A0A5K4ETQ2_SCHMA Loading...

Putative otopetrin

AlphaFold DB , UniProt , Accession A0A5K4ETQ2, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 942 aa.

						>A0A5K4ETQ2_SCHMA|A0A5K4ETQ2
MVESRPSVALADYDISDRRSSAMSSLLLLFALFEGMCGFVLPICSAFRVSSISQKRYYYENFLIFQYCLSILALAYLQSLIFYYDRKENLRHKQEILFMNQMNEARRRWQDHQSSPEETDNNLMNNHDDIDNNNNINNYGDNQWNLQLQKREDKLRLVTFIHDAHELSTDVYSDSTSVHVDSTDMKYLEDRTRLINQHDDNISSNEEEGNPSGENDKLSNNKSNQNEQKSSTLNVTFANPVTPLTKQNDNVDNNGNIHNIINDIKSHNNIESEEGEGRKIIIDPSNHNNNEIKTNNSNRRNKMKLQLSGINICNGNNHSSNHDRNHTIDDHNNHSNTNNNDNNNNSNNSNNTDKNDLQIMKADDVYFTFNNVKPCNSFNHHVSRIKDSSDVIQNGYNSTRRPNNKNKCLAIKAKNVNTSKTKKKRMTSCCGERSGSPTQSGSFYPLAILFGDKPRVSRRECYFSRDTEGVNLYLRLGAVGFGFGVMIFDGFKIAEPWEEVANSVVSCHGHLWIPLHLLHFVYVFWQTYFLFKHHRVVFNVQKFVLRFLLCHLAVANLCQWLKTIVDEIGSEPGHEEELIPDSAIVFPSEYFLDAKTPLNSTTLHKYTNGTMSPTFNLTNLANMVLLNRKKHNANTKPHDANYDNSTVHAAEQAVLGCGITVKYLAPYLFPCAIEYSLIAGAIFYKMFEKVGHVRKESERLEKLRKANPKTSQFSECHRSHKGLFVGLLLFMATLVAMSLFFIFIVKRDRRNTAITLYQGTELVLLSVSTVTCLISLFRLQALKLSDLSEEVAFDDNLLLIGLVGMLFYDLFLLVPALEAIPNGVIAAKLYAAKAIMEMIQSMLQVFFILEASRRCAGTLEHVQKKPGRTMITFLLVLNLAMWFVNTFEVKHADNHSIHINYYSSMAWKIITHIALPLIVFFRFHSTVCLSDIWANAYRFRTE
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	33	Very low	36.5	Very low	246 Å²	246	134.3 Å²	134.3	100%	1.212	75%	0.746	S	S	*	*				0	73.4	0	-71.6	-179.2	175.5	0	0	110.1
2	V	36.5	Very low	36.8	Very low	136 Å²	136	134.4 Å²	134.4	82%	0.824	74%	0.744	S	S	*	*			trans	-118.6	90.3	163.1	176.3	0	0	0	0	103.6	S4	V2-S4 VanDerWaalsContact C-N 3.25Å; V2-S4 PolarHBondContact O-N 2.88Å; V2-S4 VanDerWaalsContact O-N 3.09Å
3	E	32.9	Very low	37.7	Very low	188 Å²	188	136.8 Å²	136.8	88%	0.879	74%	0.737	S	S	*	*			trans	-77.8	88.4	170	-166.5	167.7	-174.4	0	0	105.8	R5	E3-R5 VanDerWaalsContact C-N 3.34Å; E3-R5 PolarHBondContact O-N 3.37Å
4	S	37.8	Very low	38.5	Very low	105 Å²	105	136.9 Å²	136.9	73%	0.734	74%	0.737	S	S	*	*			trans	-63.2	98.6	167.1	42.9	0	0	0	0	107.1	V2	V2-S4 VanDerWaalsContact C-N 3.25Å; V2-S4 PolarHBondContact O-N 2.88Å; V2-S4 VanDerWaalsContact O-N 3.09Å
5	R	38.1	Very low	39.7	Very low	221 Å²	221	129.5 Å²	129.5	83%	0.834	70%	0.697	S	S	*	*			trans	-58.1	138.7	168.8	-76.8	-174.4	176.2	-164.5	-2.8	108.4	E3 S7	E3-R5 VanDerWaalsContact C-N 3.34Å; E3-R5 PolarHBondContact O-N 3.37Å; R5-S7 PolarHBondContact O-N 3.05Å
6	P	30.6	Very low	40.9	Very low	106 Å²	106	127.6 Å²	127.6	69%	0.688	70%	0.697	S	S	*	*			trans	-63.8	106.9	167.9	28.2	-30	0	0	0	105.8
7	S	34	Very low	42.5	Very low	86 Å²	86	126.5 Å²	126.5	60%	0.601	69%	0.69	S	S	*	*			trans	-58.9	143.2	155.6	84.5	0	0	0	0	105.5	R5 A9	R5-S7 PolarHBondContact O-N 3.05Å; S7-A9 PolarHBondContact O-N 3.32Å
8	V	39.5	Very low	44.1	Very low	130 Å²	130	126.5 Å²	126.5	79%	0.788	68%	0.678	S	S	*	*	S	Bend	trans	-70.5	64.1	-178	-175.7	0	0	0	0	109.1
9	A	37.1	Very low	45.9	Very low	49 Å²	49	130.2 Å²	130.2	41%	0.405	68%	0.681	S	S	.	*			trans	-95	110.8	158.8	0	0	0	0	0	104.4	S7 A11	S7-A9 PolarHBondContact O-N 3.32Å; A9-A11 PolarHBondContact O-N 3.11Å
10	L	41.4	Very low	47.6	Very low	165 Å²	165	125.7 Å²	125.7	86%	0.864	66%	0.661	S	S	*	*	S	Bend	trans	-68.2	17.9	-175.8	-137.2	120.2	0	0	0	113.6
11	A	40.7	Very low	49	Very low	45 Å²	45	119.7 Å²	119.7	37%	0.372	63%	0.629	S	S	.	*			trans	-164	87.6	170	0	0	0	0	0	109.5	A9 Y13	A9-A11 PolarHBondContact O-N 3.11Å; A11-Y13 PolarHBondContact O-N 3.42Å
12	D	40.2	Very low	51.5	Low	136 Å²	136	108.9 Å²	108.9	73%	0.727	58%	0.58	S	S	*	*			trans	-72.3	54.7	153.9	-90.9	-20.7	0	0	0	108.9
13	Y	47.9	Very low	53.8	Low	165 Å²	165	106.9 Å²	106.9	65%	0.647	56%	0.562	S	S	*	*			trans	-95.8	128	166.7	-163.3	-96.3	0	0	0	106.5	A11 I15	A11-Y13 PolarHBondContact O-N 3.42Å; Y13-I15 VanDerWaalsContact C-N 3.33Å; Y13-I15 HydrophobicContact CD1-CG1 4.39Å; Y13-I15 WeakPolarHBondContact O-CG1 3.22Å; Y13-I15 PolarHBondContact O-N 3.45Å
14	D	49.3	Very low	56.3	Low	139 Å²	139	100 Å²	100	74%	0.743	54%	0.535	S	S	*	.			trans	-68.8	94.7	175	-152.6	-3.8	0	0	0	107.9	S16	D14-S16 VanDerWaalsContact C-N 3.28Å; D14-S16 PolarHBondContact O-N 3.49Å
15	I	57.2	Low	58.7	Low	26 Å²	26	95.5 Å²	95.5	13%	0.133	50%	0.503	C	S	.	.			trans	-77.8	84.1	-174.4	-64.4	166.1	0	0	0	107.9	Y13 L784 R853	Y13-I15 VanDerWaalsContact C-N 3.33Å; Y13-I15 HydrophobicContact CD1-CG1 4.39Å; Y13-I15 WeakPolarHBondContact O-CG1 3.22Å; Y13-I15 PolarHBondContact O-N 3.45Å; I15-L784 HydrophobicContact CG2-CD2 4.39Å; I15-R853 VanDerWaalsContact CB-NH2 3.28Å; I15-R853 VanDerWaalsContact CD1-NH1 3.28Å
16	S	57.8	Low	61.2	Low	99 Å²	99	88.9 Å²	88.9	69%	0.692	48%	0.484	S	S	*	.			trans	-75.6	-27.3	175.1	58.8	0	0	0	0	112.7	D14	D14-S16 VanDerWaalsContact C-N 3.28Å; D14-S16 PolarHBondContact O-N 3.49Å
17	D	68.5	Low	64.1	Low	109 Å²	109	89.4 Å²	89.4	58%	0.583	48%	0.48	S	S	*	.	S	Bend	trans	-113.5	137.4	-170.7	-86.5	-24	0	0	0	114.8	R19 S20 S21	D17-R19 PolarHBondContact O-N 3.44Å; D17-S20 WeakPolarHBondContact O-CB 3.32Å; D17-S20 PolarHBondContact O-N 2.96Å; D17-S21 PolarHBondContact O-N 3.2Å; D17-S21 VanDerWaalsContact O-N 3.12Å
18	R	71	Confident	66.8	Low	126 Å²	126	88.1 Å²	88.1	48%	0.475	47%	0.467	S	S	.	.	H	α-helix	trans	-52.1	-40	176.6	-177.5	-172.7	-62.6	-155	-6.9	113.1	A22 Q780	R18-A22 PolarHBondContact O-N 2.74Å; R18-Q780 VanDerWaalsContact CZ-O 3.25Å; R18-Q780 PolarHBondContact NH1-O 3.34Å; R18-Q780 PolarHBondContact NH2-O 3.1Å
19	R	78.8	Confident	69.4	Low	197 Å²	197	82.2 Å²	82.2	74%	0.743	43%	0.431	S	S	*	.	H	α-helix	trans	-69.6	-37.8	-179.2	-173	177.6	178.5	176.1	-0.5	111.1	D17 M23	D17-R19 PolarHBondContact O-N 3.44Å; R19-M23 HydrophobicContact CG-CG 4.39Å; R19-M23 WeakPolarHBondContact O-CB 3.44Å; R19-M23 WeakPolarHBondContact O-CG 3.5Å; R19-M23 PolarHBondContact O-N 3.22Å
20	S	79	Confident	72.1	Confident	39 Å²	39	84.3 Å²	84.3	27%	0.273	43%	0.431	S	S	.	.	H	α-helix	trans	-64.8	-44.8	177.4	-174.9	0	0	0	0	111	D17 A22 M23 S24	D17-S20 WeakPolarHBondContact O-CB 3.32Å; D17-S20 PolarHBondContact O-N 2.96Å; S20-A22 PolarHBondContact O-N 3.46Å; S20-M23 PolarHBondContact O-N 3.31Å; S20-S24 WeakPolarHBondContact O-CB 3.43Å; S20-S24 PolarHBondContact O-N 3Å
21	S	78	Confident	74.5	Confident	0 Å²	0	79.1 Å²	79.1	0%	0	41%	0.412	C	S	.	.	H	α-helix	trans	-53.5	-55.1	173.9	-179.9	0	0	0	0	112.4	D17 M23 S24 S25 E850 R853	D17-S21 PolarHBondContact O-N 3.2Å; D17-S21 VanDerWaalsContact O-N 3.12Å; S21-M23 VanDerWaalsContact C-N 3.32Å; S21-M23 PolarHBondContact O-N 3.27Å; S21-S24 WeakPolarHBondContact O-CB 3.14Å; S21-S24 PolarHBondContact O-N 3.43Å; S21-S25 PolarHBondContact O-N 3.03Å; S21-S25 PolarHBondContact O-OG 3Å; S21-E850 PolarHBondContact OG-OE1 3.43Å; S21-R853 VanDerWaalsContact OG-CZ 3.3Å; S21-R853 PolarHBondContact OG-NH1 2.95Å
22	A	84.4	Confident	77	Confident	20 Å²	20	78.9 Å²	78.9	17%	0.165	40%	0.404	C	S	.	.	H	α-helix	trans	-63.7	-39.3	-176.5	0	0	0	0	0	111.8	R18 S20 S25 L26 F846 E850	R18-A22 PolarHBondContact O-N 2.74Å; S20-A22 PolarHBondContact O-N 3.46Å; A22-S25 PolarHBondContact O-N 2.84Å; A22-L26 WeakPolarHBondContact O-CB 3.47Å; A22-L26 VanDerWaalsContact O-CG 3.28Å; A22-L26 WeakPolarHBondContact O-CG 3.2Å; A22-L26 PolarHBondContact O-N 3.49Å; A22-F846 HydrophobicContact CB-CE2 4.35Å; A22-F846 HydrophobicContact CB-CZ 4.16Å; A22-E850 WeakPolarHBondContact CA-OE1 3.2Å; A22-E850 PolarHBondContact N-OE1 3.26Å
23	M	85.8	Confident	79.6	Confident	94 Å²	94	75.3 Å²	75.3	46%	0.463	38%	0.382	S	S	.	.	H	α-helix	trans	-65.7	-42.7	176.5	-70.6	-67.6	145.4	0	0	111.6	R19 S20 S21 S25 L26 L27	R19-M23 HydrophobicContact CG-CG 4.39Å; R19-M23 WeakPolarHBondContact O-CB 3.44Å; R19-M23 WeakPolarHBondContact O-CG 3.5Å; R19-M23 PolarHBondContact O-N 3.22Å; S20-M23 PolarHBondContact O-N 3.31Å; S21-M23 VanDerWaalsContact C-N 3.32Å; S21-M23 PolarHBondContact O-N 3.27Å; M23-S25 PolarHBondContact O-N 3.47Å; M23-L26 PolarHBondContact O-N 3.12Å; M23-L27 WeakPolarHBondContact O-CB 3.21Å; M23-L27 VanDerWaalsContact O-CG 3.26Å; M23-L27 WeakPolarHBondContact O-CG 3.42Å; M23-L27 PolarHBondContact O-N 2.69Å
24	S	85.5	Confident	81.7	Confident	43 Å²	43	70 Å²	70	30%	0.301	36%	0.363	S	S	.	.	H	α-helix	trans	-58.6	-46.7	175.7	-171.2	0	0	0	0	111.6	S20 S21 L27 L28	S20-S24 WeakPolarHBondContact O-CB 3.43Å; S20-S24 PolarHBondContact O-N 3Å; S21-S24 WeakPolarHBondContact O-CB 3.14Å; S21-S24 PolarHBondContact O-N 3.43Å; S24-L27 PolarHBondContact O-N 2.9Å; S24-L28 WeakPolarHBondContact O-CB 3.18Å; S24-L28 PolarHBondContact O-N 2.76Å
25	S	87.8	Confident	83.7	Confident	10 Å²	10	65.2 Å²	65.2	7%	0.07	35%	0.347	C	S	.	.	H	α-helix	trans	-63.8	-41.4	177.8	-58.5	0	0	0	0	112.2	S21 A22 M23 L28 L29	S21-S25 PolarHBondContact O-N 3.03Å; S21-S25 PolarHBondContact O-OG 3Å; A22-S25 PolarHBondContact O-N 2.84Å; M23-S25 PolarHBondContact O-N 3.47Å; S25-L28 PolarHBondContact O-N 3.17Å; S25-L29 VanDerWaalsContact O-CG 3.28Å; S25-L29 WeakPolarHBondContact O-CG 3.4Å; S25-L29 PolarHBondContact O-N 3.03Å
26	L	91.3	Very high	85.5	Confident	82 Å²	82	65.4 Å²	65.4	43%	0.429	35%	0.347	S	S	.	.	H	α-helix	trans	-66.5	-41.6	177.4	-74.8	168.8	0	0	0	112.4	A22 M23 L28 L29 F30 F846	A22-L26 WeakPolarHBondContact O-CB 3.47Å; A22-L26 VanDerWaalsContact O-CG 3.28Å; A22-L26 WeakPolarHBondContact O-CG 3.2Å; A22-L26 PolarHBondContact O-N 3.49Å; M23-L26 PolarHBondContact O-N 3.12Å; L26-L28 VanDerWaalsContact C-N 3.34Å; L26-L29 PolarHBondContact O-N 3.23Å; L26-F30 WeakPolarHBondContact O-CB 3.37Å; L26-F30 PolarHBondContact O-N 3.41Å; L26-F846 HydrophobicContact CD1-CE2 4.32Å; L26-F846 HydrophobicContact CD2-CD2 3.94Å; L26-F846 HydrophobicContact CD2-CE2 3.96Å; L26-F846 HydrophobicContact CD2-CG 4.45Å; L26-F846 HydrophobicContact CD2-CZ 4.47Å; L26-F846 HydrophobicContact CG-CD2 4.05Å; L26-F846 HydrophobicContact CG-CE2 3.67Å; L26-F846 HydrophobicContact CG-CZ 4.3Å
27	L	90.7	Very high	87.1	Confident	117 Å²	117	61.1 Å²	61.1	61%	0.613	32%	0.317	S	S	*	.	H	α-helix	trans	-63.7	-41.4	176.6	-73.8	170.8	0	0	0	111.4	M23 S24 F30 A31	M23-L27 WeakPolarHBondContact O-CB 3.21Å; M23-L27 VanDerWaalsContact O-CG 3.26Å; M23-L27 WeakPolarHBondContact O-CG 3.42Å; M23-L27 PolarHBondContact O-N 2.69Å; S24-L27 PolarHBondContact O-N 2.9Å; L27-F30 PolarHBondContact O-N 3.48Å; L27-A31 WeakPolarHBondContact O-CB 3.42Å; L27-A31 PolarHBondContact O-N 3.36Å
28	L	91.4	Very high	88.2	Confident	60 Å²	60	57.4 Å²	57.4	31%	0.314	31%	0.305	S	S	.	.	H	α-helix	trans	-60.1	-47.8	174.8	179.6	63	0	0	0	111.5	S24 S25 L26 F30 A31 L32 L799	S24-L28 WeakPolarHBondContact O-CB 3.18Å; S24-L28 PolarHBondContact O-N 2.76Å; S25-L28 PolarHBondContact O-N 3.17Å; L26-L28 VanDerWaalsContact C-N 3.34Å; L28-F30 PolarHBondContact O-N 2.82Å; L28-A31 PolarHBondContact O-N 2.97Å; L28-L32 HydrophobicContact CG-CD1 4.42Å; L28-L32 WeakPolarHBondContact O-CG 3.34Å; L28-L32 PolarHBondContact O-N 3.47Å; L28-L799 HydrophobicContact CD2-CD1 3.75Å; L28-L799 HydrophobicContact CD2-CD2 4.25Å
29	L	93.7	Very high	89.2	Confident	6 Å²	6	57 Å²	57	3%	0.031	31%	0.306	C	S	.	.	H	α-helix	trans	-65.6	-37.9	178.6	-68.7	171.8	0	0	0	112.6	S25 L26 F33 L799 L802 M842 V845 F846	S25-L29 VanDerWaalsContact O-CG 3.28Å; S25-L29 WeakPolarHBondContact O-CG 3.4Å; S25-L29 PolarHBondContact O-N 3.03Å; L26-L29 PolarHBondContact O-N 3.23Å; L29-F33 WeakPolarHBondContact O-CB 3.2Å; L29-F33 PolarHBondContact O-N 2.84Å; L29-L799 HydrophobicContact CD2-CD2 4.39Å; L29-L802 HydrophobicContact CD2-CD2 3.4Å; L29-L802 VanDerWaalsContact CD2-CD2 3.4Å; L29-M842 HydrophobicContact CB-CE 4.28Å; L29-V845 HydrophobicContact CD2-CB 4.16Å; L29-V845 HydrophobicContact CD2-CG1 3.8Å; L29-F846 HydrophobicContact CD1-CB 3.61Å; L29-F846 HydrophobicContact CD1-CD2 4.27Å; L29-F846 HydrophobicContact CD1-CG 4.41Å
30	F	93	Very high	89.8	Confident	92 Å²	92	47.6 Å²	47.6	40%	0.404	27%	0.271	S	S	.	.	H	α-helix	trans	-62.7	-48.5	174.2	175.8	-98	0	0	0	111.3	L26 L27 L28 L32 F33 E34 L69	L26-F30 WeakPolarHBondContact O-CB 3.37Å; L26-F30 PolarHBondContact O-N 3.41Å; L27-F30 PolarHBondContact O-N 3.48Å; L28-F30 PolarHBondContact O-N 2.82Å; F30-L32 VanDerWaalsContact C-N 3.33Å; F30-L32 PolarHBondContact O-N 3.37Å; F30-F33 PolarHBondContact O-N 3.08Å; F30-E34 WeakPolarHBondContact CE1-OE2 3.49Å; F30-E34 WeakPolarHBondContact O-CB 3.38Å; F30-E34 PolarHBondContact O-N 3.31Å; F30-L69 HydrophobicContact CZ-CD2 3.9Å
31	A	92.7	Very high	90.4	Very high	57 Å²	57	46.7 Å²	46.7	47%	0.471	26%	0.263	S	S	.	.	H	α-helix	trans	-61.3	-40.2	178.4	0	0	0	0	0	112.2	L27 L28 G35	L27-A31 WeakPolarHBondContact O-CB 3.42Å; L27-A31 PolarHBondContact O-N 3.36Å; L28-A31 PolarHBondContact O-N 2.97Å; A31-G35 PolarHBondContact O-N 3.35Å
32	L	93.4	Very high	91	Very high	39 Å²	39	48.7 Å²	48.7	20%	0.204	28%	0.276	C	S	.	.	H	α-helix	trans	-63.4	-45.5	174.3	-73	175.3	0	0	0	111.7	L28 F30 G35 M36 L799 L802 V803	L28-L32 HydrophobicContact CG-CD1 4.42Å; L28-L32 WeakPolarHBondContact O-CG 3.34Å; L28-L32 PolarHBondContact O-N 3.47Å; F30-L32 VanDerWaalsContact C-N 3.33Å; F30-L32 PolarHBondContact O-N 3.37Å; L32-G35 PolarHBondContact O-N 3.27Å; L32-M36 VanDerWaalsContact O-CG 3.31Å; L32-M36 WeakPolarHBondContact O-CG 3.47Å; L32-M36 PolarHBondContact O-N 3.02Å; L32-L799 HydrophobicContact CD1-CB 4.39Å; L32-L799 HydrophobicContact CD1-CD2 3.68Å; L32-L802 HydrophobicContact CD1-CD2 4.42Å; L32-V803 HydrophobicContact CD2-CG2 3.95Å
33	F	94	Very high	91.2	Very high	62 Å²	62	49.7 Å²	49.7	27%	0.272	28%	0.278	S	S	.	.	H	α-helix	trans	-65.4	-44.7	179.5	178.1	-116	0	0	0	112.6	L29 F30 M36 C37 L806 M838 M842	L29-F33 WeakPolarHBondContact O-CB 3.2Å; L29-F33 PolarHBondContact O-N 2.84Å; F30-F33 PolarHBondContact O-N 3.08Å; F33-M36 PolarHBondContact O-N 2.95Å; F33-C37 VanDerWaalsContact CE2-SG 3.51Å; F33-C37 WeakPolarHBondContact CZ-SG 3.14Å; F33-C37 PolarHBondContact O-N 3.05Å; F33-C37 PolarHBondContact O-SG 3Å; F33-L806 HydrophobicContact CB-CD1 4.49Å; F33-L806 HydrophobicContact CD2-CD1 4.41Å; F33-L806 HydrophobicContact CD2-CD2 4.32Å; F33-M838 HydrophobicContact CD2-CE 4.11Å; F33-M838 HydrophobicContact CE2-CE 3.16Å; F33-M838 HydrophobicContact CZ-CE 3.75Å; F33-M842 HydrophobicContact CB-CE 3.84Å; F33-M842 HydrophobicContact CB-SD 4.28Å; F33-M842 HydrophobicContact CD2-SD 4.36Å; F33-M842 HydrophobicContact CG-CE 4.24Å; F33-M842 HydrophobicContact CG-SD 4.24Å
34	E	92.1	Very high	91.3	Very high	53 Å²	53	45.2 Å²	45.2	25%	0.248	26%	0.256	C	S	.	.	H	α-helix	trans	-61.9	-45.5	175.5	-172.2	-176.2	164.8	0	0	111.1	F30 M36 C37 G38 F62 Q66	F30-E34 WeakPolarHBondContact CE1-OE2 3.49Å; F30-E34 WeakPolarHBondContact O-CB 3.38Å; F30-E34 PolarHBondContact O-N 3.31Å; E34-M36 VanDerWaalsContact C-N 3.29Å; E34-M36 PolarHBondContact O-N 2.83Å; E34-C37 PolarHBondContact O-N 3.14Å; E34-G38 PolarHBondContact O-N 2.95Å; E34-F62 HydrophobicContact CG-CE2 4.49Å; E34-F62 HydrophobicContact CG-CZ 4.2Å; E34-Q66 PolarHBondContact OE1-NE2 3.02Å
35	G	92.1	Very high	91.3	Very high	38 Å²	38	45 Å²	45	39%	0.392	26%	0.255	S	S	.	.	H	α-helix	trans	-58	-40.1	175.5	0	0	0	0	0	112.6	A31 L32 G38 F39	A31-G35 PolarHBondContact O-N 3.35Å; L32-G35 PolarHBondContact O-N 3.27Å; G35-G38 PolarHBondContact O-N 3.17Å; G35-F39 WeakPolarHBondContact O-CB 3.27Å; G35-F39 PolarHBondContact O-N 3.39Å
36	M	93.7	Very high	91.2	Very high	30 Å²	30	48.4 Å²	48.4	15%	0.148	28%	0.283	C	S	.	.	H	α-helix	trans	-69.4	-42.5	176.3	-71.3	-52.6	98.9	0	0	112.8	L32 F33 E34 G38 F39 V40 V803 L806 L810	L32-M36 VanDerWaalsContact O-CG 3.31Å; L32-M36 WeakPolarHBondContact O-CG 3.47Å; L32-M36 PolarHBondContact O-N 3.02Å; F33-M36 PolarHBondContact O-N 2.95Å; E34-M36 VanDerWaalsContact C-N 3.29Å; E34-M36 PolarHBondContact O-N 2.83Å; M36-G38 VanDerWaalsContact C-N 3.31Å; M36-G38 PolarHBondContact O-N 3.34Å; M36-F39 PolarHBondContact O-N 2.87Å; M36-V40 WeakPolarHBondContact O-CB 3.3Å; M36-V40 WeakPolarHBondContact O-CG2 3.36Å; M36-V40 PolarHBondContact O-N 2.89Å; M36-V803 HydrophobicContact CE-CG1 4.11Å; M36-V803 HydrophobicContact SD-CG1 3.72Å; M36-L806 HydrophobicContact CB-CB 4.38Å; M36-L806 HydrophobicContact CG-CB 4.12Å; M36-L806 HydrophobicContact CG-CD1 4.44Å; M36-L810 HydrophobicContact CB-CD1 3.92Å
37	C	92.5	Very high	90.9	Very high	9 Å²	9	49.4 Å²	49.4	6%	0.061	28%	0.284	C	S	.	.	H	α-helix	trans	-58.9	-44.4	172.8	-71.8	0	0	0	0	111.5	F33 E34 F39 L41 F62	F33-C37 VanDerWaalsContact CE2-SG 3.51Å; F33-C37 WeakPolarHBondContact CZ-SG 3.14Å; F33-C37 PolarHBondContact O-N 3.05Å; F33-C37 PolarHBondContact O-SG 3Å; E34-C37 PolarHBondContact O-N 3.14Å; C37-F39 VanDerWaalsContact C-N 3.28Å; C37-F39 PolarHBondContact O-N 3Å; C37-L41 HydrophobicContact CB-CD1 4.13Å; C37-L41 VanDerWaalsContact O-CB 3.29Å; C37-L41 WeakPolarHBondContact O-CB 3.45Å; C37-L41 VanDerWaalsContact O-CG 3.26Å; C37-L41 WeakPolarHBondContact O-CG 3.19Å; C37-L41 PolarHBondContact O-N 2.97Å; C37-L41 VanDerWaalsContact O-N 3.11Å; C37-F62 HydrophobicContact CB-CD2 3.79Å; C37-F62 HydrophobicContact CB-CE1 4.42Å; C37-F62 HydrophobicContact CB-CE2 3.29Å; C37-F62 HydrophobicContact CB-CZ 3.66Å
38	G	91	Very high	90.4	Very high	31 Å²	31	46.3 Å²	46.3	32%	0.32	27%	0.265	S	S	.	.	H	α-helix	trans	-64.9	-27.6	178.3	0	0	0	0	0	114.1	E34 G35 M36 P42	E34-G38 PolarHBondContact O-N 2.95Å; G35-G38 PolarHBondContact O-N 3.17Å; M36-G38 VanDerWaalsContact C-N 3.31Å; M36-G38 PolarHBondContact O-N 3.34Å; G38-P42 VanDerWaalsContact O-CD 3.3Å; G38-P42 WeakPolarHBondContact O-CD 3.49Å; G38-P42 WeakPolarHBondContact O-CG 3.32Å
39	F	92.1	Very high	89.7	Confident	117 Å²	117	47.8 Å²	47.8	51%	0.513	28%	0.276	S	S	.	.	H	α-helix	trans	-86.7	-46.6	176.3	-175.4	-109	0	0	0	112.9	G35 M36 C37 P42 I43 F807	G35-F39 WeakPolarHBondContact O-CB 3.27Å; G35-F39 PolarHBondContact O-N 3.39Å; M36-F39 PolarHBondContact O-N 2.87Å; C37-F39 VanDerWaalsContact C-N 3.28Å; C37-F39 PolarHBondContact O-N 3Å; F39-P42 WeakPolarHBondContact O-CD 3.47Å; F39-I43 HydrophobicContact CD1-CD1 3.94Å; F39-I43 HydrophobicContact CD2-CD1 4.38Å; F39-I43 HydrophobicContact CE1-CD1 3.63Å; F39-I43 HydrophobicContact CE2-CD1 4.09Å; F39-I43 HydrophobicContact CG-CD1 4.31Å; F39-I43 HydrophobicContact CZ-CD1 3.7Å; F39-I43 VanDerWaalsContact O-CD1 3.26Å; F39-I43 WeakPolarHBondContact O-CD1 3.48Å; F39-I43 VanDerWaalsContact O-CG1 3.29Å; F39-I43 WeakPolarHBondContact O-CG1 3.31Å; F39-F807 HydrophobicContact CD1-CD2 4.35Å; F39-F807 HydrophobicContact CD1-CE2 4.26Å; F39-F807 HydrophobicContact CE1-CD2 4.36Å; F39-F807 AromaticContact CE1-CE2 3.91Å; F39-F807 HydrophobicContact CE1-CE2 3.91Å
40	V	92.7	Very high	88.4	Confident	0 Å²	0	50.3 Å²	50.3	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-80.7	-42.4	-170.3	175	0	0	0	0	112.9	M36 I43 C44 F807 L810 F811	M36-V40 WeakPolarHBondContact O-CB 3.3Å; M36-V40 WeakPolarHBondContact O-CG2 3.36Å; M36-V40 PolarHBondContact O-N 2.89Å; V40-I43 WeakPolarHBondContact O-CA 3.47Å; V40-I43 WeakPolarHBondContact O-CB 3.36Å; V40-I43 PolarHBondContact O-N 3.3Å; V40-C44 PolarHBondContact O-N 2.84Å; V40-C44 PolarHBondContact O-SG 3.46Å; V40-C44 VanDerWaalsContact O-SG 3.39Å; V40-F807 HydrophobicContact CG2-CD2 3.61Å; V40-F807 HydrophobicContact CG2-CE2 4.14Å; V40-F807 HydrophobicContact CG2-CG 4.33Å; V40-L810 HydrophobicContact CB-CB 4.09Å; V40-L810 HydrophobicContact CB-CD1 4.01Å; V40-L810 HydrophobicContact CG1-CB 3.56Å; V40-L810 HydrophobicContact CG1-CD1 4.42Å; V40-L810 HydrophobicContact CG2-CB 4.46Å; V40-L810 HydrophobicContact CG2-CD1 4.13Å; V40-F811 HydrophobicContact CB-CE2 4.29Å; V40-F811 HydrophobicContact CG1-CD1 4.41Å; V40-F811 HydrophobicContact CG1-CD2 3.65Å; V40-F811 HydrophobicContact CG1-CE1 4.32Å; V40-F811 HydrophobicContact CG1-CE2 3.5Å; V40-F811 VanDerWaalsContact CG1-CE2 3.5Å; V40-F811 HydrophobicContact CG1-CG 4.09Å; V40-F811 HydrophobicContact CG1-CZ 3.86Å; V40-F811 HydrophobicContact CG2-CE2 4.05Å
41	L	91.1	Very high	86.6	Confident	20 Å²	20	51.8 Å²	51.8	11%	0.105	32%	0.316	C	S	.	.	H	α-helix	trans	-59.3	-41.9	-177.2	-65	174.5	0	0	0	114.1	C37 I43 C44 S45 Y59 F62 V814	C37-L41 HydrophobicContact CB-CD1 4.13Å; C37-L41 VanDerWaalsContact O-CB 3.29Å; C37-L41 WeakPolarHBondContact O-CB 3.45Å; C37-L41 VanDerWaalsContact O-CG 3.26Å; C37-L41 WeakPolarHBondContact O-CG 3.19Å; C37-L41 PolarHBondContact O-N 2.97Å; C37-L41 VanDerWaalsContact O-N 3.11Å; L41-I43 VanDerWaalsContact C-N 3.31Å; L41-I43 PolarHBondContact O-N 3.18Å; L41-C44 PolarHBondContact O-N 3.32Å; L41-S45 PolarHBondContact O-N 3.34Å; L41-S45 VanDerWaalsContact O-N 3.12Å; L41-Y59 HydrophobicContact CB-CD2 4.19Å; L41-F62 HydrophobicContact CD1-CB 3.49Å; L41-F62 VanDerWaalsContact CD1-CB 3.49Å; L41-F62 HydrophobicContact CD1-CD1 4.09Å; L41-F62 HydrophobicContact CD1-CD2 3.99Å; L41-F62 HydrophobicContact CD1-CG 3.57Å; L41-V814 HydrophobicContact CD2-CG2 3.8Å
42	P	89.1	Confident	84.8	Confident	42 Å²	42	54.6 Å²	54.6	27%	0.273	32%	0.322	S	S	.	.	H	α-helix	trans	-59.6	-42	171.7	-12.8	18	0	0	0	112.5	G38 F39 S45 A46 Y59	G38-P42 VanDerWaalsContact O-CD 3.3Å; G38-P42 WeakPolarHBondContact O-CD 3.49Å; G38-P42 WeakPolarHBondContact O-CG 3.32Å; F39-P42 WeakPolarHBondContact O-CD 3.47Å; P42-S45 PolarHBondContact O-N 2.82Å; P42-A46 PolarHBondContact O-N 2.91Å; P42-Y59 HydrophobicContact CB-CD2 4.35Å; P42-Y59 HydrophobicContact CB-CE2 4.07Å; P42-Y59 HydrophobicContact CG-CD2 3.94Å; P42-Y59 HydrophobicContact CG-CE2 3.55Å
43	I	89.6	Confident	83	Confident	41 Å²	41	58 Å²	58	21%	0.21	35%	0.349	C	S	.	.	H	α-helix	trans	-66.2	-42.8	-179.3	-62.5	170.8	0	0	0	110.4	F39 V40 L41 S45 A46 F47 F811	F39-I43 HydrophobicContact CD1-CD1 3.94Å; F39-I43 HydrophobicContact CD2-CD1 4.38Å; F39-I43 HydrophobicContact CE1-CD1 3.63Å; F39-I43 HydrophobicContact CE2-CD1 4.09Å; F39-I43 HydrophobicContact CG-CD1 4.31Å; F39-I43 HydrophobicContact CZ-CD1 3.7Å; F39-I43 VanDerWaalsContact O-CD1 3.26Å; F39-I43 WeakPolarHBondContact O-CD1 3.48Å; F39-I43 VanDerWaalsContact O-CG1 3.29Å; F39-I43 WeakPolarHBondContact O-CG1 3.31Å; V40-I43 WeakPolarHBondContact O-CA 3.47Å; V40-I43 WeakPolarHBondContact O-CB 3.36Å; V40-I43 PolarHBondContact O-N 3.3Å; L41-I43 VanDerWaalsContact C-N 3.31Å; L41-I43 PolarHBondContact O-N 3.18Å; I43-S45 VanDerWaalsContact C-N 3.27Å; I43-S45 PolarHBondContact O-N 3.4Å; I43-A46 PolarHBondContact O-N 3.28Å; I43-F47 HydrophobicContact CG2-CD2 3.41Å; I43-F47 VanDerWaalsContact CG2-CD2 3.41Å; I43-F47 HydrophobicContact CG2-CE2 3.42Å; I43-F47 VanDerWaalsContact CG2-CE2 3.42Å; I43-F47 WeakPolarHBondContact O-CD2 3.4Å; I43-F47 PolarHBondContact O-N 3.39Å; I43-F811 HydrophobicContact CB-CE1 4.49Å; I43-F811 HydrophobicContact CB-CZ 4.01Å; I43-F811 HydrophobicContact CG2-CE1 3.93Å; I43-F811 HydrophobicContact CG2-CZ 3.57Å
44	C	88.1	Confident	81.2	Confident	1 Å²	1	61.9 Å²	61.9	1%	0.007	37%	0.368	C	S	.	.	H	α-helix	trans	-56.4	-43.8	174.6	-71.2	0	0	0	0	111.7	V40 L41 A46 F811 V814 Y902	V40-C44 PolarHBondContact O-N 2.84Å; V40-C44 PolarHBondContact O-SG 3.46Å; V40-C44 VanDerWaalsContact O-SG 3.39Å; L41-C44 PolarHBondContact O-N 3.32Å; C44-A46 VanDerWaalsContact C-N 3.29Å; C44-A46 PolarHBondContact O-N 3.01Å; C44-F811 WeakPolarHBondContact SG-CD1 3.26Å; C44-F811 VanDerWaalsContact SG-CE1 3.54Å; C44-V814 HydrophobicContact CB-CB 4.45Å; C44-V814 HydrophobicContact CB-CG1 4.22Å; C44-V814 HydrophobicContact CB-CG2 4.41Å; C44-Y902 HydrophobicContact CB-CE1 4.28Å; C44-Y902 PolarHBondContact SG-OH 3.4Å
45	S	84.7	Confident	79.4	Confident	38 Å²	38	66.7 Å²	66.7	27%	0.266	39%	0.388	S	S	.	.	H	α-helix	trans	-67.9	-27.3	176.8	-175.7	0	0	0	0	113.2	L41 P42 I43 R56	L41-S45 PolarHBondContact O-N 3.34Å; L41-S45 VanDerWaalsContact O-N 3.12Å; P42-S45 PolarHBondContact O-N 2.82Å; I43-S45 VanDerWaalsContact C-N 3.27Å; I43-S45 PolarHBondContact O-N 3.4Å; S45-R56 WeakPolarHBondContact OG-CG 3.44Å
46	A	85.4	Confident	78.4	Confident	81 Å²	81	71.5 Å²	71.5	67%	0.669	39%	0.394	S	S	*	.	H	α-helix	trans	-79.7	-37.5	-178.4	0	0	0	0	0	112.8	P42 I43 C44	P42-A46 PolarHBondContact O-N 2.91Å; I43-A46 PolarHBondContact O-N 3.28Å; C44-A46 VanDerWaalsContact C-N 3.29Å; C44-A46 PolarHBondContact O-N 3.01Å
47	F	85.1	Confident	77.7	Confident	103 Å²	103	77 Å²	77	45%	0.452	42%	0.415	S	S	.	.	S	Bend	trans	-85.8	0.2	-178.5	-76.7	-67	0	0	0	114.8	I43 V49 Y902 A906	I43-F47 HydrophobicContact CG2-CD2 3.41Å; I43-F47 VanDerWaalsContact CG2-CD2 3.41Å; I43-F47 HydrophobicContact CG2-CE2 3.42Å; I43-F47 VanDerWaalsContact CG2-CE2 3.42Å; I43-F47 WeakPolarHBondContact O-CD2 3.4Å; I43-F47 PolarHBondContact O-N 3.39Å; F47-V49 PolarHBondContact O-N 3.06Å; F47-Y902 HydrophobicContact CB-CD1 3.69Å; F47-Y902 HydrophobicContact CB-CE1 4.39Å; F47-Y902 WeakPolarHBondContact O-CA 3.21Å; F47-A906 HydrophobicContact CD1-CB 3.95Å; F47-A906 HydrophobicContact CE1-CB 4.36Å; F47-A906 HydrophobicContact CG-CB 4.38Å
48	R	81.8	Confident	77.2	Confident	52 Å²	52	80.1 Å²	80.1	20%	0.196	43%	0.425	C	S	.	.			trans	-65.6	125	-178.8	-174.2	-179.8	-178.9	-176.9	6	111.6	S50 Q54 E818 Y901	R48-S50 PolarHBondContact NE-OG 3.34Å; R48-S50 VanDerWaalsContact NE-OG 3.13Å; R48-Q54 PolarHBondContact NH1-O 2.91Å; R48-Q54 VanDerWaalsContact NH1-O 3.11Å; R48-E818 IonicContact CZ-OE1 2.77Å; R48-E818 IonicContact CZ-OE2 3.82Å; R48-E818 IonicContact NE-OE2 2.64Å; R48-E818 PolarHBondContact NE-OE2 3.07Å; R48-E818 IonicContact NH1-OE1 3.93Å; R48-E818 IonicContact NH1-OE2 3.39Å; R48-E818 IonicContact NH2-OE2 3.97Å; R48-E818 PolarHBondContact NH2-OE2 3.16Å; R48-Y901 CarbonylContact C-O 3.59Å; R48-Y901 WeakPolarHBondContact CA-O 3.43Å; R48-Y901 HydrophobicContact CB-CE1 4.15Å; R48-Y901 HydrophobicContact CG-CD2 4.39Å; R48-Y901 HydrophobicContact CG-CE1 4.24Å; R48-Y901 HydrophobicContact CG-CE2 3.88Å
49	V	76.2	Confident	76.9	Confident	92 Å²	92	81.5 Å²	81.5	56%	0.558	42%	0.421	S	S	*	.			trans	-81.9	-20.6	-177	179.5	0	0	0	0	113.3	F47 Y901	F47-V49 PolarHBondContact O-N 3.06Å; V49-Y901 PolarHBondContact N-O 3.17Å
50	S	65.6	Low	76.7	Confident	59 Å²	59	80.4 Å²	80.4	41%	0.413	42%	0.418	S	S	.	.			trans	-82.5	130.9	-172	81.2	0	0	0	0	114.4	R48 I52	R48-S50 PolarHBondContact NE-OG 3.34Å; R48-S50 VanDerWaalsContact NE-OG 3.13Å; S50-I52 VanDerWaalsContact C-N 3.28Å; S50-I52 PolarHBondContact O-N 3.18Å
51	S	55.4	Low	76.4	Confident	123 Å²	123	83.6 Å²	83.6	86%	0.86	44%	0.435	S	S	*	.			trans	-83.6	26.6	-172.7	67.4	0	0	0	0	115.2
52	I	56.1	Low	76.3	Confident	115 Å²	115	84 Å²	84	59%	0.59	44%	0.436	S	S	*	.	S	Bend	trans	-111	134.4	-170.8	-63.6	171.4	0	0	0	110.7	S50 Q54	S50-I52 VanDerWaalsContact C-N 3.28Å; S50-I52 PolarHBondContact O-N 3.18Å; I52-Q54 PolarHBondContact O-N 3.18Å
53	S	53.8	Low	76.3	Confident	111 Å²	111	83.6 Å²	83.6	78%	0.776	43%	0.431	S	S	*	.	S	Bend	trans	-54.5	13.1	-169.6	-64.8	0	0	0	0	119.2	K55	S53-K55 PolarHBondContact O-N 3.41Å
54	Q	56.1	Low	76.5	Confident	143 Å²	143	86.3 Å²	86.3	67%	0.668	45%	0.445	S	S	*	.			trans	-84	46.1	173.8	-113.6	178	-26.1	0	0	111.8	R48 I52 R56	R48-Q54 PolarHBondContact NH1-O 2.91Å; R48-Q54 VanDerWaalsContact NH1-O 3.11Å; I52-Q54 PolarHBondContact O-N 3.18Å; Q54-R56 PolarHBondContact O-N 2.93Å
55	K	55.5	Low	76.6	Confident	154 Å²	154	92.4 Å²	92.4	67%	0.67	47%	0.472	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.5	128.7	-170.6	-69	177.9	179.6	176.5	0	110.1	S53 Y57	S53-K55 PolarHBondContact O-N 3.41Å; K55-Y57 PolarHBondContact O-N 3.36Å
56	R	70.4	Confident	76.9	Confident	140 Å²	140	93.1 Å²	93.1	53%	0.528	47%	0.471	S	S	.	.	T	Hydrogen-bonded Turn	trans	69.3	9.5	163.7	-56.4	173.9	-178.6	-146	-2.8	118.9	S45 Q54 Y58 Y59 E60	S45-R56 WeakPolarHBondContact OG-CG 3.44Å; Q54-R56 PolarHBondContact O-N 2.93Å; R56-Y58 PolarHBondContact O-N 3.45Å; R56-Y59 HydrophobicContact CB-CD1 4.41Å; R56-Y59 PolarHBondContact O-N 3.42Å; R56-E60 HydrophobicContact CB-CG 3.78Å; R56-E60 WeakPolarHBondContact CB-OE1 3.46Å; R56-E60 WeakPolarHBondContact O-CB 3.39Å; R56-E60 PolarHBondContact O-N 3.49Å
57	Y	79.5	Confident	77.2	Confident	146 Å²	146	95.9 Å²	95.9	57%	0.573	47%	0.465	S	S	*	.	H	α-helix	trans	-43.3	-57.1	-175.8	-178.1	-99.9	0	0	0	114.8	K55 Y59 E60 N61	K55-Y57 PolarHBondContact O-N 3.36Å; Y57-Y59 PolarHBondContact O-N 3.38Å; Y57-E60 PolarHBondContact O-N 2.93Å; Y57-N61 WeakPolarHBondContact CD2-ND2 3.47Å; Y57-N61 WeakPolarHBondContact CE1-ND2 3.44Å; Y57-N61 WeakPolarHBondContact CE2-ND2 3.17Å; Y57-N61 WeakPolarHBondContact O-CB 3.48Å; Y57-N61 PolarHBondContact O-N 2.76Å; Y57-N61 PolarHBondContact O-ND2 2.9Å
58	Y	82.3	Confident	77.7	Confident	73 Å²	73	94.1 Å²	94.1	29%	0.286	47%	0.465	S	S	.	.	H	α-helix	trans	-65.6	-39.5	-178.5	-65.1	-71.4	0	0	0	113.4	R56 F62 V814 L817 E818	R56-Y58 PolarHBondContact O-N 3.45Å; Y58-F62 WeakPolarHBondContact O-CB 3.23Å; Y58-F62 PolarHBondContact O-N 3.22Å; Y58-V814 HydrophobicContact CD2-CG1 4.18Å; Y58-L817 HydrophobicContact CD1-CD1 4.46Å; Y58-L817 HydrophobicContact CE1-CB 4.39Å; Y58-L817 HydrophobicContact CE1-CD1 3.77Å; Y58-L817 HydrophobicContact CE2-CB 4.44Å; Y58-L817 VanDerWaalsContact OH-CB 3.25Å; Y58-L817 WeakPolarHBondContact OH-CB 3.05Å; Y58-E818 HydrophobicContact CE2-CG 3.79Å
59	Y	84.4	Confident	78.1	Confident	61 Å²	61	94.9 Å²	94.9	24%	0.239	47%	0.472	C	S	.	.	H	α-helix	trans	-66.3	-43.1	177.5	173.5	-117	0	0	0	111.7	L41 P42 R56 Y57 F62 L63	L41-Y59 HydrophobicContact CB-CD2 4.19Å; P42-Y59 HydrophobicContact CB-CD2 4.35Å; P42-Y59 HydrophobicContact CB-CE2 4.07Å; P42-Y59 HydrophobicContact CG-CD2 3.94Å; P42-Y59 HydrophobicContact CG-CE2 3.55Å; R56-Y59 HydrophobicContact CB-CD1 4.41Å; R56-Y59 PolarHBondContact O-N 3.42Å; Y57-Y59 PolarHBondContact O-N 3.38Å; Y59-F62 PolarHBondContact O-N 3.16Å; Y59-L63 HydrophobicContact CD1-CD1 4.15Å; Y59-L63 HydrophobicContact CD2-CG 4.39Å; Y59-L63 HydrophobicContact CE1-CD1 3.57Å; Y59-L63 HydrophobicContact CE1-CG 4.42Å; Y59-L63 HydrophobicContact CE2-CD1 3.95Å; Y59-L63 HydrophobicContact CE2-CD2 4.19Å; Y59-L63 HydrophobicContact CE2-CG 3.94Å; Y59-L63 VanDerWaalsContact CZ-CD1 3.47Å; Y59-L63 WeakPolarHBondContact O-CG 3.31Å; Y59-L63 PolarHBondContact O-N 3.41Å
60	E	87.9	Confident	78.8	Confident	93 Å²	93	93 Å²	93	44%	0.435	46%	0.464	S	S	.	.	H	α-helix	trans	-65.2	-44	176.3	-73.8	173.5	179.8	0	0	111.7	R56 Y57 F62 L63 I64	R56-E60 HydrophobicContact CB-CG 3.78Å; R56-E60 WeakPolarHBondContact CB-OE1 3.46Å; R56-E60 WeakPolarHBondContact O-CB 3.39Å; R56-E60 PolarHBondContact O-N 3.49Å; Y57-E60 PolarHBondContact O-N 2.93Å; E60-F62 VanDerWaalsContact C-N 3.32Å; E60-F62 PolarHBondContact O-N 2.67Å; E60-L63 PolarHBondContact O-N 3.02Å; E60-I64 VanDerWaalsContact O-CG1 3.24Å; E60-I64 WeakPolarHBondContact O-CG1 3.45Å; E60-I64 PolarHBondContact O-N 2.67Å
61	N	86.7	Confident	80.2	Confident	68 Å²	68	95.6 Å²	95.6	36%	0.364	47%	0.472	S	S	.	.	H	α-helix	trans	-61	-41.1	174.6	-79.5	-73.3	0	0	0	112.1	Y57 I64 F65	Y57-N61 WeakPolarHBondContact CD2-ND2 3.47Å; Y57-N61 WeakPolarHBondContact CE1-ND2 3.44Å; Y57-N61 WeakPolarHBondContact CE2-ND2 3.17Å; Y57-N61 WeakPolarHBondContact O-CB 3.48Å; Y57-N61 PolarHBondContact O-N 2.76Å; Y57-N61 PolarHBondContact O-ND2 2.9Å; N61-I64 PolarHBondContact O-N 2.99Å; N61-F65 WeakPolarHBondContact O-CB 3.35Å; N61-F65 PolarHBondContact O-N 3.25Å
62	F	88.3	Confident	82.1	Confident	28 Å²	28	95.5 Å²	95.5	12%	0.123	46%	0.461	C	S	.	.	H	α-helix	trans	-62.2	-46.8	175.3	173.3	-99.3	0	0	0	111.7	E34 C37 L41 Y58 Y59 E60 I64 F65 Q66	E34-F62 HydrophobicContact CG-CE2 4.49Å; E34-F62 HydrophobicContact CG-CZ 4.2Å; C37-F62 HydrophobicContact CB-CD2 3.79Å; C37-F62 HydrophobicContact CB-CE1 4.42Å; C37-F62 HydrophobicContact CB-CE2 3.29Å; C37-F62 HydrophobicContact CB-CZ 3.66Å; L41-F62 HydrophobicContact CD1-CB 3.49Å; L41-F62 VanDerWaalsContact CD1-CB 3.49Å; L41-F62 HydrophobicContact CD1-CD1 4.09Å; L41-F62 HydrophobicContact CD1-CD2 3.99Å; L41-F62 HydrophobicContact CD1-CG 3.57Å; Y58-F62 WeakPolarHBondContact O-CB 3.23Å; Y58-F62 PolarHBondContact O-N 3.22Å; Y59-F62 PolarHBondContact O-N 3.16Å; E60-F62 VanDerWaalsContact C-N 3.32Å; E60-F62 PolarHBondContact O-N 2.67Å; F62-I64 PolarHBondContact O-N 3.22Å; F62-F65 PolarHBondContact O-N 3.02Å; F62-Q66 VanDerWaalsContact CE1-OE1 3.31Å; F62-Q66 WeakPolarHBondContact O-CB 3.39Å; F62-Q66 PolarHBondContact O-N 3.4Å
63	L	90.2	Very high	83.7	Confident	33 Å²	33	92.2 Å²	92.2	17%	0.173	45%	0.451	C	S	.	.	H	α-helix	trans	-60.4	-43.3	176.1	-74.3	176.2	0	0	0	112.2	Y59 E60 F65 Q66 Y67	Y59-L63 HydrophobicContact CD1-CD1 4.15Å; Y59-L63 HydrophobicContact CD2-CG 4.39Å; Y59-L63 HydrophobicContact CE1-CD1 3.57Å; Y59-L63 HydrophobicContact CE1-CG 4.42Å; Y59-L63 HydrophobicContact CE2-CD1 3.95Å; Y59-L63 HydrophobicContact CE2-CD2 4.19Å; Y59-L63 HydrophobicContact CE2-CG 3.94Å; Y59-L63 VanDerWaalsContact CZ-CD1 3.47Å; Y59-L63 WeakPolarHBondContact O-CG 3.31Å; Y59-L63 PolarHBondContact O-N 3.41Å; E60-L63 PolarHBondContact O-N 3.02Å; L63-F65 VanDerWaalsContact C-N 3.34Å; L63-F65 PolarHBondContact O-N 3.44Å; L63-Q66 PolarHBondContact O-N 3.07Å; L63-Y67 HydrophobicContact CB-CE2 4.15Å; L63-Y67 WeakPolarHBondContact O-CB 3.44Å; L63-Y67 VanDerWaalsContact O-CD2 3.22Å; L63-Y67 WeakPolarHBondContact O-CD2 3.48Å; L63-Y67 PolarHBondContact O-N 3.32Å
64	I	91.8	Very high	85.7	Confident	98 Å²	98	91.9 Å²	91.9	50%	0.503	44%	0.44	S	S	.	.	H	α-helix	trans	-58.2	-49.3	175.9	-69.8	164.2	0	0	0	109.8	E60 N61 F62 Q66 Y67 C68	E60-I64 VanDerWaalsContact O-CG1 3.24Å; E60-I64 WeakPolarHBondContact O-CG1 3.45Å; E60-I64 PolarHBondContact O-N 2.67Å; N61-I64 PolarHBondContact O-N 2.99Å; F62-I64 PolarHBondContact O-N 3.22Å; I64-Q66 PolarHBondContact O-N 3.46Å; I64-Y67 PolarHBondContact O-N 2.95Å; I64-C68 WeakPolarHBondContact O-CB 3.37Å; I64-C68 PolarHBondContact O-N 3.29Å; I64-C68 PolarHBondContact O-SG 3.49Å
65	F	90.3	Very high	87.5	Confident	129 Å²	129	87.4 Å²	87.4	57%	0.566	43%	0.427	S	S	*	.	H	α-helix	trans	-60.2	-45.3	178.2	-179.4	-95.2	0	0	0	112	N61 F62 L63 Y67 C68 L69	N61-F65 WeakPolarHBondContact O-CB 3.35Å; N61-F65 PolarHBondContact O-N 3.25Å; F62-F65 PolarHBondContact O-N 3.02Å; L63-F65 VanDerWaalsContact C-N 3.34Å; L63-F65 PolarHBondContact O-N 3.44Å; F65-Y67 PolarHBondContact O-N 2.64Å; F65-C68 PolarHBondContact O-N 3.42Å; F65-L69 HydrophobicContact CE1-CD2 4.29Å; F65-L69 WeakPolarHBondContact O-CB 3.45Å; F65-L69 PolarHBondContact O-N 3.4Å
66	Q	90.9	Very high	89.3	Confident	54 Å²	54	87.4 Å²	87.4	25%	0.252	42%	0.424	S	S	.	.	H	α-helix	trans	-61.5	-43.8	179	-171.6	175.4	8	0	0	111.8	E34 F62 L63 I64 L69 S70	E34-Q66 PolarHBondContact OE1-NE2 3.02Å; F62-Q66 VanDerWaalsContact CE1-OE1 3.31Å; F62-Q66 WeakPolarHBondContact O-CB 3.39Å; F62-Q66 PolarHBondContact O-N 3.4Å; L63-Q66 PolarHBondContact O-N 3.07Å; I64-Q66 PolarHBondContact O-N 3.46Å; Q66-L69 PolarHBondContact O-N 2.95Å; Q66-S70 WeakPolarHBondContact O-CB 3.22Å; Q66-S70 PolarHBondContact O-N 3.1Å; Q66-S70 PolarHBondContact O-OG 3.25Å
67	Y	93	Very high	90.3	Very high	139 Å²	139	85.1 Å²	85.1	55%	0.545	42%	0.422	S	S	.	.	H	α-helix	trans	-66.7	-42.8	176	-62.4	-28.7	0	0	0	112	L63 I64 F65 L69 S70 I71	L63-Y67 HydrophobicContact CB-CE2 4.15Å; L63-Y67 WeakPolarHBondContact O-CB 3.44Å; L63-Y67 VanDerWaalsContact O-CD2 3.22Å; L63-Y67 WeakPolarHBondContact O-CD2 3.48Å; L63-Y67 PolarHBondContact O-N 3.32Å; I64-Y67 PolarHBondContact O-N 2.95Å; F65-Y67 PolarHBondContact O-N 2.64Å; Y67-L69 PolarHBondContact O-N 2.93Å; Y67-S70 PolarHBondContact O-N 3.26Å; Y67-I71 VanDerWaalsContact O-CG1 3.25Å; Y67-I71 WeakPolarHBondContact O-CG1 3.34Å; Y67-I71 PolarHBondContact O-N 2.69Å
68	C	94.3	Very high	91	Very high	66 Å²	66	84.6 Å²	84.6	45%	0.446	43%	0.425	S	S	.	.	H	α-helix	trans	-60	-45.8	175.3	-72.7	0	0	0	0	112	I64 F65 S70 I71 L72	I64-C68 WeakPolarHBondContact O-CB 3.37Å; I64-C68 PolarHBondContact O-N 3.29Å; I64-C68 PolarHBondContact O-SG 3.49Å; F65-C68 PolarHBondContact O-N 3.42Å; C68-S70 VanDerWaalsContact C-N 3.35Å; C68-I71 PolarHBondContact O-N 3.11Å; C68-L72 WeakPolarHBondContact O-CG 3.14Å; C68-L72 PolarHBondContact O-N 3.32Å
