	0	0	0	0	114.4	M589 S590	M589-S592 PolarHBondContact O-N 3.14Å; M589-S592 PolarHBondContact O-OG 3.15Å; S590-S592 PolarHBondContact O-N 3.38Å
593	Y	23	Very low	38.1	Very low	120 Å²	120	89.4 Å²	89.4	47%	0.471	53%	0.527	S	S	.	.			trans	-117.3	58.6	-172.9	-80.9	-78.4	0	0	0	113.7	S590 T695	S590-Y593 PolarHBondContact O-N 2.73Å; Y593-T695 PolarHBondContact OH-OG1 2.99Å
594	Q	21.6	Very low	35.5	Very low	148 Å²	148	95.9 Å²	95.9	69%	0.692	56%	0.559	S	S	*	*			trans	-138.1	71.5	162.5	-74.6	-160.4	-7.9	0	0	112.8
595	V	24.8	Very low	33.1	Very low	127 Å²	127	102.8 Å²	102.8	77%	0.77	59%	0.594	S	S	*	*			trans	-135.9	72.6	158.3	-171.1	0	0	0	0	108.8	S597	V595-S597 VanDerWaalsContact C-N 3.33Å; V595-S597 PolarHBondContact O-N 3.33Å
596	N	21.6	Very low	31	Very low	164 Å²	164	107.7 Å²	107.7	88%	0.877	63%	0.631	S	S	*	*			trans	-78.4	82	173.7	-76.3	-4.6	0	0	0	110
597	S	22.7	Very low	29	Very low	98 Å²	98	106.9 Å²	106.9	69%	0.685	63%	0.625	S	S	*	*	P	Polyproline II helix	trans	-85.3	132	164.1	-58.4	0	0	0	0	109.6	V595	V595-S597 VanDerWaalsContact C-N 3.33Å; V595-S597 PolarHBondContact O-N 3.33Å
598	P	30.9	Very low	27.3	Very low	123 Å²	123	112.4 Å²	112.4	80%	0.799	65%	0.652	S	S	*	*	P	Polyproline II helix	trans	-69	153.5	-174	27.3	-34.6	0	0	0	113.1	L600	P598-L600 PolarHBondContact O-N 3.14Å
599	T	22	Very low	26.2	Very low	136 Å²	136	113.1 Å²	113.1	83%	0.834	66%	0.66	S	S	*	*	P	Polyproline II helix	trans	-53.4	122.9	-175.7	47.2	0	0	0	0	114.9
600	L	21.8	Very low	25.9	Very low	172 Å²	172	114 Å²	114	90%	0.901	67%	0.666	S	S	*	*			trans	-136.9	163.7	149.2	-82.8	-177	0	0	0	110.5	P598	P598-L600 PolarHBondContact O-N 3.14Å
601	T	21.6	Very low	25.5	Very low	130 Å²	130	112.7 Å²	112.7	80%	0.798	66%	0.66	S	S	*	*			trans	-82.3	159.1	-154.3	43.9	0	0	0	0	115.8	T603	T601-T603 PolarHBondContact O-N 2.91Å
602	S	22.6	Very low	25.4	Very low	119 Å²	119	112.7 Å²	112.7	83%	0.832	67%	0.667	S	S	*	*			trans	-64.3	112.2	-174.9	52.7	0	0	0	0	113.9
603	T	24	Very low	25.5	Very low	123 Å²	123	117.7 Å²	117.7	76%	0.755	68%	0.675	S	S	*	*			trans	-134.7	149.2	155	44.1	0	0	0	0	109.8	T601 I605	T601-T603 PolarHBondContact O-N 2.91Å; T603-I605 PolarHBondContact O-N 3.34Å
604	N	27.3	Very low	25.6	Very low	171 Å²	171	113.3 Å²	113.3	91%	0.914	67%	0.666	S	S	*	*			trans	-73.4	112.7	-164.7	-65.8	-43.9	0	0	0	112.9
605	I	25.4	Very low	25.9	Very low	146 Å²	146	112 Å²	112	75%	0.749	66%	0.663	S	S	*	*			trans	-124.1	113	168.1	-57.1	-179.1	0	0	0	108.3	T603 S607	T603-I605 PolarHBondContact O-N 3.34Å; I605-S607 PolarHBondContact O-N 2.98Å
606	S	31.7	Very low	26.1	Very low	128 Å²	128	110.5 Å²	110.5	90%	0.895	65%	0.654	S	S	*	*			trans	-97.4	14.2	-150.4	51	0	0	0	0	116.4
607	S	29.8	Very low	26.3	Very low	24 Å²	24	104.4 Å²	104.4	17%	0.168	63%	0.63	C	S	.	*			trans	-158.5	120	-173.4	171.3	0	0	0	0	113.9	I605 A609 D610 A611	I605-S607 PolarHBondContact O-N 2.98Å; S607-A609 PolarHBondContact O-N 3Å; S607-A609 PolarHBondContact OG-N 2.94Å; S607-D610 WeakPolarHBondContact CB-OD2 3.45Å; S607-D610 CarbonylContact O-C 3.57Å; S607-D610 PolarHBondContact O-N 3.38Å; S607-D610 PolarHBondContact OG-N 3.07Å; S607-D610 PolarHBondContact OG-OD2 3.17Å; S607-A611 PolarHBondContact O-N 2.7Å
608	L	26.8	Very low	26.4	Very low	151 Å²	151	109.2 Å²	109.2	79%	0.791	63%	0.633	S	S	*	*	H	α-helix	trans	-64.4	-23.4	170.4	-173.1	64	0	0	0	112.4	D610 A611 A612	L608-D610 VanDerWaalsContact C-N 3.26Å; L608-D610 PolarHBondContact O-N 3.13Å; L608-A611 HydrophobicContact CD1-CB 4.23Å; L608-A612 WeakPolarHBondContact O-CB 3.48Å; L608-A612 PolarHBondContact O-N 3.34Å
609	A	28.4	Very low	26.2	Very low	42 Å²	42	109.1 Å²	109.1	35%	0.347	63%	0.625	S	S	.	*	H	α-helix	trans	-71.9	-23.8	172.3	0	0	0	0	0	111.9	S607 R613	S607-A609 PolarHBondContact O-N 3Å; S607-A609 PolarHBondContact OG-N 2.94Å; A609-R613 WeakPolarHBondContact O-CB 3.25Å; A609-R613 WeakPolarHBondContact O-CG 3.49Å; A609-R613 PolarHBondContact O-N 3.18Å
610	D	28	Very low	26.6	Very low	68 Å²	68	106.2 Å²	106.2	36%	0.364	61%	0.61	S	S	.	*	H	α-helix	trans	-96.9	-19.5	176.3	-60.4	-60.6	0	0	0	112.4	S607 L608 R613 G614	S607-D610 WeakPolarHBondContact CB-OD2 3.45Å; S607-D610 CarbonylContact O-C 3.57Å; S607-D610 PolarHBondContact O-N 3.38Å; S607-D610 PolarHBondContact OG-N 3.07Å; S607-D610 PolarHBondContact OG-OD2 3.17Å; L608-D610 VanDerWaalsContact C-N 3.26Å; L608-D610 PolarHBondContact O-N 3.13Å; D610-R613 IonicContact OD1-CZ 2.73Å; D610-R613 IonicContact OD1-NE 3.96Å; D610-R613 PolarHBondContact OD1-NE 3.04Å; D610-R613 IonicContact OD1-NH2 2.82Å; D610-R613 PolarHBondContact OD1-NH2 2.9Å; D610-R613 IonicContact OD2-NH2 3.76Å; D610-G614 WeakPolarHBondContact O-CA 3.45Å; D610-G614 PolarHBondContact O-N 3.17Å
611	A	28.2	Very low	26.9	Very low	50 Å²	50	102 Å²	102	41%	0.413	60%	0.6	S	S	.	*	H	α-helix	trans	-65.3	-40.6	154.7	0	0	0	0	0	111.2	S607 L608 G614 L615	S607-A611 PolarHBondContact O-N 2.7Å; L608-A611 HydrophobicContact CD1-CB 4.23Å; A611-G614 CarbonylContact O-C 3.58Å; A611-G614 PolarHBondContact O-N 2.69Å; A611-L615 WeakPolarHBondContact O-CB 3.42Å; A611-L615 PolarHBondContact O-N 3Å
612	A	26.7	Very low	27.1	Very low	54 Å²	54	98.3 Å²	98.3	45%	0.446	58%	0.58	S	S	.	*	H	α-helix	trans	-71.4	-48.1	177.4	0	0	0	0	0	112.9	L608 G614 L615 V616	L608-A612 WeakPolarHBondContact O-CB 3.48Å; L608-A612 PolarHBondContact O-N 3.34Å; A612-G614 PolarHBondContact O-N 3Å; A612-L615 PolarHBondContact O-N 2.97Å; A612-V616 WeakPolarHBondContact O-CG2 3.46Å; A612-V616 PolarHBondContact O-N 3.24Å
613	R	26.9	Very low	27.3	Very low	178 Å²	178	97.8 Å²	97.8	67%	0.672	58%	0.576	S	S	*	*	H	α-helix	trans	-63.6	-30	169.9	-72.4	-167.7	-67.5	-172.6	-2.7	111.9	A609 D610 G617	A609-R613 WeakPolarHBondContact O-CB 3.25Å; A609-R613 WeakPolarHBondContact O-CG 3.49Å; A609-R613 PolarHBondContact O-N 3.18Å; D610-R613 IonicContact OD1-CZ 2.73Å; D610-R613 IonicContact OD1-NE 3.96Å; D610-R613 PolarHBondContact OD1-NE 3.04Å; D610-R613 IonicContact OD1-NH2 2.82Å; D610-R613 PolarHBondContact OD1-NH2 2.9Å; D610-R613 IonicContact OD2-NH2 3.76Å; R613-G617 VanDerWaalsContact O-CA 3.3Å; R613-G617 WeakPolarHBondContact O-CA 3.46Å; R613-G617 PolarHBondContact O-N 3.37Å
614	G	24.9	Very low	27.5	Very low	27 Å²	27	94.5 Å²	94.5	28%	0.278	57%	0.566	S	S	.	*	H	α-helix	trans	-70.7	-37.3	172.9	0	0	0	0	0	113	D610 A611 A612 R618	D610-G614 WeakPolarHBondContact O-CA 3.45Å; D610-G614 PolarHBondContact O-N 3.17Å; A611-G614 CarbonylContact O-C 3.58Å; A611-G614 PolarHBondContact O-N 2.69Å; A612-G614 PolarHBondContact O-N 3Å; G614-R618 WeakPolarHBondContact O-CB 3.46Å; G614-R618 WeakPolarHBondContact O-CG 3.33Å; G614-R618 PolarHBondContact O-N 2.89Å
615	L	27.2	Very low	27.4	Very low	120 Å²	120	94.4 Å²	94.4	63%	0.628	57%	0.565	S	S	*	*	H	α-helix	trans	-71	-50.8	176.3	-149.4	80.9	0	0	0	110.3	A611 A612 R618 L619	A611-L615 WeakPolarHBondContact O-CB 3.42Å; A611-L615 PolarHBondContact O-N 3Å; A612-L615 PolarHBondContact O-N 2.97Å; L615-R618 PolarHBondContact O-N 3.49Å; L615-L619 HydrophobicContact CG-CD1 4.44Å; L615-L619 WeakPolarHBondContact O-CB 3.16Å; L615-L619 WeakPolarHBondContact O-CD1 3.01Å; L615-L619 VanDerWaalsContact O-CG 3.22Å; L615-L619 WeakPolarHBondContact O-CG 3.45Å; L615-L619 PolarHBondContact O-N 3.22Å
616	V	29	Very low	27.3	Very low	96 Å²	96	96.3 Å²	96.3	58%	0.582	57%	0.568	S	S	*	*	H	α-helix	trans	-60.3	-47.9	175.2	175.4	0	0	0	0	110.3	A612 R618 L619 S620	A612-V616 WeakPolarHBondContact O-CG2 3.46Å; A612-V616 PolarHBondContact O-N 3.24Å; V616-R618 PolarHBondContact O-N 3.34Å; V616-L619 PolarHBondContact O-N 3.1Å; V616-S620 PolarHBondContact O-N 3.42Å; V616-S620 PolarHBondContact O-OG 3.29Å; V616-S620 VanDerWaalsContact O-OG 3.11Å
617	G	26	Very low	26.9	Very low	36 Å²	36	97.4 Å²	97.4	37%	0.371	56%	0.564	S	S	.	*	H	α-helix	trans	-65.2	-37.1	179.9	0	0	0	0	0	114	R613 S620 A621	R613-G617 VanDerWaalsContact O-CA 3.3Å; R613-G617 WeakPolarHBondContact O-CA 3.46Å; R613-G617 PolarHBondContact O-N 3.37Å; G617-S620 PolarHBondContact O-N 3.38Å; G617-A621 VanDerWaalsContact O-CB 3.23Å; G617-A621 WeakPolarHBondContact O-CB 3.5Å; G617-A621 PolarHBondContact O-N 2.93Å
618	R	26.1	Very low	26.7	Very low	199 Å²	199	102.4 Å²	102.4	75%	0.751	59%	0.594	S	S	*	*	H	α-helix	trans	-72.1	-37.7	174.2	-74.3	174.6	179.3	-156.4	-1.3	111.9	G614 L615 V616 S620 A621 S622	G614-R618 WeakPolarHBondContact O-CB 3.46Å; G614-R618 WeakPolarHBondContact O-CG 3.33Å; G614-R618 PolarHBondContact O-N 2.89Å; L615-R618 PolarHBondContact O-N 3.49Å; V616-R618 PolarHBondContact O-N 3.34Å; R618-S620 VanDerWaalsContact C-N 3.3Å; R618-S620 PolarHBondContact O-N 2.86Å; R618-A621 PolarHBondContact O-N 2.92Å; R618-S622 WeakPolarHBondContact O-CB 3.43Å; R618-S622 PolarHBondContact O-N 2.87Å; R618-S622 PolarHBondContact O-OG 3.13Å
619	L	26.3	Very low	26.6	Very low	121 Å²	121	101.6 Å²	101.6	63%	0.634	60%	0.595	S	S	*	*	H	α-helix	trans	-66.4	-30.8	172.5	-70.8	168.5	0	0	0	112.5	L615 V616	L615-L619 HydrophobicContact CG-CD1 4.44Å; L615-L619 WeakPolarHBondContact O-CB 3.16Å; L615-L619 WeakPolarHBondContact O-CD1 3.01Å; L615-L619 VanDerWaalsContact O-CG 3.22Å; L615-L619 WeakPolarHBondContact O-CG 3.45Å; L615-L619 PolarHBondContact O-N 3.22Å; V616-L619 PolarHBondContact O-N 3.1Å
620	S	29.1	Very low	26.5	Very low	76 Å²	76	106.2 Å²	106.2	53%	0.531	61%	0.614	S	S	.	*	H	α-helix	trans	-74.7	-38.8	169.7	-61.4	0	0	0	0	112.6	V616 G617 R618 S623	V616-S620 PolarHBondContact O-N 3.42Å; V616-S620 PolarHBondContact O-OG 3.29Å; V616-S620 VanDerWaalsContact O-OG 3.11Å; G617-S620 PolarHBondContact O-N 3.38Å; R618-S620 VanDerWaalsContact C-N 3.3Å; R618-S620 PolarHBondContact O-N 2.86Å; S620-S623 WeakPolarHBondContact O-CB 3.43Å; S620-S623 PolarHBondContact O-OG 3.11Å
621	A	28.8	Very low	26.5	Very low	83 Å²	83	106.5 Å²	106.5	69%	0.686	62%	0.621	S	S	*	*	H	α-helix	trans	-74.3	-29.4	-178.7	0	0	0	0	0	113.3	G617 R618 S623	G617-A621 VanDerWaalsContact O-CB 3.23Å; G617-A621 WeakPolarHBondContact O-CB 3.5Å; G617-A621 PolarHBondContact O-N 2.93Å; R618-A621 PolarHBondContact O-N 2.92Å; A621-S623 PolarHBondContact O-N 3.03Å; A621-S623 VanDerWaalsContact O-N 3.07Å
622	S	25.3	Very low	26.5	Very low	53 Å²	53	109 Å²	109	37%	0.371	63%	0.628	S	S	.	*	T	Hydrogen-bonded Turn	trans	-79	27.3	173.4	72	0	0	0	0	113.5	R618 G624	R618-S622 WeakPolarHBondContact O-CB 3.43Å; R618-S622 PolarHBondContact O-N 2.87Å; R618-S622 PolarHBondContact O-OG 3.13Å; S622-G624 PolarHBondContact O-N 3.15Å
623	S	27.4	Very low	26.6	Very low	107 Å²	107	112.6 Å²	112.6	75%	0.748	64%	0.64	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.7	-12.5	173.6	-64.4	0	0	0	0	112.8	S620 A621	S620-S623 WeakPolarHBondContact O-CB 3.43Å; S620-S623 PolarHBondContact O-OG 3.11Å; A621-S623 PolarHBondContact O-N 3.03Å; A621-S623 VanDerWaalsContact O-N 3.07Å
624	G	28	Very low	27	Very low	54 Å²	54	108.1 Å²	108.1	56%	0.557	63%	0.632	S	S	*	*	S	Bend	trans	-96.9	132.9	162.4	0	0	0	0	0	111.2	S622	S622-G624 PolarHBondContact O-N 3.15Å
625	L	25.3	Very low	27.4	Very low	170 Å²	170	110.3 Å²	110.3	89%	0.89	64%	0.637	S	S	*	*	S	Bend	trans	72.1	51.2	169.7	-55.5	173.4	0	0	0	118
626	F	23.7	Very low	27.6	Very low	185 Å²	185	109 Å²	109	81%	0.811	63%	0.63	S	S	*	*			trans	-137.7	88.6	150.3	-87.7	-71.3	0	0	0	112.8
627	N	24	Very low	27.7	Very low	151 Å²	151	107.5 Å²	107.5	81%	0.807	63%	0.627	S	S	*	*			trans	-84.4	170	152.8	-94.8	-21.6	0	0	0	109.7
628	T	23.6	Very low	28	Very low	130 Å²	130	109.1 Å²	109.1	80%	0.798	62%	0.624	S	S	*	*	S	Bend	trans	68.9	79.5	179	59.8	0	0	0	0	117.1
629	T	26.7	Very low	28.3	Very low	133 Å²	133	102.2 Å²	102.2	82%	0.816	61%	0.606	S	S	*	*				36.2	108.8	124.7	54.6	0	0	0	0	120
630	N	26	Very low	28.8	Very low	139 Å²	139	98.5 Å²	98.5	74%	0.743	59%	0.587	S	S	*	*			trans	-158.7	99.8	139.3	-124.8	-33.5	0	0	0	110.9
631	S	28.5	Very low	29.2	Very low	74 Å²	74	98.8 Å²	98.8	52%	0.517	58%	0.582	S	S	.	*			trans	-70.8	-37.1	-172	38.6	0	0	0	0	114.2	N633 V634	S631-N633 VanDerWaalsContact C-N 3.27Å; S631-N633 PolarHBondContact O-N 2.72Å; S631-V634 WeakPolarHBondContact O-CB 3.1Å; S631-V634 PolarHBondContact O-N 3.08Å
632	N	28.1	Very low	29.8	Very low	103 Å²	103	96.5 Å²	96.5	55%	0.551	56%	0.558	S	S	*	*	H	α-helix	trans	-61	-30.4	-156.6	-58.2	-2.4	0	0	0	114.4	V634	N632-V634 VanDerWaalsContact C-N 3.29Å; N632-V634 PolarHBondContact O-N 3.09Å
633	N	28.9	Very low	31.1	Very low	129 Å²	129	96.3 Å²	96.3	69%	0.69	56%	0.557	S	S	*	*	H	α-helix	trans	-70.4	-24	179.5	-70.7	-9.4	0	0	0	113.3	S631	S631-N633 VanDerWaalsContact C-N 3.27Å; S631-N633 PolarHBondContact O-N 2.72Å
634	V	34.7	Very low	32.3	Very low	84 Å²	84	92.9 Å²	92.9	51%	0.509	53%	0.533	S	S	.	.	H	α-helix	trans	-76.8	-33.9	-179	-175.8	0	0	0	0	110.9	S631 N632 A637 K638	S631-V634 WeakPolarHBondContact O-CB 3.1Å; S631-V634 PolarHBondContact O-N 3.08Å; N632-V634 VanDerWaalsContact C-N 3.29Å; N632-V634 PolarHBondContact O-N 3.09Å; V634-A637 PolarHBondContact O-N 3.28Å; V634-K638 WeakPolarHBondContact O-CG 2.52Å; V634-K638 PolarHBondContact O-N 3.21Å
635	D	33.3	Very low	33.7	Very low	73 Å²	73	92.6 Å²	92.6	39%	0.39	52%	0.52	S	S	.	.	H	α-helix	trans	-79.8	-29	-173.5	-59.7	-45.5	0	0	0	113.2	A637 K638 S639	D635-A637 VanDerWaalsContact C-N 3.35Å; D635-K638 PolarHBondContact O-N 2.91Å; D635-K638 IonicContact OD1-NZ 3.2Å; D635-K638 PolarHBondContact OD1-NZ 3.31Å; D635-S639 PolarHBondContact O-N 2.94Å; D635-S639 VanDerWaalsContact O-N 3.16Å
636	I	31.6	Very low	35.6	Very low	94 Å²	94	85.7 Å²	85.7	48%	0.482	48%	0.484	S	S	.	.	H	α-helix	trans	-64	-41	169.6	-60.4	170	0	0	0	110.6	K638 S639 N640	I636-K638 VanDerWaalsContact C-N 3.35Å; I636-K638 PolarHBondContact O-N 2.82Å; I636-S639 PolarHBondContact O-N 2.86Å; I636-S639 PolarHBondContact O-OG 3.25Å; I636-N640 PolarHBondContact O-ND2 3.09Å; I636-N640 PolarHBondContact O-OD1 2.93Å
637	A	31.1	Very low	37.5	Very low	63 Å²	63	77 Å²	77	52%	0.521	45%	0.447	S	S	.	.	H	α-helix	trans	-65.7	-37.5	177.8	0	0	0	0	0	112.2	V634 D635	V634-A637 PolarHBondContact O-N 3.28Å; D635-A637 VanDerWaalsContact C-N 3.35Å
638	K	31.2	Very low	39.5	Very low	70 Å²	70	72.6 Å²	72.6	30%	0.304	43%	0.428	S	S	.	.	H	α-helix	trans	-64.4	-44.1	175.5	-69.3	170	-171.9	153.1	0	112.7	V634 D635 I636 N640 L641	V634-K638 WeakPolarHBondContact O-CG 2.52Å; V634-K638 PolarHBondContact O-N 3.21Å; D635-K638 PolarHBondContact O-N 2.91Å; D635-K638 IonicContact OD1-NZ 3.2Å; D635-K638 PolarHBondContact OD1-NZ 3.31Å; I636-K638 VanDerWaalsContact C-N 3.35Å; I636-K638 PolarHBondContact O-N 2.82Å; K638-N640 PolarHBondContact O-N 2.66Å; K638-N640 VanDerWaalsContact O-N 3.09Å; K638-L641 PolarHBondContact O-N 3.45Å
639	S	32.9	Very low	41.6	Very low	54 Å²	54	68.2 Å²	68.2	38%	0.378	40%	0.401	S	S	.	.	H	α-helix	trans	-62.6	-22.1	-175.8	51.8	0	0	0	0	114	D635 I636 S643	D635-S639 PolarHBondContact O-N 2.94Å; D635-S639 VanDerWaalsContact O-N 3.16Å; I636-S639 PolarHBondContact O-N 2.86Å; I636-S639 PolarHBondContact O-OG 3.25Å; S639-S643 WeakPolarHBondContact O-CB 3.45Å
640	N	37.5	Very low	44	Very low	44 Å²	44	61.9 Å²	61.9	24%	0.235	36%	0.362	C	S	.	.	H	α-helix	trans	-82.7	-24.9	-172.6	-64.2	-8.7	0	0	0	113.4	I636 K638 S644	I636-N640 PolarHBondContact O-ND2 3.09Å; I636-N640 PolarHBondContact O-OD1 2.93Å; K638-N640 PolarHBondContact O-N 2.66Å; K638-N640 VanDerWaalsContact O-N 3.09Å; N640-S644 WeakPolarHBondContact O-CB 3.24Å; N640-S644 PolarHBondContact O-N 3.12Å
641	L	36.1	Very low	46.3	Very low	81 Å²	81	55.9 Å²	55.9	42%	0.424	33%	0.332	S	S	.	.	H	α-helix	trans	-77.1	-52.4	-168.7	-138.2	77.2	0	0	0	113.1	E245 K638 S643 S644 T645	E245-L641 VanDerWaalsContact OE1-CB 3.23Å; E245-L641 WeakPolarHBondContact OE1-CB 3.01Å; K638-L641 PolarHBondContact O-N 3.45Å; L641-S643 VanDerWaalsContact C-N 3.32Å; L641-S643 PolarHBondContact O-N 3.4Å; L641-S644 PolarHBondContact O-N 2.97Å; L641-S644 PolarHBondContact O-OG 2.87Å; L641-T645 PolarHBondContact O-N 3.21Å; L641-T645 PolarHBondContact O-OG1 3.22Å
642	I	42.3	Very low	48.2	Very low	36 Å²	36	56.6 Å²	56.6	19%	0.185	33%	0.333	C	S	.	.	H	α-helix	trans	-60.2	-43.7	171.5	-72.6	154.5	0	0	0	111.1	E245 Q249 S644 T645 I646	E245-I642 HydrophobicContact CG-CD1 3.77Å; E245-I642 WeakPolarHBondContact OE1-CD1 3.38Å; E245-I642 VanDerWaalsContact OE1-CG1 3.26Å; E245-I642 WeakPolarHBondContact OE1-CG1 3.36Å; E245-I642 PolarHBondContact OE1-N 3.43Å; Q249-I642 HydrophobicContact CB-CD1 3.65Å; Q249-I642 HydrophobicContact CG-CD1 3.76Å; I642-S644 PolarHBondContact O-N 3.1Å; I642-T645 WeakPolarHBondContact O-CB 3.21Å; I642-T645 PolarHBondContact O-N 2.11Å; I642-I646 PolarHBondContact O-N 2.86Å
643	S	51.5	Low	50.7	Low	48 Å²	48	54.2 Å²	54.2	34%	0.336	32%	0.318	S	S	.	.	H	α-helix	trans	-55.8	-39	177.6	-169.8	0	0	0	0	112	N591 S639 L641 T645 A647	N591-S643 PolarHBondContact ND2-OG 3.35Å; S639-S643 WeakPolarHBondContact O-CB 3.45Å; L641-S643 VanDerWaalsContact C-N 3.32Å; L641-S643 PolarHBondContact O-N 3.4Å; S643-T645 VanDerWaalsContact C-N 3.31Å; S643-T645 PolarHBondContact O-N 2.74Å; S643-A647 WeakPolarHBondContact O-CB 3.24Å; S643-A647 PolarHBondContact O-N 2.81Å
644	S	52.8	Low	53.3	Low	36 Å²	36	48 Å²	48	25%	0.252	29%	0.285	S	S	.	.	H	α-helix	trans	-63.5	-31.3	173.9	79.5	0	0	0	0	114.2	N640 L641 I642 S648	N640-S644 WeakPolarHBondContact O-CB 3.24Å; N640-S644 PolarHBondContact O-N 3.12Å; L641-S644 PolarHBondContact O-N 2.97Å; L641-S644 PolarHBondContact O-OG 2.87Å; I642-S644 PolarHBondContact O-N 3.1Å; S644-S648 WeakPolarHBondContact O-CB 3.26Å; S644-S648 PolarHBondContact O-N 3.42Å; S644-S648 PolarHBondContact O-OG 3.15Å
645	T	58.3	Low	55.5	Low	47 Å²	47	45.1 Å²	45.1	29%	0.288	27%	0.269	S	S	.	.	H	α-helix	trans	-75.8	-47.5	-177.5	-55.3	0	0	0	0	110.5	L641 I642 S643 A647 S648 V649	L641-T645 PolarHBondContact O-N 3.21Å; L641-T645 PolarHBondContact O-OG1 3.22Å; I642-T645 WeakPolarHBondContact O-CB 3.21Å; I642-T645 PolarHBondContact O-N 2.11Å; S643-T645 VanDerWaalsContact C-N 3.31Å; S643-T645 PolarHBondContact O-N 2.74Å; T645-A647 VanDerWaalsContact C-N 3.35Å; T645-A647 PolarHBondContact O-N 3.44Å; T645-S648 PolarHBondContact O-N 3.46Å; T645-S648 PolarHBondContact O-OG 3.19Å; T645-V649 PolarHBondContact O-N 2.88Å
646	I	64.3	Low	57.9	Low	25 Å²	25	46.4 Å²	46.4	13%	0.128	27%	0.269	C	S	.	.	H	α-helix	trans	-63.9	-42.5	173.6	-61.4	178	0	0	0	110.1	G545 L549 I642 S648 V649 C650	G545-I646 WeakPolarHBondContact O-CG2 3.5Å; L549-I646 HydrophobicContact CB-CG2 4.4Å; I642-I646 PolarHBondContact O-N 2.86Å; I646-S648 VanDerWaalsContact C-N 3.35Å; I646-S648 PolarHBondContact O-N 3.09Å; I646-V649 PolarHBondContact O-N 3.32Å; I646-C650 WeakPolarHBondContact O-CB 3.05Å; I646-C650 PolarHBondContact O-N 3.03Å; I646-C650 PolarHBondContact O-SG 3.37Å
647	A	64.8	Low	60.7	Low	4 Å²	4	41.9 Å²	41.9	3%	0.033	25%	0.246	C	C	.	.	H	α-helix	trans	-61.5	-37.5	177.8	0	0	0	0	0	113.4	S643 T645 C650 A651	S643-A647 WeakPolarHBondContact O-CB 3.24Å; S643-A647 PolarHBondContact O-N 2.81Å; T645-A647 VanDerWaalsContact C-N 3.35Å; T645-A647 PolarHBondContact O-N 3.44Å; A647-C650 PolarHBondContact O-N 2.86Å; A647-A651 WeakPolarHBondContact O-CB 3.44Å; A647-A651 PolarHBondContact O-N 2.97Å
648	S	64.8	Low	63.4	Low	57 Å²	57	39.3 Å²	39.3	40%	0.399	22%	0.223	S	C	.	.	H	α-helix	trans	-70.1	-36.8	176	66.3	0	0	0	0	113.3	S644 T645 I646 T652	S644-S648 WeakPolarHBondContact O-CB 3.26Å; S644-S648 PolarHBondContact O-N 3.42Å; S644-S648 PolarHBondContact O-OG 3.15Å; T645-S648 PolarHBondContact O-N 3.46Å; T645-S648 PolarHBondContact O-OG 3.19Å; I646-S648 VanDerWaalsContact C-N 3.35Å; I646-S648 PolarHBondContact O-N 3.09Å; S648-T652 WeakPolarHBondContact O-CB 3.41Å; S648-T652 PolarHBondContact O-N 3.24Å; S648-T652 PolarHBondContact O-OG1 2.75Å
649	V	68.5	Low	66	Low	39 Å²	39	37 Å²	37	24%	0.236	21%	0.214	C	C	.	.	H	α-helix	trans	-65.3	-43.2	171.7	173.8	0	0	0	0	110.7	L549 T645 I646 T652 K653	L549-V649 HydrophobicContact CD1-CG1 3.65Å; T645-V649 PolarHBondContact O-N 2.88Å; I646-V649 PolarHBondContact O-N 3.32Å; V649-T652 WeakPolarHBondContact O-CB 3.14Å; V649-T652 PolarHBondContact O-N 2.93Å; V649-K653 HydrophobicContact CG1-CD 4.25Å; V649-K653 WeakPolarHBondContact O-CG 3.21Å; V649-K653 PolarHBondContact O-N 3.39Å
650	C	76.2	Confident	68.8	Low	0 Å²	0	36.3 Å²	36.3	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-66.3	-40.2	176.8	-69.2	0	0	0	0	112.5	R548 C584 I646 A647 T652 K653 A654	R548-C650 HydrophobicContact CG-CB 4.23Å; C584-C650 VanDerWaalsContact SG-C 3.6Å; I646-C650 WeakPolarHBondContact O-CB 3.05Å; I646-C650 PolarHBondContact O-N 3.03Å; I646-C650 PolarHBondContact O-SG 3.37Å; A647-C650 PolarHBondContact O-N 2.86Å; C650-T652 VanDerWaalsContact C-N 3.32Å; C650-T652 PolarHBondContact O-N 3.38Å; C650-K653 CarbonylContact O-C 3.59Å; C650-K653 PolarHBondContact O-N 2.88Å; C650-A654 WeakPolarHBondContact O-CB 3.41Å; C650-A654 PolarHBondContact O-N 3.25Å
651	A	73.8	Confident	71.4	Confident	13 Å²	13	34.2 Å²	34.2	11%	0.107	19%	0.191	C	C	.	.	H	α-helix	trans	-62.5	-37.9	171.9	0	0	0	0	0	112.2	L585 A647 A654 A655	L585-A651 HydrophobicContact CD2-CB 4.29Å; A647-A651 WeakPolarHBondContact O-CB 3.44Å; A647-A651 PolarHBondContact O-N 2.97Å; A651-A654 PolarHBondContact O-N 2.88Å; A651-A655 PolarHBondContact O-N 3.41Å
652	T	69.4	Low	73.9	Confident	88 Å²	88	31.4 Å²	31.4	54%	0.54	18%	0.178	S	C	.	.	H	α-helix	trans	-65.2	-40.1	173.9	-55.3	0	0	0	0	111.6	S648 V649 C650 A655 R656	S648-T652 WeakPolarHBondContact O-CB 3.41Å; S648-T652 PolarHBondContact O-N 3.24Å; S648-T652 PolarHBondContact O-OG1 2.75Å; V649-T652 WeakPolarHBondContact O-CB 3.14Å; V649-T652 PolarHBondContact O-N 2.93Å; C650-T652 VanDerWaalsContact C-N 3.32Å; C650-T652 PolarHBondContact O-N 3.38Å; T652-A655 PolarHBondContact O-N 2.93Å; T652-R656 PolarHBondContact O-N 3.22Å; T652-R656 VanDerWaalsContact O-N 3.08Å
653	K	80.9	Confident	76.1	Confident	53 Å²	53	35.1 Å²	35.1	23%	0.23	19%	0.194	C	C	.	.	H	α-helix	trans	-67.6	-39.5	173.2	-71.1	172.1	-174.1	-76.2	0	111.9	L549 C552 N553 V556 V649 C650 A655 R656 I657	L549-K653 HydrophobicContact CD1-CD 3.96Å; C552-K653 HydrophobicContact CB-CB 3.93Å; C552-K653 HydrophobicContact CB-CD 3.82Å; N553-K653 WeakPolarHBondContact OD1-CE 3.33Å; N553-K653 PolarHBondContact OD1-NZ 2.61Å; V556-K653 HydrophobicContact CG2-CB 3.98Å; V556-K653 HydrophobicContact CG2-CG 4.3Å; V649-K653 HydrophobicContact CG1-CD 4.25Å; V649-K653 WeakPolarHBondContact O-CG 3.21Å; V649-K653 PolarHBondContact O-N 3.39Å; C650-K653 CarbonylContact O-C 3.59Å; C650-K653 PolarHBondContact O-N 2.88Å; K653-A655 PolarHBondContact O-N 2.81Å; K653-R656 CarbonylContact O-C 3.15Å; K653-R656 WeakPolarHBondContact O-CB 3.49Å; K653-R656 PolarHBondContact O-N 2.91Å; K653-R656 VanDerWaalsContact O-N 3.1Å; K653-I657 VanDerWaalsContact O-CG1 3.32Å; K653-I657 WeakPolarHBondContact O-CG1 3.41Å; K653-I657 PolarHBondContact O-N 2.85Å
654	A	83.9	Confident	77.8	Confident	0 Å²	0	34 Å²	34	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-61.4	-42.7	174.7	0	0	0	0	0	111.8	L581 C584 L585 C650 A651 R656 I657 L658	L581-A654 HydrophobicContact CD2-CB 3.74Å; C584-A654 HydrophobicContact CB-CB 4.13Å; L585-A654 HydrophobicContact CD2-CB 4.31Å; L585-A654 HydrophobicContact CG-CB 4.39Å; C650-A654 WeakPolarHBondContact O-CB 3.41Å; C650-A654 PolarHBondContact O-N 3.25Å; A651-A654 PolarHBondContact O-N 2.88Å; A654-R656 VanDerWaalsContact C-N 3.33Å; A654-R656 PolarHBondContact O-N 3.26Å; A654-I657 PolarHBondContact O-N 3.23Å; A654-L658 WeakPolarHBondContact O-CG 3.47Å; A654-L658 PolarHBondContact O-N 3.04Å
655	A	79.7	Confident	79.5	Confident	23 Å²	23	36.4 Å²	36.4	19%	0.19	20%	0.204	C	C	.	.	H	α-helix	trans	-60.3	-40.9	171.3	0	0	0	0	0	112	A651 T652 K653 L658 E659 T705	A651-A655 PolarHBondContact O-N 3.41Å; T652-A655 PolarHBondContact O-N 2.93Å; K653-A655 PolarHBondContact O-N 2.81Å; A655-L658 PolarHBondContact O-N 2.65Å; A655-E659 WeakPolarHBondContact O-CG 3.2Å; A655-E659 PolarHBondContact O-N 2.91Å; A655-T705 HydrophobicContact CB-CG2 4.19Å
656	R	84.1	Confident	81	Confident	99 Å²	99	39.9 Å²	39.9	37%	0.374	21%	0.211	S	C	.	.	H	α-helix	trans	-67.9	-34.1	176.7	-172.4	56.3	174.9	178.9	5	113.6	T652 K653 A654 E659 Y660	T652-R656 PolarHBondContact O-N 3.22Å; T652-R656 VanDerWaalsContact O-N 3.08Å; K653-R656 CarbonylContact O-C 3.15Å; K653-R656 WeakPolarHBondContact O-CB 3.49Å; K653-R656 PolarHBondContact O-N 2.91Å; K653-R656 VanDerWaalsContact O-N 3.1Å; A654-R656 VanDerWaalsContact C-N 3.33Å; A654-R656 PolarHBondContact O-N 3.26Å; R656-E659 WeakPolarHBondContact CD-OE2 3.3Å; R656-E659 IonicContact CZ-OE2 3.51Å; R656-E659 IonicContact NE-OE2 2.87Å; R656-E659 IonicContact NH1-OE2 3.26Å; R656-E659 PolarHBondContact NH1-OE2 3.03Å; R656-E659 PolarHBondContact O-N 3.31Å; R656-Y660 HydrophobicContact CG-CE2 4.08Å; R656-Y660 VanDerWaalsContact CZ-CE1 3.5Å; R656-Y660 VanDerWaalsContact NE-CZ 3.26Å; R656-Y660 PolarHBondContact NE-OH 2.82Å; R656-Y660 VanDerWaalsContact NE-OH 3.17Å; R656-Y660 PolarHBondContact NH2-OH 3.47Å; R656-Y660 PolarHBondContact O-N 3.44Å; R656-Y660 VanDerWaalsContact O-N 3.11Å
657	I	89.8	Confident	82.3	Confident	0 Å²	0	38.7 Å²	38.7	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-64.7	-42.5	171.7	-66.3	159.7	0	0	0	110	L555 V556 T559 L581 K653 A654 Y660 L661	L555-I657 HydrophobicContact CB-CD1 3.54Å; L555-I657 HydrophobicContact CB-CG1 4.17Å; V556-I657 HydrophobicContact CB-CG1 4.41Å; V556-I657 HydrophobicContact CG2-CD1 4.02Å; V556-I657 HydrophobicContact CG2-CG1 3.61Å; T559-I657 HydrophobicContact CG2-CG2 4.1Å; L581-I657 HydrophobicContact CD1-CB 4.44Å; L581-I657 HydrophobicContact CD1-CG2 3.76Å; L581-I657 HydrophobicContact CD2-CB 3.98Å; L581-I657 HydrophobicContact CD2-CD1 3.9Å; L581-I657 HydrophobicContact CD2-CG2 3.94Å; L581-I657 HydrophobicContact CG-CG2 4.49Å; K653-I657 VanDerWaalsContact O-CG1 3.32Å; K653-I657 WeakPolarHBondContact O-CG1 3.41Å; K653-I657 PolarHBondContact O-N 2.85Å; A654-I657 PolarHBondContact O-N 3.23Å; I657-Y660 PolarHBondContact O-N 2.87Å; I657-L661 HydrophobicContact CG2-CD1 3.83Å; I657-L661 HydrophobicContact CG2-CG 4.29Å; I657-L661 WeakPolarHBondContact O-CB 3.38Å; I657-L661 VanDerWaalsContact O-CG 3.29Å; I657-L661 WeakPolarHBondContact O-CG 3.4Å; I657-L661 PolarHBondContact O-N 3.01Å
658	L	88.8	Confident	83.5	Confident	8 Å²	8	40.1 Å²	40.1	4%	0.042	21%	0.212	C	C	.	.	H	α-helix	trans	-63.8	-42.1	175.2	-68.3	169.7	0	0	0	112.2	L578 L581 L585 A654 A655 Y660 L661 T662 V684	L578-L658 HydrophobicContact CD2-CD2 3.97Å; L581-L658 HydrophobicContact CB-CD2 4.49Å; L581-L658 HydrophobicContact CD1-CD2 3.67Å; L581-L658 HydrophobicContact CD1-CG 4.04Å; L585-L658 HydrophobicContact CD1-CD1 4.1Å; A654-L658 WeakPolarHBondContact O-CG 3.47Å; A654-L658 PolarHBondContact O-N 3.04Å; A655-L658 PolarHBondContact O-N 2.65Å; L658-Y660 PolarHBondContact O-N 3.33Å; L658-L661 PolarHBondContact O-N 3.32Å; L658-T662 WeakPolarHBondContact O-CB 3.5Å; L658-T662 VanDerWaalsContact O-CG2 3.23Å; L658-T662 WeakPolarHBondContact O-CG2 3.41Å; L658-T662 PolarHBondContact O-N 2.79Å; L658-T662 PolarHBondContact O-OG1 3.21Å; L658-T662 VanDerWaalsContact O-OG1 3.08Å; L658-V684 HydrophobicContact CD1-CG1 3.57Å; L658-V684 HydrophobicContact CD2-CG1 3.99Å; L658-V684 HydrophobicContact CG-CG1 4.47Å
659	E	86.2	Confident	84.6	Confident	23 Å²	23	41.6 Å²	41.6	11%	0.107	22%	0.215	C	C	.	.	H	α-helix	trans	-53.2	-54.4	172.6	-74.5	176.1	174.9	0	0	110.3	A655 R656 L661 T662 E663 T704 C708	A655-E659 WeakPolarHBondContact O-CG 3.2Å; A655-E659 PolarHBondContact O-N 2.91Å; R656-E659 WeakPolarHBondContact CD-OE2 3.3Å; R656-E659 IonicContact CZ-OE2 3.51Å; R656-E659 IonicContact NE-OE2 2.87Å; R656-E659 IonicContact NH1-OE2 3.26Å; R656-E659 PolarHBondContact NH1-OE2 3.03Å; R656-E659 PolarHBondContact O-N 3.31Å; E659-L661 PolarHBondContact O-N 3.25Å; E659-T662 PolarHBondContact O-N 2.8Å; E659-T662 PolarHBondContact O-OG1 2.88Å; E659-E663 PolarHBondContact O-N 2.77Å; E659-T704 WeakPolarHBondContact OE1-CB 3.46Å; E659-T704 PolarHBondContact OE1-OG1 3.42Å; E659-C708 HydrophobicContact CG-CB 4Å
660	Y	90.8	Very high	85.5	Confident	38 Å²	38	42.6 Å²	42.6	15%	0.149	22%	0.218	C	C	.	.	H	α-helix	trans	-62.7	-39	178.4	-70.4	-30.1	0	0	0	114.2	V556 T559 R565 R656 I657 L658 E663	V556-Y660 HydrophobicContact CG1-CE2 4.15Å; T559-Y660 WeakPolarHBondContact O-CB 3.46Å; R565-Y660 WeakPolarHBondContact CD-O 3.5Å; R565-Y660 PolarHBondContact NE-O 3.46Å; R565-Y660 PolarHBondContact NH1-O 3.34Å; R656-Y660 HydrophobicContact CG-CE2 4.08Å; R656-Y660 VanDerWaalsContact CZ-CE1 3.5Å; R656-Y660 VanDerWaalsContact NE-CZ 3.26Å; R656-Y660 PolarHBondContact NE-OH 2.82Å; R656-Y660 VanDerWaalsContact NE-OH 3.17Å; R656-Y660 PolarHBondContact NH2-OH 3.47Å; R656-Y660 PolarHBondContact O-N 3.44Å; R656-Y660 VanDerWaalsContact O-N 3.11Å; I657-Y660 PolarHBondContact O-N 2.87Å; L658-Y660 PolarHBondContact O-N 3.33Å; Y660-E663 WeakPolarHBondContact O-CB 3.42Å; Y660-E663 PolarHBondContact O-N 3.5Å
661	L	91.7	Very high	86.1	Confident	0 Å²	0	42.6 Å²	42.6	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-66.1	-39	176.4	-71.9	171.4	0	0	0	111.4	T559 I577 L581 I657 L658 E659 E663 S664 F667	T559-L661 HydrophobicContact CG2-CD2 3.87Å; T559-L661 HydrophobicContact CG2-CG 4.14Å; I577-L661 HydrophobicContact CG2-CD1 3.86Å; L581-L661 HydrophobicContact CD1-CD1 4.04Å; I657-L661 HydrophobicContact CG2-CD1 3.83Å; I657-L661 HydrophobicContact CG2-CG 4.29Å; I657-L661 WeakPolarHBondContact O-CB 3.38Å; I657-L661 VanDerWaalsContact O-CG 3.29Å; I657-L661 WeakPolarHBondContact O-CG 3.4Å; I657-L661 PolarHBondContact O-N 3.01Å; L658-L661 PolarHBondContact O-N 3.32Å; E659-L661 PolarHBondContact O-N 3.25Å; L661-E663 VanDerWaalsContact C-N 3.26Å; L661-E663 PolarHBondContact O-N 3.24Å; L661-S664 WeakPolarHBondContact O-CB 3.37Å; L661-S664 PolarHBondContact O-N 3.49Å; L661-F667 VanDerWaalsContact C-CD1 3.48Å; L661-F667 HydrophobicContact CB-CD1 3.79Å; L661-F667 HydrophobicContact CB-CD2 4.41Å; L661-F667 HydrophobicContact CB-CE1 3.63Å; L661-F667 HydrophobicContact CB-CE2 4.26Å; L661-F667 HydrophobicContact CB-CG 4.15Å; L661-F667 HydrophobicContact CB-CZ 3.84Å; L661-F667 HydrophobicContact CD1-CE2 4.23Å; L661-F667 HydrophobicContact CD1-CZ 4.1Å; L661-F667 HydrophobicContact CD2-CD2 4.49Å; L661-F667 WeakPolarHBondContact O-CB 3.41Å; L661-F667 WeakPolarHBondContact O-CD1 3.47Å
662	T	89.7	Confident	86.8	Confident	23 Å²	23	45.7 Å²	45.7	14%	0.141	23%	0.227	C	C	.	.	H	α-helix	trans	-69.6	-17.4	178.7	59.9	0	0	0	0	114.4	L658 E659 S664 F667 L668 L712	L658-T662 WeakPolarHBondContact O-CB 3.5Å; L658-T662 VanDerWaalsContact O-CG2 3.23Å; L658-T662 WeakPolarHBondContact O-CG2 3.41Å; L658-T662 PolarHBondContact O-N 2.79Å; L658-T662 PolarHBondContact O-OG1 3.21Å; L658-T662 VanDerWaalsContact O-OG1 3.08Å; E659-T662 PolarHBondContact O-N 2.8Å; E659-T662 PolarHBondContact O-OG1 2.88Å; T662-S664 PolarHBondContact O-N 3.25Å; T662-F667 HydrophobicContact CG2-CE1 4.33Å; T662-L668 HydrophobicContact CG2-CD2 4.19Å; T662-L712 HydrophobicContact CG2-CD2 3.62Å; T662-L712 HydrophobicContact CG2-CG 3.97Å
663	E	88.2	Confident	87.6	Confident	113 Å²	113	46.1 Å²	46.1	53%	0.528	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-21.3	166.3	-64.9	174	-171.7	0	0	112.5	R565 E659 Y660 L661	R565-E663 IonicContact CZ-OE2 2.64Å; R565-E663 IonicContact NH1-OE2 4Å; R565-E663 PolarHBondContact NH1-OE2 3.43Å; R565-E663 IonicContact NH2-OE2 3.94Å; R565-E663 PolarHBondContact NH2-OE2 2.98Å; E659-E663 PolarHBondContact O-N 2.77Å; Y660-E663 WeakPolarHBondContact O-CB 3.42Å; Y660-E663 PolarHBondContact O-N 3.5Å; L661-E663 VanDerWaalsContact C-N 3.26Å; L661-E663 PolarHBondContact O-N 3.24Å
664	S	88	Confident	87.8	Confident	24 Å²	24	45.7 Å²	45.7	17%	0.168	24%	0.237	C	C	.	.			trans	-92.7	110.6	-179.2	-179.5	0	0	0	0	112.1	L661 T662 R666 F667 L668	L661-S664 WeakPolarHBondContact O-CB 3.37Å; L661-S664 PolarHBondContact O-N 3.49Å; T662-S664 PolarHBondContact O-N 3.25Å; S664-R666 PolarHBondContact O-N 3.13Å; S664-F667 WeakPolarHBondContact O-CB 3.39Å; S664-F667 PolarHBondContact O-N 2.8Å; S664-F667 VanDerWaalsContact O-N 3.08Å; S664-F667 PolarHBondContact OG-N 3.44Å; S664-L668 PolarHBondContact O-N 2.73Å
665	S	88	Confident	88	Confident	88 Å²	88	50.9 Å²	50.9	62%	0.615	27%	0.274	S	S	*	.	H	α-helix	trans	-59.8	-32.4	171.6	-44.2	0	0	0	0	112.2	L668 I669	S665-L668 PolarHBondContact O-N 2.87Å; S665-I669 WeakPolarHBondContact O-CD1 3.23Å; S665-I669 VanDerWaalsContact O-CG1 3.29Å; S665-I669 WeakPolarHBondContact O-CG1 3.49Å; S665-I669 PolarHBondContact O-N 3.04Å; S665-I669 VanDerWaalsContact O-N 3.08Å
666	R	88.6	Confident	88.3	Confident	120 Å²	120	52.7 Å²	52.7	45%	0.453	28%	0.28	S	S	.	.	H	α-helix	trans	-61.5	-41.8	173.7	-176.3	-176.5	179.7	100.7	-7.6	111.3	D570 S664 I669 L670	D570-R666 IonicContact OD1-CZ 3.57Å; D570-R666 VanDerWaalsContact OD1-CZ 3.23Å; D570-R666 IonicContact OD1-NE 2.73Å; D570-R666 PolarHBondContact OD1-NE 3.49Å; D570-R666 IonicContact OD1-NH2 3.45Å; D570-R666 PolarHBondContact OD1-NH2 3.36Å; D570-R666 IonicContact OD2-CZ 3.49Å; D570-R666 IonicContact OD2-NE 2.8Å; D570-R666 IonicContact OD2-NH2 3.46Å; D570-R666 PolarHBondContact OD2-NH2 3.46Å; D570-R666 VanDerWaalsContact OD2-NH2 3.12Å; S664-R666 PolarHBondContact O-N 3.13Å; R666-I669 PolarHBondContact O-N 3.04Å; R666-L670 HydrophobicContact CG-CD1 3.96Å; R666-L670 HydrophobicContact CG-CG 4.49Å; R666-L670 WeakPolarHBondContact O-CB 3.37Å; R666-L670 VanDerWaalsContact O-CG 3.3Å; R666-L670 WeakPolarHBondContact O-CG 3.28Å; R666-L670 PolarHBondContact O-N 3.38Å
667	F	92.6	Very high	88.6	Confident	0 Å²	0	48 Å²	48	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-60.2	-51.4	175	169.5	-115.3	0	0	0	111.7	L569 P574 L578 L661 T662 S664 I669 L670 A671 L712	L569-F667 HydrophobicContact CD1-CB 3.78Å; L569-F667 HydrophobicContact CD1-CD2 4.44Å; L569-F667 HydrophobicContact CD2-CB 4.43Å; L569-F667 HydrophobicContact CD2-CD2 3.56Å; L569-F667 HydrophobicContact CD2-CE2 4.29Å; L569-F667 HydrophobicContact CD2-CG 4.43Å; P574-F667 HydrophobicContact CB-CD2 3.9Å; P574-F667 HydrophobicContact CB-CE2 3.7Å; L578-F667 HydrophobicContact CD1-CE2 4.11Å; L578-F667 HydrophobicContact CD1-CZ 4.07Å; L578-F667 HydrophobicContact CD2-CE2 4.5Å; L578-F667 HydrophobicContact CD2-CZ 3.81Å; L578-F667 HydrophobicContact CG-CE2 4.18Å; L578-F667 HydrophobicContact CG-CZ 3.98Å; L661-F667 VanDerWaalsContact C-CD1 3.48Å; L661-F667 HydrophobicContact CB-CD1 3.79Å; L661-F667 HydrophobicContact CB-CD2 4.41Å; L661-F667 HydrophobicContact CB-CE1 3.63Å; L661-F667 HydrophobicContact CB-CE2 4.26Å; L661-F667 HydrophobicContact CB-CG 4.15Å; L661-F667 HydrophobicContact CB-CZ 3.84Å; L661-F667 HydrophobicContact CD1-CE2 4.23Å; L661-F667 HydrophobicContact CD1-CZ 4.1Å; L661-F667 HydrophobicContact CD2-CD2 4.49Å; L661-F667 WeakPolarHBondContact O-CB 3.41Å; L661-F667 WeakPolarHBondContact O-CD1 3.47Å; T662-F667 HydrophobicContact CG2-CE1 4.33Å; S664-F667 WeakPolarHBondContact O-CB 3.39Å; S664-F667 PolarHBondContact O-N 2.8Å; S664-F667 VanDerWaalsContact O-N 3.08Å; S664-F667 PolarHBondContact OG-N 3.44Å; F667-I669 VanDerWaalsContact C-N 3.27Å; F667-I669 PolarHBondContact O-N 2.98Å; F667-L670 PolarHBondContact O-N 3.26Å; F667-A671 HydrophobicContact CE2-CB 4.48Å; F667-A671 WeakPolarHBondContact O-CB 3.38Å; F667-A671 PolarHBondContact O-N 3.44Å; F667-L712 HydrophobicContact CE1-CD2 4.46Å
668	L	89.4	Confident	88.5	Confident	33 Å²	33	49.2 Å²	49.2	17%	0.173	27%	0.269	C	S	.	.	H	α-helix	trans	-62.9	-34.6	-177.4	-63.1	177.6	0	0	0	112.4	T662 S664 S665 R672 S715	T662-L668 HydrophobicContact CG2-CD2 4.19Å; S664-L668 PolarHBondContact O-N 2.73Å; S665-L668 PolarHBondContact O-N 2.87Å; L668-R672 PolarHBondContact O-N 2.77Å; L668-S715 PolarHBondContact O-OG 3.05Å
669	I	88.3	Confident	88.6	Confident	89 Å²	89	52.7 Å²	52.7	46%	0.456	29%	0.285	S	S	.	.	H	α-helix	trans	-67.2	-54.1	173	-67.5	164.5	0	0	0	110.6	S665 R666 F667 A671 R672 S673	S665-I669 WeakPolarHBondContact O-CD1 3.23Å; S665-I669 VanDerWaalsContact O-CG1 3.29Å; S665-I669 WeakPolarHBondContact O-CG1 3.49Å; S665-I669 PolarHBondContact O-N 3.04Å; S665-I669 VanDerWaalsContact O-N 3.08Å; R666-I669 PolarHBondContact O-N 3.04Å; F667-I669 VanDerWaalsContact C-N 3.27Å; F667-I669 PolarHBondContact O-N 2.98Å; I669-A671 VanDerWaalsContact C-N 3.28Å; I669-A671 PolarHBondContact O-N 2.93Å; I669-R672 PolarHBondContact O-N 3.07Å; I669-S673 WeakPolarHBondContact O-CB 3.4Å; I669-S673 PolarHBondContact O-N 2.76Å; I669-S673 PolarHBondContact O-OG 3.39Å
670	L	88.2	Confident	88.7	Confident	59 Å²	59	51.6 Å²	51.6	31%	0.309	28%	0.28	S	S	.	.	H	α-helix	trans	-60.4	-37.5	-179.4	-69.7	172.3	0	0	0	112.5	L569 P574 R666 F667 R672 S673 S674	L569-L670 HydrophobicContact CB-CD1 4.48Å; P574-L670 HydrophobicContact CG-CB 4.02Å; R666-L670 HydrophobicContact CG-CD1 3.96Å; R666-L670 HydrophobicContact CG-CG 4.49Å; R666-L670 WeakPolarHBondContact O-CB 3.37Å; R666-L670 VanDerWaalsContact O-CG 3.3Å; R666-L670 WeakPolarHBondContact O-CG 3.28Å; R666-L670 PolarHBondContact O-N 3.38Å; F667-L670 PolarHBondContact O-N 3.26Å; L670-R672 VanDerWaalsContact C-N 3.25Å; L670-R672 PolarHBondContact O-N 3.12Å; L670-S673 PolarHBondContact O-N 2.65Å; L670-S674 PolarHBondContact O-N 3.46Å; L670-S674 PolarHBondContact O-OG 3.03Å
671	A	89	Confident	88.7	Confident	0 Å²	0	49.9 Å²	49.9	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-69.2	-21.4	177.8	0	0	0	0	0	113	P574 L578 F667 I669 G677 L678	P574-A671 HydrophobicContact CB-CB 3.93Å; P574-A671 HydrophobicContact CG-CB 4.21Å; L578-A671 HydrophobicContact CD1-CB 4.06Å; F667-A671 HydrophobicContact CE2-CB 4.48Å; F667-A671 WeakPolarHBondContact O-CB 3.38Å; F667-A671 PolarHBondContact O-N 3.44Å; I669-A671 VanDerWaalsContact C-N 3.28Å; I669-A671 PolarHBondContact O-N 2.93Å; A671-G677 CarbonylContact O-C 3.6Å; A671-L678 VanDerWaalsContact O-CA 3.23Å; A671-L678 WeakPolarHBondContact O-CA 3.3Å; A671-L678 PolarHBondContact O-N 3.01Å
672	R	87.5	Confident	88.6	Confident	79 Å²	79	50 Å²	50	30%	0.298	27%	0.274	S	S	.	.	H	α-helix	trans	-90.6	-40.1	171.5	178	169.4	70.9	-118.8	8.5	112.6	L668 I669 L670 A719	L668-R672 PolarHBondContact O-N 2.77Å; I669-R672 PolarHBondContact O-N 3.07Å; L670-R672 VanDerWaalsContact C-N 3.25Å; L670-R672 PolarHBondContact O-N 3.12Å; R672-A719 HydrophobicContact CG-CB 3.87Å
673	S	85.6	Confident	88.6	Confident	96 Å²	96	50.4 Å²	50.4	67%	0.671	28%	0.278	S	S	*	.	H	α-helix	trans	-82.1	-10.7	-170.6	-67.6	0	0	0	0	115	I669 L670	I669-S673 WeakPolarHBondContact O-CB 3.4Å; I669-S673 PolarHBondContact O-N 2.76Å; I669-S673 PolarHBondContact O-OG 3.39Å; L670-S673 PolarHBondContact O-N 2.65Å
674	S	86.4	Confident	88.6	Confident	44 Å²	44	45 Å²	45	31%	0.308	25%	0.253	S	S	.	.	S	Bend	trans	-113.1	137.8	177.1	61.5	0	0	0	0	111.1	L670 D676 G677 L678	L670-S674 PolarHBondContact O-N 3.46Å; L670-S674 PolarHBondContact O-OG 3.03Å; S674-D676 VanDerWaalsContact C-N 3.35Å; S674-D676 PolarHBondContact O-N 3.3Å; S674-G677 PolarHBondContact O-N 3.03Å; S674-G677 WeakPolarHBondContact OG-CA 3.46Å; S674-G677 PolarHBondContact OG-N 3.46Å; S674-L678 WeakPolarHBondContact O-CB 3.46Å; S674-L678 PolarHBondContact O-N 3.3Å
675	S	86.7	Confident	88.6	Confident	109 Å²	109	43.9 Å²	43.9	76%	0.762	25%	0.245	S	C	*	.	H	α-helix	trans	-59.8	-42.8	-178.5	-175.2	0	0	0	0	112.4	L678 Q679	S675-L678 PolarHBondContact O-N 3.03Å; S675-Q679 WeakPolarHBondContact O-CB 3.34Å; S675-Q679 PolarHBondContact O-N 2.98Å
676	D	87.2	Confident	88.5	Confident	61 Å²	61	41.4 Å²	41.4	33%	0.326	22%	0.223	S	C	.	.	H	α-helix	trans	-69.6	-37.4	175.5	-174.6	44.3	0	0	0	112.7	G575 P576 R579 S674 L678 G680	G575-D676 WeakPolarHBondContact CA-OD2 3.49Å; P576-D676 WeakPolarHBondContact CD-OD2 3.5Å; R579-D676 IonicContact CZ-OD1 2.77Å; R579-D676 IonicContact NH2-OD1 3.47Å; R579-D676 PolarHBondContact NH2-OD1 3.02Å; R579-D676 IonicContact NH2-OD2 2.59Å; S674-D676 VanDerWaalsContact C-N 3.35Å; S674-D676 PolarHBondContact O-N 3.3Å; D676-L678 VanDerWaalsContact C-N 3.33Å; D676-L678 PolarHBondContact O-N 2.95Å; D676-G680 PolarHBondContact O-N 3.25Å
677	G	89.1	Confident	88.1	Confident	0 Å²	0	36.5 Å²	36.5	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-60	-43.2	171.5	0	0	0	0	0	112.4	A671 S674 G680 L681	A671-G677 CarbonylContact O-C 3.6Å; S674-G677 PolarHBondContact O-N 3.03Å; S674-G677 WeakPolarHBondContact OG-CA 3.46Å; S674-G677 PolarHBondContact OG-N 3.46Å; G677-G680 PolarHBondContact O-N 3.01Å; G677-L681 VanDerWaalsContact O-CB 3.3Å; G677-L681 WeakPolarHBondContact O-CB 3.43Å; G677-L681 PolarHBondContact O-N 3.47Å
678	L	89.3	Confident	87.6	Confident	26 Å²	26	37.5 Å²	37.5	14%	0.136	22%	0.216	C	C	.	.	H	α-helix	trans	-71.3	-38.7	-178.2	-175.3	58.6	0	0	0	111.6	A671 S674 S675 D676 L681 L682 L716 A719 F725	A671-L678 VanDerWaalsContact O-CA 3.23Å; A671-L678 WeakPolarHBondContact O-CA 3.3Å; A671-L678 PolarHBondContact O-N 3.01Å; S674-L678 WeakPolarHBondContact O-CB 3.46Å; S674-L678 PolarHBondContact O-N 3.3Å; S675-L678 PolarHBondContact O-N 3.03Å; D676-L678 VanDerWaalsContact C-N 3.33Å; D676-L678 PolarHBondContact O-N 2.95Å; L678-L681 HydrophobicContact CD1-CD2 4.41Å; L678-L681 PolarHBondContact O-N 3.46Å; L678-L682 WeakPolarHBondContact O-CG 3.42Å; L678-L682 PolarHBondContact O-N 3.25Å; L678-L716 HydrophobicContact CD1-CD1 3.94Å; L678-A719 HydrophobicContact CD1-CB 3.67Å; L678-A719 HydrophobicContact CD2-CB 4.38Å; L678-F725 HydrophobicContact CD1-CE1 4.23Å; L678-F725 HydrophobicContact CD1-CE2 4.24Å; L678-F725 HydrophobicContact CD1-CZ 3.69Å; L678-F725 HydrophobicContact CD2-CD2 3.89Å; L678-F725 HydrophobicContact CD2-CE1 4.34Å; L678-F725 HydrophobicContact CD2-CE2 3.53Å; L678-F725 HydrophobicContact CD2-CG 4.44Å; L678-F725 HydrophobicContact CD2-CZ 3.78Å; L678-F725 HydrophobicContact CG-CE2 3.8Å; L678-F725 HydrophobicContact CG-CZ 3.79Å
679	Q	89.9	Confident	87.1	Confident	81 Å²	81	36.1 Å²	36.1	38%	0.379	21%	0.209	S	C	.	.	H	α-helix	trans	-67.8	-40.3	172.5	179.6	63.3	-10.5	0	0	111.8	S675 L682 S683 R733	S675-Q679 WeakPolarHBondContact O-CB 3.34Å; S675-Q679 PolarHBondContact O-N 2.98Å; Q679-L682 PolarHBondContact O-N 2.88Å; Q679-S683 PolarHBondContact O-N 2.67Å; Q679-S683 PolarHBondContact O-OG 2.86Å; Q679-R733 VanDerWaalsContact OE1-NH2 3.15Å
680	G	89.2	Confident	86	Confident	1 Å²	1	36.1 Å²	36.1	1%	0.01	21%	0.213	C	C	.	.	H	α-helix	trans	-61.8	-43	172	0	0	0	0	0	112.6	D676 G677 S683 V684	D676-G680 PolarHBondContact O-N 3.25Å; G677-G680 PolarHBondContact O-N 3.01Å; G680-S683 PolarHBondContact O-N 2.96Å; G680-V684 PolarHBondContact O-N 2.75Å
681	L	90.6	Very high	84.3	Confident	1 Å²	1	36.3 Å²	36.3	1%	0.005	22%	0.219	C	C	.	.	H	α-helix	trans	-60.5	-46	176.6	177.1	61.2	0	0	0	110.9	L578 G677 L678 V684 I685 L712 L716	L578-L681 HydrophobicContact CD1-CB 4.19Å; G677-L681 VanDerWaalsContact O-CB 3.3Å; G677-L681 WeakPolarHBondContact O-CB 3.43Å; G677-L681 PolarHBondContact O-N 3.47Å; L678-L681 HydrophobicContact CD1-CD2 4.41Å; L678-L681 PolarHBondContact O-N 3.46Å; L681-V684 PolarHBondContact O-N 3.43Å; L681-I685 HydrophobicContact CD1-CD1 3.81Å; L681-I685 HydrophobicContact CD1-CG1 4.4Å; L681-I685 HydrophobicContact CG-CD1 3.93Å; L681-I685 WeakPolarHBondContact O-CB 3.44Å; L681-I685 VanDerWaalsContact O-CG1 3.3Å; L681-I685 WeakPolarHBondContact O-CG1 3.45Å; L681-I685 PolarHBondContact O-N 3.47Å; L681-L712 HydrophobicContact CD1-CB 4.08Å; L681-L712 HydrophobicContact CD1-CD2 3.68Å; L681-L712 HydrophobicContact CD1-CG 4.43Å; L681-L716 HydrophobicContact CD2-CB 4.24Å
682	L	89.6	Confident	82.3	Confident	4 Å²	4	37.3 Å²	37.3	2%	0.021	23%	0.226	C	C	.	.	H	α-helix	trans	-58.1	-49.9	172.5	-77.5	167.7	0	0	0	111.7	L678 Q679 V684 I685 E686 L716 F725 L736	L678-L682 WeakPolarHBondContact O-CG 3.42Å; L678-L682 PolarHBondContact O-N 3.25Å; Q679-L682 PolarHBondContact O-N 2.88Å; L682-V684 VanDerWaalsContact C-N 3.33Å; L682-V684 PolarHBondContact O-N 3.16Å; L682-I685 PolarHBondContact O-N 3.02Å; L682-I685 VanDerWaalsContact O-N 3.16Å; L682-E686 WeakPolarHBondContact O-CB 3.38Å; L682-E686 VanDerWaalsContact O-CG 3.31Å; L682-E686 WeakPolarHBondContact O-CG 3.24Å; L682-E686 PolarHBondContact O-N 2.89Å; L682-L716 HydrophobicContact CD2-CD1 3.79Å; L682-L716 HydrophobicContact CD2-CD2 3.85Å; L682-L716 HydrophobicContact CD2-CG 4.5Å; L682-L716 HydrophobicContact CG-CD1 4.11Å; L682-F725 HydrophobicContact CD1-CE2 3.87Å; L682-F725 HydrophobicContact CD1-CZ 3.93Å; L682-F725 HydrophobicContact CD2-CZ 4.45Å; L682-F725 HydrophobicContact CG-CZ 4.4Å; L682-L736 HydrophobicContact CD2-CD2 3.7Å
683	S	88.8	Confident	79.8	Confident	30 Å²	30	35.3 Å²	35.3	21%	0.21	22%	0.224	C	C	.	.	H	α-helix	trans	-63	-34.7	-179.2	-65.1	0	0	0	0	113.6	Q679 G680 S687	Q679-S683 PolarHBondContact O-N 2.67Å; Q679-S683 PolarHBondContact O-OG 2.86Å; G680-S683 PolarHBondContact O-N 2.96Å; S683-S687 VanDerWaalsContact O-CB 3.31Å; S683-S687 WeakPolarHBondContact O-CB 3.43Å; S683-S687 PolarHBondContact O-N 3.5Å; S683-S687 PolarHBondContact O-OG 3.29Å
684	V	88.7	Confident	77.4	Confident	1 Å²	1	34.1 Å²	34.1	1%	0.006	21%	0.214	C	C	.	.	H	α-helix	trans	-67.3	-45.4	172.4	168.4	0	0	0	0	111.2	L578 L581 A582 L585 L658 G680 L681 L682 S687 A688 L712	L578-V684 HydrophobicContact CB-CG2 4Å; L578-V684 HydrophobicContact CD2-CB 4.16Å; L578-V684 HydrophobicContact CD2-CG2 3.66Å; L578-V684 HydrophobicContact CG-CG2 4.48Å; L578-V684 WeakPolarHBondContact O-CG2 3.46Å; L581-V684 HydrophobicContact CB-CG2 4.4Å; A582-V684 HydrophobicContact CB-CG2 3.91Å; L585-V684 HydrophobicContact CD1-CG1 4.42Å; L658-V684 HydrophobicContact CD1-CG1 3.57Å; L658-V684 HydrophobicContact CD2-CG1 3.99Å; L658-V684 HydrophobicContact CG-CG1 4.47Å; G680-V684 PolarHBondContact O-N 2.75Å; L681-V684 PolarHBondContact O-N 3.43Å; L682-V684 VanDerWaalsContact C-N 3.33Å; L682-V684 PolarHBondContact O-N 3.16Å; V684-S687 PolarHBondContact O-N 3.29Å; V684-A688 VanDerWaalsContact O-CB 3.3Å; V684-A688 WeakPolarHBondContact O-CB 3.44Å; V684-A688 PolarHBondContact O-N 3.38Å; V684-L712 HydrophobicContact CG1-CD1 4.13Å
685	I	87.6	Confident	74.9	Confident	0 Å²	0	37 Å²	37	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-64.8	-44.4	179	-69.9	166.3	0	0	0	110.7	L681 L682 S687 A688 L689 L712 L713 L716 L736	L681-I685 HydrophobicContact CD1-CD1 3.81Å; L681-I685 HydrophobicContact CD1-CG1 4.4Å; L681-I685 HydrophobicContact CG-CD1 3.93Å; L681-I685 WeakPolarHBondContact O-CB 3.44Å; L681-I685 VanDerWaalsContact O-CG1 3.3Å; L681-I685 WeakPolarHBondContact O-CG1 3.45Å; L681-I685 PolarHBondContact O-N 3.47Å; L682-I685 PolarHBondContact O-N 3.02Å; L682-I685 VanDerWaalsContact O-N 3.16Å; I685-S687 PolarHBondContact O-N 2.98Å; I685-A688 PolarHBondContact O-N 3.02Å; I685-L689 HydrophobicContact CG2-CD1 3.65Å; I685-L689 HydrophobicContact CG2-CG 4.26Å; I685-L689 WeakPolarHBondContact O-CB 3.38Å; I685-L689 WeakPolarHBondContact O-CG 3.22Å; I685-L689 PolarHBondContact O-N 2.86Å; I685-L712 HydrophobicContact CD1-CB 4.09Å; I685-L712 HydrophobicContact CG1-CB 4.08Å; I685-L713 HydrophobicContact CD1-CD2 4.42Å; I685-L713 HydrophobicContact CG2-CD2 3.71Å; I685-L716 HydrophobicContact CD1-CB 3.98Å; I685-L716 HydrophobicContact CD1-CD2 3.72Å; I685-L716 HydrophobicContact CD1-CG 4.42Å; I685-L736 HydrophobicContact CG2-CD1 3.7Å
686	E	85.7	Confident	72.3	Confident	35 Å²	35	34 Å²	34	16%	0.164	21%	0.207	C	C	.	.	H	α-helix	trans	-59.2	-45.4	175.3	-72.6	169.8	142.6	0	0	111	L682 L689 T690 R733 L736	L682-E686 WeakPolarHBondContact O-CB 3.38Å; L682-E686 VanDerWaalsContact O-CG 3.31Å; L682-E686 WeakPolarHBondContact O-CG 3.24Å; L682-E686 PolarHBondContact O-N 2.89Å; E686-L689 PolarHBondContact O-N 3.16Å; E686-T690 WeakPolarHBondContact O-CG2 3.4Å; E686-T690 PolarHBondContact O-N 2.76Å; E686-T690 PolarHBondContact O-OG1 3Å; E686-R733 IonicContact OE1-CZ 2.68Å; E686-R733 IonicContact OE1-NE 3.86Å; E686-R733 PolarHBondContact OE1-NE 3.44Å; E686-R733 IonicContact OE1-NH2 2.95Å; E686-R733 PolarHBondContact OE1-NH2 2.9Å; E686-R733 IonicContact OE2-CZ 3.91Å; E686-R733 IonicContact OE2-NE 3.18Å; E686-R733 IonicContact OE2-NH2 3.38Å; E686-R733 PolarHBondContact OE2-NH2 3.44Å; E686-L736 HydrophobicContact CG-CB 4Å; E686-L736 HydrophobicContact CG-CD1 4.18Å
687	S	81.9	Confident	69.6	Low	17 Å²	17	35.8 Å²	35.8	12%	0.119	22%	0.217	C	C	.	.	H	α-helix	trans	-64.8	-43.4	176.8	-57.3	0	0	0	0	112.5	A582 S683 V684 I685 T690 S691	A582-S687 PolarHBondContact O-OG 3.29Å; S683-S687 VanDerWaalsContact O-CB 3.31Å; S683-S687 WeakPolarHBondContact O-CB 3.43Å; S683-S687 PolarHBondContact O-N 3.5Å; S683-S687 PolarHBondContact O-OG 3.29Å; V684-S687 PolarHBondContact O-N 3.29Å; I685-S687 PolarHBondContact O-N 2.98Å; S687-T690 PolarHBondContact O-N 3.31Å; S687-T690 PolarHBondContact O-OG1 2.85Å; S687-S691 PolarHBondContact O-N 3.22Å
688	A	81	Confident	67.1	Low	21 Å²	21	38.2 Å²	38.2	17%	0.174	23%	0.232	C	C	.	.	H	α-helix	trans	-63.9	-42.8	177.2	0	0	0	0	0	111.9	V684 I685 S691 L709	V684-A688 VanDerWaalsContact O-CB 3.3Å; V684-A688 WeakPolarHBondContact O-CB 3.44Å; V684-A688 PolarHBondContact O-N 3.38Å; I685-A688 PolarHBondContact O-N 3.02Å; A688-S691 WeakPolarHBondContact O-CB 3.29Å; A688-S691 PolarHBondContact O-N 3.42Å; A688-S691 PolarHBondContact O-OG 2.85Å; A688-L709 HydrophobicContact CB-CD1 4.1Å
689	L	79.2	Confident	64.7	Low	5 Å²	5	42.4 Å²	42.4	3%	0.026	25%	0.254	C	S	.	.	H	α-helix	trans	-66	-39.5	177.7	-69.5	167.4	0	0	0	111.9	I685 E686 S691 S692 L736 L740 C743	I685-L689 HydrophobicContact CG2-CD1 3.65Å; I685-L689 HydrophobicContact CG2-CG 4.26Å; I685-L689 WeakPolarHBondContact O-CB 3.38Å; I685-L689 WeakPolarHBondContact O-CG 3.22Å; I685-L689 PolarHBondContact O-N 2.86Å; E686-L689 PolarHBondContact O-N 3.16Å; L689-S691 PolarHBondContact O-N 2.76Å; L689-S692 PolarHBondContact O-N 3.23Å; L689-S692 PolarHBondContact O-OG 3.02Å; L689-L736 HydrophobicContact CD1-CD1 3.67Å; L689-L740 HydrophobicContact CD1-CD2 3.78Å; L689-L740 HydrophobicContact CD1-CG 3.92Å; L689-L740 HydrophobicContact CD2-CD2 4.22Å; L689-C743 HydrophobicContact CD2-CB 3.49Å; L689-C743 VanDerWaalsContact CD2-CB 3.49Å
690	T	65.8	Low	62.4	Low	88 Å²	88	41.9 Å²	41.9	54%	0.54	25%	0.252	S	S	.	.	H	α-helix	trans	-62	-28.1	174.8	53.5	0	0	0	0	113.5	E686 S687 S692	E686-T690 WeakPolarHBondContact O-CG2 3.4Å; E686-T690 PolarHBondContact O-N 2.76Å; E686-T690 PolarHBondContact O-OG1 3Å; S687-T690 PolarHBondContact O-N 3.31Å; S687-T690 PolarHBondContact O-OG1 2.85Å; T690-S692 PolarHBondContact O-N 2.68Å
691	S	52	Low	60.5	Low	63 Å²	63	43.6 Å²	43.6	44%	0.441	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70	-11.4	175.1	79.8	0	0	0	0	114.6	S687 A688 L689	S687-S691 PolarHBondContact O-N 3.22Å; A688-S691 WeakPolarHBondContact O-CB 3.29Å; A688-S691 PolarHBondContact O-N 3.42Å; A688-S691 PolarHBondContact O-OG 2.85Å; L689-S691 PolarHBondContact O-N 2.76Å
692	S	45.6	Very low	58.6	Low	22 Å²	22	45.3 Å²	45.3	15%	0.154	28%	0.275	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.4	19.3	-178.9	70.8	0	0	0	0	114.8	L689 T690	L689-S692 PolarHBondContact O-N 3.23Å; L689-S692 PolarHBondContact O-OG 3.02Å; T690-S692 PolarHBondContact O-N 2.68Å
693	S	36.2	Very low	56.9	Low	37 Å²	37	48.4 Å²	48.4	26%	0.259	30%	0.297	S	S	.	.			trans	-60.2	127.2	-177	-177.8	0	0	0	0	112.9	T695 T696	S693-T695 PolarHBondContact O-N 3.33Å; S693-T695 VanDerWaalsContact O-N 3.07Å; S693-T695 PolarHBondContact OG-OG1 2.8Å; S693-T695 VanDerWaalsContact OG-OG1 3.08Å; S693-T696 PolarHBondContact O-N 3.23Å; S693-T696 VanDerWaalsContact O-N 3.07Å; S693-T696 PolarHBondContact O-OG1 2.86Å
694	P	35.3	Very low	55.3	Low	70 Å²	70	50.5 Å²	50.5	46%	0.455	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.8	-10.5	-175.5	28.2	-36.2	0	0	0	114.3	T696	P694-T696 PolarHBondContact O-N 3.48Å
695	T	33.5	Very low	54.4	Low	105 Å²	105	52.2 Å²	52.2	64%	0.644	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.2	-21.2	171.4	56	0	0	0	0	112.8	Y593 S693	Y593-T695 PolarHBondContact OH-OG1 2.99Å; S693-T695 PolarHBondContact O-N 3.33Å; S693-T695 VanDerWaalsContact O-N 3.07Å; S693-T695 PolarHBondContact OG-OG1 2.8Å; S693-T695 VanDerWaalsContact OG-OG1 3.08Å
696	T	31.8	Very low	54	Low	46 Å²	46	52.3 Å²	52.3	28%	0.282	32%	0.319	S	S	.	.			trans	-119.3	90.8	173.7	43.7	0	0	0	0	109.5	S693 P694 T698	S693-T696 PolarHBondContact O-N 3.23Å; S693-T696 VanDerWaalsContact O-N 3.07Å; S693-T696 PolarHBondContact O-OG1 2.86Å; P694-T696 PolarHBondContact O-N 3.48Å; T696-T698 PolarHBondContact O-N 3.26Å
697	N	31.9	Very low	53.8	Low	98 Å²	98	54.1 Å²	54.1	52%	0.524	33%	0.328	S	S	.	.			trans	-60.6	9.2	174.2	-78.2	-49.9	0	0	0	114.9	A113 N699	A113-N697 CarbonylContact O-C 3.55Å; N697-N699 PolarHBondContact O-N 3.36Å
698	T	35.4	Very low	53.9	Low	52 Å²	52	53.7 Å²	53.7	32%	0.319	33%	0.325	S	S	.	.			trans	-95.6	8.1	-149.2	62.1	0	0	0	0	115.2	A113 G114 T696	A113-T698 VanDerWaalsContact O-CA 3.23Å; A113-T698 WeakPolarHBondContact O-CA 3.24Å; A113-T698 PolarHBondContact O-N 2.75Å; G114-T698 CarbonylContact C-O 3.55Å; G114-T698 CarbonylContact O-C 3.52Å; T696-T698 PolarHBondContact O-N 3.26Å
699	N	39.9	Very low	54.2	Low	114 Å²	114	53.8 Å²	53.8	61%	0.61	32%	0.323	S	S	*	.			trans	-150.5	102.5	168.3	-82	-51.8	0	0	0	108	N697 P701 Y746	N697-N699 PolarHBondContact O-N 3.36Å; N699-P701 VanDerWaalsContact O-CD 3.24Å; N699-P701 WeakPolarHBondContact O-CD 3.34Å; N699-Y746 PolarHBondContact O-OH 3.38Å
700	Q	40.5	Very low	54.7	Low	69 Å²	69	53.7 Å²	53.7	32%	0.322	32%	0.322	S	S	.	.	P	Polyproline II helix	trans	-68	116.7	152.9	-80.3	-167.4	-50.6	0	0	106.3	N115 S702 L750	N115-Q700 PolarHBondContact ND2-OE1 3.41Å; Q700-S702 PolarHBondContact O-N 2.79Å; Q700-L750 HydrophobicContact CG-CD1 4.45Å; Q700-L750 VanDerWaalsContact NE2-CD2 3.27Å
701	P	48.6	Very low	55.9	Low	38 Å²	38	51.2 Å²	51.2	25%	0.247	31%	0.307	C	S	.	.	P	Polyproline II helix	trans	-60.5	133.3	178.1	22.1	-29	0	0	0	108.6	N699	N699-P701 VanDerWaalsContact O-CD 3.24Å; N699-P701 WeakPolarHBondContact O-CD 3.34Å
702	S	51.7	Low	57.7	Low	36 Å²	36	48.4 Å²	48.4	25%	0.252	29%	0.287	S	S	.	.	P	Polyproline II helix	trans	-57.1	154.3	174	21.9	0	0	0	0	111.9	K117 Q700 T704 T705 C706	K117-S702 PolarHBondContact NZ-OG 2.88Å; Q700-S702 PolarHBondContact O-N 2.79Å; S702-T704 PolarHBondContact O-N 2.88Å; S702-T704 VanDerWaalsContact O-N 3.08Å; S702-T705 WeakPolarHBondContact CA-OG1 3.36Å; S702-T705 PolarHBondContact N-OG1 3.44Å; S702-T705 PolarHBondContact O-N 2.59Å; S702-T705 PolarHBondContact O-OG1 3.05Å; S702-T705 PolarHBondContact OG-OG1 2.91Å; S702-C706 PolarHBondContact O-N 3.37Å
703	S	53.3	Low	60	Low	69 Å²	69	47.3 Å²	47.3	48%	0.483	28%	0.28	S	S	.	.	H	α-helix	trans	-48.8	-37.1	175.1	177.9	0	0	0	0	113.5	Q707 S755	S703-Q707 WeakPolarHBondContact O-CB 3.5Å; S703-Q707 PolarHBondContact O-N 3.07Å; S703-S755 WeakPolarHBondContact OG-CB 3.47Å
704	T	54.7	Low	62.6	Low	74 Å²	74	47.6 Å²	47.6	45%	0.454	28%	0.278	S	S	.	.	H	α-helix	trans	-69.7	-42.9	175.6	64	0	0	0	0	113.2	E659 S702 Q707 C708	E659-T704 WeakPolarHBondContact OE1-CB 3.46Å; E659-T704 PolarHBondContact OE1-OG1 3.42Å; S702-T704 PolarHBondContact O-N 2.88Å; S702-T704 VanDerWaalsContact O-N 3.08Å; T704-Q707 WeakPolarHBondContact O-CB 3.23Å; T704-Q707 PolarHBondContact O-N 3.48Å; T704-C708 WeakPolarHBondContact O-CB 3.27Å; T704-C708 PolarHBondContact O-N 2.77Å
705	T	71.6	Confident	65.2	Low	38 Å²	38	44.5 Å²	44.5	23%	0.233	26%	0.258	C	S	.	.	H	α-helix	trans	-66	-36	173.4	37.2	0	0	0	0	112.7	A655 S702 C708 L709	A655-T705 HydrophobicContact CB-CG2 4.19Å; S702-T705 WeakPolarHBondContact CA-OG1 3.36Å; S702-T705 PolarHBondContact N-OG1 3.44Å; S702-T705 PolarHBondContact O-N 2.59Å; S702-T705 PolarHBondContact O-OG1 3.05Å; S702-T705 PolarHBondContact OG-OG1 2.91Å; T705-C708 PolarHBondContact O-N 3.48Å; T705-L709 WeakPolarHBondContact O-CB 3.47Å; T705-L709 PolarHBondContact O-N 3.36Å
706	C	78.1	Confident	68	Low	1 Å²	1	39.5 Å²	39.5	1%	0.007	23%	0.228	C	C	.	.	H	α-helix	trans	-62	-44.6	170	-69.5	0	0	0	0	111.3	S702 A710 L759	S702-C706 PolarHBondContact O-N 3.37Å; C706-A710 VanDerWaalsContact O-CB 3.24Å; C706-A710 WeakPolarHBondContact O-CB 3.42Å; C706-A710 PolarHBondContact O-N 2.97Å; C706-L759 HydrophobicContact CB-CD2 4.43Å
707	Q	81.1	Confident	70.7	Confident	73 Å²	73	37.5 Å²	37.5	34%	0.341	22%	0.216	S	C	.	.	H	α-helix	trans	-62.6	-46.5	176.6	-175.5	65.3	32.1	0	0	111.8	S703 T704 A710 T711	S703-Q707 WeakPolarHBondContact O-CB 3.5Å; S703-Q707 PolarHBondContact O-N 3.07Å; T704-Q707 WeakPolarHBondContact O-CB 3.23Å; T704-Q707 PolarHBondContact O-N 3.48Å; Q707-A710 WeakPolarHBondContact O-CB 3.32Å; Q707-A710 PolarHBondContact O-N 2.83Å; Q707-T711 WeakPolarHBondContact O-CG2 3.45Å; Q707-T711 PolarHBondContact O-N 2.96Å
708	C	84	Confident	73.4	Confident	9 Å²	9	36 Å²	36	6%	0.061	21%	0.208	C	C	.	.	H	α-helix	trans	-58.4	-53	177.2	-175.7	0	0	0	0	110.9	E659 T704 T705 A710 T711 L712	E659-C708 HydrophobicContact CG-CB 4Å; T704-C708 WeakPolarHBondContact O-CB 3.27Å; T704-C708 PolarHBondContact O-N 2.77Å; T705-C708 PolarHBondContact O-N 3.48Å; C708-A710 VanDerWaalsContact C-N 3.32Å; C708-A710 PolarHBondContact O-N 3.37Å; C708-T711 PolarHBondContact O-N 3Å; C708-T711 VanDerWaalsContact O-N 3.14Å; C708-T711 PolarHBondContact O-OG1 2.89Å; C708-L712 WeakPolarHBondContact O-CG 3.35Å; C708-L712 PolarHBondContact O-N 3.15Å
709	L	88.1	Confident	75.8	Confident	23 Å²	23	34 Å²	34	12%	0.12	20%	0.197	C	C	.	.	H	α-helix	trans	-61.6	-39.8	179.2	-175.6	58.4	0	0	0	111.7	A688 T705 T711 L712 L713 L759	A688-L709 HydrophobicContact CB-CD1 4.1Å; T705-L709 WeakPolarHBondContact O-CB 3.47Å; T705-L709 PolarHBondContact O-N 3.36Å; L709-T711 PolarHBondContact O-N 3.14Å; L709-L712 PolarHBondContact O-N 3.18Å; L709-L713 HydrophobicContact CD1-CD1 4.33Å; L709-L713 HydrophobicContact CD1-CG 4.24Å; L709-L713 HydrophobicContact CG-CD1 3.97Å; L709-L713 HydrophobicContact CG-CG 4.36Å; L709-L713 WeakPolarHBondContact O-CB 3.46Å; L709-L713 WeakPolarHBondContact O-CG 3.28Å; L709-L713 PolarHBondContact O-N 3.48Å; L709-L759 HydrophobicContact CB-CD1 4.08Å; L709-L759 HydrophobicContact CD2-CD1 3.89Å; L709-L759 HydrophobicContact CD2-CD2 4.28Å; L709-L759 HydrophobicContact CG-CD1 3.8Å
710	A	89.2	Confident	78	Confident	3 Å²	3	28.8 Å²	28.8	3%	0.025	17%	0.169	C	C	.	.	H	α-helix	trans	-58.3	-44.4	173.5	0	0	0	0	0	112.5	C706 Q707 C708 L713 D714 R758 L759 S762	C706-A710 VanDerWaalsContact O-CB 3.24Å; C706-A710 WeakPolarHBondContact O-CB 3.42Å; C706-A710 PolarHBondContact O-N 2.97Å; Q707-A710 WeakPolarHBondContact O-CB 3.32Å; Q707-A710 PolarHBondContact O-N 2.83Å; C708-A710 VanDerWaalsContact C-N 3.32Å; C708-A710 PolarHBondContact O-N 3.37Å; A710-L713 PolarHBondContact O-N 3.43Å; A710-D714 WeakPolarHBondContact O-CB 3.5Å; A710-D714 PolarHBondContact O-N 2.76Å; A710-R758 HydrophobicContact CB-CG 4.37Å; A710-L759 HydrophobicContact CB-CD1 4.45Å; A710-S762 WeakPolarHBondContact CB-OG 3.32Å; A710-S762 PolarHBondContact O-OG 3.32Å
711	T	90.5	Very high	80	Confident	35 Å²	35	33 Å²	33	22%	0.215	19%	0.189	C	C	.	.	H	α-helix	trans	-67.6	-35	177.4	60.2	0	0	0	0	113.6	Q707 C708 L709 S715	Q707-T711 WeakPolarHBondContact O-CG2 3.45Å; Q707-T711 PolarHBondContact O-N 2.96Å; C708-T711 PolarHBondContact O-N 3Å; C708-T711 VanDerWaalsContact O-N 3.14Å; C708-T711 PolarHBondContact O-OG1 2.89Å; L709-T711 PolarHBondContact O-N 3.14Å; T711-S715 PolarHBondContact O-N 3.37Å
712	L	91.4	Very high	81.7	Confident	4 Å²	4	34.9 Å²	34.9	2%	0.021	20%	0.197	C	C	.	.	H	α-helix	trans	-67.6	-43.6	174.9	-65.5	173	0	0	0	111.1	T662 F667 L681 V684 I685 C708 L709 S715 L716	T662-L712 HydrophobicContact CG2-CD2 3.62Å; T662-L712 HydrophobicContact CG2-CG 3.97Å; F667-L712 HydrophobicContact CE1-CD2 4.46Å; L681-L712 HydrophobicContact CD1-CB 4.08Å; L681-L712 HydrophobicContact CD1-CD2 3.68Å; L681-L712 HydrophobicContact CD1-CG 4.43Å; V684-L712 HydrophobicContact CG1-CD1 4.13Å; I685-L712 HydrophobicContact CD1-CB 4.09Å; I685-L712 HydrophobicContact CG1-CB 4.08Å; C708-L712 WeakPolarHBondContact O-CG 3.35Å; C708-L712 PolarHBondContact O-N 3.15Å; L709-L712 PolarHBondContact O-N 3.18Å; L712-S715 PolarHBondContact O-N 2.96Å; L712-L716 WeakPolarHBondContact O-CB 3.46Å; L712-L716 PolarHBondContact O-N 3.49Å
713	L	92.7	Very high	83.2	Confident	0 Å²	0	39.3 Å²	39.3	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-64.5	-39.2	175.2	-69.2	169.7	0	0	0	112.4	I685 L709 A710 L716 G717 L740 L759 I763 L766	I685-L713 HydrophobicContact CD1-CD2 4.42Å; I685-L713 HydrophobicContact CG2-CD2 3.71Å; L709-L713 HydrophobicContact CD1-CD1 4.33Å; L709-L713 HydrophobicContact CD1-CG 4.24Å; L709-L713 HydrophobicContact CG-CD1 3.97Å; L709-L713 HydrophobicContact CG-CG 4.36Å; L709-L713 WeakPolarHBondContact O-CB 3.46Å; L709-L713 WeakPolarHBondContact O-CG 3.28Å; L709-L713 PolarHBondContact O-N 3.48Å; A710-L713 PolarHBondContact O-N 3.43Å; L713-L716 PolarHBondContact O-N 3.32Å; L713-G717 PolarHBondContact O-N 2.68Å; L713-L740 HydrophobicContact CD2-CD2 3.71Å; L713-L759 HydrophobicContact CD1-CD1 3.66Å; L713-I763 HydrophobicContact CD1-CG1 3.71Å; L713-L766 HydrophobicContact CD2-CD2 3.51Å
714	D	91.7	Very high	84.7	Confident	43 Å²	43	40.5 Å²	40.5	23%	0.23	21%	0.212	C	C	.	.	H	α-helix	trans	-67.4	-38	174.6	-77.3	8.6	0	0	0	111.4	A710 G717 N718 S762 R765	A710-D714 WeakPolarHBondContact O-CB 3.5Å; A710-D714 PolarHBondContact O-N 2.76Å; D714-G717 PolarHBondContact O-N 3.41Å; D714-N718 PolarHBondContact O-N 3.42Å; D714-N718 VanDerWaalsContact O-N 3.16Å; D714-N718 PolarHBondContact O-ND2 3.32Å; D714-S762 VanDerWaalsContact CG-OG 3.31Å; D714-S762 WeakPolarHBondContact OD1-CA 3.44Å; D714-S762 WeakPolarHBondContact OD1-CB 3.5Å; D714-S762 PolarHBondContact OD1-OG 3Å; D714-R765 VanDerWaalsContact CG-NH1 3.31Å; D714-R765 VanDerWaalsContact CG-NH2 3.27Å; D714-R765 IonicContact OD1-CZ 3.79Å; D714-R765 VanDerWaalsContact OD1-CZ 3.23Å; D714-R765 IonicContact OD1-NH1 3.12Å; D714-R765 PolarHBondContact OD1-NH1 3.49Å; D714-R765 IonicContact OD1-NH2 3.23Å; D714-R765 PolarHBondContact OD1-NH2 3.03Å; D714-R765 IonicContact OD2-CZ 2.7Å; D714-R765 IonicContact OD2-NH1 3.57Å; D714-R765 PolarHBondContact OD2-NH1 2.85Å; D714-R765 IonicContact OD2-NH2 3.97Å; D714-R765 PolarHBondContact OD2-NH2 3.29Å
715	S	90.2	Very high	86.1	Confident	5 Å²	5	38 Å²	38	4%	0.035	20%	0.195	C	C	.	.	H	α-helix	trans	-64.3	-43.4	173.9	-164.3	0	0	0	0	111.8	L668 T711 L712 N718 A719	L668-S715 PolarHBondContact O-OG 3.05Å; T711-S715 PolarHBondContact O-N 3.37Å; L712-S715 PolarHBondContact O-N 2.96Å; S715-N718 WeakPolarHBondContact O-CB 3.22Å; S715-N718 PolarHBondContact O-N 3.11Å; S715-A719 PolarHBondContact O-N 2.87Å
716	L	90.9	Very high	86.8	Confident	0 Å²	0	36.6 Å²	36.6	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-63.3	-39.5	173.4	-177.2	64.7	0	0	0	111.9	L678 L681 L682 I685 L712 L713 N718 A719 C720 F725 L736 L766	L678-L716 HydrophobicContact CD1-CD1 3.94Å; L681-L716 HydrophobicContact CD2-CB 4.24Å; L682-L716 HydrophobicContact CD2-CD1 3.79Å; L682-L716 HydrophobicContact CD2-CD2 3.85Å; L682-L716 HydrophobicContact CD2-CG 4.5Å; L682-L716 HydrophobicContact CG-CD1 4.11Å; I685-L716 HydrophobicContact CD1-CB 3.98Å; I685-L716 HydrophobicContact CD1-CD2 3.72Å; I685-L716 HydrophobicContact CD1-CG 4.42Å; L712-L716 WeakPolarHBondContact O-CB 3.46Å; L712-L716 PolarHBondContact O-N 3.49Å; L713-L716 PolarHBondContact O-N 3.32Å; L716-N718 PolarHBondContact O-N 3.45Å; L716-A719 WeakPolarHBondContact O-CA 3.25Å; L716-A719 VanDerWaalsContact O-CB 3.22Å; L716-A719 WeakPolarHBondContact O-CB 3.35Å; L716-A719 PolarHBondContact O-N 3.21Å; L716-C720 PolarHBondContact O-N 3.48Å; L716-C720 PolarHBondContact O-SG 3.05Å; L716-F725 HydrophobicContact CD1-CE1 3.79Å; L716-F725 HydrophobicContact CD1-CZ 3.67Å; L716-L736 HydrophobicContact CD2-CD2 4.35Å; L716-L766 HydrophobicContact CB-CD1 4.33Å; L716-L766 HydrophobicContact CD2-CD1 4.08Å; L716-L766 HydrophobicContact CD2-CD2 3.87Å; L716-L766 HydrophobicContact CG-CD1 3.89Å; L716-L766 HydrophobicContact CG-CD2 4.5Å
717	G	89.7	Confident	87	Confident	4 Å²	4	41.5 Å²	41.5	4%	0.041	21%	0.207	C	C	.	.	H	α-helix	trans	-64.7	-23	177.4	0	0	0	0	0	113.8	L713 D714 N769	L713-G717 PolarHBondContact O-N 2.68Å; D714-G717 PolarHBondContact O-N 3.41Å; G717-N769 PolarHBondContact O-ND2 3.49Å
718	N	87.1	Confident	87.2	Confident	67 Å²	67	41.2 Å²	41.2	36%	0.358	21%	0.211	S	C	.	.	H	α-helix	trans	-79.7	-25.1	168.5	-75.6	-77	0	0	0	112.9	D714 S715 L716 C720 Q721	D714-N718 PolarHBondContact O-N 3.42Å; D714-N718 VanDerWaalsContact O-N 3.16Å; D714-N718 PolarHBondContact O-ND2 3.32Å; S715-N718 WeakPolarHBondContact O-CB 3.22Å; S715-N718 PolarHBondContact O-N 3.11Å; L716-N718 PolarHBondContact O-N 3.45Å; N718-C720 VanDerWaalsContact C-N 3.3Å; N718-Q721 WeakPolarHBondContact O-CG 3.34Å; N718-Q721 PolarHBondContact O-N 3.08Å
719	A	86.3	Confident	87.3	Confident	10 Å²	10	40.9 Å²	40.9	8%	0.083	21%	0.208	C	C	.	.	H	α-helix	trans	-69.7	-31.3	173.2	0	0	0	0	0	111.4	R672 L678 S715 L716 Q721 D722 F725	R672-A719 HydrophobicContact CG-CB 3.87Å; L678-A719 HydrophobicContact CD1-CB 3.67Å; L678-A719 HydrophobicContact CD2-CB 4.38Å; S715-A719 PolarHBondContact O-N 2.87Å; L716-A719 WeakPolarHBondContact O-CA 3.25Å; L716-A719 VanDerWaalsContact O-CB 3.22Å; L716-A719 WeakPolarHBondContact O-CB 3.35Å; L716-A719 PolarHBondContact O-N 3.21Å; A719-Q721 PolarHBondContact O-N 3.3Å; A719-D722 PolarHBondContact O-N 3.17Å; A719-D722 VanDerWaalsContact O-N 3.13Å; A719-F725 HydrophobicContact CB-CD1 4.02Å; A719-F725 HydrophobicContact CB-CE1 3.66Å; A719-F725 HydrophobicContact CB-CZ 4.41Å
720	C	86.7	Confident	87	Confident	4 Å²	4	39.9 Å²	39.9	3%	0.027	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.5	17.3	172.7	-57.6	0	0	0	0	114.9	L716 N718 D722 Q726 N769	L716-C720 PolarHBondContact O-N 3.48Å; L716-C720 PolarHBondContact O-SG 3.05Å; N718-C720 VanDerWaalsContact C-N 3.3Å; C720-D722 VanDerWaalsContact C-N 3.33Å; C720-Q726 HydrophobicContact CB-CG 4.33Å; C720-Q726 PolarHBondContact O-NE2 3.35Å; C720-N769 HydrophobicContact CB-CB 3.9Å
721	Q	82.9	Confident	86.6	Confident	157 Å²	157	45.1 Å²	45.1	73%	0.734	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74.7	-26.4	160.4	-68.6	178.4	6.6	0	0	111.5	N718 A719	N718-Q721 WeakPolarHBondContact O-CG 3.34Å; N718-Q721 PolarHBondContact O-N 3.08Å; A719-Q721 PolarHBondContact O-N 3.3Å
722	D	83.7	Confident	86.2	Confident	77 Å²	77	46.9 Å²	46.9	41%	0.412	24%	0.241	S	C	.	.	S	Bend	trans	-79.4	120.1	173.5	178.7	1.4	0	0	0	111.4	A719 C720 T724 F725 Q726	A719-D722 PolarHBondContact O-N 3.17Å; A719-D722 VanDerWaalsContact O-N 3.13Å; C720-D722 VanDerWaalsContact C-N 3.33Å; D722-T724 VanDerWaalsContact C-N 3.3Å; D722-T724 PolarHBondContact O-N 2.97Å; D722-T724 WeakPolarHBondContact OD1-CA 3.17Å; D722-T724 WeakPolarHBondContact OD1-CB 3.34Å; D722-T724 PolarHBondContact OD1-N 2.92Å; D722-T724 PolarHBondContact OD1-OG1 3.44Å; D722-T724 PolarHBondContact OD2-OG1 3.49Å; D722-F725 HydrophobicContact CB-CB 3.96Å; D722-F725 PolarHBondContact O-N 3.46Å; D722-Q726 WeakPolarHBondContact O-CG 3.42Å; D722-Q726 PolarHBondContact O-N 3.21Å
723	R	83.3	Confident	85.9	Confident	130 Å²	130	48.5 Å²	48.5	49%	0.491	25%	0.247	S	C	.	.	H	α-helix	trans	-72.2	-20.2	179.4	-161.6	173.4	-170.8	-168.4	2.5	113.2	K727 G773	R723-K727 WeakPolarHBondContact O-CG 3.45Å; R723-K727 PolarHBondContact O-N 2.97Å; R723-G773 PolarHBondContact NH2-O 3.4Å
724	T	84.1	Confident	85.4	Confident	93 Å²	93	53.8 Å²	53.8	57%	0.571	27%	0.27	S	S	*	.	H	α-helix	trans	-71	-49.4	170.3	76.1	0	0	0	0	109.7	D722 Q726 K727 T728	D722-T724 VanDerWaalsContact C-N 3.3Å; D722-T724 PolarHBondContact O-N 2.97Å; D722-T724 WeakPolarHBondContact OD1-CA 3.17Å; D722-T724 WeakPolarHBondContact OD1-CB 3.34Å; D722-T724 PolarHBondContact OD1-N 2.92Å; D722-T724 PolarHBondContact OD1-OG1 3.44Å; D722-T724 PolarHBondContact OD2-OG1 3.49Å; T724-Q726 PolarHBondContact O-N 3.27Å; T724-K727 WeakPolarHBondContact O-CB 3.47Å; T724-K727 PolarHBondContact O-N 2.91Å; T724-T728 PolarHBondContact O-N 2.92Å; T724-T728 PolarHBondContact O-OG1 3.18Å; T724-T728 VanDerWaalsContact O-OG1 3.12Å