69	L	90.6	Very high	91.4	Very high	67 Å²	67	84.8 Å²	84.8	35%	0.351	44%	0.437	S	S	.	.	H	α-helix	trans	-64.3	-40.6	177.7	-172.1	65.9	0	0	0	111.6	F30 F65 Q66 Y67 L72 A73	F30-L69 HydrophobicContact CZ-CD2 3.9Å; F65-L69 HydrophobicContact CE1-CD2 4.29Å; F65-L69 WeakPolarHBondContact O-CB 3.45Å; F65-L69 PolarHBondContact O-N 3.4Å; Q66-L69 PolarHBondContact O-N 2.95Å; Y67-L69 PolarHBondContact O-N 2.93Å; L69-L72 PolarHBondContact O-N 3.09Å; L69-A73 WeakPolarHBondContact O-CB 3.29Å; L69-A73 PolarHBondContact O-N 3.19Å
70	S	92.4	Very high	91.8	Very high	54 Å²	54	84.8 Å²	84.8	38%	0.378	44%	0.44	S	S	.	.	H	α-helix	trans	-63	-43	176.1	-60	0	0	0	0	112	Q66 Y67 C68 A73 L74	Q66-S70 WeakPolarHBondContact O-CB 3.22Å; Q66-S70 PolarHBondContact O-N 3.1Å; Q66-S70 PolarHBondContact O-OG 3.25Å; Y67-S70 PolarHBondContact O-N 3.26Å; C68-S70 VanDerWaalsContact C-N 3.35Å; S70-A73 PolarHBondContact O-N 3.44Å; S70-L74 WeakPolarHBondContact O-CB 3.4Å; S70-L74 VanDerWaalsContact O-CG 3.29Å; S70-L74 WeakPolarHBondContact O-CG 3.4Å; S70-L74 PolarHBondContact O-N 2.78Å
71	I	95.1	Very high	92	Very high	113 Å²	113	86 Å²	86	58%	0.579	45%	0.449	S	S	*	.	H	α-helix	trans	-63.3	-44.6	175.7	-68.6	164.1	0	0	0	110.7	Y67 C68 A73 L74 A75	Y67-I71 VanDerWaalsContact O-CG1 3.25Å; Y67-I71 WeakPolarHBondContact O-CG1 3.34Å; Y67-I71 PolarHBondContact O-N 2.69Å; C68-I71 PolarHBondContact O-N 3.11Å; I71-A73 VanDerWaalsContact C-N 3.33Å; I71-A73 PolarHBondContact O-N 3.38Å; I71-L74 PolarHBondContact O-N 3.24Å; I71-A75 WeakPolarHBondContact O-CB 3.3Å; I71-A75 PolarHBondContact O-N 3.5Å
72	L	93.7	Very high	92.2	Very high	120 Å²	120	89 Å²	89	63%	0.628	46%	0.459	S	S	*	.	H	α-helix	trans	-61.4	-41.2	175.8	-73.3	172.1	0	0	0	112	C68 L69 A75 Y76	C68-L72 WeakPolarHBondContact O-CG 3.14Å; C68-L72 PolarHBondContact O-N 3.32Å; L69-L72 PolarHBondContact O-N 3.09Å; L72-A75 PolarHBondContact O-N 3.48Å; L72-Y76 WeakPolarHBondContact O-CB 3.31Å; L72-Y76 PolarHBondContact O-N 2.98Å
73	A	91.4	Very high	92.3	Very high	47 Å²	47	94.2 Å²	94.2	39%	0.388	48%	0.479	S	S	.	.	H	α-helix	trans	-64.1	-45.1	176.3	0	0	0	0	0	111.7	L69 S70 I71 Y76 L77	L69-A73 WeakPolarHBondContact O-CB 3.29Å; L69-A73 PolarHBondContact O-N 3.19Å; S70-A73 PolarHBondContact O-N 3.44Å; I71-A73 VanDerWaalsContact C-N 3.33Å; I71-A73 PolarHBondContact O-N 3.38Å; A73-Y76 PolarHBondContact O-N 3.13Å; A73-L77 WeakPolarHBondContact O-CB 3Å; A73-L77 VanDerWaalsContact O-CG 3.31Å; A73-L77 WeakPolarHBondContact O-CG 3.09Å; A73-L77 PolarHBondContact O-N 3Å
74	L	94	Very high	92.2	Very high	104 Å²	104	98.5 Å²	98.5	55%	0.545	49%	0.493	S	S	.	.	H	α-helix	trans	-61.6	-43.4	175.2	-71.9	170.7	0	0	0	111.7	S70 I71 Y76 L77 Q78	S70-L74 WeakPolarHBondContact O-CB 3.4Å; S70-L74 VanDerWaalsContact O-CG 3.29Å; S70-L74 WeakPolarHBondContact O-CG 3.4Å; S70-L74 PolarHBondContact O-N 2.78Å; I71-L74 PolarHBondContact O-N 3.24Å; L74-Y76 PolarHBondContact O-N 3.06Å; L74-L77 PolarHBondContact O-N 3.17Å; L74-Q78 WeakPolarHBondContact O-CB 3.12Å; L74-Q78 VanDerWaalsContact O-CG 3.3Å; L74-Q78 WeakPolarHBondContact O-CG 3.43Å; L74-Q78 PolarHBondContact O-N 2.97Å
75	A	93.9	Very high	92	Very high	49 Å²	49	97.9 Å²	97.9	41%	0.405	49%	0.491	S	S	.	.	H	α-helix	trans	-62.9	-41.9	176.5	0	0	0	0	0	112	I71 L72 S79	I71-A75 WeakPolarHBondContact O-CB 3.3Å; I71-A75 PolarHBondContact O-N 3.5Å; L72-A75 PolarHBondContact O-N 3.48Å; A75-S79 WeakPolarHBondContact O-CB 3.5Å; A75-S79 PolarHBondContact O-N 3.23Å
76	Y	93.2	Very high	92	Very high	154 Å²	154	99.1 Å²	99.1	60%	0.604	49%	0.492	S	S	*	.	H	α-helix	trans	-63.2	-46.7	174.6	175.9	-101.9	0	0	0	111.9	L72 A73 L74 Q78 S79 L80	L72-Y76 WeakPolarHBondContact O-CB 3.31Å; L72-Y76 PolarHBondContact O-N 2.98Å; A73-Y76 PolarHBondContact O-N 3.13Å; L74-Y76 PolarHBondContact O-N 3.06Å; Y76-Q78 PolarHBondContact O-N 3.34Å; Y76-S79 WeakPolarHBondContact O-CB 3.46Å; Y76-S79 PolarHBondContact O-N 3.43Å; Y76-L80 WeakPolarHBondContact O-CB 3.38Å; Y76-L80 PolarHBondContact O-N 2.86Å
77	L	92.5	Very high	91.7	Very high	91 Å²	91	100.7 Å²	100.7	48%	0.476	50%	0.498	S	S	.	.	H	α-helix	trans	-62.3	-43.1	177.8	-73.4	170.2	0	0	0	111.7	A73 L74 S79 L80 I81	A73-L77 WeakPolarHBondContact O-CB 3Å; A73-L77 VanDerWaalsContact O-CG 3.31Å; A73-L77 WeakPolarHBondContact O-CG 3.09Å; A73-L77 PolarHBondContact O-N 3Å; L74-L77 PolarHBondContact O-N 3.17Å; L77-S79 PolarHBondContact O-N 2.92Å; L77-L80 WeakPolarHBondContact O-CB 3.41Å; L77-L80 PolarHBondContact O-N 3.48Å; L77-I81 VanDerWaalsContact O-CG1 3.28Å; L77-I81 WeakPolarHBondContact O-CG1 3.14Å; L77-I81 PolarHBondContact O-N 3.38Å
78	Q	94.1	Very high	91.3	Very high	135 Å²	135	99 Å²	99	63%	0.631	50%	0.495	S	S	*	.	H	α-helix	trans	-61.4	-43.1	173.9	-75.6	176.6	-28.5	0	0	111.8	L74 Y76 L80 I81 F82	L74-Q78 WeakPolarHBondContact O-CB 3.12Å; L74-Q78 VanDerWaalsContact O-CG 3.3Å; L74-Q78 WeakPolarHBondContact O-CG 3.43Å; L74-Q78 PolarHBondContact O-N 2.97Å; Y76-Q78 PolarHBondContact O-N 3.34Å; Q78-L80 VanDerWaalsContact C-N 3.32Å; Q78-L80 PolarHBondContact O-N 3.09Å; Q78-I81 PolarHBondContact O-N 2.88Å; Q78-F82 WeakPolarHBondContact O-CB 3.32Å; Q78-F82 PolarHBondContact O-N 2.9Å
79	S	91.2	Very high	90.8	Very high	77 Å²	77	99.7 Å²	99.7	54%	0.538	49%	0.494	S	S	.	.	H	α-helix	trans	-62	-40.1	175.2	-175.6	0	0	0	0	112.1	A75 Y76 L77 Y83	A75-S79 WeakPolarHBondContact O-CB 3.5Å; A75-S79 PolarHBondContact O-N 3.23Å; Y76-S79 WeakPolarHBondContact O-CB 3.46Å; Y76-S79 PolarHBondContact O-N 3.43Å; L77-S79 PolarHBondContact O-N 2.92Å; S79-Y83 VanDerWaalsContact O-CB 3.31Å; S79-Y83 WeakPolarHBondContact O-CB 3.39Å; S79-Y83 PolarHBondContact O-N 3.24Å
80	L	91.6	Very high	90.4	Very high	61 Å²	61	101 Å²	101	32%	0.319	50%	0.502	S	S	.	.	H	α-helix	trans	-65	-48	177.4	-163.2	84.7	0	0	0	111.4	Y76 L77 Q78 Y83 Y84	Y76-L80 WeakPolarHBondContact O-CB 3.38Å; Y76-L80 PolarHBondContact O-N 2.86Å; L77-L80 WeakPolarHBondContact O-CB 3.41Å; L77-L80 PolarHBondContact O-N 3.48Å; Q78-L80 VanDerWaalsContact C-N 3.32Å; Q78-L80 PolarHBondContact O-N 3.09Å; L80-Y83 PolarHBondContact O-N 3.01Å; L80-Y84 HydrophobicContact CD1-CD2 4.34Å; L80-Y84 HydrophobicContact CD1-CE2 3.87Å; L80-Y84 HydrophobicContact CD2-CE2 4.47Å; L80-Y84 HydrophobicContact CG-CD2 3.92Å; L80-Y84 HydrophobicContact CG-CE2 3.89Å; L80-Y84 WeakPolarHBondContact O-CD2 3.28Å; L80-Y84 PolarHBondContact O-N 2.96Å
81	I	92.2	Very high	89.9	Confident	119 Å²	119	104.7 Å²	104.7	61%	0.61	51%	0.507	S	S	*	.	H	α-helix	trans	-59.2	-48.8	176.8	-68.5	164.7	0	0	0	109.8	L77 Q78 Y83 Y84 D85	L77-I81 VanDerWaalsContact O-CG1 3.28Å; L77-I81 WeakPolarHBondContact O-CG1 3.14Å; L77-I81 PolarHBondContact O-N 3.38Å; Q78-I81 PolarHBondContact O-N 2.88Å; I81-Y83 VanDerWaalsContact C-N 3.33Å; I81-Y83 PolarHBondContact O-N 3.22Å; I81-Y84 PolarHBondContact O-N 2.84Å; I81-D85 VanDerWaalsContact O-CB 3.25Å; I81-D85 WeakPolarHBondContact O-CB 3.46Å; I81-D85 PolarHBondContact O-N 3.37Å
82	F	91.6	Very high	89.1	Confident	132 Å²	132	103.9 Å²	103.9	58%	0.579	50%	0.5	S	S	*	.	H	α-helix	trans	-60.7	-40.1	177.5	-179.4	-99.8	0	0	0	112.7	Q78 R86	Q78-F82 WeakPolarHBondContact O-CB 3.32Å; Q78-F82 PolarHBondContact O-N 2.9Å; F82-R86 WeakPolarHBondContact O-CB 3.28Å; F82-R86 PolarHBondContact O-N 2.87Å
83	Y	89.5	Confident	88.7	Confident	137 Å²	137	105 Å²	105	54%	0.537	50%	0.5	S	S	.	.	H	α-helix	trans	-64.1	-46.1	177.5	175.3	-95.9	0	0	0	112.1	S79 L80 I81 K87	S79-Y83 VanDerWaalsContact O-CB 3.31Å; S79-Y83 WeakPolarHBondContact O-CB 3.39Å; S79-Y83 PolarHBondContact O-N 3.24Å; L80-Y83 PolarHBondContact O-N 3.01Å; I81-Y83 VanDerWaalsContact C-N 3.33Å; I81-Y83 PolarHBondContact O-N 3.22Å; Y83-K87 HydrophobicContact CE1-CD 4.37Å; Y83-K87 WeakPolarHBondContact O-CB 3.33Å; Y83-K87 PolarHBondContact O-N 3.39Å
84	Y	88.2	Confident	88.1	Confident	122 Å²	122	109.4 Å²	109.4	48%	0.478	51%	0.513	S	S	.	.	H	α-helix	trans	-74.4	-39.5	-179.1	-81	-72.5	0	0	0	112.9	L80 I81 R86 K87 E88	L80-Y84 HydrophobicContact CD1-CD2 4.34Å; L80-Y84 HydrophobicContact CD1-CE2 3.87Å; L80-Y84 HydrophobicContact CD2-CE2 4.47Å; L80-Y84 HydrophobicContact CG-CD2 3.92Å; L80-Y84 HydrophobicContact CG-CE2 3.89Å; L80-Y84 WeakPolarHBondContact O-CD2 3.28Å; L80-Y84 PolarHBondContact O-N 2.96Å; I81-Y84 PolarHBondContact O-N 2.84Å; Y84-R86 VanDerWaalsContact C-N 3.31Å; Y84-R86 PolarHBondContact O-N 3.38Å; Y84-K87 HydrophobicContact CD1-CD 4.38Å; Y84-K87 CarbonylContact O-C 3.54Å; Y84-K87 WeakPolarHBondContact O-CB 3.49Å; Y84-K87 PolarHBondContact O-N 2.92Å; Y84-K87 VanDerWaalsContact O-N 3.11Å; Y84-E88 WeakPolarHBondContact O-CB 3.28Å; Y84-E88 PolarHBondContact O-N 3.03Å
85	D	88.8	Confident	87.4	Confident	86 Å²	86	109.5 Å²	109.5	46%	0.46	51%	0.511	S	S	.	.	H	α-helix	trans	-59.2	-43.6	172.6	179.2	75.1	0	0	0	110.9	I81 K87 E88 N89	I81-D85 VanDerWaalsContact O-CB 3.25Å; I81-D85 WeakPolarHBondContact O-CB 3.46Å; I81-D85 PolarHBondContact O-N 3.37Å; D85-K87 PolarHBondContact O-N 3.15Å; D85-E88 PolarHBondContact O-N 3.48Å; D85-N89 VanDerWaalsContact O-CB 3.28Å; D85-N89 WeakPolarHBondContact O-CB 3.44Å; D85-N89 PolarHBondContact O-N 3.27Å; D85-N89 PolarHBondContact O-ND2 3.42Å; D85-N89 VanDerWaalsContact O-ND2 3.16Å; D85-N89 PolarHBondContact OD2-ND2 2.9Å; D85-N89 VanDerWaalsContact OD2-ND2 3.11Å
86	R	88.9	Confident	86.8	Confident	154 Å²	154	112 Å²	112	58%	0.581	52%	0.516	S	S	*	.	H	α-helix	trans	-63.5	-39.5	173.7	-174.9	174.3	-179.4	168.7	1.3	112.5	F82 Y84 L90	F82-R86 WeakPolarHBondContact O-CB 3.28Å; F82-R86 PolarHBondContact O-N 2.87Å; Y84-R86 VanDerWaalsContact C-N 3.31Å; Y84-R86 PolarHBondContact O-N 3.38Å; R86-L90 HydrophobicContact CG-CD1 4.19Å; R86-L90 WeakPolarHBondContact O-CB 3.44Å; R86-L90 WeakPolarHBondContact O-CD1 3.28Å; R86-L90 VanDerWaalsContact O-CG 3.26Å; R86-L90 WeakPolarHBondContact O-CG 3.4Å; R86-L90 PolarHBondContact O-N 3.34Å
87	K	85.8	Confident	86.3	Confident	88 Å²	88	109.9 Å²	109.9	38%	0.383	51%	0.514	S	S	.	.	H	α-helix	trans	-68	-38.8	178.4	-175.8	178.5	178	-179.2	0	111.8	Y83 Y84 D85 L90 R91	Y83-K87 HydrophobicContact CE1-CD 4.37Å; Y83-K87 WeakPolarHBondContact O-CB 3.33Å; Y83-K87 PolarHBondContact O-N 3.39Å; Y84-K87 HydrophobicContact CD1-CD 4.38Å; Y84-K87 CarbonylContact O-C 3.54Å; Y84-K87 WeakPolarHBondContact O-CB 3.49Å; Y84-K87 PolarHBondContact O-N 2.92Å; Y84-K87 VanDerWaalsContact O-N 3.11Å; D85-K87 PolarHBondContact O-N 3.15Å; K87-L90 PolarHBondContact O-N 3.07Å; K87-R91 PolarHBondContact O-N 3.02Å
88	E	83.3	Confident	85.8	Confident	104 Å²	104	109.6 Å²	109.6	49%	0.486	51%	0.51	S	S	.	.	H	α-helix	trans	-68.4	-46.2	175.4	-172.5	162.7	-160.9	0	0	111.2	Y84 D85 L90 R91 H92	Y84-E88 WeakPolarHBondContact O-CB 3.28Å; Y84-E88 PolarHBondContact O-N 3.03Å; D85-E88 PolarHBondContact O-N 3.48Å; E88-L90 VanDerWaalsContact C-N 3.26Å; E88-L90 PolarHBondContact O-N 2.84Å; E88-R91 CarbonylContact O-C 3.59Å; E88-R91 WeakPolarHBondContact O-CA 3.32Å; E88-R91 WeakPolarHBondContact O-CB 3.47Å; E88-R91 PolarHBondContact O-N 3.13Å; E88-H92 PolarHBondContact O-N 3.47Å
89	N	83.7	Confident	84.9	Confident	79 Å²	79	108.1 Å²	108.1	42%	0.422	50%	0.504	S	S	.	.	H	α-helix	trans	-57.6	-37.2	171.6	-83.3	-45.7	0	0	0	112.7	D85 K93	D85-N89 VanDerWaalsContact O-CB 3.28Å; D85-N89 WeakPolarHBondContact O-CB 3.44Å; D85-N89 PolarHBondContact O-N 3.27Å; D85-N89 PolarHBondContact O-ND2 3.42Å; D85-N89 VanDerWaalsContact O-ND2 3.16Å; D85-N89 PolarHBondContact OD2-ND2 2.9Å; D85-N89 VanDerWaalsContact OD2-ND2 3.11Å; N89-K93 WeakPolarHBondContact O-CB 3.09Å; N89-K93 WeakPolarHBondContact O-CG 3.42Å; N89-K93 PolarHBondContact O-N 3.45Å
90	L	83.9	Confident	84.5	Confident	96 Å²	96	108.8 Å²	108.8	50%	0.503	50%	0.501	S	S	.	.	H	α-helix	trans	-70.4	-37.2	173.9	-76.5	165.2	0	0	0	112.6	R86 K87 E88 K93 Q94	R86-L90 HydrophobicContact CG-CD1 4.19Å; R86-L90 WeakPolarHBondContact O-CB 3.44Å; R86-L90 WeakPolarHBondContact O-CD1 3.28Å; R86-L90 VanDerWaalsContact O-CG 3.26Å; R86-L90 WeakPolarHBondContact O-CG 3.4Å; R86-L90 PolarHBondContact O-N 3.34Å; K87-L90 PolarHBondContact O-N 3.07Å; E88-L90 VanDerWaalsContact C-N 3.26Å; E88-L90 PolarHBondContact O-N 2.84Å; L90-K93 PolarHBondContact O-N 2.81Å; L90-Q94 WeakPolarHBondContact O-CB 3.34Å; L90-Q94 WeakPolarHBondContact O-CG 3.49Å; L90-Q94 PolarHBondContact O-N 3.49Å
91	R	81.3	Confident	84	Confident	131 Å²	131	110.4 Å²	110.4	49%	0.494	51%	0.507	S	S	.	.	H	α-helix	trans	-64.6	-48.5	173	-84.8	-164.9	-75.5	-165.1	2.1	111.3	K87 E88 K93 Q94 E95	K87-R91 PolarHBondContact O-N 3.02Å; E88-R91 CarbonylContact O-C 3.59Å; E88-R91 WeakPolarHBondContact O-CA 3.32Å; E88-R91 WeakPolarHBondContact O-CB 3.47Å; E88-R91 PolarHBondContact O-N 3.13Å; R91-K93 VanDerWaalsContact C-N 3.33Å; R91-K93 PolarHBondContact O-N 3.47Å; R91-Q94 CarbonylContact O-C 3.51Å; R91-Q94 WeakPolarHBondContact O-CB 3.35Å; R91-Q94 PolarHBondContact O-N 2.81Å; R91-Q94 VanDerWaalsContact O-N 3.07Å; R91-E95 WeakPolarHBondContact O-CG 3.45Å; R91-E95 PolarHBondContact O-N 3.06Å
92	H	78.8	Confident	83.1	Confident	95 Å²	95	108.1 Å²	108.1	44%	0.44	50%	0.495	S	S	.	.	H	α-helix	trans	-58.8	-42.7	174.6	-87.2	-47.9	0	0	0	112.2	E88 Q94 E95 I96	E88-H92 PolarHBondContact O-N 3.47Å; H92-Q94 VanDerWaalsContact C-N 3.34Å; H92-Q94 PolarHBondContact O-N 3.2Å; H92-E95 IonicContact ND1-OE2 3.41Å; H92-E95 PolarHBondContact ND1-OE2 2.82Å; H92-E95 PolarHBondContact O-N 2.96Å; H92-I96 WeakPolarHBondContact O-CB 2.94Å; H92-I96 VanDerWaalsContact O-CG1 3.24Å; H92-I96 WeakPolarHBondContact O-CG1 3.49Å; H92-I96 PolarHBondContact O-N 3.28Å
93	K	83.9	Confident	82.4	Confident	144 Å²	144	105.7 Å²	105.7	63%	0.626	49%	0.488	S	S	*	.	H	α-helix	trans	-61.8	-40.3	173.9	-78.8	-178.4	-179	-176.8	0	112.5	N89 L90 R91 L97	N89-K93 WeakPolarHBondContact O-CB 3.09Å; N89-K93 WeakPolarHBondContact O-CG 3.42Å; N89-K93 PolarHBondContact O-N 3.45Å; L90-K93 PolarHBondContact O-N 2.81Å; R91-K93 VanDerWaalsContact C-N 3.33Å; R91-K93 PolarHBondContact O-N 3.47Å; K93-L97 WeakPolarHBondContact O-CB 3.49Å; K93-L97 PolarHBondContact O-N 2.68Å
94	Q	80.1	Confident	81.9	Confident	140 Å²	140	103.8 Å²	103.8	65%	0.654	48%	0.484	S	S	*	.	H	α-helix	trans	-67.1	-39.4	175.9	-79.2	179.8	-18.2	0	0	112.3	L90 R91 H92 L97 F98	L90-Q94 WeakPolarHBondContact O-CB 3.34Å; L90-Q94 WeakPolarHBondContact O-CG 3.49Å; L90-Q94 PolarHBondContact O-N 3.49Å; R91-Q94 CarbonylContact O-C 3.51Å; R91-Q94 WeakPolarHBondContact O-CB 3.35Å; R91-Q94 PolarHBondContact O-N 2.81Å; R91-Q94 VanDerWaalsContact O-N 3.07Å; H92-Q94 VanDerWaalsContact C-N 3.34Å; H92-Q94 PolarHBondContact O-N 3.2Å; Q94-L97 PolarHBondContact O-N 3.41Å; Q94-F98 VanDerWaalsContact O-CB 3.26Å; Q94-F98 WeakPolarHBondContact O-CB 3.48Å; Q94-F98 PolarHBondContact O-N 3.05Å
95	E	78.5	Confident	81.1	Confident	106 Å²	106	100 Å²	100	50%	0.495	48%	0.479	S	S	.	.	H	α-helix	trans	-65.9	-44.1	175.8	-74.2	171.4	178.4	0	0	111.7	R91 H92 L97 F98 M99	R91-E95 WeakPolarHBondContact O-CG 3.45Å; R91-E95 PolarHBondContact O-N 3.06Å; H92-E95 IonicContact ND1-OE2 3.41Å; H92-E95 PolarHBondContact ND1-OE2 2.82Å; H92-E95 PolarHBondContact O-N 2.96Å; E95-L97 PolarHBondContact O-N 2.83Å; E95-F98 WeakPolarHBondContact O-CB 3.36Å; E95-F98 PolarHBondContact O-N 3.44Å; E95-M99 WeakPolarHBondContact O-CB 3.45Å; E95-M99 VanDerWaalsContact O-CG 3.3Å; E95-M99 WeakPolarHBondContact O-CG 3.08Å; E95-M99 PolarHBondContact O-N 3.49Å
96	I	81.3	Confident	80.1	Confident	100 Å²	100	104.5 Å²	104.5	51%	0.513	49%	0.489	S	S	.	.	H	α-helix	trans	-62.2	-44.2	174.9	-67.6	165.3	0	0	0	110.6	H92 F98 M99 N100	H92-I96 WeakPolarHBondContact O-CB 2.94Å; H92-I96 VanDerWaalsContact O-CG1 3.24Å; H92-I96 WeakPolarHBondContact O-CG1 3.49Å; H92-I96 PolarHBondContact O-N 3.28Å; I96-F98 VanDerWaalsContact C-N 3.3Å; I96-F98 PolarHBondContact O-N 3.29Å; I96-M99 PolarHBondContact O-N 3.22Å; I96-N100 WeakPolarHBondContact O-CB 3.35Å; I96-N100 PolarHBondContact O-N 2.94Å
97	L	82.8	Confident	79.2	Confident	110 Å²	110	105.1 Å²	105.1	58%	0.576	49%	0.491	S	S	*	.	H	α-helix	trans	-63	-38.5	176.7	-122.5	144.4	0	0	0	111.7	K93 Q94 E95 Q101	K93-L97 WeakPolarHBondContact O-CB 3.49Å; K93-L97 PolarHBondContact O-N 2.68Å; Q94-L97 PolarHBondContact O-N 3.41Å; E95-L97 PolarHBondContact O-N 2.83Å; L97-Q101 WeakPolarHBondContact O-CG 3.49Å; L97-Q101 PolarHBondContact O-N 3.43Å; L97-Q101 VanDerWaalsContact O-N 3.08Å
98	F	81.5	Confident	78.1	Confident	85 Å²	85	109 Å²	109	37%	0.373	50%	0.503	S	S	.	.	H	α-helix	trans	-67.4	-44.7	175.9	-174	-101.4	0	0	0	111.9	Q94 E95 I96 Q101 M102 L155	Q94-F98 VanDerWaalsContact O-CB 3.26Å; Q94-F98 WeakPolarHBondContact O-CB 3.48Å; Q94-F98 PolarHBondContact O-N 3.05Å; E95-F98 WeakPolarHBondContact O-CB 3.36Å; E95-F98 PolarHBondContact O-N 3.44Å; I96-F98 VanDerWaalsContact C-N 3.3Å; I96-F98 PolarHBondContact O-N 3.29Å; F98-Q101 PolarHBondContact O-N 2.95Å; F98-M102 HydrophobicContact CD1-CE 4.12Å; F98-M102 HydrophobicContact CD1-CG 4.41Å; F98-M102 HydrophobicContact CD1-SD 4.25Å; F98-M102 HydrophobicContact CE1-CE 3.87Å; F98-M102 HydrophobicContact CE1-CG 4.09Å; F98-M102 HydrophobicContact CE1-SD 3.56Å; F98-M102 VanDerWaalsContact CE1-SD 3.56Å; F98-M102 HydrophobicContact CZ-CG 4.33Å; F98-M102 HydrophobicContact CZ-SD 4.02Å; F98-M102 WeakPolarHBondContact O-CG 3.22Å; F98-M102 PolarHBondContact O-N 3.41Å; F98-L155 HydrophobicContact CE1-CD1 4.03Å; F98-L155 HydrophobicContact CZ-CD1 3.77Å
99	M	76.5	Confident	76.7	Confident	104 Å²	104	111.6 Å²	111.6	51%	0.512	51%	0.509	S	S	.	.	H	α-helix	trans	-62.7	-41.7	175.9	-73.2	-64.9	-180	0	0	112	E95 I96 M102 N103	E95-M99 WeakPolarHBondContact O-CB 3.45Å; E95-M99 VanDerWaalsContact O-CG 3.3Å; E95-M99 WeakPolarHBondContact O-CG 3.08Å; E95-M99 PolarHBondContact O-N 3.49Å; I96-M99 PolarHBondContact O-N 3.22Å; M99-M102 HydrophobicContact CE-CE 4.21Å; M99-M102 PolarHBondContact O-N 2.83Å; M99-M102 HydrophobicContact SD-CE 3.39Å; M99-M102 WeakPolarHBondContact SD-CE 3.4Å; M99-N103 WeakPolarHBondContact O-CB 3.37Å; M99-N103 PolarHBondContact O-N 3.43Å
100	N	82.4	Confident	75.2	Confident	91 Å²	91	114.2 Å²	114.2	49%	0.487	52%	0.519	S	S	.	.	H	α-helix	trans	-62.9	-43.4	175.1	-79.1	-12.2	0	0	0	112	I96 M102 N103 E104	I96-N100 WeakPolarHBondContact O-CB 3.35Å; I96-N100 PolarHBondContact O-N 2.94Å; N100-M102 VanDerWaalsContact C-N 3.34Å; N100-M102 PolarHBondContact O-N 3.37Å; N100-N103 PolarHBondContact O-N 3.48Å; N100-E104 WeakPolarHBondContact O-CG 3.41Å; N100-E104 PolarHBondContact O-N 3.4Å
101	Q	81.2	Confident	73.6	Confident	95 Å²	95	115.7 Å²	115.7	44%	0.444	53%	0.527	S	S	.	.	H	α-helix	trans	-63.5	-37.5	175	-78.1	-172.9	-5.5	0	0	112.7	L97 F98 A105	L97-Q101 WeakPolarHBondContact O-CG 3.49Å; L97-Q101 PolarHBondContact O-N 3.43Å; L97-Q101 VanDerWaalsContact O-N 3.08Å; F98-Q101 PolarHBondContact O-N 2.95Å; Q101-A105 WeakPolarHBondContact O-CB 3.24Å; Q101-A105 PolarHBondContact O-N 3.08Å
102	M	73.5	Confident	72	Confident	71 Å²	71	117.5 Å²	117.5	35%	0.35	54%	0.541	S	S	.	.	H	α-helix	trans	-68.5	-40.8	175.1	-73.5	-158.3	-52.6	0	0	112.3	F98 M99 N100 E104 A105 R106	F98-M102 HydrophobicContact CD1-CE 4.12Å; F98-M102 HydrophobicContact CD1-CG 4.41Å; F98-M102 HydrophobicContact CD1-SD 4.25Å; F98-M102 HydrophobicContact CE1-CE 3.87Å; F98-M102 HydrophobicContact CE1-CG 4.09Å; F98-M102 HydrophobicContact CE1-SD 3.56Å; F98-M102 VanDerWaalsContact CE1-SD 3.56Å; F98-M102 HydrophobicContact CZ-CG 4.33Å; F98-M102 HydrophobicContact CZ-SD 4.02Å; F98-M102 WeakPolarHBondContact O-CG 3.22Å; F98-M102 PolarHBondContact O-N 3.41Å; M99-M102 HydrophobicContact CE-CE 4.21Å; M99-M102 PolarHBondContact O-N 2.83Å; M99-M102 HydrophobicContact SD-CE 3.39Å; M99-M102 WeakPolarHBondContact SD-CE 3.4Å; N100-M102 VanDerWaalsContact C-N 3.34Å; N100-M102 PolarHBondContact O-N 3.37Å; M102-E104 VanDerWaalsContact C-N 3.34Å; M102-A105 PolarHBondContact O-N 2.87Å; M102-R106 WeakPolarHBondContact O-CB 3.45Å; M102-R106 PolarHBondContact O-N 2.74Å
103	N	77.3	Confident	70.3	Confident	82 Å²	82	119.7 Å²	119.7	44%	0.439	55%	0.551	S	S	.	*	H	α-helix	trans	-65.5	-37.7	177.1	-76.2	-17.2	0	0	0	111.8	M99 N100 R107	M99-N103 WeakPolarHBondContact O-CB 3.37Å; M99-N103 PolarHBondContact O-N 3.43Å; N100-N103 PolarHBondContact O-N 3.48Å; N103-R107 PolarHBondContact O-N 3.36Å
104	E	78.9	Confident	68	Low	96 Å²	96	117.5 Å²	117.5	45%	0.449	55%	0.554	S	S	.	*	H	α-helix	trans	-65.4	-41.9	171.1	-76.5	-176.5	-173.2	0	0	112.8	N100 M102 R106 R107 R108	N100-E104 WeakPolarHBondContact O-CG 3.41Å; N100-E104 PolarHBondContact O-N 3.4Å; M102-E104 VanDerWaalsContact C-N 3.34Å; E104-R106 VanDerWaalsContact C-N 3.35Å; E104-R107 PolarHBondContact O-N 3.21Å; E104-R108 PolarHBondContact O-N 3.47Å; E104-R108 VanDerWaalsContact O-N 3.14Å
105	A	70.1	Confident	65.9	Low	44 Å²	44	116 Å²	116	36%	0.364	56%	0.559	S	S	.	*	H	α-helix	trans	-64.4	-39.5	176.1	0	0	0	0	0	111.9	Q101 M102 R108 W109	Q101-A105 WeakPolarHBondContact O-CB 3.24Å; Q101-A105 PolarHBondContact O-N 3.08Å; M102-A105 PolarHBondContact O-N 2.87Å; A105-R108 PolarHBondContact O-N 2.91Å; A105-W109 PolarHBondContact O-N 3.06Å; A105-W109 VanDerWaalsContact O-N 3.12Å
106	R	68.7	Low	63.8	Low	180 Å²	180	116.5 Å²	116.5	68%	0.679	57%	0.571	S	S	*	*	H	α-helix	trans	-65.4	-41.6	176.7	-173.5	179.8	-70.3	-160.6	-0.8	112.1	M102 E104 W109 Q110	M102-R106 WeakPolarHBondContact O-CB 3.45Å; M102-R106 PolarHBondContact O-N 2.74Å; E104-R106 VanDerWaalsContact C-N 3.35Å; R106-W109 PolarHBondContact O-N 2.76Å; R106-Q110 PolarHBondContact O-N 3.3Å
107	R	68.9	Low	61.5	Low	166 Å²	166	120.9 Å²	120.9	63%	0.626	59%	0.59	S	S	*	*	H	α-helix	trans	-60.6	-47.5	174.7	-79.4	-164.3	-80.5	-172.4	-3	111.8	N103 E104 W109 Q110 D111	N103-R107 PolarHBondContact O-N 3.36Å; E104-R107 PolarHBondContact O-N 3.21Å; R107-W109 PolarHBondContact O-N 2.69Å; R107-Q110 PolarHBondContact O-N 3.45Å; R107-D111 PolarHBondContact O-N 2.89Å
108	R	64.4	Low	59.5	Low	169 Å²	169	124.7 Å²	124.7	64%	0.638	60%	0.604	S	S	*	*	H	α-helix	trans	-62	-27.2	176.4	-72.3	-169.2	-179.4	105.9	-0.1	113.8	E104 A105	E104-R108 PolarHBondContact O-N 3.47Å; E104-R108 VanDerWaalsContact O-N 3.14Å; A105-R108 PolarHBondContact O-N 2.91Å
109	W	53.7	Low	57.4	Low	160 Å²	160	126.6 Å²	126.6	61%	0.606	62%	0.623	S	S	*	*	H	α-helix	trans	-77.2	-34.5	179	-125.1	78.4	0	0	0	112.9	A105 R106 R107 H112 Q113	A105-W109 PolarHBondContact O-N 3.06Å; A105-W109 VanDerWaalsContact O-N 3.12Å; R106-W109 PolarHBondContact O-N 2.76Å; R107-W109 PolarHBondContact O-N 2.69Å; W109-H112 PolarHBondContact O-N 2.97Å; W109-Q113 HydrophobicContact CE3-CG 4.36Å; W109-Q113 HydrophobicContact CZ3-CG 4.33Å
110	Q	51	Low	55.3	Low	134 Å²	134	128.5 Å²	128.5	63%	0.626	64%	0.636	S	S	*	*	H	α-helix	trans	-68.6	-35.1	176.3	-78.8	-178.3	-51.7	0	0	112.3	R106 R107 H112 Q113	R106-Q110 PolarHBondContact O-N 3.3Å; R107-Q110 PolarHBondContact O-N 3.45Å; Q110-H112 PolarHBondContact O-N 3.38Å; Q110-Q113 PolarHBondContact O-N 2.89Å
111	D	50.2	Low	53	Low	126 Å²	126	130.7 Å²	130.7	67%	0.674	65%	0.647	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.8	-15.7	176.7	-63.2	-26.7	0	0	0	113.1	R107	R107-D111 PolarHBondContact O-N 2.89Å
112	H	49.3	Very low	50.9	Low	170 Å²	170	133.2 Å²	133.2	79%	0.787	66%	0.664	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.9	-1.2	178.8	-88.3	-44.7	0	0	0	114.8	W109 Q110	W109-H112 PolarHBondContact O-N 2.97Å; Q110-H112 PolarHBondContact O-N 3.38Å
113	Q	41.3	Very low	49	Very low	140 Å²	140	137 Å²	137	65%	0.654	69%	0.685	S	S	*	*	S	Bend	trans	-106.2	4.3	-179.7	-84	-170.8	-37.5	0	0	115.1	W109 Q110	W109-Q113 HydrophobicContact CE3-CG 4.36Å; W109-Q113 HydrophobicContact CZ3-CG 4.33Å; Q110-Q113 PolarHBondContact O-N 2.89Å
114	S	36.2	Very low	46.8	Very low	99 Å²	99	140.6 Å²	140.6	69%	0.692	70%	0.701	S	S	*	*	S	Bend	trans	-110.1	69.5	175.1	59.5	0	0	0	0	112.2
115	S	35.5	Very low	44.8	Very low	109 Å²	109	141.7 Å²	141.7	76%	0.762	71%	0.71	S	S	*	*			trans	168.4	107.4	155	-178	0	0	0	0	107.1
116	P	35.3	Very low	43.2	Very low	115 Å²	115	145.7 Å²	145.7	75%	0.747	73%	0.725	S	S	*	*				-153.7	139.8	96.6	35.6	-16.5	0	0	0	114.6
117	E	33.7	Very low	41.8	Very low	193 Å²	193	144.4 Å²	144.4	90%	0.902	73%	0.726	S	S	*	*			trans	155.4	99.8	144.9	-90.4	177.3	-179.5	0	0	109.2
118	E	40	Very low	40.3	Very low	189 Å²	189	142.1 Å²	142.1	88%	0.883	73%	0.727	S	S	*	*			trans	-160.3	104.1	143.7	-110.3	-179.3	-173.1	0	0	110.1
119	T	37.7	Very low	39.1	Very low	126 Å²	126	140.7 Å²	140.7	77%	0.773	73%	0.732	S	S	*	*			trans	63.1	114.5	135.2	-17.1	0	0	0	0	120.6
120	D	31.9	Very low	38.3	Very low	144 Å²	144	139.3 Å²	139.3	77%	0.77	74%	0.735	S	S	*	*			trans	-34	137.3	149.5	-80	-43.6	0	0	0	113.7
121	N	34.6	Very low	37.5	Very low	136 Å²	136	139.2 Å²	139.2	73%	0.727	74%	0.739	S	S	*	*			trans	136.2	106.9	138.7	-68.3	-46.6	0	0	0	111.4
122	N	36.2	Very low	36.6	Very low	148 Å²	148	139.1 Å²	139.1	79%	0.791	74%	0.738	S	S	*	*				142.5	123.6	128.9	-72.1	-39.8	0	0	0	113.9
123	L	33.8	Very low	35.8	Very low	150 Å²	150	138.7 Å²	138.7	79%	0.785	74%	0.742	S	S	*	*			trans	74.4	98.4	148.1	-92.6	80	0	0	0	119.6
124	M	31.2	Very low	35.3	Very low	158 Å²	158	138.2 Å²	138.2	78%	0.778	74%	0.744	S	S	*	*				28.1	109.9	107.6	-93.2	152.9	81.4	0	0	116.1
125	N	36.7	Very low	35	Very low	119 Å²	119	141 Å²	141	64%	0.636	75%	0.75	S	S	*	*				162.4	134	93.4	-92.3	-23	0	0	0	112.8
126	N	36.3	Very low	34.8	Very low	129 Å²	129	143 Å²	143	69%	0.69	75%	0.751	S	S	*	*			trans	87	119.5	134.3	-67.5	-11.2	0	0	0	122.3
127	H	39.6	Very low	34.7	Very low	152 Å²	152	144 Å²	144	70%	0.704	75%	0.751	S	S	*	*			trans	93.2	98.4	132	-86.9	-55.8	0	0	0	118.7
128	D	36.9	Very low	34.8	Very low	119 Å²	119	141.3 Å²	141.3	64%	0.636	74%	0.742	S	S	*	*				44.8	114.6	109.5	-56.2	-13.5	0	0	0	116.6
129	D	39	Very low	34.5	Very low	138 Å²	138	141.8 Å²	141.8	74%	0.738	74%	0.737	S	S	*	*				175.6	134.7	89.8	-102	-29.5	0	0	0	112.4
130	I	37.7	Very low	34.3	Very low	132 Å²	132	137.6 Å²	137.6	68%	0.677	72%	0.719	S	S	*	*			trans	81.9	108.9	132.6	-64	168.7	0	0	0	120
131	D	35	Very low	34.7	Very low	131 Å²	131	135.7 Å²	135.7	70%	0.701	71%	0.709	S	S	*	*			trans	84.1	108.8	135.1	-75.7	-25.1	0	0	0	123.1
132	N	31.4	Very low	35.2	Very low	124 Å²	124	134.2 Å²	134.2	66%	0.663	70%	0.701	S	S	*	*				50.4	100.7	120.3	-75.5	-41.6	0	0	0	117.7
133	N	31.4	Very low	35.3	Very low	161 Å²	161	132.8 Å²	132.8	86%	0.861	69%	0.69	S	S	*	*				-165.2	140.6	106.5	-106.4	-37.1	0	0	0	113.9
134	N	30.5	Very low	35.5	Very low	131 Å²	131	132.6 Å²	132.6	70%	0.701	68%	0.679	S	S	*	*			trans	-63.5	158	-175.6	-70.4	-56.4	0	0	0	114.8
135	N	30.4	Very low	36.2	Very low	156 Å²	156	129.8 Å²	129.8	83%	0.834	67%	0.667	S	S	*	*			trans	76.7	52.5	140.9	-86.3	-5.4	0	0	0	120.2
136	I	31.8	Very low	36.8	Very low	151 Å²	151	130.2 Å²	130.2	77%	0.774	67%	0.668	S	S	*	*			trans	-146.6	118.3	153	-52.6	177	0	0	0	105.3
137	N	33.3	Very low	37.4	Very low	138 Å²	138	128.6 Å²	128.6	74%	0.738	66%	0.657	S	S	*	*	S	Bend	trans	163.8	-15.6	150	-78.2	-13.4	0	0	0	113.6	Y139	N137-Y139 PolarHBondContact O-N 3.11Å
138	N	36	Very low	38	Very low	135 Å²	135	124.6 Å²	124.6	72%	0.722	64%	0.64	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.1	9.8	-178.8	-132.4	-5.1	0	0	0	115.4	N142	N138-N142 PolarHBondContact O-ND2 3.22Å
139	Y	32.6	Very low	38.8	Very low	199 Å²	199	124.8 Å²	124.8	78%	0.78	64%	0.637	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107.6	-15	174.2	-123.6	-94.3	0	0	0	113	N137 Q143	N137-Y139 PolarHBondContact O-N 3.11Å; Y139-Q143 WeakPolarHBondContact O-CB 3.26Å; Y139-Q143 PolarHBondContact O-N 3.04Å
140	G	35.3	Very low	39.5	Very low	38 Å²	38	125.2 Å²	125.2	39%	0.392	63%	0.632	S	S	.	*	H	α-helix	trans	-77.8	-43.7	-178.2	0	0	0	0	0	113.4	Q143 W144	G140-Q143 PolarHBondContact O-N 3.23Å; G140-W144 PolarHBondContact O-N 2.89Å
141	D	39.9	Very low	40.2	Very low	105 Å²	105	124.2 Å²	124.2	56%	0.561	62%	0.62	S	S	*	*	H	α-helix	trans	-75.1	-33.1	-174.9	-67.8	-23.1	0	0	0	112.7	W144 N145	D141-W144 PolarHBondContact O-N 3.33Å; D141-N145 PolarHBondContact O-N 3.32Å; D141-N145 VanDerWaalsContact O-N 3.07Å; D141-N145 PolarHBondContact O-ND2 3.12Å
142	N	43.8	Very low	41.2	Very low	104 Å²	104	123.3 Å²	123.3	56%	0.556	61%	0.612	S	S	*	*	H	α-helix	trans	-72.1	-30.8	174.1	-64.8	-31.9	0	0	0	111.9	N138 L146	N138-N142 PolarHBondContact O-ND2 3.22Å; N142-L146 WeakPolarHBondContact O-CB 3.44Å; N142-L146 PolarHBondContact O-N 2.89Å
143	Q	39.5	Very low	42.3	Very low	119 Å²	119	121.6 Å²	121.6	56%	0.556	60%	0.602	S	S	*	*	H	α-helix	trans	-78.1	-32.5	175.6	-171.1	174.2	-40	0	0	112.1	Y139 G140 Q147	Y139-Q143 WeakPolarHBondContact O-CB 3.26Å; Y139-Q143 PolarHBondContact O-N 3.04Å; G140-Q143 PolarHBondContact O-N 3.23Å; Q143-Q147 WeakPolarHBondContact O-CB 3.5Å; Q143-Q147 VanDerWaalsContact O-CG 3.23Å; Q143-Q147 WeakPolarHBondContact O-CG 3.43Å; Q143-Q147 PolarHBondContact O-N 3.35Å
144	W	38.1	Very low	43.2	Very low	146 Å²	146	120.9 Å²	120.9	55%	0.553	59%	0.592	S	S	*	*	H	α-helix	trans	-66.7	-45	173.1	-111.9	115.9	0	0	0	112.1	G140 D141 L146 Q147 L148	G140-W144 PolarHBondContact O-N 2.89Å; D141-W144 PolarHBondContact O-N 3.33Å; W144-L146 VanDerWaalsContact C-N 3.33Å; W144-L146 PolarHBondContact O-N 3.38Å; W144-Q147 PolarHBondContact O-N 3.44Å; W144-L148 HydrophobicContact CE3-CD1 3.74Å; W144-L148 HydrophobicContact CE3-CG 3.96Å; W144-L148 HydrophobicContact CZ3-CD1 4.17Å; W144-L148 HydrophobicContact CZ3-CG 4.1Å; W144-L148 WeakPolarHBondContact O-CB 3.09Å; W144-L148 PolarHBondContact O-N 3.36Å
145	N	44.9	Very low	44.2	Very low	99 Å²	99	119 Å²	119	53%	0.529	58%	0.581	S	S	.	*	H	α-helix	trans	-64.6	-37.1	175.7	-74.4	-29.5	0	0	0	112.1	D141 Q149	D141-N145 PolarHBondContact O-N 3.32Å; D141-N145 VanDerWaalsContact O-N 3.07Å; D141-N145 PolarHBondContact O-ND2 3.12Å; N145-Q149 WeakPolarHBondContact O-CB 3.25Å; N145-Q149 PolarHBondContact O-N 3.44Å
146	L	50.3	Low	45.1	Very low	128 Å²	128	119.9 Å²	119.9	67%	0.67	57%	0.573	S	S	*	*	H	α-helix	trans	-69.8	-33.6	174.9	-143.1	80.5	0	0	0	112.8	N142 W144 K150	N142-L146 WeakPolarHBondContact O-CB 3.44Å; N142-L146 PolarHBondContact O-N 2.89Å; W144-L146 VanDerWaalsContact C-N 3.33Å; W144-L146 PolarHBondContact O-N 3.38Å; L146-K150 WeakPolarHBondContact O-CB 3.36Å; L146-K150 PolarHBondContact O-N 2.81Å; L146-K150 VanDerWaalsContact O-N 3.1Å
147	Q	48.7	Very low	46	Very low	95 Å²	95	117.5 Å²	117.5	44%	0.444	56%	0.561	S	S	.	*	H	α-helix	trans	-73.3	-36.7	175.6	-79	-83.4	-7.1	0	0	112.5	Q143 W144 K150 R151	Q143-Q147 WeakPolarHBondContact O-CB 3.5Å; Q143-Q147 VanDerWaalsContact O-CG 3.23Å; Q143-Q147 WeakPolarHBondContact O-CG 3.43Å; Q143-Q147 PolarHBondContact O-N 3.35Å; W144-Q147 PolarHBondContact O-N 3.44Å; Q147-K150 PolarHBondContact O-N 2.91Å; Q147-R151 WeakPolarHBondContact O-CG 3.44Å; Q147-R151 PolarHBondContact O-N 2.8Å
148	L	51.1	Low	46.9	Very low	67 Å²	67	115.8 Å²	115.8	35%	0.351	56%	0.556	S	S	.	*	H	α-helix	trans	-63.6	-46.9	173.1	-88	155.4	0	0	0	110.9	W144 K150 R151 E152	W144-L148 HydrophobicContact CE3-CD1 3.74Å; W144-L148 HydrophobicContact CE3-CG 3.96Å; W144-L148 HydrophobicContact CZ3-CD1 4.17Å; W144-L148 HydrophobicContact CZ3-CG 4.1Å; W144-L148 WeakPolarHBondContact O-CB 3.09Å; W144-L148 PolarHBondContact O-N 3.36Å; L148-K150 VanDerWaalsContact C-N 3.34Å; L148-K150 PolarHBondContact O-N 2.83Å; L148-R151 PolarHBondContact O-N 3.17Å; L148-R151 VanDerWaalsContact O-N 3.09Å; L148-E152 PolarHBondContact O-N 3.44Å
149	Q	53.7	Low	47.7	Very low	123 Å²	123	113 Å²	113	58%	0.575	54%	0.544	S	S	*	.	H	α-helix	trans	-64.2	-38.5	177.5	-163.7	141.1	6.3	0	0	112.3	N145 R151 E152 D153	N145-Q149 WeakPolarHBondContact O-CB 3.25Å; N145-Q149 PolarHBondContact O-N 3.44Å; Q149-R151 VanDerWaalsContact C-N 3.28Å; Q149-R151 PolarHBondContact O-N 3.05Å; Q149-E152 PolarHBondContact O-N 2.91Å; Q149-D153 WeakPolarHBondContact O-CB 3.39Å; Q149-D153 VanDerWaalsContact O-CG 3.31Å; Q149-D153 PolarHBondContact O-N 2.8Å
150	K	54.2	Low	48.6	Very low	148 Å²	148	110.4 Å²	110.4	64%	0.643	54%	0.536	S	S	*	.	H	α-helix	trans	-68.7	-23.6	175	-143.5	174.2	-168.4	176.2	0	113.4	L146 Q147 L148 K154	L146-K150 WeakPolarHBondContact O-CB 3.36Å; L146-K150 PolarHBondContact O-N 2.81Å; L146-K150 VanDerWaalsContact O-N 3.1Å; Q147-K150 PolarHBondContact O-N 2.91Å; L148-K150 VanDerWaalsContact C-N 3.34Å; L148-K150 PolarHBondContact O-N 2.83Å; K150-K154 PolarHBondContact O-N 3.38Å
151	R	52.2	Low	49.3	Very low	110 Å²	110	113.5 Å²	113.5	42%	0.415	54%	0.543	S	S	.	.	H	α-helix	trans	-82.7	-39.6	173.6	-81.5	-174.4	-161	-169.9	4.3	112.1	Q147 L148 Q149 D153 K154 L155	Q147-R151 WeakPolarHBondContact O-CG 3.44Å; Q147-R151 PolarHBondContact O-N 2.8Å; L148-R151 PolarHBondContact O-N 3.17Å; L148-R151 VanDerWaalsContact O-N 3.09Å; Q149-R151 VanDerWaalsContact C-N 3.28Å; Q149-R151 PolarHBondContact O-N 3.05Å; R151-D153 VanDerWaalsContact C-N 3.33Å; R151-K154 PolarHBondContact O-N 2.91Å; R151-L155 PolarHBondContact O-N 2.91Å
152	E	57.1	Low	49.7	Very low	113 Å²	113	114.4 Å²	114.4	53%	0.528	54%	0.543	S	S	.	.	H	α-helix	trans	-63.5	-39.3	173.5	-72.4	-174.7	168.2	0	0	111.7	L148 Q149 K154 L155 R156	L148-E152 PolarHBondContact O-N 3.44Å; Q149-E152 PolarHBondContact O-N 2.91Å; E152-K154 VanDerWaalsContact C-N 3.34Å; E152-K154 PolarHBondContact O-N 3.37Å; E152-L155 PolarHBondContact O-N 3.3Å; E152-R156 WeakPolarHBondContact O-CB 3.36Å; E152-R156 WeakPolarHBondContact O-CG 3.35Å; E152-R156 PolarHBondContact O-N 2.9Å
153	D	54.2	Low	49.7	Very low	87 Å²	87	113.6 Å²	113.6	47%	0.465	54%	0.539	S	S	.	.	H	α-helix	trans	-65.4	-35.4	174.6	-73.7	-21.3	0	0	0	112.5	Q149 R151 L157	Q149-D153 WeakPolarHBondContact O-CB 3.39Å; Q149-D153 VanDerWaalsContact O-CG 3.31Å; Q149-D153 PolarHBondContact O-N 2.8Å; R151-D153 VanDerWaalsContact C-N 3.33Å; D153-L157 WeakPolarHBondContact O-CB 3.4Å; D153-L157 PolarHBondContact O-N 3.03Å
154	K	50.5	Low	49.8	Very low	146 Å²	146	109.9 Å²	109.9	64%	0.635	53%	0.529	S	S	*	.	H	α-helix	trans	-68.9	-38.6	172.6	-83.1	-175.1	176.8	-173.3	0	112.1	K150 R151 E152 L157 V158	K150-K154 PolarHBondContact O-N 3.38Å; R151-K154 PolarHBondContact O-N 2.91Å; E152-K154 VanDerWaalsContact C-N 3.34Å; E152-K154 PolarHBondContact O-N 3.37Å; K154-L157 PolarHBondContact O-N 3.05Å; K154-V158 WeakPolarHBondContact O-CG2 3.43Å; K154-V158 PolarHBondContact O-N 2.95Å
155	L	50	Low	50.1	Low	93 Å²	93	109.8 Å²	109.8	49%	0.487	53%	0.534	S	S	.	.	H	α-helix	trans	-66.4	-41.4	177	-136.3	86.6	0	0	0	111	F98 R151 E152 L157 V158 T159	F98-L155 HydrophobicContact CE1-CD1 4.03Å; F98-L155 HydrophobicContact CZ-CD1 3.77Å; R151-L155 PolarHBondContact O-N 2.91Å; E152-L155 PolarHBondContact O-N 3.3Å; L155-L157 VanDerWaalsContact C-N 3.34Å; L155-V158 PolarHBondContact O-N 3.05Å; L155-T159 PolarHBondContact O-N 2.58Å; L155-T159 PolarHBondContact O-OG1 2.68Å
156	R	50.5	Low	49.9	Very low	174 Å²	174	110.7 Å²	110.7	66%	0.657	54%	0.535	S	S	*	.	H	α-helix	trans	-64	-35.7	172.2	-76.6	-178.4	177.1	173.5	1.9	112.6	E152 T159 F160	E152-R156 WeakPolarHBondContact O-CB 3.36Å; E152-R156 WeakPolarHBondContact O-CG 3.35Å; E152-R156 PolarHBondContact O-N 2.9Å; R156-T159 VanDerWaalsContact CA-OG1 3.32Å; R156-T159 WeakPolarHBondContact CA-OG1 3.24Å; R156-T159 PolarHBondContact O-OG1 3.18Å; R156-F160 WeakPolarHBondContact O-CB 3.31Å; R156-F160 PolarHBondContact O-N 3.36Å
157	L	49.6	Very low	49.3	Very low	101 Å²	101	110.5 Å²	110.5	53%	0.529	53%	0.534	S	S	.	.	H	α-helix	trans	-70.1	-37.7	176.1	-167.4	73.1	0	0	0	111.9	D153 K154 L155 F160 I161	D153-L157 WeakPolarHBondContact O-CB 3.4Å; D153-L157 PolarHBondContact O-N 3.03Å; K154-L157 PolarHBondContact O-N 3.05Å; L155-L157 VanDerWaalsContact C-N 3.34Å; L157-F160 PolarHBondContact O-N 2.98Å; L157-I161 HydrophobicContact CG-CD1 4Å; L157-I161 WeakPolarHBondContact O-CB 3.38Å; L157-I161 WeakPolarHBondContact O-CD1 3.15Å; L157-I161 WeakPolarHBondContact O-CG1 3.43Å; L157-I161 PolarHBondContact O-N 3.26Å
158	V	52.3	Low	48.8	Very low	102 Å²	102	110.1 Å²	110.1	62%	0.618	54%	0.542	S	S	*	.	H	α-helix	trans	-70.6	-41	176.9	173.2	0	0	0	0	111.3	K154 L155 I161 H162	K154-V158 WeakPolarHBondContact O-CG2 3.43Å; K154-V158 PolarHBondContact O-N 2.95Å; L155-V158 PolarHBondContact O-N 3.05Å; V158-I161 PolarHBondContact O-N 3.34Å; V158-H162 WeakPolarHBondContact O-CB 3.34Å; V158-H162 PolarHBondContact O-N 3.48Å
159	T	52.6	Low	48.2	Very low	77 Å²	77	112.4 Å²	112.4	47%	0.472	56%	0.559	S	S	.	*	H	α-helix	trans	-66.1	-40	171.5	26.6	0	0	0	0	111.5	L155 R156 I161 H162 D163	L155-T159 PolarHBondContact O-N 2.58Å; L155-T159 PolarHBondContact O-OG1 2.68Å; R156-T159 VanDerWaalsContact CA-OG1 3.32Å; R156-T159 WeakPolarHBondContact CA-OG1 3.24Å; R156-T159 PolarHBondContact O-OG1 3.18Å; T159-I161 PolarHBondContact O-N 3.2Å; T159-H162 PolarHBondContact O-N 3Å; T159-D163 VanDerWaalsContact O-CB 3.31Å; T159-D163 WeakPolarHBondContact O-CB 3.48Å; T159-D163 PolarHBondContact O-N 3.19Å
160	F	51.4	Low	47.2	Very low	143 Å²	143	112.5 Å²	112.5	63%	0.627	56%	0.564	S	S	*	*	H	α-helix	trans	-65.8	-34.3	174.6	-172.4	-95.6	0	0	0	113.1	R156 L157 A164	R156-F160 WeakPolarHBondContact O-CB 3.31Å; R156-F160 PolarHBondContact O-N 3.36Å; L157-F160 PolarHBondContact O-N 2.98Å; F160-A164 WeakPolarHBondContact O-CA 3.34Å; F160-A164 WeakPolarHBondContact O-CB 3.38Å; F160-A164 PolarHBondContact O-N 3.26Å
161	I	50.9	Low	46.2	Very low	103 Å²	103	111 Å²	111	53%	0.528	57%	0.566	S	S	.	*	H	α-helix	trans	-73.4	-35.8	175.3	-70.7	165.3	0	0	0	110.8	L157 V158 T159 H165	L157-I161 HydrophobicContact CG-CD1 4Å; L157-I161 WeakPolarHBondContact O-CB 3.38Å; L157-I161 WeakPolarHBondContact O-CD1 3.15Å; L157-I161 WeakPolarHBondContact O-CG1 3.43Å; L157-I161 PolarHBondContact O-N 3.26Å; V158-I161 PolarHBondContact O-N 3.34Å; T159-I161 PolarHBondContact O-N 3.2Å; I161-H165 VanDerWaalsContact O-CB 3.25Å; I161-H165 WeakPolarHBondContact O-CB 3.43Å; I161-H165 PolarHBondContact O-N 3.37Å
162	H	47.1	Very low	45.2	Very low	124 Å²	124	116.4 Å²	116.4	57%	0.574	59%	0.588	S	S	*	*	H	α-helix	trans	-66.8	-47.3	173.8	-166.1	-77.8	0	0	0	110.9	V158 T159 A164 H165 E166	V158-H162 WeakPolarHBondContact O-CB 3.34Å; V158-H162 PolarHBondContact O-N 3.48Å; T159-H162 PolarHBondContact O-N 3Å; H162-A164 PolarHBondContact O-N 3.22Å; H162-H165 PolarHBondContact O-N 3.27Å; H162-E166 IonicContact CE1-OE2 3Å; H162-E166 IonicContact ND1-OE2 2.98Å; H162-E166 PolarHBondContact O-N 3.36Å
163	D	44.6	Very low	44	Very low	87 Å²	87	115.9 Å²	115.9	47%	0.465	60%	0.598	S	S	.	*	H	α-helix	trans	-68.2	-31.8	177.1	-66.2	-10.4	0	0	0	112	T159 L167	T159-D163 VanDerWaalsContact O-CB 3.31Å; T159-D163 WeakPolarHBondContact O-CB 3.48Å; T159-D163 PolarHBondContact O-N 3.19Å; D163-L167 VanDerWaalsContact O-CB 3.31Å; D163-L167 WeakPolarHBondContact O-CB 3.22Å; D163-L167 PolarHBondContact O-N 3.43Å
164	A	42.7	Very low	43	Very low	41 Å²	41	119.5 Å²	119.5	34%	0.339	62%	0.617	S	S	.	*	H	α-helix	trans	-77.8	-22.4	174.2	0	0	0	0	0	113.3	F160 H162 S168	F160-A164 WeakPolarHBondContact O-CA 3.34Å; F160-A164 WeakPolarHBondContact O-CB 3.38Å; F160-A164 PolarHBondContact O-N 3.26Å; H162-A164 PolarHBondContact O-N 3.22Å; A164-S168 VanDerWaalsContact O-CB 3.28Å; A164-S168 WeakPolarHBondContact O-CB 3.4Å; A164-S168 PolarHBondContact O-N 2.79Å; A164-S168 PolarHBondContact O-OG 3.5Å
165	H	42.6	Very low	42.2	Very low	144 Å²	144	117.2 Å²	117.2	67%	0.667	62%	0.619	S	S	*	*	H	α-helix	trans	-79	-28.6	171.7	-164.7	-85.6	0	0	0	111.1	I161 H162 S168	I161-H165 VanDerWaalsContact O-CB 3.25Å; I161-H165 WeakPolarHBondContact O-CB 3.43Å; I161-H165 PolarHBondContact O-N 3.37Å; H162-H165 PolarHBondContact O-N 3.27Å; H165-S168 PolarHBondContact O-OG 3.31Å
166	E	41.8	Very low	41.3	Very low	118 Å²	118	117 Å²	117	55%	0.551	62%	0.622	S	S	*	*	H	α-helix	trans	-76.7	-35.8	164.9	-94.2	176.1	140.5	0	0	112.6	H162 S168 T169	H162-E166 IonicContact CE1-OE2 3Å; H162-E166 IonicContact ND1-OE2 2.98Å; H162-E166 PolarHBondContact O-N 3.36Å; E166-S168 PolarHBondContact O-N 3.39Å; E166-T169 PolarHBondContact O-OG1 2.89Å; E166-T169 VanDerWaalsContact O-OG1 3.07Å
167	L	37.2	Very low	40.2	Very low	124 Å²	124	114.2 Å²	114.2	65%	0.649	63%	0.629	S	S	*	*	H	α-helix	trans	-78.1	-15.8	177.7	-113	75.1	0	0	0	114.8	D163 T169 V171	D163-L167 VanDerWaalsContact O-CB 3.31Å; D163-L167 WeakPolarHBondContact O-CB 3.22Å; D163-L167 PolarHBondContact O-N 3.43Å; L167-T169 VanDerWaalsContact C-N 3.32Å; L167-V171 WeakPolarHBondContact O-CG2 3.47Å
168	S	38.5	Very low	39.4	Very low	88 Å²	88	115.6 Å²	115.6	62%	0.615	64%	0.641	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.8	-3.2	177.1	49.5	0	0	0	0	113.5	A164 H165 E166	A164-S168 VanDerWaalsContact O-CB 3.28Å; A164-S168 WeakPolarHBondContact O-CB 3.4Å; A164-S168 PolarHBondContact O-N 2.79Å; A164-S168 PolarHBondContact O-OG 3.5Å; H165-S168 PolarHBondContact O-OG 3.31Å; E166-S168 PolarHBondContact O-N 3.39Å
169	T	37.6	Very low	38.3	Very low	114 Å²	114	119.2 Å²	119.2	70%	0.699	65%	0.651	S	S	*	*	S	Bend	trans	-98.9	-0	169.9	38.5	0	0	0	0	113.7	E166 L167	E166-T169 PolarHBondContact O-OG1 2.89Å; E166-T169 VanDerWaalsContact O-OG1 3.07Å; L167-T169 VanDerWaalsContact C-N 3.32Å
170	D	32.7	Very low	37.3	Very low	125 Å²	125	121.6 Å²	121.6	67%	0.668	67%	0.665	S	S	*	*	S	Bend	trans	-123.9	12.4	-176	-87.6	-24.2	0	0	0	116
171	V	34.1	Very low	36.5	Very low	116 Å²	116	120.7 Å²	120.7	70%	0.703	67%	0.667	S	S	*	*			trans	-112.1	63.8	177.9	-172.2	0	0	0	0	111.3	L167	L167-V171 WeakPolarHBondContact O-CG2 3.47Å
172	Y	31.8	Very low	35.8	Very low	224 Å²	224	121.8 Å²	121.8	88%	0.878	68%	0.684	S	S	*	*	S	Bend	trans	-157.4	55.6	159.5	-124.1	-81.5	0	0	0	111.1
173	S	31.9	Very low	35.6	Very low	103 Å²	103	120.9 Å²	120.9	72%	0.72	69%	0.687	S	S	*	*			trans	-153.2	56.9	178.4	54.7	0	0	0	0	112.6
174	D	32.7	Very low	35.3	Very low	163 Å²	163	122.9 Å²	122.9	87%	0.872	70%	0.698	S	S	*	*			trans	-94.9	126.7	164.2	-134.8	-11.1	0	0	0	111
175	S	33.3	Very low	35	Very low	98 Å²	98	128.4 Å²	128.4	69%	0.685	72%	0.718	S	S	*	*	S	Bend	trans	80.3	80.7	172.3	75.2	0	0	0	0	119.1
176	T	32.3	Very low	34.9	Very low	89 Å²	89	129.1 Å²	129.1	55%	0.546	72%	0.72	S	S	.	*				174.9	118.3	101.8	28.3	0	0	0	0	113.1	V178 R699	T176-V178 PolarHBondContact O-N 3.19Å; T176-R699 VanDerWaalsContact OG1-CZ 3.31Å; T176-R699 PolarHBondContact OG1-NH1 2.92Å; T176-R699 PolarHBondContact OG1-NH2 3.43Å
177	S	27.3	Very low	34.8	Very low	115 Å²	115	131.9 Å²	131.9	80%	0.804	73%	0.726	S	S	*	*			trans	-30.2	116.5	168.3	58.9	0	0	0	0	116.6
178	V	31.1	Very low	34.9	Very low	129 Å²	129	132.1 Å²	132.1	78%	0.782	73%	0.728	S	S	*	*			trans	-147.9	119.6	143.4	-177.2	0	0	0	0	109.1	T176	T176-V178 PolarHBondContact O-N 3.19Å
179	H	29.3	Very low	35.1	Very low	178 Å²	178	132.9 Å²	132.9	82%	0.824	72%	0.721	S	S	*	*			trans	-38.9	125	164.6	-125.1	-85.9	0	0	0	112.9
180	V	33.3	Very low	35.3	Very low	128 Å²	128	132.2 Å²	132.2	78%	0.776	71%	0.714	S	S	*	*			trans	-135.6	131.6	162.6	-178.3	0	0	0	0	109.6
181	D	32.8	Very low	35.6	Very low	123 Å²	123	134.7 Å²	134.7	66%	0.658	71%	0.714	S	S	*	*			trans	-68.1	153.2	-164.9	-81.1	-47.2	0	0	0	117	T183	D181-T183 PolarHBondContact O-N 2.92Å
182	S	36.4	Very low	36.1	Very low	126 Å²	126	133.7 Å²	133.7	88%	0.881	71%	0.708	S	S	*	*	T	Hydrogen-bonded Turn	trans	-54.7	39.2	176.7	-178.3	0	0	0	0	118
183	T	43.6	Very low	36.3	Very low	106 Å²	106	130.9 Å²	130.9	65%	0.65	70%	0.696	S	S	*	*	T	Hydrogen-bonded Turn	trans	-119.6	-12.4	-173.4	1	0	0	0	0	116.5	D181	D181-T183 PolarHBondContact O-N 2.92Å
184	D	38	Very low	36.7	Very low	128 Å²	128	132.8 Å²	132.8	68%	0.684	70%	0.697	S	S	*	*	S	Bend	trans	-99.9	-6.6	-175.7	-68.7	-32.1	0	0	0	114.5
185	M	37.5	Very low	37.1	Very low	157 Å²	157	131.3 Å²	131.3	77%	0.773	69%	0.688	S	S	*	*	H	α-helix	trans	-79.8	-11.7	176.4	-97	-91.8	-70.1	0	0	114.4
186	K	40.8	Very low	37.3	Very low	159 Å²	159	133.3 Å²	133.3	69%	0.691	69%	0.691	S	S	*	*	H	α-helix	trans	-89.3	-18.2	-178	-160.6	172.1	-178.8	-177.8	0	113.7
187	Y	38.1	Very low	37.5	Very low	176 Å²	176	137.2 Å²	137.2	69%	0.69	70%	0.703	S	S	*	*	H	α-helix	trans	-85.6	-27	-176.7	-170.7	-104.2	0	0	0	113.3
188	L	39	Very low	37.9	Very low	130 Å²	130	140 Å²	140	68%	0.681	70%	0.703	S	S	*	*	H	α-helix	trans	-84.4	-22.3	175.3	-86.3	155.9	0	0	0	112.8	T192	L188-T192 PolarHBondContact O-OG1 3.39Å
189	E	42.9	Very low	38.1	Very low	103 Å²	103	141.2 Å²	141.2	48%	0.481	71%	0.705	S	S	.	*	H	α-helix	trans	-82.2	-30.7	176.8	-147.3	-177.8	154.3	0	0	112.8	R191 R193	E189-R191 VanDerWaalsContact C-N 3.34Å; E189-R193 IonicContact OE1-CZ 2.64Å; E189-R193 IonicContact OE1-NH2 2.69Å; E189-R193 PolarHBondContact OE1-NH2 2.93Å
190	D	42.9	Very low	38.3	Very low	100 Å²	100	140.1 Å²	140.1	54%	0.535	71%	0.705	S	S	.	*	H	α-helix	trans	-73.2	-24	175.2	-92.9	-9.7	0	0	0	113.1
191	R	39.6	Very low	38.3	Very low	177 Å²	177	141.5 Å²	141.5	67%	0.668	71%	0.708	S	S	*	*	H	α-helix	trans	-83.6	-20.6	-178.1	-146.1	174.5	172.6	177.7	-3.3	113.6	E189	E189-R191 VanDerWaalsContact C-N 3.34Å
192	T	43.1	Very low	38.2	Very low	96 Å²	96	144.2 Å²	144.2	59%	0.589	72%	0.721	S	S	*	*	H	α-helix	trans	-89.8	-17.3	177.5	-46.2	0	0	0	0	112.1	L188	L188-T192 PolarHBondContact O-OG1 3.39Å
193	R	37	Very low	38.1	Very low	165 Å²	165	143 Å²	143	62%	0.623	71%	0.712	S	S	*	*	H	α-helix	trans	-85.1	-15.2	173.5	-69.3	-175	-170.2	-169.4	7.1	114.3	E189	E189-R193 IonicContact OE1-CZ 2.64Å; E189-R193 IonicContact OE1-NH2 2.69Å; E189-R193 PolarHBondContact OE1-NH2 2.93Å
194	L	39	Very low	37.8	Very low	142 Å²	142	142.2 Å²	142.2	74%	0.743	71%	0.711	S	S	*	*	S	Bend	trans	-90.7	-4.7	-179.3	-103.6	142.6	0	0	0	114.6
195	I	41	Very low	37.6	Very low	132 Å²	132	142.7 Å²	142.7	68%	0.677	71%	0.714	S	S	*	*	S	Bend	trans	-104.7	-13.5	-178.2	-64.2	174.7	0	0	0	112.2
196	N	37.8	Very low	37.5	Very low	140 Å²	140	142.1 Å²	142.1	75%	0.749	71%	0.709	S	S	*	*	S	Bend	trans	-105	25.1	-178.6	-73.3	-17.4	0	0	0	114.3
197	Q	36.8	Very low	37.4	Very low	172 Å²	172	142.3 Å²	142.3	80%	0.804	71%	0.713	S	S	*	*	S	Bend	trans	-128.1	17.3	-179.2	-117.4	-178.9	0.3	0	0	113.6
198	H	35.6	Very low	37.3	Very low	173 Å²	173	142.5 Å²	142.5	80%	0.801	72%	0.72	S	S	*	*	S	Bend	trans	-129.7	25.8	-173.8	-129.4	54.5	0	0	0	115.1
199	D	35.3	Very low	37.1	Very low	155 Å²	155	139.6 Å²	139.6	83%	0.829	72%	0.721	S	S	*	*	S	Bend	trans	-155.4	67.1	172	-83.9	-43.2	0	0	0	109.1
200	D	34.2	Very low	36.7	Very low	154 Å²	154	142.4 Å²	142.4	82%	0.824	74%	0.74	S	S	*	*	S	Bend	trans	-166	134.8	159.5	-88.1	-34.5	0	0	0	109.1
201	N	33.2	Very low	36.5	Very low	157 Å²	157	142.8 Å²	142.8	84%	0.84	75%	0.747	S	S	*	*			trans	92.2	57.7	172.7	-48.6	-30	0	0	0	117.6
202	I	30.6	Very low	36.2	Very low	180 Å²	180	140.2 Å²	140.2	92%	0.923	76%	0.757	S	S	*	*			trans	-101.4	93.3	142.4	-63.6	175.2	0	0	0	107.1
203	S	34.8	Very low	35.9	Very low	100 Å²	100	139.3 Å²	139.3	70%	0.699	77%	0.767	S	S	*	*			trans	-170.9	118.3	163.6	178	0	0	0	0	110.8
204	S	35.7	Very low	35.9	Very low	90 Å²	90	139.6 Å²	139.6	63%	0.629	78%	0.775	S	S	*	*			trans	66.2	113.8	146.9	59.2	0	0	0	0	121.6
205	N	35.3	Very low	35.8	Very low	138 Å²	138	138.7 Å²	138.7	74%	0.738	77%	0.771	S	S	*	*				59.7	144	124	-58.9	11.8	0	0	0	118.9
206	E	35.6	Very low	35.6	Very low	145 Å²	145	137.9 Å²	137.9	68%	0.678	77%	0.768	S	S	*	*			cis	-173	156.6	2.2	-112.5	163	173	0	0	104.8
207	E	37.4	Very low	35.5	Very low	164 Å²	164	139.3 Å²	139.3	77%	0.766	77%	0.767	S	S	*	*			trans	58.8	146.4	151.8	-62.5	174.9	174.2	0	0	119.6
208	E	36.5	Very low	35.5	Very low	180 Å²	180	137.9 Å²	137.9	84%	0.841	77%	0.765	S	S	*	*			cis	-170.8	162.2	-1.8	-118.9	-171.7	163.6	0	0	105.5
209	G	34.4	Very low	35.5	Very low	69 Å²	69	133.9 Å²	133.9	71%	0.711	76%	0.756	S	S	*	*			trans	121.9	62.6	147.4	0	0	0	0	0	120
210	N	35.6	Very low	35.5	Very low	162 Å²	162	132.9 Å²	132.9	87%	0.866	75%	0.751	S	S	*	*				66.9	152.2	125.8	-86.1	-9.7	0	0	0	124.7
211	P	39	Very low	35.5	Very low	107 Å²	107	132.6 Å²	132.6	70%	0.695	75%	0.749	S	S	*	*			trans	-132.9	-169.9	-142.8	36.4	-13.2	0	0	0	114.3
212	S	32.8	Very low	35.6	Very low	124 Å²	124	134.6 Å²	134.6	87%	0.867	75%	0.75	S	S	*	*			trans	128.1	139	137.4	72.3	0	0	0	0	118.3
213	G	36.4	Very low	35.7	Very low	77 Å²	77	131.3 Å²	131.3	79%	0.794	74%	0.744	S	S	*	*			trans	101.1	130.1	163.1	0	0	0	0	0	115.1
214	E	37.4	Very low	35.3	Very low	171 Å²	171	134 Å²	134	80%	0.799	75%	0.75	S	S	*	*			cis	-173.1	131.7	4.8	-163.6	176.1	174	0	0	109.8
215	N	36	Very low	35.2	Very low	123 Å²	123	139.3 Å²	139.3	66%	0.658	77%	0.765	S	S	*	*			trans	44.6	129.1	140.7	-54.2	-24.9	0	0	0	125
216	D	36.7	Very low	34.7	Very low	115 Å²	115	140.3 Å²	140.3	62%	0.615	77%	0.77	S	S	*	*				120.7	123	108.6	-97.2	0.1	0	0	0	121
217	K	37.3	Very low	34.5	Very low	169 Å²	169	141.6 Å²	141.6	74%	0.735	78%	0.776	S	S	*	*			trans	76.7	138.7	139.4	-70.5	170.4	-179.7	136.3	0	118.2
218	L	35.6	Very low	34.2	Very low	143 Å²	143	140.6 Å²	140.6	75%	0.749	77%	0.772	S	S	*	*			cis	-170.9	139.5	15.9	-159.7	72.5	0	0	0	110.6
219	S	36.5	Very low	34	Very low	89 Å²	89	141 Å²	141	62%	0.622	77%	0.77	S	S	*	*			trans	51	144.7	144.3	81.1	0	0	0	0	121.6
220	N	35.3	Very low	33.5	Very low	134 Å²	134	143 Å²	143	72%	0.717	77%	0.774	S	S	*	*			cis	-171.7	128.8	31.8	-121.7	-17.5	0	0	0	112
221	N	33.3	Very low	33.5	Very low	147 Å²	147	140.5 Å²	140.5	79%	0.786	77%	0.769	S	S	*	*			trans	41.5	117.1	133.8	-68.2	-21.9	0	0	0	124.6
222	K	35.1	Very low	33	Very low	199 Å²	199	141.3 Å²	141.3	87%	0.865	77%	0.772	S	S	*	*				171.1	98.8	105.9	-106.7	177.8	174.4	174.7	0	110.3
223	S	32.1	Very low	32.8	Very low	112 Å²	112	142.9 Å²	142.9	78%	0.783	77%	0.77	S	S	*	*				98.2	100.6	90.5	82.6	0	0	0	0	113.9
224	N	27.5	Very low	32.4	Very low	157 Å²	157	146.2 Å²	146.2	84%	0.84	77%	0.769	S	S	*	*			trans	-63	154.5	164.5	-71.2	-29.1	0	0	0	112.7
225	Q	32.9	Very low	32.1	Very low	201 Å²	201	143.8 Å²	143.8	94%	0.939	77%	0.766	S	S	*	*				-142.8	106.3	128.4	-97.2	-176.3	7.2	0	0	108.7
226	N	26.2	Very low	31.9	Very low	158 Å²	158	144.1 Å²	144.1	85%	0.845	77%	0.773	S	S	*	*			trans	-141.4	110.4	165.9	-126.9	6.5	0	0	0	105.1
227	E	30.9	Very low	31.6	Very low	172 Å²	172	148.2 Å²	148.2	80%	0.804	79%	0.785	S	S	*	*			trans	-171.9	134.9	165.5	-99.1	-167	130.9	0	0	103.5
228	Q	30.9	Very low	31.6	Very low	144 Å²	144	144.8 Å²	144.8	67%	0.673	79%	0.789	S	S	*	*			cis	-174	158	39	-126.3	167.5	20.1	0	0	110.1
229	K	31.6	Very low	31.6	Very low	188 Å²	188	145.2 Å²	145.2	82%	0.817	79%	0.792	S	S	*	*			trans	86.1	91.7	150.6	-81.2	174.8	173.2	173.5	0	120.4
230	S	25.2	Very low	31.5	Very low	112 Å²	112	146.7 Å²	146.7	78%	0.783	80%	0.799	S	S	*	*			trans	-52	139	138.3	-175.1	0	0	0	0	112.2
231	S	33.9	Very low	31.5	Very low	109 Å²	109	147.2 Å²	147.2	76%	0.762	81%	0.807	S	S	*	*			trans	-128.5	106.6	153.3	57	0	0	0	0	108.6
232	T	28.9	Very low	31.6	Very low	124 Å²	124	145.9 Å²	145.9	76%	0.761	81%	0.805	S	S	*	*			trans	-46.2	128.3	160.5	26.3	0	0	0	0	111.6
233	L	30.1	Very low	31.4	Very low	157 Å²	157	141.9 Å²	141.9	82%	0.822	80%	0.799	S	S	*	*			trans	-122.1	101.6	164.5	-120.6	163.6	0	0	0	108.4	V235	L233-V235 PolarHBondContact O-N 2.95Å
234	N	26.4	Very low	31.4	Very low	146 Å²	146	145 Å²	145	78%	0.781	81%	0.806	S	S	*	*			trans	-61.4	119.2	166.9	-73.8	-20.7	0	0	0	108.9
235	V	32.2	Very low	31.4	Very low	121 Å²	121	143.2 Å²	143.2	73%	0.733	80%	0.801	S	S	*	*			trans	-111.9	101.2	162	-179.7	0	0	0	0	107.9	L233 F237	L233-V235 PolarHBondContact O-N 2.95Å; V235-F237 PolarHBondContact O-N 3.29Å
236	T	31.1	Very low	31.3	Very low	130 Å²	130	143 Å²	143	80%	0.798	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-64.3	120.5	171.5	-41.3	0	0	0	0	109.2	A238	T236-A238 PolarHBondContact O-N 3.3Å
237	F	31	Very low	31.6	Very low	200 Å²	200	144.4 Å²	144.4	88%	0.877	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-68.9	122.1	171.7	-83.9	-91.7	0	0	0	110.2	V235	V235-F237 PolarHBondContact O-N 3.29Å
238	A	37.5	Very low	31.5	Very low	98 Å²	98	142.6 Å²	142.6	81%	0.81	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-80.6	140	167.4	0	0	0	0	0	110.6	T236	T236-A238 PolarHBondContact O-N 3.3Å
239	N	34.3	Very low	31.6	Very low	151 Å²	151	141.6 Å²	141.6	81%	0.807	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-48.3	147.2	-169.6	-66.5	-35	0	0	0	117.2
240	P	34.7	Very low	31.5	Very low	121 Å²	121	139.4 Å²	139.4	79%	0.786	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-82.4	131.2	165.5	32.4	-28.5	0	0	0	111.1
241	V	36.7	Very low	31.8	Very low	144 Å²	144	139.3 Å²	139.3	87%	0.873	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-72	129.5	173	175.6	0	0	0	0	110.4
242	T	34.4	Very low	31.6	Very low	120 Å²	120	140 Å²	140	74%	0.736	78%	0.78	S	S	*	*	P	Polyproline II helix	trans	-62.7	140.4	179.9	-27.6	0	0	0	0	113.4
243	P	31.4	Very low	31.6	Very low	115 Å²	115	139.9 Å²	139.9	75%	0.747	78%	0.775	S	S	*	*	P	Polyproline II helix	trans	-95.6	122.7	161.7	32.2	-23.2	0	0	0	110.6
244	L	31.1	Very low	31.4	Very low	177 Å²	177	139.8 Å²	139.8	93%	0.927	78%	0.775	S	S	*	*	P	Polyproline II helix	trans	-79.6	128.2	169.3	-89	161	0	0	0	110.3
245	T	28.3	Very low	31.7	Very low	119 Å²	119	136.1 Å²	136.1	73%	0.73	77%	0.772	S	S	*	*			trans	-106.1	148.3	170.8	44.1	0	0	0	0	111.9
246	K	29.9	Very low	31.5	Very low	197 Å²	197	137.6 Å²	137.6	86%	0.857	78%	0.776	S	S	*	*			trans	83	113.9	154.2	-72.9	175.7	175.8	-177.9	0	119.3
247	Q	32.8	Very low	31.4	Very low	187 Å²	187	138 Å²	138	87%	0.874	77%	0.771	S	S	*	*				-171.5	112	106.5	-121.3	167.2	-30.8	0	0	107.9
248	N	29.6	Very low	31.4	Very low	134 Å²	134	136 Å²	136	72%	0.717	76%	0.764	S	S	*	*				54.3	102.5	94.1	-104.9	47.4	0	0	0	113.5
249	D	33.6	Very low	31	Very low	124 Å²	124	137 Å²	137	66%	0.663	76%	0.756	S	S	*	*				154.2	125	105.8	-77.8	-20.6	0	0	0	112
250	N	29	Very low	31.2	Very low	142 Å²	142	137.7 Å²	137.7	76%	0.759	76%	0.758	S	S	*	*			trans	72.1	121.6	134	-76.9	-11.1	0	0	0	122.3
251	V	30.7	Very low	31	Very low	109 Å²	109	138.1 Å²	138.1	66%	0.661	75%	0.753	S	S	*	*				98.5	103.1	120.3	168.5	0	0	0	0	116.6
252	D	28.9	Very low	30.7	Very low	124 Å²	124	138 Å²	138	66%	0.663	75%	0.747	S	S	*	*				86	123.4	126.3	-70.2	1.3	0	0	0	122.6
253	N	29	Very low	30.7	Very low	122 Å²	122	139.7 Å²	139.7	65%	0.652	75%	0.752	S	S	*	*				83.3	114.7	126.7	-75.4	-28.3	0	0	0	120.6
254	N	26.9	Very low	30.8	Very low	155 Å²	155	141.1 Å²	141.1	83%	0.829	75%	0.751	S	S	*	*				61.9	133.9	125.7	-70.8	-19.7	0	0	0	120.6
255	G	31.8	Very low	30.8	Very low	69 Å²	69	142.1 Å²	142.1	71%	0.711	75%	0.748	S	S	*	*			trans	125.5	82.3	160.2	0	0	0	0	0	112
256	N	28.2	Very low	30.9	Very low	152 Å²	152	141.2 Å²	141.2	81%	0.813	75%	0.747	S	S	*	*				62.6	131.8	79.7	-132.4	12.9	0	0	0	113.4
257	I	29.2	Very low	31.1	Very low	138 Å²	138	140.8 Å²	140.8	71%	0.708	75%	0.747	S	S	*	*			trans	97.4	100.2	148.1	-59.8	164.7	0	0	0	118.5
258	H	30.4	Very low	31	Very low	157 Å²	157	138.7 Å²	138.7	73%	0.727	74%	0.742	S	S	*	*				72.4	138.1	120	-112.9	-54.9	0	0	0	123.3
259	N	31.1	Very low	30.9	Very low	120 Å²	120	139.3 Å²	139.3	64%	0.642	75%	0.746	S	S	*	*			trans	74.9	131.8	153.8	-62.3	-28.6	0	0	0	115.6
260	I	36.6	Very low	30.9	Very low	165 Å²	165	140.2 Å²	140.2	85%	0.846	75%	0.749	S	S	*	*				-151	136.6	64.7	-77.4	157.1	0	0	0	111.6
261	I	31.3	Very low	31	Very low	131 Å²	131	141.9 Å²	141.9	67%	0.672	75%	0.752	S	S	*	*			trans	-103	147.6	173.9	-84.7	172.9	0	0	0	107.6
262	N	30	Very low	31	Very low	142 Å²	142	141.4 Å²	141.4	76%	0.759	75%	0.754	S	S	*	*			trans	68	118.7	158.8	-65.9	-18	0	0	0	120
263	D	35.3	Very low	31.3	Very low	155 Å²	155	144.2 Å²	144.2	83%	0.829	76%	0.763	S	S	*	*			trans	178.5	129.6	142.8	-96.9	-12.2	0	0	0	106.1
264	I	33.9	Very low	31.5	Very low	145 Å²	145	147.5 Å²	147.5	74%	0.744	77%	0.774	S	S	*	*			cis	-159.1	138.6	25.3	-89.1	142.1	0	0	0	108.4
265	K	30.5	Very low	31.9	Very low	197 Å²	197	143.6 Å²	143.6	86%	0.857	77%	0.771	S	S	*	*			trans	-86.7	152.6	166.3	-127.9	174.9	-175.5	176.5	0	108.4
266	S	30.2	Very low	32.1	Very low	101 Å²	101	150 Å²	150	71%	0.706	78%	0.782	S	S	*	*			trans	91	107.8	167.6	80	0	0	0	0	117.1
267	H	34.8	Very low	32.3	Very low	187 Å²	187	146.3 Å²	146.3	87%	0.866	78%	0.78	S	S	*	*				-164.5	121.4	119.1	-111.7	-80.6	0	0	0	109.8
268	N	29.7	Very low	32.4	Very low	143 Å²	143	152.1 Å²	152.1	77%	0.765	79%	0.793	S	S	*	*			trans	-85.1	154.2	172.3	-83.6	-23	0	0	0	110.4
269	N	27.6	Very low	32.4	Very low	147 Å²	147	152.8 Å²	152.8	79%	0.786	79%	0.794	S	S	*	*			trans	89.9	142.4	150.8	-63	-14.7	0	0	0	120.2
270	I	33.1	Very low	32.6	Very low	144 Å²	144	155.2 Å²	155.2	74%	0.738	81%	0.805	S	S	*	*			trans	100.5	94.4	158.8	-59	159.6	0	0	0	113.3
271	E	32.5	Very low	32.4	Very low	176 Å²	176	152 Å²	152	82%	0.822	79%	0.788	S	S	*	*				76.5	145	104.7	-72.4	-178.1	153.7	0	0	112.5
272	S	29.2	Very low	32.8	Very low	99 Å²	99	153.8 Å²	153.8	69%	0.692	80%	0.798	S	S	*	*			cis	-175.6	176.2	-7.1	-89.3	0	0	0	0	106.1
273	E	36.2	Very low	33	Very low	183 Å²	183	153.7 Å²	153.7	86%	0.855	80%	0.797	S	S	*	*			trans	90.3	139.8	167.3	-60	-168.2	164.6	0	0	118.6
274	E	33.2	Very low	32.9	Very low	191 Å²	191	151.9 Å²	151.9	89%	0.893	79%	0.794	S	S	*	*			cis	-178.2	153.6	-37.9	-121.4	-171	175.1	0	0	105.8
275	G	34.6	Very low	33	Very low	73 Å²	73	150.3 Å²	150.3	75%	0.753	80%	0.796	S	S	*	*			trans	167.7	67.5	171.6	0	0	0	0	0	116.7
276	E	35.7	Very low	33.1	Very low	203 Å²	203	147.4 Å²	147.4	95%	0.949	79%	0.79	S	S	*	*			trans	26	140.1	147.3	-71.8	-179.4	130.9	0	0	122.2
277	G	33	Very low	33.4	Very low	75 Å²	75	149.7 Å²	149.7	77%	0.773	79%	0.789	S	S	*	*			cis	175.6	-177.5	10.8	0	0	0	0	0	117.9
278	R	32.4	Very low	33.3	Very low	260 Å²	260	146.5 Å²	146.5	98%	0.981	78%	0.778	S	S	*	*			trans	79.4	100.3	171.7	-75.3	-174.1	-163.4	-171.8	6	120.7
279	K	30.1	Very low	33.4	Very low	171 Å²	171	146 Å²	146	74%	0.743	78%	0.776	S	S	*	*			trans	-118.4	146.8	161.5	-162.3	179.4	-178.6	-167.5	0	108	I281	K279-I281 HydrophobicContact CD-CD1 3.92Å; K279-I281 HydrophobicContact CD-CG1 3.69Å; K279-I281 HydrophobicContact CG-CG1 3.95Å
280	I	35.9	Very low	33.7	Very low	171 Å²	171	146.8 Å²	146.8	88%	0.877	78%	0.78	S	S	*	*			trans	-118.5	124.8	153.6	-64.8	179.6	0	0	0	106.7
281	I	32.4	Very low	33.5	Very low	97 Å²	97	148.5 Å²	148.5	50%	0.497	79%	0.785	S	S	.	*			trans	-101.6	154.1	179.3	-65.1	167.5	0	0	0	107.8	K279	K279-I281 HydrophobicContact CD-CD1 3.92Å; K279-I281 HydrophobicContact CD-CG1 3.69Å; K279-I281 HydrophobicContact CG-CG1 3.95Å
282	I	38.3	Very low	33.5	Very low	170 Å²	170	148 Å²	148	87%	0.872	79%	0.786	S	S	*	*			trans	-154.2	138.8	131	-87	143.3	0	0	0	108.3
283	D	33.6	Very low	33.4	Very low	139 Å²	139	152.3 Å²	152.3	74%	0.743	79%	0.792	S	S	*	*			trans	-68.6	164.4	-159.2	-73.5	-53.3	0	0	0	119.8
284	P	34.9	Very low	33.3	Very low	118 Å²	118	150.7 Å²	150.7	77%	0.766	80%	0.795	S	S	*	*			trans	-107	152.4	160.6	37.8	-26.1	0	0	0	113
285	S	34.4	Very low	33	Very low	111 Å²	111	149 Å²	149	78%	0.776	79%	0.792	S	S	*	*			trans	-159.1	139.8	150.3	54.5	0	0	0	0	114.4
286	N	33.5	Very low	32.7	Very low	137 Å²	137	153.1 Å²	153.1	73%	0.733	80%	0.797	S	S	*	*			trans	87.3	104.4	144.8	-78.7	-2.5	0	0	0	123.6
287	H	35.9	Very low	32.5	Very low	149 Å²	149	148.9 Å²	148.9	69%	0.69	79%	0.79	S	S	*	*				94.2	118.6	115	-92.1	-56.4	0	0	0	121.9
288	N	34.3	Very low	32.3	Very low	120 Å²	120	152.7 Å²	152.7	64%	0.642	79%	0.792	S	S	*	*			trans	85.4	105.4	134.7	-70.8	-10.5	0	0	0	121.3
289	N	30.9	Very low	32.3	Very low	133 Å²	133	150.3 Å²	150.3	71%	0.711	78%	0.783	S	S	*	*				48	108.8	118.4	-59.5	-5.5	0	0	0	118.8
290	N	34.3	Very low	32.3	Very low	162 Å²	162	151.5 Å²	151.5	87%	0.866	78%	0.783	S	S	*	*				177.4	140	102.9	-87.5	-21.5	0	0	0	111.5
291	E	28.4	Very low	32.1	Very low	181 Å²	181	149.1 Å²	149.1	85%	0.846	77%	0.772	S	S	*	*			trans	-56.5	147.8	175.2	-67.6	172.4	113.9	0	0	113.1
292	I	32	Very low	32	Very low	166 Å²	166	153.1 Å²	153.1	85%	0.851	79%	0.786	S	S	*	*				179.1	133.3	109.7	-84.8	155	0	0	0	109.7
293	K	28.4	Very low	31.6	Very low	189 Å²	189	154.1 Å²	154.1	82%	0.822	79%	0.789	S	S	*	*			trans	-39.1	140.3	176.1	-67.8	161.9	173.6	170.1	0	115.2
294	T	32.8	Very low	31.3	Very low	149 Å²	149	155.9 Å²	155.9	91%	0.914	79%	0.79	S	S	*	*				-175.9	149.5	120	24.6	0	0	0	0	112.4
295	N	28	Very low	30.9	Very low	154 Å²	154	158.4 Å²	158.4	82%	0.824	80%	0.796	S	S	*	*			trans	-68.2	163	-167.1	-79.5	-28.2	0	0	0	116.5
296	N	27.4	Very low	30.7	Very low	160 Å²	160	160.6 Å²	160.6	86%	0.856	80%	0.795	S	S	*	*			trans	78.4	106	158.5	-70.2	-12.8	0	0	0	118.2
297	S	32.8	Very low	30.4	Very low	114 Å²	114	162.6 Å²	162.6	80%	0.797	80%	0.804	S	S	*	*			trans	-178.3	122.1	133.2	174.6	0	0	0	0	111.6	R299	S297-R299 PolarHBondContact O-N 2.92Å
298	N	28.3	Very low	30.1	Very low	155 Å²	155	160.6 Å²	160.6	83%	0.829	81%	0.807	S	S	*	*			trans	-41.3	131.9	155.3	-82.3	-39.1	0	0	0	112.6
299	R	32.3	Very low	29.9	Very low	211 Å²	211	158.1 Å²	158.1	80%	0.796	81%	0.81	S	S	*	*			trans	-176	116.9	138.6	-108.4	175.2	-174	-170.8	3.9	113.2	S297	S297-R299 PolarHBondContact O-N 2.92Å
300	R	30	Very low	29.8	Very low	195 Å²	195	159.2 Å²	159.2	74%	0.736	81%	0.814	S	S	*	*				58.2	119.8	122.7	-81.8	-175.9	-169.1	170.8	5.1	120.1
301	N	30.6	Very low	29.6	Very low	121 Å²	121	159.8 Å²	159.8	65%	0.647	82%	0.817	S	S	*	*				108.1	118.5	109.5	-78.8	-7.7	0	0	0	119.4
302	K	30	Very low	29.8	Very low	181 Å²	181	157.9 Å²	157.9	79%	0.787	81%	0.811	S	S	*	*				67	125	129.1	-78.3	179.1	170.4	176.7	0	118.7
303	M	30.1	Very low	29.5	Very low	191 Å²	191	155.2 Å²	155.2	94%	0.941	81%	0.806	S	S	*	*				-147	126.8	112.2	-130.2	165.3	177.4	0	0	111.8
304	K	27.2	Very low	29.8	Very low	176 Å²	176	154.1 Å²	154.1	77%	0.765	81%	0.809	S	S	*	*			trans	-83.7	151.1	169.4	-101.7	179.6	171	-175.8	0	108.4
305	L	27.9	Very low	29.6	Very low	171 Å²	171	150 Å²	150	90%	0.895	80%	0.796	S	S	*	*			trans	-145.2	125.8	143.1	-114.9	135.4	0	0	0	109.9
306	Q	28.7	Very low	29.9	Very low	158 Å²	158	151 Å²	151	74%	0.738	80%	0.802	S	S	*	*			trans	-79.8	154.4	173.5	-79.3	-160.8	-48.9	0	0	110.6
307	L	28.8	Very low	30.1	Very low	178 Å²	178	150.7 Å²	150.7	93%	0.932	80%	0.8	S	S	*	*			trans	-141	127.3	142.4	-138.7	76.5	0	0	0	109.5
308	S	28.9	Very low	30.2	Very low	108 Å²	108	153.9 Å²	153.9	76%	0.755	80%	0.802	S	S	*	*			trans	-101.3	150.1	178.8	53.6	0	0	0	0	111.2
309	G	29.5	Very low	30.4	Very low	68 Å²	68	151.3 Å²	151.3	70%	0.701	80%	0.796	S	S	*	*			trans	142.4	112	148.5	0	0	0	0	0	114.5
310	I	28.7	Very low	30.5	Very low	156 Å²	156	146.3 Å²	146.3	80%	0.8	79%	0.793	S	S	*	*				175.2	113.9	125.4	-81.5	150.6	0	0	0	106.6	I312	I310-I312 HydrophobicContact CG2-CG1 4.36Å
311	N	30.5	Very low	30.6	Very low	173 Å²	173	143.7 Å²	143.7	93%	0.925	79%	0.794	S	S	*	*			trans	-137.8	133.8	161.5	-112	-5	0	0	0	107.7
312	I	32.4	Very low	30.9	Very low	142 Å²	142	145.4 Å²	145.4	73%	0.728	80%	0.798	S	S	*	*			trans	-106.9	131.6	-170.1	-68.9	174.8	0	0	0	109.6	I310	I310-I312 HydrophobicContact CG2-CG1 4.36Å
313	C	26.4	Very low	31.2	Very low	109 Å²	109	141.8 Å²	141.8	74%	0.736	79%	0.787	S	S	*	*			trans	42	119.6	154.6	-58.2	0	0	0	0	121.5
314	N	33.8	Very low	31.4	Very low	166 Å²	166	142.7 Å²	142.7	89%	0.888	78%	0.78	S	S	*	*				-178.2	139	99.1	-104.3	-5.6	0	0	0	111.3
315	G	30.1	Very low	31.6	Very low	63 Å²	63	141.1 Å²	141.1	65%	0.649	78%	0.78	S	S	*	*			trans	-82.8	158.1	179.2	0	0	0	0	0	113.9
316	N	34.4	Very low	32	Very low	175 Å²	175	140.8 Å²	140.8	94%	0.936	77%	0.774	S	S	*	*			trans	-169.5	140.6	130.7	-96.6	-17.4	0	0	0	111.2
317	N	29.9	Very low	32.4	Very low	153 Å²	153	138.3 Å²	138.3	82%	0.818	77%	0.769	S	S	*	*			trans	-81.6	171.2	-176	-77.1	-33.8	0	0	0	113.8
318	H	35.9	Very low	32.8	Very low	182 Å²	182	136.5 Å²	136.5	84%	0.843	76%	0.759	S	S	*	*			trans	105.8	109.5	165.5	-72.8	-76.7	0	0	0	114.3
319	S	33.1	Very low	33.1	Very low	100 Å²	100	137.7 Å²	137.7	70%	0.699	76%	0.757	S	S	*	*			cis	95.4	128.3	43.1	178.7	0	0	0	0	113.4
320	S	34	Very low	33.5	Very low	106 Å²	106	142.2 Å²	142.2	74%	0.741	77%	0.765	S	S	*	*			trans	79.1	150.1	157.7	77.7	0	0	0	0	117.8
321	N	32.7	Very low	34	Very low	141 Å²	141	142.4 Å²	142.4	75%	0.754	76%	0.762	S	S	*	*			cis	177.4	165.4	-28.9	-115.9	-4.8	0	0	0	105.5
322	H	36.8	Very low	34.4	Very low	156 Å²	156	140.7 Å²	140.7	72%	0.722	75%	0.753	S	S	*	*			trans	76.6	147.2	163	-66.7	-64.8	0	0	0	118.5
323	D	35.9	Very low	34.7	Very low	105 Å²	105	139.9 Å²	139.9	56%	0.561	75%	0.75	S	S	*	*			cis	-171	146.7	-8.7	-113.3	-28.4	0	0	0	109.7
324	R	33.8	Very low	35.3	Very low	211 Å²	211	142.5 Å²	142.5	80%	0.796	75%	0.751	S	S	*	*			trans	44.5	122.9	136.1	-61.9	174.6	-156.4	-168.2	-2.1	125.3
325	N	31.4	Very low	35.5	Very low	142 Å²	142	138.5 Å²	138.5	76%	0.759	74%	0.736	S	S	*	*				48	151.1	117.3	-73.2	0.8	0	0	0	126.3
326	H	37.5	Very low	35.9	Very low	165 Å²	165	142.1 Å²	142.1	76%	0.764	74%	0.741	S	S	*	*			trans	91.7	138.4	157.4	-70.6	-69.2	0	0	0	116
327	T	35.6	Very low	36	Very low	105 Å²	105	138.9 Å²	138.9	64%	0.644	73%	0.727	S	S	*	*			cis	179.7	158.1	12.1	14.3	0	0	0	0	112.4
328	I	37.3	Very low	36.3	Very low	141 Å²	141	138 Å²	138	72%	0.723	72%	0.723	S	S	*	*			trans	86.1	114.3	139.6	-65.4	155.9	0	0	0	121.9
329	D	34.7	Very low	36.4	Very low	133 Å²	133	135.8 Å²	135.8	71%	0.711	72%	0.717	S	S	*	*			trans	0.8	144.2	141.3	-49.7	-48.4	0	0	0	122.1
330	D	38.1	Very low	36.3	Very low	162 Å²	162	138.1 Å²	138.1	87%	0.866	72%	0.722	S	S	*	*				-165.2	155.8	120.7	-107.9	-29.9	0	0	0	115.3
331	H	40.5	Very low	36.5	Very low	160 Å²	160	140 Å²	140	74%	0.741	72%	0.723	S	S	*	*			trans	-88.9	171.3	-157.2	-99.9	-86.2	0	0	0	118.1
332	N	38.5	Very low	36.8	Very low	138 Å²	138	139.5 Å²	139.5	74%	0.738	72%	0.721	S	S	*	*			trans	95.4	149.5	146.3	-67.2	-31.4	0	0	0	119.4
333	N	38.4	Very low	36.6	Very low	124 Å²	124	138.4 Å²	138.4	66%	0.663	72%	0.72	S	S	*	*			cis	179.8	155.4	-35.1	-137	-11.7	0	0	0	105.9
334	H	39.4	Very low	36.7	Very low	164 Å²	164	140.3 Å²	140.3	76%	0.759	73%	0.731	S	S	*	*			trans	70.5	153.4	162.8	-73	-60.1	0	0	0	120.1
335	S	38.4	Very low	36.8	Very low	82 Å²	82	136.6 Å²	136.6	57%	0.573	73%	0.727	S	S	*	*			cis	176.8	141.8	-45.3	47.2	0	0	0	0	106.6
336	N	37.2	Very low	37.1	Very low	140 Å²	140	134.2 Å²	134.2	75%	0.749	72%	0.721	S	S	*	*			trans	79.8	117.1	145.8	-78.7	-0	0	0	0	123
337	T	37.7	Very low	36.9	Very low	106 Å²	106	132.3 Å²	132.3	65%	0.65	72%	0.716	S	S	*	*				89.5	114	119.7	55.1	0	0	0	0	122.1
338	N	36.6	Very low	36.9	Very low	135 Å²	135	133.9 Å²	133.9	72%	0.722	72%	0.721	S	S	*	*				82.1	123.3	120.4	-70.4	-2.7	0	0	0	122.6
339	N	36.5	Very low	36.8	Very low	136 Å²	136	131.3 Å²	131.3	73%	0.727	72%	0.715	S	S	*	*			trans	84.8	109.7	132.9	-70.4	-8.7	0	0	0	120.9
340	N	32.4	Very low	36.7	Very low	149 Å²	149	131.6 Å²	131.6	80%	0.797	72%	0.717	S	S	*	*			trans	39.7	112.8	131.5	-73.6	-4.7	0	0	0	120
341	D	38.3	Very low	36.6	Very low	144 Å²	144	130 Å²	130	77%	0.77	71%	0.708	S	S	*	*			trans	-154.7	116.5	138.7	-92.2	-40.2	0	0	0	107.7
342	N	37.5	Very low	36.3	Very low	131 Å²	131	127.3 Å²	127.3	70%	0.701	70%	0.703	S	S	*	*				68.6	117.9	93.8	-82.2	-39.7	0	0	0	115.5
343	N	34	Very low	36	Very low	133 Å²	133	126.1 Å²	126.1	71%	0.711	70%	0.697	S	S	*	*			trans	42	120.3	139.2	-70.1	-20.8	0	0	0	118.9
344	N	38	Very low	35.8	Very low	145 Å²	145	127.9 Å²	127.9	78%	0.775	70%	0.699	S	S	*	*				173.3	121.4	109.8	-87.3	-38.1	0	0	0	109
345	N	35	Very low	35.5	Very low	134 Å²	134	126.8 Å²	126.8	72%	0.717	70%	0.699	S	S	*	*				96.8	143.6	70.6	-142.8	0.1	0	0	0	110.5
346	S	37	Very low	35.4	Very low	92 Å²	92	129.6 Å²	129.6	64%	0.643	71%	0.707	S	S	*	*			trans	77.5	140.7	161.5	-63.1	0	0	0	0	117.9
347	N	33.7	Very low	35	Very low	124 Å²	124	129.8 Å²	129.8	66%	0.663	71%	0.707	S	S	*	*			cis	175.3	165	-16.3	-110.5	-30.8	0	0	0	104.4
348	N	35.2	Very low	34.7	Very low	139 Å²	139	132.2 Å²	132.2	74%	0.743	71%	0.712	S	S	*	*			trans	76.9	136.2	152.6	-69.1	-10.6	0	0	0	116.2
349	S	35.4	Very low	34.2	Very low	86 Å²	86	133.2 Å²	133.2	60%	0.601	72%	0.715	S	S	*	*			cis	-174.7	143.3	18.2	28.9	0	0	0	0	108.9
350	N	34.1	Very low	33.8	Very low	140 Å²	140	135.1 Å²	135.1	75%	0.749	72%	0.722	S	S	*	*			trans	65.8	130	133.7	-54.7	-10.7	0	0	0	116.9
351	N	34.6	Very low	33.5	Very low	127 Å²	127	137.3 Å²	137.3	68%	0.679	72%	0.724	S	S	*	*				-176	141	51.9	-130.7	-0.2	0	0	0	109.8
352	T	34	Very low	33.2	Very low	104 Å²	104	134.7 Å²	134.7	64%	0.638	72%	0.722	S	S	*	*			trans	57.9	142.6	133.6	53.1	0	0	0	0	119.8
353	D	33.4	Very low	32.8	Very low	114 Å²	114	134.5 Å²	134.5	61%	0.61	72%	0.722	S	S	*	*			cis	179.6	153.2	-7.7	-117.7	-7.6	0	0	0	105
354	K	33.1	Very low	32.5	Very low	160 Å²	160	134.1 Å²	134.1	70%	0.696	72%	0.72	S	S	*	*			trans	54.8	119.8	141.8	-63	175.7	-178.9	111.4	0	120.3
355	N	34.4	Very low	32.1	Very low	142 Å²	142	133.8 Å²	133.8	76%	0.759	72%	0.722	S	S	*	*				177.4	108.6	116.9	-79.7	-20.2	0	0	0	106.8
356	D	35	Very low	31.6	Very low	140 Å²	140	135.4 Å²	135.4	75%	0.749	72%	0.72	S	S	*	*				59.6	106.1	91.4	-74.5	-25.2	0	0	0	112.2
357	L	28.3	Very low	31.1	Very low	144 Å²	144	139.5 Å²	139.5	75%	0.754	73%	0.726	S	S	*	*				93.2	146.7	84.5	-162.6	76.5	0	0	0	111
358	Q	32.5	Very low	30.7	Very low	158 Å²	158	137.6 Å²	137.6	74%	0.738	72%	0.719	S	S	*	*			trans	94.2	105.4	165.5	-50.3	-169.7	16.2	0	0	115
359	I	26.3	Very low	30.3	Very low	155 Å²	155	139.2 Å²	139.2	80%	0.795	72%	0.72	S	S	*	*				58.6	101.9	81.1	-58.8	168.8	0	0	0	111.4
360	M	27.4	Very low	29.8	Very low	176 Å²	176	141 Å²	141	87%	0.867	72%	0.723	S	S	*	*			trans	-167.7	94.2	144.1	-103.7	173.8	-179.2	0	0	106.8
361	K	27.1	Very low	29.5	Very low	195 Å²	195	141.6 Å²	141.6	85%	0.848	73%	0.726	S	S	*	*				-21.8	110.6	102.7	-86.7	-177.6	173	177.3	0	112.8
362	A	31.4	Very low	29.2	Very low	89 Å²	89	141.5 Å²	141.5	74%	0.736	73%	0.729	S	S	*	*			trans	-127.7	97.2	158	0	0	0	0	0	106.7
363	D	28.1	Very low	28.8	Very low	128 Å²	128	141.6 Å²	141.6	68%	0.684	72%	0.721	S	S	*	*			trans	-60.9	156.8	157	-64.7	-51.6	0	0	0	109.6
364	D	27.8	Very low	28.6	Very low	125 Å²	125	141.5 Å²	141.5	67%	0.668	73%	0.727	S	S	*	*			trans	58.1	93.3	154.7	-62.6	-27.3	0	0	0	119.5
365	V	30.1	Very low	28.2	Very low	137 Å²	137	137 Å²	137	83%	0.83	72%	0.715	S	S	*	*			trans	-132.9	97.5	132.7	-175.8	0	0	0	0	109.9	F367	V365-F367 PolarHBondContact O-N 2.86Å
366	Y	25.6	Very low	28	Very low	169 Å²	169	136.3 Å²	136.3	66%	0.663	71%	0.711	S	S	*	*			trans	-49.4	120.4	159.6	-80.1	-107.2	0	0	0	111.5	T368	Y366-T368 HydrophobicContact CD1-CG2 3.69Å; Y366-T368 HydrophobicContact CE1-CG2 4.18Å
367	F	24.7	Very low	27.6	Very low	177 Å²	177	133.9 Å²	133.9	78%	0.776	71%	0.705	S	S	*	*			trans	-113.9	69.1	140.6	-105.1	-80.7	0	0	0	108.7	V365 F369	V365-F367 PolarHBondContact O-N 2.86Å; F367-F369 HydrophobicContact CD1-CD2 4.25Å; F367-F369 HydrophobicContact CD1-CE2 4.32Å; F367-F369 PolarHBondContact O-N 3.16Å
368	T	26.1	Very low	27.7	Very low	84 Å²	84	136.9 Å²	136.9	52%	0.515	71%	0.712	S	S	.	*			trans	-62.3	100.5	153.7	38.6	0	0	0	0	108.3	Y366 N370	Y366-T368 HydrophobicContact CD1-CG2 3.69Å; Y366-T368 HydrophobicContact CE1-CG2 4.18Å; T368-N370 PolarHBondContact O-N 2.78Å
369	F	26.2	Very low	27.6	Very low	173 Å²	173	135.9 Å²	135.9	76%	0.759	71%	0.712	S	S	*	*			trans	-72.5	65	155.5	-111.6	-83.9	0	0	0	108.7	F367	F367-F369 HydrophobicContact CD1-CD2 4.25Å; F367-F369 HydrophobicContact CD1-CE2 4.32Å; F367-F369 PolarHBondContact O-N 3.16Å
370	N	26.5	Very low	27.7	Very low	125 Å²	125	137 Å²	137	67%	0.668	71%	0.714	S	S	*	*			trans	-82.1	133.8	161.4	-90.3	-29.3	0	0	0	108	T368	T368-N370 PolarHBondContact O-N 2.78Å
371	N	26.4	Very low	27.9	Very low	151 Å²	151	136.8 Å²	136.8	81%	0.807	71%	0.71	S	S	*	*			trans	91	60.4	173.6	-56.5	-42.3	0	0	0	118.3
372	V	29.3	Very low	28	Very low	125 Å²	125	133 Å²	133	76%	0.758	70%	0.703	S	S	*	*			trans	-121.5	101.7	137.7	-174.3	0	0	0	0	108.8
373	K	26.1	Very low	28	Very low	106 Å²	106	133.5 Å²	133.5	46%	0.461	70%	0.701	S	S	.	*			trans	-54	129.3	-179	-77.7	174.3	172.7	178.4	0	111.7	C375 K423	K373-C375 PolarHBondContact O-N 2.92Å; K373-K423 HydrophobicContact CD-CG 4.25Å
374	P	27.5	Very low	27.9	Very low	113 Å²	113	138.3 Å²	138.3	73%	0.734	71%	0.71	S	S	*	*			trans	-75.5	107.7	149.4	29.8	-25.2	0	0	0	107.7
375	C	26	Very low	28.1	Very low	66 Å²	66	140 Å²	140	45%	0.446	72%	0.718	S	S	.	*			trans	-75.6	129.3	151	-72.4	0	0	0	0	105.6	K373	K373-C375 PolarHBondContact O-N 2.92Å
376	N	30.1	Very low	28.2	Very low	126 Å²	126	142.7 Å²	142.7	67%	0.674	72%	0.718	S	S	*	*			cis	-149.4	130.9	15	-75.1	-38.7	0	0	0	106