725	F	85	Confident	84.9	Confident	22 Å²	22	55.3 Å²	55.3	10%	0.096	29%	0.288	C	S	.	.	H	α-helix	trans	-59.3	-40.9	176.5	-173.4	-115.5	0	0	0	113.3	L678 L682 L716 A719 D722 K727 T728 I729	L678-F725 HydrophobicContact CD1-CE1 4.23Å; L678-F725 HydrophobicContact CD1-CE2 4.24Å; L678-F725 HydrophobicContact CD1-CZ 3.69Å; L678-F725 HydrophobicContact CD2-CD2 3.89Å; L678-F725 HydrophobicContact CD2-CE1 4.34Å; L678-F725 HydrophobicContact CD2-CE2 3.53Å; L678-F725 HydrophobicContact CD2-CG 4.44Å; L678-F725 HydrophobicContact CD2-CZ 3.78Å; L678-F725 HydrophobicContact CG-CE2 3.8Å; L678-F725 HydrophobicContact CG-CZ 3.79Å; L682-F725 HydrophobicContact CD1-CE2 3.87Å; L682-F725 HydrophobicContact CD1-CZ 3.93Å; L682-F725 HydrophobicContact CD2-CZ 4.45Å; L682-F725 HydrophobicContact CG-CZ 4.4Å; L716-F725 HydrophobicContact CD1-CE1 3.79Å; L716-F725 HydrophobicContact CD1-CZ 3.67Å; A719-F725 HydrophobicContact CB-CD1 4.02Å; A719-F725 HydrophobicContact CB-CE1 3.66Å; A719-F725 HydrophobicContact CB-CZ 4.41Å; D722-F725 HydrophobicContact CB-CB 3.96Å; D722-F725 PolarHBondContact O-N 3.46Å; F725-K727 PolarHBondContact O-N 3.22Å; F725-T728 PolarHBondContact O-N 3.11Å; F725-I729 HydrophobicContact CD1-CD1 3.99Å; F725-I729 HydrophobicContact CE1-CD1 3.52Å; F725-I729 HydrophobicContact CE1-CG1 4.39Å; F725-I729 HydrophobicContact CE2-CD1 4.45Å; F725-I729 HydrophobicContact CZ-CD1 3.78Å; F725-I729 HydrophobicContact CZ-CG1 4.29Å; F725-I729 PolarHBondContact O-N 3.49Å
726	Q	86.3	Confident	84.7	Confident	9 Å²	9	55.1 Å²	55.1	4%	0.042	29%	0.287	C	S	.	.	H	α-helix	trans	-54.1	-48.7	170.8	-71.6	167.9	3.8	0	0	112	C720 D722 T724 I729 L730 N769 V772	C720-Q726 HydrophobicContact CB-CG 4.33Å; C720-Q726 PolarHBondContact O-NE2 3.35Å; D722-Q726 WeakPolarHBondContact O-CG 3.42Å; D722-Q726 PolarHBondContact O-N 3.21Å; T724-Q726 PolarHBondContact O-N 3.27Å; Q726-I729 PolarHBondContact O-N 3.04Å; Q726-L730 WeakPolarHBondContact O-CG 3.3Å; Q726-L730 PolarHBondContact O-N 2.9Å; Q726-L730 VanDerWaalsContact O-N 3.17Å; Q726-N769 PolarHBondContact NE2-O 3.44Å; Q726-V772 PolarHBondContact OE1-O 3.42Å
727	K	83	Confident	84.6	Confident	103 Å²	103	55.2 Å²	55.2	45%	0.448	29%	0.287	S	S	.	.	H	α-helix	trans	-63	-44.1	177.3	-72.6	-179.8	175.4	-169.8	0	111.4	R723 T724 F725 I729 L730 Q731	R723-K727 WeakPolarHBondContact O-CG 3.45Å; R723-K727 PolarHBondContact O-N 2.97Å; T724-K727 WeakPolarHBondContact O-CB 3.47Å; T724-K727 PolarHBondContact O-N 2.91Å; F725-K727 PolarHBondContact O-N 3.22Å; K727-I729 VanDerWaalsContact C-N 3.32Å; K727-I729 PolarHBondContact O-N 3.49Å; K727-L730 PolarHBondContact O-N 2.89Å; K727-Q731 WeakPolarHBondContact O-CB 3.33Å; K727-Q731 WeakPolarHBondContact O-CG 3.35Å; K727-Q731 PolarHBondContact O-N 3.37Å
728	T	84.4	Confident	84.4	Confident	68 Å²	68	58.5 Å²	58.5	42%	0.417	30%	0.301	S	S	.	.	H	α-helix	trans	-58.6	-42.2	177.8	-53.2	0	0	0	0	112	T724 F725 S732	T724-T728 PolarHBondContact O-N 2.92Å; T724-T728 PolarHBondContact O-OG1 3.18Å; T724-T728 VanDerWaalsContact O-OG1 3.12Å; F725-T728 PolarHBondContact O-N 3.11Å; T728-S732 WeakPolarHBondContact O-CB 3.32Å; T728-S732 PolarHBondContact O-N 3.29Å; T728-S732 PolarHBondContact O-OG 3.25Å
729	I	85	Confident	84.2	Confident	1 Å²	1	55.8 Å²	55.8	1%	0.005	29%	0.289	C	S	.	.	H	α-helix	trans	-61.1	-52.1	175.3	-73.1	172.4	0	0	0	110.9	F725 Q726 K727 Q731 R733 L736 L737 I770	F725-I729 HydrophobicContact CD1-CD1 3.99Å; F725-I729 HydrophobicContact CE1-CD1 3.52Å; F725-I729 HydrophobicContact CE1-CG1 4.39Å; F725-I729 HydrophobicContact CE2-CD1 4.45Å; F725-I729 HydrophobicContact CZ-CD1 3.78Å; F725-I729 HydrophobicContact CZ-CG1 4.29Å; F725-I729 PolarHBondContact O-N 3.49Å; Q726-I729 PolarHBondContact O-N 3.04Å; K727-I729 VanDerWaalsContact C-N 3.32Å; K727-I729 PolarHBondContact O-N 3.49Å; I729-Q731 PolarHBondContact O-N 3.45Å; I729-R733 CarbonylContact O-C 3.54Å; I729-R733 WeakPolarHBondContact O-CA 3.43Å; I729-R733 PolarHBondContact O-N 3.38Å; I729-L736 HydrophobicContact CG2-CD2 4.26Å; I729-L737 HydrophobicContact CG2-CD2 4.03Å; I729-L737 HydrophobicContact CG2-CG 4.4Å; I729-I770 HydrophobicContact CD1-CD1 4.42Å; I729-I770 HydrophobicContact CD1-CG1 4.26Å; I729-I770 HydrophobicContact CG2-CD1 3.99Å; I729-I770 HydrophobicContact CG2-CG1 4.29Å; I729-I770 HydrophobicContact CG2-CG2 4.07Å
730	L	83.2	Confident	84.4	Confident	2 Å²	2	55.3 Å²	55.3	1%	0.01	29%	0.285	C	S	.	.	H	α-helix	trans	-62.2	-43.1	-177.1	-71.3	166.4	0	0	0	112.6	Q726 K727 L737 I770 Y771 Q774 T802	Q726-L730 WeakPolarHBondContact O-CG 3.3Å; Q726-L730 PolarHBondContact O-N 2.9Å; Q726-L730 VanDerWaalsContact O-N 3.17Å; K727-L730 PolarHBondContact O-N 2.89Å; L730-L737 HydrophobicContact CD2-CD1 4.15Å; L730-I770 HydrophobicContact CD1-CG2 4.3Å; L730-I770 HydrophobicContact CD2-CG2 3.75Å; L730-I770 HydrophobicContact CG-CG2 3.8Å; L730-Y771 HydrophobicContact CD2-CD1 4.2Å; L730-Y771 HydrophobicContact CD2-CE1 3.49Å; L730-Y771 VanDerWaalsContact CD2-CE1 3.49Å; L730-Q774 HydrophobicContact CD1-CG 4.32Å; L730-Q774 VanDerWaalsContact CD1-NE2 3.25Å; L730-T802 HydrophobicContact CD2-CG2 4.41Å
731	Q	81.3	Confident	84.5	Confident	113 Å²	113	55.1 Å²	55.1	53%	0.528	28%	0.283	S	S	.	.	H	α-helix	trans	-73.6	-48.6	-178.1	-69.5	172.6	-31.1	0	0	112.4	K727 I729 L801	K727-Q731 WeakPolarHBondContact O-CB 3.33Å; K727-Q731 WeakPolarHBondContact O-CG 3.35Å; K727-Q731 PolarHBondContact O-N 3.37Å; I729-Q731 PolarHBondContact O-N 3.45Å; Q731-L801 HydrophobicContact CG-CD2 3.62Å
732	S	81.3	Confident	84.5	Confident	73 Å²	73	51.1 Å²	51.1	51%	0.51	27%	0.267	S	S	.	.	H	α-helix	trans	-106.8	-26.5	-166.7	73.7	0	0	0	0	115.5	T728 K734	T728-S732 WeakPolarHBondContact O-CB 3.32Å; T728-S732 PolarHBondContact O-N 3.29Å; T728-S732 PolarHBondContact O-OG 3.25Å; S732-K734 PolarHBondContact O-N 2.68Å
733	R	84.7	Confident	84.6	Confident	37 Å²	37	47.5 Å²	47.5	14%	0.14	25%	0.247	C	C	.	.			trans	-104.3	47.6	-172.3	-49.4	-58.2	-90.5	-98.8	4.2	112.5	Q679 E686 I729 A735 L736 L737	Q679-R733 VanDerWaalsContact OE1-NH2 3.15Å; E686-R733 IonicContact OE1-CZ 2.68Å; E686-R733 IonicContact OE1-NE 3.86Å; E686-R733 PolarHBondContact OE1-NE 3.44Å; E686-R733 IonicContact OE1-NH2 2.95Å; E686-R733 PolarHBondContact OE1-NH2 2.9Å; E686-R733 IonicContact OE2-CZ 3.91Å; E686-R733 IonicContact OE2-NE 3.18Å; E686-R733 IonicContact OE2-NH2 3.38Å; E686-R733 PolarHBondContact OE2-NH2 3.44Å; I729-R733 CarbonylContact O-C 3.54Å; I729-R733 WeakPolarHBondContact O-CA 3.43Å; I729-R733 PolarHBondContact O-N 3.38Å; R733-A735 PolarHBondContact O-N 3.05Å; R733-L736 HydrophobicContact CB-CB 4.05Å; R733-L736 WeakPolarHBondContact O-CB 3.38Å; R733-L736 PolarHBondContact O-N 3.07Å; R733-L736 VanDerWaalsContact O-N 3.08Å; R733-L737 PolarHBondContact O-N 2.93Å
734	K	82.3	Confident	84.8	Confident	111 Å²	111	41.3 Å²	41.3	48%	0.483	22%	0.224	S	C	.	.	H	α-helix	trans	-55.9	-34.6	175.5	-63.5	179.1	-178	178	0	112	S732 L737 F738	S732-K734 PolarHBondContact O-N 2.68Å; K734-L737 PolarHBondContact O-N 3.11Å; K734-F738 VanDerWaalsContact O-CD2 3.31Å; K734-F738 WeakPolarHBondContact O-CD2 3.48Å; K734-F738 PolarHBondContact O-N 3.15Å
735	A	80.8	Confident	84.9	Confident	75 Å²	75	39.4 Å²	39.4	62%	0.62	22%	0.215	S	C	*	.	H	α-helix	trans	-61.2	-44	175	0	0	0	0	0	113.1	R733 L737 G739	R733-A735 PolarHBondContact O-N 3.05Å; A735-L737 PolarHBondContact O-N 3.27Å; A735-G739 PolarHBondContact O-N 2.99Å
736	L	86.7	Confident	84.8	Confident	1 Å²	1	40 Å²	40	1%	0.005	22%	0.216	C	C	.	.	H	α-helix	trans	-57.9	-47.6	173.5	173.7	64.4	0	0	0	111	L682 I685 E686 L689 L716 I729 R733 G739 L740	L682-L736 HydrophobicContact CD2-CD2 3.7Å; I685-L736 HydrophobicContact CG2-CD1 3.7Å; E686-L736 HydrophobicContact CG-CB 4Å; E686-L736 HydrophobicContact CG-CD1 4.18Å; L689-L736 HydrophobicContact CD1-CD1 3.67Å; L716-L736 HydrophobicContact CD2-CD2 4.35Å; I729-L736 HydrophobicContact CG2-CD2 4.26Å; R733-L736 HydrophobicContact CB-CB 4.05Å; R733-L736 WeakPolarHBondContact O-CB 3.38Å; R733-L736 PolarHBondContact O-N 3.07Å; R733-L736 VanDerWaalsContact O-N 3.08Å; L736-G739 PolarHBondContact O-N 3.26Å; L736-L740 HydrophobicContact CD1-CD1 4.2Å; L736-L740 HydrophobicContact CD1-CG 4.22Å; L736-L740 HydrophobicContact CG-CD1 4.11Å; L736-L740 WeakPolarHBondContact O-CG 3.41Å; L736-L740 PolarHBondContact O-N 2.93Å
737	L	88	Confident	84.8	Confident	2 Å²	2	39.7 Å²	39.7	1%	0.01	22%	0.215	C	C	.	.	H	α-helix	trans	-66.1	-42.7	-176.7	-60.6	174.2	0	0	0	112.5	I729 L730 R733 K734 A735 L740 S741 L767 I770 L806	I729-L737 HydrophobicContact CG2-CD2 4.03Å; I729-L737 HydrophobicContact CG2-CG 4.4Å; L730-L737 HydrophobicContact CD2-CD1 4.15Å; R733-L737 PolarHBondContact O-N 2.93Å; K734-L737 PolarHBondContact O-N 3.11Å; A735-L737 PolarHBondContact O-N 3.27Å; L737-L740 PolarHBondContact O-N 3.45Å; L737-S741 PolarHBondContact O-N 2.91Å; L737-L767 HydrophobicContact CD2-CD2 4.26Å; L737-I770 HydrophobicContact CD2-CD1 4.13Å; L737-I770 HydrophobicContact CD2-CG2 4.49Å; L737-L806 HydrophobicContact CB-CD1 4.04Å; L737-L806 HydrophobicContact CB-CD2 3.61Å; L737-L806 HydrophobicContact CB-CG 4.47Å; L737-L806 HydrophobicContact CD1-CD2 3.89Å; L737-L806 HydrophobicContact CG-CD2 4.37Å
738	F	85.8	Confident	85	Confident	74 Å²	74	35.1 Å²	35.1	33%	0.325	20%	0.196	S	C	.	.	H	α-helix	trans	-65.8	-37.7	172	-81.2	-68.9	0	0	0	112.1	K734 S741 N742 L806	K734-F738 VanDerWaalsContact O-CD2 3.31Å; K734-F738 WeakPolarHBondContact O-CD2 3.48Å; K734-F738 PolarHBondContact O-N 3.15Å; F738-S741 PolarHBondContact O-N 3.39Å; F738-N742 WeakPolarHBondContact O-CB 3.34Å; F738-N742 PolarHBondContact O-N 2.84Å; F738-N742 PolarHBondContact O-ND2 3.42Å; F738-L806 HydrophobicContact CD1-CB 4.47Å; F738-L806 HydrophobicContact CD1-CD1 3.94Å; F738-L806 HydrophobicContact CE1-CB 3.82Å; F738-L806 HydrophobicContact CE1-CD1 4.15Å; F738-L806 HydrophobicContact CE2-CB 4.37Å; F738-L806 HydrophobicContact CG-CD1 4.2Å; F738-L806 HydrophobicContact CZ-CB 3.77Å
739	G	83.5	Confident	84.9	Confident	10 Å²	10	36.5 Å²	36.5	10%	0.103	21%	0.206	C	C	.	.	H	α-helix	trans	-59.3	-45.6	173.2	0	0	0	0	0	112.5	A735 L736 N742 C743	A735-G739 PolarHBondContact O-N 2.99Å; L736-G739 PolarHBondContact O-N 3.26Å; G739-N742 PolarHBondContact O-N 3.3Å; G739-C743 WeakPolarHBondContact O-CB 3.43Å; G739-C743 PolarHBondContact O-N 3.22Å
740	L	90	Very high	84.8	Confident	0 Å²	0	38.1 Å²	38.1	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-62	-42.8	174.2	-69.6	170.3	0	0	0	111.6	L689 L713 L736 L737 L744 I763 L766 L767	L689-L740 HydrophobicContact CD1-CD2 3.78Å; L689-L740 HydrophobicContact CD1-CG 3.92Å; L689-L740 HydrophobicContact CD2-CD2 4.22Å; L713-L740 HydrophobicContact CD2-CD2 3.71Å; L736-L740 HydrophobicContact CD1-CD1 4.2Å; L736-L740 HydrophobicContact CD1-CG 4.22Å; L736-L740 HydrophobicContact CG-CD1 4.11Å; L736-L740 WeakPolarHBondContact O-CG 3.41Å; L736-L740 PolarHBondContact O-N 2.93Å; L737-L740 PolarHBondContact O-N 3.45Å; L740-L744 WeakPolarHBondContact O-CB 3.38Å; L740-L744 PolarHBondContact O-N 2.87Å; L740-I763 HydrophobicContact CB-CG2 4.24Å; L740-I763 HydrophobicContact CD2-CG1 4.15Å; L740-I763 HydrophobicContact CD2-CG2 4.16Å; L740-L766 HydrophobicContact CD1-CD2 3.78Å; L740-L766 HydrophobicContact CD1-CG 4.41Å; L740-L766 HydrophobicContact CD2-CD2 4.06Å; L740-L767 HydrophobicContact CB-CD2 4.44Å; L740-L767 HydrophobicContact CD1-CD2 3.96Å; L740-L767 HydrophobicContact CD1-CG 4.38Å
741	S	88.2	Confident	84.8	Confident	0 Å²	0	38.8 Å²	38.8	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-64.6	-43.6	178.2	-156.4	0	0	0	0	112.5	L737 F738 L744 S745 S809 L810	L737-S741 PolarHBondContact O-N 2.91Å; F738-S741 PolarHBondContact O-N 3.39Å; S741-L744 PolarHBondContact O-N 3.22Å; S741-S745 WeakPolarHBondContact O-CB 3.45Å; S741-S745 PolarHBondContact O-N 2.65Å; S741-S745 PolarHBondContact O-OG 3.36Å; S741-S809 WeakPolarHBondContact OG-CB 3.41Å; S741-S809 PolarHBondContact OG-OG 2.93Å; S741-L810 WeakPolarHBondContact OG-CD2 3.48Å; S741-L810 PolarHBondContact OG-N 3.48Å
742	N	84.1	Confident	84.7	Confident	72 Å²	72	39.2 Å²	39.2	39%	0.385	23%	0.233	S	C	.	.	H	α-helix	trans	-66.8	-44.9	177.6	-68.8	-12.8	0	0	0	111.7	F738 G739 L744 S745 Y746	F738-N742 WeakPolarHBondContact O-CB 3.34Å; F738-N742 PolarHBondContact O-N 2.84Å; F738-N742 PolarHBondContact O-ND2 3.42Å; G739-N742 PolarHBondContact O-N 3.3Å; N742-L744 VanDerWaalsContact C-N 3.34Å; N742-S745 WeakPolarHBondContact O-CB 3.38Å; N742-S745 PolarHBondContact O-N 2.94Å; N742-Y746 WeakPolarHBondContact O-CB 3.39Å; N742-Y746 PolarHBondContact O-N 3.23Å
743	C	84.6	Confident	84.7	Confident	1 Å²	1	39.2 Å²	39.2	1%	0.007	23%	0.228	C	C	.	.	H	α-helix	trans	-63.3	-40.5	176.6	-177.9	0	0	0	0	111.3	L689 G739 Y746 H747 I763	L689-C743 HydrophobicContact CD2-CB 3.49Å; L689-C743 VanDerWaalsContact CD2-CB 3.49Å; G739-C743 WeakPolarHBondContact O-CB 3.43Å; G739-C743 PolarHBondContact O-N 3.22Å; C743-Y746 PolarHBondContact O-N 3.46Å; C743-H747 PolarHBondContact O-CD2 3.48Å; C743-H747 PolarHBondContact O-N 3.29Å; C743-H747 VanDerWaalsContact O-N 3.09Å; C743-H747 PolarHBondContact SG-CD2 3.08Å; C743-I763 HydrophobicContact CB-CD1 4.32Å
744	L	88.5	Confident	84.7	Confident	0 Å²	0	40.7 Å²	40.7	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-59.1	-56.5	172.3	-168.4	65.2	0	0	0	110.2	L740 S741 N742 Y746 H747 V748 I760 I763 L810 I814 I817	L740-L744 WeakPolarHBondContact O-CB 3.38Å; L740-L744 PolarHBondContact O-N 2.87Å; S741-L744 PolarHBondContact O-N 3.22Å; N742-L744 VanDerWaalsContact C-N 3.34Å; L744-Y746 VanDerWaalsContact C-N 3.29Å; L744-Y746 PolarHBondContact O-N 3.2Å; L744-H747 PolarHBondContact O-N 3.31Å; L744-V748 HydrophobicContact CG-CG2 4.48Å; L744-V748 WeakPolarHBondContact O-CG2 3.5Å; L744-V748 PolarHBondContact O-N 3.2Å; L744-I760 HydrophobicContact CD1-CB 4.37Å; L744-I760 HydrophobicContact CD1-CG1 4.24Å; L744-I760 HydrophobicContact CD1-CG2 3.87Å; L744-I763 HydrophobicContact CB-CG2 4.24Å; L744-I763 HydrophobicContact CD1-CB 4.36Å; L744-I763 HydrophobicContact CD1-CG2 4.04Å; L744-I763 HydrophobicContact CD2-CG2 4.49Å; L744-L810 HydrophobicContact CD2-CD2 4.47Å; L744-I814 HydrophobicContact CD2-CG1 4.49Å; L744-I817 HydrophobicContact CD1-CD1 3.86Å; L744-I817 HydrophobicContact CG-CD1 4.27Å
745	S	86.3	Confident	84.6	Confident	53 Å²	53	35.7 Å²	35.7	37%	0.371	23%	0.227	S	C	.	.	H	α-helix	trans	-51.5	-42.3	176.6	-77.3	0	0	0	0	113.4	S741 N742 P749 S813	S741-S745 WeakPolarHBondContact O-CB 3.45Å; S741-S745 PolarHBondContact O-N 2.65Å; S741-S745 PolarHBondContact O-OG 3.36Å; N742-S745 WeakPolarHBondContact O-CB 3.38Å; N742-S745 PolarHBondContact O-N 2.94Å; S745-P749 WeakPolarHBondContact O-CD 3.47Å; S745-S813 PolarHBondContact OG-OG 3.26Å
746	Y	83.1	Confident	84.8	Confident	35 Å²	35	32.5 Å²	32.5	14%	0.137	20%	0.199	C	C	.	.	H	α-helix	trans	-68.8	-31.2	178.3	179	-100.7	0	0	0	113.1	N699 N742 C743 L744 L750	N699-Y746 PolarHBondContact O-OH 3.38Å; N742-Y746 WeakPolarHBondContact O-CB 3.39Å; N742-Y746 PolarHBondContact O-N 3.23Å; C743-Y746 PolarHBondContact O-N 3.46Å; L744-Y746 VanDerWaalsContact C-N 3.29Å; L744-Y746 PolarHBondContact O-N 3.2Å; Y746-L750 HydrophobicContact CE1-CD1 4.39Å
747	H	85.4	Confident	84.8	Confident	2 Å²	2	33.6 Å²	33.6	1%	0.009	21%	0.208	C	C	.	.	H	α-helix	trans	-92.9	-20.5	-178.6	-68.5	-47.8	0	0	0	115.1	C743 L744 P749 L750 H756 L759 I760	C743-H747 PolarHBondContact O-CD2 3.48Å; C743-H747 PolarHBondContact O-N 3.29Å; C743-H747 VanDerWaalsContact O-N 3.09Å; C743-H747 PolarHBondContact SG-CD2 3.08Å; L744-H747 PolarHBondContact O-N 3.31Å; H747-P749 VanDerWaalsContact C-CD 3.45Å; H747-P749 VanDerWaalsContact C-N 3.32Å; H747-L750 CarbonylContact O-C 3.57Å; H747-L750 WeakPolarHBondContact O-CA 3.47Å; H747-L750 WeakPolarHBondContact O-CB 3.46Å; H747-L750 PolarHBondContact O-N 2.95Å; H747-H756 AromaticContact CE1-CE1 3.63Å; H747-H756 AromaticContact CE1-ND1 3.52Å; H747-H756 AromaticContact CG-ND1 3.94Å; H747-H756 AromaticContact ND1-CE1 3.53Å; H747-H756 AromaticContact ND1-ND1 3.18Å; H747-H756 PolarHBondContact ND1-ND1 2.97Å; H747-H756 VanDerWaalsContact ND1-ND1 3.18Å; H747-L759 WeakPolarHBondContact NE2-CD2 3.13Å; H747-I760 HydrophobicContact CB-CD1 3.95Å; H747-I760 HydrophobicContact CB-CG1 3.91Å
748	V	86.9	Confident	84.7	Confident	8 Å²	8	38.7 Å²	38.7	5%	0.048	23%	0.227	C	C	.	.	G	3₁₀ helix	trans	-52.2	-40.5	176.8	-177.6	0	0	0	0	113.6	L744 L750 L751 A816 I817 Q820	L744-V748 HydrophobicContact CG-CG2 4.48Å; L744-V748 WeakPolarHBondContact O-CG2 3.5Å; L744-V748 PolarHBondContact O-N 3.2Å; V748-L750 PolarHBondContact O-N 3.45Å; V748-L751 WeakPolarHBondContact O-CB 3.23Å; V748-A816 HydrophobicContact CG1-CB 3.85Å; V748-A816 WeakPolarHBondContact CG1-O 3.22Å; V748-I817 HydrophobicContact CB-CG1 4.31Å; V748-I817 HydrophobicContact CG1-CG1 3.84Å; V748-I817 HydrophobicContact CG2-CD1 3.92Å; V748-I817 HydrophobicContact CG2-CG1 3.62Å; V748-Q820 VanDerWaalsContact CG1-NE2 3.27Å; V748-Q820 PolarHBondContact O-NE2 3.02Å
749	P	83.9	Confident	84.9	Confident	97 Å²	97	35.2 Å²	35.2	63%	0.63	21%	0.212	S	C	*	.	G	3₁₀ helix	trans	-68.6	-8.9	175.3	-20.9	34.6	0	0	0	114.9	S745 H747	S745-P749 WeakPolarHBondContact O-CD 3.47Å; H747-P749 VanDerWaalsContact C-CD 3.45Å; H747-P749 VanDerWaalsContact C-N 3.32Å
750	L	82.5	Confident	85.2	Confident	34 Å²	34	34.7 Å²	34.7	18%	0.178	21%	0.207	C	C	.	.	G	3₁₀ helix	trans	-112.1	11.7	-173.3	-51.8	-179.9	0	0	0	112.6	Q700 Y746 H747 V748 S752 D753 H756	Q700-L750 HydrophobicContact CG-CD1 4.45Å; Q700-L750 VanDerWaalsContact NE2-CD2 3.27Å; Y746-L750 HydrophobicContact CE1-CD1 4.39Å; H747-L750 CarbonylContact O-C 3.57Å; H747-L750 WeakPolarHBondContact O-CA 3.47Å; H747-L750 WeakPolarHBondContact O-CB 3.46Å; H747-L750 PolarHBondContact O-N 2.95Å; V748-L750 PolarHBondContact O-N 3.45Å; L750-S752 PolarHBondContact O-N 3.17Å; L750-D753 PolarHBondContact O-N 3.24Å; L750-H756 HydrophobicContact CB-CB 4.2Å; L750-H756 WeakPolarHBondContact O-CB 3.37Å
751	L	82	Confident	85.3	Confident	16 Å²	16	35.5 Å²	35.5	8%	0.084	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.2	-14.4	-174.7	-173.3	63.1	0	0	0	114.5	V748 D753 A757 I760 I817 Q820 H823 L827	V748-L751 WeakPolarHBondContact O-CB 3.23Å; L751-D753 VanDerWaalsContact C-N 3.26Å; L751-D753 PolarHBondContact O-N 3.4Å; L751-A757 HydrophobicContact CD1-CB 3.86Å; L751-I760 HydrophobicContact CD1-CD1 3.74Å; L751-I817 HydrophobicContact CD2-CG2 4.37Å; L751-Q820 HydrophobicContact CD2-CB 4.28Å; L751-H823 HydrophobicContact CD2-CB 4.41Å; L751-L827 HydrophobicContact CD1-CD2 3.87Å
752	S	81.1	Confident	85.5	Confident	122 Å²	122	35.5 Å²	35.5	85%	0.853	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70.3	-16.2	173.1	52.5	0	0	0	0	114.3	L750	L750-S752 PolarHBondContact O-N 3.17Å
753	D	81	Confident	85.9	Confident	73 Å²	73	32.1 Å²	32.1	39%	0.39	20%	0.195	S	C	.	.	S	Bend	trans	-92.7	126.1	171.5	-170.9	-56.3	0	0	0	110.5	L750 L751 S755 H756 A757	L750-D753 PolarHBondContact O-N 3.24Å; L751-D753 VanDerWaalsContact C-N 3.26Å; L751-D753 PolarHBondContact O-N 3.4Å; D753-S755 PolarHBondContact O-N 2.92Å; D753-S755 VanDerWaalsContact O-N 3.15Å; D753-S755 WeakPolarHBondContact OD1-CA 3.35Å; D753-S755 VanDerWaalsContact OD1-CB 3.27Å; D753-S755 WeakPolarHBondContact OD1-CB 3.33Å; D753-S755 PolarHBondContact OD1-N 3.39Å; D753-S755 PolarHBondContact OD1-OG 3.44Å; D753-H756 HydrophobicContact CB-CB 4.35Å; D753-H756 PolarHBondContact O-N 2.9Å; D753-H756 VanDerWaalsContact O-N 3.15Å; D753-A757 PolarHBondContact O-N 2.76Å
754	A	83.8	Confident	86.3	Confident	69 Å²	69	32 Å²	32	57%	0.57	20%	0.195	S	C	*	.	H	α-helix	trans	-61.2	-23.9	-178.4	0	0	0	0	0	114.2	R758	A754-R758 WeakPolarHBondContact O-CB 3.41Å; A754-R758 PolarHBondContact O-N 3.16Å; A754-R758 VanDerWaalsContact O-N 3.14Å
755	S	80.4	Confident	86.5	Confident	5 Å²	5	36.1 Å²	36.1	4%	0.035	21%	0.21	C	C	.	.	H	α-helix	trans	-76.9	-40.7	175.5	71.7	0	0	0	0	112.2	S703 D753 R758 L759	S703-S755 WeakPolarHBondContact OG-CB 3.47Å; D753-S755 PolarHBondContact O-N 2.92Å; D753-S755 VanDerWaalsContact O-N 3.15Å; D753-S755 WeakPolarHBondContact OD1-CA 3.35Å; D753-S755 VanDerWaalsContact OD1-CB 3.27Å; D753-S755 WeakPolarHBondContact OD1-CB 3.33Å; D753-S755 PolarHBondContact OD1-N 3.39Å; D753-S755 PolarHBondContact OD1-OG 3.44Å; S755-R758 PolarHBondContact O-N 3.46Å; S755-L759 PolarHBondContact O-N 3.37Å; S755-L759 VanDerWaalsContact O-N 3.09Å
756	H	84.8	Confident	86.9	Confident	9 Å²	9	33.7 Å²	33.7	4%	0.042	19%	0.193	C	C	.	.	H	α-helix	trans	-67.8	-41.4	171.7	-70.9	-51.9	0	0	0	111.2	H747 L750 D753 R758 L759 I760	H747-H756 AromaticContact CE1-CE1 3.63Å; H747-H756 AromaticContact CE1-ND1 3.52Å; H747-H756 AromaticContact CG-ND1 3.94Å; H747-H756 AromaticContact ND1-CE1 3.53Å; H747-H756 AromaticContact ND1-ND1 3.18Å; H747-H756 PolarHBondContact ND1-ND1 2.97Å; H747-H756 VanDerWaalsContact ND1-ND1 3.18Å; L750-H756 HydrophobicContact CB-CB 4.2Å; L750-H756 WeakPolarHBondContact O-CB 3.37Å; D753-H756 HydrophobicContact CB-CB 4.35Å; D753-H756 PolarHBondContact O-N 2.9Å; D753-H756 VanDerWaalsContact O-N 3.15Å; H756-R758 VanDerWaalsContact C-N 3.31Å; H756-R758 PolarHBondContact O-N 3.01Å; H756-L759 PolarHBondContact O-N 3.21Å; H756-I760 WeakPolarHBondContact O-CB 3.5Å; H756-I760 VanDerWaalsContact O-CG1 3.28Å; H756-I760 WeakPolarHBondContact O-CG1 3.43Å; H756-I760 PolarHBondContact O-N 3.37Å
757	A	86.4	Confident	87.3	Confident	23 Å²	23	32 Å²	32	19%	0.19	19%	0.187	C	C	.	.	H	α-helix	trans	-59.4	-39.2	174.9	0	0	0	0	0	112.9	L751 D753 A761	L751-A757 HydrophobicContact CD1-CB 3.86Å; D753-A757 PolarHBondContact O-N 2.76Å; A757-A761 WeakPolarHBondContact O-CB 3.2Å; A757-A761 PolarHBondContact O-N 2.8Å
758	R	87.1	Confident	87.5	Confident	109 Å²	109	33.2 Å²	33.2	41%	0.411	19%	0.192	S	C	.	.	H	α-helix	trans	-67.9	-42.6	174.6	-172.1	179	-62.7	106.5	15.4	112.4	A710 A754 S755 H756 I760 A761 S762	A710-R758 HydrophobicContact CB-CG 4.37Å; A754-R758 WeakPolarHBondContact O-CB 3.41Å; A754-R758 PolarHBondContact O-N 3.16Å; A754-R758 VanDerWaalsContact O-N 3.14Å; S755-R758 PolarHBondContact O-N 3.46Å; H756-R758 VanDerWaalsContact C-N 3.31Å; H756-R758 PolarHBondContact O-N 3.01Å; R758-I760 VanDerWaalsContact C-N 3.35Å; R758-I760 PolarHBondContact O-N 3.46Å; R758-A761 WeakPolarHBondContact O-CB 3.3Å; R758-A761 PolarHBondContact O-N 3.24Å; R758-S762 PolarHBondContact O-N 3.2Å; R758-S762 PolarHBondContact O-OG 2.93Å
759	L	89.1	Confident	87.6	Confident	1 Å²	1	35.1 Å²	35.1	1%	0.005	20%	0.202	C	C	.	.	H	α-helix	trans	-60.7	-44.4	175.7	177.1	57.5	0	0	0	111.4	C706 L709 A710 L713 H747 S755 H756 A761 S762 I763	C706-L759 HydrophobicContact CB-CD2 4.43Å; L709-L759 HydrophobicContact CB-CD1 4.08Å; L709-L759 HydrophobicContact CD2-CD1 3.89Å; L709-L759 HydrophobicContact CD2-CD2 4.28Å; L709-L759 HydrophobicContact CG-CD1 3.8Å; A710-L759 HydrophobicContact CB-CD1 4.45Å; L713-L759 HydrophobicContact CD1-CD1 3.66Å; H747-L759 WeakPolarHBondContact NE2-CD2 3.13Å; S755-L759 PolarHBondContact O-N 3.37Å; S755-L759 VanDerWaalsContact O-N 3.09Å; H756-L759 PolarHBondContact O-N 3.21Å; L759-A761 VanDerWaalsContact C-N 3.35Å; L759-A761 PolarHBondContact O-N 3.23Å; L759-S762 WeakPolarHBondContact O-CB 3.37Å; L759-S762 PolarHBondContact O-N 3.45Å; L759-I763 HydrophobicContact CD1-CD1 4.25Å; L759-I763 HydrophobicContact CD1-CG1 4.4Å; L759-I763 HydrophobicContact CG-CD1 4.12Å; L759-I763 WeakPolarHBondContact O-CG1 3.14Å; L759-I763 PolarHBondContact O-N 3.23Å
760	I	90.7	Very high	87.8	Confident	0 Å²	0	30.5 Å²	30.5	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-57.6	-46.4	172.3	-69.7	165.9	0	0	0	110.7	L744 H747 L751 H756 R758 S762 I763 C764 I817 L827	L744-I760 HydrophobicContact CD1-CB 4.37Å; L744-I760 HydrophobicContact CD1-CG1 4.24Å; L744-I760 HydrophobicContact CD1-CG2 3.87Å; H747-I760 HydrophobicContact CB-CD1 3.95Å; H747-I760 HydrophobicContact CB-CG1 3.91Å; L751-I760 HydrophobicContact CD1-CD1 3.74Å; H756-I760 WeakPolarHBondContact O-CB 3.5Å; H756-I760 VanDerWaalsContact O-CG1 3.28Å; H756-I760 WeakPolarHBondContact O-CG1 3.43Å; H756-I760 PolarHBondContact O-N 3.37Å; R758-I760 VanDerWaalsContact C-N 3.35Å; R758-I760 PolarHBondContact O-N 3.46Å; I760-S762 VanDerWaalsContact C-N 3.31Å; I760-S762 PolarHBondContact O-N 3.11Å; I760-I763 PolarHBondContact O-N 2.65Å; I760-C764 PolarHBondContact O-N 3.01Å; I760-C764 PolarHBondContact O-SG 3.36Å; I760-C764 VanDerWaalsContact O-SG 3.38Å; I760-I817 HydrophobicContact CG2-CD1 3.71Å; I760-I817 HydrophobicContact CG2-CG1 4.48Å; I760-L827 HydrophobicContact CG2-CD1 4.04Å; I760-L827 HydrophobicContact CG2-CD2 4.35Å
761	A	91.1	Very high	88	Confident	17 Å²	17	29.2 Å²	29.2	14%	0.14	17%	0.165	C	C	.	.	H	α-helix	trans	-61.6	-35.2	176.7	0	0	0	0	0	113.2	A757 R758 L759 R765 L827	A757-A761 WeakPolarHBondContact O-CB 3.2Å; A757-A761 PolarHBondContact O-N 2.8Å; R758-A761 WeakPolarHBondContact O-CB 3.3Å; R758-A761 PolarHBondContact O-N 3.24Å; L759-A761 VanDerWaalsContact C-N 3.35Å; L759-A761 PolarHBondContact O-N 3.23Å; A761-R765 WeakPolarHBondContact O-CB 3.32Å; A761-R765 VanDerWaalsContact O-CG 3.25Å; A761-R765 WeakPolarHBondContact O-CG 3.44Å; A761-R765 PolarHBondContact O-N 3.26Å; A761-R765 PolarHBondContact O-NE 2.99Å; A761-L827 HydrophobicContact CB-CD1 3.92Å
762	S	92.2	Very high	87.9	Confident	0 Å²	0	30.9 Å²	30.9	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-68.3	-45.9	172.4	-72.1	0	0	0	0	112.7	A710 D714 R758 L759 I760 C764 R765 L766	A710-S762 WeakPolarHBondContact CB-OG 3.32Å; A710-S762 PolarHBondContact O-OG 3.32Å; D714-S762 VanDerWaalsContact CG-OG 3.31Å; D714-S762 WeakPolarHBondContact OD1-CA 3.44Å; D714-S762 WeakPolarHBondContact OD1-CB 3.5Å; D714-S762 PolarHBondContact OD1-OG 3Å; R758-S762 PolarHBondContact O-N 3.2Å; R758-S762 PolarHBondContact O-OG 2.93Å; L759-S762 WeakPolarHBondContact O-CB 3.37Å; L759-S762 PolarHBondContact O-N 3.45Å; I760-S762 VanDerWaalsContact C-N 3.31Å; I760-S762 PolarHBondContact O-N 3.11Å; S762-C764 PolarHBondContact O-N 2.88Å; S762-R765 PolarHBondContact O-N 3.3Å; S762-R765 PolarHBondContact OG-NH2 3.37Å; S762-L766 WeakPolarHBondContact O-CB 3.23Å; S762-L766 PolarHBondContact O-N 2.91Å
763	I	93.8	Very high	87.3	Confident	0 Å²	0	25.5 Å²	25.5	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-58.7	-47.7	176.2	-66.6	165.4	0	0	0	110.3	L713 L740 C743 L744 L759 I760 R765 L766 L767	L713-I763 HydrophobicContact CD1-CG1 3.71Å; L740-I763 HydrophobicContact CB-CG2 4.24Å; L740-I763 HydrophobicContact CD2-CG1 4.15Å; L740-I763 HydrophobicContact CD2-CG2 4.16Å; C743-I763 HydrophobicContact CB-CD1 4.32Å; L744-I763 HydrophobicContact CB-CG2 4.24Å; L744-I763 HydrophobicContact CD1-CB 4.36Å; L744-I763 HydrophobicContact CD1-CG2 4.04Å; L744-I763 HydrophobicContact CD2-CG2 4.49Å; L759-I763 HydrophobicContact CD1-CD1 4.25Å; L759-I763 HydrophobicContact CD1-CG1 4.4Å; L759-I763 HydrophobicContact CG-CD1 4.12Å; L759-I763 WeakPolarHBondContact O-CG1 3.14Å; L759-I763 PolarHBondContact O-N 3.23Å; I760-I763 PolarHBondContact O-N 2.65Å; I763-R765 PolarHBondContact O-N 2.93Å; I763-L766 PolarHBondContact O-N 3.44Å; I763-L767 HydrophobicContact CG2-CD1 3.78Å; I763-L767 HydrophobicContact CG2-CG 4.42Å; I763-L767 WeakPolarHBondContact O-CB 3.48Å; I763-L767 VanDerWaalsContact O-CG 3.3Å; I763-L767 WeakPolarHBondContact O-CG 3.45Å; I763-L767 PolarHBondContact O-N 2.86Å
764	C	93	Very high	86	Confident	0 Å²	0	23.8 Å²	23.8	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-68	-34.3	179.7	-64.1	0	0	0	0	113	I760 S762 H768 V830 V831 L834	I760-C764 PolarHBondContact O-N 3.01Å; I760-C764 PolarHBondContact O-SG 3.36Å; I760-C764 VanDerWaalsContact O-SG 3.38Å; S762-C764 PolarHBondContact O-N 2.88Å; C764-H768 WeakPolarHBondContact O-CB 3.19Å; C764-H768 PolarHBondContact O-N 3.24Å; C764-V830 HydrophobicContact CB-CG1 3.66Å; C764-V831 HydrophobicContact CB-CG2 4.2Å; C764-L834 HydrophobicContact CB-CD2 4.04Å
765	R	92.2	Very high	84.2	Confident	86 Å²	86	24.1 Å²	24.1	33%	0.325	13%	0.128	S	C	.	.	H	α-helix	trans	-66.9	-44.6	172.6	-79.3	177	-68.6	147.5	3.5	112	D714 A761 S762 I763 H768 N769 V830	D714-R765 VanDerWaalsContact CG-NH1 3.31Å; D714-R765 VanDerWaalsContact CG-NH2 3.27Å; D714-R765 IonicContact OD1-CZ 3.79Å; D714-R765 VanDerWaalsContact OD1-CZ 3.23Å; D714-R765 IonicContact OD1-NH1 3.12Å; D714-R765 PolarHBondContact OD1-NH1 3.49Å; D714-R765 IonicContact OD1-NH2 3.23Å; D714-R765 PolarHBondContact OD1-NH2 3.03Å; D714-R765 IonicContact OD2-CZ 2.7Å; D714-R765 IonicContact OD2-NH1 3.57Å; D714-R765 PolarHBondContact OD2-NH1 2.85Å; D714-R765 IonicContact OD2-NH2 3.97Å; D714-R765 PolarHBondContact OD2-NH2 3.29Å; A761-R765 WeakPolarHBondContact O-CB 3.32Å; A761-R765 VanDerWaalsContact O-CG 3.25Å; A761-R765 WeakPolarHBondContact O-CG 3.44Å; A761-R765 PolarHBondContact O-N 3.26Å; A761-R765 PolarHBondContact O-NE 2.99Å; S762-R765 PolarHBondContact O-N 3.3Å; S762-R765 PolarHBondContact OG-NH2 3.37Å; I763-R765 PolarHBondContact O-N 2.93Å; R765-H768 PolarHBondContact O-N 3.22Å; R765-N769 WeakPolarHBondContact O-CB 3.15Å; R765-N769 VanDerWaalsContact O-CG 3.23Å; R765-N769 PolarHBondContact O-N 2.78Å; R765-N769 PolarHBondContact O-OD1 3.43Å; R765-V830 HydrophobicContact CB-CG1 4.44Å; R765-V830 HydrophobicContact CG-CB 4.4Å; R765-V830 HydrophobicContact CG-CG1 3.71Å; R765-V830 HydrophobicContact CG-CG2 3.74Å
766	L	93.6	Very high	82.2	Confident	1 Å²	1	27.7 Å²	27.7	1%	0.005	15%	0.146	C	C	.	.	H	α-helix	trans	-60.1	-50.2	175.6	173.6	61.9	0	0	0	111.2	L713 L716 L740 S762 I763 H768 N769 I770	L713-L766 HydrophobicContact CD2-CD2 3.51Å; L716-L766 HydrophobicContact CB-CD1 4.33Å; L716-L766 HydrophobicContact CD2-CD1 4.08Å; L716-L766 HydrophobicContact CD2-CD2 3.87Å; L716-L766 HydrophobicContact CG-CD1 3.89Å; L716-L766 HydrophobicContact CG-CD2 4.5Å; L740-L766 HydrophobicContact CD1-CD2 3.78Å; L740-L766 HydrophobicContact CD1-CG 4.41Å; L740-L766 HydrophobicContact CD2-CD2 4.06Å; S762-L766 WeakPolarHBondContact O-CB 3.23Å; S762-L766 PolarHBondContact O-N 2.91Å; I763-L766 PolarHBondContact O-N 3.44Å; L766-H768 PolarHBondContact O-N 2.86Å; L766-N769 PolarHBondContact O-N 2.85Å; L766-N769 VanDerWaalsContact O-N 3.15Å; L766-I770 HydrophobicContact CD1-CD1 3.83Å; L766-I770 HydrophobicContact CD1-CG1 4.18Å; L766-I770 HydrophobicContact CG-CD1 3.78Å; L766-I770 WeakPolarHBondContact O-CG1 3.45Å; L766-I770 PolarHBondContact O-N 3.19Å
767	L	91.8	Very high	79.7	Confident	0 Å²	0	32.2 Å²	32.2	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-60	-44.2	176.7	-70.5	168.5	0	0	0	111.6	L737 L740 I763 N769 I770 Y771 L810 L834	L737-L767 HydrophobicContact CD2-CD2 4.26Å; L740-L767 HydrophobicContact CB-CD2 4.44Å; L740-L767 HydrophobicContact CD1-CD2 3.96Å; L740-L767 HydrophobicContact CD1-CG 4.38Å; I763-L767 HydrophobicContact CG2-CD1 3.78Å; I763-L767 HydrophobicContact CG2-CG 4.42Å; I763-L767 WeakPolarHBondContact O-CB 3.48Å; I763-L767 VanDerWaalsContact O-CG 3.3Å; I763-L767 WeakPolarHBondContact O-CG 3.45Å; I763-L767 PolarHBondContact O-N 2.86Å; L767-N769 PolarHBondContact O-N 2.77Å; L767-I770 PolarHBondContact O-N 2.85Å; L767-Y771 HydrophobicContact CD2-CE2 4.35Å; L767-Y771 VanDerWaalsContact O-CD2 3.24Å; L767-Y771 WeakPolarHBondContact O-CD2 3.42Å; L767-Y771 PolarHBondContact O-N 3.07Å; L767-L810 HydrophobicContact CD1-CD2 3.66Å; L767-L810 HydrophobicContact CD2-CD1 4.36Å; L767-L810 HydrophobicContact CD2-CD2 4.45Å; L767-L834 HydrophobicContact CB-CD1 3.94Å; L767-L834 HydrophobicContact CB-CD2 3.85Å; L767-L834 HydrophobicContact CD1-CD2 4.2Å
768	H	89.7	Confident	76.9	Confident	28 Å²	28	35.9 Å²	35.9	13%	0.13	19%	0.191	C	C	.	.	H	α-helix	trans	-56.5	-40.1	175.6	170	-85.3	0	0	0	112	C764 R765 L766 V772 L834 R837	C764-H768 WeakPolarHBondContact O-CB 3.19Å; C764-H768 PolarHBondContact O-N 3.24Å; R765-H768 PolarHBondContact O-N 3.22Å; L766-H768 PolarHBondContact O-N 2.86Å; H768-V772 WeakPolarHBondContact O-CG2 3.35Å; H768-L834 HydrophobicContact CB-CB 4.46Å; H768-L834 HydrophobicContact CB-CD1 4.44Å; H768-R837 PolarHBondContact CD2-NE 3.41Å; H768-R837 PolarHBondContact CE1-NH2 2.76Å; H768-R837 PolarHBondContact NE2-NE 3.41Å; H768-R837 PolarHBondContact NE2-NH2 2.89Å
769	N	89.4	Confident	74.1	Confident	48 Å²	48	36.3 Å²	36.3	26%	0.257	20%	0.201	S	C	.	.	H	α-helix	trans	-76.7	-31.2	-179.9	-67.9	6.3	0	0	0	113.1	G717 C720 Q726 R765 L766 L767 V772	G717-N769 PolarHBondContact O-ND2 3.49Å; C720-N769 HydrophobicContact CB-CB 3.9Å; Q726-N769 PolarHBondContact NE2-O 3.44Å; R765-N769 WeakPolarHBondContact O-CB 3.15Å; R765-N769 VanDerWaalsContact O-CG 3.23Å; R765-N769 PolarHBondContact O-N 2.78Å; R765-N769 PolarHBondContact O-OD1 3.43Å; L766-N769 PolarHBondContact O-N 2.85Å; L766-N769 VanDerWaalsContact O-N 3.15Å; L767-N769 PolarHBondContact O-N 2.77Å; N769-V772 WeakPolarHBondContact O-CG2 3.38Å
770	I	88.8	Confident	71.2	Confident	0 Å²	0	38.6 Å²	38.6	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-66.6	-40.4	171.3	-68.1	161.7	0	0	0	110.6	I729 L730 L737 L766 L767 V772	I729-I770 HydrophobicContact CD1-CD1 4.42Å; I729-I770 HydrophobicContact CD1-CG1 4.26Å; I729-I770 HydrophobicContact CG2-CD1 3.99Å; I729-I770 HydrophobicContact CG2-CG1 4.29Å; I729-I770 HydrophobicContact CG2-CG2 4.07Å; L730-I770 HydrophobicContact CD1-CG2 4.3Å; L730-I770 HydrophobicContact CD2-CG2 3.75Å; L730-I770 HydrophobicContact CG-CG2 3.8Å; L737-I770 HydrophobicContact CD2-CD1 4.13Å; L737-I770 HydrophobicContact CD2-CG2 4.49Å; L766-I770 HydrophobicContact CD1-CD1 3.83Å; L766-I770 HydrophobicContact CD1-CG1 4.18Å; L766-I770 HydrophobicContact CG-CD1 3.78Å; L766-I770 WeakPolarHBondContact O-CG1 3.45Å; L766-I770 PolarHBondContact O-N 3.19Å; L767-I770 PolarHBondContact O-N 2.85Å; I770-V772 VanDerWaalsContact C-N 3.26Å; I770-V772 PolarHBondContact O-N 3.27Å
771	Y	85.7	Confident	68.2	Low	6 Å²	6	43.9 Å²	43.9	2%	0.024	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.5	32.8	180	-69.9	-70.2	0	0	0	114	L730 L767 Q774 T802 L810 L834 R837 L838 L841	L730-Y771 HydrophobicContact CD2-CD1 4.2Å; L730-Y771 HydrophobicContact CD2-CE1 3.49Å; L730-Y771 VanDerWaalsContact CD2-CE1 3.49Å; L767-Y771 HydrophobicContact CD2-CE2 4.35Å; L767-Y771 VanDerWaalsContact O-CD2 3.24Å; L767-Y771 WeakPolarHBondContact O-CD2 3.42Å; L767-Y771 PolarHBondContact O-N 3.07Å; Y771-Q774 HydrophobicContact CD1-CG 4.45Å; Y771-T802 HydrophobicContact CE1-CG2 3.67Å; Y771-T802 WeakPolarHBondContact OH-CG2 3.46Å; Y771-L810 HydrophobicContact CE2-CD1 4.45Å; Y771-L834 HydrophobicContact CD2-CD1 4.49Å; Y771-R837 WeakPolarHBondContact O-CD 3.47Å; Y771-R837 PolarHBondContact O-NH1 3.36Å; Y771-L838 HydrophobicContact CD1-CD2 4.24Å; Y771-L838 HydrophobicContact CD2-CD2 3.76Å; Y771-L838 HydrophobicContact CE1-CD2 4.19Å; Y771-L838 HydrophobicContact CE2-CD2 3.71Å; Y771-L838 HydrophobicContact CG-CD2 4.05Å; Y771-L841 HydrophobicContact CD1-CD1 4.09Å; Y771-L841 HydrophobicContact CE1-CD1 4.07Å
772	V	81.3	Confident	65	Low	52 Å²	52	50.7 Å²	50.7	32%	0.315	29%	0.291	S	S	.	.	S	Bend	trans	-84.8	136.2	171.2	-179.8	0	0	0	0	111	Q726 H768 N769 I770 Q774	Q726-V772 PolarHBondContact OE1-O 3.42Å; H768-V772 WeakPolarHBondContact O-CG2 3.35Å; N769-V772 WeakPolarHBondContact O-CG2 3.38Å; I770-V772 VanDerWaalsContact C-N 3.26Å; I770-V772 PolarHBondContact O-N 3.27Å; V772-Q774 VanDerWaalsContact C-N 3.28Å; V772-Q774 PolarHBondContact O-N 2.79Å
773	G	66.4	Low	61.8	Low	9 Å²	9	57.5 Å²	57.5	9%	0.093	33%	0.327	C	S	.	.	S	Bend	trans	67.4	18.7	171.5	0	0	0	0	0	116	R723	R723-G773 PolarHBondContact NH2-O 3.4Å
774	Q	54.6	Low	58.6	Low	36 Å²	36	64.3 Å²	64.3	17%	0.168	36%	0.364	C	S	.	.	S	Bend	trans	-78.9	-35.9	171.3	-65.8	-62.7	-35.8	0	0	111.8	L730 Y771 V772 D776	L730-Q774 HydrophobicContact CD1-CG 4.32Å; L730-Q774 VanDerWaalsContact CD1-NE2 3.25Å; Y771-Q774 HydrophobicContact CD1-CG 4.45Å; V772-Q774 VanDerWaalsContact C-N 3.28Å; V772-Q774 PolarHBondContact O-N 2.79Å; Q774-D776 VanDerWaalsContact C-N 3.28Å; Q774-D776 PolarHBondContact O-N 3.03Å
775	S	46.8	Very low	55.2	Low	77 Å²	77	69.9 Å²	69.9	54%	0.538	40%	0.403	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.8	-3	-177.7	58.6	0	0	0	0	115.3
776	D	38.4	Very low	51.9	Low	79 Å²	79	74.1 Å²	74.1	42%	0.422	42%	0.424	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.3	0.3	178	-66.9	-69.1	0	0	0	112.8	Q774 R1025	Q774-D776 VanDerWaalsContact C-N 3.28Å; Q774-D776 PolarHBondContact O-N 3.03Å; D776-R1025 IonicContact OD1-CZ 2.89Å; D776-R1025 VanDerWaalsContact OD1-CZ 3.26Å; D776-R1025 IonicContact OD1-NH1 2.78Å; D776-R1025 PolarHBondContact OD1-NH1 3.11Å; D776-R1025 IonicContact OD1-NH2 2.73Å; D776-R1025 PolarHBondContact OD1-NH2 2.71Å
777	Q	32.2	Very low	48.6	Very low	105 Å²	105	82 Å²	82	49%	0.491	47%	0.466	S	S	.	.	S	Bend	trans	-101	117.9	163.1	-68.7	-170.6	-66.1	0	0	108	I779 T798	Q777-I779 PolarHBondContact O-N 3.22Å; Q777-T798 HydrophobicContact CB-CG2 4.19Å
778	S	27.9	Very low	45.5	Very low	99 Å²	99	89 Å²	89	69%	0.692	50%	0.503	S	S	*	.			trans	-46.2	123	-166.8	50.1	0	0	0	0	114	G780	S778-G780 PolarHBondContact O-N 3.43Å
779	I	28.3	Very low	42.7	Very low	118 Å²	118	92.8 Å²	92.8	61%	0.605	53%	0.53	S	S	*	.			trans	-71.4	83.6	158.2	-58	177.2	0	0	0	106.6	Q777 T781 P840	Q777-I779 PolarHBondContact O-N 3.22Å; I779-T781 PolarHBondContact O-N 3.22Å; I779-P840 HydrophobicContact CD1-CB 4.19Å
780	G	27.7	Very low	39.7	Very low	50 Å²	50	98.4 Å²	98.4	52%	0.515	56%	0.56	S	S	.	*			trans	-58.7	120.2	165.6	0	0	0	0	0	108.2	S778 N782	S778-G780 PolarHBondContact O-N 3.43Å; G780-N782 PolarHBondContact O-N 3.48Å
781	T	27.2	Very low	36.7	Very low	110 Å²	110	104.4 Å²	104.4	68%	0.675	60%	0.597	S	S	*	*			trans	-69.6	100.2	179.4	46.9	0	0	0	0	109	I779 N783	I779-T781 PolarHBondContact O-N 3.22Å; T781-N783 PolarHBondContact O-N 2.94Å
782	N	24.1	Very low	34	Very low	161 Å²	161	109.1 Å²	109.1	86%	0.861	63%	0.631	S	S	*	*			trans	-68.4	38.2	178.5	-89.1	5.4	0	0	0	114.1	G780	G780-N782 PolarHBondContact O-N 3.48Å
783	N	25.1	Very low	31.4	Very low	142 Å²	142	113.7 Å²	113.7	76%	0.759	65%	0.653	S	S	*	*			trans	-99.6	70.9	170.4	-73.3	11	0	0	0	109.2	T781	T781-N783 PolarHBondContact O-N 2.94Å
784	N	25.8	Very low	29.5	Very low	143 Å²	143	120.5 Å²	120.5	77%	0.765	69%	0.688	S	S	*	*			trans	179.9	115.8	144.2	-91.2	-16.4	0	0	0	109.6	F786	N784-F786 PolarHBondContact O-N 3.41Å
785	S	22.4	Very low	28.2	Very low	118 Å²	118	125.6 Å²	125.6	83%	0.825	72%	0.716	S	S	*	*			trans	-84	89.8	178.1	55.2	0	0	0	0	111
786	F	23.6	Very low	27.2	Very low	175 Å²	175	126.8 Å²	126.8	77%	0.768	72%	0.723	S	S	*	*			trans	-110.8	114.1	167.1	-89.2	-83.7	0	0	0	110.9	N784 L788	N784-F786 PolarHBondContact O-N 3.41Å; F786-L788 HydrophobicContact CB-CD1 4.48Å; F786-L788 PolarHBondContact O-N 3.32Å
787	N	24.4	Very low	26.9	Very low	165 Å²	165	126 Å²	126	88%	0.882	72%	0.724	S	S	*	*			trans	-76.2	104	174.7	-65.6	-24.5	0	0	0	109.3
788	L	24.7	Very low	27.1	Very low	148 Å²	148	124 Å²	124	78%	0.775	72%	0.719	S	S	*	*			trans	-100	143.2	156.8	-83.9	83.9	0	0	0	109.3	F786	F786-L788 HydrophobicContact CB-CD1 4.48Å; F786-L788 PolarHBondContact O-N 3.32Å
789	P	32.6	Very low	27.6	Very low	108 Å²	108	122.8 Å²	122.8	70%	0.701	71%	0.71	S	S	*	*			trans	-80.6	136.5	-169.4	31.4	-35.2	0	0	0	113.5	T791	P789-T791 PolarHBondContact O-N 2.94Å
790	D	25.6	Very low	28.2	Very low	165 Å²	165	121.6 Å²	121.6	88%	0.882	71%	0.712	S	S	*	*			trans	36.7	65.3	146.4	-58.7	-19.7	0	0	0	117.9
791	T	25.8	Very low	29.3	Very low	127 Å²	127	120.9 Å²	120.9	78%	0.779	70%	0.696	S	S	*	*			trans	-109.8	114.9	147.9	38.9	0	0	0	0	109.1	P789	P789-T791 PolarHBondContact O-N 2.94Å
792	S	28.5	Very low	30.8	Very low	105 Å²	105	116.9 Å²	116.9	73%	0.734	67%	0.671	S	S	*	*			trans	-70.9	159.9	178.8	42.6	0	0	0	0	112
793	N	27.2	Very low	33.1	Very low	147 Å²	147	111.8 Å²	111.8	79%	0.786	65%	0.648	S	S	*	*			trans	83	30.9	177.5	-44.9	-28.1	0	0	0	117.3	D795	N793-D795 PolarHBondContact O-N 3.45Å
794	N	26.9	Very low	35.7	Very low	153 Å²	153	108.3 Å²	108.3	82%	0.818	64%	0.635	S	S	*	*			trans	-83.4	95	158.7	-108.9	-23.1	0	0	0	110.2	C796	N794-C796 VanDerWaalsContact C-N 3.34Å; N794-C796 PolarHBondContact O-N 3.05Å
795	D	26.3	Very low	38.5	Very low	142 Å²	142	109.2 Å²	109.2	76%	0.759	63%	0.632	S	S	*	*			trans	-68.1	79.7	-178.3	-85.8	-41.1	0	0	0	112.9	N793 S797	N793-D795 PolarHBondContact O-N 3.45Å; D795-S797 PolarHBondContact O-N 2.95Å; D795-S797 PolarHBondContact O-OG 3Å; D795-S797 VanDerWaalsContact O-OG 3.05Å
796	C	26.3	Very low	41.5	Very low	102 Å²	102	103.8 Å²	103.8	69%	0.689	59%	0.594	S	S	*	*			trans	-69.4	65.9	171.7	-167	0	0	0	0	111.3	N794	N794-C796 VanDerWaalsContact C-N 3.34Å; N794-C796 PolarHBondContact O-N 3.05Å
797	S	32.3	Very low	44.6	Very low	62 Å²	62	95.4 Å²	95.4	43%	0.434	56%	0.557	S	S	.	*			trans	-101.7	-21.4	-161.1	53.7	0	0	0	0	114.1	D795 L801	D795-S797 PolarHBondContact O-N 2.95Å; D795-S797 PolarHBondContact O-OG 3Å; D795-S797 VanDerWaalsContact O-OG 3.05Å; S797-L801 WeakPolarHBondContact O-CG 3.18Å
798	T	35.6	Very low	47.6	Very low	63 Å²	63	88.7 Å²	88.7	39%	0.387	52%	0.521	S	S	.	.	S	Bend	trans	-75.8	-42.8	-177	46.1	0	0	0	0	113.3	Q777 C800 L801	Q777-T798 HydrophobicContact CB-CG2 4.19Å; T798-C800 PolarHBondContact O-N 3.09Å; T798-L801 PolarHBondContact O-N 3.26Å
799	S	38.3	Very low	50.7	Low	74 Å²	74	83 Å²	83	52%	0.517	49%	0.494	S	S	.	.	G	3₁₀ helix	trans	-61.3	-26.5	179.9	58.2	0	0	0	0	113.5
800	C	42.6	Very low	53.5	Low	94 Å²	94	77.9 Å²	77.9	64%	0.635	46%	0.461	S	S	*	.	G	3₁₀ helix	trans	-80.5	-14.3	-178.1	-163.4	0	0	0	0	113.9	T798 T802	T798-C800 PolarHBondContact O-N 3.09Å; C800-T802 PolarHBondContact O-N 3.43Å
801	L	50.7	Low	56.6	Low	34 Å²	34	70 Å²	70	18%	0.178	42%	0.419	C	S	.	.	G	3₁₀ helix	trans	-74.9	-17.4	-170.5	-64.8	175.9	0	0	0	114.8	Q731 S797 T798	Q731-L801 HydrophobicContact CG-CD2 3.62Å; S797-L801 WeakPolarHBondContact O-CG 3.18Å; T798-L801 PolarHBondContact O-N 3.26Å
802	T	58.6	Low	59.7	Low	26 Å²	26	68.2 Å²	68.2	16%	0.16	40%	0.404	C	S	.	.	S	Bend	trans	-136.5	127.2	177.5	51.4	0	0	0	0	112.1	L730 Y771 C800 S804 V807	L730-T802 HydrophobicContact CD2-CG2 4.41Å; Y771-T802 HydrophobicContact CE1-CG2 3.67Å; Y771-T802 WeakPolarHBondContact OH-CG2 3.46Å; C800-T802 PolarHBondContact O-N 3.43Å; T802-S804 PolarHBondContact O-N 2.89Å; T802-V807 HydrophobicContact CG2-CG2 4.37Å
803	S	72.6	Confident	62.6	Low	54 Å²	54	63.4 Å²	63.4	38%	0.378	37%	0.371	S	S	.	.			trans	-63.8	130	168	-176.6	0	0	0	0	109.8	K805 L806 V807	S803-K805 PolarHBondContact O-N 3.35Å; S803-L806 WeakPolarHBondContact O-CA 3.2Å; S803-L806 WeakPolarHBondContact O-CB 3.43Å; S803-L806 PolarHBondContact O-N 3.07Å; S803-V807 PolarHBondContact O-N 2.89Å; S803-V807 VanDerWaalsContact O-N 3.17Å
804	S	78.4	Confident	65.7	Low	70 Å²	70	56.4 Å²	56.4	49%	0.49	33%	0.333	S	S	.	.	H	α-helix	trans	-52	-43.4	174.2	52.7	0	0	0	0	111.6	T802 L806 V807 N808	T802-S804 PolarHBondContact O-N 2.89Å; S804-L806 PolarHBondContact O-N 2.94Å; S804-L806 VanDerWaalsContact O-N 3.14Å; S804-V807 PolarHBondContact O-N 3.3Å; S804-V807 VanDerWaalsContact O-N 3.13Å; S804-N808 WeakPolarHBondContact O-CB 3.49Å; S804-N808 PolarHBondContact O-N 3.06Å; S804-N808 PolarHBondContact O-OD1 3.03Å
805	K	84.1	Confident	68.7	Low	161 Å²	161	49.1 Å²	49.1	70%	0.7	29%	0.294	S	S	*	.	H	α-helix	trans	-55	-33.9	175.7	-61.5	-173.5	-177.5	-176	0	113.7	S803 S809	S803-K805 PolarHBondContact O-N 3.35Å; K805-S809 VanDerWaalsContact O-CB 3.29Å; K805-S809 WeakPolarHBondContact O-CB 3.29Å; K805-S809 PolarHBondContact O-N 3.48Å; K805-S809 VanDerWaalsContact O-N 3.08Å
806	L	86.2	Confident	71.7	Confident	4 Å²	4	44.4 Å²	44.4	2%	0.021	28%	0.275	C	S	.	.	H	α-helix	trans	-73.7	-50.3	175.9	173.4	67.2	0	0	0	111.2	L737 F738 S803 S804 N808 S809 L810	L737-L806 HydrophobicContact CB-CD1 4.04Å; L737-L806 HydrophobicContact CB-CD2 3.61Å; L737-L806 HydrophobicContact CB-CG 4.47Å; L737-L806 HydrophobicContact CD1-CD2 3.89Å; L737-L806 HydrophobicContact CG-CD2 4.37Å; F738-L806 HydrophobicContact CD1-CB 4.47Å; F738-L806 HydrophobicContact CD1-CD1 3.94Å; F738-L806 HydrophobicContact CE1-CB 3.82Å; F738-L806 HydrophobicContact CE1-CD1 4.15Å; F738-L806 HydrophobicContact CE2-CB 4.37Å; F738-L806 HydrophobicContact CG-CD1 4.2Å; F738-L806 HydrophobicContact CZ-CB 3.77Å; S803-L806 WeakPolarHBondContact O-CA 3.2Å; S803-L806 WeakPolarHBondContact O-CB 3.43Å; S803-L806 PolarHBondContact O-N 3.07Å; S804-L806 PolarHBondContact O-N 2.94Å; S804-L806 VanDerWaalsContact O-N 3.14Å; L806-N808 PolarHBondContact O-N 3.24Å; L806-S809 PolarHBondContact O-N 3.34Å; L806-L810 HydrophobicContact CD1-CD1 4.13Å; L806-L810 HydrophobicContact CD1-CG 4.26Å; L806-L810 HydrophobicContact CG-CD1 4.14Å; L806-L810 WeakPolarHBondContact O-CG 2.82Å; L806-L810 PolarHBondContact O-N 3.41Å
807	V	87.8	Confident	74.7	Confident	0 Å²	0	39.5 Å²	39.5	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-56.6	-43.6	177.4	179.4	0	0	0	0	109.9	T802 S803 S804 L810 L811 L841 C842	T802-V807 HydrophobicContact CG2-CG2 4.37Å; S803-V807 PolarHBondContact O-N 2.89Å; S803-V807 VanDerWaalsContact O-N 3.17Å; S804-V807 PolarHBondContact O-N 3.3Å; S804-V807 VanDerWaalsContact O-N 3.13Å; V807-L810 PolarHBondContact O-N 3.25Å; V807-L811 HydrophobicContact CG1-CD1 3.89Å; V807-L811 HydrophobicContact CG1-CG 4.39Å; V807-L811 WeakPolarHBondContact O-CB 3.24Å; V807-L811 WeakPolarHBondContact O-CG 3.46Å; V807-L811 PolarHBondContact O-N 2.88Å; V807-L841 HydrophobicContact CG1-CB 4.22Å; V807-L841 HydrophobicContact CG2-CB 4.29Å; V807-C842 HydrophobicContact CG1-CB 4.26Å
808	N	88.4	Confident	77.4	Confident	23 Å²	23	36.8 Å²	36.8	12%	0.123	22%	0.223	C	C	.	.	H	α-helix	trans	-67.9	-41.1	-179.8	-62.1	21.7	0	0	0	112	S804 L806 L811 N812 D844 Q847	S804-N808 WeakPolarHBondContact O-CB 3.49Å; S804-N808 PolarHBondContact O-N 3.06Å; S804-N808 PolarHBondContact O-OD1 3.03Å; L806-N808 PolarHBondContact O-N 3.24Å; N808-L811 PolarHBondContact O-N 2.95Å; N808-N812 WeakPolarHBondContact O-CB 3.31Å; N808-N812 PolarHBondContact O-N 2.92Å; N808-N812 PolarHBondContact O-ND2 3.34Å; N808-D844 VanDerWaalsContact ND2-CB 3.3Å; N808-D844 WeakPolarHBondContact ND2-CB 3.41Å; N808-D844 PolarHBondContact ND2-OD2 3.11Å; N808-Q847 PolarHBondContact O-NE2 3.38Å; N808-Q847 PolarHBondContact OD1-OE1 3.06Å
809	S	88.9	Confident	79.8	Confident	29 Å²	29	36 Å²	36	20%	0.203	22%	0.216	C	C	.	.	H	α-helix	trans	-62.3	-41.6	174.1	179	0	0	0	0	112.3	S741 K805 L806 S813	S741-S809 WeakPolarHBondContact OG-CB 3.41Å; S741-S809 PolarHBondContact OG-OG 2.93Å; K805-S809 VanDerWaalsContact O-CB 3.29Å; K805-S809 WeakPolarHBondContact O-CB 3.29Å; K805-S809 PolarHBondContact O-N 3.48Å; K805-S809 VanDerWaalsContact O-N 3.08Å; L806-S809 PolarHBondContact O-N 3.34Å; S809-S813 PolarHBondContact O-N 2.88Å; S809-S813 VanDerWaalsContact O-N 3.11Å; S809-S813 PolarHBondContact O-OG 2.9Å
810	L	91.4	Very high	81.9	Confident	0 Å²	0	35.8 Å²	35.8	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-65.8	-47.3	175.9	-71.7	173.7	0	0	0	111.6	S741 L744 L767 Y771 L806 V807 N812 S813 I814 L838	S741-L810 WeakPolarHBondContact OG-CD2 3.48Å; S741-L810 PolarHBondContact OG-N 3.48Å; L744-L810 HydrophobicContact CD2-CD2 4.47Å; L767-L810 HydrophobicContact CD1-CD2 3.66Å; L767-L810 HydrophobicContact CD2-CD1 4.36Å; L767-L810 HydrophobicContact CD2-CD2 4.45Å; Y771-L810 HydrophobicContact CE2-CD1 4.45Å; L806-L810 HydrophobicContact CD1-CD1 4.13Å; L806-L810 HydrophobicContact CD1-CG 4.26Å; L806-L810 HydrophobicContact CG-CD1 4.14Å; L806-L810 WeakPolarHBondContact O-CG 2.82Å; L806-L810 PolarHBondContact O-N 3.41Å; V807-L810 PolarHBondContact O-N 3.25Å; L810-N812 VanDerWaalsContact C-N 3.32Å; L810-N812 PolarHBondContact O-N 3.01Å; L810-S813 WeakPolarHBondContact O-CB 3.18Å; L810-S813 PolarHBondContact O-N 3.33Å; L810-I814 HydrophobicContact CB-CD1 4.49Å; L810-I814 WeakPolarHBondContact O-CB 3.44Å; L810-I814 WeakPolarHBondContact O-CD1 3.38Å; L810-I814 VanDerWaalsContact O-CG1 3.22Å; L810-I814 WeakPolarHBondContact O-CG1 3.16Å; L810-I814 PolarHBondContact O-N 3.08Å; L810-L838 HydrophobicContact CB-CD1 3.92Å; L810-L838 HydrophobicContact CD1-CD1 4.19Å
811	L	91.6	Very high	83	Confident	0 Å²	0	39 Å²	39	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-64.7	-32.7	179.1	-75.9	175.5	0	0	0	113.2	V807 N808 G815 L838 L839 C842 W851	V807-L811 HydrophobicContact CG1-CD1 3.89Å; V807-L811 HydrophobicContact CG1-CG 4.39Å; V807-L811 WeakPolarHBondContact O-CB 3.24Å; V807-L811 WeakPolarHBondContact O-CG 3.46Å; V807-L811 PolarHBondContact O-N 2.88Å; N808-L811 PolarHBondContact O-N 2.95Å; L811-G815 PolarHBondContact O-N 3.04Å; L811-L838 HydrophobicContact CD2-CB 3.79Å; L811-L838 HydrophobicContact CG-CB 4.2Å; L811-L839 HydrophobicContact CD1-CD2 4.22Å; L811-L839 HydrophobicContact CD2-CD2 4.02Å; L811-L839 HydrophobicContact CD2-CG 3.96Å; L811-C842 HydrophobicContact CD1-CB 3.62Å; L811-W851 HydrophobicContact CD2-CZ2 4.13Å; L811-W851 PolarHBondContact O-NE1 2.98Å
812	N	90.4	Very high	83.7	Confident	90 Å²	90	41 Å²	41	48%	0.481	25%	0.245	S	C	.	.	H	α-helix	trans	-66.6	-45.5	171.4	-76.1	-16.6	0	0	0	111.5	N808 L810 I814 G815 A816 Q847	N808-N812 WeakPolarHBondContact O-CB 3.31Å; N808-N812 PolarHBondContact O-N 2.92Å; N808-N812 PolarHBondContact O-ND2 3.34Å; L810-N812 VanDerWaalsContact C-N 3.32Å; L810-N812 PolarHBondContact O-N 3.01Å; N812-I814 PolarHBondContact O-N 2.98Å; N812-G815 PolarHBondContact O-N 3.36Å; N812-A816 WeakPolarHBondContact O-CB 3.03Å; N812-A816 PolarHBondContact O-N 3.11Å; N812-Q847 VanDerWaalsContact CG-NE2 3.29Å; N812-Q847 PolarHBondContact OD1-NE2 3.46Å
813	S	89.7	Confident	84.3	Confident	4 Å²	4	40.4 Å²	40.4	3%	0.028	24%	0.24	C	C	.	.	H	α-helix	trans	-61.7	-43.7	177.2	-54.3	0	0	0	0	111.9	S745 S809 L810 A816 I817	S745-S813 PolarHBondContact OG-OG 3.26Å; S809-S813 PolarHBondContact O-N 2.88Å; S809-S813 VanDerWaalsContact O-N 3.11Å; S809-S813 PolarHBondContact O-OG 2.9Å; L810-S813 WeakPolarHBondContact O-CB 3.18Å; L810-S813 PolarHBondContact O-N 3.33Å; S813-A816 PolarHBondContact O-N 2.91Å; S813-I817 WeakPolarHBondContact O-CG1 3.37Å; S813-I817 PolarHBondContact O-N 3Å
814	I	92	Very high	84.4	Confident	0 Å²	0	39.8 Å²	39.8	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-66.3	-43.2	178.3	-72.7	164.3	0	0	0	111.3	L744 L810 N812 I817 L818 V831 L834 A835 L838 W851	L744-I814 HydrophobicContact CD2-CG1 4.49Å; L810-I814 HydrophobicContact CB-CD1 4.49Å; L810-I814 WeakPolarHBondContact O-CB 3.44Å; L810-I814 WeakPolarHBondContact O-CD1 3.38Å; L810-I814 VanDerWaalsContact O-CG1 3.22Å; L810-I814 WeakPolarHBondContact O-CG1 3.16Å; L810-I814 PolarHBondContact O-N 3.08Å; N812-I814 PolarHBondContact O-N 2.98Å; I814-I817 PolarHBondContact O-N 3.26Å; I814-L818 HydrophobicContact CG2-CD1 4.27Å; I814-L818 WeakPolarHBondContact O-CG 3.36Å; I814-L818 PolarHBondContact O-N 3.04Å; I814-V831 HydrophobicContact CG2-CG1 3.8Å; I814-L834 HydrophobicContact CD1-CD2 3.66Å; I814-L834 HydrophobicContact CD1-CG 3.76Å; I814-L834 HydrophobicContact CG1-CD2 4.32Å; I814-A835 HydrophobicContact CG2-CB 3.92Å; I814-L838 HydrophobicContact CD1-CD1 3.53Å; I814-W851 HydrophobicContact CB-CZ2 4.37Å; I814-W851 HydrophobicContact CG2-CH2 3.91Å; I814-W851 HydrophobicContact CG2-CZ2 3.79Å
815	G	90.4	Very high	84.6	Confident	0 Å²	0	40.9 Å²	40.9	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-56.5	-51.2	174	0	0	0	0	0	111.2	L811 N812 I817 L818 D819	L811-G815 PolarHBondContact O-N 3.04Å; N812-G815 PolarHBondContact O-N 3.36Å; G815-I817 PolarHBondContact O-N 3.47Å; G815-I817 VanDerWaalsContact O-N 3.15Å; G815-L818 PolarHBondContact O-N 3.27Å; G815-D819 VanDerWaalsContact O-CG 3.3Å; G815-D819 PolarHBondContact O-N 2.85Å
816	A	88.7	Confident	84.5	Confident	42 Å²	42	39.8 Å²	39.8	35%	0.347	25%	0.245	S	C	.	.	H	α-helix	trans	-64.7	-16.2	179.1	0	0	0	0	0	115.1	V748 N812 S813 Q820	V748-A816 HydrophobicContact CG1-CB 3.85Å; V748-A816 WeakPolarHBondContact CG1-O 3.22Å; N812-A816 WeakPolarHBondContact O-CB 3.03Å; N812-A816 PolarHBondContact O-N 3.11Å; S813-A816 PolarHBondContact O-N 2.91Å; A816-Q820 PolarHBondContact O-NE2 3.23Å; A816-Q820 VanDerWaalsContact O-NE2 3.07Å
817	I	89.8	Confident	84.5	Confident	0 Å²	0	40.4 Å²	40.4	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-80.8	-45.9	167.1	-65.7	160.7	0	0	0	110.2	L744 V748 L751 I760 S813 I814 G815 D819 Q820 H823 V831	L744-I817 HydrophobicContact CD1-CD1 3.86Å; L744-I817 HydrophobicContact CG-CD1 4.27Å; V748-I817 HydrophobicContact CB-CG1 4.31Å; V748-I817 HydrophobicContact CG1-CG1 3.84Å; V748-I817 HydrophobicContact CG2-CD1 3.92Å; V748-I817 HydrophobicContact CG2-CG1 3.62Å; L751-I817 HydrophobicContact CD2-CG2 4.37Å; I760-I817 HydrophobicContact CG2-CD1 3.71Å; I760-I817 HydrophobicContact CG2-CG1 4.48Å; S813-I817 WeakPolarHBondContact O-CG1 3.37Å; S813-I817 PolarHBondContact O-N 3Å; I814-I817 PolarHBondContact O-N 3.26Å; G815-I817 PolarHBondContact O-N 3.47Å; G815-I817 VanDerWaalsContact O-N 3.15Å; I817-D819 VanDerWaalsContact C-N 3.33Å; I817-D819 PolarHBondContact O-N 2.89Å; I817-Q820 PolarHBondContact O-N 3.24Å; I817-H823 PolarHBondContact O-CE1 2.88Å; I817-H823 PolarHBondContact O-ND1 2.59Å; I817-V831 HydrophobicContact CB-CG1 4.45Å; I817-V831 HydrophobicContact CG2-CG1 4.24Å; I817-V831 HydrophobicContact CG2-CG2 4.18Å
818	L	88.8	Confident	84.5	Confident	5 Å²	5	43.5 Å²	43.5	3%	0.026	26%	0.26	C	S	.	.	H	α-helix	trans	-68.4	-28.8	-178.7	-67.6	176.1	0	0	0	113.6	I814 G815 Q820 H823 V831 V832 W851 R866 L869	I814-L818 HydrophobicContact CG2-CD1 4.27Å; I814-L818 WeakPolarHBondContact O-CG 3.36Å; I814-L818 PolarHBondContact O-N 3.04Å; G815-L818 PolarHBondContact O-N 3.27Å; L818-Q820 PolarHBondContact O-N 2.99Å; L818-H823 WeakPolarHBondContact CA-CE1 3.41Å; L818-H823 PolarHBondContact O-CE1 3.47Å; L818-V831 HydrophobicContact CD1-CG1 4.25Å; L818-V831 HydrophobicContact CD2-CB 4.26Å; L818-V831 HydrophobicContact CD2-CG1 3.66Å; L818-V831 HydrophobicContact CG-CG1 3.72Å; L818-V832 HydrophobicContact CD2-CG2 3.79Å; L818-W851 HydrophobicContact CD1-CH2 3.74Å; L818-W851 HydrophobicContact CD1-CZ3 4.3Å; L818-R866 HydrophobicContact CB-CB 3.77Å; L818-R866 HydrophobicContact CD1-CB 4.47Å; L818-L869 HydrophobicContact CB-CD2 4.36Å; L818-L869 HydrophobicContact CD2-CD2 4.09Å; L818-L869 WeakPolarHBondContact O-CD2 3.47Å
819	D	86.8	Confident	84.4	Confident	47 Å²	47	42.7 Å²	42.7	25%	0.251	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.9	-10.3	176.1	-63.8	-48.4	0	0	0	113.1	G815 I817 P865 R866	G815-D819 VanDerWaalsContact O-CG 3.3Å; G815-D819 PolarHBondContact O-N 2.85Å; I817-D819 VanDerWaalsContact C-N 3.33Å; I817-D819 PolarHBondContact O-N 2.89Å; D819-P865 HydrophobicContact CB-CB 4.27Å; D819-P865 HydrophobicContact CB-CG 4.48Å; D819-P865 WeakPolarHBondContact OD1-CB 3.46Å; D819-P865 WeakPolarHBondContact OD1-CD 3.41Å; D819-R866 WeakPolarHBondContact OD1-CB 3.44Å; D819-R866 WeakPolarHBondContact OD1-CG 3.5Å; D819-R866 PolarHBondContact OD1-N 3.38Å; D819-R866 IonicContact OD2-CZ 2.83Å; D819-R866 IonicContact OD2-NE 3.77Å; D819-R866 IonicContact OD2-NH1 2.9Å; D819-R866 PolarHBondContact OD2-NH1 3.03Å
820	Q	82.4	Confident	84.4	Confident	69 Å²	69	42.9 Å²	42.9	32%	0.322	26%	0.256	S	S	.	.			trans	-88.8	139.9	173	-68.7	-178.4	54.8	0	0	111.4	V748 L751 A816 I817 L818 H823	V748-Q820 VanDerWaalsContact CG1-NE2 3.27Å; V748-Q820 PolarHBondContact O-NE2 3.02Å; L751-Q820 HydrophobicContact CD2-CB 4.28Å; A816-Q820 PolarHBondContact O-NE2 3.23Å; A816-Q820 VanDerWaalsContact O-NE2 3.07Å; I817-Q820 PolarHBondContact O-N 3.24Å; L818-Q820 PolarHBondContact O-N 2.99Å; Q820-H823 PolarHBondContact O-CE1 2.46Å; Q820-H823 PolarHBondContact O-ND1 2.6Å
821	I	65.1	Low	84.5	Confident	162 Å²	162	42.9 Å²	42.9	83%	0.831	26%	0.256	S	S	*	.	S	Bend	trans	-82.4	-19.8	-171	-62.6	173.6	0	0	0	112.8
822	G	66.4	Low	84.5	Confident	76 Å²	76	42.9 Å²	42.9	78%	0.784	26%	0.256	S	S	*	.			trans	-92.5	-1.7	-161.5	0	0	0	0	0	118.7
823	H	70.4	Confident	84.4	Confident	13 Å²	13	39 Å²	39	6%	0.06	24%	0.236	C	C	.	.			trans	-79.2	141.3	-175.9	51.4	-89.2	0	0	0	114.2	L751 I817 L818 Q820 L827 R828 L869	L751-H823 HydrophobicContact CD2-CB 4.41Å; I817-H823 PolarHBondContact O-CE1 2.88Å; I817-H823 PolarHBondContact O-ND1 2.59Å; L818-H823 WeakPolarHBondContact CA-CE1 3.41Å; L818-H823 PolarHBondContact O-CE1 3.47Å; Q820-H823 PolarHBondContact O-CE1 2.46Å; Q820-H823 PolarHBondContact O-ND1 2.6Å; H823-L827 HydrophobicContact CB-CD2 3.88Å; H823-L827 HydrophobicContact CB-CG 4.3Å; H823-R828 PolarHBondContact CD2-NE 3.3Å; H823-R828 WeakPolarHBondContact NE2-CD 3.45Å; H823-R828 WeakPolarHBondContact NE2-CG 3.22Å; H823-R828 PolarHBondContact NE2-NE 2.96Å; H823-R828 PolarHBondContact O-NH2 2.78Å; H823-L869 WeakPolarHBondContact NE2-CD2 3.1Å
824	G	75.5	Confident	84.5	Confident	40 Å²	40	38.8 Å²	38.8	41%	0.412	24%	0.235	S	C	.	.			trans	-64.9	163.3	178.3	0	0	0	0	0	114.7	E826 L827 R828	G824-E826 PolarHBondContact O-N 2.89Å; G824-L827 PolarHBondContact O-N 2.84Å; G824-R828 PolarHBondContact O-N 3.03Å
825	P	80.9	Confident	84.5	Confident	93 Å²	93	38.8 Å²	38.8	60%	0.604	24%	0.235	S	C	*	.	H	α-helix	trans	-64.3	-36.8	-170.6	25.2	-34.4	0	0	0	113.4	R828 A829	P825-R828 WeakPolarHBondContact O-CB 3.28Å; P825-R828 PolarHBondContact O-N 3.47Å; P825-A829 PolarHBondContact O-N 3.43Å
826	E	82.4	Confident	84.5	Confident	139 Å²	139	39 Å²	39	65%	0.65	24%	0.237	S	C	*	.	H	α-helix	trans	-59.7	-51.1	175.4	-67.3	161.6	-146.9	0	0	111.7	G824 R828 A829 V830 I915	G824-E826 PolarHBondContact O-N 2.89Å; E826-R828 VanDerWaalsContact C-N 3.3Å; E826-R828 PolarHBondContact O-N 2.65Å; E826-A829 PolarHBondContact O-N 2.97Å; E826-V830 WeakPolarHBondContact O-CG2 3.34Å; E826-V830 PolarHBondContact O-N 3.31Å; E826-I915 HydrophobicContact CG-CD1 3.98Å
827	L	86.2	Confident	84.4	Confident	16 Å²	16	39.2 Å²	39.2	8%	0.084	23%	0.229	C	C	.	.	H	α-helix	trans	-62.6	-39.6	177.9	178.2	57.2	0	0	0	110.7	L751 I760 A761 H823 G824 A829 V830 V831	L751-L827 HydrophobicContact CD1-CD2 3.87Å; I760-L827 HydrophobicContact CG2-CD1 4.04Å; I760-L827 HydrophobicContact CG2-CD2 4.35Å; A761-L827 HydrophobicContact CB-CD1 3.92Å; H823-L827 HydrophobicContact CB-CD2 3.88Å; H823-L827 HydrophobicContact CB-CG 4.3Å; G824-L827 PolarHBondContact O-N 2.84Å; L827-A829 PolarHBondContact O-N 3.06Å; L827-V830 PolarHBondContact O-N 3.07Å; L827-V831 HydrophobicContact CD1-CG2 3.5Å; L827-V831 VanDerWaalsContact CD1-CG2 3.5Å; L827-V831 HydrophobicContact CG-CG2 4.11Å; L827-V831 WeakPolarHBondContact O-CB 3.41Å; L827-V831 WeakPolarHBondContact O-CG2 3.39Å; L827-V831 PolarHBondContact O-N 3.02Å
828	R	87.8	Confident	84.4	Confident	66 Å²	66	39.2 Å²	39.2	25%	0.249	23%	0.229	C	C	.	.	H	α-helix	trans	-58.2	-48.2	174.1	-162	169.9	-66.2	177.2	0.4	111.9	H823 G824 P825 E826 V831 V832 L919	H823-R828 PolarHBondContact CD2-NE 3.3Å; H823-R828 WeakPolarHBondContact NE2-CD 3.45Å; H823-R828 WeakPolarHBondContact NE2-CG 3.22Å; H823-R828 PolarHBondContact NE2-NE 2.96Å; H823-R828 PolarHBondContact O-NH2 2.78Å; G824-R828 PolarHBondContact O-N 3.03Å; P825-R828 WeakPolarHBondContact O-CB 3.28Å; P825-R828 PolarHBondContact O-N 3.47Å; E826-R828 VanDerWaalsContact C-N 3.3Å; E826-R828 PolarHBondContact O-N 2.65Å; R828-V831 PolarHBondContact O-N 3.16Å; R828-V832 HydrophobicContact CG-CG2 4.37Å; R828-V832 WeakPolarHBondContact O-CB 3.38Å; R828-V832 VanDerWaalsContact O-CG2 3.28Å; R828-V832 WeakPolarHBondContact O-CG2 3.43Å; R828-V832 PolarHBondContact O-N 3.39Å; R828-L919 HydrophobicContact CG-CD1 4.06Å
829	A	87.4	Confident	84.5	Confident	6 Å²	6	39 Å²	39	5%	0.05	23%	0.227	C	C	.	.	H	α-helix	trans	-61.6	-46	-179.4	0	0	0	0	0	112	P825 E826 L827 A833 I915 L919	P825-A829 PolarHBondContact O-N 3.43Å; E826-A829 PolarHBondContact O-N 2.97Å; L827-A829 PolarHBondContact O-N 3.06Å; A829-A833 WeakPolarHBondContact O-CB 3.19Å; A829-A833 PolarHBondContact O-N 3.44Å; A829-I915 HydrophobicContact CB-CG2 3.86Å; A829-L919 HydrophobicContact CB-CB 3.99Å; A829-L919 HydrophobicContact CB-CD1 4.38Å
830	V	88.7	Confident	84.4	Confident	32 Å²	32	38.4 Å²	38.4	19%	0.194	23%	0.227	C	C	.	.	H	α-helix	trans	-63	-47.7	177	175.1	0	0	0	0	111.6	C764 R765 E826 L827 A833 L834	C764-V830 HydrophobicContact CB-CG1 3.66Å; R765-V830 HydrophobicContact CB-CG1 4.44Å; R765-V830 HydrophobicContact CG-CB 4.4Å; R765-V830 HydrophobicContact CG-CG1 3.71Å; R765-V830 HydrophobicContact CG-CG2 3.74Å; E826-V830 WeakPolarHBondContact O-CG2 3.34Å; E826-V830 PolarHBondContact O-N 3.31Å; L827-V830 PolarHBondContact O-N 3.07Å; V830-A833 PolarHBondContact O-N 3.15Å; V830-L834 WeakPolarHBondContact O-CB 3.42Å; V830-L834 PolarHBondContact O-N 3.21Å
831	V	92.1	Very high	84.5	Confident	0 Å²	0	37.2 Å²	37.2	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-68.1	-39.7	-175.1	175.2	0	0	0	0	111.3	C764 I814 I817 L818 L827 R828 L834 A835	C764-V831 HydrophobicContact CB-CG2 4.2Å; I814-V831 HydrophobicContact CG2-CG1 3.8Å; I817-V831 HydrophobicContact CB-CG1 4.45Å; I817-V831 HydrophobicContact CG2-CG1 4.24Å; I817-V831 HydrophobicContact CG2-CG2 4.18Å; L818-V831 HydrophobicContact CD1-CG1 4.25Å; L818-V831 HydrophobicContact CD2-CB 4.26Å; L818-V831 HydrophobicContact CD2-CG1 3.66Å; L818-V831 HydrophobicContact CG-CG1 3.72Å; L827-V831 HydrophobicContact CD1-CG2 3.5Å; L827-V831 VanDerWaalsContact CD1-CG2 3.5Å; L827-V831 HydrophobicContact CG-CG2 4.11Å; L827-V831 WeakPolarHBondContact O-CB 3.41Å; L827-V831 WeakPolarHBondContact O-CG2 3.39Å; L827-V831 PolarHBondContact O-N 3.02Å; R828-V831 PolarHBondContact O-N 3.16Å; V831-L834 PolarHBondContact O-N 3.18Å; V831-A835 WeakPolarHBondContact O-CB 3.22Å; V831-A835 PolarHBondContact O-N 3.06Å
832	V	92.1	Very high	85.4	Confident	1 Å²	1	29.8 Å²	29.8	1%	0.006	19%	0.185	C	C	.	.	H	α-helix	trans	-67.9	-40.8	173.7	171.8	0	0	0	0	111.4	L818 R828 L834 A835 G836 L870 I873 L919 C923	L818-V832 HydrophobicContact CD2-CG2 3.79Å; R828-V832 HydrophobicContact CG-CG2 4.37Å; R828-V832 WeakPolarHBondContact O-CB 3.38Å; R828-V832 VanDerWaalsContact O-CG2 3.28Å; R828-V832 WeakPolarHBondContact O-CG2 3.43Å; R828-V832 PolarHBondContact O-N 3.39Å; V832-L834 VanDerWaalsContact C-N 3.3Å; V832-L834 PolarHBondContact O-N 3.16Å; V832-A835 PolarHBondContact O-N 2.93Å; V832-G836 PolarHBondContact O-N 3.22Å; V832-L870 HydrophobicContact CG1-CD2 4Å; V832-L870 HydrophobicContact CG2-CD2 4.41Å; V832-I873 HydrophobicContact CG2-CD1 4.17Å; V832-L919 HydrophobicContact CB-CD1 4.14Å; V832-L919 HydrophobicContact CG1-CD1 4.37Å; V832-L919 HydrophobicContact CG2-CD1 4.16Å; V832-C923 HydrophobicContact CG1-CB 4.03Å; V832-C923 VanDerWaalsContact CG1-N 3.31Å
833	A	89.1	Confident	86.1	Confident	8 Å²	8	33.5 Å²	33.5	7%	0.066	18%	0.181	C	C	.	.	H	α-helix	trans	-66.4	-29.6	175.1	0	0	0	0	0	113.4	A829 V830 R837	A829-A833 WeakPolarHBondContact O-CB 3.19Å; A829-A833 PolarHBondContact O-N 3.44Å; V830-A833 PolarHBondContact O-N 3.15Å; A833-R837 WeakPolarHBondContact O-CG 3.36Å
834	L	92	Very high	86.7	Confident	0 Å²	0	35.7 Å²	35.7	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-74.6	-44.8	172.1	177.8	58	0	0	0	111.8	C764 L767 H768 Y771 I814 V830 V831 V832 G836 R837 L838	C764-L834 HydrophobicContact CB-CD2 4.04Å; L767-L834 HydrophobicContact CB-CD1 3.94Å; L767-L834 HydrophobicContact CB-CD2 3.85Å; L767-L834 HydrophobicContact CD1-CD2 4.2Å; H768-L834 HydrophobicContact CB-CB 4.46Å; H768-L834 HydrophobicContact CB-CD1 4.44Å; Y771-L834 HydrophobicContact CD2-CD1 4.49Å; I814-L834 HydrophobicContact CD1-CD2 3.66Å; I814-L834 HydrophobicContact CD1-CG 3.76Å; I814-L834 HydrophobicContact CG1-CD2 4.32Å; V830-L834 WeakPolarHBondContact O-CB 3.42Å; V830-L834 PolarHBondContact O-N 3.21Å; V831-L834 PolarHBondContact O-N 3.18Å; V832-L834 VanDerWaalsContact C-N 3.3Å; V832-L834 PolarHBondContact O-N 3.16Å; L834-G836 VanDerWaalsContact C-N 3.31Å; L834-G836 PolarHBondContact O-N 3.03Å; L834-R837 WeakPolarHBondContact O-CB 3.42Å; L834-R837 PolarHBondContact O-N 3.39Å; L834-L838 HydrophobicContact CD1-CD1 3.79Å; L834-L838 HydrophobicContact CD1-CG 3.97Å; L834-L838 HydrophobicContact CG-CD1 3.94Å; L834-L838 HydrophobicContact CG-CG 4.45Å; L834-L838 PolarHBondContact O-N 2.95Å
835	A	91.8	Very high	87	Confident	0 Å²	0	38.2 Å²	38.2	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-55.1	-47.2	175.5	0	0	0	0	0	111.3	I814 V831 V832 R837 L838 L839 W851	I814-A835 HydrophobicContact CG2-CB 3.92Å; V831-A835 WeakPolarHBondContact O-CB 3.22Å; V831-A835 PolarHBondContact O-N 3.06Å; V832-A835 PolarHBondContact O-N 2.93Å; A835-R837 PolarHBondContact O-N 3.4Å; A835-L838 PolarHBondContact O-N 2.91Å; A835-L838 VanDerWaalsContact O-N 3.15Å; A835-L839 HydrophobicContact CB-CD1 4.35Å; A835-L839 WeakPolarHBondContact O-CB 3.31Å; A835-L839 WeakPolarHBondContact O-CD1 3.29Å; A835-L839 WeakPolarHBondContact O-CG 3.35Å; A835-L839 PolarHBondContact O-N 2.95Å; A835-W851 HydrophobicContact CB-CH2 3.7Å; A835-W851 HydrophobicContact CB-CZ3 4.26Å
836	G	89.9	Confident	87.1	Confident	4 Å²	4	39.8 Å²	39.8	4%	0.041	20%	0.204	C	C	.	.	H	α-helix	trans	-66.5	-2.6	176.9	0	0	0	0	0	115.6	V832 L834 R925 C926	V832-G836 PolarHBondContact O-N 3.22Å; L834-G836 VanDerWaalsContact C-N 3.31Å; L834-G836 PolarHBondContact O-N 3.03Å; G836-R925 WeakPolarHBondContact O-CB 2.96Å; G836-C926 PolarHBondContact N-SG 3.42Å
837	R	87.4	Confident	87.2	Confident	46 Å²	46	33.7 Å²	33.7	17%	0.174	18%	0.176	C	C	.	.	H	α-helix	trans	-104.7	-34.3	169.7	-66.8	168.8	-177.4	-81.8	4.6	112.7	H768 Y771 A833 L834 A835	H768-R837 PolarHBondContact CD2-NE 3.41Å; H768-R837 PolarHBondContact CE1-NH2 2.76Å; H768-R837 PolarHBondContact NE2-NE 3.41Å; H768-R837 PolarHBondContact NE2-NH2 2.89Å; Y771-R837 WeakPolarHBondContact O-CD 3.47Å; Y771-R837 PolarHBondContact O-NH1 3.36Å; A833-R837 WeakPolarHBondContact O-CG 3.36Å; L834-R837 WeakPolarHBondContact O-CB 3.42Å; L834-R837 PolarHBondContact O-N 3.39Å; A835-R837 PolarHBondContact O-N 3.4Å
838	L	89.9	Confident	87.1	Confident	0 Å²	0	33.2 Å²	33.2	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-85.6	-31.1	-177	-69.9	178.5	0	0	0	113.4	Y771 L810 L811 I814 L834 A835 L841 C842	Y771-L838 HydrophobicContact CD1-CD2 4.24Å; Y771-L838 HydrophobicContact CD2-CD2 3.76Å; Y771-L838 HydrophobicContact CE1-CD2 4.19Å; Y771-L838 HydrophobicContact CE2-CD2 3.71Å; Y771-L838 HydrophobicContact CG-CD2 4.05Å; L810-L838 HydrophobicContact CB-CD1 3.92Å; L810-L838 HydrophobicContact CD1-CD1 4.19Å; L811-L838 HydrophobicContact CD2-CB 3.79Å; L811-L838 HydrophobicContact CG-CB 4.2Å; I814-L838 HydrophobicContact CD1-CD1 3.53Å; L834-L838 HydrophobicContact CD1-CD1 3.79Å; L834-L838 HydrophobicContact CD1-CG 3.97Å; L834-L838 HydrophobicContact CG-CD1 3.94Å; L834-L838 HydrophobicContact CG-CG 4.45Å; L834-L838 PolarHBondContact O-N 2.95Å; A835-L838 PolarHBondContact O-N 2.91Å; A835-L838 VanDerWaalsContact O-N 3.15Å; L838-L841 HydrophobicContact CD2-CD1 4.34Å; L838-L841 WeakPolarHBondContact O-CB 3.13Å; L838-L841 PolarHBondContact O-N 2.85Å; L838-C842 PolarHBondContact O-N 2.91Å