377	S	26.7	Very low	28.3	Very low	90 Å²	90	142.4 Å²	142.4	63%	0.629	73%	0.728	S	S	*	*				40	87.7	102.6	178.1	0	0	0	0	114
378	F	29.7	Very low	28.7	Very low	206 Å²	206	139.7 Å²	139.7	90%	0.904	73%	0.731	S	S	*	*			trans	-125.6	101.7	141.6	-114.1	-89.9	0	0	0	107.3	H380	F378-H380 PolarHBondContact O-N 2.94Å
379	N	29.8	Very low	28.9	Very low	138 Å²	138	140.4 Å²	140.4	74%	0.738	74%	0.739	S	S	*	*			trans	-62.8	127	170.3	-84.6	-22.3	0	0	0	108.5	H381	N379-H381 PolarHBondContact O-N 3.28Å; N379-H381 VanDerWaalsContact O-N 3.11Å
380	H	28.8	Very low	29.3	Very low	177 Å²	177	139.2 Å²	139.2	82%	0.819	74%	0.741	S	S	*	*			trans	-55.1	108.1	156.1	-100.5	-97.3	0	0	0	108.6	F378	F378-H380 PolarHBondContact O-N 2.94Å
381	H	31.5	Very low	29.5	Very low	172 Å²	172	139 Å²	139	80%	0.796	74%	0.743	S	S	*	*			trans	-101.3	97.2	152.5	-121.8	-69.8	0	0	0	106.9	N379 S383	N379-H381 PolarHBondContact O-N 3.28Å; N379-H381 VanDerWaalsContact O-N 3.11Å; H381-S383 PolarHBondContact O-N 3.37Å
382	V	28.7	Very low	29.9	Very low	116 Å²	116	139.6 Å²	139.6	70%	0.703	75%	0.745	S	S	*	*			trans	-75.1	113.2	161.3	172.1	0	0	0	0	106.1
383	S	32.5	Very low	30	Very low	99 Å²	99	141.5 Å²	141.5	69%	0.692	75%	0.746	S	S	*	*			trans	-137.6	105.2	160.1	55.2	0	0	0	0	108.6	H381	H381-S383 PolarHBondContact O-N 3.37Å
384	R	26	Very low	30.4	Very low	229 Å²	229	144.2 Å²	144.2	86%	0.864	77%	0.765	S	S	*	*			trans	-45.6	144	161.3	-67.4	172	-178.4	169.4	-0.4	110.5
385	I	32.6	Very low	30.5	Very low	162 Å²	162	141.7 Å²	141.7	83%	0.831	76%	0.759	S	S	*	*			trans	-168.3	99.1	138.2	-83.8	134.3	0	0	0	104
386	K	31.7	Very low	30.9	Very low	193 Å²	193	150 Å²	150	84%	0.839	78%	0.783	S	S	*	*				60.8	117.4	89.9	-96.8	-171	176	-173.7	0	113.9
387	D	27.4	Very low	30.8	Very low	163 Å²	163	151.6 Å²	151.6	87%	0.872	79%	0.792	S	S	*	*			trans	-43.5	138.2	165.8	-57.6	-60.6	0	0	0	112.6
388	S	34.3	Very low	31.2	Very low	120 Å²	120	153 Å²	153	84%	0.839	80%	0.802	S	S	*	*			trans	-167.3	118.2	134.1	-126.6	0	0	0	0	110.4
389	S	29.7	Very low	31.3	Very low	99 Å²	99	149.2 Å²	149.2	69%	0.692	80%	0.795	S	S	*	*			trans	-51.2	139.2	155.5	-39	0	0	0	0	110.4
390	D	34.5	Very low	31.3	Very low	148 Å²	148	154.6 Å²	154.6	79%	0.791	81%	0.805	S	S	*	*				173.5	119.6	121.3	-81.6	-22.8	0	0	0	112.4
391	V	31.1	Very low	31.4	Very low	119 Å²	119	157.4 Å²	157.4	72%	0.721	81%	0.809	S	S	*	*				37.9	126.4	129.4	-162.2	0	0	0	0	118.6
392	I	34.1	Very low	31.7	Very low	165 Å²	165	154 Å²	154	85%	0.846	80%	0.802	S	S	*	*				-177.1	130.5	111.7	-85.2	161	0	0	0	110.7
393	Q	31.6	Very low	31.9	Very low	164 Å²	164	155.7 Å²	155.7	77%	0.766	81%	0.807	S	S	*	*			trans	-71.1	158.3	175	-74.3	166.1	-57.1	0	0	114.1
394	N	33.5	Very low	32.2	Very low	164 Å²	164	158 Å²	158	88%	0.877	81%	0.812	S	S	*	*			trans	143.8	131.8	137.7	-78	-14.4	0	0	0	107.9
395	G	31.4	Very low	32.7	Very low	59 Å²	59	155.3 Å²	155.3	61%	0.608	81%	0.806	S	S	*	*			cis	148	148.4	14.6	0	0	0	0	0	106.8
396	Y	33.2	Very low	32.8	Very low	241 Å²	241	154.1 Å²	154.1	95%	0.945	80%	0.801	S	S	*	*			trans	98.7	108.4	164.7	-69.8	-85	0	0	0	121.2
397	N	29	Very low	32.9	Very low	160 Å²	160	153.9 Å²	153.9	86%	0.856	80%	0.8	S	S	*	*			trans	-53.6	149.6	157.7	-66.1	-37.9	0	0	0	113.4
398	S	34.9	Very low	32.9	Very low	120 Å²	120	151.3 Å²	151.3	84%	0.839	79%	0.794	S	S	*	*				-173.2	141.9	116.1	-163	0	0	0	0	112.7
399	T	30.2	Very low	32.9	Very low	125 Å²	125	153 Å²	153	77%	0.767	79%	0.793	S	S	*	*			trans	-68.3	138.9	178.6	41.5	0	0	0	0	115.5
400	R	31.7	Very low	32.9	Very low	251 Å²	251	152.9 Å²	152.9	95%	0.947	80%	0.797	S	S	*	*				172.7	134	125.6	-104.2	178.2	178.2	174.4	-0.2	113.2
401	R	30	Very low	33	Very low	237 Å²	237	152.7 Å²	152.7	89%	0.894	80%	0.795	S	S	*	*			trans	-75.9	-178.9	164	-88.5	-174.4	-179.7	-173.3	0.7	111.2
402	P	38.3	Very low	33.2	Very low	99 Å²	99	156.2 Å²	156.2	64%	0.643	80%	0.801	S	S	*	*			cis	-137.6	-170.1	-38.2	37	-17.9	0	0	0	113.2
403	N	32.4	Very low	33.1	Very low	152 Å²	152	153 Å²	153	81%	0.813	80%	0.799	S	S	*	*			trans	76.5	114.8	162.6	-68.9	-9.8	0	0	0	118.5
404	N	38.6	Very low	33.3	Very low	149 Å²	149	155.5 Å²	155.5	80%	0.797	81%	0.807	S	S	*	*				-175	161.9	95	-139.7	-16.9	0	0	0	112.3
405	K	36.2	Very low	33.3	Very low	172 Å²	172	154.4 Å²	154.4	75%	0.748	80%	0.802	S	S	*	*			trans	-57.2	153.3	-172	-70.4	161.2	174	172	0	117.5
406	N	35.2	Very low	33.6	Very low	136 Å²	136	158.2 Å²	158.2	73%	0.727	81%	0.812	S	S	*	*			trans	82.3	127.1	136.7	-69.4	-10.2	0	0	0	122.2
407	K	33.8	Very low	33.4	Very low	188 Å²	188	153.2 Å²	153.2	82%	0.817	80%	0.802	S	S	*	*			trans	85.6	122.9	137.9	-79.3	176.8	178.1	178.7	0	119.5
408	C	26.4	Very low	33.8	Very low	109 Å²	109	151.8 Å²	151.8	74%	0.736	80%	0.799	S	S	*	*				99.8	134.7	126.8	-98.2	0	0	0	0	119.9
409	L	34.5	Very low	33.6	Very low	157 Å²	157	150.8 Å²	150.8	82%	0.822	79%	0.792	S	S	*	*			trans	104.1	107.5	140.6	-71.1	151.7	0	0	0	118.9
410	A	31.3	Very low	33.7	Very low	95 Å²	95	153.9 Å²	153.9	79%	0.785	80%	0.795	S	S	*	*			trans	-70.4	137.4	157.1	0	0	0	0	0	111.4
411	I	35.7	Very low	33.8	Very low	145 Å²	145	149 Å²	149	74%	0.744	79%	0.793	S	S	*	*			trans	-148.6	121.1	159.8	-68.8	-167.6	0	0	0	112.1
412	K	34.6	Very low	33.9	Very low	193 Å²	193	147.7 Å²	147.7	84%	0.839	79%	0.794	S	S	*	*			trans	63.4	108.9	144.1	-71.6	172.3	177.2	171.9	0	124
413	A	32.2	Very low	33.7	Very low	98 Å²	98	149 Å²	149	81%	0.81	79%	0.79	S	S	*	*				-4.7	140.6	129	0	0	0	0	0	121.2
414	K	35.7	Very low	33.5	Very low	215 Å²	215	150.3 Å²	150.3	94%	0.935	79%	0.788	S	S	*	*			trans	-133.4	128.4	144.3	-106	179.5	178.7	177.1	0	109.9
415	N	33.3	Very low	33.1	Very low	142 Å²	142	154.5 Å²	154.5	76%	0.759	79%	0.793	S	S	*	*			trans	-91.9	132.8	-176.5	-128.2	-11	0	0	0	109.8
416	V	38	Very low	32.9	Very low	138 Å²	138	155.9 Å²	155.9	84%	0.836	80%	0.804	S	S	*	*			trans	-140.8	113.9	156.7	176.7	0	0	0	0	108
417	N	29.8	Very low	32.6	Very low	137 Å²	137	155 Å²	155	73%	0.733	80%	0.804	S	S	*	*			trans	-87	134.4	174.2	-79.5	-33.7	0	0	0	110.2
418	T	36.2	Very low	32.6	Very low	130 Å²	130	151.9 Å²	151.9	80%	0.798	81%	0.806	S	S	*	*			trans	-163.1	95.4	143.7	24.4	0	0	0	0	111.4
419	S	32	Very low	32.7	Very low	98 Å²	98	151.6 Å²	151.6	69%	0.685	80%	0.804	S	S	*	*			trans	33.5	130.2	133.2	61.5	0	0	0	0	123.4
420	K	32.8	Very low	32.6	Very low	190 Å²	190	150.1 Å²	150.1	83%	0.826	81%	0.806	S	S	*	*			trans	86.5	104.8	143.9	-68.5	167.9	-178.2	178.3	0	118.7
421	T	33.8	Very low	32.6	Very low	149 Å²	149	148.6 Å²	148.6	91%	0.914	80%	0.799	S	S	*	*				-179.2	134	106.2	28.5	0	0	0	0	112.9
422	K	30.6	Very low	32.5	Very low	210 Å²	210	150.9 Å²	150.9	91%	0.913	81%	0.807	S	S	*	*			trans	-70	125.5	-178.4	-77.8	169.6	169.7	172	0	112.3
423	K	33.9	Very low	32.4	Very low	125 Å²	125	152.9 Å²	152.9	54%	0.543	81%	0.809	S	S	.	*			trans	-143.3	123.4	152.4	-117.1	176.4	-176.8	178.5	0	111.4	K373	K373-K423 HydrophobicContact CD-CG 4.25Å
424	K	29.8	Very low	32.4	Very low	180 Å²	180	154.3 Å²	154.3	78%	0.783	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-47.2	127.7	-173.8	-76.2	175.7	169.4	179.5	0	113.3
425	R	30.3	Very low	32.4	Very low	238 Å²	238	147.9 Å²	147.9	90%	0.898	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-95.1	126.4	163.4	-125.4	177.7	179.2	177.6	-0.7	107.6
426	M	30.9	Very low	32.5	Very low	200 Å²	200	146.9 Å²	146.9	99%	0.985	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-93.6	116.7	173.6	-150.2	143.4	115.2	0	0	108
427	T	29.2	Very low	32.5	Very low	118 Å²	118	146.1 Å²	146.1	72%	0.724	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-83.4	142.7	-176.4	43.1	0	0	0	0	111.9
428	S	34.3	Very low	32.7	Very low	123 Å²	123	146.6 Å²	146.6	86%	0.86	82%	0.818	S	S	*	*			trans	-141.2	75.5	158.8	165.8	0	0	0	0	105.8
429	C	29.2	Very low	32.7	Very low	103 Å²	103	149.6 Å²	149.6	70%	0.696	82%	0.823	S	S	*	*				74.5	79.2	85	-71.2	0	0	0	0	113.8
430	C	31.9	Very low	32.8	Very low	126 Å²	126	151 Å²	151	85%	0.851	83%	0.833	S	S	*	*			trans	-153.4	88.5	147.5	-100.1	0	0	0	0	107.7
431	G	31.3	Very low	33	Very low	63 Å²	63	145.2 Å²	145.2	65%	0.649	83%	0.827	S	S	*	*			trans	-121.4	131.2	168.5	0	0	0	0	0	108.5
432	E	32.7	Very low	33.2	Very low	193 Å²	193	143 Å²	143	90%	0.902	82%	0.817	S	S	*	*			trans	-68.5	137.7	-174.6	-65.1	165.8	144.2	0	0	112.2
433	R	33	Very low	33.6	Very low	235 Å²	235	141.9 Å²	141.9	89%	0.887	81%	0.813	S	S	*	*			trans	-161.1	129.1	147.1	-109.8	173.4	-166.3	-162.6	2	109.9
434	S	32.7	Very low	33.9	Very low	127 Å²	127	146 Å²	146	89%	0.888	83%	0.826	S	S	*	*			trans	-77	144.3	179.2	38.3	0	0	0	0	112
435	G	34.4	Very low	34.7	Very low	80 Å²	80	142.5 Å²	142.5	83%	0.825	82%	0.822	S	S	*	*			trans	175.9	114.4	172.2	0	0	0	0	0	110.1
436	S	35.2	Very low	35.6	Very low	122 Å²	122	137.4 Å²	137.4	85%	0.853	81%	0.812	S	S	*	*			trans	-76.6	167.2	-173.2	41.1	0	0	0	0	114.2
437	P	37.6	Very low	36.9	Very low	121 Å²	121	131 Å²	131	79%	0.786	79%	0.791	S	S	*	*			trans	-109.1	168.9	-148	40.6	-32.5	0	0	0	115.2
438	T	35.4	Very low	38.2	Very low	148 Å²	148	132 Å²	132	91%	0.908	79%	0.79	S	S	*	*			trans	-141.8	153.8	162.4	32.8	0	0	0	0	112.1
439	Q	35.1	Very low	38.9	Very low	192 Å²	192	133 Å²	133	90%	0.897	79%	0.786	S	S	*	*			trans	-81.4	160.9	-152.3	-64.2	158.5	-15.2	0	0	117
440	S	35	Very low	40	Very low	129 Å²	129	134 Å²	134	90%	0.902	78%	0.778	S	S	*	*				132.4	133.2	122	-164.6	0	0	0	0	115.4
441	G	36.6	Very low	40.3	Very low	68 Å²	68	131.1 Å²	131.1	70%	0.701	77%	0.77	S	S	*	*			trans	127.2	83	149.5	0	0	0	0	0	119.1
442	S	37.1	Very low	41.3	Very low	102 Å²	102	134.3 Å²	134.3	71%	0.713	77%	0.772	S	S	*	*			trans	45.4	109	135.9	-159.3	0	0	0	0	121.4
443	F	39.3	Very low	41.9	Very low	186 Å²	186	133.9 Å²	133.9	82%	0.816	77%	0.767	S	S	*	*				175.7	89.2	121.8	-108.3	-86.4	0	0	0	108.3
444	Y	41.8	Very low	42.2	Very low	211 Å²	211	128.5 Å²	128.5	83%	0.827	76%	0.762	S	S	*	*			trans	-128.4	100.2	179.7	-65.9	-89.6	0	0	0	109.5
445	P	45.3	Very low	42.5	Very low	107 Å²	107	133.6 Å²	133.6	70%	0.695	76%	0.762	S	S	*	*	S	Bend	trans	-148.6	17.1	148.4	29.3	-6.9	0	0	0	118.3
446	L	50	Low	42.8	Very low	132 Å²	132	136.6 Å²	136.6	69%	0.691	76%	0.764	S	S	*	*	S	Bend	trans	-110	-24.3	176.6	-112.1	150.1	0	0	0	114.8	I448	L446-I448 VanDerWaalsContact C-N 3.32Å; L446-I448 PolarHBondContact O-N 2.96Å
447	A	58.4	Low	42.6	Very low	65 Å²	65	135.8 Å²	135.8	54%	0.537	76%	0.759	S	S	.	*	T	Hydrogen-bonded Turn	trans	-73.9	-18.9	-177.2	0	0	0	0	0	114.3
448	I	56.4	Low	42.6	Very low	138 Å²	138	139.7 Å²	139.7	71%	0.708	76%	0.757	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.5	-25.7	-180	-67.1	172	0	0	0	111.7	L446 F450	L446-I448 VanDerWaalsContact C-N 3.32Å; L446-I448 PolarHBondContact O-N 2.96Å; I448-F450 PolarHBondContact O-N 2.68Å
449	L	48.3	Very low	42.6	Very low	146 Å²	146	142.3 Å²	142.3	76%	0.764	75%	0.751	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.3	-18.4	-176.7	-145	89.2	0	0	0	113.3
450	F	52.9	Low	43.1	Very low	124 Å²	124	139.8 Å²	139.8	54%	0.544	74%	0.739	S	S	.	*	T	Hydrogen-bonded Turn	trans	-110.1	18.2	-177.4	-72.1	-75.2	0	0	0	114.4	I448 D452 F543	I448-F450 PolarHBondContact O-N 2.68Å; F450-D452 PolarHBondContact O-N 3.45Å; F450-F543 HydrophobicContact CD1-CE2 4.49Å; F450-F543 HydrophobicContact CE1-CE2 4.21Å; F450-F543 HydrophobicContact CE1-CZ 4.16Å; F450-F543 HydrophobicContact CZ-CE1 4.48Å; F450-F543 HydrophobicContact CZ-CZ 4.24Å
451	G	38.2	Very low	43.9	Very low	65 Å²	65	137.6 Å²	137.6	67%	0.67	72%	0.723	S	S	*	*	T	Hydrogen-bonded Turn	trans	79.4	9	167.2	0	0	0	0	0	116.5	K453	G451-K453 PolarHBondContact O-N 2.97Å
452	D	52	Low	44.9	Very low	129 Å²	129	142.4 Å²	142.4	69%	0.69	72%	0.721	S	S	*	*			trans	-79.8	106.7	174.9	-86.2	-21.1	0	0	0	111	F450	F450-D452 PolarHBondContact O-N 3.45Å
453	K	44.7	Very low	46.1	Very low	184 Å²	184	143.3 Å²	143.3	80%	0.8	71%	0.712	S	S	*	*			trans	-74.5	122.9	162.7	-73.3	-177.7	-179.1	175.2	0	109	G451 R455	G451-K453 PolarHBondContact O-N 2.97Å; K453-R455 PolarHBondContact O-N 3.4Å
454	P	40.7	Very low	47	Very low	122 Å²	122	135.1 Å²	135.1	79%	0.792	68%	0.678	S	S	*	*			trans	-78.2	113.7	176.7	30.6	-30	0	0	0	109.4
455	R	38.2	Very low	47.8	Very low	235 Å²	235	133.5 Å²	133.5	89%	0.887	67%	0.67	S	S	*	*			trans	-116.3	107.2	163.1	-80	-173	172.8	147	-4.4	110	K453 S457	K453-R455 PolarHBondContact O-N 3.4Å; R455-S457 PolarHBondContact O-N 2.86Å
456	V	39.8	Very low	48.5	Very low	142 Å²	142	130 Å²	130	86%	0.861	65%	0.646	S	S	*	*			trans	-62.2	117.3	169.3	177.4	0	0	0	0	109.4
457	S	31.4	Very low	48.7	Very low	106 Å²	106	125.5 Å²	125.5	74%	0.741	62%	0.624	S	S	*	*			trans	161.6	85.6	132	75.8	0	0	0	0	113.5	R455	R455-S457 PolarHBondContact O-N 2.86Å
458	R	39	Very low	48.8	Very low	202 Å²	202	125.4 Å²	125.4	76%	0.762	61%	0.612	S	S	*	*	S	Bend	trans	-173.9	138.2	143.4	-109.6	176.8	-161.8	-159.1	5.3	105	E460	R458-E460 PolarHBondContact O-N 3Å
459	R	35.6	Very low	49.3	Very low	203 Å²	203	119.5 Å²	119.5	77%	0.766	59%	0.586	S	S	*	*			trans	-62.4	89.9	173.9	-68.4	179.6	-167.7	160.3	3.3	107.8	C461	R459-C461 PolarHBondContact O-N 3.37Å
460	E	45.5	Very low	50.6	Low	140 Å²	140	112.8 Å²	112.8	65%	0.654	55%	0.551	S	S	*	*			trans	-69.6	118.9	172.9	-82	178.1	153.8	0	0	107.3	R458 Y462	R458-E460 PolarHBondContact O-N 3Å; E460-Y462 PolarHBondContact O-N 2.93Å; E460-Y462 VanDerWaalsContact O-N 3.12Å
461	C	50.7	Low	51.7	Low	83 Å²	83	107.6 Å²	107.6	56%	0.561	53%	0.529	S	S	*	.			trans	-62.4	117.9	173.9	-156.2	0	0	0	0	107.1	R459 F463 N539	R459-C461 PolarHBondContact O-N 3.37Å; C461-F463 PolarHBondContact O-N 3.23Å; C461-F463 PolarHBondContact SG-O 3.3Å; C461-N539 PolarHBondContact O-ND2 3Å
462	Y	57.1	Low	53.8	Low	168 Å²	168	109.1 Å²	109.1	66%	0.659	52%	0.521	S	S	*	.	S	Bend	trans	-49.7	-33.6	-178.4	-71	-96.8	0	0	0	111.9	E460 N539 V540	E460-Y462 PolarHBondContact O-N 2.93Å; E460-Y462 VanDerWaalsContact O-N 3.12Å; Y462-N539 PolarHBondContact O-N 2.88Å; Y462-V540 VanDerWaalsContact CA-CG2 3.49Å; Y462-V540 HydrophobicContact CD1-CB 4.42Å; Y462-V540 HydrophobicContact CD1-CG1 4.29Å; Y462-V540 HydrophobicContact CD1-CG2 3.35Å; Y462-V540 HydrophobicContact CE1-CG2 4.26Å; Y462-V540 HydrophobicContact CG-CG2 3.89Å; Y462-V540 WeakPolarHBondContact O-CG2 3.37Å
463	F	62.9	Low	55.4	Low	122 Å²	122	107.9 Å²	107.9	54%	0.535	51%	0.507	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	126.6	172.5	-58.6	-82.1	0	0	0	109.3	C461 V536 F538	C461-F463 PolarHBondContact O-N 3.23Å; C461-F463 PolarHBondContact SG-O 3.3Å; F463-V536 HydrophobicContact CD1-CG1 3.64Å; F463-V536 HydrophobicContact CE1-CG1 4.35Å; F463-V536 HydrophobicContact CG-CG1 4.5Å; F463-F538 AromaticContact CD1-CD1 3.89Å; F463-F538 HydrophobicContact CD1-CD1 3.89Å; F463-F538 HydrophobicContact CD1-CE1 4.3Å; F463-F538 AromaticContact CE1-CD1 3.53Å; F463-F538 HydrophobicContact CE1-CD1 3.53Å; F463-F538 AromaticContact CE1-CE1 3.76Å; F463-F538 HydrophobicContact CE1-CE1 3.76Å
464	S	58.3	Low	57.2	Low	14 Å²	14	99.2 Å²	99.2	10%	0.098	47%	0.47	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	150.7	162.3	-73	0	0	0	0	109	V537 N539	S464-V537 PolarHBondContact N-O 2.96Å; S464-V537 PolarHBondContact O-N 2.66Å; S464-V537 VanDerWaalsContact O-O 3.09Å; S464-N539 PolarHBondContact OG-ND2 3.27Å
465	R	57.9	Low	59.6	Low	176 Å²	176	94.8 Å²	94.8	66%	0.664	44%	0.437	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-103.5	127.3	168.9	-64.5	-175	87.7	104	-0.1	107.5	R535	R465-R535 CarbonylContact C-O 3.6Å; R465-R535 WeakPolarHBondContact CA-O 3.15Å
466	D	60.6	Low	62	Low	35 Å²	35	88.8 Å²	88.8	19%	0.187	42%	0.422	C	S	.	.	P	Polyproline II helix	trans	-68.3	141	170.3	-152.7	-11.7	0	0	0	109.9	E468 R535 V537 K689	D466-E468 VanDerWaalsContact C-N 3.26Å; D466-E468 WeakPolarHBondContact CB-O 3.34Å; D466-R535 PolarHBondContact N-O 3.31Å; D466-V537 HydrophobicContact CB-CG2 3.94Å; D466-K689 WeakPolarHBondContact OD2-CE 3.45Å; D466-K689 IonicContact OD2-NZ 2.67Å; D466-K689 PolarHBondContact OD2-NZ 3.26Å
467	T	53.6	Low	64.4	Low	37 Å²	37	82.5 Å²	82.5	23%	0.227	39%	0.386	C	S	.	.	S	Bend	trans	-70.9	-32.5	-173.2	52.2	0	0	0	0	110.9	E701	T467-E701 HydrophobicContact CG2-CB 3.66Å; T467-E701 HydrophobicContact CG2-CG 3.9Å
468	E	61.5	Low	67.3	Low	62 Å²	62	77.5 Å²	77.5	29%	0.29	35%	0.351	S	S	.	.	S	Bend	trans	-121.6	138.5	171.8	-57.1	-174.2	159.5	0	0	105.5	D466 E790	D466-E468 VanDerWaalsContact C-N 3.26Å; D466-E468 WeakPolarHBondContact CB-O 3.34Å; E468-E790 WeakPolarHBondContact CB-OE2 3.15Å; E468-E790 VanDerWaalsContact O-OE1 3.05Å
469	G	66.7	Low	70	Confident	14 Å²	14	69.3 Å²	69.3	14%	0.144	32%	0.324	C	S	.	.			trans	-126.7	-174.7	-177.1	0	0	0	0	0	108.9	N471	G469-N471 PolarHBondContact O-N 2.99Å
470	V	74.7	Confident	72.7	Confident	6 Å²	6	61.7 Å²	61.7	4%	0.036	31%	0.308	C	S	.	.	S	Bend	trans	-49.1	133.6	176.1	-173	0	0	0	0	112.3	L472 L474 R475 H534 I682 K685	V470-L472 PolarHBondContact O-N 3.47Å; V470-L474 HydrophobicContact CG1-CB 4.17Å; V470-L474 HydrophobicContact CG1-CD2 3.68Å; V470-L474 HydrophobicContact CG1-CG 4.38Å; V470-R475 HydrophobicContact CB-CG 4.2Å; V470-R475 HydrophobicContact CG1-CG 3.98Å; V470-R475 PolarHBondContact O-NE 3.4Å; V470-H534 HydrophobicContact CB-CB 4.01Å; V470-H534 HydrophobicContact CG2-CB 3.97Å; V470-I682 HydrophobicContact CG1-CD1 4.1Å; V470-I682 HydrophobicContact CG1-CG1 4.03Å; V470-I682 HydrophobicContact CG2-CG2 3.91Å; V470-K685 HydrophobicContact CG2-CD 4.46Å
471	N	77.7	Confident	75	Confident	15 Å²	15	56 Å²	56	8%	0.08	28%	0.281	C	S	.	.			trans	-47.2	135.9	178.6	-172.9	-31.4	0	0	0	111.3	G469 Y473 L474 R475 V927	G469-N471 PolarHBondContact O-N 2.99Å; N471-Y473 VanDerWaalsContact C-N 3.27Å; N471-Y473 PolarHBondContact O-N 3.27Å; N471-Y473 WeakPolarHBondContact OD1-CD2 3.42Å; N471-Y473 PolarHBondContact OD1-N 3.04Å; N471-L474 HydrophobicContact CB-CB 4.22Å; N471-L474 PolarHBondContact O-N 3.09Å; N471-R475 WeakPolarHBondContact O-CG 3.28Å; N471-R475 PolarHBondContact O-N 3.04Å; N471-R475 VanDerWaalsContact O-N 3.12Å; N471-V927 HydrophobicContact CB-CG1 4.21Å; N471-V927 WeakPolarHBondContact ND2-CG1 3.46Å; N471-V927 PolarHBondContact ND2-O 2.92Å
472	L	82	Confident	77.1	Confident	96 Å²	96	52.1 Å²	52.1	50%	0.503	26%	0.255	S	S	.	.	H	α-helix	trans	-57	-40.2	178.3	177.9	64.8	0	0	0	112.3	V470 R475 L476	V470-L472 PolarHBondContact O-N 3.47Å; L472-R475 PolarHBondContact O-N 3.4Å; L472-L476 WeakPolarHBondContact O-CB 3.32Å; L472-L476 PolarHBondContact O-N 3.24Å
473	Y	84.2	Confident	79	Confident	103 Å²	103	49.6 Å²	49.6	40%	0.404	25%	0.247	S	C	.	.	H	α-helix	trans	-69.4	-39.3	-178	-66	-83.7	0	0	0	111.7	N471 R475 L476 G477 S930	N471-Y473 VanDerWaalsContact C-N 3.27Å; N471-Y473 PolarHBondContact O-N 3.27Å; N471-Y473 WeakPolarHBondContact OD1-CD2 3.42Å; N471-Y473 PolarHBondContact OD1-N 3.04Å; Y473-R475 VanDerWaalsContact C-N 3.31Å; Y473-R475 PolarHBondContact O-N 2.89Å; Y473-L476 PolarHBondContact O-N 3.46Å; Y473-G477 PolarHBondContact O-N 3.37Å; Y473-S930 WeakPolarHBondContact CD2-OG 3.26Å; Y473-S930 WeakPolarHBondContact CE2-OG 3.26Å
474	L	84.1	Confident	80.5	Confident	3 Å²	3	44.1 Å²	44.1	2%	0.016	23%	0.226	C	C	.	.	H	α-helix	trans	-61.7	-41.2	173.3	-164.3	72.7	0	0	0	111.3	V470 N471 G477 A478 I678 I682 F923 V927	V470-L474 HydrophobicContact CG1-CB 4.17Å; V470-L474 HydrophobicContact CG1-CD2 3.68Å; V470-L474 HydrophobicContact CG1-CG 4.38Å; N471-L474 HydrophobicContact CB-CB 4.22Å; N471-L474 PolarHBondContact O-N 3.09Å; L474-G477 PolarHBondContact O-N 3.27Å; L474-A478 PolarHBondContact O-N 2.94Å; L474-I678 HydrophobicContact CD1-CG1 4.38Å; L474-I678 HydrophobicContact CD1-CG2 4.1Å; L474-I678 HydrophobicContact CG-CG2 3.98Å; L474-I682 HydrophobicContact CD2-CD1 4.2Å; L474-I682 HydrophobicContact CD2-CG1 3.92Å; L474-I682 HydrophobicContact CG-CD1 4.44Å; L474-F923 HydrophobicContact CD1-CE1 4.12Å; L474-V927 HydrophobicContact CB-CG1 4.14Å; L474-V927 HydrophobicContact CD1-CG1 4.47Å; L474-V927 HydrophobicContact CD1-CG2 4.38Å
475	R	89.5	Confident	82.2	Confident	29 Å²	29	43.7 Å²	43.7	11%	0.109	22%	0.222	C	C	.	.	H	α-helix	trans	-65.7	-39.9	174.9	-69.9	-176.7	-71	141.2	1	112.7	V470 N471 L472 Y473 G477 A478 V479 F531 H534	V470-R475 HydrophobicContact CB-CG 4.2Å; V470-R475 HydrophobicContact CG1-CG 3.98Å; V470-R475 PolarHBondContact O-NE 3.4Å; N471-R475 WeakPolarHBondContact O-CG 3.28Å; N471-R475 PolarHBondContact O-N 3.04Å; N471-R475 VanDerWaalsContact O-N 3.12Å; L472-R475 PolarHBondContact O-N 3.4Å; Y473-R475 VanDerWaalsContact C-N 3.31Å; Y473-R475 PolarHBondContact O-N 2.89Å; R475-G477 VanDerWaalsContact C-N 3.31Å; R475-A478 PolarHBondContact O-N 3.07Å; R475-V479 WeakPolarHBondContact O-CG2 3.39Å; R475-V479 PolarHBondContact O-N 3.33Å; R475-F531 HydrophobicContact CB-CD2 4.34Å; R475-H534 PolarHBondContact NH1-CE1 3.1Å; R475-H534 PolarHBondContact NH1-ND1 3.46Å; R475-H534 PolarHBondContact NH1-NE2 3.36Å
476	L	89.8	Confident	84	Confident	109 Å²	109	35.9 Å²	35.9	57%	0.571	19%	0.194	S	C	*	.	H	α-helix	trans	-65.9	-37.9	176.7	-169.3	67.2	0	0	0	111	L472 Y473 V479 G480	L472-L476 WeakPolarHBondContact O-CB 3.32Å; L472-L476 PolarHBondContact O-N 3.24Å; Y473-L476 PolarHBondContact O-N 3.46Å; L476-V479 PolarHBondContact O-N 2.87Å; L476-G480 PolarHBondContact O-N 2.74Å
477	G	89.3	Confident	85.6	Confident	9 Å²	9	38.6 Å²	38.6	9%	0.093	21%	0.207	C	C	.	.	H	α-helix	trans	-59.7	-50.6	170.4	0	0	0	0	0	112.3	Y473 L474 R475 V479 G480 F481	Y473-G477 PolarHBondContact O-N 3.37Å; L474-G477 PolarHBondContact O-N 3.27Å; R475-G477 VanDerWaalsContact C-N 3.31Å; G477-V479 PolarHBondContact O-N 3.39Å; G477-G480 PolarHBondContact O-N 2.84Å; G477-G480 VanDerWaalsContact O-N 3.11Å; G477-F481 WeakPolarHBondContact O-CD2 3.3Å; G477-F481 PolarHBondContact O-N 2.87Å
478	A	92.5	Very high	87.4	Confident	2 Å²	2	37.2 Å²	37.2	2%	0.017	20%	0.198	C	C	.	.	H	α-helix	trans	-55.2	-39.3	175.9	0	0	0	0	0	112.3	L474 R475 G482 Y675 I678	L474-A478 PolarHBondContact O-N 2.94Å; R475-A478 PolarHBondContact O-N 3.07Å; A478-G482 WeakPolarHBondContact O-CA 3.35Å; A478-G482 PolarHBondContact O-N 3.03Å; A478-Y675 VanDerWaalsContact O-CD2 3.26Å; A478-Y675 WeakPolarHBondContact O-CD2 2.99Å; A478-Y675 VanDerWaalsContact O-CE2 3.32Å; A478-Y675 WeakPolarHBondContact O-CE2 3.4Å; A478-I678 HydrophobicContact CB-CG2 3.83Å
479	V	95	Very high	88.9	Confident	30 Å²	30	34.5 Å²	34.5	18%	0.182	19%	0.185	C	C	.	.	H	α-helix	trans	-67.4	-50.6	175.2	173	0	0	0	0	111.3	R475 L476 G477 G482 F483 T527 F531	R475-V479 WeakPolarHBondContact O-CG2 3.39Å; R475-V479 PolarHBondContact O-N 3.33Å; L476-V479 PolarHBondContact O-N 2.87Å; G477-V479 PolarHBondContact O-N 3.39Å; V479-G482 PolarHBondContact O-N 3.09Å; V479-F483 HydrophobicContact CG1-CD2 3.73Å; V479-F483 HydrophobicContact CG1-CE2 3.43Å; V479-F483 VanDerWaalsContact CG1-CE2 3.43Å; V479-F483 WeakPolarHBondContact O-CD2 3.37Å; V479-F483 PolarHBondContact O-N 3.14Å; V479-T527 HydrophobicContact CB-CG2 4.39Å; V479-T527 HydrophobicContact CG2-CG2 3.95Å; V479-F531 HydrophobicContact CG2-CB 4.36Å; V479-F531 HydrophobicContact CG2-CD2 3.66Å; V479-F531 HydrophobicContact CG2-CE2 4.32Å; V479-F531 HydrophobicContact CG2-CG 4.28Å
480	G	93.5	Very high	90.1	Very high	43 Å²	43	35.4 Å²	35.4	44%	0.443	20%	0.195	S	C	.	.	H	α-helix	trans	-60.7	-50.4	-178.8	0	0	0	0	0	113	L476 G477 F483 G484	L476-G480 PolarHBondContact O-N 2.74Å; G477-G480 PolarHBondContact O-N 2.84Å; G477-G480 VanDerWaalsContact O-N 3.11Å; G480-F483 PolarHBondContact O-N 2.98Å; G480-G484 PolarHBondContact O-N 3.44Å; G480-G484 VanDerWaalsContact O-N 3.13Å
481	F	93.7	Very high	90.8	Very high	21 Å²	21	38.2 Å²	38.2	9%	0.092	21%	0.207	C	C	.	.	H	α-helix	trans	-68.5	-36.9	177.4	-62.9	-56.9	0	0	0	112.1	G477 F483 G484 V485 C671 E674 Y675 I678 W882 F923	G477-F481 WeakPolarHBondContact O-CD2 3.3Å; G477-F481 PolarHBondContact O-N 2.87Å; F481-F483 VanDerWaalsContact C-N 3.28Å; F481-F483 PolarHBondContact O-N 3.29Å; F481-G484 CarbonylContact O-C 3.41Å; F481-G484 WeakPolarHBondContact O-CA 3.23Å; F481-G484 PolarHBondContact O-N 2.95Å; F481-V485 VanDerWaalsContact O-CG2 3.26Å; F481-V485 WeakPolarHBondContact O-CG2 3.37Å; F481-V485 PolarHBondContact O-N 3.4Å; F481-C671 HydrophobicContact CD1-CB 4.3Å; F481-E674 HydrophobicContact CD1-CB 3.96Å; F481-E674 HydrophobicContact CD2-CB 3.82Å; F481-E674 HydrophobicContact CE1-CB 4.01Å; F481-E674 HydrophobicContact CE1-CG 4.17Å; F481-E674 HydrophobicContact CE2-CB 3.87Å; F481-E674 HydrophobicContact CE2-CG 4.4Å; F481-E674 HydrophobicContact CG-CB 3.86Å; F481-E674 HydrophobicContact CZ-CB 3.96Å; F481-E674 HydrophobicContact CZ-CG 4.08Å; F481-Y675 HydrophobicContact CB-CD2 4.48Å; F481-I678 HydrophobicContact CD2-CD1 3.52Å; F481-I678 HydrophobicContact CE2-CD1 3.71Å; F481-W882 HydrophobicContact CE1-CH2 4.33Å; F481-W882 AromaticContact CE1-CZ2 3.9Å; F481-W882 HydrophobicContact CE1-CZ2 3.9Å; F481-W882 HydrophobicContact CZ-CH2 4.2Å; F481-W882 AromaticContact CZ-CZ2 3.59Å; F481-W882 HydrophobicContact CZ-CZ2 3.59Å; F481-F923 HydrophobicContact CE2-CD1 4.48Å; F481-F923 HydrophobicContact CE2-CD2 4.22Å; F481-F923 HydrophobicContact CE2-CE1 4.29Å; F481-F923 HydrophobicContact CE2-CE2 4.02Å; F481-F923 HydrophobicContact CE2-CG 4.47Å; F481-F923 HydrophobicContact CE2-CZ 4.08Å; F481-F923 HydrophobicContact CZ-CD2 4.34Å; F481-F923 HydrophobicContact CZ-CE2 4.44Å
482	G	95.6	Very high	91.2	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-59	-39.5	174	0	0	0	0	0	112.3	A478 V479 V485 M486 Y675	A478-G482 WeakPolarHBondContact O-CA 3.35Å; A478-G482 PolarHBondContact O-N 3.03Å; V479-G482 PolarHBondContact O-N 3.09Å; G482-V485 PolarHBondContact O-N 3.39Å; G482-M486 WeakPolarHBondContact O-CE 3.11Å; G482-M486 WeakPolarHBondContact O-CG 3.49Å; G482-M486 PolarHBondContact O-N 3.16Å; G482-Y675 VanDerWaalsContact N-CD2 3.32Å
483	F	95.8	Very high	91.5	Very high	115 Å²	115	35.4 Å²	35.4	50%	0.504	19%	0.191	S	C	.	.	H	α-helix	trans	-63.1	-41.2	169.7	-79.2	-63.7	0	0	0	112.7	V479 G480 F481 V485 M486 I487	V479-F483 HydrophobicContact CG1-CD2 3.73Å; V479-F483 HydrophobicContact CG1-CE2 3.43Å; V479-F483 VanDerWaalsContact CG1-CE2 3.43Å; V479-F483 WeakPolarHBondContact O-CD2 3.37Å; V479-F483 PolarHBondContact O-N 3.14Å; G480-F483 PolarHBondContact O-N 2.98Å; F481-F483 VanDerWaalsContact C-N 3.28Å; F481-F483 PolarHBondContact O-N 3.29Å; F483-V485 VanDerWaalsContact C-N 3.33Å; F483-V485 PolarHBondContact O-N 2.99Å; F483-M486 HydrophobicContact CB-CE 4.38Å; F483-M486 HydrophobicContact CD1-CE 3.34Å; F483-M486 HydrophobicContact CE1-CE 3.7Å; F483-M486 HydrophobicContact CG-CE 3.93Å; F483-M486 PolarHBondContact O-N 3.35Å; F483-I487 VanDerWaalsContact O-CG1 3.3Å; F483-I487 WeakPolarHBondContact O-CG1 3.28Å; F483-I487 PolarHBondContact O-N 3.41Å
484	G	93.7	Very high	91.6	Very high	8 Å²	8	32.8 Å²	32.8	8%	0.082	19%	0.191	C	C	.	.	H	α-helix	trans	-57.2	-42.9	173.1	0	0	0	0	0	113	G480 F481 I487 F488	G480-G484 PolarHBondContact O-N 3.44Å; G480-G484 VanDerWaalsContact O-N 3.13Å; F481-G484 CarbonylContact O-C 3.41Å; F481-G484 WeakPolarHBondContact O-CA 3.23Å; F481-G484 PolarHBondContact O-N 2.95Å; G484-I487 PolarHBondContact O-N 3.49Å; G484-F488 PolarHBondContact O-N 2.87Å
485	V	94.9	Very high	91.4	Very high	4 Å²	4	33.5 Å²	33.5	2%	0.024	19%	0.194	C	C	.	.	H	α-helix	trans	-65.4	-43.5	176.1	-170.8	0	0	0	0	111.6	F481 G482 F483 I487 F488 D489 V523 A672 Y675	F481-V485 VanDerWaalsContact O-CG2 3.26Å; F481-V485 WeakPolarHBondContact O-CG2 3.37Å; F481-V485 PolarHBondContact O-N 3.4Å; G482-V485 PolarHBondContact O-N 3.39Å; F483-V485 VanDerWaalsContact C-N 3.33Å; F483-V485 PolarHBondContact O-N 2.99Å; V485-I487 VanDerWaalsContact C-N 3.3Å; V485-I487 PolarHBondContact O-N 3.43Å; V485-F488 CarbonylContact O-C 3.53Å; V485-F488 WeakPolarHBondContact O-CA 3.39Å; V485-F488 WeakPolarHBondContact O-CB 3.33Å; V485-F488 PolarHBondContact O-N 2.96Å; V485-D489 PolarHBondContact O-N 2.88Å; V485-V523 HydrophobicContact CB-CG1 4.23Å; V485-V523 HydrophobicContact CG1-CG1 4.47Å; V485-V523 HydrophobicContact CG1-CG2 4.05Å; V485-A672 HydrophobicContact CG2-CB 4.1Å; V485-Y675 HydrophobicContact CG2-CD1 4.03Å; V485-Y675 HydrophobicContact CG2-CG 3.96Å
486	M	95.7	Very high	90.9	Very high	12 Å²	12	33.1 Å²	33.1	6%	0.059	20%	0.195	C	C	.	.	H	α-helix	trans	-62.8	-37.5	177.4	-75	-174.9	-69	0	0	112.2	G482 F483 F488 G490 F520 V523 F524	G482-M486 WeakPolarHBondContact O-CE 3.11Å; G482-M486 WeakPolarHBondContact O-CG 3.49Å; G482-M486 PolarHBondContact O-N 3.16Å; F483-M486 HydrophobicContact CB-CE 4.38Å; F483-M486 HydrophobicContact CD1-CE 3.34Å; F483-M486 HydrophobicContact CE1-CE 3.7Å; F483-M486 HydrophobicContact CG-CE 3.93Å; F483-M486 PolarHBondContact O-N 3.35Å; M486-F488 VanDerWaalsContact C-N 3.33Å; M486-G490 PolarHBondContact O-N 3.1Å; M486-F520 HydrophobicContact CB-CD2 3.91Å; M486-F520 HydrophobicContact CB-CE2 3.58Å; M486-F520 HydrophobicContact CB-CZ 4.22Å; M486-F520 HydrophobicContact CG-CD2 4.07Å; M486-F520 HydrophobicContact CG-CE2 3.99Å; M486-F520 HydrophobicContact CG-CZ 4.35Å; M486-F520 WeakPolarHBondContact O-CD2 3.22Å; M486-F520 WeakPolarHBondContact O-CE2 3.42Å; M486-F520 HydrophobicContact SD-CE1 4.47Å; M486-F520 HydrophobicContact SD-CE2 4.47Å; M486-F520 HydrophobicContact SD-CZ 4.24Å; M486-V523 HydrophobicContact CG-CB 4.32Å; M486-V523 HydrophobicContact CG-CG1 3.86Å; M486-F524 HydrophobicContact CE-CD2 4.43Å; M486-F524 HydrophobicContact SD-CB 3.74Å; M486-F524 HydrophobicContact SD-CD2 3.82Å; M486-F524 HydrophobicContact SD-CG 4.29Å
487	I	93.9	Very high	90.3	Very high	92 Å²	92	36.1 Å²	36.1	47%	0.472	20%	0.199	S	C	.	.	H	α-helix	trans	-63.1	-42.9	171.7	-70.3	166	0	0	0	110.1	F483 G484 V485 G490 F491 L668	F483-I487 VanDerWaalsContact O-CG1 3.3Å; F483-I487 WeakPolarHBondContact O-CG1 3.28Å; F483-I487 PolarHBondContact O-N 3.41Å; G484-I487 PolarHBondContact O-N 3.49Å; V485-I487 VanDerWaalsContact C-N 3.3Å; V485-I487 PolarHBondContact O-N 3.43Å; I487-G490 PolarHBondContact O-N 2.97Å; I487-F491 HydrophobicContact CG2-CD2 3.8Å; I487-F491 HydrophobicContact CG2-CE2 3.36Å; I487-F491 HydrophobicContact CG2-CZ 4.38Å; I487-F491 WeakPolarHBondContact O-CD2 3.47Å; I487-F491 PolarHBondContact O-N 3.49Å; I487-L668 HydrophobicContact CG2-CD1 4.32Å; I487-L668 HydrophobicContact CG2-CD2 4.34Å
488	F	92.1	Very high	89.5	Confident	9 Å²	9	37.7 Å²	37.7	4%	0.039	20%	0.204	C	C	.	.	H	α-helix	trans	-62.9	-45	177.9	-171.1	-150.7	0	0	0	112.9	G484 V485 M486 G490 F491 K492 V661 A665 L668 F669 A672	G484-F488 PolarHBondContact O-N 2.87Å; V485-F488 CarbonylContact O-C 3.53Å; V485-F488 WeakPolarHBondContact O-CA 3.39Å; V485-F488 WeakPolarHBondContact O-CB 3.33Å; V485-F488 PolarHBondContact O-N 2.96Å; M486-F488 VanDerWaalsContact C-N 3.33Å; F488-G490 VanDerWaalsContact C-N 3.29Å; F488-G490 PolarHBondContact O-N 3.19Å; F488-F491 PolarHBondContact O-N 2.9Å; F488-K492 VanDerWaalsContact CE2-CE 3.49Å; F488-K492 HydrophobicContact CE2-CG 4.41Å; F488-K492 PolarHBondContact O-N 3.49Å; F488-V661 HydrophobicContact CE2-CG1 4.21Å; F488-A665 HydrophobicContact CE2-CB 3.82Å; F488-A665 HydrophobicContact CZ-CB 4.11Å; F488-L668 HydrophobicContact CB-CB 4.04Å; F488-L668 HydrophobicContact CB-CD1 3.99Å; F488-L668 HydrophobicContact CD2-CB 4.02Å; F488-L668 HydrophobicContact CD2-CD1 3.92Å; F488-L668 HydrophobicContact CG-CB 3.97Å; F488-L668 HydrophobicContact CG-CD1 4.28Å; F488-F669 AromaticContact CE1-CD1 3.97Å; F488-F669 HydrophobicContact CE1-CD1 3.97Å; F488-F669 AromaticContact CE1-CE1 3.98Å; F488-F669 HydrophobicContact CE1-CE1 3.98Å; F488-F669 HydrophobicContact CZ-CD1 4.02Å; F488-F669 AromaticContact CZ-CE1 3.7Å; F488-F669 HydrophobicContact CZ-CE1 3.7Å; F488-F669 HydrophobicContact CZ-CZ 4.18Å; F488-A672 HydrophobicContact CD1-CB 4.46Å
489	D	92.6	Very high	88.2	Confident	4 Å²	4	37.7 Å²	37.7	2%	0.021	20%	0.204	C	C	.	.	H	α-helix	trans	-61.1	-39.7	172.6	-75.6	-37.5	0	0	0	111.4	V485 F491 K492 I493 H516 H519 F520	V485-D489 PolarHBondContact O-N 2.88Å; D489-F491 VanDerWaalsContact C-N 3.28Å; D489-F491 PolarHBondContact O-N 3.45Å; D489-K492 PolarHBondContact O-N 3.27Å; D489-I493 WeakPolarHBondContact O-CD1 3.2Å; D489-I493 WeakPolarHBondContact O-CG1 3.18Å; D489-I493 PolarHBondContact O-N 3.28Å; D489-H516 IonicContact OD1-ND1 3.59Å; D489-H516 PolarHBondContact OD1-ND1 2.63Å; D489-H519 VanDerWaalsContact CG-ND1 3.31Å; D489-H519 IonicContact OD1-ND1 2.97Å; D489-H519 PolarHBondContact OD1-ND1 3.36Å; D489-H519 VanDerWaalsContact OD1-ND1 3.14Å; D489-H519 IonicContact OD2-CE1 3.14Å; D489-H519 IonicContact OD2-CG 3.8Å; D489-H519 IonicContact OD2-ND1 3.97Å; D489-H519 PolarHBondContact OD2-ND1 3.41Å; D489-F520 HydrophobicContact CB-CB 4.24Å; D489-F520 HydrophobicContact CB-CD2 4.18Å
490	G	91.7	Very high	86.8	Confident	34 Å²	34	41.8 Å²	41.8	35%	0.351	23%	0.228	S	C	.	.	H	α-helix	trans	-56.3	-42.2	174.6	0	0	0	0	0	112.7	M486 I487 F488 A494	M486-G490 PolarHBondContact O-N 3.1Å; I487-G490 PolarHBondContact O-N 2.97Å; F488-G490 VanDerWaalsContact C-N 3.29Å; F488-G490 PolarHBondContact O-N 3.19Å; G490-A494 PolarHBondContact O-N 3.34Å
491	F	88.9	Confident	85.4	Confident	64 Å²	64	43.6 Å²	43.6	28%	0.281	24%	0.239	S	C	.	.	H	α-helix	trans	-67.7	-42	174.9	-74.8	-60.7	0	0	0	112.9	I487 F488 D489 I493 A494 E495 T660 V661 L664 L668	I487-F491 HydrophobicContact CG2-CD2 3.8Å; I487-F491 HydrophobicContact CG2-CE2 3.36Å; I487-F491 HydrophobicContact CG2-CZ 4.38Å; I487-F491 WeakPolarHBondContact O-CD2 3.47Å; I487-F491 PolarHBondContact O-N 3.49Å; F488-F491 PolarHBondContact O-N 2.9Å; D489-F491 VanDerWaalsContact C-N 3.28Å; D489-F491 PolarHBondContact O-N 3.45Å; F491-I493 VanDerWaalsContact C-N 3.32Å; F491-I493 PolarHBondContact O-N 2.96Å; F491-A494 WeakPolarHBondContact O-CB 3.35Å; F491-A494 PolarHBondContact O-N 3.44Å; F491-A494 VanDerWaalsContact O-N 3.1Å; F491-E495 PolarHBondContact O-N 3.27Å; F491-T660 HydrophobicContact CD1-CG2 4.39Å; F491-T660 HydrophobicContact CE1-CG2 4.48Å; F491-V661 HydrophobicContact CB-CG2 3.99Å; F491-L664 HydrophobicContact CD2-CD2 3.94Å; F491-L664 HydrophobicContact CE1-CD2 3.94Å; F491-L664 HydrophobicContact CE2-CD2 3.23Å; F491-L664 HydrophobicContact CZ-CD2 3.25Å; F491-L668 HydrophobicContact CD2-CD1 3.75Å; F491-L668 HydrophobicContact CE2-CD1 4.07Å
492	K	87.1	Confident	83.8	Confident	25 Å²	25	45.8 Å²	45.8	11%	0.109	25%	0.252	C	S	.	.	H	α-helix	trans	-65	-33.6	176.3	-67.8	-172.8	-179.3	-174.8	0	113.4	F488 D489 A494 E495 W512 H516 V661	F488-K492 VanDerWaalsContact CE2-CE 3.49Å; F488-K492 HydrophobicContact CE2-CG 4.41Å; F488-K492 PolarHBondContact O-N 3.49Å; D489-K492 PolarHBondContact O-N 3.27Å; K492-A494 VanDerWaalsContact C-N 3.25Å; K492-A494 PolarHBondContact O-N 3.18Å; K492-E495 PolarHBondContact O-N 3.02Å; K492-W512 PolarHBondContact O-NE1 2.96Å; K492-H516 WeakPolarHBondContact CD-CE1 3.4Å; K492-V661 HydrophobicContact CG-CG1 4.48Å
493	I	88.8	Confident	82	Confident	28 Å²	28	50.3 Å²	50.3	14%	0.144	28%	0.284	C	S	.	.	H	α-helix	trans	-66.9	-30.8	173.9	-68	159.7	0	0	0	111	D489 F491 P496 W497 I513 H516 L517	D489-I493 WeakPolarHBondContact O-CD1 3.2Å; D489-I493 WeakPolarHBondContact O-CG1 3.18Å; D489-I493 PolarHBondContact O-N 3.28Å; F491-I493 VanDerWaalsContact C-N 3.32Å; F491-I493 PolarHBondContact O-N 2.96Å; I493-P496 WeakPolarHBondContact O-CD 3.15Å; I493-W497 HydrophobicContact CG2-CZ3 4.31Å; I493-I513 HydrophobicContact CG2-CG2 4.44Å; I493-H516 HydrophobicContact CD1-CB 4.17Å; I493-H516 HydrophobicContact CG1-CB 3.56Å; I493-L517 HydrophobicContact CD1-CD2 3.67Å; I493-L517 HydrophobicContact CD1-CG 4.05Å; I493-L517 HydrophobicContact CG1-CG 4.48Å
494	A	85.7	Confident	80.3	Confident	48 Å²	48	45.5 Å²	45.5	40%	0.397	26%	0.264	S	S	.	.	H	α-helix	trans	-78.3	-20.3	179.6	0	0	0	0	0	113.6	G490 F491 K492 W497 E498	G490-A494 PolarHBondContact O-N 3.34Å; F491-A494 WeakPolarHBondContact O-CB 3.35Å; F491-A494 PolarHBondContact O-N 3.44Å; F491-A494 VanDerWaalsContact O-N 3.1Å; K492-A494 VanDerWaalsContact C-N 3.25Å; K492-A494 PolarHBondContact O-N 3.18Å; A494-W497 WeakPolarHBondContact O-CB 3.44Å; A494-W497 PolarHBondContact O-N 3.41Å; A494-E498 PolarHBondContact O-N 3.31Å; A494-E498 VanDerWaalsContact O-N 3.15Å