839	L	90	Very high	86.8	Confident	0 Å²	0	32.4 Å²	32.4	0%	0	18%	0.176	C	C	.	.	G	3₁₀ helix	trans	-56.9	-46	179	-76.7	161.9	0	0	0	112.6	L811 A835 L841 C842 L848 W851 F852 C926 F929	L811-L839 HydrophobicContact CD1-CD2 4.22Å; L811-L839 HydrophobicContact CD2-CD2 4.02Å; L811-L839 HydrophobicContact CD2-CG 3.96Å; A835-L839 HydrophobicContact CB-CD1 4.35Å; A835-L839 WeakPolarHBondContact O-CB 3.31Å; A835-L839 WeakPolarHBondContact O-CD1 3.29Å; A835-L839 WeakPolarHBondContact O-CG 3.35Å; A835-L839 PolarHBondContact O-N 2.95Å; L839-L841 PolarHBondContact O-N 3.49Å; L839-C842 WeakPolarHBondContact O-CB 3.4Å; L839-C842 PolarHBondContact O-N 3.41Å; L839-L848 HydrophobicContact CD2-CD2 3.99Å; L839-W851 HydrophobicContact CD1-CE3 4.1Å; L839-W851 HydrophobicContact CD1-CZ3 3.97Å; L839-W851 HydrophobicContact CD2-CD2 3.98Å; L839-W851 HydrophobicContact CD2-CE3 4.02Å; L839-W851 HydrophobicContact CD2-CG 4.25Å; L839-F852 HydrophobicContact CD1-CZ 3.94Å; L839-F852 HydrophobicContact CD2-CE2 4.11Å; L839-F852 HydrophobicContact CD2-CZ 4.27Å; L839-C926 HydrophobicContact CD1-CB 4.09Å; L839-F929 HydrophobicContact CB-CD1 3.88Å; L839-F929 HydrophobicContact CB-CE1 4.4Å; L839-F929 HydrophobicContact CB-CG 4.42Å; L839-F929 WeakPolarHBondContact O-CE1 3.48Å; L839-F929 WeakPolarHBondContact O-CZ 3.4Å
840	P	85.4	Confident	86.6	Confident	36 Å²	36	35.3 Å²	35.3	23%	0.234	20%	0.196	C	C	.	.	G	3₁₀ helix	trans	-63.6	-8.4	173.7	-23.9	35.8	0	0	0	116.3	I779 F929	I779-P840 HydrophobicContact CD1-CB 4.19Å; P840-F929 HydrophobicContact CB-CD2 4.23Å; P840-F929 HydrophobicContact CB-CE2 4.32Å; P840-F929 HydrophobicContact CG-CD2 4.17Å; P840-F929 HydrophobicContact CG-CG 4.43Å
841	L	84.3	Confident	86.6	Confident	44 Å²	44	33.8 Å²	33.8	23%	0.23	19%	0.186	C	C	.	.	G	3₁₀ helix	trans	-98.4	-7.7	174.3	-53.7	179.5	0	0	0	112.2	Y771 V807 L838 L839 H843	Y771-L841 HydrophobicContact CD1-CD1 4.09Å; Y771-L841 HydrophobicContact CE1-CD1 4.07Å; V807-L841 HydrophobicContact CG1-CB 4.22Å; V807-L841 HydrophobicContact CG2-CB 4.29Å; L838-L841 HydrophobicContact CD2-CD1 4.34Å; L838-L841 WeakPolarHBondContact O-CB 3.13Å; L838-L841 PolarHBondContact O-N 2.85Å; L839-L841 PolarHBondContact O-N 3.49Å; L841-H843 PolarHBondContact O-CE1 3.18Å; L841-H843 PolarHBondContact O-ND1 3.41Å
842	C	84.4	Confident	86.3	Confident	6 Å²	6	33.8 Å²	33.8	4%	0.041	19%	0.186	C	C	.	.			trans	-82.9	123.1	178.9	-172.8	0	0	0	0	110.5	V807 L811 L838 L839 Q847 L848	V807-C842 HydrophobicContact CG1-CB 4.26Å; L811-C842 HydrophobicContact CD1-CB 3.62Å; L838-C842 PolarHBondContact O-N 2.91Å; L839-C842 WeakPolarHBondContact O-CB 3.4Å; L839-C842 PolarHBondContact O-N 3.41Å; C842-Q847 PolarHBondContact SG-OE1 3Å; C842-L848 HydrophobicContact CB-CD2 3.97Å
843	H	80.9	Confident	85.3	Confident	153 Å²	153	34 Å²	34	71%	0.708	19%	0.189	S	C	*	.			trans	-107.8	1.9	178.6	-63.3	66.1	0	0	0	112	L841	L841-H843 PolarHBondContact O-CE1 3.18Å; L841-H843 PolarHBondContact O-ND1 3.41Å
844	D	83	Confident	84.1	Confident	59 Å²	59	39.1 Å²	39.1	32%	0.316	21%	0.212	S	C	.	.			trans	-92.6	100.9	-178.2	-176.1	-16.7	0	0	0	109.8	N808 N846 Q847 L848	N808-D844 VanDerWaalsContact ND2-CB 3.3Å; N808-D844 WeakPolarHBondContact ND2-CB 3.41Å; N808-D844 PolarHBondContact ND2-OD2 3.11Å; D844-N846 VanDerWaalsContact C-N 3.27Å; D844-N846 PolarHBondContact O-N 2.86Å; D844-N846 WeakPolarHBondContact OD1-CB 3.37Å; D844-N846 PolarHBondContact OD1-N 2.84Å; D844-N846 VanDerWaalsContact OD1-N 3.12Å; D844-Q847 HydrophobicContact CB-CB 4.06Å; D844-Q847 PolarHBondContact O-N 3.46Å; D844-Q847 VanDerWaalsContact O-N 3.11Å; D844-Q847 PolarHBondContact OD1-N 3.28Å; D844-L848 PolarHBondContact O-N 2.87Å; D844-L848 VanDerWaalsContact O-N 3.09Å
845	T	81.5	Confident	82.4	Confident	93 Å²	93	43.2 Å²	43.2	57%	0.571	23%	0.234	S	C	*	.	H	α-helix	trans	-57.9	-38	-178.7	49.3	0	0	0	0	112.4	Q847 L848 T849	T845-Q847 VanDerWaalsContact C-N 3.29Å; T845-Q847 PolarHBondContact O-N 3.31Å; T845-L848 PolarHBondContact O-N 3.45Å; T845-L848 VanDerWaalsContact O-N 3.15Å; T845-T849 PolarHBondContact O-N 3.37Å; T845-T849 PolarHBondContact O-OG1 2.94Å
846	N	82.5	Confident	80.7	Confident	127 Å²	127	48 Å²	48	68%	0.679	26%	0.263	S	S	*	.	H	α-helix	trans	-64.1	-37.5	178.7	-59.5	-57.5	0	0	0	111.3	D844 S850	D844-N846 VanDerWaalsContact C-N 3.27Å; D844-N846 PolarHBondContact O-N 2.86Å; D844-N846 WeakPolarHBondContact OD1-CB 3.37Å; D844-N846 PolarHBondContact OD1-N 2.84Å; D844-N846 VanDerWaalsContact OD1-N 3.12Å; N846-S850 WeakPolarHBondContact O-CB 3.36Å; N846-S850 PolarHBondContact O-N 3.35Å
847	Q	83.9	Confident	78.9	Confident	11 Å²	11	50.8 Å²	50.8	5%	0.051	28%	0.279	C	S	.	.	H	α-helix	trans	-69.5	-35.9	174.8	-170.7	174.6	36.2	0	0	112.3	N808 N812 C842 D844 T845 S850 W851	N808-Q847 PolarHBondContact O-NE2 3.38Å; N808-Q847 PolarHBondContact OD1-OE1 3.06Å; N812-Q847 VanDerWaalsContact CG-NE2 3.29Å; N812-Q847 PolarHBondContact OD1-NE2 3.46Å; C842-Q847 PolarHBondContact SG-OE1 3Å; D844-Q847 HydrophobicContact CB-CB 4.06Å; D844-Q847 PolarHBondContact O-N 3.46Å; D844-Q847 VanDerWaalsContact O-N 3.11Å; D844-Q847 PolarHBondContact OD1-N 3.28Å; T845-Q847 VanDerWaalsContact C-N 3.29Å; T845-Q847 PolarHBondContact O-N 3.31Å; Q847-S850 CarbonylContact O-C 3.57Å; Q847-S850 WeakPolarHBondContact O-CB 3.45Å; Q847-S850 PolarHBondContact O-N 2.76Å; Q847-W851 WeakPolarHBondContact O-CB 3.47Å; Q847-W851 PolarHBondContact O-N 3.44Å
848	L	85.1	Confident	77.4	Confident	5 Å²	5	56.4 Å²	56.4	3%	0.026	31%	0.307	C	S	.	.	H	α-helix	trans	-68.3	-41.9	176.3	-64.1	179.6	0	0	0	112.1	L839 C842 D844 T845 W851 F852 F929	L839-L848 HydrophobicContact CD2-CD2 3.99Å; C842-L848 HydrophobicContact CB-CD2 3.97Å; D844-L848 PolarHBondContact O-N 2.87Å; D844-L848 VanDerWaalsContact O-N 3.09Å; T845-L848 PolarHBondContact O-N 3.45Å; T845-L848 VanDerWaalsContact O-N 3.15Å; L848-W851 WeakPolarHBondContact O-CB 3.32Å; L848-W851 PolarHBondContact O-N 3.23Å; L848-W851 VanDerWaalsContact O-N 3.08Å; L848-F852 WeakPolarHBondContact O-CD2 3.35Å; L848-F852 PolarHBondContact O-N 2.9Å; L848-F929 HydrophobicContact CD1-CE1 3.64Å; L848-F929 HydrophobicContact CD1-CZ 4.06Å; L848-F929 HydrophobicContact CD2-CD1 4.39Å; L848-F929 HydrophobicContact CD2-CE1 3.71Å; L848-F929 HydrophobicContact CG-CE1 4.33Å
849	T	80.6	Confident	76	Confident	49 Å²	49	58.3 Å²	58.3	30%	0.301	32%	0.321	S	S	.	.	H	α-helix	trans	-58.8	-46.8	169.8	-51	0	0	0	0	110.6	T845 W851 F852 G853 E854	T845-T849 PolarHBondContact O-N 3.37Å; T845-T849 PolarHBondContact O-OG1 2.94Å; T849-W851 VanDerWaalsContact C-N 3.25Å; T849-W851 PolarHBondContact O-N 2.74Å; T849-F852 PolarHBondContact O-N 3.15Å; T849-G853 CarbonylContact O-C 3.57Å; T849-G853 VanDerWaalsContact O-C 3.32Å; T849-G853 WeakPolarHBondContact O-CA 3.34Å; T849-G853 PolarHBondContact O-N 2.98Å; T849-E854 HydrophobicContact CG2-CB 4.31Å; T849-E854 HydrophobicContact CG2-CG 3.9Å
850	S	83.9	Confident	74.7	Confident	67 Å²	67	63 Å²	63	47%	0.469	35%	0.345	S	S	.	.	H	α-helix	trans	-59.5	-35.4	173	-175.9	0	0	0	0	112.4	N846 Q847 T864 R866	N846-S850 WeakPolarHBondContact O-CB 3.36Å; N846-S850 PolarHBondContact O-N 3.35Å; Q847-S850 CarbonylContact O-C 3.57Å; Q847-S850 WeakPolarHBondContact O-CB 3.45Å; Q847-S850 PolarHBondContact O-N 2.76Å; S850-T864 WeakPolarHBondContact O-CG2 3.44Å; S850-R866 PolarHBondContact O-NH2 3.26Å
851	W	87.8	Confident	73.8	Confident	0 Å²	0	65.8 Å²	65.8	0%	0	37%	0.365	C	S	.	.	H	α-helix	trans	-68.6	-48.5	-179.2	-115	74.6	0	0	0	112.6	L811 I814 L818 A835 L839 Q847 L848 T849 T864 R866 T867	L811-W851 HydrophobicContact CD2-CZ2 4.13Å; L811-W851 PolarHBondContact O-NE1 2.98Å; I814-W851 HydrophobicContact CB-CZ2 4.37Å; I814-W851 HydrophobicContact CG2-CH2 3.91Å; I814-W851 HydrophobicContact CG2-CZ2 3.79Å; L818-W851 HydrophobicContact CD1-CH2 3.74Å; L818-W851 HydrophobicContact CD1-CZ3 4.3Å; A835-W851 HydrophobicContact CB-CH2 3.7Å; A835-W851 HydrophobicContact CB-CZ3 4.26Å; L839-W851 HydrophobicContact CD1-CE3 4.1Å; L839-W851 HydrophobicContact CD1-CZ3 3.97Å; L839-W851 HydrophobicContact CD2-CD2 3.98Å; L839-W851 HydrophobicContact CD2-CE3 4.02Å; L839-W851 HydrophobicContact CD2-CG 4.25Å; Q847-W851 WeakPolarHBondContact O-CB 3.47Å; Q847-W851 PolarHBondContact O-N 3.44Å; L848-W851 WeakPolarHBondContact O-CB 3.32Å; L848-W851 PolarHBondContact O-N 3.23Å; L848-W851 VanDerWaalsContact O-N 3.08Å; T849-W851 VanDerWaalsContact C-N 3.25Å; T849-W851 PolarHBondContact O-N 2.74Å; W851-T864 WeakPolarHBondContact O-CG2 3.42Å; W851-T864 PolarHBondContact O-OG1 2.77Å; W851-R866 PolarHBondContact O-NE 2.98Å; W851-R866 VanDerWaalsContact O-NE 3.12Å; W851-T867 PolarHBondContact O-OG1 3.23Å
852	F	85.8	Confident	73.2	Confident	0 Å²	0	67.3 Å²	67.3	0%	0	37%	0.373	C	S	.	.	H	α-helix	trans	-100.8	-28.3	-169.7	-65.2	-73.3	0	0	0	115.4	L839 L848 T849 T867 L870 C926 G930 L937	L839-F852 HydrophobicContact CD1-CZ 3.94Å; L839-F852 HydrophobicContact CD2-CE2 4.11Å; L839-F852 HydrophobicContact CD2-CZ 4.27Å; L848-F852 WeakPolarHBondContact O-CD2 3.35Å; L848-F852 PolarHBondContact O-N 2.9Å; T849-F852 PolarHBondContact O-N 3.15Å; F852-T867 WeakPolarHBondContact CA-OG1 3.47Å; F852-L870 HydrophobicContact CE1-CD1 4.37Å; F852-C926 WeakPolarHBondContact CZ-O 3.47Å; F852-G930 VanDerWaalsContact CE2-CA 3.47Å; F852-L937 HydrophobicContact CD1-CD2 3.69Å; F852-L937 HydrophobicContact CE1-CD2 4.14Å; F852-L937 HydrophobicContact CG-CD2 4.37Å
853	G	72.7	Confident	73.1	Confident	6 Å²	6	67.2 Å²	67.2	6%	0.062	37%	0.372	C	S	.	.			trans	124.9	160	-171	0	0	0	0	0	111.3	T849	T849-G853 CarbonylContact O-C 3.57Å; T849-G853 VanDerWaalsContact O-C 3.32Å; T849-G853 WeakPolarHBondContact O-CA 3.34Å; T849-G853 PolarHBondContact O-N 2.98Å
854	E	64	Low	73.3	Confident	116 Å²	116	61 Å²	61	54%	0.542	35%	0.345	S	S	.	.			trans	-69.8	170.5	175.6	-67.8	-166.5	-173.8	0	0	113.2	T849 T856	T849-E854 HydrophobicContact CG2-CB 4.31Å; T849-E854 HydrophobicContact CG2-CG 3.9Å; E854-T856 VanDerWaalsContact CB-OG1 3.27Å; E854-T856 WeakPolarHBondContact CB-OG1 3.5Å; E854-T856 PolarHBondContact OE2-OG1 3.38Å
855	N	55.7	Low	73.4	Confident	86 Å²	86	61.1 Å²	61.1	46%	0.46	35%	0.349	S	S	.	.	S	Bend	trans	-105.4	16.8	175.7	-72.7	-35.5	0	0	0	112.7	H933 S934 I935	N855-H933 PolarHBondContact ND2-O 3.2Å; N855-H933 PolarHBondContact OD1-O 2.99Å; N855-S934 VanDerWaalsContact OD1-CA 3.3Å; N855-S934 WeakPolarHBondContact OD1-CA 3.44Å; N855-I935 HydrophobicContact CB-CG2 4.13Å; N855-I935 PolarHBondContact OD1-N 3.4Å
856	T	55.4	Low	73.7	Confident	101 Å²	101	57.9 Å²	57.9	62%	0.62	33%	0.327	S	S	*	.	S	Bend	trans	-103.6	-19	-164	44.8	0	0	0	0	114.2	E854	E854-T856 VanDerWaalsContact CB-OG1 3.27Å; E854-T856 WeakPolarHBondContact CB-OG1 3.5Å; E854-T856 PolarHBondContact OE2-OG1 3.38Å
857	T	52.7	Low	74	Confident	61 Å²	61	51.9 Å²	51.9	37%	0.374	29%	0.294	S	S	.	.			trans	-137.5	128.3	-173.6	51.9	0	0	0	0	111.3	S859 D862 N936	T857-S859 PolarHBondContact O-N 3.13Å; T857-D862 WeakPolarHBondContact CB-OD2 3.34Å; T857-D862 PolarHBondContact OG1-OD2 2.99Å; T857-N936 PolarHBondContact O-ND2 3.3Å; T857-N936 PolarHBondContact O-OD1 2.84Å
858	E	56	Low	74.3	Confident	165 Å²	165	57.4 Å²	57.4	77%	0.771	32%	0.315	S	S	*	.			trans	-70.1	10.3	178.6	-60.2	177.6	159.8	0	0	113.9
859	S	60.6	Low	74.5	Confident	40 Å²	40	58.6 Å²	58.6	28%	0.28	32%	0.321	S	S	.	.			trans	-87.9	119.6	-171.6	126.2	0	0	0	0	111.6	T857 S861 D862	T857-S859 PolarHBondContact O-N 3.13Å; S859-S861 PolarHBondContact O-N 3.14Å; S859-S861 VanDerWaalsContact O-N 3.11Å; S859-S861 VanDerWaalsContact OG-CB 3.3Å; S859-S861 WeakPolarHBondContact OG-CB 3.44Å; S859-S861 PolarHBondContact OG-OG 2.6Å; S859-D862 VanDerWaalsContact CB-OD2 3.23Å; S859-D862 WeakPolarHBondContact CB-OD2 3.49Å; S859-D862 PolarHBondContact O-N 2.83Å; S859-D862 VanDerWaalsContact O-N 3.11Å; S859-D862 PolarHBondContact OG-OD2 3.17Å
860	I	62.3	Low	75	Confident	98 Å²	98	56.3 Å²	56.3	50%	0.503	31%	0.307	S	S	.	.	G	3₁₀ helix	trans	-60.9	-20.7	175.5	-61.3	175.3	0	0	0	111.5	D862 L863	I860-D862 PolarHBondContact O-N 3.33Å; I860-L863 HydrophobicContact CG2-CD1 4.08Å; I860-L863 PolarHBondContact O-N 2.88Å
861	S	66.3	Low	75.3	Confident	95 Å²	95	53.4 Å²	53.4	66%	0.664	29%	0.286	S	S	*	.	G	3₁₀ helix	trans	-56.2	-33.2	173.4	-10	0	0	0	0	113.4	S859 L863	S859-S861 PolarHBondContact O-N 3.14Å; S859-S861 VanDerWaalsContact O-N 3.11Å; S859-S861 VanDerWaalsContact OG-CB 3.3Å; S859-S861 WeakPolarHBondContact OG-CB 3.44Å; S859-S861 PolarHBondContact OG-OG 2.6Å; S861-L863 PolarHBondContact O-N 2.94Å
862	D	71.6	Confident	75.3	Confident	76 Å²	76	55.8 Å²	55.8	41%	0.406	31%	0.306	S	S	.	.	G	3₁₀ helix	trans	-82.6	0.7	-169.8	-56.1	-43.5	0	0	0	113.3	T857 S859 I860	T857-D862 WeakPolarHBondContact CB-OD2 3.34Å; T857-D862 PolarHBondContact OG1-OD2 2.99Å; S859-D862 VanDerWaalsContact CB-OD2 3.23Å; S859-D862 WeakPolarHBondContact CB-OD2 3.49Å; S859-D862 PolarHBondContact O-N 2.83Å; S859-D862 VanDerWaalsContact O-N 3.11Å; S859-D862 PolarHBondContact OG-OD2 3.17Å; I860-D862 PolarHBondContact O-N 3.33Å
863	L	82	Confident	75.4	Confident	3 Å²	3	56.1 Å²	56.1	2%	0.016	31%	0.307	C	S	.	.	S	Bend	trans	-68.1	133.5	175.3	-67	175.9	0	0	0	111.9	I860 S861 T867 R868 L871 N936 A940	I860-L863 HydrophobicContact CG2-CD1 4.08Å; I860-L863 PolarHBondContact O-N 2.88Å; S861-L863 PolarHBondContact O-N 2.94Å; L863-T867 HydrophobicContact CD2-CG2 4.03Å; L863-R868 HydrophobicContact CB-CG 3.9Å; L863-R868 PolarHBondContact O-NE 2.74Å; L863-R868 PolarHBondContact O-NH2 3.36Å; L863-L871 HydrophobicContact CD1-CD1 3.84Å; L863-N936 HydrophobicContact CD2-CB 4Å; L863-A940 HydrophobicContact CD1-CB 3.78Å
864	T	85.3	Confident	76.2	Confident	22 Å²	22	56.1 Å²	56.1	14%	0.135	31%	0.306	C	S	.	.			trans	-61	153.6	178.6	66.6	0	0	0	0	111.9	S850 W851 R866 T867 R868	S850-T864 WeakPolarHBondContact O-CG2 3.44Å; W851-T864 WeakPolarHBondContact O-CG2 3.42Å; W851-T864 PolarHBondContact O-OG1 2.77Å; T864-R866 VanDerWaalsContact C-N 3.34Å; T864-R866 PolarHBondContact O-N 3.4Å; T864-R866 VanDerWaalsContact OG1-CG 3.29Å; T864-R866 WeakPolarHBondContact OG1-CG 3.47Å; T864-T867 PolarHBondContact O-N 3.36Å; T864-T867 VanDerWaalsContact O-N 3.07Å; T864-T867 VanDerWaalsContact OG1-CB 3.31Å; T864-T867 WeakPolarHBondContact OG1-CB 3.41Å; T864-T867 PolarHBondContact OG1-N 3.35Å; T864-T867 PolarHBondContact OG1-OG1 2.78Å; T864-R868 PolarHBondContact O-N 3.21Å
865	P	85.5	Confident	77.4	Confident	63 Å²	63	53 Å²	53	41%	0.409	29%	0.293	S	S	.	.	H	α-helix	trans	-58.5	-43.9	-178.9	-20.2	30.8	0	0	0	112.3	D819 T867 R868 L869	D819-P865 HydrophobicContact CB-CB 4.27Å; D819-P865 HydrophobicContact CB-CG 4.48Å; D819-P865 WeakPolarHBondContact OD1-CB 3.46Å; D819-P865 WeakPolarHBondContact OD1-CD 3.41Å; P865-T867 PolarHBondContact O-N 3.33Å; P865-R868 PolarHBondContact O-N 3.05Å; P865-L869 WeakPolarHBondContact O-CB 3.33Å; P865-L869 PolarHBondContact O-N 2.85Å
866	R	88.7	Confident	78.7	Confident	25 Å²	25	53.2 Å²	53.2	9%	0.094	30%	0.301	C	S	.	.	H	α-helix	trans	-57.3	-39.5	170.4	58.4	-169.9	167.1	-129.5	7.7	114.6	L818 D819 S850 W851 T864 L869 L870	L818-R866 HydrophobicContact CB-CB 3.77Å; L818-R866 HydrophobicContact CD1-CB 4.47Å; D819-R866 WeakPolarHBondContact OD1-CB 3.44Å; D819-R866 WeakPolarHBondContact OD1-CG 3.5Å; D819-R866 PolarHBondContact OD1-N 3.38Å; D819-R866 IonicContact OD2-CZ 2.83Å; D819-R866 IonicContact OD2-NE 3.77Å; D819-R866 IonicContact OD2-NH1 2.9Å; D819-R866 PolarHBondContact OD2-NH1 3.03Å; S850-R866 PolarHBondContact O-NH2 3.26Å; W851-R866 PolarHBondContact O-NE 2.98Å; W851-R866 VanDerWaalsContact O-NE 3.12Å; T864-R866 VanDerWaalsContact C-N 3.34Å; T864-R866 PolarHBondContact O-N 3.4Å; T864-R866 VanDerWaalsContact OG1-CG 3.29Å; T864-R866 WeakPolarHBondContact OG1-CG 3.47Å; R866-L869 WeakPolarHBondContact O-CB 3.48Å; R866-L869 PolarHBondContact O-N 2.83Å; R866-L870 WeakPolarHBondContact O-CG 3.26Å; R866-L870 PolarHBondContact O-N 3.43Å
867	T	88.9	Confident	79.4	Confident	0 Å²	0	49.1 Å²	49.1	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-72.5	-38.3	176.2	-66.4	0	0	0	0	111.8	W851 F852 L863 T864 P865 L869 L870 L871 L937	W851-T867 PolarHBondContact O-OG1 3.23Å; F852-T867 WeakPolarHBondContact CA-OG1 3.47Å; L863-T867 HydrophobicContact CD2-CG2 4.03Å; T864-T867 PolarHBondContact O-N 3.36Å; T864-T867 VanDerWaalsContact O-N 3.07Å; T864-T867 VanDerWaalsContact OG1-CB 3.31Å; T864-T867 WeakPolarHBondContact OG1-CB 3.41Å; T864-T867 PolarHBondContact OG1-N 3.35Å; T864-T867 PolarHBondContact OG1-OG1 2.78Å; P865-T867 PolarHBondContact O-N 3.33Å; T867-L869 VanDerWaalsContact C-N 3.27Å; T867-L869 PolarHBondContact O-N 3.15Å; T867-L870 PolarHBondContact O-N 3.2Å; T867-L871 PolarHBondContact O-N 3.44Å; T867-L937 HydrophobicContact CG2-CD1 3.65Å; T867-L937 HydrophobicContact CG2-CD2 4.48Å
868	R	88.7	Confident	79.8	Confident	128 Å²	128	49.1 Å²	49.1	48%	0.483	28%	0.279	S	S	.	.	H	α-helix	trans	-61.7	-34.7	169.4	-77.1	-178.9	-83.4	139.1	-9.7	112.2	L863 T864 P865 L871 A872	L863-R868 HydrophobicContact CB-CG 3.9Å; L863-R868 PolarHBondContact O-NE 2.74Å; L863-R868 PolarHBondContact O-NH2 3.36Å; T864-R868 PolarHBondContact O-N 3.21Å; P865-R868 PolarHBondContact O-N 3.05Å; R868-L871 PolarHBondContact O-N 3.43Å; R868-A872 WeakPolarHBondContact O-CB 3.28Å; R868-A872 PolarHBondContact O-N 3.23Å
869	L	89	Confident	79.7	Confident	29 Å²	29	43 Å²	43	15%	0.152	25%	0.251	C	S	.	.	H	α-helix	trans	-65.6	-41.8	172.3	178.9	63.1	0	0	0	112.2	L818 H823 P865 R866 T867 A872 I873	L818-L869 HydrophobicContact CB-CD2 4.36Å; L818-L869 HydrophobicContact CD2-CD2 4.09Å; L818-L869 WeakPolarHBondContact O-CD2 3.47Å; H823-L869 WeakPolarHBondContact NE2-CD2 3.1Å; P865-L869 WeakPolarHBondContact O-CB 3.33Å; P865-L869 PolarHBondContact O-N 2.85Å; R866-L869 WeakPolarHBondContact O-CB 3.48Å; R866-L869 PolarHBondContact O-N 2.83Å; T867-L869 VanDerWaalsContact C-N 3.27Å; T867-L869 PolarHBondContact O-N 3.15Å; L869-A872 PolarHBondContact O-N 3.43Å; L869-I873 HydrophobicContact CD1-CD1 4.43Å; L869-I873 HydrophobicContact CG-CD1 4.12Å; L869-I873 WeakPolarHBondContact O-CD1 3.44Å; L869-I873 VanDerWaalsContact O-CG1 3.26Å; L869-I873 WeakPolarHBondContact O-CG1 3.35Å; L869-I873 PolarHBondContact O-N 2.77Å
870	L	91.2	Very high	79.2	Confident	2 Å²	2	44.8 Å²	44.8	1%	0.01	26%	0.258	C	S	.	.	H	α-helix	trans	-61.7	-42.6	174.2	-68.6	171.7	0	0	0	111.9	V832 F852 R866 T867 I873 L874 C923 C926 L927	V832-L870 HydrophobicContact CG1-CD2 4Å; V832-L870 HydrophobicContact CG2-CD2 4.41Å; F852-L870 HydrophobicContact CE1-CD1 4.37Å; R866-L870 WeakPolarHBondContact O-CG 3.26Å; R866-L870 PolarHBondContact O-N 3.43Å; T867-L870 PolarHBondContact O-N 3.2Å; L870-I873 WeakPolarHBondContact O-CB 3.48Å; L870-I873 PolarHBondContact O-N 3.1Å; L870-L874 PolarHBondContact O-N 3.31Å; L870-C923 HydrophobicContact CD2-CB 4.24Å; L870-C923 PolarHBondContact O-SG 3.03Å; L870-C926 HydrophobicContact CD1-CB 3.71Å; L870-C926 HydrophobicContact CD2-CB 4.02Å; L870-L927 HydrophobicContact CB-CD2 4.01Å; L870-L927 HydrophobicContact CD1-CD2 4.32Å
871	L	90.9	Very high	78.2	Confident	6 Å²	6	43.4 Å²	43.4	3%	0.031	26%	0.257	C	S	.	.	H	α-helix	trans	-64.6	-42.2	174.2	-66.1	174.4	0	0	0	111.8	L863 T867 R868 I873 L874 D875 L937 A940 I941	L863-L871 HydrophobicContact CD1-CD1 3.84Å; T867-L871 PolarHBondContact O-N 3.44Å; R868-L871 PolarHBondContact O-N 3.43Å; L871-I873 VanDerWaalsContact C-N 3.31Å; L871-I873 PolarHBondContact O-N 3.27Å; L871-L874 WeakPolarHBondContact O-CB 3.43Å; L871-L874 PolarHBondContact O-N 3.17Å; L871-D875 WeakPolarHBondContact O-CB 3.3Å; L871-D875 PolarHBondContact O-N 3.04Å; L871-L937 HydrophobicContact CD1-CD1 4.4Å; L871-L937 HydrophobicContact CD2-CD1 4.11Å; L871-L937 HydrophobicContact CG-CD1 4.39Å; L871-A940 HydrophobicContact CD1-CB 3.95Å; L871-I941 HydrophobicContact CD2-CD1 4.24Å; L871-I941 HydrophobicContact CD2-CG1 3.68Å
872	A	88.8	Confident	76.9	Confident	50 Å²	50	43.1 Å²	43.1	41%	0.413	25%	0.254	S	S	.	.	H	α-helix	trans	-64	-33.6	175.3	0	0	0	0	0	113.1	R868 L869 D875 S876	R868-A872 WeakPolarHBondContact O-CB 3.28Å; R868-A872 PolarHBondContact O-N 3.23Å; L869-A872 PolarHBondContact O-N 3.43Å; A872-D875 PolarHBondContact O-N 3.26Å; A872-S876 WeakPolarHBondContact O-CB 3.46Å; A872-S876 PolarHBondContact O-N 2.66Å; A872-S876 PolarHBondContact O-OG 2.88Å
873	I	87.9	Confident	75	Confident	6 Å²	6	43.4 Å²	43.4	3%	0.031	26%	0.262	C	S	.	.	H	α-helix	trans	-62.4	-51.9	170.4	-70.9	158.5	0	0	0	109.5	V832 L869 L870 L871 D875 S876 C877 L919 C923	V832-I873 HydrophobicContact CG2-CD1 4.17Å; L869-I873 HydrophobicContact CD1-CD1 4.43Å; L869-I873 HydrophobicContact CG-CD1 4.12Å; L869-I873 WeakPolarHBondContact O-CD1 3.44Å; L869-I873 VanDerWaalsContact O-CG1 3.26Å; L869-I873 WeakPolarHBondContact O-CG1 3.35Å; L869-I873 PolarHBondContact O-N 2.77Å; L870-I873 WeakPolarHBondContact O-CB 3.48Å; L870-I873 PolarHBondContact O-N 3.1Å; L871-I873 VanDerWaalsContact C-N 3.31Å; L871-I873 PolarHBondContact O-N 3.27Å; I873-D875 VanDerWaalsContact C-N 3.28Å; I873-D875 PolarHBondContact O-N 3.42Å; I873-S876 PolarHBondContact O-N 3.03Å; I873-S876 PolarHBondContact O-OG 3.41Å; I873-C877 PolarHBondContact O-N 2.95Å; I873-C877 PolarHBondContact O-SG 2.99Å; I873-L919 HydrophobicContact CD1-CD1 3.87Å; I873-L919 HydrophobicContact CD1-CG 4.5Å; I873-L919 HydrophobicContact CG1-CD1 4.38Å; I873-L919 HydrophobicContact CG1-CD2 4.44Å; I873-L919 HydrophobicContact CG2-CD1 4.42Å; I873-L919 HydrophobicContact CG2-CD2 4.12Å; I873-L919 HydrophobicContact CG2-CG 3.89Å; I873-C923 HydrophobicContact CG2-CB 3.92Å
874	L	89.4	Confident	72.4	Confident	6 Å²	6	50.2 Å²	50.2	3%	0.031	29%	0.291	C	S	.	.	H	α-helix	trans	-55.6	-42.5	175.6	-179.1	63.6	0	0	0	112.2	L870 L871 S876 C877 L927 R947 R950 L951 F954	L870-L874 PolarHBondContact O-N 3.31Å; L871-L874 WeakPolarHBondContact O-CB 3.43Å; L871-L874 PolarHBondContact O-N 3.17Å; L874-S876 VanDerWaalsContact C-N 3.34Å; L874-S876 PolarHBondContact O-N 3.45Å; L874-C877 PolarHBondContact O-N 3.4Å; L874-L927 HydrophobicContact CD2-CD1 4.22Å; L874-R947 HydrophobicContact CD2-CB 4.32Å; L874-R947 HydrophobicContact CD2-CG 4.24Å; L874-R950 WeakPolarHBondContact O-CD 3.4Å; L874-R950 PolarHBondContact O-NE 3.39Å; L874-R950 PolarHBondContact O-NH1 3.15Å; L874-L951 HydrophobicContact CD1-CD2 3.93Å; L874-L951 HydrophobicContact CD1-CG 4.23Å; L874-L951 HydrophobicContact CD2-CD1 4.23Å; L874-L951 HydrophobicContact CD2-CD2 4.22Å; L874-L951 HydrophobicContact CD2-CG 4.12Å; L874-F954 HydrophobicContact CD1-CE2 4.22Å
875	D	88.2	Confident	69.6	Low	51 Å²	51	57 Å²	57	27%	0.273	32%	0.315	S	S	.	.	H	α-helix	trans	-70.5	-25.2	-178.5	-68.2	-26.2	0	0	0	114.3	L871 A872 I873 R947 R950	L871-D875 WeakPolarHBondContact O-CB 3.3Å; L871-D875 PolarHBondContact O-N 3.04Å; A872-D875 PolarHBondContact O-N 3.26Å; I873-D875 VanDerWaalsContact C-N 3.28Å; I873-D875 PolarHBondContact O-N 3.42Å; D875-R947 VanDerWaalsContact OD1-CG 3.25Å; D875-R947 WeakPolarHBondContact OD1-CG 3.45Å; D875-R947 IonicContact OD1-CZ 2.72Å; D875-R947 IonicContact OD1-NE 3.14Å; D875-R947 PolarHBondContact OD1-NE 2.89Å; D875-R947 IonicContact OD1-NH2 3.25Å; D875-R947 IonicContact OD2-CZ 2.95Å; D875-R947 IonicContact OD2-NE 2.77Å; D875-R947 PolarHBondContact OD2-NE 3.31Å; D875-R947 IonicContact OD2-NH2 3.8Å; D875-R947 PolarHBondContact OD2-NH2 2.88Å; D875-R950 VanDerWaalsContact C-NH1 3.28Å; D875-R950 PolarHBondContact O-NH1 3.4Å; D875-R950 PolarHBondContact O-NH2 3.34Å
876	S	82.8	Confident	66.8	Low	90 Å²	90	60.8 Å²	60.8	63%	0.629	33%	0.331	S	S	*	.	H	α-helix	trans	-83.9	-23.5	176.3	63.6	0	0	0	0	114.2	A872 I873 L874 S878	A872-S876 WeakPolarHBondContact O-CB 3.46Å; A872-S876 PolarHBondContact O-N 2.66Å; A872-S876 PolarHBondContact O-OG 2.88Å; I873-S876 PolarHBondContact O-N 3.03Å; I873-S876 PolarHBondContact O-OG 3.41Å; L874-S876 VanDerWaalsContact C-N 3.34Å; L874-S876 PolarHBondContact O-N 3.45Å; S876-S878 PolarHBondContact O-N 3.17Å
877	C	70.2	Confident	64	Low	15 Å²	15	65 Å²	65	10%	0.101	36%	0.362	C	S	.	.			trans	-81	117.7	-171.7	-66	0	0	0	0	113.5	I873 L874 I920 R950 F954	I873-C877 PolarHBondContact O-N 2.95Å; I873-C877 PolarHBondContact O-SG 2.99Å; L874-C877 PolarHBondContact O-N 3.4Å; C877-I920 HydrophobicContact CB-CD1 3.95Å; C877-I920 HydrophobicContact CB-CG1 4.12Å; C877-I920 WeakPolarHBondContact SG-CG1 3.42Å; C877-R950 WeakPolarHBondContact O-CD 3.32Å; C877-R950 PolarHBondContact O-NH1 2.93Å; C877-F954 HydrophobicContact CB-CZ 4.35Å
878	S	61.3	Low	61.1	Low	61 Å²	61	71.4 Å²	71.4	43%	0.427	40%	0.401	S	S	.	.			trans	-94.8	149.9	168.4	-169.1	0	0	0	0	111	S876 S881	S876-S878 PolarHBondContact O-N 3.17Å; S878-S881 PolarHBondContact O-OG 2.99Å
879	L	54.5	Low	58.2	Low	36 Å²	36	71.8 Å²	71.8	19%	0.188	41%	0.413	C	S	.	.	S	Bend	trans	-80.2	-23.9	179	-156.1	80.8	0	0	0	112.4	S881 C882 R953 F954	L879-S881 PolarHBondContact O-N 3.49Å; L879-S881 VanDerWaalsContact O-N 3.16Å; L879-C882 PolarHBondContact O-N 3.21Å; L879-R953 HydrophobicContact CD2-CB 4.35Å; L879-F954 HydrophobicContact CD1-CD1 3.66Å; L879-F954 HydrophobicContact CD1-CE1 3.76Å; L879-F954 HydrophobicContact CD1-CG 4.38Å
880	D	49.5	Very low	55.7	Low	79 Å²	79	76.5 Å²	76.5	42%	0.422	45%	0.445	S	S	.	.	H	α-helix	trans	-59	-27.7	-173.3	-83.3	41.6	0	0	0	114.4	C882 K884	D880-C882 VanDerWaalsContact C-N 3.25Å; D880-C882 PolarHBondContact O-N 2.77Å; D880-K884 HydrophobicContact CB-CD 4.44Å; D880-K884 WeakPolarHBondContact OD2-CE 3.41Å; D880-K884 IonicContact OD2-NZ 2.78Å; D880-K884 PolarHBondContact OD2-NZ 3.22Å
881	S	41.4	Very low	52.6	Low	69 Å²	69	80.7 Å²	80.7	48%	0.483	47%	0.474	S	S	.	.	H	α-helix	trans	-70.1	-19.1	178.1	48.1	0	0	0	0	113.7	S878 L879	S878-S881 PolarHBondContact O-OG 2.99Å; L879-S881 PolarHBondContact O-N 3.49Å; L879-S881 VanDerWaalsContact O-N 3.16Å
882	C	38.3	Very low	49.7	Very low	89 Å²	89	86.6 Å²	86.6	60%	0.601	51%	0.511	S	S	*	.	H	α-helix	trans	-99.9	-17.5	-178.1	-62.7	0	0	0	0	113.8	L879 D880	L879-C882 PolarHBondContact O-N 3.21Å; D880-C882 VanDerWaalsContact C-N 3.25Å; D880-C882 PolarHBondContact O-N 2.77Å
883	S	32.8	Very low	46.9	Very low	81 Å²	81	90.6 Å²	90.6	57%	0.566	53%	0.53	S	S	*	.	H	α-helix	trans	-110.9	-25.1	-169.6	57.6	0	0	0	0	115.2	R885	S883-R885 PolarHBondContact O-N 3.35Å
884	K	26.4	Very low	44.1	Very low	147 Å²	147	96.1 Å²	96.1	64%	0.639	56%	0.564	S	S	*	*			trans	-86.8	75.6	-172.3	-73.8	177.9	172.1	171.9	0	113.6	D880	D880-K884 HydrophobicContact CB-CD 4.44Å; D880-K884 WeakPolarHBondContact OD2-CE 3.41Å; D880-K884 IonicContact OD2-NZ 2.78Å; D880-K884 PolarHBondContact OD2-NZ 3.22Å
885	R	27.5	Very low	41.2	Very low	164 Å²	164	102.7 Å²	102.7	62%	0.619	60%	0.599	S	S	*	*			trans	-108.5	100.1	148.2	-79.2	-173.5	175.2	176.2	-0.6	108.5	S883 E961	S883-R885 PolarHBondContact O-N 3.35Å; R885-E961 IonicContact NH1-OE2 3.33Å
886	N	26.5	Very low	38.2	Very low	142 Å²	142	108 Å²	108	76%	0.759	62%	0.622	S	S	*	*			trans	-64.1	139	165.6	-73	3.1	0	0	0	108.3	V888	N886-V888 PolarHBondContact O-N 3.27Å
887	P	29.7	Very low	35.5	Very low	114 Å²	114	110.7 Å²	110.7	74%	0.74	63%	0.625	S	S	*	*			trans	-60.8	135	169.7	27	-33.4	0	0	0	109	N889	P887-N889 PolarHBondContact O-N 2.91Å
888	V	28.5	Very low	33.3	Very low	134 Å²	134	119.1 Å²	119.1	81%	0.812	66%	0.663	S	S	*	*			trans	-72	115.3	176.7	177.3	0	0	0	0	107.9	N886 P890	N886-V888 PolarHBondContact O-N 3.27Å; V888-P890 VanDerWaalsContact O-CD 3.26Å; V888-P890 WeakPolarHBondContact O-CD 3.42Å
889	N	27.5	Very low	31.6	Very low	137 Å²	137	124.4 Å²	124.4	73%	0.733	68%	0.681	S	S	*	*			trans	-61.1	116.4	173.4	-82.7	-6.7	0	0	0	109.6	P887 S891	P887-N889 PolarHBondContact O-N 2.91Å; N889-S891 VanDerWaalsContact C-N 3.32Å; N889-S891 PolarHBondContact O-N 3.47Å
890	P	36.2	Very low	30.2	Very low	127 Å²	127	132.1 Å²	132.1	83%	0.825	72%	0.716	S	S	*	*			trans	-88.2	65	-172.8	36.1	-34.7	0	0	0	111.2	V888	V888-P890 VanDerWaalsContact O-CD 3.26Å; V888-P890 WeakPolarHBondContact O-CD 3.42Å
891	S	27	Very low	29.1	Very low	90 Å²	90	133.6 Å²	133.6	63%	0.629	73%	0.732	S	S	*	*			trans	-157	80.3	179.7	58.8	0	0	0	0	114.7	N889	N889-S891 VanDerWaalsContact C-N 3.32Å; N889-S891 PolarHBondContact O-N 3.47Å
892	T	30.2	Very low	28.3	Very low	131 Å²	131	139 Å²	139	80%	0.804	76%	0.756	S	S	*	*				-175.8	97.9	129.9	18.9	0	0	0	0	108.9	T894	T892-T894 PolarHBondContact O-N 3.44Å
893	V	28.4	Very low	27.7	Very low	133 Å²	133	138 Å²	138	81%	0.806	76%	0.761	S	S	*	*			trans	-85.5	106.7	163.3	178.3	0	0	0	0	106.7
894	T	30.1	Very low	27.4	Very low	122 Å²	122	141.9 Å²	141.9	75%	0.748	78%	0.775	S	S	*	*			trans	-126.6	103.1	163.1	50.9	0	0	0	0	106.4	T892 E896	T892-T894 PolarHBondContact O-N 3.44Å; T894-E896 PolarHBondContact O-N 3.19Å
895	D	27.2	Very low	27.5	Very low	144 Å²	144	141.8 Å²	141.8	77%	0.77	79%	0.787	S	S	*	*			trans	-60.1	132.7	172.2	-59.8	-79.3	0	0	0	109.9
896	E	25.4	Very low	27.5	Very low	162 Å²	162	138.7 Å²	138.7	76%	0.757	79%	0.79	S	S	*	*				-167.8	158.9	125.6	-115.2	-174.1	-137.9	0	0	114.4	T894	T894-E896 PolarHBondContact O-N 3.19Å
897	Q	26.7	Very low	27.8	Very low	147 Å²	147	137.5 Å²	137.5	69%	0.687	79%	0.79	S	S	*	*			trans	58.9	92.5	158.9	-64.5	179.6	46.3	0	0	118.4	Q899	Q897-Q899 PolarHBondContact O-N 2.9Å
898	Q	23.9	Very low	28.1	Very low	192 Å²	192	134.4 Å²	134.4	90%	0.897	77%	0.771	S	S	*	*			trans	-62.1	123.5	157.4	-60.6	171.6	-1	0	0	110.6
899	Q	26.2	Very low	28.4	Very low	172 Å²	172	136.3 Å²	136.3	80%	0.804	77%	0.769	S	S	*	*			trans	-129.8	131.2	157.4	-69.8	-165.4	5	0	0	110.3	Q897	Q897-Q899 PolarHBondContact O-N 2.9Å
900	Q	23.8	Very low	28.9	Very low	198 Å²	198	134.5 Å²	134.5	93%	0.925	76%	0.759	S	S	*	*			trans	-88.4	118.9	-177.6	-64.5	174.3	-6.1	0	0	110
901	S	26.3	Very low	29	Very low	111 Å²	111	134.1 Å²	134.1	78%	0.776	75%	0.746	S	S	*	*			trans	-135.6	117.8	168.7	64.7	0	0	0	0	110.6	G903	S901-G903 PolarHBondContact O-N 3.48Å; S901-G903 VanDerWaalsContact O-N 3.14Å
902	N	25.4	Very low	29.9	Very low	182 Å²	182	133.8 Å²	133.8	97%	0.973	74%	0.74	S	S	*	*			trans	-64.1	111.7	-179.7	-70.2	-41.5	0	0	0	111.1
903	G	26	Very low	31.2	Very low	69 Å²	69	130.9 Å²	130.9	71%	0.711	72%	0.72	S	S	*	*			trans	-112	131.7	175.9	0	0	0	0	0	111.6	S901 V905	S901-G903 PolarHBondContact O-N 3.48Å; S901-G903 VanDerWaalsContact O-N 3.14Å; G903-V905 PolarHBondContact O-N 3.42Å
904	N	25.5	Very low	32.9	Very low	161 Å²	161	129.4 Å²	129.4	86%	0.861	71%	0.707	S	S	*	*			trans	-60.1	134.5	-175.9	-73.4	-43	0	0	0	112.7	S906	N904-S906 PolarHBondContact O-N 2.92Å
905	V	29.1	Very low	34.7	Very low	146 Å²	146	126 Å²	126	89%	0.885	68%	0.684	S	S	*	*			trans	-63.2	104.2	175	-178.9	0	0	0	0	109.5	G903	G903-V905 PolarHBondContact O-N 3.42Å
906	S	27.5	Very low	37	Very low	98 Å²	98	121.8 Å²	121.8	69%	0.685	66%	0.664	S	S	*	*	P	Polyproline II helix	trans	-72.2	139.6	169.2	-62.1	0	0	0	0	109.4	N904	N904-S906 PolarHBondContact O-N 2.92Å
907	P	32.1	Very low	39.5	Very low	117 Å²	117	116.6 Å²	116.6	76%	0.76	65%	0.645	S	S	*	*	P	Polyproline II helix	trans	-58.5	143.1	-178.6	24.6	-34.1	0	0	0	111.1	K909	P907-K909 PolarHBondContact O-N 3.49Å
908	S	35.9	Very low	41.9	Very low	50 Å²	50	114.9 Å²	114.9	35%	0.35	64%	0.637	S	S	.	*	P	Polyproline II helix	trans	-70.4	131	-164.4	82.4	0	0	0	0	111.7	N910 E911	S908-N910 PolarHBondContact O-N 3.25Å; S908-E911 PolarHBondContact O-N 3.37Å; S908-E911 WeakPolarHBondContact OG-CG 3.38Å; S908-E911 PolarHBondContact OG-OE2 3Å
909	K	36.8	Very low	44.9	Very low	173 Å²	173	107 Å²	107	75%	0.752	60%	0.601	S	S	*	*	H	α-helix	trans	-59.7	-13.7	176.6	-67.2	-178.5	178.5	176.9	0	113.5	P907 T912 N913	P907-K909 PolarHBondContact O-N 3.49Å; K909-T912 PolarHBondContact O-OG1 3.22Å; K909-N913 PolarHBondContact O-N 3.26Å; K909-N913 PolarHBondContact O-ND2 2.69Å; K909-N913 PolarHBondContact O-OD1 2.93Å
910	N	37	Very low	47.8	Very low	100 Å²	100	99.5 Å²	99.5	54%	0.535	57%	0.566	S	S	.	*	H	α-helix	trans	-76	-40.1	-179.3	-64.1	-17.5	0	0	0	111.9	S908 N913 N914	S908-N910 PolarHBondContact O-N 3.25Å; N910-N913 PolarHBondContact O-N 3.15Å; N910-N914 PolarHBondContact O-N 3.05Å; N910-N914 VanDerWaalsContact O-N 3.08Å
911	E	37.7	Very low	50.8	Low	119 Å²	119	91 Å²	91	56%	0.556	53%	0.528	S	S	*	.	H	α-helix	trans	-66.4	-44.9	-178.6	-71.5	164.8	126.6	0	0	111.4	S908 N913 N914 I915	S908-E911 PolarHBondContact O-N 3.37Å; S908-E911 WeakPolarHBondContact OG-CG 3.38Å; S908-E911 PolarHBondContact OG-OE2 3Å; E911-N913 VanDerWaalsContact C-N 3.29Å; E911-N913 PolarHBondContact O-N 3.08Å; E911-N914 PolarHBondContact O-N 3.2Å; E911-I915 WeakPolarHBondContact O-CG1 3.45Å; E911-I915 PolarHBondContact O-N 3.44Å
912	T	45.8	Very low	53.8	Low	82 Å²	82	85.8 Å²	85.8	50%	0.503	49%	0.492	S	S	.	.	H	α-helix	trans	-58	-41.4	174.8	48.6	0	0	0	0	112	K909 I915 T916	K909-T912 PolarHBondContact O-OG1 3.22Å; T912-I915 PolarHBondContact O-N 2.82Å; T912-T916 WeakPolarHBondContact O-CG2 3.33Å; T912-T916 PolarHBondContact O-N 3.18Å; T912-T916 PolarHBondContact O-OG1 2.81Å
913	N	58	Low	56.9	Low	71 Å²	71	77.2 Å²	77.2	38%	0.38	45%	0.446	S	S	.	.	H	α-helix	trans	-65.8	-45.7	180	-71.6	4.3	0	0	0	111.3	K909 N910 E911 I915 T916 S917	K909-N913 PolarHBondContact O-N 3.26Å; K909-N913 PolarHBondContact O-ND2 2.69Å; K909-N913 PolarHBondContact O-OD1 2.93Å; N910-N913 PolarHBondContact O-N 3.15Å; E911-N913 VanDerWaalsContact C-N 3.29Å; E911-N913 PolarHBondContact O-N 3.08Å; N913-I915 VanDerWaalsContact C-N 3.34Å; N913-I915 PolarHBondContact O-N 3.29Å; N913-T916 PolarHBondContact O-N 3.32Å; N913-T916 PolarHBondContact O-OG1 3.35Å; N913-S917 PolarHBondContact O-N 2.95Å
914	N	64.9	Low	60.1	Low	101 Å²	101	74.1 Å²	74.1	54%	0.54	41%	0.413	S	S	.	.	H	α-helix	trans	-60.3	-42.4	177.2	-69.5	-9.9	0	0	0	112	N910 E911 S917 H918	N910-N914 PolarHBondContact O-N 3.05Å; N910-N914 VanDerWaalsContact O-N 3.08Å; E911-N914 PolarHBondContact O-N 3.2Å; N914-S917 PolarHBondContact O-N 2.76Å; N914-H918 PolarHBondContact O-CD2 2.84Å; N914-H918 VanDerWaalsContact O-CD2 3.25Å; N914-H918 PolarHBondContact O-N 2.83Å
915	I	66.4	Low	63.3	Low	52 Å²	52	69.2 Å²	69.2	27%	0.267	38%	0.383	S	S	.	.	H	α-helix	trans	-60.8	-46.4	175.8	-66.6	164.4	0	0	0	110.7	E826 A829 E911 T912 N913 S917 H918 L919	E826-I915 HydrophobicContact CG-CD1 3.98Å; A829-I915 HydrophobicContact CB-CG2 3.86Å; E911-I915 WeakPolarHBondContact O-CG1 3.45Å; E911-I915 PolarHBondContact O-N 3.44Å; T912-I915 PolarHBondContact O-N 2.82Å; N913-I915 VanDerWaalsContact C-N 3.34Å; N913-I915 PolarHBondContact O-N 3.29Å; I915-S917 PolarHBondContact O-N 3.06Å; I915-H918 PolarHBondContact O-N 3.25Å; I915-L919 WeakPolarHBondContact O-CB 3.47Å; I915-L919 PolarHBondContact O-N 2.79Å
916	T	76.4	Confident	66.3	Low	55 Å²	55	62.2 Å²	62.2	34%	0.337	34%	0.341	S	S	.	.	H	α-helix	trans	-64.3	-38.9	177.7	58.3	0	0	0	0	112.8	T912 N913 L919 I920	T912-T916 WeakPolarHBondContact O-CG2 3.33Å; T912-T916 PolarHBondContact O-N 3.18Å; T912-T916 PolarHBondContact O-OG1 2.81Å; N913-T916 PolarHBondContact O-N 3.32Å; N913-T916 PolarHBondContact O-OG1 3.35Å; T916-L919 PolarHBondContact O-N 3.21Å; T916-I920 WeakPolarHBondContact O-CB 3.35Å; T916-I920 WeakPolarHBondContact O-CD1 3.28Å; T916-I920 WeakPolarHBondContact O-CG1 3.45Å; T916-I920 PolarHBondContact O-N 3.48Å
917	S	77	Confident	69.4	Low	53 Å²	53	57.6 Å²	57.6	37%	0.371	31%	0.308	S	S	.	.	H	α-helix	trans	-62.3	-49.9	176.7	-177.8	0	0	0	0	111.6	N913 N914 I915 L919 I920 T921	N913-S917 PolarHBondContact O-N 2.95Å; N914-S917 PolarHBondContact O-N 2.76Å; I915-S917 PolarHBondContact O-N 3.06Å; S917-L919 VanDerWaalsContact C-N 3.33Å; S917-L919 PolarHBondContact O-N 3Å; S917-I920 PolarHBondContact O-N 2.99Å; S917-T921 PolarHBondContact O-N 3.41Å; S917-T921 PolarHBondContact O-OG1 2.9Å
918	H	78.6	Confident	72.2	Confident	110 Å²	110	52.1 Å²	52.1	51%	0.509	27%	0.273	S	S	.	.	H	α-helix	trans	-61.9	-38.8	176.9	-76.5	-60.4	0	0	0	113.1	N914 I915 G922	N914-H918 PolarHBondContact O-CD2 2.84Å; N914-H918 VanDerWaalsContact O-CD2 3.25Å; N914-H918 PolarHBondContact O-N 2.83Å; I915-H918 PolarHBondContact O-N 3.25Å; H918-G922 PolarHBondContact O-N 3.43Å
919	L	86.5	Confident	74.8	Confident	26 Å²	26	51.9 Å²	51.9	14%	0.136	27%	0.266	C	S	.	.	H	α-helix	trans	-61.6	-45.2	174.7	-179.1	68.3	0	0	0	111.7	R828 A829 V832 I873 I915 T916 S917 C923	R828-L919 HydrophobicContact CG-CD1 4.06Å; A829-L919 HydrophobicContact CB-CB 3.99Å; A829-L919 HydrophobicContact CB-CD1 4.38Å; V832-L919 HydrophobicContact CB-CD1 4.14Å; V832-L919 HydrophobicContact CG1-CD1 4.37Å; V832-L919 HydrophobicContact CG2-CD1 4.16Å; I873-L919 HydrophobicContact CD1-CD1 3.87Å; I873-L919 HydrophobicContact CD1-CG 4.5Å; I873-L919 HydrophobicContact CG1-CD1 4.38Å; I873-L919 HydrophobicContact CG1-CD2 4.44Å; I873-L919 HydrophobicContact CG2-CD1 4.42Å; I873-L919 HydrophobicContact CG2-CD2 4.12Å; I873-L919 HydrophobicContact CG2-CG 3.89Å; I915-L919 WeakPolarHBondContact O-CB 3.47Å; I915-L919 PolarHBondContact O-N 2.79Å; T916-L919 PolarHBondContact O-N 3.21Å; S917-L919 VanDerWaalsContact C-N 3.33Å; S917-L919 PolarHBondContact O-N 3Å; L919-C923 WeakPolarHBondContact O-CB 3.18Å; L919-C923 PolarHBondContact O-N 2.94Å
920	I	87.3	Confident	77.3	Confident	15 Å²	15	43.7 Å²	43.7	8%	0.077	23%	0.23	C	C	.	.	H	α-helix	trans	-64.2	-50.8	178.2	-71.4	164.3	0	0	0	110.9	C877 T916 S917 G922 C923 I924 F954 L986	C877-I920 HydrophobicContact CB-CD1 3.95Å; C877-I920 HydrophobicContact CB-CG1 4.12Å; C877-I920 WeakPolarHBondContact SG-CG1 3.42Å; T916-I920 WeakPolarHBondContact O-CB 3.35Å; T916-I920 WeakPolarHBondContact O-CD1 3.28Å; T916-I920 WeakPolarHBondContact O-CG1 3.45Å; T916-I920 PolarHBondContact O-N 3.48Å; S917-I920 PolarHBondContact O-N 2.99Å; I920-G922 VanDerWaalsContact C-N 3.32Å; I920-G922 PolarHBondContact O-N 3.33Å; I920-C923 PolarHBondContact O-N 2.68Å; I920-I924 HydrophobicContact CG2-CD1 3.92Å; I920-I924 PolarHBondContact O-N 2.82Å; I920-F954 HydrophobicContact CD1-CE1 4.49Å; I920-F954 HydrophobicContact CG2-CD1 4.46Å; I920-F954 HydrophobicContact CG2-CE1 3.84Å; I920-F954 HydrophobicContact CG2-CZ 4.03Å; I920-L986 HydrophobicContact CG2-CD1 4.44Å
921	T	85.9	Confident	79.8	Confident	19 Å²	19	38.9 Å²	38.9	12%	0.117	20%	0.204	C	C	.	.	H	α-helix	trans	-65.2	-35.8	-178.5	-55.2	0	0	0	0	111.9	S917 R925 L986	S917-T921 PolarHBondContact O-N 3.41Å; S917-T921 PolarHBondContact O-OG1 2.9Å; T921-R925 VanDerWaalsContact O-CG 3.31Å; T921-R925 WeakPolarHBondContact O-CG 3.26Å; T921-R925 PolarHBondContact O-N 3.46Å; T921-L986 HydrophobicContact CG2-CD1 4.23Å
922	G	89	Confident	82.1	Confident	3 Å²	3	37.1 Å²	37.1	3%	0.031	20%	0.199	C	C	.	.	H	α-helix	trans	-63.4	-49.8	169.9	0	0	0	0	0	112.2	H918 I920 I924 R925 C926	H918-G922 PolarHBondContact O-N 3.43Å; I920-G922 VanDerWaalsContact C-N 3.32Å; I920-G922 PolarHBondContact O-N 3.33Å; G922-I924 PolarHBondContact O-N 3.16Å; G922-R925 PolarHBondContact O-N 3.4Å; G922-C926 PolarHBondContact O-N 3.49Å; G922-C926 PolarHBondContact O-SG 2.9Å; G922-C926 VanDerWaalsContact O-SG 3.37Å
923	C	92.2	Very high	84	Confident	2 Å²	2	35.9 Å²	35.9	1%	0.014	19%	0.187	C	C	.	.	H	α-helix	trans	-60.2	-44.9	-178.3	-174.2	0	0	0	0	112	V832 L870 I873 L919 I920 R925 C926 L927	V832-C923 HydrophobicContact CG1-CB 4.03Å; V832-C923 VanDerWaalsContact CG1-N 3.31Å; L870-C923 HydrophobicContact CD2-CB 4.24Å; L870-C923 PolarHBondContact O-SG 3.03Å; I873-C923 HydrophobicContact CG2-CB 3.92Å; L919-C923 WeakPolarHBondContact O-CB 3.18Å; L919-C923 PolarHBondContact O-N 2.94Å; I920-C923 PolarHBondContact O-N 2.68Å; C923-R925 VanDerWaalsContact C-N 3.33Å; C923-R925 PolarHBondContact O-N 2.89Å; C923-C926 WeakPolarHBondContact O-CB 3.04Å; C923-C926 PolarHBondContact O-N 2.71Å; C923-L927 WeakPolarHBondContact O-CG 3.38Å; C923-L927 PolarHBondContact O-N 3.27Å
924	I	92.8	Very high	85.3	Confident	3 Å²	3	32.6 Å²	32.6	2%	0.015	17%	0.17	C	C	.	.	H	α-helix	trans	-65.4	-34.4	178.6	-82.2	166.1	0	0	0	111.8	I920 G922 L927 A928 F954 L986 N989 V990 I993	I920-I924 HydrophobicContact CG2-CD1 3.92Å; I920-I924 PolarHBondContact O-N 2.82Å; G922-I924 PolarHBondContact O-N 3.16Å; I924-L927 PolarHBondContact O-N 2.98Å; I924-A928 VanDerWaalsContact O-CB 3.3Å; I924-A928 WeakPolarHBondContact O-CB 3.46Å; I924-A928 PolarHBondContact O-N 3.22Å; I924-F954 HydrophobicContact CD1-CD2 4.01Å; I924-F954 HydrophobicContact CD1-CE2 4.32Å; I924-F954 HydrophobicContact CD1-CG 4.16Å; I924-L986 HydrophobicContact CB-CD1 4.02Å; I924-L986 HydrophobicContact CD1-CD1 3.72Å; I924-L986 HydrophobicContact CD1-CG 4.35Å; I924-L986 HydrophobicContact CG1-CD1 4.46Å; I924-L986 HydrophobicContact CG2-CD1 3.9Å; I924-N989 HydrophobicContact CG2-CB 3.62Å; I924-V990 HydrophobicContact CD1-CG2 3.89Å; I924-V990 HydrophobicContact CG1-CG2 4.41Å; I924-V990 HydrophobicContact CG2-CG2 3.94Å; I924-I993 HydrophobicContact CB-CD1 4.5Å; I924-I993 HydrophobicContact CG1-CD1 4.38Å; I924-I993 HydrophobicContact CG2-CD1 4.14Å
925	R	91.7	Very high	86.3	Confident	58 Å²	58	29.8 Å²	29.8	22%	0.219	15%	0.154	C	C	.	.	H	α-helix	trans	-67.9	-41.9	172	-70.4	172.1	-172.5	-178.2	2.6	112.6	G836 T921 G922 C923 L927 F929	G836-R925 WeakPolarHBondContact O-CB 2.96Å; T921-R925 VanDerWaalsContact O-CG 3.31Å; T921-R925 WeakPolarHBondContact O-CG 3.26Å; T921-R925 PolarHBondContact O-N 3.46Å; G922-R925 PolarHBondContact O-N 3.4Å; C923-R925 VanDerWaalsContact C-N 3.33Å; C923-R925 PolarHBondContact O-N 2.89Å; R925-L927 VanDerWaalsContact C-N 3.34Å; R925-L927 PolarHBondContact O-N 3.2Å; R925-F929 PolarHBondContact O-N 2.68Å
926	C	92.3	Very high	87.2	Confident	0 Å²	0	27.6 Å²	27.6	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-58.2	-46.9	173.1	-65.9	0	0	0	0	111.5	G836 L839 F852 L870 G922 C923 G930	G836-C926 PolarHBondContact N-SG 3.42Å; L839-C926 HydrophobicContact CD1-CB 4.09Å; F852-C926 WeakPolarHBondContact CZ-O 3.47Å; L870-C926 HydrophobicContact CD1-CB 3.71Å; L870-C926 HydrophobicContact CD2-CB 4.02Å; G922-C926 PolarHBondContact O-N 3.49Å; G922-C926 PolarHBondContact O-SG 2.9Å; G922-C926 VanDerWaalsContact O-SG 3.37Å; C923-C926 WeakPolarHBondContact O-CB 3.04Å; C923-C926 PolarHBondContact O-N 2.71Å; C926-G930 PolarHBondContact O-N 2.95Å
927	L	93.2	Very high	87.8	Confident	0 Å²	0	25 Å²	25	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-68.6	-42.4	-178.6	-67.7	179.6	0	0	0	112.2	L870 L874 C923 I924 R925 F929 G930 T931 L937 I941 I993	L870-L927 HydrophobicContact CB-CD2 4.01Å; L870-L927 HydrophobicContact CD1-CD2 4.32Å; L874-L927 HydrophobicContact CD2-CD1 4.22Å; C923-L927 WeakPolarHBondContact O-CG 3.38Å; C923-L927 PolarHBondContact O-N 3.27Å; I924-L927 PolarHBondContact O-N 2.98Å; R925-L927 VanDerWaalsContact C-N 3.34Å; R925-L927 PolarHBondContact O-N 3.2Å; L927-F929 VanDerWaalsContact C-N 3.34Å; L927-F929 PolarHBondContact O-N 2.8Å; L927-G930 PolarHBondContact O-N 2.77Å; L927-G930 VanDerWaalsContact O-N 3.15Å; L927-T931 PolarHBondContact O-N 3.37Å; L927-T931 PolarHBondContact O-OG1 3.27Å; L927-L937 HydrophobicContact CD2-CD1 3.99Å; L927-L937 HydrophobicContact CD2-CD2 4.05Å; L927-L937 HydrophobicContact CD2-CG 4.49Å; L927-I941 HydrophobicContact CD1-CD1 4.42Å; L927-I941 HydrophobicContact CD2-CD1 4.22Å; L927-I993 HydrophobicContact CB-CD1 3.75Å; L927-I993 HydrophobicContact CB-CG1 4.19Å
928	A	91.8	Very high	88.4	Confident	3 Å²	3	24.4 Å²	24.4	3%	0.025	12%	0.117	C	C	.	.	H	α-helix	trans	-56.7	-46.9	178.1	0	0	0	0	0	111.9	I924 T931 N989 L992 I993	I924-A928 VanDerWaalsContact O-CB 3.3Å; I924-A928 WeakPolarHBondContact O-CB 3.46Å; I924-A928 PolarHBondContact O-N 3.22Å; A928-T931 PolarHBondContact O-OG1 3.31Å; A928-T931 VanDerWaalsContact O-OG1 3.12Å; A928-N989 HydrophobicContact CB-CB 4.01Å; A928-N989 WeakPolarHBondContact CB-OD1 3.32Å; A928-L992 HydrophobicContact CB-CB 4.24Å; A928-I993 VanDerWaalsContact CA-CG1 3.45Å; A928-I993 HydrophobicContact CB-CD1 4.44Å; A928-I993 HydrophobicContact CB-CG1 3.86Å
929	F	89.3	Confident	89	Confident	45 Å²	45	21.9 Å²	21.9	20%	0.197	10%	0.103	C	C	.	.	H	α-helix	trans	-70.9	-37.1	176	-166.2	-98.7	0	0	0	112.7	L839 P840 L848 R925 L927 H933	L839-F929 HydrophobicContact CB-CD1 3.88Å; L839-F929 HydrophobicContact CB-CE1 4.4Å; L839-F929 HydrophobicContact CB-CG 4.42Å; L839-F929 WeakPolarHBondContact O-CE1 3.48Å; L839-F929 WeakPolarHBondContact O-CZ 3.4Å; P840-F929 HydrophobicContact CB-CD2 4.23Å; P840-F929 HydrophobicContact CB-CE2 4.32Å; P840-F929 HydrophobicContact CG-CD2 4.17Å; P840-F929 HydrophobicContact CG-CG 4.43Å; L848-F929 HydrophobicContact CD1-CE1 3.64Å; L848-F929 HydrophobicContact CD1-CZ 4.06Å; L848-F929 HydrophobicContact CD2-CD1 4.39Å; L848-F929 HydrophobicContact CD2-CE1 3.71Å; L848-F929 HydrophobicContact CG-CE1 4.33Å; R925-F929 PolarHBondContact O-N 2.68Å; L927-F929 VanDerWaalsContact C-N 3.34Å; L927-F929 PolarHBondContact O-N 2.8Å; F929-H933 AromaticContact CD1-ND1 3.98Å; F929-H933 AromaticContact CE1-CE1 3.55Å; F929-H933 AromaticContact CE1-ND1 3.82Å; F929-H933 AromaticContact CE2-CE1 3.81Å; F929-H933 AromaticContact CZ-CE1 3.43Å; F929-H933 VanDerWaalsContact CZ-CE1 3.43Å; F929-H933 WeakPolarHBondContact CZ-CE1 3.35Å; F929-H933 PolarHBondContact O-ND1 3.39Å
930	G	88.6	Confident	89.1	Confident	0 Å²	0	20.8 Å²	20.8	0%	0	10%	0.098	C	C	.	.	H	α-helix	trans	-65.4	-41.6	178.6	0	0	0	0	0	113.9	F852 C926 L927 N932 H933 S934	F852-G930 VanDerWaalsContact CE2-CA 3.47Å; C926-G930 PolarHBondContact O-N 2.95Å; L927-G930 PolarHBondContact O-N 2.77Å; L927-G930 VanDerWaalsContact O-N 3.15Å; G930-N932 PolarHBondContact O-N 2.85Å; G930-H933 PolarHBondContact O-N 2.91Å; G930-S934 PolarHBondContact O-N 3.46Å
931	T	89.8	Confident	89.3	Confident	0 Å²	0	20 Å²	20	0%	0	9%	0.094	C	C	.	.	H	α-helix	trans	-65.8	-20.4	-178.4	45.4	0	0	0	0	114.3	L927 A928 H933 L937 R938 I941 I993	L927-T931 PolarHBondContact O-N 3.37Å; L927-T931 PolarHBondContact O-OG1 3.27Å; A928-T931 PolarHBondContact O-OG1 3.31Å; A928-T931 VanDerWaalsContact O-OG1 3.12Å; T931-H933 VanDerWaalsContact C-N 3.33Å; T931-L937 HydrophobicContact CG2-CD2 4.31Å; T931-L937 HydrophobicContact CG2-CG 4.1Å; T931-R938 HydrophobicContact CG2-CG 4.29Å; T931-R938 VanDerWaalsContact O-CD 3.26Å; T931-R938 WeakPolarHBondContact O-CD 3.25Å; T931-R938 WeakPolarHBondContact O-CG 2.99Å; T931-R938 PolarHBondContact O-NH1 3.02Å; T931-I941 HydrophobicContact CG2-CD1 3.77Å; T931-I993 HydrophobicContact CG2-CG2 4.23Å
932	N	86.8	Confident	89.5	Confident	82 Å²	82	19.1 Å²	19.1	44%	0.439	9%	0.089	S	C	.	.	H	α-helix	trans	-67.9	-34.9	170.2	-172.7	59.7	0	0	0	111.8	G930 R938 H996	G930-N932 PolarHBondContact O-N 2.85Å; N932-R938 PolarHBondContact O-NH1 2.82Å; N932-H996 PolarHBondContact OD1-CE1 3.4Å
933	H	84.7	Confident	89.6	Confident	56 Å²	56	22.2 Å²	22.2	26%	0.259	10%	0.104	S	C	.	.	H	α-helix	trans	-104.4	-31.8	-166.6	-60.3	99.6	0	0	0	114.7	N855 F929 G930 T931	N855-H933 PolarHBondContact ND2-O 3.2Å; N855-H933 PolarHBondContact OD1-O 2.99Å; F929-H933 AromaticContact CD1-ND1 3.98Å; F929-H933 AromaticContact CE1-CE1 3.55Å; F929-H933 AromaticContact CE1-ND1 3.82Å; F929-H933 AromaticContact CE2-CE1 3.81Å; F929-H933 AromaticContact CZ-CE1 3.43Å; F929-H933 VanDerWaalsContact CZ-CE1 3.43Å; F929-H933 WeakPolarHBondContact CZ-CE1 3.35Å; F929-H933 PolarHBondContact O-ND1 3.39Å; G930-H933 PolarHBondContact O-N 2.91Å; T931-H933 VanDerWaalsContact C-N 3.33Å
934	S	86.9	Confident	89.5	Confident	2 Å²	2	24.4 Å²	24.4	1%	0.014	12%	0.116	C	C	.	.			trans	-112.6	118.2	-178.8	178.9	0	0	0	0	111.7	N855 G930 L937 R938	N855-S934 VanDerWaalsContact OD1-CA 3.3Å; N855-S934 WeakPolarHBondContact OD1-CA 3.44Å; G930-S934 PolarHBondContact O-N 3.46Å; S934-L937 PolarHBondContact O-N 3.3Å; S934-L937 PolarHBondContact OG-N 2.92Å; S934-R938 PolarHBondContact O-N 3.21Å
935	I	85.4	Confident	89.5	Confident	42 Å²	42	30.8 Å²	30.8	22%	0.215	14%	0.14	C	C	.	.	H	α-helix	trans	-71.5	-35.9	176.1	-160.9	175.2	0	0	0	111.4	N855 L937 R938 Y939	N855-I935 HydrophobicContact CB-CG2 4.13Å; N855-I935 PolarHBondContact OD1-N 3.4Å; I935-L937 PolarHBondContact O-N 3.47Å; I935-R938 WeakPolarHBondContact O-CA 3.31Å; I935-R938 WeakPolarHBondContact O-CB 3.44Å; I935-R938 PolarHBondContact O-N 3.07Å; I935-Y939 HydrophobicContact CD1-CE2 3.87Å; I935-Y939 HydrophobicContact CG1-CD2 4.15Å; I935-Y939 HydrophobicContact CG1-CE2 3.66Å; I935-Y939 WeakPolarHBondContact O-CD2 3.29Å; I935-Y939 PolarHBondContact O-N 3.03Å
936	N	85.4	Confident	89.5	Confident	6 Å²	6	37.3 Å²	37.3	3%	0.032	16%	0.164	C	C	.	.	H	α-helix	trans	-60.9	-35.6	175.8	-66.4	20	0	0	0	111.6	T857 L863 R938 A940	T857-N936 PolarHBondContact O-ND2 3.3Å; T857-N936 PolarHBondContact O-OD1 2.84Å; L863-N936 HydrophobicContact CD2-CB 4Å; N936-R938 VanDerWaalsContact C-N 3.35Å; N936-A940 VanDerWaalsContact O-CB 3.28Å; N936-A940 WeakPolarHBondContact O-CB 3.48Å; N936-A940 PolarHBondContact O-N 2.81Å
937	L	89.1	Confident	89.5	Confident	0 Å²	0	39.4 Å²	39.4	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-69.8	-30.7	171.8	-174.5	56.4	0	0	0	112.5	F852 T867 L871 L927 T931 S934 I935 I941	F852-L937 HydrophobicContact CD1-CD2 3.69Å; F852-L937 HydrophobicContact CE1-CD2 4.14Å; F852-L937 HydrophobicContact CG-CD2 4.37Å; T867-L937 HydrophobicContact CG2-CD1 3.65Å; T867-L937 HydrophobicContact CG2-CD2 4.48Å; L871-L937 HydrophobicContact CD1-CD1 4.4Å; L871-L937 HydrophobicContact CD2-CD1 4.11Å; L871-L937 HydrophobicContact CG-CD1 4.39Å; L927-L937 HydrophobicContact CD2-CD1 3.99Å; L927-L937 HydrophobicContact CD2-CD2 4.05Å; L927-L937 HydrophobicContact CD2-CG 4.49Å; T931-L937 HydrophobicContact CG2-CD2 4.31Å; T931-L937 HydrophobicContact CG2-CG 4.1Å; S934-L937 PolarHBondContact O-N 3.3Å; S934-L937 PolarHBondContact OG-N 2.92Å; I935-L937 PolarHBondContact O-N 3.47Å; L937-I941 HydrophobicContact CD1-CD1 3.86Å; L937-I941 HydrophobicContact CD1-CG1 4.27Å; L937-I941 HydrophobicContact CG-CD1 4.01Å; L937-I941 WeakPolarHBondContact O-CG1 3.48Å; L937-I941 PolarHBondContact O-N 3.26Å
938	R	90.2	Very high	89.5	Confident	41 Å²	41	39.4 Å²	39.4	16%	0.155	17%	0.172	C	C	.	.	H	α-helix	trans	-67.4	-50.4	174.3	-65.6	-161.7	-72.1	-97.3	13.6	111.4	T931 N932 S934 I935 N936 I941 G942 H996 D1000	T931-R938 HydrophobicContact CG2-CG 4.29Å; T931-R938 VanDerWaalsContact O-CD 3.26Å; T931-R938 WeakPolarHBondContact O-CD 3.25Å; T931-R938 WeakPolarHBondContact O-CG 2.99Å; T931-R938 PolarHBondContact O-NH1 3.02Å; N932-R938 PolarHBondContact O-NH1 2.82Å; S934-R938 PolarHBondContact O-N 3.21Å; I935-R938 WeakPolarHBondContact O-CA 3.31Å; I935-R938 WeakPolarHBondContact O-CB 3.44Å; I935-R938 PolarHBondContact O-N 3.07Å; N936-R938 VanDerWaalsContact C-N 3.35Å; R938-I941 PolarHBondContact O-N 2.79Å; R938-G942 PolarHBondContact O-N 2.89Å; R938-H996 WeakPolarHBondContact CD-O 3.38Å; R938-D1000 IonicContact CZ-OD2 3.62Å; R938-D1000 IonicContact NE-OD2 2.77Å; R938-D1000 PolarHBondContact NE-OD2 3.37Å; R938-D1000 IonicContact NH2-OD2 2.72Å; R938-D1000 PolarHBondContact NH2-OD2 2.95Å
939	Y	89.8	Confident	89.5	Confident	56 Å²	56	42.4 Å²	42.4	22%	0.22	18%	0.183	C	C	.	.	H	α-helix	trans	-55.5	-53	174.3	-70.9	-56.2	0	0	0	111.5	I935 I941 G942 D943 D1000 T1001	I935-Y939 HydrophobicContact CD1-CE2 3.87Å; I935-Y939 HydrophobicContact CG1-CD2 4.15Å; I935-Y939 HydrophobicContact CG1-CE2 3.66Å; I935-Y939 WeakPolarHBondContact O-CD2 3.29Å; I935-Y939 PolarHBondContact O-N 3.03Å; Y939-I941 PolarHBondContact O-N 3.35Å; Y939-G942 PolarHBondContact O-N 3.18Å; Y939-D943 WeakPolarHBondContact CA-OD2 3.38Å; Y939-D943 WeakPolarHBondContact CB-OD2 3.48Å; Y939-D943 VanDerWaalsContact O-CB 3.31Å; Y939-D943 WeakPolarHBondContact O-CB 3.49Å; Y939-D943 PolarHBondContact O-N 3.2Å; Y939-D1000 WeakPolarHBondContact CE1-O 3.43Å; Y939-T1001 HydrophobicContact CD1-CG2 3.86Å; Y939-T1001 HydrophobicContact CE1-CG2 4.31Å
940	A	88.8	Confident	89.6	Confident	3 Å²	3	42.3 Å²	42.3	3%	0.025	18%	0.181	C	C	.	.	H	α-helix	trans	-60.6	-15.9	-179.9	0	0	0	0	0	115	L863 L871 N936 R947	L863-A940 HydrophobicContact CD1-CB 3.78Å; L871-A940 HydrophobicContact CD1-CB 3.95Å; N936-A940 VanDerWaalsContact O-CB 3.28Å; N936-A940 WeakPolarHBondContact O-CB 3.48Å; N936-A940 PolarHBondContact O-N 2.81Å; A940-R947 WeakPolarHBondContact O-CD 3.46Å; A940-R947 PolarHBondContact O-NH1 3.45Å
941	I	91.4	Very high	89.7	Confident	0 Å²	0	42.3 Å²	42.3	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-99.3	-45.9	173	-70	172.5	0	0	0	111.9	L871 L927 T931 L937 R938 Y939 V948 L951 I993	L871-I941 HydrophobicContact CD2-CD1 4.24Å; L871-I941 HydrophobicContact CD2-CG1 3.68Å; L927-I941 HydrophobicContact CD1-CD1 4.42Å; L927-I941 HydrophobicContact CD2-CD1 4.22Å; T931-I941 HydrophobicContact CG2-CD1 3.77Å; L937-I941 HydrophobicContact CD1-CD1 3.86Å; L937-I941 HydrophobicContact CD1-CG1 4.27Å; L937-I941 HydrophobicContact CG-CD1 4.01Å; L937-I941 WeakPolarHBondContact O-CG1 3.48Å; L937-I941 PolarHBondContact O-N 3.26Å; R938-I941 PolarHBondContact O-N 2.79Å; Y939-I941 PolarHBondContact O-N 3.35Å; I941-V948 VanDerWaalsContact O-CG2 3.3Å; I941-V948 WeakPolarHBondContact O-CG2 3.33Å; I941-L951 HydrophobicContact CG2-CD1 3.4Å; I941-L951 VanDerWaalsContact CG2-CD1 3.4Å; I941-I993 HydrophobicContact CD1-CG2 4.2Å; I941-I993 HydrophobicContact CG2-CG2 4.05Å
942	G	90.8	Very high	89.8	Confident	0 Å²	0	42.6 Å²	42.6	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-76.4	-34.5	-171.8	0	0	0	0	0	114.3	R938 Y939 V948 H1006	R938-G942 PolarHBondContact O-N 2.89Å; Y939-G942 PolarHBondContact O-N 3.18Å; G942-V948 VanDerWaalsContact O-CG2 3.29Å; G942-V948 WeakPolarHBondContact O-CG2 3.4Å; G942-H1006 PolarHBondContact O-CE1 3.47Å; G942-H1006 PolarHBondContact O-ND1 3.47Å
943	D	90.7	Very high	89.9	Confident	68 Å²	68	43.1 Å²	43.1	36%	0.364	18%	0.18	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.6	-23.3	-177.3	-54.1	-18.7	0	0	0	111.7	Y939 R945 P1002 H1006	Y939-D943 WeakPolarHBondContact CA-OD2 3.38Å; Y939-D943 WeakPolarHBondContact CB-OD2 3.48Å; Y939-D943 VanDerWaalsContact O-CB 3.31Å; Y939-D943 WeakPolarHBondContact O-CB 3.49Å; Y939-D943 PolarHBondContact O-N 3.2Å; D943-R945 PolarHBondContact O-N 3.12Å; D943-P1002 WeakPolarHBondContact OD1-CD 3.25Å; D943-H1006 PolarHBondContact O-CE1 2.98Å
944	D	91	Very high	90.1	Very high	48 Å²	48	40.9 Å²	40.9	26%	0.257	17%	0.169	S	C	.	.			trans	-86.9	99.4	171	-174.8	0.4	0	0	0	111.3	R946 R947 V948	D944-R946 PolarHBondContact O-N 3.31Å; D944-R946 WeakPolarHBondContact OD1-CA 3.36Å; D944-R946 WeakPolarHBondContact OD1-CB 3.29Å; D944-R946 WeakPolarHBondContact OD1-CG 3.35Å; D944-R946 PolarHBondContact OD1-N 2.81Å; D944-R947 HydrophobicContact CB-CB 4.09Å; D944-R947 HydrophobicContact CB-CG 4.1Å; D944-R947 PolarHBondContact O-N 2.76Å; D944-R947 WeakPolarHBondContact OD2-CG 3.49Å; D944-R947 IonicContact OD2-NE 2.72Å; D944-V948 PolarHBondContact O-N 3.41Å
945	R	92.7	Very high	90.2	Very high	137 Å²	137	40.8 Å²	40.8	52%	0.517	17%	0.168	S	C	.	.	H	α-helix	trans	-45.8	-31.7	170.3	-167.6	175.2	-175.3	-170.1	3.6	113.9	D943 R949 H1006	D943-R945 PolarHBondContact O-N 3.12Å; R945-R949 VanDerWaalsContact O-CB 3.28Å; R945-R949 WeakPolarHBondContact O-CB 3.44Å; R945-R949 VanDerWaalsContact O-CG 3.26Å; R945-R949 WeakPolarHBondContact O-CG 3.48Å; R945-R949 PolarHBondContact O-N 2.71Å; R945-R949 VanDerWaalsContact O-N 3.11Å; R945-H1006 HydrophobicContact CB-CB 4.25Å; R945-H1006 HydrophobicContact CG-CB 3.97Å
946	R	91.3	Very high	90.2	Very high	194 Å²	194	43.9 Å²	43.9	73%	0.732	18%	0.177	S	C	*	.	H	α-helix	trans	-73.5	-40.9	177.3	-58.1	177.5	169.2	-169.8	-2.2	111.9	D944 R950	D944-R946 PolarHBondContact O-N 3.31Å; D944-R946 WeakPolarHBondContact OD1-CA 3.36Å; D944-R946 WeakPolarHBondContact OD1-CB 3.29Å; D944-R946 WeakPolarHBondContact OD1-CG 3.35Å; D944-R946 PolarHBondContact OD1-N 2.81Å; R946-R950 VanDerWaalsContact O-CB 3.25Å; R946-R950 WeakPolarHBondContact O-CB 3.22Å; R946-R950 PolarHBondContact O-N 3.08Å; R946-R950 VanDerWaalsContact O-N 3.14Å
947	R	91.9	Very high	90	Very high	44 Å²	44	44.4 Å²	44.4	17%	0.166	18%	0.182	C	C	.	.	H	α-helix	trans	-67.9	-50.1	175.2	-73.8	174.5	-176.5	151.3	5.5	110.8	L874 D875 A940 D944 R949 R950 L951	L874-R947 HydrophobicContact CD2-CB 4.32Å; L874-R947 HydrophobicContact CD2-CG 4.24Å; D875-R947 VanDerWaalsContact OD1-CG 3.25Å; D875-R947 WeakPolarHBondContact OD1-CG 3.45Å; D875-R947 IonicContact OD1-CZ 2.72Å; D875-R947 IonicContact OD1-NE 3.14Å; D875-R947 PolarHBondContact OD1-NE 2.89Å; D875-R947 IonicContact OD1-NH2 3.25Å; D875-R947 IonicContact OD2-CZ 2.95Å; D875-R947 IonicContact OD2-NE 2.77Å; D875-R947 PolarHBondContact OD2-NE 3.31Å; D875-R947 IonicContact OD2-NH2 3.8Å; D875-R947 PolarHBondContact OD2-NH2 2.88Å; A940-R947 WeakPolarHBondContact O-CD 3.46Å; A940-R947 PolarHBondContact O-NH1 3.45Å; D944-R947 HydrophobicContact CB-CB 4.09Å; D944-R947 HydrophobicContact CB-CG 4.1Å; D944-R947 PolarHBondContact O-N 2.76Å; D944-R947 WeakPolarHBondContact OD2-CG 3.49Å; D944-R947 IonicContact OD2-NE 2.72Å; R947-R949 PolarHBondContact O-N 2.9Å; R947-R950 WeakPolarHBondContact O-CA 3.46Å; R947-R950 WeakPolarHBondContact O-CB 3.32Å; R947-R950 PolarHBondContact O-N 2.83Å; R947-L951 PolarHBondContact O-N 2.93Å
948	V	93.3	Very high	89.5	Confident	0 Å²	0	48.6 Å²	48.6	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-52.1	-53.9	174.8	172	0	0	0	0	111.8	I941 G942 D944 R950 L951 A952 L1003 H1006 L1007	I941-V948 VanDerWaalsContact O-CG2 3.3Å; I941-V948 WeakPolarHBondContact O-CG2 3.33Å; G942-V948 VanDerWaalsContact O-CG2 3.29Å; G942-V948 WeakPolarHBondContact O-CG2 3.4Å; D944-V948 PolarHBondContact O-N 3.41Å; V948-R950 PolarHBondContact O-N 3.09Å; V948-L951 PolarHBondContact O-N 3.15Å; V948-A952 PolarHBondContact O-N 2.7Å; V948-L1003 HydrophobicContact CG1-CG 3.89Å; V948-L1003 HydrophobicContact CG2-CB 4.28Å; V948-L1003 HydrophobicContact CG2-CD1 4.32Å; V948-L1003 HydrophobicContact CG2-CG 4.05Å; V948-H1006 HydrophobicContact CB-CB 4.17Å; V948-H1006 HydrophobicContact CG1-CB 3.92Å; V948-H1006 HydrophobicContact CG2-CB 4.39Å; V948-L1007 HydrophobicContact CG1-CD1 4.17Å; V948-L1007 HydrophobicContact CG1-CD2 3.58Å; V948-L1007 HydrophobicContact CG1-CG 3.54Å
949	R	92.3	Very high	88.5	Confident	66 Å²	66	49.6 Å²	49.6	25%	0.249	21%	0.206	C	C	.	.	H	α-helix	trans	-69.2	-12	179	-70.4	-176.6	-179.8	-131.7	-13.7	114	R945 R947 R953 H1006 Q1008 T1010	R945-R949 VanDerWaalsContact O-CB 3.28Å; R945-R949 WeakPolarHBondContact O-CB 3.44Å; R945-R949 VanDerWaalsContact O-CG 3.26Å; R945-R949 WeakPolarHBondContact O-CG 3.48Å; R945-R949 PolarHBondContact O-N 2.71Å; R945-R949 VanDerWaalsContact O-N 3.11Å; R947-R949 PolarHBondContact O-N 2.9Å; R949-R953 PolarHBondContact O-NE 3.39Å; R949-R953 PolarHBondContact O-NH2 3.11Å; R949-H1006 PolarHBondContact NE-O 3.34Å; R949-H1006 PolarHBondContact NH2-O 2.96Å; R949-Q1008 PolarHBondContact NH2-O 2.94Å; R949-T1010 HydrophobicContact CG-CG2 4.42Å
950	R	89.9	Confident	87	Confident	43 Å²	43	50.3 Å²	50.3	16%	0.162	22%	0.219	C	C	.	.	H	α-helix	trans	-89	-43.8	173.8	-167.7	-173.3	-56.4	-136.5	19.8	111.3	L874 D875 C877 R946 R947 V948 R953 F954	L874-R950 WeakPolarHBondContact O-CD 3.4Å; L874-R950 PolarHBondContact O-NE 3.39Å; L874-R950 PolarHBondContact O-NH1 3.15Å; D875-R950 VanDerWaalsContact C-NH1 3.28Å; D875-R950 PolarHBondContact O-NH1 3.4Å; D875-R950 PolarHBondContact O-NH2 3.34Å; C877-R950 WeakPolarHBondContact O-CD 3.32Å; C877-R950 PolarHBondContact O-NH1 2.93Å; R946-R950 VanDerWaalsContact O-CB 3.25Å; R946-R950 WeakPolarHBondContact O-CB 3.22Å; R946-R950 PolarHBondContact O-N 3.08Å; R946-R950 VanDerWaalsContact O-N 3.14Å; R947-R950 WeakPolarHBondContact O-CA 3.46Å; R947-R950 WeakPolarHBondContact O-CB 3.32Å; R947-R950 PolarHBondContact O-N 2.83Å; V948-R950 PolarHBondContact O-N 3.09Å; R950-R953 VanDerWaalsContact CA-NH2 3.34Å; R950-R953 WeakPolarHBondContact O-CB 3.49Å; R950-R953 PolarHBondContact O-N 3.01Å; R950-F954 HydrophobicContact CG-CE2 4.17Å; R950-F954 VanDerWaalsContact O-CD2 3.28Å; R950-F954 WeakPolarHBondContact O-CD2 3.32Å; R950-F954 PolarHBondContact O-N 2.86Å
951	L	92	Very high	85	Confident	0 Å²	0	56 Å²	56	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-55.8	-52.2	171	-74.3	165.9	0	0	0	110.8	L874 I941 R947 V948 R953 F954 V990 I993 L994	L874-L951 HydrophobicContact CD1-CD2 3.93Å; L874-L951 HydrophobicContact CD1-CG 4.23Å; L874-L951 HydrophobicContact CD2-CD1 4.23Å; L874-L951 HydrophobicContact CD2-CD2 4.22Å; L874-L951 HydrophobicContact CD2-CG 4.12Å; I941-L951 HydrophobicContact CG2-CD1 3.4Å; I941-L951 VanDerWaalsContact CG2-CD1 3.4Å; R947-L951 PolarHBondContact O-N 2.93Å; V948-L951 PolarHBondContact O-N 3.15Å; L951-R953 PolarHBondContact O-N 3.09Å; L951-R953 VanDerWaalsContact O-N 3.09Å; L951-F954 WeakPolarHBondContact O-CB 3.38Å; L951-F954 PolarHBondContact O-N 2.9Å; L951-V990 HydrophobicContact CB-CG1 4.4Å; L951-V990 VanDerWaalsContact O-CG1 3.22Å; L951-V990 WeakPolarHBondContact O-CG1 3.47Å; L951-I993 HydrophobicContact CD1-CG2 3.68Å; L951-I993 HydrophobicContact CD2-CD1 3.9Å; L951-I993 HydrophobicContact CD2-CG2 4.42Å; L951-L994 HydrophobicContact CB-CD2 3.95Å; L951-L994 HydrophobicContact CB-CG 4.39Å; L951-L994 HydrophobicContact CD1-CD2 4.25Å
952	A	91.7	Very high	82.8	Confident	6 Å²	6	63.4 Å²	63.4	5%	0.05	28%	0.275	C	S	.	.	H	α-helix	trans	-57.4	-29.4	178.4	0	0	0	0	0	113.9	V948 F954 I955 L994 L1007 V1012	V948-A952 PolarHBondContact O-N 2.7Å; A952-F954 VanDerWaalsContact C-N 3.33Å; A952-F954 PolarHBondContact O-N 3.29Å; A952-I955 HydrophobicContact CB-CD1 4.34Å; A952-I955 VanDerWaalsContact O-CB 3.29Å; A952-I955 WeakPolarHBondContact O-CB 3.48Å; A952-I955 WeakPolarHBondContact O-CD1 3.3Å; A952-I955 WeakPolarHBondContact O-CG1 3.43Å; A952-I955 PolarHBondContact O-N 3.47Å; A952-L994 HydrophobicContact CB-CD1 4.44Å; A952-L1007 HydrophobicContact CB-CD2 3.61Å; A952-V1012 HydrophobicContact CB-CG2 4.03Å
953	R	89.7	Confident	80.4	Confident	94 Å²	94	68.1 Å²	68.1	36%	0.355	30%	0.303	S	S	.	.	H	α-helix	trans	-69.6	-26.5	174.8	-85.9	178.2	-73.3	139.5	-5	113.7	L879 R949 R950 L951 I955 R956	L879-R953 HydrophobicContact CD2-CB 4.35Å; R949-R953 PolarHBondContact O-NE 3.39Å; R949-R953 PolarHBondContact O-NH2 3.11Å; R950-R953 VanDerWaalsContact CA-NH2 3.34Å; R950-R953 WeakPolarHBondContact O-CB 3.49Å; R950-R953 PolarHBondContact O-N 3.01Å; L951-R953 PolarHBondContact O-N 3.09Å; L951-R953 VanDerWaalsContact O-N 3.09Å; R953-I955 PolarHBondContact O-N 3.28Å; R953-R956 PolarHBondContact O-N 2.8Å
954	F	89.2	Confident	78	Confident	8 Å²	8	70.5 Å²	70.5	4%	0.035	32%	0.315	C	S	.	.	H	α-helix	trans	-71.5	-12.4	174.1	-71.4	-70.7	0	0	0	113.4	L874 C877 L879 I920 I924 R950 L951 A952 R956 A957 L986 V990	L874-F954 HydrophobicContact CD1-CE2 4.22Å; C877-F954 HydrophobicContact CB-CZ 4.35Å; L879-F954 HydrophobicContact CD1-CD1 3.66Å; L879-F954 HydrophobicContact CD1-CE1 3.76Å; L879-F954 HydrophobicContact CD1-CG 4.38Å; I920-F954 HydrophobicContact CD1-CE1 4.49Å; I920-F954 HydrophobicContact CG2-CD1 4.46Å; I920-F954 HydrophobicContact CG2-CE1 3.84Å; I920-F954 HydrophobicContact CG2-CZ 4.03Å; I924-F954 HydrophobicContact CD1-CD2 4.01Å; I924-F954 HydrophobicContact CD1-CE2 4.32Å; I924-F954 HydrophobicContact CD1-CG 4.16Å; R950-F954 HydrophobicContact CG-CE2 4.17Å; R950-F954 VanDerWaalsContact O-CD2 3.28Å; R950-F954 WeakPolarHBondContact O-CD2 3.32Å; R950-F954 PolarHBondContact O-N 2.86Å; L951-F954 WeakPolarHBondContact O-CB 3.38Å; L951-F954 PolarHBondContact O-N 2.9Å; A952-F954 VanDerWaalsContact C-N 3.33Å; A952-F954 PolarHBondContact O-N 3.29Å; F954-R956 PolarHBondContact O-N 2.9Å; F954-A957 WeakPolarHBondContact O-CB 3.37Å; F954-A957 PolarHBondContact O-N 3.02Å; F954-L986 HydrophobicContact CD1-CD2 4.26Å; F954-V990 HydrophobicContact CB-CG2 3.86Å
955	I	87.9	Confident	75.1	Confident	0 Å²	0	75.7 Å²	75.7	0%	0	34%	0.338	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.4	-25.1	169.4	-59.1	168.3	0	0	0	111	A952 R953 R982 V990 L994 V1012 D1015 L1016 L1019	A952-I955 HydrophobicContact CB-CD1 4.34Å; A952-I955 VanDerWaalsContact O-CB 3.29Å; A952-I955 WeakPolarHBondContact O-CB 3.48Å; A952-I955 WeakPolarHBondContact O-CD1 3.3Å; A952-I955 WeakPolarHBondContact O-CG1 3.43Å; A952-I955 PolarHBondContact O-N 3.47Å; R953-I955 PolarHBondContact O-N 3.28Å; I955-R982 PolarHBondContact O-NH1 3.01Å; I955-V990 HydrophobicContact CD1-CG1 4.42Å; I955-V990 HydrophobicContact CG1-CG1 3.78Å; I955-L994 HydrophobicContact CD1-CD1 4.17Å; I955-V1012 HydrophobicContact CD1-CG2 3.95Å; I955-D1015 HydrophobicContact CB-CB 4.47Å; I955-D1015 HydrophobicContact CG2-CB 3.91Å; I955-L1016 HydrophobicContact CD1-CD2 3.84Å; I955-L1016 HydrophobicContact CD1-CG 4.16Å; I955-L1016 HydrophobicContact CG2-CD2 4.21Å; I955-L1019 HydrophobicContact CG2-CB 4.4Å; I955-L1019 HydrophobicContact CG2-CD2 4.12Å
956	R	85	Confident	72.1	Confident	108 Å²	108	73.4 Å²	73.4	41%	0.408	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.3	3.8	175.3	-50.2	-178.8	-162.6	-172.2	-1	113.5	R953 F954 R958 S1011 D1015	R953-R956 PolarHBondContact O-N 2.8Å; F954-R956 PolarHBondContact O-N 2.9Å; R956-R958 WeakPolarHBondContact O-CG 3.32Å; R956-R958 PolarHBondContact O-N 3.45Å; R956-S1011 PolarHBondContact NH2-OG 2.97Å; R956-D1015 IonicContact CZ-OD1 2.66Å; R956-D1015 IonicContact CZ-OD2 2.66Å; R956-D1015 IonicContact NE-OD1 2.69Å; R956-D1015 PolarHBondContact NE-OD1 3.42Å; R956-D1015 IonicContact NE-OD2 3.41Å; R956-D1015 PolarHBondContact NE-OD2 3.37Å; R956-D1015 IonicContact NH2-OD1 2.64Å; R956-D1015 PolarHBondContact NH2-OD1 2.96Å; R956-D1015 IonicContact NH2-OD2 3.46Å; R956-D1015 PolarHBondContact NH2-OD2 3.32Å
957	A	81.2	Confident	69.5	Low	16 Å²	16	70.7 Å²	70.7	13%	0.132	35%	0.351	C	S	.	.			trans	-64.3	134.1	-179.7	0	0	0	0	0	110.7	F954 R982 D983 L986	F954-A957 WeakPolarHBondContact O-CB 3.37Å; F954-A957 PolarHBondContact O-N 3.02Å; A957-R982 WeakPolarHBondContact O-CA 3.45Å; A957-D983 PolarHBondContact O-N 3.16Å; A957-L986 HydrophobicContact CB-CD2 3.75Å
958	R	78.6	Confident	66.6	Low	88 Å²	88	73.4 Å²	73.4	33%	0.332	38%	0.376	S	S	.	.	B	Isolated β-bridge	trans	-127.7	143	-172.9	-66	-108.1	172.2	108.2	-17.5	109.1	R956 P980 P981 R982 E1022	R956-R958 WeakPolarHBondContact O-CG 3.32Å; R956-R958 PolarHBondContact O-N 3.45Å; R958-P980 HydrophobicContact CB-CG 4.27Å; R958-P980 WeakPolarHBondContact CD-O 3.46Å; R958-P981 CarbonylContact C-O 3.32Å; R958-P981 WeakPolarHBondContact CA-O 3.49Å; R958-R982 HydrophobicContact CG-CG 4.38Å; R958-E1022 IonicContact CZ-OE2 2.73Å; R958-E1022 IonicContact NE-OE2 2.89Å; R958-E1022 VanDerWaalsContact NH2-CD 3.34Å; R958-E1022 IonicContact NH2-OE1 3.16Å; R958-E1022 PolarHBondContact NH2-OE1 3.21Å; R958-E1022 IonicContact NH2-OE2 2.68Å; R958-E1022 PolarHBondContact NH2-OE2 3.21Å
959	L	68.8	Low	63.7	Low	62 Å²	62	81.8 Å²	81.8	33%	0.325	42%	0.42	S	S	.	.			trans	-70.8	148.4	-175.6	-67.7	170.6	0	0	0	110.9	P980 P981 D983	L959-P980 VanDerWaalsContact O-CB 3.29Å; L959-P980 WeakPolarHBondContact O-CB 3.46Å; L959-P981 HydrophobicContact CB-CG 4.47Å; L959-P981 HydrophobicContact CD1-CG 4.2Å; L959-P981 PolarHBondContact N-O 3.47Å; L959-D983 HydrophobicContact CD2-CB 3.84Å; L959-D983 HydrophobicContact CG-CB 4.19Å
960	S	59.9	Low	60.5	Low	71 Å²	71	84 Å²	84	50%	0.497	44%	0.444	S	S	.	.			trans	-71.7	139.6	174.9	-169.7	0	0	0	0	111	Y962 T963	S960-Y962 PolarHBondContact O-N 3.33Å; S960-Y962 VanDerWaalsContact O-N 3.11Å; S960-T963 WeakPolarHBondContact O-CB 3.4Å; S960-T963 PolarHBondContact O-N 3.05Å; S960-T963 PolarHBondContact O-OG1 3.46Å
961	E	47.1	Very low	57.8	Low	123 Å²	123	92.2 Å²	92.2	58%	0.575	48%	0.481	S	S	*	.	G	3₁₀ helix	trans	-52.7	-35.2	179.8	-60.8	167.7	135.8	0	0	112.9	R885 T963 L964	R885-E961 IonicContact NH1-OE2 3.33Å; E961-T963 PolarHBondContact O-N 3.49Å; E961-L964 PolarHBondContact O-N 2.88Å
962	Y	44.1	Very low	54.9	Low	156 Å²	156	99.4 Å²	99.4	61%	0.612	52%	0.519	S	S	*	.	G	3₁₀ helix	trans	-64.6	-19.9	178.9	-83.7	-90.2	0	0	0	114	S960 L964	S960-Y962 PolarHBondContact O-N 3.33Å; S960-Y962 VanDerWaalsContact O-N 3.11Å; Y962-L964 PolarHBondContact O-N 3.28Å
963	T	41.1	Very low	52.1	Low	98 Å²	98	104.4 Å²	104.4	60%	0.601	55%	0.553	S	S	*	*	G	3₁₀ helix	trans	-68.2	-13.9	177.5	-27.1	0	0	0	0	112.9	S960 E961	S960-T963 WeakPolarHBondContact O-CB 3.4Å; S960-T963 PolarHBondContact O-N 3.05Å; S960-T963 PolarHBondContact O-OG1 3.46Å; E961-T963 PolarHBondContact O-N 3.49Å