495	E	79.4	Confident	78.8	Confident	18 Å²	18	50.1 Å²	50.1	8%	0.084	29%	0.29	C	S	.	.	H	α-helix	trans	-54.7	-47.1	-177	-71.4	177.9	129.7	0	0	114	F491 K492 W497 E498 E499 W512 V661	F491-E495 PolarHBondContact O-N 3.27Å; K492-E495 PolarHBondContact O-N 3.02Å; E495-W497 PolarHBondContact O-N 2.85Å; E495-E498 WeakPolarHBondContact O-CB 3.41Å; E495-E498 PolarHBondContact O-N 3.19Å; E495-E499 PolarHBondContact O-N 2.91Å; E495-W512 WeakPolarHBondContact OE2-CZ2 3.46Å; E495-V661 HydrophobicContact CG-CB 4.07Å; E495-V661 HydrophobicContact CG-CG2 3.23Å; E495-V661 WeakPolarHBondContact OE1-CB 3.46Å; E495-V661 WeakPolarHBondContact OE1-CG1 3.49Å; E495-V661 VanDerWaalsContact OE1-CG2 3.23Å; E495-V661 WeakPolarHBondContact OE1-CG2 3.31Å
496	P	78.5	Confident	77.1	Confident	21 Å²	21	54.1 Å²	54.1	14%	0.136	32%	0.318	C	S	.	.	H	α-helix	trans	-62.7	-27.1	178.3	-23.8	36.3	0	0	0	113.4	I493 V500 I513	I493-P496 WeakPolarHBondContact O-CD 3.15Å; P496-V500 WeakPolarHBondContact O-CG2 3.49Å; P496-V500 PolarHBondContact O-N 3.06Å; P496-I513 HydrophobicContact CB-CD1 4.28Å; P496-I513 HydrophobicContact CG-CD1 4.2Å; P496-I513 HydrophobicContact CG-CG1 4Å
497	W	77.8	Confident	75.9	Confident	172 Å²	172	57.2 Å²	57.2	65%	0.652	34%	0.34	S	S	*	.	H	α-helix	trans	-74.9	-33.3	174.3	-90.3	-81.3	0	0	0	112.4	I493 A494 E495 E499 V500 A501 I513	I493-W497 HydrophobicContact CG2-CZ3 4.31Å; A494-W497 WeakPolarHBondContact O-CB 3.44Å; A494-W497 PolarHBondContact O-N 3.41Å; E495-W497 PolarHBondContact O-N 2.85Å; W497-E499 VanDerWaalsContact C-N 3.3Å; W497-V500 PolarHBondContact O-N 3.35Å; W497-A501 PolarHBondContact O-N 3.4Å; W497-A501 VanDerWaalsContact O-N 3.12Å; W497-I513 HydrophobicContact CH2-CD1 4.48Å; W497-I513 HydrophobicContact CZ3-CD1 4.08Å
498	E	71.7	Confident	75	Confident	41 Å²	41	54.7 Å²	54.7	19%	0.192	33%	0.326	C	S	.	.	H	α-helix	trans	-65.5	-36.3	172.2	-167.3	173.7	-161.3	0	0	110.7	A494 E495 A501 N502 T660	A494-E498 PolarHBondContact O-N 3.31Å; A494-E498 VanDerWaalsContact O-N 3.15Å; E495-E498 WeakPolarHBondContact O-CB 3.41Å; E495-E498 PolarHBondContact O-N 3.19Å; E498-A501 PolarHBondContact O-N 2.85Å; E498-N502 WeakPolarHBondContact O-CB 3.47Å; E498-N502 PolarHBondContact O-N 3.36Å; E498-N502 VanDerWaalsContact O-N 3.15Å; E498-N502 PolarHBondContact O-ND2 3.4Å; E498-T660 PolarHBondContact OE1-N 2.82Å; E498-T660 PolarHBondContact OE1-OG1 2.93Å; E498-T660 PolarHBondContact OE2-N 3.38Å; E498-T660 PolarHBondContact OE2-OG1 3.44Å
499	E	66.2	Low	74.4	Confident	3 Å²	3	56.9 Å²	56.9	1%	0.014	35%	0.351	C	S	.	.	H	α-helix	trans	-65.1	-44.8	174.6	-68.5	174.8	179	0	0	112.8	E495 W497 A501 N502 S503 V504 H508 C657	E495-E499 PolarHBondContact O-N 2.91Å; W497-E499 VanDerWaalsContact C-N 3.3Å; E499-A501 VanDerWaalsContact C-N 3.28Å; E499-A501 PolarHBondContact O-N 2.95Å; E499-N502 CarbonylContact O-C 3.57Å; E499-N502 PolarHBondContact O-N 2.97Å; E499-N502 VanDerWaalsContact O-N 3.1Å; E499-S503 PolarHBondContact O-N 2.86Å; E499-S503 VanDerWaalsContact O-N 3.11Å; E499-V504 HydrophobicContact CB-CB 4.24Å; E499-V504 HydrophobicContact CB-CG1 4.34Å; E499-V504 HydrophobicContact CG-CB 4.5Å; E499-V504 HydrophobicContact CG-CG1 4.14Å; E499-V504 PolarHBondContact O-N 3.13Å; E499-V504 VanDerWaalsContact O-N 3.12Å; E499-H508 IonicContact OE1-CE1 2.69Å; E499-H508 PolarHBondContact OE1-CE1 3.37Å; E499-H508 IonicContact OE1-ND1 3.69Å; E499-H508 PolarHBondContact OE1-ND1 3.08Å; E499-H508 IonicContact OE2-ND1 2.74Å; E499-C657 PolarHBondContact OE1-SG 3.33Å
500	V	66.2	Low	73.9	Confident	115 Å²	115	65.9 Å²	65.9	70%	0.697	39%	0.393	S	S	*	.	H	α-helix	trans	-62.9	-38.1	177.7	172.5	0	0	0	0	110.8	P496 W497 N502	P496-V500 WeakPolarHBondContact O-CG2 3.49Å; P496-V500 PolarHBondContact O-N 3.06Å; W497-V500 PolarHBondContact O-N 3.35Å; V500-N502 VanDerWaalsContact C-N 3.27Å; V500-N502 PolarHBondContact O-N 2.94Å
501	A	63	Low	73.7	Confident	82 Å²	82	70.8 Å²	70.8	68%	0.678	41%	0.411	S	S	*	.	H	α-helix	trans	-65.1	-32	175.4	0	0	0	0	0	112.5	W497 E498 E499	W497-A501 PolarHBondContact O-N 3.4Å; W497-A501 VanDerWaalsContact O-N 3.12Å; E498-A501 PolarHBondContact O-N 2.85Å; E499-A501 VanDerWaalsContact C-N 3.28Å; E499-A501 PolarHBondContact O-N 2.95Å
502	N	60.4	Low	73.7	Confident	66 Å²	66	71 Å²	71	35%	0.353	41%	0.41	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.7	9	-175.4	-68	-28.1	0	0	0	114.2	E498 E499 V500 V504	E498-N502 WeakPolarHBondContact O-CB 3.47Å; E498-N502 PolarHBondContact O-N 3.36Å; E498-N502 VanDerWaalsContact O-N 3.15Å; E498-N502 PolarHBondContact O-ND2 3.4Å; E499-N502 CarbonylContact O-C 3.57Å; E499-N502 PolarHBondContact O-N 2.97Å; E499-N502 VanDerWaalsContact O-N 3.1Å; V500-N502 VanDerWaalsContact C-N 3.27Å; V500-N502 PolarHBondContact O-N 2.94Å; N502-V504 HydrophobicContact CB-CG2 3.81Å; N502-V504 PolarHBondContact O-N 3.48Å
503	S	57.1	Low	73.8	Confident	96 Å²	96	72.3 Å²	72.3	67%	0.671	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	54	33.4	-177.8	62.8	0	0	0	0	114.2	E499	E499-S503 PolarHBondContact O-N 2.86Å; E499-S503 VanDerWaalsContact O-N 3.11Å
504	V	60.4	Low	74	Confident	14 Å²	14	74.3 Å²	74.3	9%	0.085	43%	0.432	C	S	.	.			trans	-87.8	141	-176.6	162.9	0	0	0	0	110.5	E499 N502 S506 Q652 A653	E499-V504 HydrophobicContact CB-CB 4.24Å; E499-V504 HydrophobicContact CB-CG1 4.34Å; E499-V504 HydrophobicContact CG-CB 4.5Å; E499-V504 HydrophobicContact CG-CG1 4.14Å; E499-V504 PolarHBondContact O-N 3.13Å; E499-V504 VanDerWaalsContact O-N 3.12Å; N502-V504 HydrophobicContact CB-CG2 3.81Å; N502-V504 PolarHBondContact O-N 3.48Å; V504-S506 PolarHBondContact O-N 3.38Å; V504-Q652 WeakPolarHBondContact CG2-O 3.48Å; V504-A653 HydrophobicContact CB-CB 4.25Å; V504-A653 HydrophobicContact CG1-CB 3.61Å; V504-A653 WeakPolarHBondContact CG1-O 3.44Å; V504-A653 HydrophobicContact CG2-CB 4.4Å
505	V	61.9	Low	74.3	Confident	104 Å²	104	76.5 Å²	76.5	63%	0.63	44%	0.436	S	S	*	.			trans	-57.2	127.1	169.5	177.2	0	0	0	0	108.8	C507 A653	V505-C507 PolarHBondContact O-N 3.14Å; V505-A653 HydrophobicContact CB-CB 4.35Å
506	S	61	Low	75	Confident	88 Å²	88	76 Å²	76	62%	0.615	43%	0.434	S	S	*	.			trans	-56.7	112.8	178.1	-56.4	0	0	0	0	110.7	V504	V504-S506 PolarHBondContact O-N 3.38Å
507	C	70.1	Confident	75.7	Confident	78 Å²	78	79 Å²	79	53%	0.527	45%	0.448	S	S	.	.			trans	-81.8	-10.5	174.8	-68.6	0	0	0	0	111.9	V505 C657	V505-C507 PolarHBondContact O-N 3.14Å; C507-C657 HydrophobicContact CB-CB 4.41Å; C507-C657 VanDerWaalsContact CB-SG 3.53Å
508	H	75.2	Confident	76.6	Confident	38 Å²	38	76.6 Å²	76.6	18%	0.176	45%	0.448	C	S	.	.	S	Bend	trans	-104.1	135.6	-171.5	-63	100	0	0	0	112	E499 W512 C657	E499-H508 IonicContact OE1-CE1 2.69Å; E499-H508 PolarHBondContact OE1-CE1 3.37Å; E499-H508 IonicContact OE1-ND1 3.69Å; E499-H508 PolarHBondContact OE1-ND1 3.08Å; E499-H508 IonicContact OE2-ND1 2.74Å; H508-W512 HydrophobicContact CB-CB 3.89Å; H508-W512 HydrophobicContact CB-CD2 4.23Å; H508-W512 HydrophobicContact CB-CG 3.92Å; H508-W512 AromaticContact CD2-CD2 3.21Å; H508-W512 AromaticContact CD2-CE2 3.29Å; H508-W512 AromaticContact CD2-CE3 3.39Å; H508-W512 AromaticContact CD2-CG 3.77Å; H508-W512 AromaticContact CD2-CH2 3.67Å; H508-W512 AromaticContact CD2-CZ2 3.54Å; H508-W512 AromaticContact CD2-CZ3 3.61Å; H508-W512 AromaticContact CD2-NE1 3.86Å; H508-W512 AromaticContact CG-CD2 3.91Å; H508-W512 AromaticContact CG-CG 3.98Å; H508-W512 AromaticContact NE2-CE2 3.59Å; H508-W512 AromaticContact NE2-CH2 3.69Å; H508-W512 AromaticContact NE2-CZ2 3.44Å; H508-W512 WeakPolarHBondContact NE2-CZ2 3.29Å; H508-C657 PolarHBondContact CE1-SG 3.39Å
509	G	79.2	Confident	77.7	Confident	55 Å²	55	76.4 Å²	76.4	57%	0.567	45%	0.447	S	S	*	.			trans	-66	158.3	171.6	0	0	0	0	0	111.8	L511 W512	G509-L511 PolarHBondContact O-N 2.79Å; G509-W512 WeakPolarHBondContact O-CB 3.46Å; G509-W512 PolarHBondContact O-N 2.61Å
510	H	82	Confident	79.2	Confident	194 Å²	194	79.8 Å²	79.8	90%	0.898	46%	0.462	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56	-19.7	179.7	-60.9	-61.7	0	0	0	114.6
511	L	86.9	Confident	80.7	Confident	137 Å²	137	78.5 Å²	78.5	72%	0.717	45%	0.454	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.6	-2.2	179.4	-66.4	174.8	0	0	0	114.4	G509 P514 L515	G509-L511 PolarHBondContact O-N 2.79Å; L511-P514 WeakPolarHBondContact O-CD 3.18Å; L511-L515 WeakPolarHBondContact O-CB 3.31Å; L511-L515 PolarHBondContact O-N 3.47Å
512	W	88.1	Confident	82.3	Confident	69 Å²	69	77.7 Å²	77.7	26%	0.261	43%	0.434	S	S	.	.	H	α-helix	trans	-58.7	-55.2	-176.9	-175.7	-97.2	0	0	0	113	K492 E495 H508 G509 L515 H516	K492-W512 PolarHBondContact O-NE1 2.96Å; E495-W512 WeakPolarHBondContact OE2-CZ2 3.46Å; H508-W512 HydrophobicContact CB-CB 3.89Å; H508-W512 HydrophobicContact CB-CD2 4.23Å; H508-W512 HydrophobicContact CB-CG 3.92Å; H508-W512 AromaticContact CD2-CD2 3.21Å; H508-W512 AromaticContact CD2-CE2 3.29Å; H508-W512 AromaticContact CD2-CE3 3.39Å; H508-W512 AromaticContact CD2-CG 3.77Å; H508-W512 AromaticContact CD2-CH2 3.67Å; H508-W512 AromaticContact CD2-CZ2 3.54Å; H508-W512 AromaticContact CD2-CZ3 3.61Å; H508-W512 AromaticContact CD2-NE1 3.86Å; H508-W512 AromaticContact CG-CD2 3.91Å; H508-W512 AromaticContact CG-CG 3.98Å; H508-W512 AromaticContact NE2-CE2 3.59Å; H508-W512 AromaticContact NE2-CH2 3.69Å; H508-W512 AromaticContact NE2-CZ2 3.44Å; H508-W512 WeakPolarHBondContact NE2-CZ2 3.29Å; G509-W512 WeakPolarHBondContact O-CB 3.46Å; G509-W512 PolarHBondContact O-N 2.61Å; W512-L515 PolarHBondContact O-N 2.94Å; W512-H516 AromaticContact CD1-CD2 3.92Å; W512-H516 AromaticContact CD2-CD2 3.8Å; W512-H516 AromaticContact CD2-NE2 3.79Å; W512-H516 AromaticContact CE2-CD2 3.57Å; W512-H516 AromaticContact CE2-NE2 3.48Å; W512-H516 AromaticContact CH2-NE2 3.85Å; W512-H516 AromaticContact CZ2-NE2 3.51Å; W512-H516 AromaticContact NE1-CD2 3.61Å; W512-H516 AromaticContact NE1-NE2 4Å; W512-H516 PolarHBondContact O-CD2 3.01Å; W512-H516 VanDerWaalsContact O-CD2 3.27Å; W512-H516 PolarHBondContact O-N 2.91Å; W512-H516 VanDerWaalsContact O-N 3.09Å
513	I	90.1	Very high	84	Confident	52 Å²	52	74.6 Å²	74.6	27%	0.267	42%	0.417	S	S	.	.	H	α-helix	trans	-63.1	-50	-179.3	-61	167.5	0	0	0	111	I493 P496 W497 L515 H516 L517	I493-I513 HydrophobicContact CG2-CG2 4.44Å; P496-I513 HydrophobicContact CB-CD1 4.28Å; P496-I513 HydrophobicContact CG-CD1 4.2Å; P496-I513 HydrophobicContact CG-CG1 4Å; W497-I513 HydrophobicContact CH2-CD1 4.48Å; W497-I513 HydrophobicContact CZ3-CD1 4.08Å; I513-L515 VanDerWaalsContact C-N 3.28Å; I513-L515 PolarHBondContact O-N 2.98Å; I513-H516 PolarHBondContact O-N 3.49Å; I513-L517 HydrophobicContact CG2-CD1 3.72Å; I513-L517 HydrophobicContact CG2-CG 4.23Å; I513-L517 WeakPolarHBondContact O-CB 3.46Å; I513-L517 WeakPolarHBondContact O-CG 3.36Å; I513-L517 PolarHBondContact O-N 3.3Å
514	P	93.2	Very high	85.9	Confident	69 Å²	69	75.4 Å²	75.4	45%	0.448	41%	0.409	S	S	.	.	H	α-helix	trans	-56.2	-39.2	175.3	-27.2	34.2	0	0	0	114	L511 L518	L511-P514 WeakPolarHBondContact O-CD 3.18Å; P514-L518 VanDerWaalsContact O-CB 3.26Å; P514-L518 WeakPolarHBondContact O-CB 3.17Å; P514-L518 PolarHBondContact O-N 3.14Å
515	L	92.3	Very high	87.6	Confident	94 Å²	94	83.2 Å²	83.2	49%	0.492	44%	0.437	S	S	.	.	H	α-helix	trans	-65	-47.1	-179.8	-176.9	69.3	0	0	0	111.5	L511 W512 I513 L518 H519	L511-L515 WeakPolarHBondContact O-CB 3.31Å; L511-L515 PolarHBondContact O-N 3.47Å; W512-L515 PolarHBondContact O-N 2.94Å; I513-L515 VanDerWaalsContact C-N 3.28Å; I513-L515 PolarHBondContact O-N 2.98Å; L515-L518 PolarHBondContact O-N 3.4Å; L515-H519 WeakPolarHBondContact O-CB 3.39Å; L515-H519 PolarHBondContact O-N 2.98Å
516	H	93	Very high	89.2	Confident	7 Å²	7	78.6 Å²	78.6	3%	0.032	41%	0.408	C	S	.	.	H	α-helix	trans	-71.1	-35.1	178.9	-74.9	-64.5	0	0	0	113	D489 K492 I493 W512 I513 H519 F520	D489-H516 IonicContact OD1-ND1 3.59Å; D489-H516 PolarHBondContact OD1-ND1 2.63Å; K492-H516 WeakPolarHBondContact CD-CE1 3.4Å; I493-H516 HydrophobicContact CD1-CB 4.17Å; I493-H516 HydrophobicContact CG1-CB 3.56Å; W512-H516 AromaticContact CD1-CD2 3.92Å; W512-H516 AromaticContact CD2-CD2 3.8Å; W512-H516 AromaticContact CD2-NE2 3.79Å; W512-H516 AromaticContact CE2-CD2 3.57Å; W512-H516 AromaticContact CE2-NE2 3.48Å; W512-H516 AromaticContact CH2-NE2 3.85Å; W512-H516 AromaticContact CZ2-NE2 3.51Å; W512-H516 AromaticContact NE1-CD2 3.61Å; W512-H516 AromaticContact NE1-NE2 4Å; W512-H516 PolarHBondContact O-CD2 3.01Å; W512-H516 VanDerWaalsContact O-CD2 3.27Å; W512-H516 PolarHBondContact O-N 2.91Å; W512-H516 VanDerWaalsContact O-N 3.09Å; I513-H516 PolarHBondContact O-N 3.49Å; H516-H519 PolarHBondContact O-N 3.37Å; H516-F520 WeakPolarHBondContact O-CB 3.48Å; H516-F520 PolarHBondContact O-N 3.05Å
517	L	94.7	Very high	90.9	Very high	85 Å²	85	75 Å²	75	45%	0.445	38%	0.383	S	S	.	.	H	α-helix	trans	-63.9	-42.2	171.5	-75	173.3	0	0	0	111.9	I493 I513 F520 V521	I493-L517 HydrophobicContact CD1-CD2 3.67Å; I493-L517 HydrophobicContact CD1-CG 4.05Å; I493-L517 HydrophobicContact CG1-CG 4.48Å; I513-L517 HydrophobicContact CG2-CD1 3.72Å; I513-L517 HydrophobicContact CG2-CG 4.23Å; I513-L517 WeakPolarHBondContact O-CB 3.46Å; I513-L517 WeakPolarHBondContact O-CG 3.36Å; I513-L517 PolarHBondContact O-N 3.3Å; L517-F520 PolarHBondContact O-N 2.99Å; L517-V521 WeakPolarHBondContact O-CG2 3.46Å; L517-V521 PolarHBondContact O-N 2.99Å
518	L	95.8	Very high	92	Very high	122 Å²	122	76.6 Å²	76.6	64%	0.639	38%	0.379	S	S	*	.	H	α-helix	trans	-64.3	-42.4	176.2	-176.2	66.8	0	0	0	111.1	P514 L515 V521 Y522	P514-L518 VanDerWaalsContact O-CB 3.26Å; P514-L518 WeakPolarHBondContact O-CB 3.17Å; P514-L518 PolarHBondContact O-N 3.14Å; L515-L518 PolarHBondContact O-N 3.4Å; L518-V521 PolarHBondContact O-N 2.71Å; L518-Y522 VanDerWaalsContact O-CB 3.29Å; L518-Y522 WeakPolarHBondContact O-CB 3.39Å; L518-Y522 PolarHBondContact O-N 3.43Å
519	H	95.5	Very high	92.9	Very high	37 Å²	37	77.2 Å²	77.2	17%	0.171	38%	0.381	C	S	.	.	H	α-helix	trans	-63.1	-43.3	176.3	-171	-108.4	0	0	0	111.9	D489 L515 H516 V521 Y522 V523	D489-H519 VanDerWaalsContact CG-ND1 3.31Å; D489-H519 IonicContact OD1-ND1 2.97Å; D489-H519 PolarHBondContact OD1-ND1 3.36Å; D489-H519 VanDerWaalsContact OD1-ND1 3.14Å; D489-H519 IonicContact OD2-CE1 3.14Å; D489-H519 IonicContact OD2-CG 3.8Å; D489-H519 IonicContact OD2-ND1 3.97Å; D489-H519 PolarHBondContact OD2-ND1 3.41Å; L515-H519 WeakPolarHBondContact O-CB 3.39Å; L515-H519 PolarHBondContact O-N 2.98Å; H516-H519 PolarHBondContact O-N 3.37Å; H519-V521 PolarHBondContact O-N 2.99Å; H519-Y522 WeakPolarHBondContact O-CB 3.41Å; H519-Y522 PolarHBondContact O-N 3.18Å; H519-V523 WeakPolarHBondContact O-CG2 3.42Å; H519-V523 PolarHBondContact O-N 3.27Å
520	F	96.8	Very high	93.6	Very high	74 Å²	74	74.7 Å²	74.7	33%	0.325	35%	0.354	S	S	.	.	H	α-helix	trans	-56.5	-49.2	174.4	-177.6	-79.1	0	0	0	111.7	M486 D489 H516 L517 Y522 V523 F524	M486-F520 HydrophobicContact CB-CD2 3.91Å; M486-F520 HydrophobicContact CB-CE2 3.58Å; M486-F520 HydrophobicContact CB-CZ 4.22Å; M486-F520 HydrophobicContact CG-CD2 4.07Å; M486-F520 HydrophobicContact CG-CE2 3.99Å; M486-F520 HydrophobicContact CG-CZ 4.35Å; M486-F520 WeakPolarHBondContact O-CD2 3.22Å; M486-F520 WeakPolarHBondContact O-CE2 3.42Å; M486-F520 HydrophobicContact SD-CE1 4.47Å; M486-F520 HydrophobicContact SD-CE2 4.47Å; M486-F520 HydrophobicContact SD-CZ 4.24Å; D489-F520 HydrophobicContact CB-CB 4.24Å; D489-F520 HydrophobicContact CB-CD2 4.18Å; H516-F520 WeakPolarHBondContact O-CB 3.48Å; H516-F520 PolarHBondContact O-N 3.05Å; L517-F520 PolarHBondContact O-N 2.99Å; F520-Y522 VanDerWaalsContact C-N 3.35Å; F520-Y522 PolarHBondContact O-N 3.28Å; F520-V523 PolarHBondContact O-N 2.98Å; F520-F524 WeakPolarHBondContact O-CB 3.47Å; F520-F524 PolarHBondContact O-N 3.49Å
521	V	96.9	Very high	93.9	Very high	88 Å²	88	70 Å²	70	53%	0.533	33%	0.332	S	S	.	.	H	α-helix	trans	-64.6	-40.8	178.5	173	0	0	0	0	111.2	L517 L518 H519 F524 W525	L517-V521 WeakPolarHBondContact O-CG2 3.46Å; L517-V521 PolarHBondContact O-N 2.99Å; L518-V521 PolarHBondContact O-N 2.71Å; H519-V521 PolarHBondContact O-N 2.99Å; V521-F524 PolarHBondContact O-N 2.92Å; V521-W525 WeakPolarHBondContact O-CB 3.23Å; V521-W525 PolarHBondContact O-N 3Å
522	Y	96.8	Very high	94	Very high	64 Å²	64	68.6 Å²	68.6	25%	0.251	32%	0.32	S	S	.	.	H	α-helix	trans	-58.4	-51.5	175.4	166.7	-103.7	0	0	0	111.4	L518 H519 F520 F524 W525 Q526 L552	L518-Y522 VanDerWaalsContact O-CB 3.29Å; L518-Y522 WeakPolarHBondContact O-CB 3.39Å; L518-Y522 PolarHBondContact O-N 3.43Å; H519-Y522 WeakPolarHBondContact O-CB 3.41Å; H519-Y522 PolarHBondContact O-N 3.18Å; F520-Y522 VanDerWaalsContact C-N 3.35Å; F520-Y522 PolarHBondContact O-N 3.28Å; Y522-F524 PolarHBondContact O-N 2.89Å; Y522-W525 PolarHBondContact O-N 3.27Å; Y522-Q526 VanDerWaalsContact CZ-OE1 3.23Å; Y522-Q526 WeakPolarHBondContact O-CB 3.34Å; Y522-Q526 PolarHBondContact O-N 3.14Å; Y522-Q526 PolarHBondContact OH-OE1 2.83Å; Y522-L552 HydrophobicContact CE2-CD2 4.34Å
523	V	96.7	Very high	93.9	Very high	1 Å²	1	68.1 Å²	68.1	1%	0.006	32%	0.32	C	S	.	.	H	α-helix	trans	-62.7	-42.9	178.8	171.9	0	0	0	0	111.2	V485 M486 H519 F520 T527 Y675	V485-V523 HydrophobicContact CB-CG1 4.23Å; V485-V523 HydrophobicContact CG1-CG1 4.47Å; V485-V523 HydrophobicContact CG1-CG2 4.05Å; M486-V523 HydrophobicContact CG-CB 4.32Å; M486-V523 HydrophobicContact CG-CG1 3.86Å; H519-V523 WeakPolarHBondContact O-CG2 3.42Å; H519-V523 PolarHBondContact O-N 3.27Å; F520-V523 PolarHBondContact O-N 2.98Å; V523-T527 VanDerWaalsContact O-CB 3.28Å; V523-T527 WeakPolarHBondContact O-CB 3.44Å; V523-T527 PolarHBondContact O-N 3.42Å; V523-T527 PolarHBondContact O-OG1 3.44Å; V523-Y675 HydrophobicContact CB-CE1 4.45Å; V523-Y675 HydrophobicContact CG1-CD1 4.46Å; V523-Y675 HydrophobicContact CG1-CE1 3.82Å; V523-Y675 HydrophobicContact CG2-CE1 4.18Å; V523-Y675 PolarHBondContact O-OH 3.46Å
524	F	96.8	Very high	93.6	Very high	114 Å²	114	66.7 Å²	66.7	50%	0.5	31%	0.312	S	S	.	.	H	α-helix	trans	-59.4	-50.7	177	-179	-95.2	0	0	0	111.6	M486 F520 V521 Y522 T527 Y528	M486-F524 HydrophobicContact CE-CD2 4.43Å; M486-F524 HydrophobicContact SD-CB 3.74Å; M486-F524 HydrophobicContact SD-CD2 3.82Å; M486-F524 HydrophobicContact SD-CG 4.29Å; F520-F524 WeakPolarHBondContact O-CB 3.47Å; F520-F524 PolarHBondContact O-N 3.49Å; V521-F524 PolarHBondContact O-N 2.92Å; Y522-F524 PolarHBondContact O-N 2.89Å; F524-T527 PolarHBondContact O-N 3.18Å; F524-Y528 PolarHBondContact O-N 3.04Å
525	W	96.3	Very high	92.9	Very high	178 Å²	178	68.3 Å²	68.3	67%	0.674	31%	0.309	S	S	*	.	H	α-helix	trans	-66.6	-41.9	-179	-168.9	-86.3	0	0	0	112.1	V521 Y522 Y528 F529	V521-W525 WeakPolarHBondContact O-CB 3.23Å; V521-W525 PolarHBondContact O-N 3Å; Y522-W525 PolarHBondContact O-N 3.27Å; W525-Y528 PolarHBondContact O-N 3.35Å; W525-F529 WeakPolarHBondContact O-CB 3.36Å; W525-F529 PolarHBondContact O-N 3.24Å
526	Q	96.6	Very high	92.3	Very high	7 Å²	7	64.8 Å²	64.8	3%	0.033	29%	0.292	C	S	.	.	H	α-helix	trans	-59.3	-48.7	175.4	179.2	171.9	-86.7	0	0	110.9	Y522 Y528 F529 L530 N556 Y675 F683	Y522-Q526 VanDerWaalsContact CZ-OE1 3.23Å; Y522-Q526 WeakPolarHBondContact O-CB 3.34Å; Y522-Q526 PolarHBondContact O-N 3.14Å; Y522-Q526 PolarHBondContact OH-OE1 2.83Å; Q526-Y528 VanDerWaalsContact C-N 3.33Å; Q526-Y528 PolarHBondContact O-N 3.19Å; Q526-F529 WeakPolarHBondContact O-CB 3.26Å; Q526-F529 PolarHBondContact O-N 3.24Å; Q526-F529 VanDerWaalsContact O-N 3.16Å; Q526-L530 HydrophobicContact CG-CD1 3.98Å; Q526-L530 HydrophobicContact CG-CG 4.34Å; Q526-L530 VanDerWaalsContact O-CG 3.28Å; Q526-L530 WeakPolarHBondContact O-CG 3.36Å; Q526-L530 PolarHBondContact O-N 3.45Å; Q526-N556 PolarHBondContact NE2-OD1 3.32Å; Q526-N556 PolarHBondContact OE1-ND2 3.38Å; Q526-Y675 WeakPolarHBondContact CG-OH 3.35Å; Q526-Y675 PolarHBondContact NE2-OH 3.23Å; Q526-F683 HydrophobicContact CG-CE2 3.7Å; Q526-F683 HydrophobicContact CG-CZ 3.88Å
527	T	95.5	Very high	91.6	Very high	12 Å²	12	64.9 Å²	64.9	7%	0.074	29%	0.293	C	S	.	.	H	α-helix	trans	-60.8	-42.9	178.8	-55.6	0	0	0	0	111.5	V479 V523 F524 F529 L530 F531 Y675	V479-T527 HydrophobicContact CB-CG2 4.39Å; V479-T527 HydrophobicContact CG2-CG2 3.95Å; V523-T527 VanDerWaalsContact O-CB 3.28Å; V523-T527 WeakPolarHBondContact O-CB 3.44Å; V523-T527 PolarHBondContact O-N 3.42Å; V523-T527 PolarHBondContact O-OG1 3.44Å; F524-T527 PolarHBondContact O-N 3.18Å; T527-F529 PolarHBondContact O-N 2.85Å; T527-L530 PolarHBondContact O-N 3.14Å; T527-F531 WeakPolarHBondContact O-CB 3.32Å; T527-F531 PolarHBondContact O-N 2.98Å; T527-Y675 PolarHBondContact N-OH 3.47Å; T527-Y675 VanDerWaalsContact OG1-CE2 3.28Å; T527-Y675 WeakPolarHBondContact OG1-CE2 3.4Å; T527-Y675 PolarHBondContact OG1-OH 3.43Å
528	Y	94.4	Very high	90.9	Very high	112 Å²	112	62.4 Å²	62.4	44%	0.439	28%	0.279	S	S	.	.	H	α-helix	trans	-59.1	-46.6	174.2	176.5	-96.3	0	0	0	112.1	F524 W525 Q526 F531 K532	F524-Y528 PolarHBondContact O-N 3.04Å; W525-Y528 PolarHBondContact O-N 3.35Å; Q526-Y528 VanDerWaalsContact C-N 3.33Å; Q526-Y528 PolarHBondContact O-N 3.19Å; Y528-F531 PolarHBondContact O-N 2.94Å; Y528-K532 HydrophobicContact CE1-CD 3.83Å; Y528-K532 HydrophobicContact CE2-CD 4.23Å; Y528-K532 WeakPolarHBondContact O-CB 3.36Å; Y528-K532 PolarHBondContact O-N 3.24Å; Y528-K532 VanDerWaalsContact OH-CD 3.3Å; Y528-K532 WeakPolarHBondContact OH-CD 3.45Å; Y528-K532 PolarHBondContact OH-NZ 2.99Å
529	F	94	Very high	90	Very high	50 Å²	50	57.3 Å²	57.3	22%	0.219	25%	0.252	C	S	.	.	H	α-helix	trans	-60.8	-50.3	178.7	-179.4	-90.9	0	0	0	111.4	W525 Q526 T527 F531 K532 H533 F538 F683 M686	W525-F529 WeakPolarHBondContact O-CB 3.36Å; W525-F529 PolarHBondContact O-N 3.24Å; Q526-F529 WeakPolarHBondContact O-CB 3.26Å; Q526-F529 PolarHBondContact O-N 3.24Å; Q526-F529 VanDerWaalsContact O-N 3.16Å; T527-F529 PolarHBondContact O-N 2.85Å; F529-F531 VanDerWaalsContact C-N 3.32Å; F529-F531 PolarHBondContact O-N 3.26Å; F529-K532 PolarHBondContact O-N 3.12Å; F529-H533 HydrophobicContact CD2-CB 4.29Å; F529-H533 AromaticContact CD2-CD2 3.97Å; F529-H533 HydrophobicContact CE2-CB 4.12Å; F529-H533 HydrophobicContact CZ-CB 4.3Å; F529-H533 WeakPolarHBondContact O-CB 3.41Å; F529-H533 PolarHBondContact O-N 3.32Å; F529-F538 HydrophobicContact CZ-CZ 4.2Å; F529-F683 AromaticContact CD1-CE1 3.75Å; F529-F683 HydrophobicContact CD1-CE1 3.75Å; F529-F683 HydrophobicContact CD1-CZ 4.15Å; F529-F683 AromaticContact CE1-CE1 3.71Å; F529-F683 HydrophobicContact CE1-CE1 3.71Å; F529-M686 HydrophobicContact CE1-CE 3.57Å; F529-M686 HydrophobicContact CE1-SD 3.96Å; F529-M686 HydrophobicContact CZ-CE 3.78Å
530	L	92.2	Very high	89.1	Confident	2 Å²	2	58.3 Å²	58.3	1%	0.01	26%	0.26	C	S	.	.	H	α-helix	trans	-59.6	-41.5	179.4	-67.8	175.9	0	0	0	111.9	Q526 T527 H534 A679 I682 F683	Q526-L530 HydrophobicContact CG-CD1 3.98Å; Q526-L530 HydrophobicContact CG-CG 4.34Å; Q526-L530 VanDerWaalsContact O-CG 3.28Å; Q526-L530 WeakPolarHBondContact O-CG 3.36Å; Q526-L530 PolarHBondContact O-N 3.45Å; T527-L530 PolarHBondContact O-N 3.14Å; L530-H534 WeakPolarHBondContact O-CB 3.46Å; L530-A679 HydrophobicContact CD1-CB 3.73Å; L530-I682 HydrophobicContact CD2-CB 3.87Å; L530-I682 HydrophobicContact CD2-CD1 4.49Å; L530-I682 HydrophobicContact CD2-CG2 3.49Å; L530-I682 VanDerWaalsContact CD2-CG2 3.49Å; L530-F683 HydrophobicContact CD1-CE2 4.35Å; L530-F683 HydrophobicContact CD2-CD1 4.28Å; L530-F683 HydrophobicContact CD2-CD2 4.26Å; L530-F683 HydrophobicContact CD2-CE1 3.91Å; L530-F683 HydrophobicContact CD2-CE2 3.88Å; L530-F683 HydrophobicContact CD2-CG 4.44Å; L530-F683 HydrophobicContact CD2-CZ 3.7Å; L530-F683 HydrophobicContact CG-CE2 4.31Å; L530-F683 HydrophobicContact CG-CZ 4.13Å
531	F	89.8	Confident	88.4	Confident	97 Å²	97	61.7 Å²	61.7	43%	0.425	28%	0.277	S	S	.	.	H	α-helix	trans	-68.7	-48.6	179.9	-172.3	-97.6	0	0	0	112.4	R475 V479 T527 Y528 F529 H534	R475-F531 HydrophobicContact CB-CD2 4.34Å; V479-F531 HydrophobicContact CG2-CB 4.36Å; V479-F531 HydrophobicContact CG2-CD2 3.66Å; V479-F531 HydrophobicContact CG2-CE2 4.32Å; V479-F531 HydrophobicContact CG2-CG 4.28Å; T527-F531 WeakPolarHBondContact O-CB 3.32Å; T527-F531 PolarHBondContact O-N 2.98Å; Y528-F531 PolarHBondContact O-N 2.94Å; F529-F531 VanDerWaalsContact C-N 3.32Å; F529-F531 PolarHBondContact O-N 3.26Å; F531-H534 PolarHBondContact O-ND1 3.1Å
532	K	88.3	Confident	87.8	Confident	107 Å²	107	61.8 Å²	61.8	47%	0.465	27%	0.27	S	S	.	.	H	α-helix	trans	-80.3	-41.9	-172	-174.9	176.7	178.8	-169.7	0	113.3	Y528 F529	Y528-K532 HydrophobicContact CE1-CD 3.83Å; Y528-K532 HydrophobicContact CE2-CD 4.23Å; Y528-K532 WeakPolarHBondContact O-CB 3.36Å; Y528-K532 PolarHBondContact O-N 3.24Å; Y528-K532 VanDerWaalsContact OH-CD 3.3Å; Y528-K532 WeakPolarHBondContact OH-CD 3.45Å; Y528-K532 PolarHBondContact OH-NZ 2.99Å; F529-K532 PolarHBondContact O-N 3.12Å
533	H	87.1	Confident	87.3	Confident	59 Å²	59	64.8 Å²	64.8	27%	0.273	29%	0.285	S	S	.	.	H	α-helix	trans	-102.4	13.9	-168.2	-65.4	-73.2	0	0	0	114.5	F529 R535 V536	F529-H533 HydrophobicContact CD2-CB 4.29Å; F529-H533 AromaticContact CD2-CD2 3.97Å; F529-H533 HydrophobicContact CE2-CB 4.12Å; F529-H533 HydrophobicContact CZ-CB 4.3Å; F529-H533 WeakPolarHBondContact O-CB 3.41Å; F529-H533 PolarHBondContact O-N 3.32Å; H533-R535 PolarHBondContact O-N 2.87Å; H533-V536 HydrophobicContact CB-CG2 4.11Å; H533-V536 PolarHBondContact O-N 2.79Å
534	H	83.1	Confident	86.9	Confident	22 Å²	22	68.3 Å²	68.3	10%	0.102	31%	0.306	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.6	-13.9	179.4	74.4	-73.4	0	0	0	117.7	V470 R475 L530 F531	V470-H534 HydrophobicContact CB-CB 4.01Å; V470-H534 HydrophobicContact CG2-CB 3.97Å; R475-H534 PolarHBondContact NH1-CE1 3.1Å; R475-H534 PolarHBondContact NH1-ND1 3.46Å; R475-H534 PolarHBondContact NH1-NE2 3.36Å; L530-H534 WeakPolarHBondContact O-CB 3.46Å; F531-H534 PolarHBondContact O-ND1 3.1Å
535	R	78.3	Confident	86.6	Confident	103 Å²	103	64.1 Å²	64.1	39%	0.389	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106.5	-4.6	178.7	-62.1	-173.5	-172.6	-161.6	-2.8	113.6	R465 D466 H533 V537	R465-R535 CarbonylContact C-O 3.6Å; R465-R535 WeakPolarHBondContact CA-O 3.15Å; D466-R535 PolarHBondContact N-O 3.31Å; H533-R535 PolarHBondContact O-N 2.87Å; R535-V537 PolarHBondContact O-N 3.49Å
536	V	79.7	Confident	86.3	Confident	20 Å²	20	60.1 Å²	60.1	12%	0.121	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	118.4	-172.3	179.6	0	0	0	0	108.6	F463 H533 F538	F463-V536 HydrophobicContact CD1-CG1 3.64Å; F463-V536 HydrophobicContact CE1-CG1 4.35Å; F463-V536 HydrophobicContact CG-CG1 4.5Å; H533-V536 HydrophobicContact CB-CG2 4.11Å; H533-V536 PolarHBondContact O-N 2.79Å; V536-F538 HydrophobicContact CG1-CD1 4.24Å; V536-F538 HydrophobicContact CG1-CD2 4.22Å; V536-F538 HydrophobicContact CG1-CE1 4.08Å; V536-F538 HydrophobicContact CG1-CE2 4.09Å; V536-F538 HydrophobicContact CG1-CG 4.3Å; V536-F538 HydrophobicContact CG1-CZ 4.01Å
537	V	78	Confident	86.1	Confident	9 Å²	9	66 Å²	66	6%	0.055	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	125.3	167.2	-179.3	0	0	0	0	107.2	S464 D466 R535 K689	S464-V537 PolarHBondContact N-O 2.96Å; S464-V537 PolarHBondContact O-N 2.66Å; S464-V537 VanDerWaalsContact O-O 3.09Å; D466-V537 HydrophobicContact CB-CG2 3.94Å; R535-V537 PolarHBondContact O-N 3.49Å; V537-K689 VanDerWaalsContact CG1-O 3.27Å; V537-K689 WeakPolarHBondContact CG1-O 3.46Å; V537-K689 HydrophobicContact CG2-CB 4.35Å
538	F	79.5	Confident	86	Confident	33 Å²	33	69.4 Å²	69.4	15%	0.145	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	128.1	-177	-59.4	-99.6	0	0	0	109.9	F463 F529 V536 L545 M686 G691	F463-F538 AromaticContact CD1-CD1 3.89Å; F463-F538 HydrophobicContact CD1-CD1 3.89Å; F463-F538 HydrophobicContact CD1-CE1 4.3Å; F463-F538 AromaticContact CE1-CD1 3.53Å; F463-F538 HydrophobicContact CE1-CD1 3.53Å; F463-F538 AromaticContact CE1-CE1 3.76Å; F463-F538 HydrophobicContact CE1-CE1 3.76Å; F529-F538 HydrophobicContact CZ-CZ 4.2Å; V536-F538 HydrophobicContact CG1-CD1 4.24Å; V536-F538 HydrophobicContact CG1-CD2 4.22Å; V536-F538 HydrophobicContact CG1-CE1 4.08Å; V536-F538 HydrophobicContact CG1-CE2 4.09Å; V536-F538 HydrophobicContact CG1-CG 4.3Å; V536-F538 HydrophobicContact CG1-CZ 4.01Å; F538-L545 HydrophobicContact CB-CD2 2.9Å; F538-L545 HydrophobicContact CB-CG 4.36Å; F538-L545 HydrophobicContact CD1-CD1 4.28Å; F538-L545 HydrophobicContact CD1-CD2 3.59Å; F538-L545 HydrophobicContact CD2-CD1 4.44Å; F538-L545 HydrophobicContact CD2-CD2 3.36Å; F538-L545 HydrophobicContact CD2-CG 4.38Å; F538-L545 HydrophobicContact CE1-CD1 4.3Å; F538-L545 HydrophobicContact CE1-CD2 4.33Å; F538-L545 HydrophobicContact CE2-CD1 4.43Å; F538-L545 HydrophobicContact CE2-CD2 4.12Å; F538-L545 HydrophobicContact CG-CD1 4.37Å; F538-L545 HydrophobicContact CG-CD2 3.03Å; F538-L545 HydrophobicContact CG-CG 4.27Å; F538-L545 HydrophobicContact CZ-CD1 4.37Å; F538-M686 HydrophobicContact CE2-CE 3.86Å; F538-G691 PolarHBondContact O-N 3.01Å
539	N	76.8	Confident	85.9	Confident	14 Å²	14	64.2 Å²	64.2	8%	0.075	30%	0.297	C	S	.	.			trans	-109.1	4.4	-178	-63.2	-33.7	0	0	0	113.1	C461 Y462 S464 V693	C461-N539 PolarHBondContact O-ND2 3Å; Y462-N539 PolarHBondContact O-N 2.88Å; S464-N539 PolarHBondContact OG-ND2 3.27Å; N539-V693 VanDerWaalsContact CG-CG2 3.42Å; N539-V693 WeakPolarHBondContact ND2-CG2 3.26Å; N539-V693 WeakPolarHBondContact OD1-CG2 3.45Å
540	V	78.2	Confident	85.9	Confident	58 Å²	58	64.5 Å²	64.5	35%	0.352	30%	0.304	S	S	.	.	S	Bend	trans	-122.4	146.6	-169.5	179	0	0	0	0	109.2	Y462 K542	Y462-V540 VanDerWaalsContact CA-CG2 3.49Å; Y462-V540 HydrophobicContact CD1-CB 4.42Å; Y462-V540 HydrophobicContact CD1-CG1 4.29Å; Y462-V540 HydrophobicContact CD1-CG2 3.35Å; Y462-V540 HydrophobicContact CE1-CG2 4.26Å; Y462-V540 HydrophobicContact CG-CG2 3.89Å; Y462-V540 WeakPolarHBondContact O-CG2 3.37Å; V540-K542 PolarHBondContact O-N 3.41Å
541	Q	82.1	Confident	86.1	Confident	146 Å²	146	69.6 Å²	69.6	68%	0.682	33%	0.328	S	S	*	.	S	Bend	trans	47.1	46.8	-179.9	-69.4	177	-12	0	0	111.8	F543 V544 L545	Q541-F543 PolarHBondContact O-N 3.15Å; Q541-F543 VanDerWaalsContact O-N 3.07Å; Q541-V544 HydrophobicContact CB-CB 4.35Å; Q541-V544 PolarHBondContact O-N 2.93Å; Q541-L545 PolarHBondContact O-N 2.97Å
542	K	84.3	Confident	86.4	Confident	89 Å²	89	67.2 Å²	67.2	39%	0.387	32%	0.319	S	S	.	.	H	α-helix	trans	-49.6	-42.8	-169.6	-62.1	-179.8	-175.4	-176.9	0	111.9	V540 R546 V690	V540-K542 PolarHBondContact O-N 3.41Å; K542-R546 WeakPolarHBondContact O-CB 3.22Å; K542-R546 WeakPolarHBondContact O-CG 3.36Å; K542-R546 PolarHBondContact O-N 3.35Å; K542-V690 HydrophobicContact CB-CG1 4.23Å; K542-V690 HydrophobicContact CG-CG1 4.45Å
543	F	84.9	Confident	86.8	Confident	128 Å²	128	62.6 Å²	62.6	56%	0.561	30%	0.301	S	S	*	.	H	α-helix	trans	-62.1	-55.9	177.9	-179.8	-96.8	0	0	0	113.1	F450 Q541 L545 R546 F547	F450-F543 HydrophobicContact CD1-CE2 4.49Å; F450-F543 HydrophobicContact CE1-CE2 4.21Å; F450-F543 HydrophobicContact CE1-CZ 4.16Å; F450-F543 HydrophobicContact CZ-CE1 4.48Å; F450-F543 HydrophobicContact CZ-CZ 4.24Å; Q541-F543 PolarHBondContact O-N 3.15Å; Q541-F543 VanDerWaalsContact O-N 3.07Å; F543-L545 VanDerWaalsContact C-N 3.26Å; F543-L545 PolarHBondContact O-N 3.43Å; F543-R546 PolarHBondContact O-N 2.76Å; F543-F547 PolarHBondContact O-N 3.12Å
544	V	89.5	Confident	87.2	Confident	74 Å²	74	63.2 Å²	63.2	45%	0.448	31%	0.308	S	S	.	.	H	α-helix	trans	-59.2	-43	-177.9	177.2	0	0	0	0	110.3	Q541 F547 L548	Q541-V544 HydrophobicContact CB-CB 4.35Å; Q541-V544 PolarHBondContact O-N 2.93Å; V544-F547 WeakPolarHBondContact O-CB 3.36Å; V544-F547 PolarHBondContact O-N 3.47Å; V544-L548 HydrophobicContact CG1-CD1 4.09Å; V544-L548 HydrophobicContact CG1-CG 4.45Å; V544-L548 VanDerWaalsContact O-CG 3.31Å; V544-L548 WeakPolarHBondContact O-CG 3.45Å; V544-L548 PolarHBondContact O-N 3.45Å
545	L	89.9	Confident	87.8	Confident	27 Å²	27	63.3 Å²	63.3	14%	0.141	31%	0.313	C	S	.	.	H	α-helix	trans	-71.8	-39.6	-179.3	-175	72.8	0	0	0	113.1	F538 Q541 F543 F547 L548 L549 V690	F538-L545 HydrophobicContact CB-CD2 2.9Å; F538-L545 HydrophobicContact CB-CG 4.36Å; F538-L545 HydrophobicContact CD1-CD1 4.28Å; F538-L545 HydrophobicContact CD1-CD2 3.59Å; F538-L545 HydrophobicContact CD2-CD1 4.44Å; F538-L545 HydrophobicContact CD2-CD2 3.36Å; F538-L545 HydrophobicContact CD2-CG 4.38Å; F538-L545 HydrophobicContact CE1-CD1 4.3Å; F538-L545 HydrophobicContact CE1-CD2 4.33Å; F538-L545 HydrophobicContact CE2-CD1 4.43Å; F538-L545 HydrophobicContact CE2-CD2 4.12Å; F538-L545 HydrophobicContact CG-CD1 4.37Å; F538-L545 HydrophobicContact CG-CD2 3.03Å; F538-L545 HydrophobicContact CG-CG 4.27Å; F538-L545 HydrophobicContact CZ-CD1 4.37Å; Q541-L545 PolarHBondContact O-N 2.97Å; F543-L545 VanDerWaalsContact C-N 3.26Å; F543-L545 PolarHBondContact O-N 3.43Å; L545-F547 VanDerWaalsContact C-N 3.25Å; L545-F547 PolarHBondContact O-N 3.18Å; L545-L548 PolarHBondContact O-N 3.03Å; L545-L549 HydrophobicContact CD1-CD1 4.3Å; L545-L549 HydrophobicContact CD1-CG 4.26Å; L545-L549 HydrophobicContact CD2-CD1 4.28Å; L545-L549 HydrophobicContact CG-CD1 3.9Å; L545-L549 HydrophobicContact CG-CG 4.25Å; L545-L549 WeakPolarHBondContact O-CB 3.42Å; L545-L549 WeakPolarHBondContact O-CG 3.23Å; L545-L549 PolarHBondContact O-N 3.32Å; L545-V690 HydrophobicContact CD2-CG1 3.99Å; L545-V690 HydrophobicContact CD2-CG2 3.81Å; L545-V690 HydrophobicContact CG-CG2 4.26Å
546	R	89.8	Confident	88.7	Confident	93 Å²	93	58.5 Å²	58.5	35%	0.351	30%	0.295	S	S	.	.	H	α-helix	trans	-56.9	-44.7	171.5	-82	176.2	-176.8	-163.6	0.4	110.3	K542 F543 C550 F687 V690	K542-R546 WeakPolarHBondContact O-CB 3.22Å; K542-R546 WeakPolarHBondContact O-CG 3.36Å; K542-R546 PolarHBondContact O-N 3.35Å; F543-R546 PolarHBondContact O-N 2.76Å; R546-C550 WeakPolarHBondContact O-CB 3.46Å; R546-C550 PolarHBondContact O-N 2.91Å; R546-F687 HydrophobicContact CB-CD2 3.95Å; R546-F687 HydrophobicContact CB-CE2 3.68Å; R546-F687 HydrophobicContact CG-CD2 4.08Å; R546-F687 HydrophobicContact CG-CE2 3.96Å; R546-F687 VanDerWaalsContact O-CD2 3.22Å; R546-F687 WeakPolarHBondContact O-CD2 3.24Å; R546-F687 WeakPolarHBondContact O-CE2 3.32Å; R546-V690 HydrophobicContact CG-CB 3.89Å; R546-V690 HydrophobicContact CG-CG1 3.9Å; R546-V690 HydrophobicContact CG-CG2 4.36Å; R546-V690 PolarHBondContact NE-O 2.95Å; R546-V690 PolarHBondContact NH2-O 3.48Å
547	F	92.7	Very high	89.4	Confident	130 Å²	130	61.6 Å²	61.6	57%	0.57	31%	0.311	S	S	*	.	H	α-helix	trans	-59	-48.7	174.5	177.3	-94.1	0	0	0	112.1	F543 V544 L545 C550 H551	F543-F547 PolarHBondContact O-N 3.12Å; V544-F547 WeakPolarHBondContact O-CB 3.36Å; V544-F547 PolarHBondContact O-N 3.47Å; L545-F547 VanDerWaalsContact C-N 3.25Å; L545-F547 PolarHBondContact O-N 3.18Å; F547-C550 PolarHBondContact O-N 3.15Å; F547-H551 WeakPolarHBondContact O-CB 3.49Å; F547-H551 PolarHBondContact O-N 3.05Å
548	L	93.6	Very high	90.2	Very high	85 Å²	85	64.8 Å²	64.8	45%	0.445	33%	0.333	S	S	.	.	H	α-helix	trans	-64.2	-43.2	-179.3	-70.5	173.8	0	0	0	113.1	V544 L545 H551 L552	V544-L548 HydrophobicContact CG1-CD1 4.09Å; V544-L548 HydrophobicContact CG1-CG 4.45Å; V544-L548 VanDerWaalsContact O-CG 3.31Å; V544-L548 WeakPolarHBondContact O-CG 3.45Å; V544-L548 PolarHBondContact O-N 3.45Å; L545-L548 PolarHBondContact O-N 3.03Å; L548-H551 PolarHBondContact O-N 3.2Å; L548-L552 WeakPolarHBondContact O-CG 3.23Å; L548-L552 PolarHBondContact O-N 3.43Å
549	L	93.1	Very high	90.9	Very high	3 Å²	3	65.5 Å²	65.5	2%	0.016	34%	0.336	C	S	.	.	H	α-helix	trans	-69.1	-38.2	177.9	-67.9	170.8	0	0	0	111.6	L545 L552 A553 F683 M686 F687 V690	L545-L549 HydrophobicContact CD1-CD1 4.3Å; L545-L549 HydrophobicContact CD1-CG 4.26Å; L545-L549 HydrophobicContact CD2-CD1 4.28Å; L545-L549 HydrophobicContact CG-CD1 3.9Å; L545-L549 HydrophobicContact CG-CG 4.25Å; L545-L549 WeakPolarHBondContact O-CB 3.42Å; L545-L549 WeakPolarHBondContact O-CG 3.23Å; L545-L549 PolarHBondContact O-N 3.32Å; L549-L552 PolarHBondContact O-N 3.06Å; L549-A553 WeakPolarHBondContact O-CB 3.08Å; L549-A553 PolarHBondContact O-N 3.08Å; L549-F683 HydrophobicContact CD2-CD1 3.84Å; L549-F683 HydrophobicContact CD2-CE1 4.37Å; L549-M686 HydrophobicContact CD1-CB 4.14Å; L549-M686 HydrophobicContact CD2-CB 4.23Å; L549-F687 HydrophobicContact CB-CB 3.92Å; L549-V690 HydrophobicContact CD1-CG2 3.49Å; L549-V690 VanDerWaalsContact CD1-CG2 3.49Å
550	C	94.1	Very high	91.6	Very high	55 Å²	55	67.3 Å²	67.3	37%	0.372	34%	0.342	S	S	.	.	H	α-helix	trans	-61.8	-45.5	172.3	-175.4	0	0	0	0	111	R546 F547 L552 A553 V554 F687	R546-C550 WeakPolarHBondContact O-CB 3.46Å; R546-C550 PolarHBondContact O-N 2.91Å; F547-C550 PolarHBondContact O-N 3.15Å; C550-L552 VanDerWaalsContact C-N 3.35Å; C550-L552 PolarHBondContact O-N 3.36Å; C550-A553 PolarHBondContact O-N 3.47Å; C550-V554 WeakPolarHBondContact O-CG2 3.41Å; C550-V554 PolarHBondContact O-N 3.1Å; C550-F687 HydrophobicContact CB-CD2 4.07Å; C550-F687 HydrophobicContact CB-CE2 4.03Å
551	H	96.1	Very high	92.2	Very high	110 Å²	110	69.3 Å²	69.3	51%	0.509	35%	0.35	S	S	.	.	H	α-helix	trans	-58.4	-44.8	175.2	177	73.1	0	0	0	111.9	F547 L548 A553 V554 A555	F547-H551 WeakPolarHBondContact O-CB 3.49Å; F547-H551 PolarHBondContact O-N 3.05Å; L548-H551 PolarHBondContact O-N 3.2Å; H551-A553 PolarHBondContact O-N 3.43Å; H551-V554 PolarHBondContact O-N 2.89Å; H551-A555 VanDerWaalsContact O-CB 3.22Å; H551-A555 WeakPolarHBondContact O-CB 3.33Å; H551-A555 PolarHBondContact O-N 3.18Å
552	L	96.4	Very high	92.7	Very high	47 Å²	47	66.4 Å²	66.4	25%	0.246	34%	0.335	C	S	.	.	H	α-helix	trans	-63.5	-40.1	176	-72.2	166.1	0	0	0	112.1	Y522 L548 L549 C550 N556 F683	Y522-L552 HydrophobicContact CE2-CD2 4.34Å; L548-L552 WeakPolarHBondContact O-CG 3.23Å; L548-L552 PolarHBondContact O-N 3.43Å; L549-L552 PolarHBondContact O-N 3.06Å; C550-L552 VanDerWaalsContact C-N 3.35Å; C550-L552 PolarHBondContact O-N 3.36Å; L552-N556 PolarHBondContact O-N 3.21Å; L552-N556 VanDerWaalsContact O-N 3.16Å; L552-N556 PolarHBondContact O-ND2 3.2Å; L552-F683 HydrophobicContact CB-CB 4.39Å; L552-F683 HydrophobicContact CB-CD1 3.97Å; L552-F683 HydrophobicContact CB-CD2 3.79Å; L552-F683 HydrophobicContact CB-CE1 4.15Å; L552-F683 HydrophobicContact CB-CE2 3.98Å; L552-F683 HydrophobicContact CB-CG 3.8Å; L552-F683 HydrophobicContact CB-CZ 4.15Å; L552-F683 HydrophobicContact CD1-CD1 4.01Å; L552-F683 HydrophobicContact CD1-CE1 3.6Å; L552-F683 HydrophobicContact CD1-CZ 3.92Å; L552-F683 HydrophobicContact CD2-CZ 4.45Å; L552-F683 HydrophobicContact CG-CE1 4.41Å; L552-F683 HydrophobicContact CG-CZ 4.41Å
553	A	94.8	Very high	93	Very high	9 Å²	9	62.8 Å²	62.8	7%	0.074	32%	0.321	C	S	.	.	H	α-helix	trans	-62.5	-48.7	175.2	0	0	0	0	0	111.6	L549 C550 H551 N556 L557 F683	L549-A553 WeakPolarHBondContact O-CB 3.08Å; L549-A553 PolarHBondContact O-N 3.08Å; C550-A553 PolarHBondContact O-N 3.47Å; H551-A553 PolarHBondContact O-N 3.43Å; A553-N556 PolarHBondContact O-N 3.19Å; A553-L557 PolarHBondContact O-N 2.99Å; A553-L557 VanDerWaalsContact O-N 3.1Å; A553-F683 HydrophobicContact CB-CB 4Å
554	V	96.2	Very high	93.1	Very high	72 Å²	72	57 Å²	57	44%	0.436	30%	0.295	S	S	.	.	H	α-helix	trans	-65.1	-40.2	178.5	174.2	0	0	0	0	111.6	C550 H551 N556 L557 C558	C550-V554 WeakPolarHBondContact O-CG2 3.41Å; C550-V554 PolarHBondContact O-N 3.1Å; H551-V554 PolarHBondContact O-N 2.89Å; V554-N556 VanDerWaalsContact C-N 3.29Å; V554-N556 PolarHBondContact O-N 3.49Å; V554-L557 WeakPolarHBondContact O-CB 3.36Å; V554-L557 PolarHBondContact O-N 2.95Å; V554-L557 VanDerWaalsContact O-N 3.1Å; V554-C558 PolarHBondContact O-N 3.45Å; V554-C558 PolarHBondContact O-SG 3.25Å; V554-C558 VanDerWaalsContact O-SG 3.34Å
555	A	96.8	Very high	92.9	Very high	24 Å²	24	57.6 Å²	57.6	20%	0.198	30%	0.299	C	S	.	.	H	α-helix	trans	-58.8	-42	176.9	0	0	0	0	0	111.5	H551 C558 Q559	H551-A555 VanDerWaalsContact O-CB 3.22Å; H551-A555 WeakPolarHBondContact O-CB 3.33Å; H551-A555 PolarHBondContact O-N 3.18Å; A555-C558 PolarHBondContact O-N 3.2Å; A555-Q559 WeakPolarHBondContact O-CG 3.36Å; A555-Q559 PolarHBondContact O-N 3.46Å
556	N	96.1	Very high	92.7	Very high	2 Å²	2	59 Å²	59	1%	0.011	31%	0.307	C	S	.	.	H	α-helix	trans	-66.9	-38.3	174.7	-78.3	-75.7	0	0	0	112.3	Q526 L552 A553 V554 C558 Q559 W560 S676 A679	Q526-N556 PolarHBondContact NE2-OD1 3.32Å; Q526-N556 PolarHBondContact OE1-ND2 3.38Å; L552-N556 PolarHBondContact O-N 3.21Å; L552-N556 VanDerWaalsContact O-N 3.16Å; L552-N556 PolarHBondContact O-ND2 3.2Å; A553-N556 PolarHBondContact O-N 3.19Å; V554-N556 VanDerWaalsContact C-N 3.29Å; V554-N556 PolarHBondContact O-N 3.49Å; N556-C558 VanDerWaalsContact C-N 3.33Å; N556-C558 PolarHBondContact O-N 3.09Å; N556-Q559 PolarHBondContact O-N 3.48Å; N556-W560 PolarHBondContact O-N 2.99Å; N556-S676 WeakPolarHBondContact CB-O 3.43Å; N556-S676 WeakPolarHBondContact O-CB 3.12Å; N556-A679 HydrophobicContact CB-CB 4.48Å; N556-A679 WeakPolarHBondContact OD1-CB 3.17Å
557	L	93.5	Very high	92.4	Very high	86 Å²	86	55.3 Å²	55.3	45%	0.45	29%	0.294	S	S	.	.	H	α-helix	trans	-63	-37.7	172.4	-68.9	175.8	0	0	0	112.5	A553 V554 W560 L561	A553-L557 PolarHBondContact O-N 2.99Å; A553-L557 VanDerWaalsContact O-N 3.1Å; V554-L557 WeakPolarHBondContact O-CB 3.36Å; V554-L557 PolarHBondContact O-N 2.95Å; V554-L557 VanDerWaalsContact O-N 3.1Å; L557-W560 WeakPolarHBondContact O-CB 3.42Å; L557-W560 PolarHBondContact O-N 2.78Å; L557-L561 PolarHBondContact O-N 3.07Å
558	C	95.9	Very high	91.8	Very high	76 Å²	76	51 Å²	51	51%	0.514	28%	0.276	S	S	.	.	H	α-helix	trans	-65.7	-39.8	173.7	-66.3	0	0	0	0	112	V554 A555 N556 L561 K562	V554-C558 PolarHBondContact O-N 3.45Å; V554-C558 PolarHBondContact O-SG 3.25Å; V554-C558 VanDerWaalsContact O-SG 3.34Å; A555-C558 PolarHBondContact O-N 3.2Å; N556-C558 VanDerWaalsContact C-N 3.33Å; N556-C558 PolarHBondContact O-N 3.09Å; C558-L561 PolarHBondContact O-N 3.49Å; C558-K562 WeakPolarHBondContact O-CB 3.32Å; C558-K562 PolarHBondContact O-N 2.91Å
559	Q	94.1	Very high	90.9	Very high	48 Å²	48	50 Å²	50	22%	0.224	29%	0.287	C	S	.	.	H	α-helix	trans	-65.3	-40	175.3	-69.3	-59.8	-13.4	0	0	112.1	A555 N556 K562 T563	A555-Q559 WeakPolarHBondContact O-CG 3.36Å; A555-Q559 PolarHBondContact O-N 3.46Å; N556-Q559 PolarHBondContact O-N 3.48Å; Q559-K562 PolarHBondContact O-N 3.12Å; Q559-T563 WeakPolarHBondContact O-CB 3.25Å; Q559-T563 PolarHBondContact O-N 2.98Å; Q559-T563 PolarHBondContact O-OG1 3.46Å
560	W	92.6	Very high	89.9	Confident	52 Å²	52	53 Å²	53	20%	0.197	31%	0.308	C	S	.	.	H	α-helix	trans	-57.2	-52.6	172.8	170.1	71.9	0	0	0	111.2	N556 L557 K562 T563 I564 L677	N556-W560 PolarHBondContact O-N 2.99Å; L557-W560 WeakPolarHBondContact O-CB 3.42Å; L557-W560 PolarHBondContact O-N 2.78Å; W560-K562 PolarHBondContact O-N 3.04Å; W560-T563 PolarHBondContact O-N 3.06Å; W560-I564 HydrophobicContact CD2-CD1 3.96Å; W560-I564 HydrophobicContact CG-CD1 4.41Å; W560-I564 HydrophobicContact CH2-CD1 4.2Å; W560-I564 HydrophobicContact CZ2-CD1 3.5Å; W560-I564 WeakPolarHBondContact O-CG1 3.44Å; W560-I564 PolarHBondContact O-N 3.01Å; W560-I564 VanDerWaalsContact O-N 3.09Å; W560-L677 HydrophobicContact CD2-CD2 4.09Å; W560-L677 HydrophobicContact CG-CD2 4.02Å; W560-L677 HydrophobicContact CG-CG 4.23Å
561	L	90.6	Very high	88.6	Confident	99 Å²	99	52.3 Å²	52.3	52%	0.518	30%	0.299	S	S	.	.	H	α-helix	trans	-61.3	-44.5	178.9	-178.4	62	0	0	0	112.3	L557 C558 T563 I564 V565	L557-L561 PolarHBondContact O-N 3.07Å; C558-L561 PolarHBondContact O-N 3.49Å; L561-T563 VanDerWaalsContact C-N 3.33Å; L561-T563 PolarHBondContact O-N 2.88Å; L561-I564 PolarHBondContact O-N 3.32Å; L561-V565 WeakPolarHBondContact O-CG2 3.43Å; L561-V565 PolarHBondContact O-N 2.9Å; L561-V565 VanDerWaalsContact O-N 3.09Å
562	K	92.7	Very high	86.8	Confident	86 Å²	86	51.5 Å²	51.5	37%	0.374	30%	0.304	S	S	.	.	H	α-helix	trans	-57.6	-46.8	175.9	180	-167.8	168.6	-170.5	0	111.2	C558 Q559 W560 I564 V565 D566	C558-K562 WeakPolarHBondContact O-CB 3.32Å; C558-K562 PolarHBondContact O-N 2.91Å; Q559-K562 PolarHBondContact O-N 3.12Å; W560-K562 PolarHBondContact O-N 3.04Å; K562-I564 VanDerWaalsContact C-N 3.31Å; K562-I564 PolarHBondContact O-N 3.06Å; K562-V565 PolarHBondContact O-N 3.17Å; K562-V565 VanDerWaalsContact O-N 3.14Å; K562-D566 PolarHBondContact O-N 2.92Å
563	T	90.1	Very high	84.6	Confident	12 Å²	12	51.5 Å²	51.5	7%	0.074	32%	0.315	C	S	.	.	H	α-helix	trans	-62.4	-39.5	-178.3	-55.1	0	0	0	0	111.5	Q559 W560 L561 D566 E567 F669 A672 I673	Q559-T563 WeakPolarHBondContact O-CB 3.25Å; Q559-T563 PolarHBondContact O-N 2.98Å; Q559-T563 PolarHBondContact O-OG1 3.46Å; W560-T563 PolarHBondContact O-N 3.06Å; L561-T563 VanDerWaalsContact C-N 3.33Å; L561-T563 PolarHBondContact O-N 2.88Å; T563-D566 PolarHBondContact O-N 2.71Å; T563-E567 WeakPolarHBondContact O-CB 3.31Å; T563-E567 PolarHBondContact O-N 3.01Å; T563-F669 HydrophobicContact CG2-CD1 3.8Å; T563-A672 HydrophobicContact CG2-CB 3.81Å; T563-I673 HydrophobicContact CG2-CD1 4.27Å; T563-I673 HydrophobicContact CG2-CG1 3.63Å
564	I	86.5	Confident	82.2	Confident	7 Å²	7	54.8 Å²	54.8	4%	0.036	33%	0.329	C	S	.	.	H	α-helix	trans	-60.9	-45.7	173.8	-69.7	170.6	0	0	0	111	W560 L561 K562 E567 I568 I673 H912 P916	W560-I564 HydrophobicContact CD2-CD1 3.96Å; W560-I564 HydrophobicContact CG-CD1 4.41Å; W560-I564 HydrophobicContact CH2-CD1 4.2Å; W560-I564 HydrophobicContact CZ2-CD1 3.5Å; W560-I564 WeakPolarHBondContact O-CG1 3.44Å; W560-I564 PolarHBondContact O-N 3.01Å; W560-I564 VanDerWaalsContact O-N 3.09Å; L561-I564 PolarHBondContact O-N 3.32Å; K562-I564 VanDerWaalsContact C-N 3.31Å; K562-I564 PolarHBondContact O-N 3.06Å; I564-E567 PolarHBondContact O-N 3.4Å; I564-I568 HydrophobicContact CG2-CD1 3.77Å; I564-I568 HydrophobicContact CG2-CG1 4.47Å; I564-I568 VanDerWaalsContact O-CG1 3.27Å; I564-I568 WeakPolarHBondContact O-CG1 3.39Å; I564-I568 PolarHBondContact O-N 2.78Å; I564-I673 HydrophobicContact CG1-CD1 4.25Å; I564-H912 HydrophobicContact CG2-CB 4.46Å; I564-P916 HydrophobicContact CD1-CG 4.1Å; I564-P916 HydrophobicContact CG1-CG 4.23Å
565	V	86.2	Confident	79.6	Confident	86 Å²	86	60.4 Å²	60.4	52%	0.521	35%	0.35	S	S	.	.	H	α-helix	trans	-64.1	-43.4	179	173.9	0	0	0	0	111.2	L561 K562 E567 I568 G569	L561-V565 WeakPolarHBondContact O-CG2 3.43Å; L561-V565 PolarHBondContact O-N 2.9Å; L561-V565 VanDerWaalsContact O-N 3.09Å; K562-V565 PolarHBondContact O-N 3.17Å; K562-V565 VanDerWaalsContact O-N 3.14Å; V565-E567 VanDerWaalsContact C-N 3.31Å; V565-E567 PolarHBondContact O-N 3.37Å; V565-I568 PolarHBondContact O-N 3.06Å; V565-G569 PolarHBondContact O-N 3.43Å
566	D	84.9	Confident	76.7	Confident	58 Å²	58	65.5 Å²	65.5	31%	0.31	37%	0.37	S	S	.	.	H	α-helix	trans	-60.8	-41.5	176	-72.5	-8.5	0	0	0	110.9	K562 T563 G569 S570 F669	K562-D566 PolarHBondContact O-N 2.92Å; T563-D566 PolarHBondContact O-N 2.71Å; D566-G569 PolarHBondContact O-N 3.23Å; D566-S570 WeakPolarHBondContact O-CB 3.41Å; D566-S570 PolarHBondContact O-N 3.28Å; D566-S570 PolarHBondContact O-OG 2.89Å; D566-F669 HydrophobicContact CB-CE1 4.22Å
567	E	83.7	Confident	73.9	Confident	15 Å²	15	71.4 Å²	71.4	7%	0.07	40%	0.398	C	S	.	.	H	α-helix	trans	-65.3	-48.1	178.1	-172.5	177.4	173.9	0	0	111.8	T563 I564 V565 G569 S570 E571 F669 I673 K890 H912	T563-E567 WeakPolarHBondContact O-CB 3.31Å; T563-E567 PolarHBondContact O-N 3.01Å; I564-E567 PolarHBondContact O-N 3.4Å; V565-E567 VanDerWaalsContact C-N 3.31Å; V565-E567 PolarHBondContact O-N 3.37Å; E567-G569 VanDerWaalsContact C-N 3.27Å; E567-G569 PolarHBondContact O-N 2.87Å; E567-S570 PolarHBondContact O-N 3.02Å; E567-S570 VanDerWaalsContact O-N 3.14Å; E567-S570 PolarHBondContact O-OG 2.84Å; E567-E571 PolarHBondContact O-N 3.03Å; E567-F669 HydrophobicContact CB-CD1 4.05Å; E567-F669 HydrophobicContact CB-CD2 3.99Å; E567-F669 HydrophobicContact CB-CE1 4.16Å; E567-F669 HydrophobicContact CB-CE2 4.12Å; E567-F669 HydrophobicContact CB-CG 3.97Å; E567-F669 HydrophobicContact CB-CZ 4.2Å; E567-F669 HydrophobicContact CG-CB 4.31Å; E567-F669 HydrophobicContact CG-CD2 3.61Å; E567-F669 HydrophobicContact CG-CE2 3.97Å; E567-F669 HydrophobicContact CG-CG 3.94Å; E567-I673 WeakPolarHBondContact OE2-CD1 3.44Å; E567-K890 IonicContact OE1-NZ 3.69Å; E567-K890 PolarHBondContact OE1-NZ 3.18Å; E567-H912 IonicContact OE1-CD2 3.56Å; E567-H912 IonicContact OE1-NE2 2.92Å
568	I	79.6	Confident	71.1	Confident	38 Å²	38	75 Å²	75	20%	0.195	42%	0.417	C	S	.	.	H	α-helix	trans	-58.3	-42.6	176.5	-66.9	164.8	0	0	0	110.6	I564 V565 S570 H912	I564-I568 HydrophobicContact CG2-CD1 3.77Å; I564-I568 HydrophobicContact CG2-CG1 4.47Å; I564-I568 VanDerWaalsContact O-CG1 3.27Å; I564-I568 WeakPolarHBondContact O-CG1 3.39Å; I564-I568 PolarHBondContact O-N 2.78Å; V565-I568 PolarHBondContact O-N 3.06Å; I568-S570 VanDerWaalsContact C-N 3.31Å; I568-S570 PolarHBondContact O-N 3.19Å; I568-H912 HydrophobicContact CD1-CB 3.72Å; I568-H912 HydrophobicContact CG1-CB 3.41Å; I568-H912 VanDerWaalsContact CG1-CB 3.41Å; I568-H912 VanDerWaalsContact CG1-CG 3.4Å
569	G	74.5	Confident	68.2	Low	66 Å²	66	75.7 Å²	75.7	68%	0.68	41%	0.414	S	S	*	.	H	α-helix	trans	-70	-26	179.5	0	0	0	0	0	114	V565 D566 E567	V565-G569 PolarHBondContact O-N 3.43Å; D566-G569 PolarHBondContact O-N 3.23Å; E567-G569 VanDerWaalsContact C-N 3.27Å; E567-G569 PolarHBondContact O-N 2.87Å
570	S	71.9	Confident	65.1	Low	66 Å²	66	76.6 Å²	76.6	46%	0.462	42%	0.424	S	S	.	.	H	α-helix	trans	-79.6	-17.4	179.4	73.2	0	0	0	0	114.1	D566 E567 I568 F669	D566-S570 WeakPolarHBondContact O-CB 3.41Å; D566-S570 PolarHBondContact O-N 3.28Å; D566-S570 PolarHBondContact O-OG 2.89Å; E567-S570 PolarHBondContact O-N 3.02Å; E567-S570 VanDerWaalsContact O-N 3.14Å; E567-S570 PolarHBondContact O-OG 2.84Å; I568-S570 VanDerWaalsContact C-N 3.31Å; I568-S570 PolarHBondContact O-N 3.19Å; S570-F669 WeakPolarHBondContact OG-CE2 3.28Å
571	E	68	Low	62.3	Low	40 Å²	40	80.5 Å²	80.5	19%	0.187	45%	0.449	C	S	.	.	S	Bend	trans	-83.8	122	-175.4	-165.3	-178.5	-132.3	0	0	111.3	E567 G573 K890 K908 H912	E567-E571 PolarHBondContact O-N 3.03Å; E571-G573 PolarHBondContact O-N 2.89Å; E571-K890 VanDerWaalsContact OE1-CE 3.24Å; E571-K890 WeakPolarHBondContact OE1-CE 3.43Å; E571-K908 PolarHBondContact O-NZ 3.11Å; E571-K908 VanDerWaalsContact OE2-CD 3.31Å; E571-K908 WeakPolarHBondContact OE2-CD 3.37Å; E571-K908 WeakPolarHBondContact OE2-CE 3.44Å; E571-K908 IonicContact OE2-NZ 2.74Å; E571-K908 PolarHBondContact OE2-NZ 3.02Å; E571-K908 VanDerWaalsContact OE2-NZ 3.16Å; E571-H912 IonicContact OE2-CE1 3.96Å; E571-H912 PolarHBondContact OE2-CE1 3.4Å
572	P	58.6	Low	59.7	Low	92 Å²	92	78.3 Å²	78.3	60%	0.597	44%	0.442	S	S	*	.	P	Polyproline II helix	trans	-57.8	139.5	-178.5	22.1	-31.3	0	0	0	111.2	K908	P572-K908 PolarHBondContact O-NZ 3.48Å
573	G	48.7	Very low	56.9	Low	48 Å²	48	76.8 Å²	76.8	50%	0.495	45%	0.445	S	S	.	.	P	Polyproline II helix	trans	-59.2	138	174.5	0	0	0	0	0	110.2	E571 E575 E576	E571-G573 PolarHBondContact O-N 2.89Å; G573-E575 PolarHBondContact O-N 3.04Å; G573-E576 PolarHBondContact O-N 3.3Å
574	H	45.4	Very low	54.2	Low	78 Å²	78	81.9 Å²	81.9	36%	0.361	47%	0.471	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.5	5.8	179	-83.4	-73.5	0	0	0	114.8	N894 S904 K908	H574-N894 PolarHBondContact CE1-ND2 3.29Å; H574-N894 PolarHBondContact NE2-ND2 3.14Å; H574-N894 PolarHBondContact NE2-OD1 3.2Å; H574-S904 PolarHBondContact CD2-OG 3.09Å; H574-K908 WeakPolarHBondContact CD2-CE 3.46Å
575	E	40.8	Very low	51.4	Low	189 Å²	189	84.4 Å²	84.4	88%	0.883	49%	0.487	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.3	-1.6	178.1	-64.2	-174.7	163.7	0	0	113.3	G573	G573-E575 PolarHBondContact O-N 3.04Å
576	E	36.8	Very low	48.8	Very low	132 Å²	132	86.3 Å²	86.3	62%	0.617	49%	0.488	S	S	*	.			trans	-103.4	8.1	-176.7	-117.5	174.2	-174.9	0	0	116.2	G573 L578 I579	G573-E576 PolarHBondContact O-N 3.3Å; E576-L578 PolarHBondContact O-N 3.44Å; E576-I579 PolarHBondContact O-N 3.32Å
577	E	36.7	Very low	46.1	Very low	126 Å²	126	88.1 Å²	88.1	59%	0.589	50%	0.503	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.1	29.2	175.5	-150.3	-175.6	177.6	0	0	113.5	R747 R750	E577-R747 IonicContact OE1-NH1 3.48Å; E577-R747 PolarHBondContact OE1-NH1 3.01Å; E577-R750 IonicContact OE1-CZ 2.98Å; E577-R750 IonicContact OE1-NH1 2.73Å; E577-R750 PolarHBondContact OE1-NH1 3.5Å; E577-R750 IonicContact OE1-NH2 3.49Å; E577-R750 PolarHBondContact OE1-NH2 3.38Å
578	L	35.5	Very low	43.7	Very low	161 Å²	161	92.4 Å²	92.4	84%	0.843	53%	0.534	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.6	5.2	170	-103	139.4	0	0	0	113.2	E576	E576-L578 PolarHBondContact O-N 3.44Å
579	I	34.6	Very low	41.5	Very low	91 Å²	91	97.8 Å²	97.8	47%	0.467	56%	0.559	S	S	.	*	S	Bend	trans	-79.8	121.6	169.5	-54.8	176.5	0	0	0	108.6	E576 A583	E576-I579 PolarHBondContact O-N 3.32Å; I579-A583 HydrophobicContact CG2-CB 4.17Å
580	P	29.1	Very low	39.6	Very low	67 Å²	67	101.9 Å²	101.9	44%	0.435	56%	0.555	S	S	.	*			trans	-62.7	145.4	179.9	-13.4	26.2	0	0	0	111.6	S582	P580-S582 PolarHBondContact O-N 2.88Å; P580-S582 PolarHBondContact O-OG 3.3Å
581	D	32.9	Very low	37.6	Very low	133 Å²	133	108 Å²	108	71%	0.711	57%	0.573	S	S	*	*	T	Hydrogen-bonded Turn	trans	-51.7	6.4	-179.2	-72.1	-38.7	0	0	0	117.1
582	S	36.8	Very low	35.9	Very low	53 Å²	53	113.1 Å²	113.1	37%	0.371	60%	0.601	S	S	.	*	T	Hydrogen-bonded Turn	trans	-85.9	-4.4	177	49.7	0	0	0	0	114.8	P580 F615	P580-S582 PolarHBondContact O-N 2.88Å; P580-S582 PolarHBondContact O-OG 3.3Å; S582-F615 WeakPolarHBondContact OG-CE1 3.26Å; S582-F615 WeakPolarHBondContact OG-CE2 3.45Å; S582-F615 WeakPolarHBondContact OG-CZ 3.3Å
583	A	33.8	Very low	34.5	Very low	54 Å²	54	116.4 Å²	116.4	45%	0.446	61%	0.614	S	S	.	*	S	Bend	trans	-103.7	-3.7	-173.8	0	0	0	0	0	115.1	I579 V585	I579-A583 HydrophobicContact CG2-CB 4.17Å; A583-V585 PolarHBondContact O-N 2.85Å; A583-V585 VanDerWaalsContact O-N 3.17Å
584	I	34.2	Very low	33.7	Very low	119 Å²	119	119 Å²	119	61%	0.61	63%	0.631	S	S	*	*			trans	-88.7	80.3	172.9	-52	177.3	0	0	0	108.1	F586	I584-F586 HydrophobicContact CG2-CD2 4.34Å; I584-F586 HydrophobicContact CG2-CE2 3.85Å; I584-F586 HydrophobicContact CG2-CZ 4.09Å
585	V	27.8	Very low	33.2	Very low	61 Å²	61	124.4 Å²	124.4	37%	0.37	65%	0.653	S	S	.	*			trans	-93.1	113.5	169.9	-170.9	0	0	0	0	108.1	A583 Y590	A583-V585 PolarHBondContact O-N 2.85Å; A583-V585 VanDerWaalsContact O-N 3.17Å; V585-Y590 WeakPolarHBondContact CB-OH 3.24Å; V585-Y590 HydrophobicContact CG1-CE1 4.01Å; V585-Y590 HydrophobicContact CG1-CE2 3.91Å; V585-Y590 WeakPolarHBondContact CG1-OH 3.23Å
586	F	30.1	Very low	32.9	Very low	126 Å²	126	122 Å²	122	55%	0.553	65%	0.652	S	S	*	*			trans	-68.3	144.8	173.9	-71.2	-88.5	0	0	0	110.1	I584 S588	I584-F586 HydrophobicContact CG2-CD2 4.34Å; I584-F586 HydrophobicContact CG2-CE2 3.85Å; I584-F586 HydrophobicContact CG2-CZ 4.09Å; F586-S588 PolarHBondContact O-N 2.91Å
587	P	28.3	Very low	32.8	Very low	96 Å²	96	121.8 Å²	121.8	62%	0.623	66%	0.662	S	S	*	*	G	3₁₀ helix	trans	-65.8	5.8	-176.5	-20.1	31.7	0	0	0	116.7	E589 Y590	P587-E589 PolarHBondContact O-N 3.21Å; P587-Y590 HydrophobicContact CB-CD2 4.25Å
588	S	33.3	Very low	32.4	Very low	104 Å²	104	123.3 Å²	123.3	73%	0.727	67%	0.673	S	S	*	*	G	3₁₀ helix	trans	-74.3	-6.9	179.8	64.4	0	0	0	0	114.3	F586	F586-S588 PolarHBondContact O-N 2.91Å
589	E	34.4	Very low	32.3	Very low	152 Å²	152	122.8 Å²	122.8	71%	0.71	67%	0.671	S	S	*	*	G	3₁₀ helix	trans	-104.3	-1	179.3	-77.8	-174.2	155.5	0	0	114.7	P587	P587-E589 PolarHBondContact O-N 3.21Å
590	Y	34	Very low	32.3	Very low	151 Å²	151	123.4 Å²	123.4	59%	0.592	68%	0.684	S	S	*	*	S	Bend	trans	-106.2	-7.1	-174.4	-45	-65.7	0	0	0	115.6	V585 P587	V585-Y590 WeakPolarHBondContact CB-OH 3.24Å; V585-Y590 HydrophobicContact CG1-CE1 4.01Å; V585-Y590 HydrophobicContact CG1-CE2 3.91Å; V585-Y590 WeakPolarHBondContact CG1-OH 3.23Å; P587-Y590 HydrophobicContact CB-CD2 4.25Å
591	F	30.6	Very low	32.5	Very low	195 Å²	195	126.4 Å²	126.4	86%	0.855	70%	0.701	S	S	*	*	S	Bend	trans	-99.1	5.3	-178.1	-160.1	-103.4	0	0	0	114
592	L	31.8	Very low	32.7	Very low	148 Å²	148	126.5 Å²	126.5	78%	0.775	71%	0.706	S	S	*	*	S	Bend	trans	-134.3	62.2	179.6	-77.1	165.7	0	0	0	110.5
593	D	30	Very low	32.3	Very low	160 Å²	160	132.5 Å²	132.5	86%	0.856	73%	0.733	S	S	*	*			trans	-169.3	30.8	154.9	-100.2	-15.7	0	0	0	114.8	K595	D593-K595 VanDerWaalsContact C-N 3.31Å; D593-K595 PolarHBondContact O-N 3.44Å
594	A	31.9	Very low	32.5	Very low	104 Å²	104	138.3 Å²	138.3	86%	0.86	75%	0.751	S	S	*	*			trans	-91.1	61.1	169.4	0	0	0	0	0	111.2
595	K	34.4	Very low	32.4	Very low	190 Å²	190	141.5 Å²	141.5	83%	0.826	76%	0.761	S	S	*	*			trans	-162.3	77.6	167.7	-120.9	178.6	-169.6	178.9	0	112.4	D593	D593-K595 VanDerWaalsContact C-N 3.31Å; D593-K595 PolarHBondContact O-N 3.44Å
596	T	33.9	Very low	32.5	Very low	140 Å²	140	149.7 Å²	149.7	86%	0.859	79%	0.786	S	S	*	*			trans	-174.2	135.5	143.1	15.9	0	0	0	0	111.6
597	P	34.1	Very low	32.7	Very low	126 Å²	126	148.6 Å²	148.6	82%	0.818	79%	0.79	S	S	*	*			trans	-88.5	153	-178.1	34.6	-31.6	0	0	0	113.4
598	L	30.1	Very low	33.1	Very low	158 Å²	158	151.8 Å²	151.8	83%	0.827	80%	0.802	S	S	*	*			trans	-30.8	138	171.3	-124	81.1	0	0	0	116.5
599	N	33.3	Very low	33	Very low	150 Å²	150	150 Å²	150	80%	0.802	80%	0.8	S	S	*	*				-178.3	139.8	126.1	-91.1	-18.7	0	0	0	114
600	S	34	Very low	33	Very low	104 Å²	104	149.4 Å²	149.4	73%	0.727	81%	0.807	S	S	*	*			trans	83.4	98.1	152.9	-60.6	0	0	0	0	121.6
601	T	33.1	Very low	32.8	Very low	130 Å²	130	151.7 Å²	151.7	80%	0.798	83%	0.826	S	S	*	*				28.6	113.6	120.2	-7.5	0	0	0	0	119.6
602	T	36.6	Very low	32.8	Very low	135 Å²	135	147 Å²	147	83%	0.828	82%	0.817	S	S	*	*				178.5	110.2	124	22.8	0	0	0	0	111.3
603	L	28.8	Very low	33.1	Very low	179 Å²	179	146 Å²	146	94%	0.937	82%	0.819	S	S	*	*			trans	-94.1	107.9	172.9	-176.2	76.1	0	0	0	109.1
604	H	37.9	Very low	33.5	Very low	176 Å²	176	144.8 Å²	144.8	82%	0.815	82%	0.818	S	S	*	*			trans	-102.9	126.9	171.9	-116.8	-79.1	0	0	0	111
605	K	31.4	Very low	33.7	Very low	187 Å²	187	145.5 Å²	145.5	81%	0.813	80%	0.802	S	S	*	*			trans	-49.7	133.7	166.6	-84.6	169.9	167.6	171.3	0	111.7
606	Y	30.7	Very low	33.8	Very low	232 Å²	232	141.7 Å²	141.7	91%	0.91	79%	0.79	S	S	*	*			trans	-145.8	121.8	142.4	-116.6	-87.2	0	0	0	111
607	T	34.3	Very low	34.2	Very low	104 Å²	104	141.7 Å²	141.7	64%	0.638	78%	0.784	S	S	*	*			trans	-82.6	151.6	172.8	47.7	0	0	0	0	110.6
608	N	36.5	Very low	34.7	Very low	162 Å²	162	139.4 Å²	139.4	87%	0.866	77%	0.768	S	S	*	*			trans	87.8	112.3	160.8	-53.4	-19.4	0	0	0	117.6
609	G	32.2	Very low	35.5	Very low	66 Å²	66	137.1 Å²	137.1	68%	0.68	76%	0.757	S	S	*	*			trans	117.8	118.2	150.8	0	0	0	0	0	115.1
610	T	32.9	Very low	35.9	Very low	141 Å²	141	131.9 Å²	131.9	87%	0.865	73%	0.729	S	S	*	*			trans	74.3	111.3	161.1	55.1	0	0	0	0	118.7	S612	T610-S612 PolarHBondContact O-N 3.24Å
611	M	30.1	Very low	36.5	Very low	199 Å²	199	128.1 Å²	128.1	98%	0.98	70%	0.704	S	S	*	*			trans	-53.8	120.9	177	-69.4	-178.8	87.2	0	0	112.5
612	S	30.9	Very low	37.1	Very low	97 Å²	97	126.2 Å²	126.2	68%	0.678	69%	0.689	S	S	*	*			trans	-121.6	128.1	154.1	-7	0	0	0	0	106.3	T610 T614	T610-S612 PolarHBondContact O-N 3.24Å; S612-T614 PolarHBondContact O-N 3.32Å
613	P	38.1	Very low	37.3	Very low	127 Å²	127	125.7 Å²	125.7	83%	0.825	68%	0.678	S	S	*	*			trans	-82.2	88.7	178.7	32.6	-28.7	0	0	0	108.4	F615	P613-F615 PolarHBondContact O-N 3.1Å; P613-F615 VanDerWaalsContact O-N 3.14Å
614	T	38.1	Very low	38.2	Very low	134 Å²	134	120.9 Å²	120.9	82%	0.822	66%	0.656	S	S	*	*			trans	-69.2	104.5	159.6	37.1	0	0	0	0	108	S612 N616	S612-T614 PolarHBondContact O-N 3.32Å; T614-N616 PolarHBondContact O-N 3.44Å
615	F	35.5	Very low	38.8	Very low	118 Å²	118	115.6 Å²	115.6	52%	0.518	63%	0.633	S	S	.	*			trans	-69.9	106.5	178.2	-158.6	-95.7	0	0	0	109.1	S582 P613 L620	S582-F615 WeakPolarHBondContact OG-CE1 3.26Å; S582-F615 WeakPolarHBondContact OG-CE2 3.45Å; S582-F615 WeakPolarHBondContact OG-CZ 3.3Å; P613-F615 PolarHBondContact O-N 3.1Å; P613-F615 VanDerWaalsContact O-N 3.14Å; F615-L620 HydrophobicContact CE1-CD2 4.41Å
616	N	36.9	Very low	39.5	Very low	110 Å²	110	112.7 Å²	112.7	59%	0.588	63%	0.626	S	S	*	*			trans	-88.2	110.7	-179.7	-140.9	-9.6	0	0	0	108.8	T614 T618 N619	T614-N616 PolarHBondContact O-N 3.44Å; N616-T618 PolarHBondContact O-N 3.38Å; N616-N619 PolarHBondContact O-N 2.91Å
617	L	42.1	Very low	40	Very low	140 Å²	140	107.4 Å²	107.4	73%	0.733	61%	0.614	S	S	*	*	T	Hydrogen-bonded Turn	trans	-53.9	-26.4	-173.8	-163.6	66.7	0	0	0	113.4	N619 L620	L617-N619 VanDerWaalsContact C-N 3.33Å; L617-N619 PolarHBondContact O-N 3.16Å; L617-L620 PolarHBondContact O-N 2.82Å
618	T	45.8	Very low	40.5	Very low	79 Å²	79	111.1 Å²	111.1	49%	0.485	62%	0.616	S	S	.	*	H	α-helix	trans	-66.5	-25.6	177.3	23.2	0	0	0	0	114.6	N616 N622	N616-T618 PolarHBondContact O-N 3.38Å; T618-N622 PolarHBondContact O-ND2 3.43Å
619	N	47	Very low	40.8	Very low	110 Å²	110	111.2 Å²	111.2	59%	0.588	61%	0.609	S	S	*	*	H	α-helix	trans	-81.2	-20.8	179.4	-76.7	-23.3	0	0	0	113.3	N616 L617 M623	N616-N619 PolarHBondContact O-N 2.91Å; L617-N619 VanDerWaalsContact C-N 3.33Å; L617-N619 PolarHBondContact O-N 3.16Å; N619-M623 PolarHBondContact O-N 3.39Å
620	L	41.5	Very low	41.4	Very low	40 Å²	40	116.7 Å²	116.7	21%	0.209	61%	0.614	C	S	.	*	H	α-helix	trans	-76.7	-42.3	177.5	-169.7	64.4	0	0	0	111.3	F615 L617 N622 M623 V624	F615-L620 HydrophobicContact CE1-CD2 4.41Å; L617-L620 PolarHBondContact O-N 2.82Å; L620-N622 VanDerWaalsContact C-N 3.33Å; L620-N622 PolarHBondContact O-N 2.89Å; L620-M623 PolarHBondContact O-N 3.19Å; L620-M623 VanDerWaalsContact O-N 3.14Å; L620-V624 PolarHBondContact O-N 2.7Å
621	A	46	Very low	42	Very low	24 Å²	24	118 Å²	118	20%	0.198	61%	0.61	C	S	.	*	H	α-helix	trans	-58.8	-43.2	174	0	0	0	0	0	112	M623 V624 L625	A621-M623 VanDerWaalsContact C-N 3.29Å; A621-M623 PolarHBondContact O-N 2.86Å; A621-V624 PolarHBondContact O-N 3.02Å; A621-L625 PolarHBondContact O-N 3.48Å; A621-L625 VanDerWaalsContact O-N 3.08Å
622	N	45.8	Very low	42.5	Very low	91 Å²	91	115.2 Å²	115.2	49%	0.487	60%	0.599	S	S	.	*	H	α-helix	trans	-65.3	-29.1	177	-77.3	-34.8	0	0	0	113.6	T618 L620 L626	T618-N622 PolarHBondContact O-ND2 3.43Å; L620-N622 VanDerWaalsContact C-N 3.33Å; L620-N622 PolarHBondContact O-N 2.89Å; N622-L626 WeakPolarHBondContact O-CG 3.43Å; N622-L626 PolarHBondContact O-N 3.43Å
623	M	40.7	Very low	42.9	Very low	123 Å²	123	114.5 Å²	114.5	61%	0.606	60%	0.599	S	S	*	*	H	α-helix	trans	-76	-34.8	177.9	-161.3	-172.2	-78.4	0	0	111.9	N619 L620 A621	N619-M623 PolarHBondContact O-N 3.39Å; L620-M623 PolarHBondContact O-N 3.19Å; L620-M623 VanDerWaalsContact O-N 3.14Å; A621-M623 VanDerWaalsContact C-N 3.29Å; A621-M623 PolarHBondContact O-N 2.86Å
624	V	48.1	Very low	42.9	Very low	78 Å²	78	116.4 Å²	116.4	47%	0.473	60%	0.602	S	S	.	*	H	α-helix	trans	-72.1	-40.4	177.5	177.2	0	0	0	0	111.2	L620 A621 L626 N627	L620-V624 PolarHBondContact O-N 2.7Å; A621-V624 PolarHBondContact O-N 3.02Å; V624-L626 PolarHBondContact O-N 3.31Å; V624-N627 PolarHBondContact O-N 3.49Å
625	L	49.2	Very low	43.1	Very low	65 Å²	65	116.1 Å²	116.1	34%	0.34	60%	0.6	S	S	.	*	H	α-helix	trans	-65.1	-35.9	177.5	-81.1	164.4	0	0	0	113.9	A621 N627 R628 K629 V647	A621-L625 PolarHBondContact O-N 3.48Å; A621-L625 VanDerWaalsContact O-N 3.08Å; L625-N627 VanDerWaalsContact C-N 3.35Å; L625-N627 PolarHBondContact O-N 3.43Å; L625-R628 PolarHBondContact O-N 2.99Å; L625-K629 PolarHBondContact O-N 3.26Å; L625-V647 HydrophobicContact CD1-CG1 3.56Å; L625-V647 HydrophobicContact CD2-CG1 3.96Å; L625-V647 HydrophobicContact CG-CG1 4.42Å
626	L	46	Very low	43.2	Very low	127 Å²	127	120 Å²	120	67%	0.665	62%	0.617	S	S	*	*	H	α-helix	trans	-70.5	-29.3	180	-76.9	171	0	0	0	113.1	N622 V624	N622-L626 WeakPolarHBondContact O-CG 3.43Å; N622-L626 PolarHBondContact O-N 3.43Å; V624-L626 PolarHBondContact O-N 3.31Å
627	N	42.9	Very low	43.4	Very low	120 Å²	120	120.9 Å²	120.9	64%	0.642	63%	0.629	S	S	*	*	H	α-helix	trans	-73.9	-29	176	-88	-18	0	0	0	112.7	V624 L625	V624-N627 PolarHBondContact O-N 3.49Å; L625-N627 VanDerWaalsContact C-N 3.35Å; L625-N627 PolarHBondContact O-N 3.43Å
628	R	43.4	Very low	43.3	Very low	183 Å²	183	122.8 Å²	122.8	69%	0.691	63%	0.633	S	S	*	*	H	α-helix	trans	-78.6	-28.6	-179.3	-152.1	171.5	-173.5	171.2	1.7	113.7	L625 K630 H631	L625-R628 PolarHBondContact O-N 2.99Å; R628-K630 PolarHBondContact O-N 2.96Å; R628-H631 PolarHBondContact O-N 3.12Å
629	K	44	Very low	43	Very low	163 Å²	163	127.1 Å²	127.1	71%	0.709	65%	0.654	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67	-17.8	175.4	-93.5	-176.2	177.3	177.3	0	114.1	L625 H631	L625-K629 PolarHBondContact O-N 3.26Å; K629-H631 VanDerWaalsContact C-N 3.3Å; K629-H631 PolarHBondContact O-N 2.84Å
630	K	44	Very low	42.7	Very low	181 Å²	181	125.6 Å²	125.6	79%	0.787	66%	0.656	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77	-14.3	178.7	-125.4	175.7	-177.4	177.3	0	114.1	R628	R628-K630 PolarHBondContact O-N 2.96Å
631	H	45.2	Very low	42.6	Very low	169 Å²	169	131.6 Å²	131.6	78%	0.782	69%	0.689	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.2	-12	-179.5	-95.1	-80.5	0	0	0	115.2	R628 K629	R628-H631 PolarHBondContact O-N 3.12Å; K629-H631 VanDerWaalsContact C-N 3.3Å; K629-H631 PolarHBondContact O-N 2.84Å
632	N	40.7	Very low	42.2	Very low	141 Å²	141	138.3 Å²	138.3	75%	0.754	71%	0.71	S	S	*	*			trans	-126.8	40.4	-177.7	-87.3	-7.2	0	0	0	113.4	N634	N632-N634 PolarHBondContact O-N 3.27Å
633	A	40.4	Very low	41.9	Very low	81 Å²	81	138.9 Å²	138.9	67%	0.669	71%	0.713	S	S	*	*			trans	-95.3	75.5	176.4	0	0	0	0	0	111.1
634	N	37.4	Very low	42.1	Very low	168 Å²	168	139.2 Å²	139.2	90%	0.898	72%	0.717	S	S	*	*			trans	-145.7	19.5	162.8	-103.5	-6.8	0	0	0	114	N632	N632-N634 PolarHBondContact O-N 3.27Å
635	T	41.5	Very low	42	Very low	128 Å²	128	139 Å²	139	79%	0.785	72%	0.719	S	S	*	*	S	Bend	trans	-125.1	123.1	175.5	43.8	0	0	0	0	110.4
636	K	37.6	Very low	41.9	Very low	198 Å²	198	139.4 Å²	139.4	86%	0.861	72%	0.724	S	S	*	*	P	Polyproline II helix	trans	-54.4	136.8	177.5	-70	175.3	176.1	177.3	0	110.5	H638	K636-H638 PolarHBondContact O-N 2.95Å
637	P	41.2	Very low	42	Very low	130 Å²	130	134.5 Å²	134.5	84%	0.844	70%	0.7	S	S	*	*	P	Polyproline II helix	trans	-77	116.6	174.5	30.8	-28.3	0	0	0	108.7
638	H	40.4	Very low	42.1	Very low	179 Å²	179	133.6 Å²	133.6	83%	0.829	69%	0.691	S	S	*	*	P	Polyproline II helix	trans	-87.8	136.9	160	-113.1	-83.4	0	0	0	108	K636 A640	K636-H638 PolarHBondContact O-N 2.95Å; H638-A640 PolarHBondContact O-N 3.46Å
639	D	38.9	Very low	42.1	Very low	171 Å²	171	126.6 Å²	126.6	91%	0.914	67%	0.673	S	S	*	*			trans	-52.7	106.6	175.2	-66.5	-51.6	0	0	0	111.3
640	A	42.2	Very low	42.2	Very low	77 Å²	77	121.6 Å²	121.6	64%	0.636	66%	0.662	S	S	*	*			trans	-133.4	118.3	164.1	0	0	0	0	0	107.1	H638 Y642	H638-A640 PolarHBondContact O-N 3.46Å; A640-Y642 PolarHBondContact O-N 3.08Å
641	N	38.5	Very low	42.3	Very low	166 Å²	166	114.7 Å²	114.7	89%	0.888	63%	0.632	S	S	*	*			trans	-47	104.2	172.8	-161.1	14.2	0	0	0	108.9	D643	N641-D643 PolarHBondContact O-N 3.31Å; N641-D643 VanDerWaalsContact O-N 3.15Å
642	Y	38.6	Very low	42.3	Very low	166 Å²	166	111.7 Å²	111.7	65%	0.651	62%	0.619	S	S	*	*			trans	-85.6	91.7	-170	-144.1	-110	0	0	0	107.7	A640 N644 V647	A640-Y642 PolarHBondContact O-N 3.08Å; Y642-N644 PolarHBondContact O-N 2.89Å; Y642-V647 HydrophobicContact CD1-CG2 3.58Å; Y642-V647 HydrophobicContact CE1-CG2 3.09Å
643	D	39.6	Very low	42.4	Very low	103 Å²	103	105.3 Å²	105.3	55%	0.551	59%	0.586	S	S	*	*			trans	-60.9	116.9	173.1	-107.5	-15	0	0	0	109	N641 S645 T646	N641-D643 PolarHBondContact O-N 3.31Å; N641-D643 VanDerWaalsContact O-N 3.15Å; D643-S645 PolarHBondContact O-N 2.81Å; D643-T646 HydrophobicContact CB-CG2 4.19Å; D643-T646 PolarHBondContact O-N 2.96Å; D643-T646 PolarHBondContact O-OG1 3.34Å
644	N	43.9	Very low	42.9	Very low	129 Å²	129	105.6 Å²	105.6	69%	0.69	58%	0.579	S	S	*	*	H	α-helix	trans	-55.6	-17.9	178	-77.2	-24.1	0	0	0	113	Y642 H648	Y642-N644 PolarHBondContact O-N 2.89Å; N644-H648 PolarHBondContact O-CD2 3.35Å; N644-H648 PolarHBondContact O-N 2.88Å
645	S	45.3	Very low	43.6	Very low	74 Å²	74	103.2 Å²	103.2	52%	0.517	57%	0.565	S	S	.	*	H	α-helix	trans	-66.8	-32.2	172.1	55.5	0	0	0	0	113.2	D643 A649	D643-S645 PolarHBondContact O-N 2.81Å; S645-A649 VanDerWaalsContact O-CB 3.31Å; S645-A649 WeakPolarHBondContact O-CB 3.5Å; S645-A649 PolarHBondContact O-N 3.01Å
646	T	47.8	Very low	43.9	Very low	73 Å²	73	97.3 Å²	97.3	45%	0.448	53%	0.53	S	S	.	.	H	α-helix	trans	-75	-31.1	-178.4	61.9	0	0	0	0	112.9	D643 A650	D643-T646 HydrophobicContact CB-CG2 4.19Å; D643-T646 PolarHBondContact O-N 2.96Å; D643-T646 PolarHBondContact O-OG1 3.34Å; T646-A650 WeakPolarHBondContact O-CB 3.42Å; T646-A650 PolarHBondContact O-N 3.33Å
647	V	49	Very low	44.7	Very low	25 Å²	25	89 Å²	89	15%	0.152	50%	0.497	C	S	.	.	H	α-helix	trans	-73.5	-43.5	175.9	-172.1	0	0	0	0	110.7	L625 Y642 A649 A650 E651	L625-V647 HydrophobicContact CD1-CG1 3.56Å; L625-V647 HydrophobicContact CD2-CG1 3.96Å; L625-V647 HydrophobicContact CG-CG1 4.42Å; Y642-V647 HydrophobicContact CD1-CG2 3.58Å; Y642-V647 HydrophobicContact CE1-CG2 3.09Å; V647-A649 VanDerWaalsContact C-N 3.33Å; V647-A649 PolarHBondContact O-N 2.89Å; V647-A650 PolarHBondContact O-N 3.44Å; V647-E651 WeakPolarHBondContact O-CB 3.41Å; V647-E651 PolarHBondContact O-N 3.5Å
648	H	43.7	Very low	45.5	Very low	100 Å²	100	82.9 Å²	82.9	46%	0.463	46%	0.457	S	S	.	.	H	α-helix	trans	-62.9	-39.8	173.4	-88.3	-67.9	0	0	0	111.9	N644 Q652	N644-H648 PolarHBondContact O-CD2 3.35Å; N644-H648 PolarHBondContact O-N 2.88Å; H648-Q652 WeakPolarHBondContact O-CB 3.5Å; H648-Q652 WeakPolarHBondContact O-CG 3.26Å; H648-Q652 PolarHBondContact O-N 3.24Å; H648-Q652 PolarHBondContact O-OE1 2.89Å
649	A	43.7	Very low	46.6	Very low	37 Å²	37	77.5 Å²	77.5	31%	0.306	43%	0.434	S	S	.	.	H	α-helix	trans	-66.5	-39.3	176	0	0	0	0	0	112.7	S645 V647 A653	S645-A649 VanDerWaalsContact O-CB 3.31Å; S645-A649 WeakPolarHBondContact O-CB 3.5Å; S645-A649 PolarHBondContact O-N 3.01Å; V647-A649 VanDerWaalsContact C-N 3.33Å; V647-A649 PolarHBondContact O-N 2.89Å; A649-A653 WeakPolarHBondContact O-CA 3.44Å; A649-A653 WeakPolarHBondContact O-CB 3.34Å; A649-A653 PolarHBondContact O-N 2.74Å
650	A	45.6	Very low	47.8	Very low	57 Å²	57	72.3 Å²	72.3	47%	0.471	41%	0.409	S	S	.	.	H	α-helix	trans	-72.8	-37.2	177.1	0	0	0	0	0	112.7	T646 V647 A653 V654	T646-A650 WeakPolarHBondContact O-CB 3.42Å; T646-A650 PolarHBondContact O-N 3.33Å; V647-A650 PolarHBondContact O-N 3.44Å; A650-A653 PolarHBondContact O-N 3.15Å; A650-V654 WeakPolarHBondContact O-CG2 3.38Å; A650-V654 PolarHBondContact O-N 3.45Å; A650-V654 VanDerWaalsContact O-N 3.15Å
651	E	47.5	Very low	49.1	Very low	36 Å²	36	69.2 Å²	69.2	17%	0.168	38%	0.381	C	S	.	.	H	α-helix	trans	-72.5	-40.4	177.6	-159.8	168.8	-172.2	0	0	110.7	V647 L655	V647-E651 WeakPolarHBondContact O-CB 3.41Å; V647-E651 PolarHBondContact O-N 3.5Å; E651-L655 HydrophobicContact CG-CD1 4.43Å; E651-L655 WeakPolarHBondContact O-CB 3.44Å; E651-L655 WeakPolarHBondContact O-CD1 3.34Å; E651-L655 PolarHBondContact O-N 3.41Å; E651-L655 VanDerWaalsContact O-N 3.15Å
652	Q	45.1	Very low	50.6	Low	107 Å²	107	67 Å²	67	50%	0.5	36%	0.364	S	S	.	.	H	α-helix	trans	-71.2	-26.9	169.6	-74.7	174.5	-43.1	0	0	112.9	V504 H648 L655 G656	V504-Q652 WeakPolarHBondContact CG2-O 3.48Å; H648-Q652 WeakPolarHBondContact O-CB 3.5Å; H648-Q652 WeakPolarHBondContact O-CG 3.26Å; H648-Q652 PolarHBondContact O-N 3.24Å; H648-Q652 PolarHBondContact O-OE1 2.89Å; Q652-L655 PolarHBondContact O-N 3.02Å; Q652-G656 VanDerWaalsContact O-CA 3.28Å; Q652-G656 WeakPolarHBondContact O-CA 3.48Å; Q652-G656 PolarHBondContact O-N 3.43Å