964	L	39.3	Very low	49.4	Very low	118 Å²	118	106.2 Å²	106.2	62%	0.618	58%	0.575	S	S	*	*	G	3₁₀ helix	trans	-96.6	-2.4	-175	-69.2	164.7	0	0	0	114.2	E961 Y962 S966	E961-L964 PolarHBondContact O-N 2.88Å; Y962-L964 PolarHBondContact O-N 3.28Å; L964-S966 VanDerWaalsContact C-N 3.35Å; L964-S966 PolarHBondContact O-N 2.83Å
965	Q	30.4	Very low	46.8	Very low	157 Å²	157	111.1 Å²	111.1	73%	0.734	61%	0.61	S	S	*	*			trans	-82.7	74.2	177.9	-72	-168.4	-15.1	0	0	112.7
966	S	29.6	Very low	44.6	Very low	89 Å²	89	114.8 Å²	114.8	62%	0.622	64%	0.635	S	S	*	*			trans	-77.9	136.7	153.1	51.6	0	0	0	0	109.5	L964 S968	L964-S966 VanDerWaalsContact C-N 3.35Å; L964-S966 PolarHBondContact O-N 2.83Å; S966-S968 PolarHBondContact O-N 3.31Å
967	P	37.7	Very low	42.8	Very low	138 Å²	138	117.5 Å²	117.5	90%	0.896	66%	0.658	S	S	*	*			trans	-83.3	78.2	-173.1	32.7	-35.8	0	0	0	112.2
968	S	31.2	Very low	41.6	Very low	100 Å²	100	124.6 Å²	124.6	70%	0.699	69%	0.689	S	S	*	*			trans	-122.3	139	164.5	54.8	0	0	0	0	110.7	S966 C970	S966-S968 PolarHBondContact O-N 3.31Å; S968-C970 PolarHBondContact O-N 2.95Å
969	L	30.3	Very low	40.8	Very low	176 Å²	176	126.6 Å²	126.6	92%	0.921	71%	0.705	S	S	*	*			trans	-68.7	124	-175.7	-85.2	74.3	0	0	0	111.3
970	C	27	Very low	40.8	Very low	112 Å²	112	125.8 Å²	125.8	76%	0.757	70%	0.704	S	S	*	*			trans	-150.1	96.2	150.4	-131.5	0	0	0	0	111	S968 L972	S968-C970 PolarHBondContact O-N 2.95Å; C970-L972 PolarHBondContact O-N 3.12Å; C970-L972 VanDerWaalsContact O-N 3.15Å
971	K	32.6	Very low	41.5	Very low	217 Å²	217	125.3 Å²	125.3	94%	0.943	70%	0.699	S	S	*	*			trans	-79	86.1	167.2	-77.8	-174.5	177.2	-179.4	0	108.9
972	L	31	Very low	43.1	Very low	151 Å²	151	120.4 Å²	120.4	79%	0.791	68%	0.675	S	S	*	*			trans	-131.5	123.6	165.6	-91.3	170.4	0	0	0	110.7	C970	C970-L972 PolarHBondContact O-N 3.12Å; C970-L972 VanDerWaalsContact O-N 3.15Å
973	S	32	Very low	44.9	Very low	110 Å²	110	114.1 Å²	114.1	77%	0.769	65%	0.652	S	S	*	*			trans	-74.8	133.8	168.9	50.8	0	0	0	0	110.6
974	V	34.2	Very low	47.1	Very low	133 Å²	133	110.9 Å²	110.9	81%	0.806	63%	0.63	S	S	*	*				-169.7	143.1	128	138.4	0	0	0	0	108.8	S976	V974-S976 PolarHBondContact O-N 3.5Å
975	S	34.3	Very low	49.2	Very low	110 Å²	110	107 Å²	107	77%	0.769	61%	0.612	S	S	*	*			trans	-66.9	123.2	174.1	50.8	0	0	0	0	111.6
976	S	42.1	Very low	52	Low	77 Å²	77	100 Å²	100	54%	0.538	58%	0.579	S	S	.	*			trans	-136.2	130.8	156.4	72.1	0	0	0	0	109.5	V974 Q978	V974-S976 PolarHBondContact O-N 3.5Å; S976-Q978 PolarHBondContact O-N 3.24Å
977	N	47.3	Very low	54.8	Low	165 Å²	165	95.7 Å²	95.7	88%	0.882	55%	0.55	S	S	*	.			trans	-80.8	47.8	176.7	-70.9	-14.2	0	0	0	110.7	L979	N977-L979 PolarHBondContact O-N 2.87Å
978	Q	55.7	Low	57.3	Low	166 Å²	166	89.3 Å²	89.3	78%	0.776	51%	0.509	S	S	*	.	P	Polyproline II helix	trans	-68.8	117.1	170.3	-72.1	-174.1	-7.2	0	0	108	S976	S976-Q978 PolarHBondContact O-N 3.24Å
979	L	61.1	Low	60.2	Low	129 Å²	129	86.4 Å²	86.4	68%	0.675	49%	0.485	S	S	*	.	P	Polyproline II helix	trans	-61	147.6	170.5	-67.3	107.2	0	0	0	109.1	N977	N977-L979 PolarHBondContact O-N 2.87Å
980	P	68.6	Low	63.2	Low	46 Å²	46	78 Å²	78	30%	0.299	44%	0.442	S	S	.	.	P	Polyproline II helix	trans	-54.9	154.2	178.1	20.6	-32.7	0	0	0	111.8	R958 L959	R958-P980 HydrophobicContact CB-CG 4.27Å; R958-P980 WeakPolarHBondContact CD-O 3.46Å; L959-P980 VanDerWaalsContact O-CB 3.29Å; L959-P980 WeakPolarHBondContact O-CB 3.46Å
981	P	75.8	Confident	66.4	Low	61 Å²	61	72.7 Å²	72.7	40%	0.396	41%	0.406	S	S	.	.	P	Polyproline II helix	trans	-64.1	155.2	178.9	24.9	-33.3	0	0	0	112.5	R958 L959	R958-P981 CarbonylContact C-O 3.32Å; R958-P981 WeakPolarHBondContact CA-O 3.49Å; L959-P981 HydrophobicContact CB-CG 4.47Å; L959-P981 HydrophobicContact CD1-CG 4.2Å; L959-P981 PolarHBondContact N-O 3.47Å
982	R	80	Confident	69.2	Low	20 Å²	20	64.4 Å²	64.4	8%	0.075	37%	0.371	C	S	.	.	B	Isolated β-bridge	trans	-67.1	151.1	172.9	-69.9	-171.6	-168.6	-139.9	8	111.1	I955 A957 R958 E984 D1015 E1022	I955-R982 PolarHBondContact O-NH1 3.01Å; A957-R982 WeakPolarHBondContact O-CA 3.45Å; R958-R982 HydrophobicContact CG-CG 4.38Å; R982-E984 PolarHBondContact O-N 3.29Å; R982-D1015 PolarHBondContact NH1-O 2.91Å; R982-E1022 WeakPolarHBondContact CD-OE2 3.25Å; R982-E1022 WeakPolarHBondContact CG-OE2 3.48Å; R982-E1022 IonicContact CZ-OE1 3.63Å; R982-E1022 IonicContact CZ-OE2 2.75Å; R982-E1022 IonicContact NE-OE1 3.92Å; R982-E1022 PolarHBondContact NE-OE1 3.49Å; R982-E1022 IonicContact NE-OE2 3.78Å; R982-E1022 PolarHBondContact NE-OE2 3.22Å; R982-E1022 IonicContact NH2-OE1 3.52Å; R982-E1022 PolarHBondContact NH2-OE1 3.13Å; R982-E1022 IonicContact NH2-OE2 3.4Å
983	D	81.5	Confident	72.2	Confident	24 Å²	24	57.2 Å²	57.2	13%	0.128	33%	0.334	C	S	.	.			trans	-76.3	81.8	164.2	-172.4	-22.2	0	0	0	108.3	A957 L959 P985 L986 A987	A957-D983 PolarHBondContact O-N 3.16Å; L959-D983 HydrophobicContact CD2-CB 3.84Å; L959-D983 HydrophobicContact CG-CB 4.19Å; D983-P985 WeakPolarHBondContact OD1-CD 3.43Å; D983-L986 HydrophobicContact CB-CB 3.85Å; D983-L986 HydrophobicContact CB-CD2 4.47Å; D983-L986 PolarHBondContact O-N 3.43Å; D983-L986 VanDerWaalsContact O-N 3.15Å; D983-L986 VanDerWaalsContact OD1-CB 3.32Å; D983-L986 WeakPolarHBondContact OD1-CB 3.42Å; D983-L986 PolarHBondContact OD1-N 3.25Å; D983-L986 WeakPolarHBondContact OD2-CB 3.48Å; D983-A987 WeakPolarHBondContact O-CB 3.18Å; D983-A987 PolarHBondContact O-N 3.44Å
984	E	86.4	Confident	75.2	Confident	29 Å²	29	52 Å²	52	14%	0.136	30%	0.297	C	S	.	.	H	α-helix	trans	-56.3	-45	-177.9	-62.7	-175.5	-146.5	0	0	112.8	R982 L986 A987 G988 S1023 Q1024 R1025 T1028	R982-E984 PolarHBondContact O-N 3.29Å; E984-L986 VanDerWaalsContact C-N 3.33Å; E984-L986 PolarHBondContact O-N 3Å; E984-A987 PolarHBondContact O-N 3.03Å; E984-G988 PolarHBondContact O-N 2.8Å; E984-S1023 VanDerWaalsContact CD-OG 3.31Å; E984-S1023 WeakPolarHBondContact OE1-CA 3.26Å; E984-S1023 WeakPolarHBondContact OE2-CB 3.28Å; E984-S1023 PolarHBondContact OE2-OG 2.92Å; E984-Q1024 VanDerWaalsContact CD-N 3.27Å; E984-Q1024 PolarHBondContact OE1-N 3.31Å; E984-Q1024 PolarHBondContact OE2-N 3.31Å; E984-R1025 WeakPolarHBondContact OE2-CB 3.38Å; E984-R1025 WeakPolarHBondContact OE2-CG 3.44Å; E984-R1025 PolarHBondContact OE2-N 3.31Å; E984-T1028 HydrophobicContact CB-CG2 4.26Å; E984-T1028 PolarHBondContact O-OG1 3.32Å
985	P	84.5	Confident	78	Confident	37 Å²	37	47 Å²	47	24%	0.24	27%	0.265	C	S	.	.	H	α-helix	trans	-58.1	-40.4	173.9	-25.8	35.8	0	0	0	113.5	D983 N989	D983-P985 WeakPolarHBondContact OD1-CD 3.43Å; P985-N989 PolarHBondContact O-N 2.76Å; P985-N989 PolarHBondContact O-ND2 2.84Å
986	L	88.3	Confident	80.7	Confident	9 Å²	9	43.5 Å²	43.5	5%	0.047	24%	0.236	C	C	.	.	H	α-helix	trans	-67.6	-48.6	177.1	-169.7	70.8	0	0	0	111.2	I920 T921 I924 F954 A957 D983 E984 G988 N989 V990	I920-L986 HydrophobicContact CG2-CD1 4.44Å; T921-L986 HydrophobicContact CG2-CD1 4.23Å; I924-L986 HydrophobicContact CB-CD1 4.02Å; I924-L986 HydrophobicContact CD1-CD1 3.72Å; I924-L986 HydrophobicContact CD1-CG 4.35Å; I924-L986 HydrophobicContact CG1-CD1 4.46Å; I924-L986 HydrophobicContact CG2-CD1 3.9Å; F954-L986 HydrophobicContact CD1-CD2 4.26Å; A957-L986 HydrophobicContact CB-CD2 3.75Å; D983-L986 HydrophobicContact CB-CB 3.85Å; D983-L986 HydrophobicContact CB-CD2 4.47Å; D983-L986 PolarHBondContact O-N 3.43Å; D983-L986 VanDerWaalsContact O-N 3.15Å; D983-L986 VanDerWaalsContact OD1-CB 3.32Å; D983-L986 WeakPolarHBondContact OD1-CB 3.42Å; D983-L986 PolarHBondContact OD1-N 3.25Å; D983-L986 WeakPolarHBondContact OD2-CB 3.48Å; E984-L986 VanDerWaalsContact C-N 3.33Å; E984-L986 PolarHBondContact O-N 3Å; L986-G988 PolarHBondContact O-N 2.92Å; L986-N989 PolarHBondContact O-N 3Å; L986-V990 WeakPolarHBondContact O-CG2 3.36Å; L986-V990 PolarHBondContact O-N 3.21Å
987	A	89.8	Confident	83	Confident	0 Å²	0	39.8 Å²	39.8	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-63.1	-41.2	-179.9	0	0	0	0	0	112.3	D983 E984 V990 C991 L1019	D983-A987 WeakPolarHBondContact O-CB 3.18Å; D983-A987 PolarHBondContact O-N 3.44Å; E984-A987 PolarHBondContact O-N 3.03Å; A987-V990 WeakPolarHBondContact O-CB 3.39Å; A987-V990 PolarHBondContact O-N 2.98Å; A987-C991 PolarHBondContact O-N 3.47Å; A987-C991 PolarHBondContact O-SG 3.26Å; A987-L1019 HydrophobicContact CB-CD1 3.97Å; A987-L1019 HydrophobicContact CB-CD2 3.85Å
988	G	89.4	Confident	85	Confident	4 Å²	4	32.1 Å²	32.1	4%	0.041	17%	0.17	C	C	.	.	H	α-helix	trans	-65.5	-35.9	176.7	0	0	0	0	0	113.6	E984 L986 C991 L992 N1031	E984-G988 PolarHBondContact O-N 2.8Å; L986-G988 PolarHBondContact O-N 2.92Å; G988-C991 PolarHBondContact O-N 3.41Å; G988-L992 PolarHBondContact O-N 2.95Å; G988-N1031 PolarHBondContact O-ND2 3.14Å
989	N	91.8	Very high	86.3	Confident	38 Å²	38	27.9 Å²	27.9	20%	0.203	16%	0.159	C	C	.	.	H	α-helix	trans	-71.8	-37.8	172.2	-81.7	-81.8	0	0	0	112	I924 A928 P985 L986 C991 L992 I993	I924-N989 HydrophobicContact CG2-CB 3.62Å; A928-N989 HydrophobicContact CB-CB 4.01Å; A928-N989 WeakPolarHBondContact CB-OD1 3.32Å; P985-N989 PolarHBondContact O-N 2.76Å; P985-N989 PolarHBondContact O-ND2 2.84Å; L986-N989 PolarHBondContact O-N 3Å; N989-C991 VanDerWaalsContact C-N 3.3Å; N989-C991 PolarHBondContact O-N 3.03Å; N989-L992 WeakPolarHBondContact O-CB 3.3Å; N989-L992 PolarHBondContact O-N 3.19Å; N989-I993 WeakPolarHBondContact O-CG1 3.44Å; N989-I993 PolarHBondContact O-N 3.11Å
990	V	93.6	Very high	87.3	Confident	0 Å²	0	24.5 Å²	24.5	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-60.9	-40.5	171.8	166.4	0	0	0	0	111.3	I924 L951 F954 I955 L986 A987 L992 I993 L994	I924-V990 HydrophobicContact CD1-CG2 3.89Å; I924-V990 HydrophobicContact CG1-CG2 4.41Å; I924-V990 HydrophobicContact CG2-CG2 3.94Å; L951-V990 HydrophobicContact CB-CG1 4.4Å; L951-V990 VanDerWaalsContact O-CG1 3.22Å; L951-V990 WeakPolarHBondContact O-CG1 3.47Å; F954-V990 HydrophobicContact CB-CG2 3.86Å; I955-V990 HydrophobicContact CD1-CG1 4.42Å; I955-V990 HydrophobicContact CG1-CG1 3.78Å; L986-V990 WeakPolarHBondContact O-CG2 3.36Å; L986-V990 PolarHBondContact O-N 3.21Å; A987-V990 WeakPolarHBondContact O-CB 3.39Å; A987-V990 PolarHBondContact O-N 2.98Å; V990-L992 VanDerWaalsContact C-N 3.32Å; V990-L992 PolarHBondContact O-N 2.87Å; V990-I993 PolarHBondContact O-N 2.74Å; V990-L994 HydrophobicContact CG1-CD1 3.9Å; V990-L994 HydrophobicContact CG1-CG 4.46Å; V990-L994 WeakPolarHBondContact O-CG 3.37Å; V990-L994 PolarHBondContact O-N 3.36Å
991	C	93.6	Very high	88.3	Confident	0 Å²	0	23 Å²	23	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-60.9	-40.6	174.8	-66.3	0	0	0	0	111.6	A987 G988 N989 L994 Q995 L1016 N1031 L1035	A987-C991 PolarHBondContact O-N 3.47Å; A987-C991 PolarHBondContact O-SG 3.26Å; G988-C991 PolarHBondContact O-N 3.41Å; N989-C991 VanDerWaalsContact C-N 3.3Å; N989-C991 PolarHBondContact O-N 3.03Å; C991-L994 PolarHBondContact O-N 2.9Å; C991-Q995 WeakPolarHBondContact O-CB 3.26Å; C991-Q995 PolarHBondContact O-N 2.7Å; C991-L1016 VanDerWaalsContact SG-CD2 3.58Å; C991-N1031 HydrophobicContact CB-CB 3.74Å; C991-L1035 HydrophobicContact CB-CD2 4.38Å
992	L	92.6	Very high	89	Confident	43 Å²	43	22.7 Å²	22.7	23%	0.225	13%	0.13	C	C	.	.	H	α-helix	trans	-61.9	-48.8	174	-70.4	171.9	0	0	0	112.5	A928 G988 N989 V990 L994 Q995 H996 N1031	A928-L992 HydrophobicContact CB-CB 4.24Å; G988-L992 PolarHBondContact O-N 2.95Å; N989-L992 WeakPolarHBondContact O-CB 3.3Å; N989-L992 PolarHBondContact O-N 3.19Å; V990-L992 VanDerWaalsContact C-N 3.32Å; V990-L992 PolarHBondContact O-N 2.87Å; L992-L994 VanDerWaalsContact C-N 3.31Å; L992-L994 PolarHBondContact O-N 2.88Å; L992-Q995 PolarHBondContact O-N 3.48Å; L992-H996 PolarHBondContact O-CD2 3.07Å; L992-H996 PolarHBondContact O-N 3.35Å; L992-N1031 HydrophobicContact CD2-CB 4.35Å; L992-N1031 HydrophobicContact CG-CB 4.46Å; L992-N1031 WeakPolarHBondContact CG-ND2 3.32Å
993	I	93.9	Very high	89.6	Confident	0 Å²	0	21.8 Å²	21.8	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-52.7	-52.4	177.3	-64.3	167.2	0	0	0	110.1	I924 L927 A928 T931 I941 L951 N989 V990 H996 C997	I924-I993 HydrophobicContact CB-CD1 4.5Å; I924-I993 HydrophobicContact CG1-CD1 4.38Å; I924-I993 HydrophobicContact CG2-CD1 4.14Å; L927-I993 HydrophobicContact CB-CD1 3.75Å; L927-I993 HydrophobicContact CB-CG1 4.19Å; A928-I993 VanDerWaalsContact CA-CG1 3.45Å; A928-I993 HydrophobicContact CB-CD1 4.44Å; A928-I993 HydrophobicContact CB-CG1 3.86Å; T931-I993 HydrophobicContact CG2-CG2 4.23Å; I941-I993 HydrophobicContact CD1-CG2 4.2Å; I941-I993 HydrophobicContact CG2-CG2 4.05Å; L951-I993 HydrophobicContact CD1-CG2 3.68Å; L951-I993 HydrophobicContact CD2-CD1 3.9Å; L951-I993 HydrophobicContact CD2-CG2 4.42Å; N989-I993 WeakPolarHBondContact O-CG1 3.44Å; N989-I993 PolarHBondContact O-N 3.11Å; V990-I993 PolarHBondContact O-N 2.74Å; I993-H996 PolarHBondContact O-N 3.03Å; I993-C997 PolarHBondContact O-N 3.46Å; I993-C997 VanDerWaalsContact O-N 3.07Å; I993-C997 PolarHBondContact O-SG 2.94Å; I993-C997 VanDerWaalsContact O-SG 3.34Å
994	L	94.4	Very high	90.1	Very high	0 Å²	0	20.9 Å²	20.9	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-67.3	-38.6	-178.3	-63.7	172.5	0	0	0	111.6	L951 A952 I955 V990 C991 L992 H996 C997 A998 L1003 L1035	L951-L994 HydrophobicContact CB-CD2 3.95Å; L951-L994 HydrophobicContact CB-CG 4.39Å; L951-L994 HydrophobicContact CD1-CD2 4.25Å; A952-L994 HydrophobicContact CB-CD1 4.44Å; I955-L994 HydrophobicContact CD1-CD1 4.17Å; V990-L994 HydrophobicContact CG1-CD1 3.9Å; V990-L994 HydrophobicContact CG1-CG 4.46Å; V990-L994 WeakPolarHBondContact O-CG 3.37Å; V990-L994 PolarHBondContact O-N 3.36Å; C991-L994 PolarHBondContact O-N 2.9Å; L992-L994 VanDerWaalsContact C-N 3.31Å; L992-L994 PolarHBondContact O-N 2.88Å; L994-H996 PolarHBondContact O-N 3.34Å; L994-C997 PolarHBondContact O-N 3.12Å; L994-A998 WeakPolarHBondContact O-CB 3.45Å; L994-A998 PolarHBondContact O-N 2.95Å; L994-L1003 HydrophobicContact CB-CD1 4.38Å; L994-L1003 HydrophobicContact CD2-CD1 3.78Å; L994-L1003 HydrophobicContact CD2-CG 4.42Å; L994-L1035 HydrophobicContact CB-CD1 3.76Å; L994-L1035 HydrophobicContact CB-CD2 3.67Å; L994-L1035 HydrophobicContact CB-CG 4.4Å; L994-L1035 HydrophobicContact CD1-CD2 3.9Å; L994-L1035 HydrophobicContact CG-CD2 4.45Å
995	Q	92.8	Very high	90.4	Very high	29 Å²	29	25.5 Å²	25.5	14%	0.136	14%	0.143	C	C	.	.	H	α-helix	trans	-62	-39.7	176.6	170.5	-176.5	-28	0	0	112	C991 L992 I1034 K1038	C991-Q995 WeakPolarHBondContact O-CB 3.26Å; C991-Q995 PolarHBondContact O-N 2.7Å; L992-Q995 PolarHBondContact O-N 3.48Å; Q995-I1034 HydrophobicContact CG-CG2 3.91Å; Q995-K1038 HydrophobicContact CG-CD 4.36Å; Q995-K1038 WeakPolarHBondContact O-CD 3.32Å; Q995-K1038 WeakPolarHBondContact O-CE 3.44Å; Q995-K1038 PolarHBondContact O-NZ 3.06Å
996	H	90.8	Very high	90.9	Very high	36 Å²	36	25.4 Å²	25.4	17%	0.167	14%	0.14	C	C	.	.	H	α-helix	trans	-69.8	-49.2	176.2	-72.8	-63.1	0	0	0	110.8	N932 R938 L992 I993 L994 A998	N932-H996 PolarHBondContact OD1-CE1 3.4Å; R938-H996 WeakPolarHBondContact CD-O 3.38Å; L992-H996 PolarHBondContact O-CD2 3.07Å; L992-H996 PolarHBondContact O-N 3.35Å; I993-H996 PolarHBondContact O-N 3.03Å; L994-H996 PolarHBondContact O-N 3.34Å; H996-A998 VanDerWaalsContact C-N 3.33Å; H996-A998 PolarHBondContact O-N 2.9Å
997	C	91.8	Very high	91.2	Very high	0 Å²	0	25 Å²	25	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-65.6	-30.3	179.7	-64	0	0	0	0	114	I993 L994 S999 D1000 T1001 L1003	I993-C997 PolarHBondContact O-N 3.46Å; I993-C997 VanDerWaalsContact O-N 3.07Å; I993-C997 PolarHBondContact O-SG 2.94Å; I993-C997 VanDerWaalsContact O-SG 3.34Å; L994-C997 PolarHBondContact O-N 3.12Å; C997-S999 PolarHBondContact O-N 2.86Å; C997-S999 VanDerWaalsContact O-N 3.1Å; C997-D1000 PolarHBondContact O-N 2.95Å; C997-T1001 PolarHBondContact O-N 3.22Å; C997-T1001 PolarHBondContact O-OG1 3.27Å; C997-L1003 HydrophobicContact CB-CD1 3.38Å
998	A	89.1	Confident	91.3	Very high	3 Å²	3	28.1 Å²	28.1	3%	0.025	15%	0.152	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.4	-11.7	-174.7	0	0	0	0	0	115.8	L994 H996 L1003 K1038	L994-A998 WeakPolarHBondContact O-CB 3.45Å; L994-A998 PolarHBondContact O-N 2.95Å; H996-A998 VanDerWaalsContact C-N 3.33Å; H996-A998 PolarHBondContact O-N 2.9Å; A998-L1003 HydrophobicContact CB-CD2 3.97Å; A998-K1038 HydrophobicContact CB-CB 4.12Å; A998-K1038 HydrophobicContact CB-CD 4.08Å
999	S	82.5	Confident	91.2	Very high	77 Å²	77	31.6 Å²	31.6	54%	0.538	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.4	-29.5	175.3	-82	0	0	0	0	113.8	C997 K1038	C997-S999 PolarHBondContact O-N 2.86Å; C997-S999 VanDerWaalsContact O-N 3.1Å; S999-K1038 PolarHBondContact OG-NZ 2.77Å
1000	D	82.9	Confident	91.2	Very high	58 Å²	58	31.7 Å²	31.7	31%	0.31	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	-119.9	-4.5	-162.3	-51.6	-4.5	0	0	0	112.5	R938 Y939 C997	R938-D1000 IonicContact CZ-OD2 3.62Å; R938-D1000 IonicContact NE-OD2 2.77Å; R938-D1000 PolarHBondContact NE-OD2 3.37Å; R938-D1000 IonicContact NH2-OD2 2.72Å; R938-D1000 PolarHBondContact NH2-OD2 2.95Å; Y939-D1000 WeakPolarHBondContact CE1-O 3.43Å; C997-D1000 PolarHBondContact O-N 2.95Å
1001	T	89.6	Confident	91.1	Very high	16 Å²	16	33.8 Å²	33.8	10%	0.098	21%	0.205	C	C	.	.	S	Bend	trans	-138.7	157	-168.1	68.3	0	0	0	0	112.4	Y939 C997 L1003	Y939-T1001 HydrophobicContact CD1-CG2 3.86Å; Y939-T1001 HydrophobicContact CE1-CG2 4.31Å; C997-T1001 PolarHBondContact O-N 3.22Å; C997-T1001 PolarHBondContact O-OG1 3.27Å; T1001-L1003 PolarHBondContact O-N 3.19Å; T1001-L1003 WeakPolarHBondContact OG1-CB 3.41Å
1002	P	90.1	Very high	91.1	Very high	54 Å²	54	33.8 Å²	33.8	35%	0.351	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68	19.3	174.4	29.7	-37.1	0	0	0	114.8	D943 A1004 E1005 H1006	D943-P1002 WeakPolarHBondContact OD1-CD 3.25Å; P1002-A1004 PolarHBondContact O-N 3.41Å; P1002-A1004 VanDerWaalsContact O-N 3.12Å; P1002-E1005 WeakPolarHBondContact O-CB 3.09Å; P1002-E1005 PolarHBondContact O-N 2.8Å; P1002-H1006 PolarHBondContact O-N 2.91Å
1003	L	93.2	Very high	91.1	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-48.3	-39.1	175.6	175.5	159.5	0	0	0	113.1	V948 L994 C997 A998 T1001 E1005 H1006 L1007 L1039	V948-L1003 HydrophobicContact CG1-CG 3.89Å; V948-L1003 HydrophobicContact CG2-CB 4.28Å; V948-L1003 HydrophobicContact CG2-CD1 4.32Å; V948-L1003 HydrophobicContact CG2-CG 4.05Å; L994-L1003 HydrophobicContact CB-CD1 4.38Å; L994-L1003 HydrophobicContact CD2-CD1 3.78Å; L994-L1003 HydrophobicContact CD2-CG 4.42Å; C997-L1003 HydrophobicContact CB-CD1 3.38Å; A998-L1003 HydrophobicContact CB-CD2 3.97Å; T1001-L1003 PolarHBondContact O-N 3.19Å; T1001-L1003 WeakPolarHBondContact OG1-CB 3.41Å; L1003-E1005 PolarHBondContact O-N 3.01Å; L1003-H1006 PolarHBondContact O-N 3.47Å; L1003-L1007 HydrophobicContact CD2-CD1 3.71Å; L1003-L1007 HydrophobicContact CD2-CG 4.5Å; L1003-L1007 HydrophobicContact CG-CD1 4.48Å; L1003-L1007 WeakPolarHBondContact O-CG 3.4Å; L1003-L1007 PolarHBondContact O-N 3.31Å; L1003-L1039 HydrophobicContact CD2-CD2 3.79Å
1004	A	91.4	Very high	91.1	Very high	5 Å²	5	37.7 Å²	37.7	4%	0.041	22%	0.217	C	C	.	.	H	α-helix	trans	-62.5	-42.1	178.7	0	0	0	0	0	112	P1002 L1007 Q1008 L1039 H1046	P1002-A1004 PolarHBondContact O-N 3.41Å; P1002-A1004 VanDerWaalsContact O-N 3.12Å; A1004-L1007 PolarHBondContact O-N 3.04Å; A1004-Q1008 PolarHBondContact O-N 2.95Å; A1004-L1039 HydrophobicContact CB-CD2 4.03Å; A1004-H1046 PolarHBondContact O-NE2 3.39Å
1005	E	93.1	Very high	91	Very high	126 Å²	126	38 Å²	38	59%	0.589	22%	0.219	S	C	*	.	H	α-helix	trans	-68.8	-41.8	174.7	-53.9	-171	159	0	0	111.2	P1002 L1003 L1007 Q1008	P1002-E1005 WeakPolarHBondContact O-CB 3.09Å; P1002-E1005 PolarHBondContact O-N 2.8Å; L1003-E1005 PolarHBondContact O-N 3.01Å; E1005-L1007 PolarHBondContact O-N 2.96Å; E1005-L1007 VanDerWaalsContact O-N 3.11Å; E1005-Q1008 WeakPolarHBondContact O-CB 3.29Å; E1005-Q1008 PolarHBondContact O-N 3.04Å
1006	H	94.2	Very high	91	Very high	35 Å²	35	36.7 Å²	36.7	16%	0.162	21%	0.213	C	C	.	.	H	α-helix	trans	-57.5	-27.6	175	-70.5	157.7	0	0	0	113.1	G942 D943 R945 V948 R949 P1002 L1003	G942-H1006 PolarHBondContact O-CE1 3.47Å; G942-H1006 PolarHBondContact O-ND1 3.47Å; D943-H1006 PolarHBondContact O-CE1 2.98Å; R945-H1006 HydrophobicContact CB-CB 4.25Å; R945-H1006 HydrophobicContact CG-CB 3.97Å; V948-H1006 HydrophobicContact CB-CB 4.17Å; V948-H1006 HydrophobicContact CG1-CB 3.92Å; V948-H1006 HydrophobicContact CG2-CB 4.39Å; R949-H1006 PolarHBondContact NE-O 3.34Å; R949-H1006 PolarHBondContact NH2-O 2.96Å; P1002-H1006 PolarHBondContact O-N 2.91Å; L1003-H1006 PolarHBondContact O-N 3.47Å
1007	L	94.7	Very high	91	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.5	-6.2	174.7	-69	175.3	0	0	0	115.7	V948 A952 L1003 A1004 E1005 T1010 V1012 L1039	V948-L1007 HydrophobicContact CG1-CD1 4.17Å; V948-L1007 HydrophobicContact CG1-CD2 3.58Å; V948-L1007 HydrophobicContact CG1-CG 3.54Å; A952-L1007 HydrophobicContact CB-CD2 3.61Å; L1003-L1007 HydrophobicContact CD2-CD1 3.71Å; L1003-L1007 HydrophobicContact CD2-CG 4.5Å; L1003-L1007 HydrophobicContact CG-CD1 4.48Å; L1003-L1007 WeakPolarHBondContact O-CG 3.4Å; L1003-L1007 PolarHBondContact O-N 3.31Å; A1004-L1007 PolarHBondContact O-N 3.04Å; E1005-L1007 PolarHBondContact O-N 2.96Å; E1005-L1007 VanDerWaalsContact O-N 3.11Å; L1007-T1010 WeakPolarHBondContact O-CB 3.27Å; L1007-T1010 PolarHBondContact O-N 3.18Å; L1007-T1010 PolarHBondContact O-OG1 2.99Å; L1007-V1012 HydrophobicContact CB-CG1 4.09Å; L1007-V1012 HydrophobicContact CD1-CG1 4.27Å; L1007-V1012 HydrophobicContact CD1-CG2 4.35Å; L1007-L1039 HydrophobicContact CD1-CD1 4.12Å; L1007-L1039 HydrophobicContact CD1-CD2 3.92Å
1008	Q	91.4	Very high	91	Very high	66 Å²	66	35.7 Å²	35.7	31%	0.308	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.4	143.2	176.1	-68.6	174.1	14.8	0	0	111.9	R949 A1004 E1005 T1010 S1043 V1045	R949-Q1008 PolarHBondContact NH2-O 2.94Å; A1004-Q1008 PolarHBondContact O-N 2.95Å; E1005-Q1008 WeakPolarHBondContact O-CB 3.29Å; E1005-Q1008 PolarHBondContact O-N 3.04Å; Q1008-T1010 VanDerWaalsContact C-N 3.26Å; Q1008-T1010 PolarHBondContact O-N 3.24Å; Q1008-S1043 PolarHBondContact NE2-OG 2.73Å; Q1008-S1043 VanDerWaalsContact NE2-OG 3.14Å; Q1008-V1045 HydrophobicContact CG-CB 4.29Å; Q1008-V1045 HydrophobicContact CG-CG1 4.4Å
1009	G	87.8	Confident	91.1	Very high	78 Å²	78	35.5 Å²	35.5	80%	0.804	21%	0.208	S	C	*	.	T	Hydrogen-bonded Turn	trans	65.5	26.7	-173.7	0	0	0	0	0	113.7
1010	T	92.3	Very high	91.4	Very high	40 Å²	40	32.2 Å²	32.2	25%	0.245	19%	0.185	C	C	.	.	S	Bend	trans	-124.6	146	168.2	74.5	0	0	0	0	109.3	R949 L1007 Q1008 V1012	R949-T1010 HydrophobicContact CG-CG2 4.42Å; L1007-T1010 WeakPolarHBondContact O-CB 3.27Å; L1007-T1010 PolarHBondContact O-N 3.18Å; L1007-T1010 PolarHBondContact O-OG1 2.99Å; Q1008-T1010 VanDerWaalsContact C-N 3.26Å; Q1008-T1010 PolarHBondContact O-N 3.24Å; T1010-V1012 PolarHBondContact O-N 3.43Å
1011	S	91.3	Very high	91.7	Very high	43 Å²	43	35.4 Å²	35.4	30%	0.301	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.8	33.9	-179.1	70.8	0	0	0	0	113.4	R956 I1013 Y1014 D1015	R956-S1011 PolarHBondContact NH2-OG 2.97Å; S1011-I1013 VanDerWaalsContact C-N 3.31Å; S1011-I1013 PolarHBondContact O-N 3.06Å; S1011-Y1014 WeakPolarHBondContact O-CB 3.42Å; S1011-Y1014 PolarHBondContact O-N 3.11Å; S1011-D1015 PolarHBondContact O-N 2.92Å
1012	V	93.2	Very high	91.6	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-65.2	-34	-175.6	68.8	0	0	0	0	112.2	A952 I955 L1007 T1010 D1015 L1016 L1039	A952-V1012 HydrophobicContact CB-CG2 4.03Å; I955-V1012 HydrophobicContact CD1-CG2 3.95Å; L1007-V1012 HydrophobicContact CB-CG1 4.09Å; L1007-V1012 HydrophobicContact CD1-CG1 4.27Å; L1007-V1012 HydrophobicContact CD1-CG2 4.35Å; T1010-V1012 PolarHBondContact O-N 3.43Å; V1012-D1015 PolarHBondContact O-N 2.95Å; V1012-L1016 HydrophobicContact CG2-CD1 4.02Å; V1012-L1016 HydrophobicContact CG2-CG 4.38Å; V1012-L1016 WeakPolarHBondContact O-CB 3.49Å; V1012-L1016 VanDerWaalsContact O-CG 3.25Å; V1012-L1016 WeakPolarHBondContact O-CG 3.33Å; V1012-L1016 PolarHBondContact O-N 2.94Å; V1012-L1039 HydrophobicContact CG1-CD1 4.27Å
1013	I	92.5	Very high	91.4	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-63.4	-47.5	175.4	-56.1	-57.8	0	0	0	109.8	S1011 D1015 L1016 L1017 L1039 H1046 E1049 L1050 L1053	S1011-I1013 VanDerWaalsContact C-N 3.31Å; S1011-I1013 PolarHBondContact O-N 3.06Å; I1013-D1015 PolarHBondContact O-N 3.39Å; I1013-L1016 PolarHBondContact O-N 3.23Å; I1013-L1017 HydrophobicContact CG2-CD1 4.04Å; I1013-L1017 HydrophobicContact CG2-CG 4.48Å; I1013-L1017 WeakPolarHBondContact O-CB 3.21Å; I1013-L1017 VanDerWaalsContact O-CG 3.27Å; I1013-L1017 WeakPolarHBondContact O-CG 3.43Å; I1013-L1017 PolarHBondContact O-N 3.19Å; I1013-L1039 HydrophobicContact CD1-CB 4.27Å; I1013-L1039 HydrophobicContact CD1-CD1 4.11Å; I1013-H1046 HydrophobicContact CD1-CB 4.11Å; I1013-H1046 HydrophobicContact CG1-CB 4.41Å; I1013-E1049 HydrophobicContact CB-CG 4Å; I1013-E1049 HydrophobicContact CG1-CG 4.18Å; I1013-E1049 HydrophobicContact CG2-CG 4.43Å; I1013-L1050 HydrophobicContact CG2-CB 4.2Å; I1013-L1050 HydrophobicContact CG2-CD1 3.77Å; I1013-L1053 HydrophobicContact CB-CD1 4.45Å; I1013-L1053 HydrophobicContact CG2-CD1 4.18Å
1014	Y	93.4	Very high	91	Very high	125 Å²	125	44.4 Å²	44.4	49%	0.49	24%	0.235	S	C	.	.	H	α-helix	trans	-59.3	-44	172.2	177.9	-96.7	0	0	0	112.7	S1011 L1016 L1017 S1018 L1053	S1011-Y1014 WeakPolarHBondContact O-CB 3.42Å; S1011-Y1014 PolarHBondContact O-N 3.11Å; Y1014-L1016 VanDerWaalsContact C-N 3.28Å; Y1014-L1016 PolarHBondContact O-N 3.34Å; Y1014-L1017 PolarHBondContact O-N 3.43Å; Y1014-S1018 WeakPolarHBondContact O-CB 3.36Å; Y1014-S1018 PolarHBondContact O-N 2.62Å; Y1014-S1018 PolarHBondContact O-OG 3.32Å; Y1014-L1053 HydrophobicContact CD2-CD1 4.48Å; Y1014-L1053 HydrophobicContact CD2-CD2 4.11Å
1015	D	92.5	Very high	90.7	Very high	8 Å²	8	49 Å²	49	4%	0.043	25%	0.251	C	S	.	.	H	α-helix	trans	-61.1	-37.5	179.4	-67.5	-37.3	0	0	0	112.4	I955 R956 R982 S1011 V1012 I1013 L1019	I955-D1015 HydrophobicContact CB-CB 4.47Å; I955-D1015 HydrophobicContact CG2-CB 3.91Å; R956-D1015 IonicContact CZ-OD1 2.66Å; R956-D1015 IonicContact CZ-OD2 2.66Å; R956-D1015 IonicContact NE-OD1 2.69Å; R956-D1015 PolarHBondContact NE-OD1 3.42Å; R956-D1015 IonicContact NE-OD2 3.41Å; R956-D1015 PolarHBondContact NE-OD2 3.37Å; R956-D1015 IonicContact NH2-OD1 2.64Å; R956-D1015 PolarHBondContact NH2-OD1 2.96Å; R956-D1015 IonicContact NH2-OD2 3.46Å; R956-D1015 PolarHBondContact NH2-OD2 3.32Å; R982-D1015 PolarHBondContact NH1-O 2.91Å; S1011-D1015 PolarHBondContact O-N 2.92Å; V1012-D1015 PolarHBondContact O-N 2.95Å; I1013-D1015 PolarHBondContact O-N 3.39Å; D1015-L1019 WeakPolarHBondContact O-CB 3.29Å; D1015-L1019 PolarHBondContact O-N 3.21Å
1016	L	92.8	Very high	90.3	Very high	0 Å²	0	48.2 Å²	48.2	0%	0	25%	0.25	C	S	.	.	H	α-helix	trans	-77.7	-41.1	178.7	-71	167.8	0	0	0	112.4	I955 C991 V1012 I1013 Y1014 S1018 L1019 I1020 A1032 L1035 I1036 L1039	I955-L1016 HydrophobicContact CD1-CD2 3.84Å; I955-L1016 HydrophobicContact CD1-CG 4.16Å; I955-L1016 HydrophobicContact CG2-CD2 4.21Å; C991-L1016 VanDerWaalsContact SG-CD2 3.58Å; V1012-L1016 HydrophobicContact CG2-CD1 4.02Å; V1012-L1016 HydrophobicContact CG2-CG 4.38Å; V1012-L1016 WeakPolarHBondContact O-CB 3.49Å; V1012-L1016 VanDerWaalsContact O-CG 3.25Å; V1012-L1016 WeakPolarHBondContact O-CG 3.33Å; V1012-L1016 PolarHBondContact O-N 2.94Å; I1013-L1016 PolarHBondContact O-N 3.23Å; Y1014-L1016 VanDerWaalsContact C-N 3.28Å; Y1014-L1016 PolarHBondContact O-N 3.34Å; L1016-S1018 VanDerWaalsContact C-N 3.33Å; L1016-S1018 PolarHBondContact O-N 2.64Å; L1016-L1019 PolarHBondContact O-N 2.91Å; L1016-I1020 WeakPolarHBondContact O-CG1 3.44Å; L1016-I1020 PolarHBondContact O-N 3.44Å; L1016-A1032 HydrophobicContact CD2-CB 3.9Å; L1016-L1035 HydrophobicContact CD1-CB 4.45Å; L1016-L1035 HydrophobicContact CD1-CD2 3.78Å; L1016-L1035 HydrophobicContact CD1-CG 3.88Å; L1016-L1035 HydrophobicContact CD2-CD2 4Å; L1016-I1036 HydrophobicContact CB-CD1 3.71Å; L1016-I1036 HydrophobicContact CB-CG1 3.68Å; L1016-I1036 HydrophobicContact CD1-CG1 3.81Å; L1016-I1036 HydrophobicContact CG-CG1 4.37Å; L1016-L1039 HydrophobicContact CD1-CD1 4.28Å
1017	L	92.3	Very high	89.7	Confident	7 Å²	7	51 Å²	51	4%	0.037	27%	0.266	C	S	.	.	H	α-helix	trans	-60.3	-44.7	172.4	-70.5	170.4	0	0	0	110.9	I1013 Y1014 L1019 I1020 Q1021 I1036 L1050 L1053 V1058	I1013-L1017 HydrophobicContact CG2-CD1 4.04Å; I1013-L1017 HydrophobicContact CG2-CG 4.48Å; I1013-L1017 WeakPolarHBondContact O-CB 3.21Å; I1013-L1017 VanDerWaalsContact O-CG 3.27Å; I1013-L1017 WeakPolarHBondContact O-CG 3.43Å; I1013-L1017 PolarHBondContact O-N 3.19Å; Y1014-L1017 PolarHBondContact O-N 3.43Å; L1017-L1019 PolarHBondContact O-N 3.19Å; L1017-I1020 WeakPolarHBondContact O-CB 3.45Å; L1017-I1020 PolarHBondContact O-N 2.93Å; L1017-Q1021 WeakPolarHBondContact O-CG 3.48Å; L1017-Q1021 PolarHBondContact O-N 2.76Å; L1017-I1036 HydrophobicContact CD2-CD1 3.84Å; L1017-I1036 HydrophobicContact CG-CD1 4.04Å; L1017-L1050 HydrophobicContact CD1-CD1 4.25Å; L1017-L1050 HydrophobicContact CD2-CD1 4.23Å; L1017-L1053 HydrophobicContact CD1-CB 3.87Å; L1017-L1053 HydrophobicContact CD1-CD1 4.08Å; L1017-V1058 HydrophobicContact CD2-CB 3.85Å; L1017-V1058 HydrophobicContact CD2-CG1 3.96Å; L1017-V1058 HydrophobicContact CD2-CG2 4.26Å
1018	S	90.9	Very high	89.3	Confident	8 Å²	8	51.3 Å²	51.3	6%	0.056	27%	0.268	C	S	.	.	H	α-helix	trans	-64.1	-38.6	174.9	-54.5	0	0	0	0	111.8	Y1014 L1016 Q1021 E1022	Y1014-S1018 WeakPolarHBondContact O-CB 3.36Å; Y1014-S1018 PolarHBondContact O-N 2.62Å; Y1014-S1018 PolarHBondContact O-OG 3.32Å; L1016-S1018 VanDerWaalsContact C-N 3.33Å; L1016-S1018 PolarHBondContact O-N 2.64Å; S1018-Q1021 PolarHBondContact O-N 3.11Å; S1018-E1022 VanDerWaalsContact O-CB 3.26Å; S1018-E1022 WeakPolarHBondContact O-CB 3.43Å; S1018-E1022 VanDerWaalsContact O-CG 3.28Å; S1018-E1022 WeakPolarHBondContact O-CG 3.5Å; S1018-E1022 PolarHBondContact O-N 3.37Å
1019	L	90.5	Very high	89.2	Confident	0 Å²	0	50.2 Å²	50.2	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-63.3	-41.9	173.5	178.3	65.6	0	0	0	111.8	I955 A987 D1015 L1016 L1017 Q1021 S1023 T1028 A1032	I955-L1019 HydrophobicContact CG2-CB 4.4Å; I955-L1019 HydrophobicContact CG2-CD2 4.12Å; A987-L1019 HydrophobicContact CB-CD1 3.97Å; A987-L1019 HydrophobicContact CB-CD2 3.85Å; D1015-L1019 WeakPolarHBondContact O-CB 3.29Å; D1015-L1019 PolarHBondContact O-N 3.21Å; L1016-L1019 PolarHBondContact O-N 2.91Å; L1017-L1019 PolarHBondContact O-N 3.19Å; L1019-Q1021 VanDerWaalsContact C-N 3.29Å; L1019-Q1021 PolarHBondContact O-N 2.88Å; L1019-S1023 WeakPolarHBondContact O-CB 3.4Å; L1019-S1023 PolarHBondContact O-N 3.5Å; L1019-T1028 HydrophobicContact CD1-CG2 3.91Å; L1019-T1028 HydrophobicContact CD2-CG2 3.97Å; L1019-T1028 HydrophobicContact CG-CG2 4.06Å; L1019-A1032 HydrophobicContact CD2-CB 4.06Å
1020	I	89.3	Confident	89.1	Confident	8 Å²	8	50.9 Å²	50.9	4%	0.041	24%	0.24	C	C	.	.	H	α-helix	trans	-61.2	-39.1	176.2	-73	164.3	0	0	0	111	L1016 L1017 K1029 A1032 A1033 I1036 V1058 L1059 F1062	L1016-I1020 WeakPolarHBondContact O-CG1 3.44Å; L1016-I1020 PolarHBondContact O-N 3.44Å; L1017-I1020 WeakPolarHBondContact O-CB 3.45Å; L1017-I1020 PolarHBondContact O-N 2.93Å; I1020-K1029 PolarHBondContact O-NZ 3.3Å; I1020-A1032 HydrophobicContact CD1-CB 4.08Å; I1020-A1032 HydrophobicContact CG1-CB 3.69Å; I1020-A1033 HydrophobicContact CD1-CB 4.04Å; I1020-I1036 HydrophobicContact CD1-CD1 3.66Å; I1020-V1058 HydrophobicContact CB-CG1 4.38Å; I1020-V1058 HydrophobicContact CG2-CG1 3.77Å; I1020-L1059 HydrophobicContact CD1-CD2 4.13Å; I1020-F1062 HydrophobicContact CG1-CZ 4.46Å; I1020-F1062 HydrophobicContact CG2-CE2 3.74Å; I1020-F1062 HydrophobicContact CG2-CZ 3.69Å
1021	Q	88.7	Confident	89	Confident	124 Å²	124	50 Å²	50	58%	0.579	23%	0.234	S	C	*	.	H	α-helix	trans	-73.2	-50.4	177.3	-69.3	169.8	-18.3	0	0	112.1	L1017 S1018 L1019 V1058	L1017-Q1021 WeakPolarHBondContact O-CG 3.48Å; L1017-Q1021 PolarHBondContact O-N 2.76Å; S1018-Q1021 PolarHBondContact O-N 3.11Å; L1019-Q1021 VanDerWaalsContact C-N 3.29Å; L1019-Q1021 PolarHBondContact O-N 2.88Å; Q1021-V1058 HydrophobicContact CG-CG1 4.03Å
1022	E	87.9	Confident	89	Confident	81 Å²	81	48 Å²	48	38%	0.379	22%	0.22	S	C	.	.	H	α-helix	trans	-70.6	-34.8	-175.2	-72.5	173.8	-129.2	0	0	114.4	R958 R982 S1018	R958-E1022 IonicContact CZ-OE2 2.73Å; R958-E1022 IonicContact NE-OE2 2.89Å; R958-E1022 VanDerWaalsContact NH2-CD 3.34Å; R958-E1022 IonicContact NH2-OE1 3.16Å; R958-E1022 PolarHBondContact NH2-OE1 3.21Å; R958-E1022 IonicContact NH2-OE2 2.68Å; R958-E1022 PolarHBondContact NH2-OE2 3.21Å; R982-E1022 WeakPolarHBondContact CD-OE2 3.25Å; R982-E1022 WeakPolarHBondContact CG-OE2 3.48Å; R982-E1022 IonicContact CZ-OE1 3.63Å; R982-E1022 IonicContact CZ-OE2 2.75Å; R982-E1022 IonicContact NE-OE1 3.92Å; R982-E1022 PolarHBondContact NE-OE1 3.49Å; R982-E1022 IonicContact NE-OE2 3.78Å; R982-E1022 PolarHBondContact NE-OE2 3.22Å; R982-E1022 IonicContact NH2-OE1 3.52Å; R982-E1022 PolarHBondContact NH2-OE1 3.13Å; R982-E1022 IonicContact NH2-OE2 3.4Å; S1018-E1022 VanDerWaalsContact O-CB 3.26Å; S1018-E1022 WeakPolarHBondContact O-CB 3.43Å; S1018-E1022 VanDerWaalsContact O-CG 3.28Å; S1018-E1022 WeakPolarHBondContact O-CG 3.5Å; S1018-E1022 PolarHBondContact O-N 3.37Å
1023	S	86.6	Confident	88.8	Confident	6 Å²	6	48.5 Å²	48.5	4%	0.042	23%	0.225	C	C	.	.			trans	-67.7	149.1	-171.4	168.2	0	0	0	0	113.1	E984 L1019 R1025 K1029	E984-S1023 VanDerWaalsContact CD-OG 3.31Å; E984-S1023 WeakPolarHBondContact OE1-CA 3.26Å; E984-S1023 WeakPolarHBondContact OE2-CB 3.28Å; E984-S1023 PolarHBondContact OE2-OG 2.92Å; L1019-S1023 WeakPolarHBondContact O-CB 3.4Å; L1019-S1023 PolarHBondContact O-N 3.5Å; S1023-R1025 PolarHBondContact OG-N 3.2Å; S1023-R1025 PolarHBondContact OG-O 3.02Å; S1023-K1029 WeakPolarHBondContact O-CE 3.38Å; S1023-K1029 PolarHBondContact O-NZ 3.11Å
1024	Q	85.2	Confident	88.7	Confident	173 Å²	173	51.5 Å²	51.5	81%	0.808	24%	0.24	S	C	*	.			trans	-98.3	-30.4	168.2	-61.2	-174.3	-0.2	0	0	112.7	E984 L1026	E984-Q1024 VanDerWaalsContact CD-N 3.27Å; E984-Q1024 PolarHBondContact OE1-N 3.31Å; E984-Q1024 PolarHBondContact OE2-N 3.31Å; Q1024-L1026 PolarHBondContact O-N 3.11Å
1025	R	83.2	Confident	88.6	Confident	102 Å²	102	45.6 Å²	45.6	39%	0.385	22%	0.217	S	C	.	.			trans	-73.5	115.6	-179.6	-68.8	179.8	171.7	-117.4	-0.5	112.1	D776 E984 S1023 D1027 T1028 K1029	D776-R1025 IonicContact OD1-CZ 2.89Å; D776-R1025 VanDerWaalsContact OD1-CZ 3.26Å; D776-R1025 IonicContact OD1-NH1 2.78Å; D776-R1025 PolarHBondContact OD1-NH1 3.11Å; D776-R1025 IonicContact OD1-NH2 2.73Å; D776-R1025 PolarHBondContact OD1-NH2 2.71Å; E984-R1025 WeakPolarHBondContact OE2-CB 3.38Å; E984-R1025 WeakPolarHBondContact OE2-CG 3.44Å; E984-R1025 PolarHBondContact OE2-N 3.31Å; S1023-R1025 PolarHBondContact OG-N 3.2Å; S1023-R1025 PolarHBondContact OG-O 3.02Å; R1025-D1027 VanDerWaalsContact C-N 3.27Å; R1025-D1027 PolarHBondContact O-N 3.4Å; R1025-T1028 WeakPolarHBondContact O-CB 3.45Å; R1025-T1028 PolarHBondContact O-N 3.21Å; R1025-K1029 PolarHBondContact O-N 3.24Å; R1025-K1029 VanDerWaalsContact O-N 3.16Å
1026	L	84.8	Confident	88.5	Confident	109 Å²	109	45.2 Å²	45.2	57%	0.571	22%	0.215	S	C	*	.	H	α-helix	trans	-52.8	-41	177.8	-63	173.7	0	0	0	112.9	Q1024 T1028 K1029 R1030 W1065	Q1024-L1026 PolarHBondContact O-N 3.11Å; L1026-T1028 VanDerWaalsContact C-N 3.31Å; L1026-T1028 PolarHBondContact O-N 3.29Å; L1026-K1029 WeakPolarHBondContact O-CB 3.42Å; L1026-K1029 PolarHBondContact O-N 3.06Å; L1026-R1030 WeakPolarHBondContact O-CB 3.34Å; L1026-R1030 PolarHBondContact O-N 3.42Å; L1026-W1065 HydrophobicContact CB-CH2 4.2Å; L1026-W1065 HydrophobicContact CD2-CH2 3.85Å; L1026-W1065 HydrophobicContact CD2-CZ2 3.78Å
1027	D	82.6	Confident	88.3	Confident	94 Å²	94	46.6 Å²	46.6	50%	0.503	23%	0.229	S	C	.	.	H	α-helix	trans	-64	-35.3	177.8	-52	-57.9	0	0	0	112.8	R1025 R1030 N1031	R1025-D1027 VanDerWaalsContact C-N 3.27Å; R1025-D1027 PolarHBondContact O-N 3.4Å; D1027-R1030 WeakPolarHBondContact O-CB 3.47Å; D1027-R1030 PolarHBondContact O-N 2.72Å; D1027-N1031 WeakPolarHBondContact O-CB 3.38Å; D1027-N1031 PolarHBondContact O-N 3.11Å; D1027-N1031 PolarHBondContact O-ND2 3.36Å; D1027-N1031 PolarHBondContact O-OD1 3.05Å
1028	T	86.7	Confident	88.2	Confident	6 Å²	6	48.3 Å²	48.3	4%	0.037	24%	0.236	C	C	.	.	H	α-helix	trans	-70.5	-40.9	178.6	-61.3	0	0	0	0	110.3	E984 L1019 R1025 L1026 A1032	E984-T1028 HydrophobicContact CB-CG2 4.26Å; E984-T1028 PolarHBondContact O-OG1 3.32Å; L1019-T1028 HydrophobicContact CD1-CG2 3.91Å; L1019-T1028 HydrophobicContact CD2-CG2 3.97Å; L1019-T1028 HydrophobicContact CG-CG2 4.06Å; R1025-T1028 WeakPolarHBondContact O-CB 3.45Å; R1025-T1028 PolarHBondContact O-N 3.21Å; L1026-T1028 VanDerWaalsContact C-N 3.31Å; L1026-T1028 PolarHBondContact O-N 3.29Å; T1028-A1032 VanDerWaalsContact O-CB 3.32Å; T1028-A1032 WeakPolarHBondContact O-CB 3.3Å; T1028-A1032 PolarHBondContact O-N 2.83Å; T1028-A1032 VanDerWaalsContact O-N 3.13Å
1029	K	88.6	Confident	88.2	Confident	42 Å²	42	48 Å²	48	18%	0.183	23%	0.234	C	C	.	.	H	α-helix	trans	-59.5	-45.8	168.6	-62	-175.7	-168.9	-88.1	0	111.7	I1020 S1023 R1025 L1026 A1032 A1033 F1062 W1065	I1020-K1029 PolarHBondContact O-NZ 3.3Å; S1023-K1029 WeakPolarHBondContact O-CE 3.38Å; S1023-K1029 PolarHBondContact O-NZ 3.11Å; R1025-K1029 PolarHBondContact O-N 3.24Å; R1025-K1029 VanDerWaalsContact O-N 3.16Å; L1026-K1029 WeakPolarHBondContact O-CB 3.42Å; L1026-K1029 PolarHBondContact O-N 3.06Å; K1029-A1032 PolarHBondContact O-N 2.73Å; K1029-A1033 WeakPolarHBondContact O-CB 3.34Å; K1029-A1033 PolarHBondContact O-N 2.95Å; K1029-F1062 HydrophobicContact CB-CE1 4.08Å; K1029-F1062 HydrophobicContact CB-CZ 3.98Å; K1029-W1065 HydrophobicContact CB-CH2 4.26Å
1030	R	86	Confident	88.2	Confident	92 Å²	92	48.6 Å²	48.6	35%	0.347	24%	0.239	S	C	.	.	H	α-helix	trans	-58.4	-52.8	179.8	-168.1	178.5	177.7	-178.9	-1.3	111.8	L1026 D1027 A1032 A1033 I1034 W1065	L1026-R1030 WeakPolarHBondContact O-CB 3.34Å; L1026-R1030 PolarHBondContact O-N 3.42Å; D1027-R1030 WeakPolarHBondContact O-CB 3.47Å; D1027-R1030 PolarHBondContact O-N 2.72Å; R1030-A1032 VanDerWaalsContact C-N 3.32Å; R1030-A1032 PolarHBondContact O-N 2.85Å; R1030-A1033 PolarHBondContact O-N 3.49Å; R1030-I1034 HydrophobicContact CG-CD1 3.91Å; R1030-I1034 WeakPolarHBondContact O-CG1 3.28Å; R1030-I1034 PolarHBondContact O-N 2.81Å; R1030-W1065 HydrophobicContact CB-CZ3 3.93Å; R1030-W1065 HydrophobicContact CG-CZ3 4.42Å
1031	N	89.2	Confident	88.1	Confident	22 Å²	22	55.1 Å²	55.1	12%	0.118	27%	0.269	C	S	.	.	H	α-helix	trans	-66.3	-36.8	-176.7	-59.6	-13.2	0	0	0	111.2	G988 C991 L992 D1027 L1035	G988-N1031 PolarHBondContact O-ND2 3.14Å; C991-N1031 HydrophobicContact CB-CB 3.74Å; L992-N1031 HydrophobicContact CD2-CB 4.35Å; L992-N1031 HydrophobicContact CG-CB 4.46Å; L992-N1031 WeakPolarHBondContact CG-ND2 3.32Å; D1027-N1031 WeakPolarHBondContact O-CB 3.38Å; D1027-N1031 PolarHBondContact O-N 3.11Å; D1027-N1031 PolarHBondContact O-ND2 3.36Å; D1027-N1031 PolarHBondContact O-OD1 3.05Å; N1031-L1035 WeakPolarHBondContact O-CB 3.29Å; N1031-L1035 PolarHBondContact O-N 3.05Å
1032	A	91.5	Very high	88	Confident	0 Å²	0	52.7 Å²	52.7	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-64.8	-44.5	173.5	0	0	0	0	0	112.2	L1016 L1019 I1020 T1028 K1029 R1030 L1035 I1036	L1016-A1032 HydrophobicContact CD2-CB 3.9Å; L1019-A1032 HydrophobicContact CD2-CB 4.06Å; I1020-A1032 HydrophobicContact CD1-CB 4.08Å; I1020-A1032 HydrophobicContact CG1-CB 3.69Å; T1028-A1032 VanDerWaalsContact O-CB 3.32Å; T1028-A1032 WeakPolarHBondContact O-CB 3.3Å; T1028-A1032 PolarHBondContact O-N 2.83Å; T1028-A1032 VanDerWaalsContact O-N 3.13Å; K1029-A1032 PolarHBondContact O-N 2.73Å; R1030-A1032 VanDerWaalsContact C-N 3.32Å; R1030-A1032 PolarHBondContact O-N 2.85Å; A1032-L1035 PolarHBondContact O-N 2.99Å; A1032-I1036 WeakPolarHBondContact O-CG1 3.45Å; A1032-I1036 PolarHBondContact O-N 3.35Å
1033	A	90.3	Very high	88.1	Confident	12 Å²	12	49.4 Å²	49.4	10%	0.099	25%	0.252	C	S	.	.	H	α-helix	trans	-64.4	-43	178.4	0	0	0	0	0	112.5	I1020 K1029 R1030 L1035 I1036 G1037 L1059 F1062	I1020-A1033 HydrophobicContact CD1-CB 4.04Å; K1029-A1033 WeakPolarHBondContact O-CB 3.34Å; K1029-A1033 PolarHBondContact O-N 2.95Å; R1030-A1033 PolarHBondContact O-N 3.49Å; A1033-L1035 VanDerWaalsContact C-N 3.33Å; A1033-L1035 PolarHBondContact O-N 2.87Å; A1033-I1036 PolarHBondContact O-N 3.29Å; A1033-G1037 PolarHBondContact O-N 3.2Å; A1033-L1059 HydrophobicContact CB-CD2 3.74Å; A1033-F1062 HydrophobicContact CB-CD1 3.69Å; A1033-F1062 HydrophobicContact CB-CD2 4.38Å; A1033-F1062 HydrophobicContact CB-CE1 3.67Å; A1033-F1062 HydrophobicContact CB-CE2 4.36Å; A1033-F1062 HydrophobicContact CB-CG 4.05Å; A1033-F1062 HydrophobicContact CB-CZ 4.01Å
1034	I	88.8	Confident	88.3	Confident	63 Å²	63	53.8 Å²	53.8	32%	0.323	27%	0.271	S	S	.	.	H	α-helix	trans	-64	-39.3	175.7	-62.5	164.9	0	0	0	110.8	Q995 R1030 G1037 K1038	Q995-I1034 HydrophobicContact CG-CG2 3.91Å; R1030-I1034 HydrophobicContact CG-CD1 3.91Å; R1030-I1034 WeakPolarHBondContact O-CG1 3.28Å; R1030-I1034 PolarHBondContact O-N 2.81Å; I1034-G1037 PolarHBondContact O-N 3.38Å; I1034-K1038 PolarHBondContact O-N 2.73Å
1035	L	92.3	Very high	88.7	Confident	0 Å²	0	48.7 Å²	48.7	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-64.3	-43.8	175.6	177.3	58.4	0	0	0	112.3	C991 L994 L1016 N1031 A1032 A1033 G1037 K1038 L1039	C991-L1035 HydrophobicContact CB-CD2 4.38Å; L994-L1035 HydrophobicContact CB-CD1 3.76Å; L994-L1035 HydrophobicContact CB-CD2 3.67Å; L994-L1035 HydrophobicContact CB-CG 4.4Å; L994-L1035 HydrophobicContact CD1-CD2 3.9Å; L994-L1035 HydrophobicContact CG-CD2 4.45Å; L1016-L1035 HydrophobicContact CD1-CB 4.45Å; L1016-L1035 HydrophobicContact CD1-CD2 3.78Å; L1016-L1035 HydrophobicContact CD1-CG 3.88Å; L1016-L1035 HydrophobicContact CD2-CD2 4Å; N1031-L1035 WeakPolarHBondContact O-CB 3.29Å; N1031-L1035 PolarHBondContact O-N 3.05Å; A1032-L1035 PolarHBondContact O-N 2.99Å; A1033-L1035 VanDerWaalsContact C-N 3.33Å; A1033-L1035 PolarHBondContact O-N 2.87Å; L1035-G1037 VanDerWaalsContact C-N 3.29Å; L1035-G1037 PolarHBondContact O-N 3.03Å; L1035-K1038 PolarHBondContact O-N 2.76Å; L1035-L1039 HydrophobicContact CD1-CD1 4.05Å; L1035-L1039 HydrophobicContact CD1-CG 4.02Å; L1035-L1039 HydrophobicContact CG-CD1 4.06Å; L1035-L1039 HydrophobicContact CG-CG 4.46Å; L1035-L1039 VanDerWaalsContact O-CG 3.3Å; L1035-L1039 WeakPolarHBondContact O-CG 3.39Å; L1035-L1039 PolarHBondContact O-N 3.49Å
1036	I	91.5	Very high	89.1	Confident	0 Å²	0	44.1 Å²	44.1	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-57.4	-46.3	172	-64.6	171	0	0	0	109.8	L1016 L1017 I1020 A1032 A1033 K1038 L1039 A1040 L1050 L1059	L1016-I1036 HydrophobicContact CB-CD1 3.71Å; L1016-I1036 HydrophobicContact CB-CG1 3.68Å; L1016-I1036 HydrophobicContact CD1-CG1 3.81Å; L1016-I1036 HydrophobicContact CG-CG1 4.37Å; L1017-I1036 HydrophobicContact CD2-CD1 3.84Å; L1017-I1036 HydrophobicContact CG-CD1 4.04Å; I1020-I1036 HydrophobicContact CD1-CD1 3.66Å; A1032-I1036 WeakPolarHBondContact O-CG1 3.45Å; A1032-I1036 PolarHBondContact O-N 3.35Å; A1033-I1036 PolarHBondContact O-N 3.29Å; I1036-K1038 PolarHBondContact O-N 3.2Å; I1036-L1039 PolarHBondContact O-N 2.69Å; I1036-A1040 WeakPolarHBondContact O-CB 3.34Å; I1036-A1040 PolarHBondContact O-N 3.5Å; I1036-L1050 HydrophobicContact CG2-CD1 3.65Å; I1036-L1050 HydrophobicContact CG2-CD2 4.01Å; I1036-L1050 HydrophobicContact CG2-CG 4.47Å; I1036-L1059 HydrophobicContact CD1-CD2 4.42Å; I1036-L1059 HydrophobicContact CG2-CD1 3.89Å
1037	G	87.8	Confident	89.4	Confident	29 Å²	29	42.7 Å²	42.7	30%	0.299	22%	0.222	S	C	.	.	H	α-helix	trans	-55	-48.4	177.5	0	0	0	0	0	113.1	A1033 I1034 L1035 A1040 Q1041	A1033-G1037 PolarHBondContact O-N 3.2Å; I1034-G1037 PolarHBondContact O-N 3.38Å; L1035-G1037 VanDerWaalsContact C-N 3.29Å; L1035-G1037 PolarHBondContact O-N 3.03Å; G1037-A1040 PolarHBondContact O-N 3.38Å; G1037-Q1041 VanDerWaalsContact O-CG 3.29Å; G1037-Q1041 WeakPolarHBondContact O-CG 3.36Å; G1037-Q1041 PolarHBondContact O-N 3.1Å
1038	K	90.2	Very high	89.9	Confident	44 Å²	44	42.2 Å²	42.2	19%	0.191	22%	0.219	C	C	.	.	H	α-helix	trans	-63.8	-45.7	176.1	-72.6	-164.1	176.6	-165.4	0	112.7	Q995 A998 S999 I1034 L1035 I1036 A1040 Q1041 S1042	Q995-K1038 HydrophobicContact CG-CD 4.36Å; Q995-K1038 WeakPolarHBondContact O-CD 3.32Å; Q995-K1038 WeakPolarHBondContact O-CE 3.44Å; Q995-K1038 PolarHBondContact O-NZ 3.06Å; A998-K1038 HydrophobicContact CB-CB 4.12Å; A998-K1038 HydrophobicContact CB-CD 4.08Å; S999-K1038 PolarHBondContact OG-NZ 2.77Å; I1034-K1038 PolarHBondContact O-N 2.73Å; L1035-K1038 PolarHBondContact O-N 2.76Å; I1036-K1038 PolarHBondContact O-N 3.2Å; K1038-A1040 VanDerWaalsContact C-N 3.31Å; K1038-A1040 PolarHBondContact O-N 2.84Å; K1038-Q1041 PolarHBondContact O-N 3.45Å; K1038-Q1041 VanDerWaalsContact O-N 3.16Å; K1038-S1042 PolarHBondContact O-N 3.42Å; K1038-S1042 PolarHBondContact O-OG 2.72Å
1039	L	91.4	Very high	90.1	Very high	0 Å²	0	44 Å²	44	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-62	-40.6	178.4	-68.3	174.3	0	0	0	111.9	L1003 A1004 L1007 V1012 I1013 L1016 L1035 I1036 S1042 S1043 H1046	L1003-L1039 HydrophobicContact CD2-CD2 3.79Å; A1004-L1039 HydrophobicContact CB-CD2 4.03Å; L1007-L1039 HydrophobicContact CD1-CD1 4.12Å; L1007-L1039 HydrophobicContact CD1-CD2 3.92Å; V1012-L1039 HydrophobicContact CG1-CD1 4.27Å; I1013-L1039 HydrophobicContact CD1-CB 4.27Å; I1013-L1039 HydrophobicContact CD1-CD1 4.11Å; L1016-L1039 HydrophobicContact CD1-CD1 4.28Å; L1035-L1039 HydrophobicContact CD1-CD1 4.05Å; L1035-L1039 HydrophobicContact CD1-CG 4.02Å; L1035-L1039 HydrophobicContact CG-CD1 4.06Å; L1035-L1039 HydrophobicContact CG-CG 4.46Å; L1035-L1039 VanDerWaalsContact O-CG 3.3Å; L1035-L1039 WeakPolarHBondContact O-CG 3.39Å; L1035-L1039 PolarHBondContact O-N 3.49Å; I1036-L1039 PolarHBondContact O-N 2.69Å; L1039-S1042 PolarHBondContact O-N 2.86Å; L1039-S1043 PolarHBondContact O-N 2.82Å; L1039-S1043 VanDerWaalsContact O-N 3.12Å; L1039-H1046 HydrophobicContact CB-CB 4.33Å; L1039-H1046 WeakPolarHBondContact O-CB 3.34Å; L1039-H1046 PolarHBondContact O-CD2 2.86Å
1040	A	89	Confident	90.2	Very high	13 Å²	13	42.2 Å²	42.2	11%	0.107	22%	0.22	C	C	.	.	H	α-helix	trans	-71.3	-24.9	175.8	0	0	0	0	0	113.2	I1036 G1037 K1038 R1047 L1050	I1036-A1040 WeakPolarHBondContact O-CB 3.34Å; I1036-A1040 PolarHBondContact O-N 3.5Å; G1037-A1040 PolarHBondContact O-N 3.38Å; K1038-A1040 VanDerWaalsContact C-N 3.31Å; K1038-A1040 PolarHBondContact O-N 2.84Å; A1040-R1047 HydrophobicContact CB-CG 4.06Å; A1040-R1047 WeakPolarHBondContact O-CD 3.32Å; A1040-R1047 WeakPolarHBondContact O-CG 3.34Å; A1040-R1047 PolarHBondContact O-NH1 3.3Å; A1040-L1050 HydrophobicContact CB-CD2 4.29Å
1041	Q	88.1	Confident	90.5	Very high	146 Å²	146	41.1 Å²	41.1	68%	0.682	23%	0.226	S	C	*	.	H	α-helix	trans	-72.1	-51.5	168.9	-75.4	166.7	-4.5	0	0	110.6	G1037 K1038 S1043 R1047	G1037-Q1041 VanDerWaalsContact O-CG 3.29Å; G1037-Q1041 WeakPolarHBondContact O-CG 3.36Å; G1037-Q1041 PolarHBondContact O-N 3.1Å; K1038-Q1041 PolarHBondContact O-N 3.45Å; K1038-Q1041 VanDerWaalsContact O-N 3.16Å; Q1041-S1043 PolarHBondContact O-N 3.31Å; Q1041-R1047 PolarHBondContact O-NH1 3.22Å
1042	S	87.4	Confident	90.7	Very high	72 Å²	72	47.8 Å²	47.8	50%	0.503	25%	0.25	S	C	.	.	H	α-helix	trans	-74.4	-14.3	-172.7	-52.7	0	0	0	0	115.5	K1038 L1039	K1038-S1042 PolarHBondContact O-N 3.42Å; K1038-S1042 PolarHBondContact O-OG 2.72Å; L1039-S1042 PolarHBondContact O-N 2.86Å
1043	S	88.8	Confident	90.7	Very high	13 Å²	13	50 Å²	50	9%	0.091	26%	0.261	C	S	.	.			trans	-149.4	134.4	178.2	-167.7	0	0	0	0	114.4	Q1008 L1039 Q1041 V1045 H1046 R1047	Q1008-S1043 PolarHBondContact NE2-OG 2.73Å; Q1008-S1043 VanDerWaalsContact NE2-OG 3.14Å; L1039-S1043 PolarHBondContact O-N 2.82Å; L1039-S1043 VanDerWaalsContact O-N 3.12Å; Q1041-S1043 PolarHBondContact O-N 3.31Å; S1043-V1045 VanDerWaalsContact C-N 3.3Å; S1043-V1045 PolarHBondContact O-N 3.42Å; S1043-V1045 PolarHBondContact OG-N 3.26Å; S1043-H1046 PolarHBondContact O-N 3.22Å; S1043-R1047 PolarHBondContact O-N 2.89Å
1044	Q	90.9	Very high	90.7	Very high	97 Å²	97	54.1 Å²	54.1	45%	0.453	28%	0.282	S	S	.	.	H	α-helix	trans	-60	-39.3	171.7	-173.8	61.9	38.3	0	0	112	H1046 R1047 D1048	Q1044-H1046 PolarHBondContact O-N 3.1Å; Q1044-H1046 VanDerWaalsContact O-N 3.17Å; Q1044-R1047 CarbonylContact O-C 3.2Å; Q1044-R1047 WeakPolarHBondContact O-CA 3.27Å; Q1044-R1047 WeakPolarHBondContact O-CB 3.47Å; Q1044-R1047 PolarHBondContact O-N 2.97Å; Q1044-R1047 VanDerWaalsContact OE1-CZ 3.23Å; Q1044-D1048 PolarHBondContact NE2-OD1 2.9Å; Q1044-D1048 VanDerWaalsContact O-CG 3.24Å; Q1044-D1048 PolarHBondContact O-N 2.77Å
1045	V	93.1	Very high	90.5	Very high	67 Å²	67	51.1 Å²	51.1	41%	0.406	27%	0.266	S	S	.	.	H	α-helix	trans	-57.3	-35.9	-179.9	-176.6	0	0	0	0	111.7	Q1008 S1043 E1049	Q1008-V1045 HydrophobicContact CG-CB 4.29Å; Q1008-V1045 HydrophobicContact CG-CG1 4.4Å; S1043-V1045 VanDerWaalsContact C-N 3.3Å; S1043-V1045 PolarHBondContact O-N 3.42Å; S1043-V1045 PolarHBondContact OG-N 3.26Å; V1045-E1049 WeakPolarHBondContact O-CB 3.3Å; V1045-E1049 PolarHBondContact O-N 3.28Å
1046	H	91.4	Very high	90.2	Very high	5 Å²	5	56.3 Å²	56.3	2%	0.023	29%	0.287	C	S	.	.	H	α-helix	trans	-76.3	-27.5	176	-66.1	-44.7	0	0	0	112.7	A1004 I1013 L1039 S1043 Q1044 L1050	A1004-H1046 PolarHBondContact O-NE2 3.39Å; I1013-H1046 HydrophobicContact CD1-CB 4.11Å; I1013-H1046 HydrophobicContact CG1-CB 4.41Å; L1039-H1046 HydrophobicContact CB-CB 4.33Å; L1039-H1046 WeakPolarHBondContact O-CB 3.34Å; L1039-H1046 PolarHBondContact O-CD2 2.86Å; S1043-H1046 PolarHBondContact O-N 3.22Å; Q1044-H1046 PolarHBondContact O-N 3.1Å; Q1044-H1046 VanDerWaalsContact O-N 3.17Å; H1046-L1050 WeakPolarHBondContact O-CB 3.36Å; H1046-L1050 PolarHBondContact O-N 2.87Å
1047	R	91.3	Very high	89.9	Confident	80 Å²	80	59.1 Å²	59.1	30%	0.302	31%	0.306	S	S	.	.	H	α-helix	trans	-71.2	-41.5	171	-62.9	-172	-78.1	-98.2	10.3	111.8	A1040 Q1041 S1043 Q1044 L1050 S1051	A1040-R1047 HydrophobicContact CB-CG 4.06Å; A1040-R1047 WeakPolarHBondContact O-CD 3.32Å; A1040-R1047 WeakPolarHBondContact O-CG 3.34Å; A1040-R1047 PolarHBondContact O-NH1 3.3Å; Q1041-R1047 PolarHBondContact O-NH1 3.22Å; S1043-R1047 PolarHBondContact O-N 2.89Å; Q1044-R1047 CarbonylContact O-C 3.2Å; Q1044-R1047 WeakPolarHBondContact O-CA 3.27Å; Q1044-R1047 WeakPolarHBondContact O-CB 3.47Å; Q1044-R1047 PolarHBondContact O-N 2.97Å; Q1044-R1047 VanDerWaalsContact OE1-CZ 3.23Å; R1047-L1050 PolarHBondContact O-N 3.42Å; R1047-S1051 WeakPolarHBondContact O-CB 3.3Å; R1047-S1051 PolarHBondContact O-N 3.42Å; R1047-S1051 PolarHBondContact O-OG 2.93Å
1048	D	93.1	Very high	89.7	Confident	83 Å²	83	58.9 Å²	58.9	44%	0.444	30%	0.299	S	S	.	.	H	α-helix	trans	-64.6	-46.7	177.7	-57	-29	0	0	0	110.2	Q1044 S1051 R1052	Q1044-D1048 PolarHBondContact NE2-OD1 2.9Å; Q1044-D1048 VanDerWaalsContact O-CG 3.24Å; Q1044-D1048 PolarHBondContact O-N 2.77Å; D1048-S1051 WeakPolarHBondContact O-CB 3.13Å; D1048-S1051 PolarHBondContact O-N 3.34Å; D1048-R1052 VanDerWaalsContact O-CB 3.31Å; D1048-R1052 WeakPolarHBondContact O-CB 3.44Å; D1048-R1052 PolarHBondContact O-N 3.43Å
1049	E	92.2	Very high	89.3	Confident	45 Å²	45	58.2 Å²	58.2	21%	0.21	30%	0.297	C	S	.	.	H	α-helix	trans	-64.3	-38.9	175.2	-179	66.8	176.6	0	0	112.4	I1013 V1045 S1051 R1052 L1053	I1013-E1049 HydrophobicContact CB-CG 4Å; I1013-E1049 HydrophobicContact CG1-CG 4.18Å; I1013-E1049 HydrophobicContact CG2-CG 4.43Å; V1045-E1049 WeakPolarHBondContact O-CB 3.3Å; V1045-E1049 PolarHBondContact O-N 3.28Å; E1049-S1051 VanDerWaalsContact C-N 3.34Å; E1049-R1052 PolarHBondContact O-N 3.25Å; E1049-R1052 IonicContact OE1-CZ 2.73Å; E1049-R1052 IonicContact OE1-NH2 3.72Å; E1049-R1052 PolarHBondContact OE1-NH2 3.13Å; E1049-R1052 IonicContact OE2-CZ 2.65Å; E1049-R1052 VanDerWaalsContact OE2-CZ 3.25Å; E1049-R1052 IonicContact OE2-NE 3.08Å; E1049-R1052 PolarHBondContact OE2-NE 2.84Å; E1049-R1052 IonicContact OE2-NH2 3.63Å; E1049-R1052 PolarHBondContact OE2-NH2 2.72Å; E1049-L1053 HydrophobicContact CG-CD1 4Å; E1049-L1053 WeakPolarHBondContact O-CB 3.33Å; E1049-L1053 VanDerWaalsContact O-CG 3.29Å; E1049-L1053 WeakPolarHBondContact O-CG 3.31Å; E1049-L1053 PolarHBondContact O-N 3.2Å; E1049-L1053 VanDerWaalsContact O-N 3.1Å
1050	L	90.9	Very high	88.7	Confident	3 Å²	3	62.1 Å²	62.1	2%	0.016	32%	0.321	C	S	.	.	H	α-helix	trans	-63.6	-40.2	174.6	-173.5	68.7	0	0	0	111.8	I1013 L1017 I1036 A1040 H1046 R1047 D1054 G1055 Y1056 L1059	I1013-L1050 HydrophobicContact CG2-CB 4.2Å; I1013-L1050 HydrophobicContact CG2-CD1 3.77Å; L1017-L1050 HydrophobicContact CD1-CD1 4.25Å; L1017-L1050 HydrophobicContact CD2-CD1 4.23Å; I1036-L1050 HydrophobicContact CG2-CD1 3.65Å; I1036-L1050 HydrophobicContact CG2-CD2 4.01Å; I1036-L1050 HydrophobicContact CG2-CG 4.47Å; A1040-L1050 HydrophobicContact CB-CD2 4.29Å; H1046-L1050 WeakPolarHBondContact O-CB 3.36Å; H1046-L1050 PolarHBondContact O-N 2.87Å; R1047-L1050 PolarHBondContact O-N 3.42Å; L1050-D1054 PolarHBondContact O-N 2.98Å; L1050-G1055 PolarHBondContact O-N 3.38Å; L1050-Y1056 HydrophobicContact CB-CE2 4.4Å; L1050-Y1056 HydrophobicContact CD2-CD2 4.44Å; L1050-Y1056 HydrophobicContact CD2-CE1 4.05Å; L1050-Y1056 HydrophobicContact CD2-CE2 3.96Å; L1050-Y1056 HydrophobicContact CG-CD2 4.25Å; L1050-Y1056 HydrophobicContact CG-CE2 3.98Å; L1050-L1059 HydrophobicContact CD1-CD1 4.16Å; L1050-L1059 HydrophobicContact CD2-CD1 4.09Å
1051	S	91.8	Very high	88	Confident	69 Å²	69	65 Å²	65	48%	0.483	34%	0.339	S	S	.	.	H	α-helix	trans	-65.5	-46.4	175	-53.8	0	0	0	0	111.3	R1047 D1048 E1049 L1053 D1054	R1047-S1051 WeakPolarHBondContact O-CB 3.3Å; R1047-S1051 PolarHBondContact O-N 3.42Å; R1047-S1051 PolarHBondContact O-OG 2.93Å; D1048-S1051 WeakPolarHBondContact O-CB 3.13Å; D1048-S1051 PolarHBondContact O-N 3.34Å; E1049-S1051 VanDerWaalsContact C-N 3.34Å; S1051-L1053 PolarHBondContact O-N 2.61Å; S1051-D1054 PolarHBondContact O-N 2.66Å; S1051-D1054 VanDerWaalsContact O-N 3.13Å
1052	R	93.8	Very high	87.2	Confident	163 Å²	163	59.5 Å²	59.5	62%	0.615	31%	0.313	S	S	*	.	H	α-helix	trans	-63.2	-23.1	-180	-164.4	-164.9	62.8	67.7	-2.6	113.4	D1048 E1049	D1048-R1052 VanDerWaalsContact O-CB 3.31Å; D1048-R1052 WeakPolarHBondContact O-CB 3.44Å; D1048-R1052 PolarHBondContact O-N 3.43Å; E1049-R1052 PolarHBondContact O-N 3.25Å; E1049-R1052 IonicContact OE1-CZ 2.73Å; E1049-R1052 IonicContact OE1-NH2 3.72Å; E1049-R1052 PolarHBondContact OE1-NH2 3.13Å; E1049-R1052 IonicContact OE2-CZ 2.65Å; E1049-R1052 VanDerWaalsContact OE2-CZ 3.25Å; E1049-R1052 IonicContact OE2-NE 3.08Å; E1049-R1052 PolarHBondContact OE2-NE 2.84Å; E1049-R1052 IonicContact OE2-NH2 3.63Å; E1049-R1052 PolarHBondContact OE2-NH2 2.72Å
1053	L	91.8	Very high	86.2	Confident	45 Å²	45	61.9 Å²	61.9	24%	0.236	32%	0.32	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.7	5	178.7	-69.3	174	0	0	0	113.9	I1013 Y1014 L1017 E1049 S1051 G1055	I1013-L1053 HydrophobicContact CB-CD1 4.45Å; I1013-L1053 HydrophobicContact CG2-CD1 4.18Å; Y1014-L1053 HydrophobicContact CD2-CD1 4.48Å; Y1014-L1053 HydrophobicContact CD2-CD2 4.11Å; L1017-L1053 HydrophobicContact CD1-CB 3.87Å; L1017-L1053 HydrophobicContact CD1-CD1 4.08Å; E1049-L1053 HydrophobicContact CG-CD1 4Å; E1049-L1053 WeakPolarHBondContact O-CB 3.33Å; E1049-L1053 VanDerWaalsContact O-CG 3.29Å; E1049-L1053 WeakPolarHBondContact O-CG 3.31Å; E1049-L1053 PolarHBondContact O-N 3.2Å; E1049-L1053 VanDerWaalsContact O-N 3.1Å; S1051-L1053 PolarHBondContact O-N 2.61Å; L1053-G1055 PolarHBondContact O-N 2.9Å
1054	D	89.9	Confident	84.8	Confident	99 Å²	99	64.5 Å²	64.5	53%	0.529	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	50	32.8	-169	-171.7	42.4	0	0	0	113.4	L1050 S1051 Y1056 S1057	L1050-D1054 PolarHBondContact O-N 2.98Å; S1051-D1054 PolarHBondContact O-N 2.66Å; S1051-D1054 VanDerWaalsContact O-N 3.13Å; D1054-Y1056 PolarHBondContact O-N 2.97Å; D1054-S1057 VanDerWaalsContact CG-OG 3.31Å; D1054-S1057 PolarHBondContact O-N 2.96Å; D1054-S1057 VanDerWaalsContact O-N 3.11Å; D1054-S1057 PolarHBondContact O-OG 3.3Å; D1054-S1057 WeakPolarHBondContact OD2-CB 3.15Å; D1054-S1057 PolarHBondContact OD2-OG 2.99Å
1055	G	84.8	Confident	83	Confident	0 Å²	0	63.5 Å²	63.5	0%	0	33%	0.33	C	S	.	.	H	α-helix	trans	-65.4	-15.7	-176.7	0	0	0	0	0	113.9	L1050 L1053 V1058 L1059	L1050-G1055 PolarHBondContact O-N 3.38Å; L1053-G1055 PolarHBondContact O-N 2.9Å; G1055-V1058 PolarHBondContact O-N 3.12Å; G1055-L1059 WeakPolarHBondContact O-CB 3.22Å; G1055-L1059 VanDerWaalsContact O-CG 3.29Å; G1055-L1059 WeakPolarHBondContact O-CG 3.44Å; G1055-L1059 PolarHBondContact O-N 3.14Å
1056	Y	84.8	Confident	81.1	Confident	110 Å²	110	64.5 Å²	64.5	43%	0.431	34%	0.337	S	S	.	.	H	α-helix	trans	-66.6	-35.5	173.1	-70.7	-80.4	0	0	0	112.8	L1050 D1054 L1059 T1060	L1050-Y1056 HydrophobicContact CB-CE2 4.4Å; L1050-Y1056 HydrophobicContact CD2-CD2 4.44Å; L1050-Y1056 HydrophobicContact CD2-CE1 4.05Å; L1050-Y1056 HydrophobicContact CD2-CE2 3.96Å; L1050-Y1056 HydrophobicContact CG-CD2 4.25Å; L1050-Y1056 HydrophobicContact CG-CE2 3.98Å; D1054-Y1056 PolarHBondContact O-N 2.97Å; Y1056-L1059 PolarHBondContact O-N 2.85Å; Y1056-T1060 PolarHBondContact O-N 3.17Å; Y1056-T1060 PolarHBondContact O-OG1 3.31Å
1057	S	85.3	Confident	79	Confident	59 Å²	59	66.2 Å²	66.2	41%	0.413	35%	0.352	S	S	.	.	H	α-helix	trans	-66.4	-40.9	175.1	71.6	0	0	0	0	111.1	D1054 L1059 T1060 P1061	D1054-S1057 VanDerWaalsContact CG-OG 3.31Å; D1054-S1057 PolarHBondContact O-N 2.96Å; D1054-S1057 VanDerWaalsContact O-N 3.11Å; D1054-S1057 PolarHBondContact O-OG 3.3Å; D1054-S1057 WeakPolarHBondContact OD2-CB 3.15Å; D1054-S1057 PolarHBondContact OD2-OG 2.99Å; S1057-L1059 VanDerWaalsContact C-N 3.32Å; S1057-L1059 PolarHBondContact O-N 2.72Å; S1057-T1060 WeakPolarHBondContact O-CB 3.31Å; S1057-T1060 PolarHBondContact O-N 3.46Å; S1057-P1061 WeakPolarHBondContact O-CD 3.23Å
1058	V	83.3	Confident	76.3	Confident	24 Å²	24	64.5 Å²	64.5	15%	0.145	36%	0.355	C	S	.	.	H	α-helix	trans	-64.6	-33.4	175.3	-172.3	0	0	0	0	112.5	L1017 I1020 Q1021 G1055	L1017-V1058 HydrophobicContact CD2-CB 3.85Å; L1017-V1058 HydrophobicContact CD2-CG1 3.96Å; L1017-V1058 HydrophobicContact CD2-CG2 4.26Å; I1020-V1058 HydrophobicContact CB-CG1 4.38Å; I1020-V1058 HydrophobicContact CG2-CG1 3.77Å; Q1021-V1058 HydrophobicContact CG-CG1 4.03Å; G1055-V1058 PolarHBondContact O-N 3.12Å
1059	L	82.3	Confident	73.6	Confident	29 Å²	29	64.7 Å²	64.7	15%	0.152	36%	0.355	C	S	.	.	H	α-helix	trans	-85.8	-18.7	177.7	-71.1	173.2	0	0	0	114.1	I1020 A1033 I1036 L1050 G1055 Y1056 S1057 P1061 F1062	I1020-L1059 HydrophobicContact CD1-CD2 4.13Å; A1033-L1059 HydrophobicContact CB-CD2 3.74Å; I1036-L1059 HydrophobicContact CD1-CD2 4.42Å; I1036-L1059 HydrophobicContact CG2-CD1 3.89Å; L1050-L1059 HydrophobicContact CD1-CD1 4.16Å; L1050-L1059 HydrophobicContact CD2-CD1 4.09Å; G1055-L1059 WeakPolarHBondContact O-CB 3.22Å; G1055-L1059 VanDerWaalsContact O-CG 3.29Å; G1055-L1059 WeakPolarHBondContact O-CG 3.44Å; G1055-L1059 PolarHBondContact O-N 3.14Å; Y1056-L1059 PolarHBondContact O-N 2.85Å; S1057-L1059 VanDerWaalsContact C-N 3.32Å; S1057-L1059 PolarHBondContact O-N 2.72Å; L1059-P1061 VanDerWaalsContact C-CD 3.45Å; L1059-P1061 VanDerWaalsContact C-N 3.34Å; L1059-F1062 HydrophobicContact CD2-CD2 4.34Å; L1059-F1062 WeakPolarHBondContact O-CB 3.4Å; L1059-F1062 WeakPolarHBondContact O-CD2 3.38Å; L1059-F1062 PolarHBondContact O-N 3.06Å
1060	T	78.7	Confident	71.2	Confident	82 Å²	82	70.4 Å²	70.4	50%	0.503	38%	0.382	S	S	.	.	G	3₁₀ helix	trans	-53.1	-40.3	-177.7	-68.4	0	0	0	0	114	Y1056 S1057 F1062 N1063	Y1056-T1060 PolarHBondContact O-N 3.17Å; Y1056-T1060 PolarHBondContact O-OG1 3.31Å; S1057-T1060 WeakPolarHBondContact O-CB 3.31Å; S1057-T1060 PolarHBondContact O-N 3.46Å; T1060-F1062 PolarHBondContact O-N 3.44Å; T1060-N1063 WeakPolarHBondContact O-CB 3.46Å; T1060-N1063 PolarHBondContact O-N 3.4Å
1061	P	74.4	Confident	68.6	Low	74 Å²	74	80.7 Å²	80.7	48%	0.481	42%	0.421	S	S	.	.	G	3₁₀ helix	trans	-57.7	-30	175	-27.5	36.5	0	0	0	114.5	S1057 L1059 N1063 S1064	S1057-P1061 WeakPolarHBondContact O-CD 3.23Å; L1059-P1061 VanDerWaalsContact C-CD 3.45Å; L1059-P1061 VanDerWaalsContact C-N 3.34Å; P1061-N1063 VanDerWaalsContact C-N 3.29Å; P1061-N1063 PolarHBondContact O-N 3.41Å; P1061-S1064 WeakPolarHBondContact O-CB 3.38Å; P1061-S1064 PolarHBondContact O-N 3.35Å; P1061-S1064 VanDerWaalsContact O-N 3.11Å; P1061-S1064 PolarHBondContact O-OG 3.19Å
1062	F	71.4	Confident	65.6	Low	30 Å²	30	85 Å²	85	13%	0.132	45%	0.449	C	S	.	.	G	3₁₀ helix	trans	-73.8	-19.4	-176.9	-62.7	-99.2	0	0	0	112.8	I1020 K1029 A1033 L1059 T1060 S1064 W1065	I1020-F1062 HydrophobicContact CG1-CZ 4.46Å; I1020-F1062 HydrophobicContact CG2-CE2 3.74Å; I1020-F1062 HydrophobicContact CG2-CZ 3.69Å; K1029-F1062 HydrophobicContact CB-CE1 4.08Å; K1029-F1062 HydrophobicContact CB-CZ 3.98Å; A1033-F1062 HydrophobicContact CB-CD1 3.69Å; A1033-F1062 HydrophobicContact CB-CD2 4.38Å; A1033-F1062 HydrophobicContact CB-CE1 3.67Å; A1033-F1062 HydrophobicContact CB-CE2 4.36Å; A1033-F1062 HydrophobicContact CB-CG 4.05Å; A1033-F1062 HydrophobicContact CB-CZ 4.01Å; L1059-F1062 HydrophobicContact CD2-CD2 4.34Å; L1059-F1062 WeakPolarHBondContact O-CB 3.4Å; L1059-F1062 WeakPolarHBondContact O-CD2 3.38Å; L1059-F1062 PolarHBondContact O-N 3.06Å; T1060-F1062 PolarHBondContact O-N 3.44Å; F1062-S1064 PolarHBondContact O-N 2.87Å; F1062-W1065 HydrophobicContact CD1-CD2 4.03Å; F1062-W1065 AromaticContact CD1-CE3 3.54Å; F1062-W1065 HydrophobicContact CD1-CE3 3.54Å; F1062-W1065 HydrophobicContact CD1-CH2 4.33Å; F1062-W1065 AromaticContact CD1-CZ3 3.71Å; F1062-W1065 HydrophobicContact CD1-CZ3 3.71Å; F1062-W1065 HydrophobicContact CE1-CD2 4.47Å; F1062-W1065 AromaticContact CE1-CE3 3.83Å; F1062-W1065 HydrophobicContact CE1-CE3 3.83Å; F1062-W1065 AromaticContact CE1-CH2 3.81Å; F1062-W1065 HydrophobicContact CE1-CH2 3.81Å; F1062-W1065 HydrophobicContact CE1-CZ2 4.45Å; F1062-W1065 AromaticContact CE1-CZ3 3.46Å; F1062-W1065 HydrophobicContact CE1-CZ3 3.46Å; F1062-W1065 VanDerWaalsContact CE1-CZ3 3.46Å; F1062-W1065 WeakPolarHBondContact O-CB 3.42Å; F1062-W1065 PolarHBondContact O-N 2.87Å
1063	N	66.2	Low	64.2	Low	122 Å²	122	81.2 Å²	81.2	65%	0.652	44%	0.441	S	S	*	.	H	α-helix	trans	-62.9	-21.9	169.5	-65.8	-16.7	0	0	0	112.1	T1060 P1061 T1066	T1060-N1063 WeakPolarHBondContact O-CB 3.46Å; T1060-N1063 PolarHBondContact O-N 3.4Å; P1061-N1063 VanDerWaalsContact C-N 3.29Å; P1061-N1063 PolarHBondContact O-N 3.41Å; N1063-T1066 PolarHBondContact O-OG1 3.12Å
1064	S	60.2	Low	62.7	Low	68 Å²	68	83.1 Å²	83.1	48%	0.476	45%	0.452	S	S	.	.	H	α-helix	trans	-81.3	-21.1	171	76.4	0	0	0	0	113.2	P1061 F1062 A1067 A1068	P1061-S1064 WeakPolarHBondContact O-CB 3.38Å; P1061-S1064 PolarHBondContact O-N 3.35Å; P1061-S1064 VanDerWaalsContact O-N 3.11Å; P1061-S1064 PolarHBondContact O-OG 3.19Å; F1062-S1064 PolarHBondContact O-N 2.87Å; S1064-A1067 PolarHBondContact O-N 3.47Å; S1064-A1068 WeakPolarHBondContact O-CB 3.47Å; S1064-A1068 PolarHBondContact O-N 3.16Å
1065	W	53.2	Low	61.2	Low	77 Å²	77	82.2 Å²	82.2	29%	0.292	45%	0.447	S	S	.	.	H	α-helix	trans	-77.3	-31.8	-176.7	-75.6	11.7	0	0	0	113	L1026 K1029 R1030 F1062 A1068 L1069	L1026-W1065 HydrophobicContact CB-CH2 4.2Å; L1026-W1065 HydrophobicContact CD2-CH2 3.85Å; L1026-W1065 HydrophobicContact CD2-CZ2 3.78Å; K1029-W1065 HydrophobicContact CB-CH2 4.26Å; R1030-W1065 HydrophobicContact CB-CZ3 3.93Å; R1030-W1065 HydrophobicContact CG-CZ3 4.42Å; F1062-W1065 HydrophobicContact CD1-CD2 4.03Å; F1062-W1065 AromaticContact CD1-CE3 3.54Å; F1062-W1065 HydrophobicContact CD1-CE3 3.54Å; F1062-W1065 HydrophobicContact CD1-CH2 4.33Å; F1062-W1065 AromaticContact CD1-CZ3 3.71Å; F1062-W1065 HydrophobicContact CD1-CZ3 3.71Å; F1062-W1065 HydrophobicContact CE1-CD2 4.47Å; F1062-W1065 AromaticContact CE1-CE3 3.83Å; F1062-W1065 HydrophobicContact CE1-CE3 3.83Å; F1062-W1065 AromaticContact CE1-CH2 3.81Å; F1062-W1065 HydrophobicContact CE1-CH2 3.81Å; F1062-W1065 HydrophobicContact CE1-CZ2 4.45Å; F1062-W1065 AromaticContact CE1-CZ3 3.46Å; F1062-W1065 HydrophobicContact CE1-CZ3 3.46Å; F1062-W1065 VanDerWaalsContact CE1-CZ3 3.46Å; F1062-W1065 WeakPolarHBondContact O-CB 3.42Å; F1062-W1065 PolarHBondContact O-N 2.87Å; W1065-A1068 PolarHBondContact O-N 3.42Å; W1065-L1069 WeakPolarHBondContact O-CB 3.34Å; W1065-L1069 WeakPolarHBondContact O-CD1 3.17Å; W1065-L1069 WeakPolarHBondContact O-CG 3Å; W1065-L1069 PolarHBondContact O-N 2.98Å
1066	T	51.6	Low	59.8	Low	88 Å²	88	87 Å²	87	54%	0.54	47%	0.474	S	S	.	.	H	α-helix	trans	-62.1	-50.9	168.2	41	0	0	0	0	110.4	N1063 A1068 L1069 E1070	N1063-T1066 PolarHBondContact O-OG1 3.12Å; T1066-A1068 PolarHBondContact O-N 2.79Å; T1066-L1069 CarbonylContact O-C 3.58Å; T1066-L1069 PolarHBondContact O-N 2.93Å; T1066-L1069 VanDerWaalsContact O-N 3.11Å; T1066-E1070 WeakPolarHBondContact O-CG 3.39Å; T1066-E1070 PolarHBondContact O-N 2.89Å
1067	A	47.9	Very low	58.3	Low	41 Å²	41	85.6 Å²	85.6	34%	0.339	48%	0.476	S	S	.	.	H	α-helix	trans	-65	-18.6	176.2	0	0	0	0	0	114.4	S1064 R1071	S1064-A1067 PolarHBondContact O-N 3.47Å; A1067-R1071 WeakPolarHBondContact O-CD 3.29Å; A1067-R1071 WeakPolarHBondContact O-CG 3.48Å
1068	A	35.4	Very low	56.5	Low	44 Å²	44	87.3 Å²	87.3	36%	0.364	48%	0.481	S	S	.	.	H	α-helix	trans	-84.7	-38.5	171.1	0	0	0	0	0	112.1	S1064 W1065 T1066 E1070 R1071 C1072	S1064-A1068 WeakPolarHBondContact O-CB 3.47Å; S1064-A1068 PolarHBondContact O-N 3.16Å; W1065-A1068 PolarHBondContact O-N 3.42Å; T1066-A1068 PolarHBondContact O-N 2.79Å; A1068-E1070 VanDerWaalsContact C-N 3.25Å; A1068-E1070 PolarHBondContact O-N 2.75Å; A1068-R1071 WeakPolarHBondContact O-CB 3.42Å; A1068-R1071 PolarHBondContact O-N 2.73Å; A1068-C1072 PolarHBondContact O-N 2.74Å; A1068-C1072 PolarHBondContact O-SG 3.45Å; A1068-C1072 VanDerWaalsContact O-SG 3.4Å
1069	L	35.3	Very low	54.5	Low	87 Å²	87	91.9 Å²	91.9	46%	0.455	50%	0.504	S	S	.	.	H	α-helix	trans	-72.9	-14.4	173.7	-77.3	162.2	0	0	0	113.5	W1065 T1066 R1071	W1065-L1069 WeakPolarHBondContact O-CB 3.34Å; W1065-L1069 WeakPolarHBondContact O-CD1 3.17Å; W1065-L1069 WeakPolarHBondContact O-CG 3Å; W1065-L1069 PolarHBondContact O-N 2.98Å; T1066-L1069 CarbonylContact O-C 3.58Å; T1066-L1069 PolarHBondContact O-N 2.93Å; T1066-L1069 VanDerWaalsContact O-N 3.11Å; L1069-R1071 VanDerWaalsContact C-N 3.31Å
1070	E	43	Very low	52.4	Low	165 Å²	165	96.7 Å²	96.7	77%	0.771	53%	0.532	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.5	-3	166.4	-71.1	171.9	169.7	0	0	112.7	T1066 A1068	T1066-E1070 WeakPolarHBondContact O-CG 3.39Å; T1066-E1070 PolarHBondContact O-N 2.89Å; A1068-E1070 VanDerWaalsContact C-N 3.25Å; A1068-E1070 PolarHBondContact O-N 2.75Å
1071	R	36.4	Very low	50.2	Low	219 Å²	219	97.9 Å²	97.9	83%	0.826	53%	0.534	S	S	*	.			trans	-115.4	-6.1	177.9	-71.2	175.6	178.4	177.1	0.7	114.1	A1067 A1068 L1069	A1067-R1071 WeakPolarHBondContact O-CD 3.29Å; A1067-R1071 WeakPolarHBondContact O-CG 3.48Å; A1068-R1071 WeakPolarHBondContact O-CB 3.42Å; A1068-R1071 PolarHBondContact O-N 2.73Å; L1069-R1071 VanDerWaalsContact C-N 3.31Å
1072	C	28	Very low	48	Very low	160 Å²	160	100.1 Å²	100.1	100%	1.081	54%	0.539	S	S	*	.			trans	-118.8	0	-178.1	-65.1	0	0	0	0	110.3	A1068	A1068-C1072 PolarHBondContact O-N 2.74Å; A1068-C1072 PolarHBondContact O-SG 3.45Å; A1068-C1072 VanDerWaalsContact O-SG 3.4Å

Retrieved 1,072 of 1,072 residues in 2030.3 ms (Link to these results)

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