653	A	43.3	Very low	52.2	Low	7 Å²	7	66.3 Å²	66.3	6%	0.058	36%	0.361	C	S	.	.	H	α-helix	trans	-68.7	-40.6	175.6	0	0	0	0	0	112.7	V504 V505 A649 A650 C657	V504-A653 HydrophobicContact CB-CB 4.25Å; V504-A653 HydrophobicContact CG1-CB 3.61Å; V504-A653 WeakPolarHBondContact CG1-O 3.44Å; V504-A653 HydrophobicContact CG2-CB 4.4Å; V505-A653 HydrophobicContact CB-CB 4.35Å; A649-A653 WeakPolarHBondContact O-CA 3.44Å; A649-A653 WeakPolarHBondContact O-CB 3.34Å; A649-A653 PolarHBondContact O-N 2.74Å; A650-A653 PolarHBondContact O-N 3.15Å; A653-C657 PolarHBondContact O-N 2.98Å
654	V	50.2	Low	54.1	Low	86 Å²	86	64.4 Å²	64.4	52%	0.521	35%	0.351	S	S	.	.	H	α-helix	trans	-72.7	-32	176.8	175.9	0	0	0	0	111.3	A650	A650-V654 WeakPolarHBondContact O-CG2 3.38Å; A650-V654 PolarHBondContact O-N 3.45Å; A650-V654 VanDerWaalsContact O-N 3.15Å
655	L	51	Low	55.8	Low	118 Å²	118	58.6 Å²	58.6	62%	0.618	32%	0.321	S	S	*	.	H	α-helix	trans	-82.4	-32.3	176.7	-85.8	152	0	0	0	113.7	E651 Q652 I659	E651-L655 HydrophobicContact CG-CD1 4.43Å; E651-L655 WeakPolarHBondContact O-CB 3.44Å; E651-L655 WeakPolarHBondContact O-CD1 3.34Å; E651-L655 PolarHBondContact O-N 3.41Å; E651-L655 VanDerWaalsContact O-N 3.15Å; Q652-L655 PolarHBondContact O-N 3.02Å; L655-I659 VanDerWaalsContact O-CG1 3.27Å; L655-I659 WeakPolarHBondContact O-CG1 3.45Å
656	G	48.8	Very low	57.4	Low	5 Å²	5	57.7 Å²	57.7	5%	0.052	31%	0.313	C	S	.	.	H	α-helix	trans	-89.5	-16.5	-171.4	0	0	0	0	0	115.2	Q652 G658	Q652-G656 VanDerWaalsContact O-CA 3.28Å; Q652-G656 WeakPolarHBondContact O-CA 3.48Å; Q652-G656 PolarHBondContact O-N 3.43Å; G656-G658 PolarHBondContact O-N 2.73Å
657	C	54	Low	58.9	Low	24 Å²	24	59.8 Å²	59.8	16%	0.162	31%	0.313	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69	98.9	171.3	-172.4	0	0	0	0	109.6	E499 C507 H508 A653 K662	E499-C657 PolarHBondContact OE1-SG 3.33Å; C507-C657 HydrophobicContact CB-CB 4.41Å; C507-C657 VanDerWaalsContact CB-SG 3.53Å; H508-C657 PolarHBondContact CE1-SG 3.39Å; A653-C657 PolarHBondContact O-N 2.98Å; C657-K662 VanDerWaalsContact O-CE 3.3Å; C657-K662 WeakPolarHBondContact O-CE 3.45Å; C657-K662 PolarHBondContact O-NZ 3.47Å
658	G	58.3	Low	60.8	Low	1 Å²	1	59.6 Å²	59.6	1%	0.01	31%	0.311	C	S	.	.	T	Hydrogen-bonded Turn	trans	83	35.9	167.7	0	0	0	0	0	116.1	G656 T660 V661 K662	G656-G658 PolarHBondContact O-N 2.73Å; G658-T660 VanDerWaalsContact C-N 3.3Å; G658-T660 PolarHBondContact O-N 3.09Å; G658-V661 PolarHBondContact O-N 3.44Å; G658-K662 WeakPolarHBondContact O-CB 3.23Å; G658-K662 WeakPolarHBondContact O-CD 3.37Å; G658-K662 WeakPolarHBondContact O-CG 3.38Å; G658-K662 PolarHBondContact O-N 2.9Å
659	I	62.9	Low	62.8	Low	66 Å²	66	55.2 Å²	55.2	34%	0.338	29%	0.291	S	S	.	.	H	α-helix	trans	-53.9	-51.1	176.5	-64.4	176.4	0	0	0	109.7	L655 V661 K662 Y663	L655-I659 VanDerWaalsContact O-CG1 3.27Å; L655-I659 WeakPolarHBondContact O-CG1 3.45Å; I659-V661 PolarHBondContact O-N 3.11Å; I659-K662 PolarHBondContact O-N 3.44Å; I659-Y663 HydrophobicContact CG2-CD2 4.05Å; I659-Y663 HydrophobicContact CG2-CE2 3.5Å; I659-Y663 VanDerWaalsContact CG2-CE2 3.5Å; I659-Y663 WeakPolarHBondContact O-CD2 3.48Å; I659-Y663 PolarHBondContact O-N 3.22Å
660	T	64	Low	64.8	Low	62 Å²	62	54.7 Å²	54.7	38%	0.38	29%	0.285	S	S	.	.	H	α-helix	trans	-65.9	-42	-177.4	-56.1	0	0	0	0	112.3	F491 E498 G658 Y663 L664	F491-T660 HydrophobicContact CD1-CG2 4.39Å; F491-T660 HydrophobicContact CE1-CG2 4.48Å; E498-T660 PolarHBondContact OE1-N 2.82Å; E498-T660 PolarHBondContact OE1-OG1 2.93Å; E498-T660 PolarHBondContact OE2-N 3.38Å; E498-T660 PolarHBondContact OE2-OG1 3.44Å; G658-T660 VanDerWaalsContact C-N 3.3Å; G658-T660 PolarHBondContact O-N 3.09Å; T660-Y663 PolarHBondContact O-N 3.08Å; T660-L664 PolarHBondContact O-N 3.23Å
661	V	70.7	Confident	67	Low	11 Å²	11	53.4 Å²	53.4	7%	0.067	27%	0.272	C	S	.	.	H	α-helix	trans	-70.4	-38.2	-179.4	-179.7	0	0	0	0	111.7	F488 F491 K492 E495 G658 I659 Y663 L664 A665	F488-V661 HydrophobicContact CE2-CG1 4.21Å; F491-V661 HydrophobicContact CB-CG2 3.99Å; K492-V661 HydrophobicContact CG-CG1 4.48Å; E495-V661 HydrophobicContact CG-CB 4.07Å; E495-V661 HydrophobicContact CG-CG2 3.23Å; E495-V661 WeakPolarHBondContact OE1-CB 3.46Å; E495-V661 WeakPolarHBondContact OE1-CG1 3.49Å; E495-V661 VanDerWaalsContact OE1-CG2 3.23Å; E495-V661 WeakPolarHBondContact OE1-CG2 3.31Å; G658-V661 PolarHBondContact O-N 3.44Å; I659-V661 PolarHBondContact O-N 3.11Å; V661-Y663 PolarHBondContact O-N 3.42Å; V661-L664 PolarHBondContact O-N 3.42Å; V661-A665 HydrophobicContact CG1-CB 4.29Å; V661-A665 WeakPolarHBondContact O-CA 3.41Å; V661-A665 WeakPolarHBondContact O-CB 3.29Å; V661-A665 PolarHBondContact O-N 3.12Å
662	K	69.3	Low	69.1	Low	120 Å²	120	51.9 Å²	51.9	52%	0.522	27%	0.265	S	S	.	.	H	α-helix	trans	-58	-36.7	176.3	-77.9	167.6	177.5	163.4	0	112.2	C657 G658 I659 P666	C657-K662 VanDerWaalsContact O-CE 3.3Å; C657-K662 WeakPolarHBondContact O-CE 3.45Å; C657-K662 PolarHBondContact O-NZ 3.47Å; G658-K662 WeakPolarHBondContact O-CB 3.23Å; G658-K662 WeakPolarHBondContact O-CD 3.37Å; G658-K662 WeakPolarHBondContact O-CG 3.38Å; G658-K662 PolarHBondContact O-N 2.9Å; I659-K662 PolarHBondContact O-N 3.44Å; K662-P666 VanDerWaalsContact O-CD 3.28Å; K662-P666 WeakPolarHBondContact O-CD 3.07Å
663	Y	71.5	Confident	71.3	Confident	151 Å²	151	47 Å²	47	59%	0.592	24%	0.243	S	C	*	.	H	α-helix	trans	-77	-34.6	178.2	-67.8	-62	0	0	0	113.6	I659 T660 V661	I659-Y663 HydrophobicContact CG2-CD2 4.05Å; I659-Y663 HydrophobicContact CG2-CE2 3.5Å; I659-Y663 VanDerWaalsContact CG2-CE2 3.5Å; I659-Y663 WeakPolarHBondContact O-CD2 3.48Å; I659-Y663 PolarHBondContact O-N 3.22Å; T660-Y663 PolarHBondContact O-N 3.08Å; V661-Y663 PolarHBondContact O-N 3.42Å
664	L	80.1	Confident	73.5	Confident	64 Å²	64	46.7 Å²	46.7	34%	0.335	24%	0.24	S	C	.	.	H	α-helix	trans	-91.9	-28	-177	-97.9	75.8	0	0	0	114.2	F491 T660 V661 P666 Y667 L668	F491-L664 HydrophobicContact CD2-CD2 3.94Å; F491-L664 HydrophobicContact CE1-CD2 3.94Å; F491-L664 HydrophobicContact CE2-CD2 3.23Å; F491-L664 HydrophobicContact CZ-CD2 3.25Å; T660-L664 PolarHBondContact O-N 3.23Å; V661-L664 PolarHBondContact O-N 3.42Å; L664-P666 VanDerWaalsContact C-CD 3.44Å; L664-Y667 PolarHBondContact O-N 3.43Å; L664-L668 HydrophobicContact CB-CD1 4.24Å; L664-L668 HydrophobicContact CD2-CD1 4.48Å; L664-L668 PolarHBondContact O-N 2.99Å
665	A	80.3	Confident	75.6	Confident	7 Å²	7	42.8 Å²	42.8	6%	0.058	22%	0.216	C	C	.	.	H	α-helix	trans	-53.8	-43.7	-176.4	0	0	0	0	0	113	F488 V661 Y667 L668 F669	F488-A665 HydrophobicContact CE2-CB 3.82Å; F488-A665 HydrophobicContact CZ-CB 4.11Å; V661-A665 HydrophobicContact CG1-CB 4.29Å; V661-A665 WeakPolarHBondContact O-CA 3.41Å; V661-A665 WeakPolarHBondContact O-CB 3.29Å; V661-A665 PolarHBondContact O-N 3.12Å; A665-Y667 PolarHBondContact O-N 3.1Å; A665-L668 PolarHBondContact O-N 3.46Å; A665-F669 HydrophobicContact CB-CD2 4.18Å; A665-F669 HydrophobicContact CB-CE2 3.58Å; A665-F669 HydrophobicContact CB-CZ 3.92Å; A665-F669 WeakPolarHBondContact O-CD2 3.17Å; A665-F669 WeakPolarHBondContact O-CG 3.44Å; A665-F669 PolarHBondContact O-N 3.04Å
666	P	77.8	Confident	77.7	Confident	54 Å²	54	37.5 Å²	37.5	35%	0.351	19%	0.189	S	C	.	.	H	α-helix	trans	-54.9	-28.2	177.1	-27.2	36.5	0	0	0	114.6	K662 L664	K662-P666 VanDerWaalsContact O-CD 3.28Å; K662-P666 WeakPolarHBondContact O-CD 3.07Å; L664-P666 VanDerWaalsContact C-CD 3.44Å
667	Y	80.9	Confident	79.7	Confident	117 Å²	117	38.4 Å²	38.4	46%	0.459	19%	0.193	S	C	.	.	H	α-helix	trans	-91.5	-19.5	179.5	-57.7	-77.1	0	0	0	113.3	L664 A665 F887	L664-Y667 PolarHBondContact O-N 3.43Å; A665-Y667 PolarHBondContact O-N 3.1Å; Y667-F887 HydrophobicContact CD1-CD1 4.36Å; Y667-F887 HydrophobicContact CD1-CE1 4.48Å
668	L	88.3	Confident	81.5	Confident	21 Å²	21	37.3 Å²	37.3	11%	0.11	19%	0.185	C	C	.	.	H	α-helix	trans	-99.6	-23.2	-178.2	-67.6	172.6	0	0	0	113.2	I487 F488 F491 L664 A665 C671 A672	I487-L668 HydrophobicContact CG2-CD1 4.32Å; I487-L668 HydrophobicContact CG2-CD2 4.34Å; F488-L668 HydrophobicContact CB-CB 4.04Å; F488-L668 HydrophobicContact CB-CD1 3.99Å; F488-L668 HydrophobicContact CD2-CB 4.02Å; F488-L668 HydrophobicContact CD2-CD1 3.92Å; F488-L668 HydrophobicContact CG-CB 3.97Å; F488-L668 HydrophobicContact CG-CD1 4.28Å; F491-L668 HydrophobicContact CD2-CD1 3.75Å; F491-L668 HydrophobicContact CE2-CD1 4.07Å; L664-L668 HydrophobicContact CB-CD1 4.24Å; L664-L668 HydrophobicContact CD2-CD1 4.48Å; L664-L668 PolarHBondContact O-N 2.99Å; A665-L668 PolarHBondContact O-N 3.46Å; L668-C671 WeakPolarHBondContact O-CB 3.49Å; L668-C671 PolarHBondContact O-N 2.93Å; L668-A672 PolarHBondContact O-N 3.14Å
669	F	86.1	Confident	83.2	Confident	8 Å²	8	37.2 Å²	37.2	4%	0.035	18%	0.184	C	C	.	.	H	α-helix	trans	-52.7	-46.8	173	-73.5	-58.5	0	0	0	112.7	F488 T563 D566 E567 S570 A665 C671 A672 I673	F488-F669 AromaticContact CE1-CD1 3.97Å; F488-F669 HydrophobicContact CE1-CD1 3.97Å; F488-F669 AromaticContact CE1-CE1 3.98Å; F488-F669 HydrophobicContact CE1-CE1 3.98Å; F488-F669 HydrophobicContact CZ-CD1 4.02Å; F488-F669 AromaticContact CZ-CE1 3.7Å; F488-F669 HydrophobicContact CZ-CE1 3.7Å; F488-F669 HydrophobicContact CZ-CZ 4.18Å; T563-F669 HydrophobicContact CG2-CD1 3.8Å; D566-F669 HydrophobicContact CB-CE1 4.22Å; E567-F669 HydrophobicContact CB-CD1 4.05Å; E567-F669 HydrophobicContact CB-CD2 3.99Å; E567-F669 HydrophobicContact CB-CE1 4.16Å; E567-F669 HydrophobicContact CB-CE2 4.12Å; E567-F669 HydrophobicContact CB-CG 3.97Å; E567-F669 HydrophobicContact CB-CZ 4.2Å; E567-F669 HydrophobicContact CG-CB 4.31Å; E567-F669 HydrophobicContact CG-CD2 3.61Å; E567-F669 HydrophobicContact CG-CE2 3.97Å; E567-F669 HydrophobicContact CG-CG 3.94Å; S570-F669 WeakPolarHBondContact OG-CE2 3.28Å; A665-F669 HydrophobicContact CB-CD2 4.18Å; A665-F669 HydrophobicContact CB-CE2 3.58Å; A665-F669 HydrophobicContact CB-CZ 3.92Å; A665-F669 WeakPolarHBondContact O-CD2 3.17Å; A665-F669 WeakPolarHBondContact O-CG 3.44Å; A665-F669 PolarHBondContact O-N 3.04Å; F669-C671 PolarHBondContact O-N 3.21Å; F669-A672 PolarHBondContact O-N 3.36Å; F669-A672 VanDerWaalsContact O-N 3.08Å; F669-I673 VanDerWaalsContact O-CG1 3.29Å; F669-I673 WeakPolarHBondContact O-CG1 3.42Å; F669-I673 PolarHBondContact O-N 3.5Å
670	P	86.1	Confident	84.7	Confident	27 Å²	27	34.4 Å²	34.4	18%	0.175	17%	0.172	C	C	.	.	H	α-helix	trans	-56.7	-38.1	176.6	-26.1	35.6	0	0	0	112.7	A672 I673 E674 T886	P670-A672 PolarHBondContact O-N 2.96Å; P670-I673 PolarHBondContact O-N 2.94Å; P670-E674 WeakPolarHBondContact O-CB 3.4Å; P670-E674 WeakPolarHBondContact O-CG 3.07Å; P670-E674 PolarHBondContact O-N 3.06Å; P670-T886 HydrophobicContact CB-CG2 4.17Å
671	C	90.5	Very high	85.9	Confident	29 Å²	29	32.1 Å²	32.1	20%	0.196	16%	0.159	C	C	.	.	H	α-helix	trans	-64.5	-42.3	177.7	-64.7	0	0	0	0	112.3	F481 L668 F669 Y675	F481-C671 HydrophobicContact CD1-CB 4.3Å; L668-C671 WeakPolarHBondContact O-CB 3.49Å; L668-C671 PolarHBondContact O-N 2.93Å; F669-C671 PolarHBondContact O-N 3.21Å; C671-Y675 VanDerWaalsContact O-CB 3.26Å; C671-Y675 WeakPolarHBondContact O-CB 3.48Å; C671-Y675 PolarHBondContact O-N 3.31Å
672	A	92.1	Very high	86.8	Confident	4 Å²	4	31.6 Å²	31.6	3%	0.033	16%	0.156	C	C	.	.	H	α-helix	trans	-66.9	-40.3	178.8	0	0	0	0	0	112.8	V485 F488 T563 L668 F669 P670 S676	V485-A672 HydrophobicContact CG2-CB 4.1Å; F488-A672 HydrophobicContact CD1-CB 4.46Å; T563-A672 HydrophobicContact CG2-CB 3.81Å; L668-A672 PolarHBondContact O-N 3.14Å; F669-A672 PolarHBondContact O-N 3.36Å; F669-A672 VanDerWaalsContact O-N 3.08Å; P670-A672 PolarHBondContact O-N 2.96Å; A672-S676 WeakPolarHBondContact O-CB 3.25Å; A672-S676 PolarHBondContact O-N 3.23Å; A672-S676 PolarHBondContact O-OG 2.89Å
673	I	90.6	Very high	88	Confident	4 Å²	4	26 Å²	26	2%	0.021	13%	0.132	C	C	.	.	H	α-helix	trans	-63.4	-52.8	176.1	-69.5	174.1	0	0	0	110.5	T563 I564 E567 F669 P670 S676 L677 P916	T563-I673 HydrophobicContact CG2-CD1 4.27Å; T563-I673 HydrophobicContact CG2-CG1 3.63Å; I564-I673 HydrophobicContact CG1-CD1 4.25Å; E567-I673 WeakPolarHBondContact OE2-CD1 3.44Å; F669-I673 VanDerWaalsContact O-CG1 3.29Å; F669-I673 WeakPolarHBondContact O-CG1 3.42Å; F669-I673 PolarHBondContact O-N 3.5Å; P670-I673 PolarHBondContact O-N 2.94Å; I673-S676 PolarHBondContact O-N 3Å; I673-L677 PolarHBondContact O-N 3.39Å; I673-L677 VanDerWaalsContact O-N 3.15Å; I673-P916 HydrophobicContact CD1-CG 4.04Å; I673-P916 HydrophobicContact CG2-CB 3.38Å; I673-P916 HydrophobicContact CG2-CG 3.65Å
674	E	89.9	Confident	88.8	Confident	2 Å²	2	24 Å²	24	1%	0.009	12%	0.124	C	C	.	.	H	α-helix	trans	-63.7	-43.6	-178.5	-71.1	-59.6	151.5	0	0	112.5	F481 P670 S676 L677 I678 V919 F920	F481-E674 HydrophobicContact CD1-CB 3.96Å; F481-E674 HydrophobicContact CD2-CB 3.82Å; F481-E674 HydrophobicContact CE1-CB 4.01Å; F481-E674 HydrophobicContact CE1-CG 4.17Å; F481-E674 HydrophobicContact CE2-CB 3.87Å; F481-E674 HydrophobicContact CE2-CG 4.4Å; F481-E674 HydrophobicContact CG-CB 3.86Å; F481-E674 HydrophobicContact CZ-CB 3.96Å; F481-E674 HydrophobicContact CZ-CG 4.08Å; P670-E674 WeakPolarHBondContact O-CB 3.4Å; P670-E674 WeakPolarHBondContact O-CG 3.07Å; P670-E674 PolarHBondContact O-N 3.06Å; E674-S676 VanDerWaalsContact C-N 3.3Å; E674-S676 PolarHBondContact O-N 3.24Å; E674-L677 PolarHBondContact O-N 3.21Å; E674-I678 WeakPolarHBondContact O-CD1 3.47Å; E674-I678 VanDerWaalsContact O-CG1 3.28Å; E674-I678 WeakPolarHBondContact O-CG1 3.47Å; E674-I678 PolarHBondContact O-N 3.46Å; E674-V919 HydrophobicContact CG-CG1 4.15Å; E674-V919 VanDerWaalsContact OE1-CB 3.25Å; E674-V919 WeakPolarHBondContact OE1-CB 3.42Å; E674-V919 WeakPolarHBondContact OE1-CG1 2.92Å; E674-F920 PolarHBondContact OE1-N 3.42Å
675	Y	94.7	Very high	89.1	Confident	4 Å²	4	21.4 Å²	21.4	2%	0.016	11%	0.11	C	C	.	.	H	α-helix	trans	-57.3	-46.4	177	177.7	-104.3	0	0	0	111.7	A478 F481 G482 V485 V523 Q526 T527 C671 I678 A679	A478-Y675 VanDerWaalsContact O-CD2 3.26Å; A478-Y675 WeakPolarHBondContact O-CD2 2.99Å; A478-Y675 VanDerWaalsContact O-CE2 3.32Å; A478-Y675 WeakPolarHBondContact O-CE2 3.4Å; F481-Y675 HydrophobicContact CB-CD2 4.48Å; G482-Y675 VanDerWaalsContact N-CD2 3.32Å; V485-Y675 HydrophobicContact CG2-CD1 4.03Å; V485-Y675 HydrophobicContact CG2-CG 3.96Å; V523-Y675 HydrophobicContact CB-CE1 4.45Å; V523-Y675 HydrophobicContact CG1-CD1 4.46Å; V523-Y675 HydrophobicContact CG1-CE1 3.82Å; V523-Y675 HydrophobicContact CG2-CE1 4.18Å; V523-Y675 PolarHBondContact O-OH 3.46Å; Q526-Y675 WeakPolarHBondContact CG-OH 3.35Å; Q526-Y675 PolarHBondContact NE2-OH 3.23Å; T527-Y675 PolarHBondContact N-OH 3.47Å; T527-Y675 VanDerWaalsContact OG1-CE2 3.28Å; T527-Y675 WeakPolarHBondContact OG1-CE2 3.4Å; T527-Y675 PolarHBondContact OG1-OH 3.43Å; C671-Y675 VanDerWaalsContact O-CB 3.26Å; C671-Y675 WeakPolarHBondContact O-CB 3.48Å; C671-Y675 PolarHBondContact O-N 3.31Å; Y675-I678 PolarHBondContact O-N 3.02Å; Y675-A679 HydrophobicContact CE1-CB 4.48Å; Y675-A679 VanDerWaalsContact O-CB 3.24Å; Y675-A679 WeakPolarHBondContact O-CB 3.21Å; Y675-A679 PolarHBondContact O-N 3.32Å
676	S	94.6	Very high	89.4	Confident	7 Å²	7	21.6 Å²	21.6	5%	0.049	11%	0.109	C	C	.	.	H	α-helix	trans	-63.7	-42.9	-178	-59.7	0	0	0	0	111.5	N556 A672 I673 E674 G680	N556-S676 WeakPolarHBondContact CB-O 3.43Å; N556-S676 WeakPolarHBondContact O-CB 3.12Å; A672-S676 WeakPolarHBondContact O-CB 3.25Å; A672-S676 PolarHBondContact O-N 3.23Å; A672-S676 PolarHBondContact O-OG 2.89Å; I673-S676 PolarHBondContact O-N 3Å; E674-S676 VanDerWaalsContact C-N 3.3Å; E674-S676 PolarHBondContact O-N 3.24Å; S676-G680 PolarHBondContact O-N 3.45Å
677	L	91.7	Very high	89.8	Confident	24 Å²	24	21.8 Å²	21.8	13%	0.126	11%	0.105	C	C	.	.	H	α-helix	trans	-63.8	-47.3	175.7	-72.3	175.8	0	0	0	112.2	W560 I673 E674 G680 A681 F920	W560-L677 HydrophobicContact CD2-CD2 4.09Å; W560-L677 HydrophobicContact CG-CD2 4.02Å; W560-L677 HydrophobicContact CG-CG 4.23Å; I673-L677 PolarHBondContact O-N 3.39Å; I673-L677 VanDerWaalsContact O-N 3.15Å; E674-L677 PolarHBondContact O-N 3.21Å; L677-G680 PolarHBondContact O-N 3.23Å; L677-A681 WeakPolarHBondContact O-CB 3.29Å; L677-A681 PolarHBondContact O-N 3.15Å; L677-F920 HydrophobicContact CB-CD2 4.2Å; L677-F920 HydrophobicContact CB-CE2 4.4Å; L677-F920 HydrophobicContact CD1-CB 4.13Å; L677-F920 HydrophobicContact CD1-CD2 4.25Å; L677-F920 HydrophobicContact CD1-CG 4.22Å
678	I	91.5	Very high	89.9	Confident	0 Å²	0	19.9 Å²	19.9	0%	0	10%	0.1	C	C	.	.	H	α-helix	trans	-64.1	-45.8	-179.6	-66.1	163.2	0	0	0	111	L474 A478 F481 E674 Y675 A681 I682 F920 F923	L474-I678 HydrophobicContact CD1-CG1 4.38Å; L474-I678 HydrophobicContact CD1-CG2 4.1Å; L474-I678 HydrophobicContact CG-CG2 3.98Å; A478-I678 HydrophobicContact CB-CG2 3.83Å; F481-I678 HydrophobicContact CD2-CD1 3.52Å; F481-I678 HydrophobicContact CE2-CD1 3.71Å; E674-I678 WeakPolarHBondContact O-CD1 3.47Å; E674-I678 VanDerWaalsContact O-CG1 3.28Å; E674-I678 WeakPolarHBondContact O-CG1 3.47Å; E674-I678 PolarHBondContact O-N 3.46Å; Y675-I678 PolarHBondContact O-N 3.02Å; I678-A681 PolarHBondContact O-N 3.5Å; I678-I682 HydrophobicContact CG2-CD1 3.84Å; I678-I682 HydrophobicContact CG2-CG1 4.49Å; I678-I682 WeakPolarHBondContact O-CG1 3.37Å; I678-I682 PolarHBondContact O-N 2.87Å; I678-F920 HydrophobicContact CG1-CE2 4.35Å; I678-F923 HydrophobicContact CD1-CD1 4.14Å; I678-F923 HydrophobicContact CD1-CE1 3.57Å; I678-F923 HydrophobicContact CD1-CZ 4.25Å; I678-F923 HydrophobicContact CG1-CE1 4.25Å
679	A	94.3	Very high	89.5	Confident	0 Å²	0	20.4 Å²	20.4	0%	0	10%	0.101	C	C	.	.	H	α-helix	trans	-62.9	-46.1	178.6	0	0	0	0	0	111.3	L530 N556 Y675 A681 I682 F683	L530-A679 HydrophobicContact CD1-CB 3.73Å; N556-A679 HydrophobicContact CB-CB 4.48Å; N556-A679 WeakPolarHBondContact OD1-CB 3.17Å; Y675-A679 HydrophobicContact CE1-CB 4.48Å; Y675-A679 VanDerWaalsContact O-CB 3.24Å; Y675-A679 WeakPolarHBondContact O-CB 3.21Å; Y675-A679 PolarHBondContact O-N 3.32Å; A679-A681 VanDerWaalsContact C-N 3.35Å; A679-A681 PolarHBondContact O-N 3.49Å; A679-I682 PolarHBondContact O-N 3.41Å; A679-F683 WeakPolarHBondContact O-CD2 3.43Å; A679-F683 PolarHBondContact O-N 3.47Å
680	G	93.6	Very high	89.3	Confident	7 Å²	7	20 Å²	20	7%	0.072	10%	0.1	C	C	.	.	H	α-helix	trans	-56.3	-46.8	175.3	0	0	0	0	0	112.4	S676 L677 F683 Y684	S676-G680 PolarHBondContact O-N 3.45Å; L677-G680 PolarHBondContact O-N 3.23Å; G680-F683 PolarHBondContact O-N 3.35Å; G680-Y684 WeakPolarHBondContact O-CB 3.28Å; G680-Y684 PolarHBondContact O-N 3.42Å
681	A	89.5	Confident	88.4	Confident	13 Å²	13	19.5 Å²	19.5	11%	0.107	10%	0.1	C	C	.	.	H	α-helix	trans	-61.8	-44.8	177.2	0	0	0	0	0	112.8	L677 I678 A679 Y684 K685 F793 L797	L677-A681 WeakPolarHBondContact O-CB 3.29Å; L677-A681 PolarHBondContact O-N 3.15Å; I678-A681 PolarHBondContact O-N 3.5Å; A679-A681 VanDerWaalsContact C-N 3.35Å; A679-A681 PolarHBondContact O-N 3.49Å; A681-Y684 PolarHBondContact O-N 3.28Å; A681-K685 PolarHBondContact O-N 3.39Å; A681-F793 HydrophobicContact CB-CZ 4.26Å; A681-F793 VanDerWaalsContact O-CZ 3.31Å; A681-F793 WeakPolarHBondContact O-CZ 3.32Å; A681-L797 HydrophobicContact CB-CD1 4.27Å; A681-L797 HydrophobicContact CB-CD2 3.64Å
682	I	90.1	Very high	87.3	Confident	1 Å²	1	24.1 Å²	24.1	1%	0.005	12%	0.118	C	C	.	.	H	α-helix	trans	-65.4	-41.7	178.8	-64.9	167.8	0	0	0	111.1	V470 L474 L530 I678 A679 K685 M686	V470-I682 HydrophobicContact CG1-CD1 4.1Å; V470-I682 HydrophobicContact CG1-CG1 4.03Å; V470-I682 HydrophobicContact CG2-CG2 3.91Å; L474-I682 HydrophobicContact CD2-CD1 4.2Å; L474-I682 HydrophobicContact CD2-CG1 3.92Å; L474-I682 HydrophobicContact CG-CD1 4.44Å; L530-I682 HydrophobicContact CD2-CB 3.87Å; L530-I682 HydrophobicContact CD2-CD1 4.49Å; L530-I682 HydrophobicContact CD2-CG2 3.49Å; L530-I682 VanDerWaalsContact CD2-CG2 3.49Å; I678-I682 HydrophobicContact CG2-CD1 3.84Å; I678-I682 HydrophobicContact CG2-CG1 4.49Å; I678-I682 WeakPolarHBondContact O-CG1 3.37Å; I678-I682 PolarHBondContact O-N 2.87Å; A679-I682 PolarHBondContact O-N 3.41Å; I682-K685 WeakPolarHBondContact O-CB 3.45Å; I682-K685 PolarHBondContact O-N 2.76Å; I682-M686 HydrophobicContact CG2-CG 4.4Å; I682-M686 HydrophobicContact CG2-SD 4.18Å; I682-M686 WeakPolarHBondContact O-CG 3.4Å; I682-M686 PolarHBondContact O-N 2.97Å
683	F	93.2	Very high	85.7	Confident	3 Å²	3	27 Å²	27	1%	0.013	14%	0.135	C	C	.	.	H	α-helix	trans	-65.2	-39.6	176.8	-77.2	-57.4	0	0	0	112.7	Q526 F529 L530 L549 L552 A553 A679 G680 M686 F687	Q526-F683 HydrophobicContact CG-CE2 3.7Å; Q526-F683 HydrophobicContact CG-CZ 3.88Å; F529-F683 AromaticContact CD1-CE1 3.75Å; F529-F683 HydrophobicContact CD1-CE1 3.75Å; F529-F683 HydrophobicContact CD1-CZ 4.15Å; F529-F683 AromaticContact CE1-CE1 3.71Å; F529-F683 HydrophobicContact CE1-CE1 3.71Å; L530-F683 HydrophobicContact CD1-CE2 4.35Å; L530-F683 HydrophobicContact CD2-CD1 4.28Å; L530-F683 HydrophobicContact CD2-CD2 4.26Å; L530-F683 HydrophobicContact CD2-CE1 3.91Å; L530-F683 HydrophobicContact CD2-CE2 3.88Å; L530-F683 HydrophobicContact CD2-CG 4.44Å; L530-F683 HydrophobicContact CD2-CZ 3.7Å; L530-F683 HydrophobicContact CG-CE2 4.31Å; L530-F683 HydrophobicContact CG-CZ 4.13Å; L549-F683 HydrophobicContact CD2-CD1 3.84Å; L549-F683 HydrophobicContact CD2-CE1 4.37Å; L552-F683 HydrophobicContact CB-CB 4.39Å; L552-F683 HydrophobicContact CB-CD1 3.97Å; L552-F683 HydrophobicContact CB-CD2 3.79Å; L552-F683 HydrophobicContact CB-CE1 4.15Å; L552-F683 HydrophobicContact CB-CE2 3.98Å; L552-F683 HydrophobicContact CB-CG 3.8Å; L552-F683 HydrophobicContact CB-CZ 4.15Å; L552-F683 HydrophobicContact CD1-CD1 4.01Å; L552-F683 HydrophobicContact CD1-CE1 3.6Å; L552-F683 HydrophobicContact CD1-CZ 3.92Å; L552-F683 HydrophobicContact CD2-CZ 4.45Å; L552-F683 HydrophobicContact CG-CE1 4.41Å; L552-F683 HydrophobicContact CG-CZ 4.41Å; A553-F683 HydrophobicContact CB-CB 4Å; A679-F683 WeakPolarHBondContact O-CD2 3.43Å; A679-F683 PolarHBondContact O-N 3.47Å; G680-F683 PolarHBondContact O-N 3.35Å; F683-M686 PolarHBondContact O-N 3.25Å; F683-F687 WeakPolarHBondContact O-CB 3.48Å; F683-F687 PolarHBondContact O-N 3.01Å
684	Y	89.8	Confident	84	Confident	109 Å²	109	32.7 Å²	32.7	43%	0.427	16%	0.156	S	C	.	.	H	α-helix	trans	-60.5	-44	172.7	-178.8	-88.9	0	0	0	111.5	G680 A681 M686 F687 E688 F793	G680-Y684 WeakPolarHBondContact O-CB 3.28Å; G680-Y684 PolarHBondContact O-N 3.42Å; A681-Y684 PolarHBondContact O-N 3.28Å; Y684-M686 PolarHBondContact O-N 3.04Å; Y684-F687 VanDerWaalsContact O-CB 3.3Å; Y684-F687 WeakPolarHBondContact O-CB 3.36Å; Y684-F687 PolarHBondContact O-N 3.03Å; Y684-F687 VanDerWaalsContact O-N 3.13Å; Y684-E688 HydrophobicContact CD1-CG 4.39Å; Y684-E688 HydrophobicContact CE1-CG 3.88Å; Y684-E688 WeakPolarHBondContact CE1-OE1 3.38Å; Y684-E688 PolarHBondContact O-N 3.43Å; Y684-E688 PolarHBondContact OH-OE1 3.1Å; Y684-F793 AromaticContact CD1-CE2 3.69Å; Y684-F793 HydrophobicContact CD1-CE2 3.69Å; Y684-F793 HydrophobicContact CD1-CZ 4.42Å; Y684-F793 HydrophobicContact CE1-CE2 4.15Å
685	K	85.3	Confident	82.2	Confident	9 Å²	9	39.4 Å²	39.4	4%	0.039	19%	0.185	C	C	.	.	H	α-helix	trans	-60.3	-43.3	174	-166.7	177.7	-161.2	160.8	0	112.1	V470 A681 I682 F687 K689 E790 F793 D794	V470-K685 HydrophobicContact CG2-CD 4.46Å; A681-K685 PolarHBondContact O-N 3.39Å; I682-K685 WeakPolarHBondContact O-CB 3.45Å; I682-K685 PolarHBondContact O-N 2.76Å; K685-F687 VanDerWaalsContact C-N 3.3Å; K685-F687 PolarHBondContact O-N 2.97Å; K685-K689 WeakPolarHBondContact O-CG 3.16Å; K685-K689 PolarHBondContact O-N 3.27Å; K685-E790 PolarHBondContact NZ-O 3.22Å; K685-F793 HydrophobicContact CB-CD1 4.28Å; K685-F793 HydrophobicContact CB-CE1 3.81Å; K685-F793 HydrophobicContact CB-CE2 4.31Å; K685-F793 HydrophobicContact CB-CZ 3.85Å; K685-F793 HydrophobicContact CD-CD1 3.56Å; K685-F793 HydrophobicContact CD-CE1 3.72Å; K685-F793 HydrophobicContact CD-CG 4.23Å; K685-F793 HydrophobicContact CG-CD1 3.99Å; K685-F793 HydrophobicContact CG-CE1 4.03Å; K685-F793 HydrophobicContact CG-CG 4.27Å; K685-F793 HydrophobicContact CG-CZ 4.45Å; K685-D794 IonicContact NZ-OD1 3.94Å
686	M	86.3	Confident	80.1	Confident	10 Å²	10	44.6 Å²	44.6	5%	0.049	21%	0.21	C	C	.	.	H	α-helix	trans	-64.8	-36.7	176.4	-70.4	-179.7	70.3	0	0	111.6	F529 F538 L549 I682 F683 Y684 K689 V690	F529-M686 HydrophobicContact CE1-CE 3.57Å; F529-M686 HydrophobicContact CE1-SD 3.96Å; F529-M686 HydrophobicContact CZ-CE 3.78Å; F538-M686 HydrophobicContact CE2-CE 3.86Å; L549-M686 HydrophobicContact CD1-CB 4.14Å; L549-M686 HydrophobicContact CD2-CB 4.23Å; I682-M686 HydrophobicContact CG2-CG 4.4Å; I682-M686 HydrophobicContact CG2-SD 4.18Å; I682-M686 WeakPolarHBondContact O-CG 3.4Å; I682-M686 PolarHBondContact O-N 2.97Å; F683-M686 PolarHBondContact O-N 3.25Å; Y684-M686 PolarHBondContact O-N 3.04Å; M686-K689 PolarHBondContact O-N 2.88Å; M686-V690 WeakPolarHBondContact O-CG2 3.45Å; M686-V690 PolarHBondContact O-N 2.8Å
687	F	87.9	Confident	78.1	Confident	59 Å²	59	45.2 Å²	45.2	26%	0.259	21%	0.214	S	C	.	.	H	α-helix	trans	-62	-47.4	176.7	163	-93	0	0	0	112.1	R546 L549 C550 F683 Y684 K685 K689 V690	R546-F687 HydrophobicContact CB-CD2 3.95Å; R546-F687 HydrophobicContact CB-CE2 3.68Å; R546-F687 HydrophobicContact CG-CD2 4.08Å; R546-F687 HydrophobicContact CG-CE2 3.96Å; R546-F687 VanDerWaalsContact O-CD2 3.22Å; R546-F687 WeakPolarHBondContact O-CD2 3.24Å; R546-F687 WeakPolarHBondContact O-CE2 3.32Å; L549-F687 HydrophobicContact CB-CB 3.92Å; C550-F687 HydrophobicContact CB-CD2 4.07Å; C550-F687 HydrophobicContact CB-CE2 4.03Å; F683-F687 WeakPolarHBondContact O-CB 3.48Å; F683-F687 PolarHBondContact O-N 3.01Å; Y684-F687 VanDerWaalsContact O-CB 3.3Å; Y684-F687 WeakPolarHBondContact O-CB 3.36Å; Y684-F687 PolarHBondContact O-N 3.03Å; Y684-F687 VanDerWaalsContact O-N 3.13Å; K685-F687 VanDerWaalsContact C-N 3.3Å; K685-F687 PolarHBondContact O-N 2.97Å; F687-K689 VanDerWaalsContact C-N 3.28Å; F687-K689 PolarHBondContact O-N 3.31Å; F687-V690 WeakPolarHBondContact O-CB 3.28Å; F687-V690 PolarHBondContact O-N 2.82Å
688	E	83	Confident	76.3	Confident	76 Å²	76	48.3 Å²	48.3	36%	0.355	23%	0.228	S	C	.	.	H	α-helix	trans	-62.1	-37.1	179.1	-71.5	-173.9	144.1	0	0	112.2	Y684 V690 H692	Y684-E688 HydrophobicContact CD1-CG 4.39Å; Y684-E688 HydrophobicContact CE1-CG 3.88Å; Y684-E688 WeakPolarHBondContact CE1-OE1 3.38Å; Y684-E688 PolarHBondContact O-N 3.43Å; Y684-E688 PolarHBondContact OH-OE1 3.1Å; E688-V690 VanDerWaalsContact C-N 3.29Å; E688-V690 PolarHBondContact O-N 3.32Å; E688-H692 PolarHBondContact O-ND1 2.99Å; E688-H692 VanDerWaalsContact O-ND1 3.15Å
689	K	78.7	Confident	74.4	Confident	32 Å²	32	55 Å²	55	14%	0.139	25%	0.253	C	S	.	.	H	α-helix	trans	-72.2	-16.1	179.3	-67.3	-176.6	178.9	-161.7	0	113.9	D466 V537 K685 M686 F687 G691 H692 E790	D466-K689 WeakPolarHBondContact OD2-CE 3.45Å; D466-K689 IonicContact OD2-NZ 2.67Å; D466-K689 PolarHBondContact OD2-NZ 3.26Å; V537-K689 VanDerWaalsContact CG1-O 3.27Å; V537-K689 WeakPolarHBondContact CG1-O 3.46Å; V537-K689 HydrophobicContact CG2-CB 4.35Å; K685-K689 WeakPolarHBondContact O-CG 3.16Å; K685-K689 PolarHBondContact O-N 3.27Å; M686-K689 PolarHBondContact O-N 2.88Å; F687-K689 VanDerWaalsContact C-N 3.28Å; F687-K689 PolarHBondContact O-N 3.31Å; K689-G691 PolarHBondContact O-N 2.94Å; K689-H692 PolarHBondContact O-N 3.5Å; K689-H692 VanDerWaalsContact O-N 3.16Å; K689-E790 IonicContact NZ-OE1 2.67Å; K689-E790 PolarHBondContact NZ-OE1 3.43Å
690	V	81.7	Confident	72.5	Confident	0 Å²	0	59.3 Å²	59.3	0%	0	28%	0.276	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.7	122	-176.3	177.9	0	0	0	0	111.7	K542 L545 R546 L549 M686 F687 E688 H692	K542-V690 HydrophobicContact CB-CG1 4.23Å; K542-V690 HydrophobicContact CG-CG1 4.45Å; L545-V690 HydrophobicContact CD2-CG1 3.99Å; L545-V690 HydrophobicContact CD2-CG2 3.81Å; L545-V690 HydrophobicContact CG-CG2 4.26Å; R546-V690 HydrophobicContact CG-CB 3.89Å; R546-V690 HydrophobicContact CG-CG1 3.9Å; R546-V690 HydrophobicContact CG-CG2 4.36Å; R546-V690 PolarHBondContact NE-O 2.95Å; R546-V690 PolarHBondContact NH2-O 3.48Å; L549-V690 HydrophobicContact CD1-CG2 3.49Å; L549-V690 VanDerWaalsContact CD1-CG2 3.49Å; M686-V690 WeakPolarHBondContact O-CG2 3.45Å; M686-V690 PolarHBondContact O-N 2.8Å; F687-V690 WeakPolarHBondContact O-CB 3.28Å; F687-V690 PolarHBondContact O-N 2.82Å; E688-V690 VanDerWaalsContact C-N 3.29Å; E688-V690 PolarHBondContact O-N 3.32Å; V690-H692 VanDerWaalsContact C-N 3.32Å
691	G	68.3	Low	70.7	Confident	17 Å²	17	61.9 Å²	61.9	18%	0.175	29%	0.286	C	S	.	.	T	Hydrogen-bonded Turn	trans	83	0.3	177.1	0	0	0	0	0	115.4	F538 K689	F538-G691 PolarHBondContact O-N 3.01Å; K689-G691 PolarHBondContact O-N 2.94Å
692	H	66	Low	69.1	Low	125 Å²	125	68 Å²	68	58%	0.579	31%	0.31	S	S	*	.			trans	-99.3	101	176	-67.7	103.9	0	0	0	110	E688 K689 V690	E688-H692 PolarHBondContact O-ND1 2.99Å; E688-H692 VanDerWaalsContact O-ND1 3.15Å; K689-H692 PolarHBondContact O-N 3.5Å; K689-H692 VanDerWaalsContact O-N 3.16Å; V690-H692 VanDerWaalsContact C-N 3.32Å
693	V	58.6	Low	67.4	Low	65 Å²	65	73.5 Å²	73.5	39%	0.394	34%	0.339	S	S	.	.			trans	-97.2	97.3	167.7	-175.9	0	0	0	0	107.8	N539 K695	N539-V693 VanDerWaalsContact CG-CG2 3.42Å; N539-V693 WeakPolarHBondContact ND2-CG2 3.26Å; N539-V693 WeakPolarHBondContact OD1-CG2 3.45Å; V693-K695 PolarHBondContact O-N 3.09Å
694	R	56.3	Low	65.6	Low	123 Å²	123	80.5 Å²	80.5	46%	0.464	37%	0.365	S	S	.	.			trans	-69	98.1	173.8	-171.6	174.7	155.4	148.5	-0.3	108.6	E696 S697	R694-E696 HydrophobicContact CG-CB 3.85Å; R694-E696 IonicContact CZ-OE2 3.14Å; R694-E696 IonicContact NE-OE2 3.22Å; R694-E696 PolarHBondContact NE-OE2 2.7Å; R694-E696 IonicContact NH2-OE1 3.22Å; R694-E696 PolarHBondContact NH2-OE1 3.42Å; R694-E696 IonicContact NH2-OE2 2.76Å; R694-E696 PolarHBondContact NH2-OE2 2.97Å; R694-E696 PolarHBondContact O-N 3.31Å; R694-S697 PolarHBondContact O-N 2.98Å; R694-S697 PolarHBondContact O-OG 3.03Å; R694-S697 VanDerWaalsContact O-OG 3.05Å
695	K	51.5	Low	64	Low	143 Å²	143	82.2 Å²	82.2	62%	0.622	38%	0.375	S	S	*	.	H	α-helix	trans	-52.1	-24.1	173	-85.4	176.5	179.5	165.3	0	113	V693 R699	V693-K695 PolarHBondContact O-N 3.09Å; K695-R699 PolarHBondContact O-N 3.22Å
696	E	50.6	Low	62.5	Low	114 Å²	114	85.5 Å²	85.5	53%	0.533	40%	0.404	S	S	.	.	H	α-helix	trans	-76	-31.7	178.3	-153.5	-169.5	158.1	0	0	113.1	R694 E698 R699 L700	R694-E696 HydrophobicContact CG-CB 3.85Å; R694-E696 IonicContact CZ-OE2 3.14Å; R694-E696 IonicContact NE-OE2 3.22Å; R694-E696 PolarHBondContact NE-OE2 2.7Å; R694-E696 IonicContact NH2-OE1 3.22Å; R694-E696 PolarHBondContact NH2-OE1 3.42Å; R694-E696 IonicContact NH2-OE2 2.76Å; R694-E696 PolarHBondContact NH2-OE2 2.97Å; R694-E696 PolarHBondContact O-N 3.31Å; E696-E698 VanDerWaalsContact C-N 3.32Å; E696-E698 PolarHBondContact O-N 2.93Å; E696-R699 WeakPolarHBondContact O-CB 3.41Å; E696-R699 PolarHBondContact O-N 3.27Å; E696-R699 VanDerWaalsContact O-N 3.17Å; E696-L700 WeakPolarHBondContact O-CB 3.45Å; E696-L700 PolarHBondContact O-N 3.13Å
697	S	52.6	Low	60.7	Low	20 Å²	20	88.4 Å²	88.4	14%	0.14	42%	0.42	C	S	.	.	H	α-helix	trans	-66.8	-37.4	176.4	77.5	0	0	0	0	110.8	R694 R699 L700 E701	R694-S697 PolarHBondContact O-N 2.98Å; R694-S697 PolarHBondContact O-OG 3.03Å; R694-S697 VanDerWaalsContact O-OG 3.05Å; S697-R699 PolarHBondContact O-N 2.87Å; S697-L700 PolarHBondContact O-N 2.76Å; S697-E701 WeakPolarHBondContact O-CB 3.33Å; S697-E701 PolarHBondContact O-N 3.11Å
698	E	53.6	Low	59	Low	88 Å²	88	90 Å²	90	41%	0.411	44%	0.436	S	S	.	.	H	α-helix	trans	-65.3	-35.1	172.4	-72.2	-171.2	174.9	0	0	113.1	E696 K702	E696-E698 VanDerWaalsContact C-N 3.32Å; E696-E698 PolarHBondContact O-N 2.93Å; E698-K702 WeakPolarHBondContact O-CB 3.48Å; E698-K702 VanDerWaalsContact O-CG 3.22Å; E698-K702 WeakPolarHBondContact O-CG 3.29Å; E698-K702 PolarHBondContact O-N 3.26Å
699	R	52	Low	57.2	Low	142 Å²	142	95.1 Å²	95.1	54%	0.536	46%	0.457	S	S	.	.	H	α-helix	trans	-66.7	-46.2	173.7	-84.6	-175.2	163.6	165.2	-2.9	110.9	T176 K695 E696 S697 E701 K702 L703	T176-R699 VanDerWaalsContact OG1-CZ 3.31Å; T176-R699 PolarHBondContact OG1-NH1 2.92Å; T176-R699 PolarHBondContact OG1-NH2 3.43Å; K695-R699 PolarHBondContact O-N 3.22Å; E696-R699 WeakPolarHBondContact O-CB 3.41Å; E696-R699 PolarHBondContact O-N 3.27Å; E696-R699 VanDerWaalsContact O-N 3.17Å; S697-R699 PolarHBondContact O-N 2.87Å; R699-E701 VanDerWaalsContact C-N 3.34Å; R699-E701 PolarHBondContact O-N 3.09Å; R699-K702 WeakPolarHBondContact O-CB 3.32Å; R699-K702 PolarHBondContact O-N 3.41Å; R699-L703 WeakPolarHBondContact O-CG 3.44Å; R699-L703 PolarHBondContact O-N 2.95Å
700	L	54.2	Low	55.9	Low	90 Å²	90	97.2 Å²	97.2	47%	0.471	47%	0.472	S	S	.	.	H	α-helix	trans	-66.4	-36.3	179.3	-160.1	70	0	0	0	111.7	E696 S697 L703 R704	E696-L700 WeakPolarHBondContact O-CB 3.45Å; E696-L700 PolarHBondContact O-N 3.13Å; S697-L700 PolarHBondContact O-N 2.76Å; L700-L703 PolarHBondContact O-N 2.92Å; L700-R704 WeakPolarHBondContact O-CB 3.46Å; L700-R704 PolarHBondContact O-N 3.46Å
701	E	55.3	Low	54.2	Low	61 Å²	61	102.1 Å²	102.1	29%	0.285	51%	0.507	S	S	.	.	H	α-helix	trans	-69.3	-35.6	174.4	-155	-167.7	174.6	0	0	112.2	T467 S697 R699 R704 K705	T467-E701 HydrophobicContact CG2-CB 3.66Å; T467-E701 HydrophobicContact CG2-CG 3.9Å; S697-E701 WeakPolarHBondContact O-CB 3.33Å; S697-E701 PolarHBondContact O-N 3.11Å; R699-E701 VanDerWaalsContact C-N 3.34Å; R699-E701 PolarHBondContact O-N 3.09Å; E701-R704 PolarHBondContact O-N 3.18Å; E701-K705 HydrophobicContact CG-CD 4.49Å; E701-K705 WeakPolarHBondContact O-CB 2.99Å; E701-K705 WeakPolarHBondContact O-CG 3.43Å; E701-K705 PolarHBondContact O-N 3.01Å; E701-K705 WeakPolarHBondContact OE1-CE 3.33Å; E701-K705 IonicContact OE1-NZ 2.69Å; E701-K705 PolarHBondContact OE1-NZ 3.2Å; E701-K705 IonicContact OE2-NZ 3.49Å; E701-K705 PolarHBondContact OE2-NZ 3.39Å
702	K	55.8	Low	53	Low	141 Å²	141	109.4 Å²	109.4	61%	0.613	54%	0.536	S	S	*	.	H	α-helix	trans	-63.7	-43.1	172.2	-77.4	170.5	-175.1	171.8	0	111.2	E698 R699 K705 A706	E698-K702 WeakPolarHBondContact O-CB 3.48Å; E698-K702 VanDerWaalsContact O-CG 3.22Å; E698-K702 WeakPolarHBondContact O-CG 3.29Å; E698-K702 PolarHBondContact O-N 3.26Å; R699-K702 WeakPolarHBondContact O-CB 3.32Å; R699-K702 PolarHBondContact O-N 3.41Å; K702-K705 PolarHBondContact O-N 3.31Å; K702-A706 VanDerWaalsContact O-CB 3.32Å; K702-A706 WeakPolarHBondContact O-CB 3.47Å; K702-A706 PolarHBondContact O-N 2.87Å
703	L	55.8	Low	52.1	Low	116 Å²	116	108.5 Å²	108.5	61%	0.607	53%	0.531	S	S	*	.	H	α-helix	trans	-64.4	-42.5	174.3	-69.5	170.4	0	0	0	111.7	R699 L700 K705 A706 N707	R699-L703 WeakPolarHBondContact O-CG 3.44Å; R699-L703 PolarHBondContact O-N 2.95Å; L700-L703 PolarHBondContact O-N 2.92Å; L703-K705 PolarHBondContact O-N 3.49Å; L703-A706 PolarHBondContact O-N 3.03Å; L703-N707 PolarHBondContact O-N 2.86Å
704	R	54.1	Low	51.5	Low	151 Å²	151	110.7 Å²	110.7	57%	0.57	55%	0.549	S	S	*	.	H	α-helix	trans	-64.3	-38	176.9	-176.8	-178.8	145.8	96.5	4.6	112.7	L700 E701	L700-R704 WeakPolarHBondContact O-CB 3.46Å; L700-R704 PolarHBondContact O-N 3.46Å; E701-R704 PolarHBondContact O-N 3.18Å
705	K	56.9	Low	51.3	Low	144 Å²	144	111 Å²	111	63%	0.626	56%	0.556	S	S	*	*	H	α-helix	trans	-74.6	-27.7	174.2	-76.5	174.1	-176.3	157.3	0	112.6	E701 K702 L703 N707	E701-K705 HydrophobicContact CG-CD 4.49Å; E701-K705 WeakPolarHBondContact O-CB 2.99Å; E701-K705 WeakPolarHBondContact O-CG 3.43Å; E701-K705 PolarHBondContact O-N 3.01Å; E701-K705 WeakPolarHBondContact OE1-CE 3.33Å; E701-K705 IonicContact OE1-NZ 2.69Å; E701-K705 PolarHBondContact OE1-NZ 3.2Å; E701-K705 IonicContact OE2-NZ 3.49Å; E701-K705 PolarHBondContact OE2-NZ 3.39Å; K702-K705 PolarHBondContact O-N 3.31Å; L703-K705 PolarHBondContact O-N 3.49Å; K705-N707 VanDerWaalsContact C-N 3.27Å; K705-N707 PolarHBondContact O-N 3.4Å
706	A	54.3	Low	51.5	Low	79 Å²	79	108.5 Å²	108.5	65%	0.653	56%	0.555	S	S	*	*	H	α-helix	trans	-72.3	-18.2	176.9	0	0	0	0	0	113.3	K702 L703 P708	K702-A706 VanDerWaalsContact O-CB 3.32Å; K702-A706 WeakPolarHBondContact O-CB 3.47Å; K702-A706 PolarHBondContact O-N 2.87Å; L703-A706 PolarHBondContact O-N 3.03Å; A706-P708 VanDerWaalsContact C-CD 3.43Å; A706-P708 WeakPolarHBondContact O-CD 3.3Å
707	N	48.3	Very low	51.9	Low	71 Å²	71	110.7 Å²	110.7	38%	0.38	57%	0.565	S	S	.	*			trans	-115.8	76.1	176.9	-152	-8.8	0	0	0	112.3	L703 K705 K709 T710	L703-N707 PolarHBondContact O-N 2.86Å; K705-N707 VanDerWaalsContact C-N 3.27Å; K705-N707 PolarHBondContact O-N 3.4Å; N707-K709 PolarHBondContact O-N 3.41Å; N707-K709 VanDerWaalsContact O-N 3.08Å; N707-T710 PolarHBondContact O-OG1 3.14Å
708	P	50.6	Low	52.5	Low	93 Å²	93	116.3 Å²	116.3	60%	0.604	58%	0.583	S	S	*	*	G	3₁₀ helix	trans	-68.5	-6.3	-175.3	25.5	-33.4	0	0	0	114.8	A706 T710 S711	A706-P708 VanDerWaalsContact C-CD 3.43Å; A706-P708 WeakPolarHBondContact O-CD 3.3Å; P708-T710 VanDerWaalsContact C-N 3.31Å; P708-T710 PolarHBondContact O-N 2.82Å; P708-S711 PolarHBondContact O-OG 3.31Å
709	K	47	Very low	53.5	Low	182 Å²	182	112.4 Å²	112.4	79%	0.791	57%	0.566	S	S	*	*	G	3₁₀ helix	trans	-77.7	-4	-170.7	-70.7	-174	176.6	179.2	0	115.5	N707	N707-K709 PolarHBondContact O-N 3.41Å; N707-K709 VanDerWaalsContact O-N 3.08Å
710	T	49.8	Very low	55	Low	76 Å²	76	109.8 Å²	109.8	47%	0.466	56%	0.559	S	S	.	*	G	3₁₀ helix	trans	-98.9	-4.7	179.8	25.5	0	0	0	0	114.6	N707 P708 F939	N707-T710 PolarHBondContact O-OG1 3.14Å; P708-T710 VanDerWaalsContact C-N 3.31Å; P708-T710 PolarHBondContact O-N 2.82Å; T710-F939 HydrophobicContact CG2-CB 3.86Å
711	S	46.6	Very low	56.6	Low	103 Å²	103	112.3 Å²	112.3	72%	0.72	57%	0.567	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.8	-4.3	-175.3	64.3	0	0	0	0	115.3	P708	P708-S711 PolarHBondContact O-OG 3.31Å
712	Q	43.6	Very low	58.3	Low	170 Å²	170	109.6 Å²	109.6	79%	0.794	56%	0.555	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107.4	3.7	-170	-148.6	169.5	4.6	0	0	115	S714	Q712-S714 VanDerWaalsContact C-N 3.34Å; Q712-S714 PolarHBondContact O-N 3.34Å
713	F	46.2	Very low	59.9	Low	106 Å²	106	106 Å²	106	47%	0.465	54%	0.542	S	S	.	.			trans	-94.5	44.1	176.6	-93.8	-80.3	0	0	0	113.4	E715	F713-E715 PolarHBondContact O-N 3.38Å
714	S	47.6	Very low	61.7	Low	111 Å²	111	107.1 Å²	107.1	78%	0.776	54%	0.542	S	S	*	.			trans	-85.3	51.8	167.7	65	0	0	0	0	111.2	Q712	Q712-S714 VanDerWaalsContact C-N 3.34Å; Q712-S714 PolarHBondContact O-N 3.34Å
715	E	50.4	Low	63.6	Low	130 Å²	130	104 Å²	104	61%	0.607	54%	0.54	S	S	*	.			trans	-94.4	107.5	173.6	-73.6	-176.1	167	0	0	109.7	F713 H717 K865	F713-E715 PolarHBondContact O-N 3.38Å; E715-H717 PolarHBondContact O-N 3.04Å; E715-H717 VanDerWaalsContact O-N 3.13Å; E715-K865 PolarHBondContact O-NZ 3.32Å
716	C	56	Low	65.4	Low	91 Å²	91	97.1 Å²	97.1	62%	0.615	51%	0.51	S	S	*	.	G	3₁₀ helix	trans	-65	-2.9	174.2	-165	0	0	0	0	113.2	R718 S719	C716-R718 PolarHBondContact O-N 3.25Å; C716-S719 PolarHBondContact O-N 3.24Å
717	H	59.4	Low	67.4	Low	159 Å²	159	97 Å²	97	74%	0.736	50%	0.498	S	S	*	.	G	3₁₀ helix	trans	-57.5	-25.8	-166.2	-164.8	-107.4	0	0	0	114.3	E715 H720	E715-H717 PolarHBondContact O-N 3.04Å; E715-H717 VanDerWaalsContact O-N 3.13Å; H717-H720 PolarHBondContact O-ND1 3.31Å
718	R	65.2	Low	69.6	Low	138 Å²	138	99.9 Å²	99.9	52%	0.521	51%	0.513	S	S	.	.	G	3₁₀ helix	trans	-101	-2.7	-174.2	-144.8	171.7	-178.2	156.4	1.8	116	C716 Q863 K864 T869	C716-R718 PolarHBondContact O-N 3.25Å; R718-Q863 PolarHBondContact NH1-O 3.29Å; R718-K864 PolarHBondContact NE-O 2.96Å; R718-K864 PolarHBondContact NH1-O 3.38Å; R718-T869 PolarHBondContact O-OG1 2.62Å
719	S	75.2	Confident	71.8	Confident	6 Å²	6	97.1 Å²	97.1	4%	0.042	49%	0.492	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.5	-16.6	-177.9	-108.5	0	0	0	0	114.8	C716 K721 G722 L723 T872	C716-S719 PolarHBondContact O-N 3.24Å; S719-K721 VanDerWaalsContact C-N 3.34Å; S719-K721 PolarHBondContact O-N 3.44Å; S719-G722 PolarHBondContact O-N 2.98Å; S719-L723 PolarHBondContact O-N 2.8Å; S719-T872 PolarHBondContact OG-OG1 2.73Å
720	H	83.1	Confident	74.1	Confident	87 Å²	87	89.6 Å²	89.6	40%	0.403	46%	0.46	S	S	.	.	H	α-helix	trans	-56.8	-41	-164	67.2	-89.4	0	0	0	113.7	H717 G722 L723 F724	H717-H720 PolarHBondContact O-ND1 3.31Å; H720-G722 PolarHBondContact O-N 3Å; H720-L723 WeakPolarHBondContact O-CB 3.44Å; H720-L723 PolarHBondContact O-N 3.13Å; H720-F724 HydrophobicContact CB-CD2 4.13Å; H720-F724 HydrophobicContact CB-CE2 4.12Å; H720-F724 WeakPolarHBondContact O-CD2 3.48Å; H720-F724 PolarHBondContact O-N 3.02Å
721	K	88.1	Confident	76.3	Confident	144 Å²	144	91.6 Å²	91.6	63%	0.626	47%	0.465	S	S	*	.	H	α-helix	trans	-57.8	-46.4	-177.9	-61.5	-170.4	178.5	-173.6	0	112.8	S719 V725 T869	S719-K721 VanDerWaalsContact C-N 3.34Å; S719-K721 PolarHBondContact O-N 3.44Å; K721-V725 VanDerWaalsContact O-CG2 3.29Å; K721-V725 WeakPolarHBondContact O-CG2 3.45Å; K721-V725 PolarHBondContact O-N 3.45Å; K721-V725 VanDerWaalsContact O-N 3.14Å; K721-T869 HydrophobicContact CB-CG2 4.02Å
722	G	90	Very high	78.7	Confident	3 Å²	3	89.6 Å²	89.6	3%	0.031	46%	0.455	C	S	.	.	H	α-helix	trans	-69.8	-36.8	179.9	0	0	0	0	0	111.8	S719 H720 G726 T869	S719-G722 PolarHBondContact O-N 2.98Å; H720-G722 PolarHBondContact O-N 3Å; G722-G726 PolarHBondContact O-N 3.23Å; G722-T869 VanDerWaalsContact N-CG2 3.26Å
723	L	90.5	Very high	81.2	Confident	66 Å²	66	81.8 Å²	81.8	35%	0.346	42%	0.419	S	S	.	.	H	α-helix	trans	-62.5	-50.8	175.1	-176	68.6	0	0	0	111.8	S719 H720 G726 L727 T872 V876	S719-L723 PolarHBondContact O-N 2.8Å; H720-L723 WeakPolarHBondContact O-CB 3.44Å; H720-L723 PolarHBondContact O-N 3.13Å; L723-G726 PolarHBondContact O-N 3.37Å; L723-L727 HydrophobicContact CD1-CD1 4.35Å; L723-L727 HydrophobicContact CD1-CG 4.46Å; L723-L727 HydrophobicContact CG-CD1 4.04Å; L723-L727 HydrophobicContact CG-CG 4.49Å; L723-L727 WeakPolarHBondContact O-CB 3.24Å; L723-L727 VanDerWaalsContact O-CG 3.31Å; L723-L727 WeakPolarHBondContact O-CG 3.47Å; L723-L727 PolarHBondContact O-N 3.29Å; L723-T872 HydrophobicContact CB-CG2 3.88Å; L723-T872 HydrophobicContact CD1-CG2 4.24Å; L723-V876 HydrophobicContact CD1-CG2 4.04Å
724	F	93.1	Very high	83.5	Confident	139 Å²	139	79.3 Å²	79.3	61%	0.61	41%	0.41	S	S	*	.	H	α-helix	trans	-66.3	-41.5	-177.6	-81	-73.5	0	0	0	112.8	H720 G726 L727 L728	H720-F724 HydrophobicContact CB-CD2 4.13Å; H720-F724 HydrophobicContact CB-CE2 4.12Å; H720-F724 WeakPolarHBondContact O-CD2 3.48Å; H720-F724 PolarHBondContact O-N 3.02Å; F724-G726 VanDerWaalsContact C-N 3.32Å; F724-L727 PolarHBondContact O-N 3.16Å; F724-L728 PolarHBondContact O-N 2.87Å
725	V	94.5	Very high	85.9	Confident	86 Å²	86	78.3 Å²	78.3	52%	0.521	40%	0.399	S	S	.	.	H	α-helix	trans	-64.6	-39.9	174.5	177	0	0	0	0	110.6	K721 L728 L729 F873	K721-V725 VanDerWaalsContact O-CG2 3.29Å; K721-V725 WeakPolarHBondContact O-CG2 3.45Å; K721-V725 PolarHBondContact O-N 3.45Å; K721-V725 VanDerWaalsContact O-N 3.14Å; V725-L728 PolarHBondContact O-N 3.44Å; V725-L729 PolarHBondContact O-N 3.44Å; V725-L729 VanDerWaalsContact O-N 3.12Å; V725-F873 HydrophobicContact CB-CD2 4.32Å; V725-F873 HydrophobicContact CB-CE2 4.38Å; V725-F873 HydrophobicContact CG1-CD2 4.12Å; V725-F873 HydrophobicContact CG1-CE2 3.74Å; V725-F873 HydrophobicContact CG1-CZ 4.42Å
726	G	94.8	Very high	88	Confident	0 Å²	0	72.9 Å²	72.9	0%	0	38%	0.377	C	S	.	.	H	α-helix	trans	-62.5	-46.7	175.6	0	0	0	0	0	112.5	G722 L723 F724 L728 L729 F730 F873 V876	G722-G726 PolarHBondContact O-N 3.23Å; L723-G726 PolarHBondContact O-N 3.37Å; F724-G726 VanDerWaalsContact C-N 3.32Å; G726-L728 VanDerWaalsContact C-N 3.35Å; G726-L728 PolarHBondContact O-N 3.28Å; G726-L729 PolarHBondContact O-N 2.91Å; G726-F730 WeakPolarHBondContact O-CB 3.44Å; G726-F730 PolarHBondContact O-N 3.48Å; G726-F873 VanDerWaalsContact CA-CD2 3.46Å; G726-V876 VanDerWaalsContact O-CG1 3.31Å; G726-V876 WeakPolarHBondContact O-CG1 3.21Å
727	L	94.7	Very high	89.8	Confident	76 Å²	76	69.1 Å²	69.1	40%	0.398	35%	0.35	S	S	.	.	H	α-helix	trans	-63.6	-39.2	178.1	-73.6	172.7	0	0	0	111.9	L723 F724 L729 F730 M731 V876	L723-L727 HydrophobicContact CD1-CD1 4.35Å; L723-L727 HydrophobicContact CD1-CG 4.46Å; L723-L727 HydrophobicContact CG-CD1 4.04Å; L723-L727 HydrophobicContact CG-CG 4.49Å; L723-L727 WeakPolarHBondContact O-CB 3.24Å; L723-L727 VanDerWaalsContact O-CG 3.31Å; L723-L727 WeakPolarHBondContact O-CG 3.47Å; L723-L727 PolarHBondContact O-N 3.29Å; F724-L727 PolarHBondContact O-N 3.16Å; L727-L729 VanDerWaalsContact C-N 3.34Å; L727-L729 PolarHBondContact O-N 3.01Å; L727-F730 PolarHBondContact O-N 3.49Å; L727-M731 VanDerWaalsContact O-CG 3.26Å; L727-M731 WeakPolarHBondContact O-CG 3.48Å; L727-M731 PolarHBondContact O-N 2.82Å; L727-V876 HydrophobicContact CD2-CG1 4.41Å
728	L	95.9	Very high	91.4	Very high	132 Å²	132	64.8 Å²	64.8	69%	0.691	34%	0.338	S	S	*	.	H	α-helix	trans	-60.9	-44.9	175.1	-177.5	66.5	0	0	0	111.4	F724 V725 G726 M731 A732	F724-L728 PolarHBondContact O-N 2.87Å; V725-L728 PolarHBondContact O-N 3.44Å; G726-L728 VanDerWaalsContact C-N 3.35Å; G726-L728 PolarHBondContact O-N 3.28Å; L728-M731 PolarHBondContact O-N 3.03Å; L728-A732 PolarHBondContact O-N 3.38Å
729	L	96	Very high	92.8	Very high	34 Å²	34	61.5 Å²	61.5	18%	0.178	33%	0.33	C	S	.	.	H	α-helix	trans	-64.5	-42.8	176	-179.6	154.9	0	0	0	111.4	V725 G726 L727 M731 A732 T733 L764 V767 F873 L877 A880	V725-L729 PolarHBondContact O-N 3.44Å; V725-L729 VanDerWaalsContact O-N 3.12Å; G726-L729 PolarHBondContact O-N 2.91Å; L727-L729 VanDerWaalsContact C-N 3.34Å; L727-L729 PolarHBondContact O-N 3.01Å; L729-M731 VanDerWaalsContact C-N 3.34Å; L729-M731 PolarHBondContact O-N 3.38Å; L729-A732 WeakPolarHBondContact O-CB 3.39Å; L729-A732 PolarHBondContact O-N 3.49Å; L729-A732 VanDerWaalsContact O-N 3.16Å; L729-T733 HydrophobicContact CD2-CG2 4.18Å; L729-T733 WeakPolarHBondContact O-CG2 3.48Å; L729-T733 PolarHBondContact O-N 3.3Å; L729-T733 PolarHBondContact O-OG1 2.96Å; L729-L764 HydrophobicContact CD1-CD2 4.48Å; L729-L764 HydrophobicContact CD2-CD2 3.49Å; L729-L764 VanDerWaalsContact CD2-CD2 3.49Å; L729-L764 HydrophobicContact CG-CD2 4.25Å; L729-V767 HydrophobicContact CD1-CG1 4.13Å; L729-F873 HydrophobicContact CD1-CE2 4.38Å; L729-F873 HydrophobicContact CD1-CZ 4.07Å; L729-L877 HydrophobicContact CD1-CD1 3.94Å; L729-L877 HydrophobicContact CD2-CD1 3.5Å; L729-L877 VanDerWaalsContact CD2-CD1 3.5Å; L729-L877 HydrophobicContact CG-CD1 4.4Å; L729-A880 HydrophobicContact CD2-CB 4.16Å
730	F	95.7	Very high	93.6	Very high	24 Å²	24	61.2 Å²	61.2	11%	0.105	33%	0.328	C	S	.	.	H	α-helix	trans	-59.1	-43.3	175.2	-175.1	-105.5	0	0	0	111.9	G726 L727 A732 T733 L734 V876 L879 A880 F883	G726-F730 WeakPolarHBondContact O-CB 3.44Å; G726-F730 PolarHBondContact O-N 3.48Å; L727-F730 PolarHBondContact O-N 3.49Å; F730-A732 PolarHBondContact O-N 2.96Å; F730-T733 VanDerWaalsContact C-OG1 3.29Å; F730-T733 VanDerWaalsContact CA-OG1 3.32Å; F730-T733 WeakPolarHBondContact CA-OG1 3.39Å; F730-T733 PolarHBondContact O-N 3.44Å; F730-T733 PolarHBondContact O-OG1 2.95Å; F730-L734 HydrophobicContact CD1-CD1 4.09Å; F730-L734 HydrophobicContact CD1-CG 4.49Å; F730-L734 HydrophobicContact CE1-CD1 3.69Å; F730-L734 HydrophobicContact CE1-CG 4.2Å; F730-L734 HydrophobicContact CZ-CD1 4.26Å; F730-L734 HydrophobicContact CZ-CD2 4.28Å; F730-L734 HydrophobicContact CZ-CG 4.4Å; F730-L734 WeakPolarHBondContact O-CG 3.38Å; F730-L734 PolarHBondContact O-N 3.46Å; F730-V876 HydrophobicContact CB-CG1 3.92Å; F730-V876 HydrophobicContact CG-CG1 4.46Å; F730-L879 HydrophobicContact CE2-CD2 4.38Å; F730-L879 HydrophobicContact CE2-CG 4.16Å; F730-A880 HydrophobicContact CD2-CB 3.72Å; F730-A880 HydrophobicContact CE2-CB 4.44Å; F730-F883 HydrophobicContact CE2-CB 4.44Å; F730-F883 AromaticContact CE2-CD2 3.6Å; F730-F883 HydrophobicContact CE2-CD2 3.6Å; F730-F883 AromaticContact CE2-CE2 4Å; F730-F883 HydrophobicContact CE2-CE2 4Å; F730-F883 HydrophobicContact CE2-CG 4.05Å; F730-F883 HydrophobicContact CZ-CD1 4.5Å; F730-F883 AromaticContact CZ-CD2 3.71Å; F730-F883 HydrophobicContact CZ-CD2 3.71Å; F730-F883 HydrophobicContact CZ-CE1 4.46Å; F730-F883 AromaticContact CZ-CE2 3.66Å; F730-F883 HydrophobicContact CZ-CE2 3.66Å; F730-F883 HydrophobicContact CZ-CG 4.15Å; F730-F883 HydrophobicContact CZ-CZ 4.06Å
731	M	96.3	Very high	93.9	Very high	119 Å²	119	59.8 Å²	59.8	59%	0.586	32%	0.321	S	S	*	.	H	α-helix	trans	-64.3	-40.5	175.2	-66.6	-60.9	-101.7	0	0	111.8	L727 L728 L729 T733 L734 V735	L727-M731 VanDerWaalsContact O-CG 3.26Å; L727-M731 WeakPolarHBondContact O-CG 3.48Å; L727-M731 PolarHBondContact O-N 2.82Å; L728-M731 PolarHBondContact O-N 3.03Å; L729-M731 VanDerWaalsContact C-N 3.34Å; L729-M731 PolarHBondContact O-N 3.38Å; M731-T733 VanDerWaalsContact C-N 3.31Å; M731-T733 PolarHBondContact O-N 2.81Å; M731-L734 PolarHBondContact O-N 3.01Å; M731-L734 HydrophobicContact SD-CD1 4.18Å; M731-V735 WeakPolarHBondContact O-CG2 3.48Å; M731-V735 PolarHBondContact O-N 3.32Å; M731-V735 VanDerWaalsContact O-N 3.13Å
732	A	96.4	Very high	94.1	Very high	61 Å²	61	57.3 Å²	57.3	50%	0.504	31%	0.313	S	S	.	.	H	α-helix	trans	-61.5	-39	174.4	0	0	0	0	0	112	L728 L729 F730 V735 A736	L728-A732 PolarHBondContact O-N 3.38Å; L729-A732 WeakPolarHBondContact O-CB 3.39Å; L729-A732 PolarHBondContact O-N 3.49Å; L729-A732 VanDerWaalsContact O-N 3.16Å; F730-A732 PolarHBondContact O-N 2.96Å; A732-V735 PolarHBondContact O-N 3.02Å; A732-A736 PolarHBondContact O-N 3.41Å
733	T	96.2	Very high	94.2	Very high	5 Å²	5	59 Å²	59	3%	0.031	32%	0.32	C	S	.	.	H	α-helix	trans	-64.5	-42.1	174.9	52.3	0	0	0	0	112.5	L729 F730 M731 V735 A736 M737 T760 L764 A880	L729-T733 HydrophobicContact CD2-CG2 4.18Å; L729-T733 WeakPolarHBondContact O-CG2 3.48Å; L729-T733 PolarHBondContact O-N 3.3Å; L729-T733 PolarHBondContact O-OG1 2.96Å; F730-T733 VanDerWaalsContact C-OG1 3.29Å; F730-T733 VanDerWaalsContact CA-OG1 3.32Å; F730-T733 WeakPolarHBondContact CA-OG1 3.39Å; F730-T733 PolarHBondContact O-N 3.44Å; F730-T733 PolarHBondContact O-OG1 2.95Å; M731-T733 VanDerWaalsContact C-N 3.31Å; M731-T733 PolarHBondContact O-N 2.81Å; T733-V735 VanDerWaalsContact C-N 3.29Å; T733-V735 PolarHBondContact O-N 2.83Å; T733-A736 PolarHBondContact O-N 3.07Å; T733-M737 VanDerWaalsContact O-CG 3.28Å; T733-M737 WeakPolarHBondContact O-CG 3.41Å; T733-M737 PolarHBondContact O-N 2.87Å; T733-T760 HydrophobicContact CG2-CG2 4.41Å; T733-L764 HydrophobicContact CG2-CD1 3.72Å; T733-L764 HydrophobicContact CG2-CD2 3.49Å; T733-L764 VanDerWaalsContact CG2-CD2 3.49Å; T733-L764 HydrophobicContact CG2-CG 4.06Å; T733-A880 HydrophobicContact CG2-CB 4.2Å
734	L	95.2	Very high	94	Very high	55 Å²	55	57.2 Å²	57.2	29%	0.288	31%	0.311	S	S	.	.	H	α-helix	trans	-62.4	-36.8	177	-67.4	178.9	0	0	0	112.5	F730 M731 M737 S738 F883	F730-L734 HydrophobicContact CD1-CD1 4.09Å; F730-L734 HydrophobicContact CD1-CG 4.49Å; F730-L734 HydrophobicContact CE1-CD1 3.69Å; F730-L734 HydrophobicContact CE1-CG 4.2Å; F730-L734 HydrophobicContact CZ-CD1 4.26Å; F730-L734 HydrophobicContact CZ-CD2 4.28Å; F730-L734 HydrophobicContact CZ-CG 4.4Å; F730-L734 WeakPolarHBondContact O-CG 3.38Å; F730-L734 PolarHBondContact O-N 3.46Å; M731-L734 PolarHBondContact O-N 3.01Å; M731-L734 HydrophobicContact SD-CD1 4.18Å; L734-M737 HydrophobicContact CD2-SD 4.4Å; L734-M737 PolarHBondContact O-N 2.95Å; L734-S738 WeakPolarHBondContact O-CB 3.48Å; L734-S738 PolarHBondContact O-N 2.98Å; L734-S738 PolarHBondContact O-OG 3.4Å; L734-F883 HydrophobicContact CD2-CD1 4.16Å
735	V	96.2	Very high	93.7	Very high	90 Å²	90	55.1 Å²	55.1	55%	0.545	31%	0.309	S	S	.	.	H	α-helix	trans	-66.6	-46	174.5	174.5	0	0	0	0	110.8	M731 A732 T733 M737 S738 L739	M731-V735 WeakPolarHBondContact O-CG2 3.48Å; M731-V735 PolarHBondContact O-N 3.32Å; M731-V735 VanDerWaalsContact O-N 3.13Å; A732-V735 PolarHBondContact O-N 3.02Å; T733-V735 VanDerWaalsContact C-N 3.29Å; T733-V735 PolarHBondContact O-N 2.83Å; V735-M737 VanDerWaalsContact C-N 3.28Å; V735-M737 PolarHBondContact O-N 3.46Å; V735-S738 PolarHBondContact O-N 3.31Å; V735-L739 HydrophobicContact CG1-CD1 4.37Å; V735-L739 WeakPolarHBondContact O-CG 3.41Å; V735-L739 PolarHBondContact O-N 3.33Å
736	A	95.5	Very high	93.3	Very high	16 Å²	16	56.5 Å²	56.5	13%	0.132	31%	0.308	C	S	.	.	H	α-helix	trans	-58.9	-41.7	175.8	0	0	0	0	0	111.5	A732 T733 L739 F740 T760	A732-A736 PolarHBondContact O-N 3.41Å; T733-A736 PolarHBondContact O-N 3.07Å; A736-L739 WeakPolarHBondContact O-CB 3.32Å; A736-L739 PolarHBondContact O-N 3.22Å; A736-F740 PolarHBondContact O-N 3Å; A736-T760 HydrophobicContact CB-CG2 4.06Å
737	M	93.2	Very high	92.7	Very high	11 Å²	11	64 Å²	64	5%	0.054	34%	0.336	C	S	.	.	H	α-helix	trans	-64.7	-43.5	177.8	-69.9	177.7	73	0	0	112.7	T733 L734 V735 L739 F740 F741 F883 V884 F887 E888	T733-M737 VanDerWaalsContact O-CG 3.28Å; T733-M737 WeakPolarHBondContact O-CG 3.41Å; T733-M737 PolarHBondContact O-N 2.87Å; L734-M737 HydrophobicContact CD2-SD 4.4Å; L734-M737 PolarHBondContact O-N 2.95Å; V735-M737 VanDerWaalsContact C-N 3.28Å; V735-M737 PolarHBondContact O-N 3.46Å; M737-L739 PolarHBondContact O-N 3.42Å; M737-F740 WeakPolarHBondContact O-CB 3.27Å; M737-F740 PolarHBondContact O-N 3.14Å; M737-F740 VanDerWaalsContact O-N 3.12Å; M737-F741 WeakPolarHBondContact O-CD2 3.36Å; M737-F741 PolarHBondContact O-N 3.09Å; M737-F741 VanDerWaalsContact O-N 3.09Å; M737-F883 WeakPolarHBondContact CE-O 3.31Å; M737-F883 HydrophobicContact SD-CB 4.27Å; M737-V884 HydrophobicContact CG-CG2 4.03Å; M737-V884 HydrophobicContact SD-CG2 3.87Å; M737-F887 HydrophobicContact CE-CB 3.66Å; M737-F887 HydrophobicContact CE-CD2 3.92Å; M737-F887 HydrophobicContact CE-CG 4.22Å; M737-E888 WeakPolarHBondContact CA-OE1 3.4Å; M737-E888 WeakPolarHBondContact CB-OE1 3.17Å; M737-E888 HydrophobicContact CE-CG 3.9Å; M737-E888 HydrophobicContact CG-CG 4.38Å; M737-E888 WeakPolarHBondContact CG-OE1 3.36Å
738	S	93.2	Very high	92.3	Very high	68 Å²	68	67.8 Å²	67.8	48%	0.476	36%	0.357	S	S	.	.	H	α-helix	trans	-58.8	-40.5	175.9	-57.6	0	0	0	0	111.3	L734 V735 I742	L734-S738 WeakPolarHBondContact O-CB 3.48Å; L734-S738 PolarHBondContact O-N 2.98Å; L734-S738 PolarHBondContact O-OG 3.4Å; V735-S738 PolarHBondContact O-N 3.31Å; S738-I742 WeakPolarHBondContact O-CD1 3.43Å; S738-I742 VanDerWaalsContact O-CG1 3.23Å; S738-I742 WeakPolarHBondContact O-CG1 3.37Å; S738-I742 PolarHBondContact O-N 3.48Å; S738-I742 VanDerWaalsContact O-N 3.16Å
739	L	94	Very high	91.9	Very high	69 Å²	69	65.1 Å²	65.1	36%	0.361	34%	0.338	S	S	.	.	H	α-helix	trans	-67.1	-37.8	175.7	-70	173.7	0	0	0	112.5	V735 A736 M737 I742 F743 L756	V735-L739 HydrophobicContact CG1-CD1 4.37Å; V735-L739 WeakPolarHBondContact O-CG 3.41Å; V735-L739 PolarHBondContact O-N 3.33Å; A736-L739 WeakPolarHBondContact O-CB 3.32Å; A736-L739 PolarHBondContact O-N 3.22Å; M737-L739 PolarHBondContact O-N 3.42Å; L739-I742 PolarHBondContact O-N 2.72Å; L739-F743 HydrophobicContact CB-CE2 4.49Å; L739-F743 HydrophobicContact CD2-CZ 4.39Å; L739-F743 WeakPolarHBondContact O-CB 3.36Å; L739-F743 VanDerWaalsContact O-CG 3.23Å; L739-F743 WeakPolarHBondContact O-CG 3.47Å; L739-F743 PolarHBondContact O-N 2.97Å; L739-L756 HydrophobicContact CB-CD2 3.63Å
740	F	93.1	Very high	91.4	Very high	0 Å²	0	67.3 Å²	67.3	0%	0	34%	0.344	C	S	.	.	H	α-helix	trans	-57.6	-51.6	174.2	166.6	-98	0	0	0	111.2	A736 M737 I742 F743 I744 A753 L756 E888 H891 A892	A736-F740 PolarHBondContact O-N 3Å; M737-F740 WeakPolarHBondContact O-CB 3.27Å; M737-F740 PolarHBondContact O-N 3.14Å; M737-F740 VanDerWaalsContact O-N 3.12Å; F740-I742 VanDerWaalsContact C-N 3.3Å; F740-I742 PolarHBondContact O-N 2.91Å; F740-F743 PolarHBondContact O-N 2.95Å; F740-I744 HydrophobicContact CE1-CG2 4.48Å; F740-I744 HydrophobicContact CE2-CB 4.4Å; F740-I744 HydrophobicContact CE2-CD1 4.12Å; F740-I744 HydrophobicContact CE2-CG1 4.42Å; F740-I744 HydrophobicContact CZ-CB 4.29Å; F740-I744 HydrophobicContact CZ-CD1 4.23Å; F740-I744 HydrophobicContact CZ-CG1 4.16Å; F740-I744 WeakPolarHBondContact O-CB 3.3Å; F740-I744 PolarHBondContact O-N 3.35Å; F740-A753 HydrophobicContact CD2-CB 3.95Å; F740-A753 WeakPolarHBondContact CD2-O 3.5Å; F740-A753 HydrophobicContact CE2-CB 4.21Å; F740-L756 HydrophobicContact CB-CD2 4.49Å; F740-E888 VanDerWaalsContact CB-OE1 3.31Å; F740-E888 WeakPolarHBondContact CB-OE1 3.39Å; F740-E888 HydrophobicContact CD1-CB 4.21Å; F740-E888 VanDerWaalsContact CD1-CD 3.49Å; F740-E888 HydrophobicContact CD1-CG 3.75Å; F740-E888 WeakPolarHBondContact CD1-OE1 3.29Å; F740-E888 HydrophobicContact CE1-CB 3.99Å; F740-E888 HydrophobicContact CE1-CG 3.97Å; F740-E888 WeakPolarHBondContact CG-OE1 3.48Å; F740-H891 HydrophobicContact CE1-CB 3.94Å; F740-H891 HydrophobicContact CZ-CB 3.79Å; F740-A892 HydrophobicContact CE2-CB 3.97Å; F740-A892 HydrophobicContact CZ-CB 3.91Å
741	F	89.6	Confident	90.9	Very high	58 Å²	58	71.6 Å²	71.6	25%	0.254	37%	0.368	S	S	.	.	H	α-helix	trans	-61.9	-35.3	178.2	-76	-67.8	0	0	0	113	M737 F743 I744 V745 F887 E888	M737-F741 WeakPolarHBondContact O-CD2 3.36Å; M737-F741 PolarHBondContact O-N 3.09Å; M737-F741 VanDerWaalsContact O-N 3.09Å; F741-F743 VanDerWaalsContact C-N 3.32Å; F741-F743 PolarHBondContact O-N 2.84Å; F741-I744 WeakPolarHBondContact O-CG2 3.46Å; F741-V745 WeakPolarHBondContact O-CG2 3.39Å; F741-F887 HydrophobicContact CE2-CB 4.29Å; F741-F887 HydrophobicContact CZ-CB 4.1Å; F741-F887 WeakPolarHBondContact CZ-O 3.43Å; F741-E888 HydrophobicContact CE2-CG 4.12Å; F741-E888 HydrophobicContact CZ-CG 4.26Å
742	I	92	Very high	90.7	Very high	92 Å²	92	69.5 Å²	69.5	47%	0.472	36%	0.362	S	S	.	.	H	α-helix	trans	-67.6	-34.1	174.8	-67.2	164.1	0	0	0	111.6	S738 L739 F740	S738-I742 WeakPolarHBondContact O-CD1 3.43Å; S738-I742 VanDerWaalsContact O-CG1 3.23Å; S738-I742 WeakPolarHBondContact O-CG1 3.37Å; S738-I742 PolarHBondContact O-N 3.48Å; S738-I742 VanDerWaalsContact O-N 3.16Å; L739-I742 PolarHBondContact O-N 2.72Å; F740-I742 VanDerWaalsContact C-N 3.3Å; F740-I742 PolarHBondContact O-N 2.91Å
743	F	91.7	Very high	90.4	Very high	37 Å²	37	66.6 Å²	66.6	16%	0.162	34%	0.338	C	S	.	.	H	α-helix	trans	-86.2	-34.9	-176.7	-67	-10.9	0	0	0	113	L739 F740 F741 V745 K746 R749 T752 A753 L756	L739-F743 HydrophobicContact CB-CE2 4.49Å; L739-F743 HydrophobicContact CD2-CZ 4.39Å; L739-F743 WeakPolarHBondContact O-CB 3.36Å; L739-F743 VanDerWaalsContact O-CG 3.23Å; L739-F743 WeakPolarHBondContact O-CG 3.47Å; L739-F743 PolarHBondContact O-N 2.97Å; F740-F743 PolarHBondContact O-N 2.95Å; F741-F743 VanDerWaalsContact C-N 3.32Å; F741-F743 PolarHBondContact O-N 2.84Å; F743-V745 VanDerWaalsContact C-N 3.31Å; F743-V745 PolarHBondContact O-N 3.31Å; F743-K746 PolarHBondContact O-N 3.08Å; F743-K746 VanDerWaalsContact O-N 3.14Å; F743-R749 HydrophobicContact CB-CB 4.4Å; F743-R749 VanDerWaalsContact CE1-NH2 3.33Å; F743-T752 HydrophobicContact CD2-CG2 4.28Å; F743-T752 HydrophobicContact CE2-CG2 4.43Å; F743-A753 HydrophobicContact CB-CB 3.57Å; F743-L756 HydrophobicContact CD2-CD2 4.23Å; F743-L756 HydrophobicContact CE2-CD2 4.37Å
744	I	87.4	Confident	90.2	Very high	30 Å²	30	67 Å²	67	15%	0.154	34%	0.34	C	S	.	.	H	α-helix	trans	-66	-33.4	-177.5	-161.5	67.7	0	0	0	112.2	F740 F741 K746 R750 A753	F740-I744 HydrophobicContact CE1-CG2 4.48Å; F740-I744 HydrophobicContact CE2-CB 4.4Å; F740-I744 HydrophobicContact CE2-CD1 4.12Å; F740-I744 HydrophobicContact CE2-CG1 4.42Å; F740-I744 HydrophobicContact CZ-CB 4.29Å; F740-I744 HydrophobicContact CZ-CD1 4.23Å; F740-I744 HydrophobicContact CZ-CG1 4.16Å; F740-I744 WeakPolarHBondContact O-CB 3.3Å; F740-I744 PolarHBondContact O-N 3.35Å; F741-I744 WeakPolarHBondContact O-CG2 3.46Å; I744-K746 VanDerWaalsContact C-N 3.27Å; I744-K746 PolarHBondContact O-N 3.22Å; I744-R750 WeakPolarHBondContact O-CG 3.14Å; I744-A753 HydrophobicContact CB-CB 4.11Å; I744-A753 HydrophobicContact CD1-CB 4.06Å
745	V	85.4	Confident	90	Very high	95 Å²	95	67.8 Å²	67.8	58%	0.576	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.7	-30.2	176.1	176.1	0	0	0	0	111.5	F741 F743 R747	F741-V745 WeakPolarHBondContact O-CG2 3.39Å; F743-V745 VanDerWaalsContact C-N 3.31Å; F743-V745 PolarHBondContact O-N 3.31Å; V745-R747 PolarHBondContact O-N 2.88Å
746	K	86.7	Confident	89.9	Confident	114 Å²	114	65.8 Å²	65.8	50%	0.496	33%	0.333	S	S	.	.	S	Bend	trans	-86.1	111	179.7	-63.7	-163.2	-174.5	-176	0	110.4	F743 I744 D748 R749 R750	F743-K746 PolarHBondContact O-N 3.08Å; F743-K746 VanDerWaalsContact O-N 3.14Å; I744-K746 VanDerWaalsContact C-N 3.27Å; I744-K746 PolarHBondContact O-N 3.22Å; K746-D748 PolarHBondContact O-N 3.44Å; K746-D748 VanDerWaalsContact O-N 3.11Å; K746-R749 HydrophobicContact CB-CB 4.28Å; K746-R749 CarbonylContact O-C 3.59Å; K746-R749 PolarHBondContact O-N 3.21Å; K746-R750 PolarHBondContact O-N 3.45Å; K746-R750 VanDerWaalsContact O-N 3.16Å
747	R	81.9	Confident	89.8	Confident	157 Å²	157	65 Å²	65	59%	0.592	33%	0.326	S	S	*	.	G	3₁₀ helix	trans	-47.1	-43.8	179.4	-170.6	178.8	177.7	91.3	2.8	113.5	E577 V745 R749	E577-R747 IonicContact OE1-NH1 3.48Å; E577-R747 PolarHBondContact OE1-NH1 3.01Å; V745-R747 PolarHBondContact O-N 2.88Å; R747-R749 VanDerWaalsContact C-N 3.29Å; R747-R749 PolarHBondContact O-N 2.98Å
748	D	85.9	Confident	89.8	Confident	157 Å²	157	64.5 Å²	64.5	84%	0.84	32%	0.324	S	S	*	.	G	3₁₀ helix	trans	-67.3	-24.8	-179.8	-168.7	47.7	0	0	0	113.8	K746	K746-D748 PolarHBondContact O-N 3.44Å; K746-D748 VanDerWaalsContact O-N 3.11Å
749	R	87.7	Confident	89.8	Confident	76 Å²	76	62.7 Å²	62.7	29%	0.287	32%	0.316	S	S	.	.	G	3₁₀ helix	trans	-110.2	9.2	-177	-59.4	-161.4	-62.4	-177.3	-0.7	114.2	F743 K746 R747 N751 T752 A753	F743-R749 HydrophobicContact CB-CB 4.4Å; F743-R749 VanDerWaalsContact CE1-NH2 3.33Å; K746-R749 HydrophobicContact CB-CB 4.28Å; K746-R749 CarbonylContact O-C 3.59Å; K746-R749 PolarHBondContact O-N 3.21Å; R747-R749 VanDerWaalsContact C-N 3.29Å; R747-R749 PolarHBondContact O-N 2.98Å; R749-N751 VanDerWaalsContact C-N 3.3Å; R749-N751 PolarHBondContact O-N 3.33Å; R749-T752 WeakPolarHBondContact O-CB 3.49Å; R749-T752 PolarHBondContact O-N 3.49Å; R749-T752 VanDerWaalsContact O-N 3.08Å; R749-A753 PolarHBondContact O-N 2.9Å
750	R	85.9	Confident	89.8	Confident	79 Å²	79	60.4 Å²	60.4	30%	0.298	31%	0.305	S	S	.	.	H	α-helix	trans	-55.6	-43.3	177.8	-71.3	-176.4	-167.3	173.6	7.1	112	E577 I744 K746 T752 A753 I754	E577-R750 IonicContact OE1-CZ 2.98Å; E577-R750 IonicContact OE1-NH1 2.73Å; E577-R750 PolarHBondContact OE1-NH1 3.5Å; E577-R750 IonicContact OE1-NH2 3.49Å; E577-R750 PolarHBondContact OE1-NH2 3.38Å; I744-R750 WeakPolarHBondContact O-CG 3.14Å; K746-R750 PolarHBondContact O-N 3.45Å; K746-R750 VanDerWaalsContact O-N 3.16Å; R750-T752 VanDerWaalsContact C-N 3.33Å; R750-T752 PolarHBondContact O-N 3.21Å; R750-A753 WeakPolarHBondContact O-CB 3.46Å; R750-A753 PolarHBondContact O-N 2.99Å; R750-I754 WeakPolarHBondContact O-CG1 3.41Å; R750-I754 PolarHBondContact O-N 3.36Å
751	N	86.3	Confident	89.9	Confident	114 Å²	114	60.4 Å²	60.4	61%	0.61	31%	0.305	S	S	*	.	H	α-helix	trans	-64.4	-37.1	178.1	-70	-16.1	0	0	0	112.5	R749 T755	R749-N751 VanDerWaalsContact C-N 3.3Å; R749-N751 PolarHBondContact O-N 3.33Å; N751-T755 WeakPolarHBondContact O-CB 3.34Å; N751-T755 PolarHBondContact O-N 3.37Å; N751-T755 PolarHBondContact O-OG1 2.87Å
752	T	90.6	Very high	90.2	Very high	76 Å²	76	59 Å²	59	47%	0.466	30%	0.299	S	S	.	.	H	α-helix	trans	-67.3	-40	174.6	-51.2	0	0	0	0	111.1	F743 R749 R750 T755 L756	F743-T752 HydrophobicContact CD2-CG2 4.28Å; F743-T752 HydrophobicContact CE2-CG2 4.43Å; R749-T752 WeakPolarHBondContact O-CB 3.49Å; R749-T752 PolarHBondContact O-N 3.49Å; R749-T752 VanDerWaalsContact O-N 3.08Å; R750-T752 VanDerWaalsContact C-N 3.33Å; R750-T752 PolarHBondContact O-N 3.21Å; T752-T755 PolarHBondContact O-N 2.9Å; T752-L756 WeakPolarHBondContact O-CB 3.33Å; T752-L756 PolarHBondContact O-N 3.29Å
753	A	91.6	Very high	90.4	Very high	0 Å²	0	58.9 Å²	58.9	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-59	-50.2	174.7	0	0	0	0	0	111	F740 F743 I744 R749 R750 T755 L756 Y757	F740-A753 HydrophobicContact CD2-CB 3.95Å; F740-A753 WeakPolarHBondContact CD2-O 3.5Å; F740-A753 HydrophobicContact CE2-CB 4.21Å; F743-A753 HydrophobicContact CB-CB 3.57Å; I744-A753 HydrophobicContact CB-CB 4.11Å; I744-A753 HydrophobicContact CD1-CB 4.06Å; R749-A753 PolarHBondContact O-N 2.9Å; R750-A753 WeakPolarHBondContact O-CB 3.46Å; R750-A753 PolarHBondContact O-N 2.99Å; A753-T755 VanDerWaalsContact C-N 3.32Å; A753-T755 PolarHBondContact O-N 2.87Å; A753-L756 WeakPolarHBondContact O-CB 3.35Å; A753-L756 PolarHBondContact O-N 3.4Å; A753-L756 VanDerWaalsContact O-N 3.16Å; A753-Y757 PolarHBondContact O-N 2.73Å
754	I	90.4	Very high	90.7	Very high	13 Å²	13	57.3 Å²	57.3	7%	0.067	30%	0.296	C	S	.	.	H	α-helix	trans	-60.9	-43.6	178.3	-65	168.3	0	0	0	110.4	R750 L756 Y757 Q758 Y830 H895	R750-I754 WeakPolarHBondContact O-CG1 3.41Å; R750-I754 PolarHBondContact O-N 3.36Å; I754-L756 VanDerWaalsContact C-N 3.32Å; I754-L756 PolarHBondContact O-N 3.47Å; I754-Y757 PolarHBondContact O-N 3.2Å; I754-Q758 HydrophobicContact CG2-CG 4.16Å; I754-Q758 WeakPolarHBondContact O-CB 3.4Å; I754-Q758 WeakPolarHBondContact O-CG 3.4Å; I754-Q758 PolarHBondContact O-N 3.48Å; I754-Y830 HydrophobicContact CG2-CE2 4.32Å; I754-Y830 WeakPolarHBondContact CG2-OH 3.23Å; I754-H895 VanDerWaalsContact CD1-ND1 3.3Å; I754-H895 WeakPolarHBondContact CD1-ND1 3.46Å
755	T	91.8	Very high	91.1	Very high	71 Å²	71	55.9 Å²	55.9	44%	0.436	29%	0.289	S	S	.	.	H	α-helix	trans	-62.1	-39.7	177.2	-55	0	0	0	0	111.9	N751 T752 A753 G759 L829	N751-T755 WeakPolarHBondContact O-CB 3.34Å; N751-T755 PolarHBondContact O-N 3.37Å; N751-T755 PolarHBondContact O-OG1 2.87Å; T752-T755 PolarHBondContact O-N 2.9Å; A753-T755 VanDerWaalsContact C-N 3.32Å; A753-T755 PolarHBondContact O-N 2.87Å; T755-G759 PolarHBondContact O-N 3.35Å; T755-L829 HydrophobicContact CG2-CD1 4.16Å
756	L	93.4	Very high	91.7	Very high	48 Å²	48	53.9 Å²	53.9	25%	0.251	28%	0.279	S	S	.	.	H	α-helix	trans	-64.5	-46.2	177	176.6	67.1	0	0	0	111.7	L739 F740 F743 T752 A753 I754 G759 T760	L739-L756 HydrophobicContact CB-CD2 3.63Å; F740-L756 HydrophobicContact CB-CD2 4.49Å; F743-L756 HydrophobicContact CD2-CD2 4.23Å; F743-L756 HydrophobicContact CE2-CD2 4.37Å; T752-L756 WeakPolarHBondContact O-CB 3.33Å; T752-L756 PolarHBondContact O-N 3.29Å; A753-L756 WeakPolarHBondContact O-CB 3.35Å; A753-L756 PolarHBondContact O-N 3.4Å; A753-L756 VanDerWaalsContact O-N 3.16Å; I754-L756 VanDerWaalsContact C-N 3.32Å; I754-L756 PolarHBondContact O-N 3.47Å; L756-G759 PolarHBondContact O-N 2.82Å; L756-T760 WeakPolarHBondContact O-CB 3.21Å; L756-T760 PolarHBondContact O-N 3.27Å; L756-T760 PolarHBondContact O-OG1 3.29Å
757	Y	93.5	Very high	92.2	Very high	1 Å²	1	50.7 Å²	50.7	0%	0.004	27%	0.269	C	S	.	.	H	α-helix	trans	-59.2	-54.7	175.6	164.4	-102.9	0	0	0	111	A753 I754 G759 T760 E761 V884 E888 V889 A892	A753-Y757 PolarHBondContact O-N 2.73Å; I754-Y757 PolarHBondContact O-N 3.2Å; Y757-G759 VanDerWaalsContact C-N 3.29Å; Y757-G759 PolarHBondContact O-N 3.43Å; Y757-T760 PolarHBondContact O-N 3.34Å; Y757-T760 VanDerWaalsContact O-N 3.1Å; Y757-E761 HydrophobicContact CD2-CG 4.4Å; Y757-E761 HydrophobicContact CE2-CG 3.95Å; Y757-E761 PolarHBondContact O-N 3.4Å; Y757-V884 HydrophobicContact CD2-CG1 4.07Å; Y757-V884 HydrophobicContact CE2-CG1 3.62Å; Y757-E888 HydrophobicContact CD2-CB 3.72Å; Y757-E888 VanDerWaalsContact CD2-OE2 3.3Å; Y757-E888 WeakPolarHBondContact CD2-OE2 3.26Å; Y757-E888 HydrophobicContact CE2-CB 3.64Å; Y757-V889 VanDerWaalsContact OH-CG2 3.24Å; Y757-V889 WeakPolarHBondContact OH-CG2 3.36Å; Y757-A892 HydrophobicContact CD1-CB 3.21Å; Y757-A892 HydrophobicContact CD2-CB 4.11Å; Y757-A892 HydrophobicContact CE1-CB 3.32Å; Y757-A892 HydrophobicContact CE2-CB 4.21Å; Y757-A892 HydrophobicContact CG-CB 3.61Å
758	Q	93.3	Very high	92.9	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-58.2	-42.2	179.5	-66.8	-64.1	-29.8	0	0	111.6	I754 L762 L829 K833	I754-Q758 HydrophobicContact CG2-CG 4.16Å; I754-Q758 WeakPolarHBondContact O-CB 3.4Å; I754-Q758 WeakPolarHBondContact O-CG 3.4Å; I754-Q758 PolarHBondContact O-N 3.48Å; Q758-L762 WeakPolarHBondContact O-CB 2.93Å; Q758-L762 WeakPolarHBondContact O-CG 3.27Å; Q758-L762 PolarHBondContact O-N 3.33Å; Q758-L829 HydrophobicContact CB-CB 4.06Å; Q758-L829 HydrophobicContact CB-CD1 4.22Å; Q758-L829 HydrophobicContact CG-CB 4.25Å; Q758-K833 VanDerWaalsContact OE1-CD 3.32Å
759	G	93.5	Very high	93.4	Very high	30 Å²	30	37.2 Å²	37.2	31%	0.309	21%	0.21	S	C	.	.	H	α-helix	trans	-64	-41.6	176.5	0	0	0	0	0	113.1	T755 L756 Y757 L762 V763	T755-G759 PolarHBondContact O-N 3.35Å; L756-G759 PolarHBondContact O-N 2.82Å; Y757-G759 VanDerWaalsContact C-N 3.29Å; Y757-G759 PolarHBondContact O-N 3.43Å; G759-L762 PolarHBondContact O-N 2.77Å; G759-V763 VanDerWaalsContact O-CG2 3.31Å; G759-V763 WeakPolarHBondContact O-CG2 3.12Å; G759-V763 PolarHBondContact O-N 3.04Å; G759-V763 VanDerWaalsContact O-N 3.08Å
760	T	95	Very high	93.8	Very high	21 Å²	21	37.6 Å²	37.6	13%	0.129	22%	0.221	C	C	.	.	H	α-helix	trans	-63.6	-47.8	177.9	-57.1	0	0	0	0	110.6	T733 A736 L756 Y757 L762 V763 L764	T733-T760 HydrophobicContact CG2-CG2 4.41Å; A736-T760 HydrophobicContact CB-CG2 4.06Å; L756-T760 WeakPolarHBondContact O-CB 3.21Å; L756-T760 PolarHBondContact O-N 3.27Å; L756-T760 PolarHBondContact O-OG1 3.29Å; Y757-T760 PolarHBondContact O-N 3.34Å; Y757-T760 VanDerWaalsContact O-N 3.1Å; T760-L762 PolarHBondContact O-N 2.77Å; T760-V763 PolarHBondContact O-N 2.83Å; T760-L764 HydrophobicContact CG2-CD1 4.16Å; T760-L764 WeakPolarHBondContact O-CG 3.22Å; T760-L764 PolarHBondContact O-N 3.43Å
761	E	94.4	Very high	94.3	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-59.4	-47.7	176.4	-83.7	-62	117.2	0	0	112.1	Y757 V763 L764 L765 V884	Y757-E761 HydrophobicContact CD2-CG 4.4Å; Y757-E761 HydrophobicContact CE2-CG 3.95Å; Y757-E761 PolarHBondContact O-N 3.4Å; E761-V763 VanDerWaalsContact C-N 3.29Å; E761-V763 PolarHBondContact O-N 3.46Å; E761-L764 PolarHBondContact O-N 2.98Å; E761-L764 VanDerWaalsContact O-N 3.12Å; E761-L765 WeakPolarHBondContact O-CB 3.41Å; E761-L765 VanDerWaalsContact O-CG 3.26Å; E761-L765 WeakPolarHBondContact O-CG 3.44Å; E761-L765 PolarHBondContact O-N 3.06Å; E761-V884 HydrophobicContact CG-CG1 4.04Å; E761-V884 WeakPolarHBondContact OE1-CB 3.3Å; E761-V884 WeakPolarHBondContact OE1-CG1 3.4Å
762	L	96	Very high	94.8	Very high	27 Å²	27	28.8 Å²	28.8	14%	0.141	18%	0.18	C	C	.	.	H	α-helix	trans	-58.8	-39.6	177.4	-71.4	170.9	0	0	0	112.4	Q758 G759 T760 S766 L829 A832 K833 M836	Q758-L762 WeakPolarHBondContact O-CB 2.93Å; Q758-L762 WeakPolarHBondContact O-CG 3.27Å; Q758-L762 PolarHBondContact O-N 3.33Å; G759-L762 PolarHBondContact O-N 2.77Å; T760-L762 PolarHBondContact O-N 2.77Å; L762-S766 VanDerWaalsContact O-CB 3.29Å; L762-S766 WeakPolarHBondContact O-CB 3.16Å; L762-S766 PolarHBondContact O-N 2.87Å; L762-S766 PolarHBondContact O-OG 2.84Å; L762-L829 HydrophobicContact CD1-CD2 3.91Å; L762-A832 HydrophobicContact CD2-CB 4.12Å; L762-K833 HydrophobicContact CD2-CB 4.39Å; L762-M836 HydrophobicContact CB-CE 4.04Å; L762-M836 HydrophobicContact CD2-CE 3.42Å; L762-M836 VanDerWaalsContact CD2-CE 3.42Å; L762-M836 HydrophobicContact CD2-SD 3.6Å; L762-M836 HydrophobicContact CG-CE 4.34Å; L762-M836 VanDerWaalsContact O-CE 3.24Å; L762-M836 WeakPolarHBondContact O-CE 3.48Å
763	V	96.4	Very high	95	Very high	91 Å²	91	28.6 Å²	28.6	55%	0.552	18%	0.176	S	C	*	.	H	α-helix	trans	-64.9	-46.4	175.5	169.9	0	0	0	0	110.7	G759 T760 E761 S766 V767	G759-V763 VanDerWaalsContact O-CG2 3.31Å; G759-V763 WeakPolarHBondContact O-CG2 3.12Å; G759-V763 PolarHBondContact O-N 3.04Å; G759-V763 VanDerWaalsContact O-N 3.08Å; T760-V763 PolarHBondContact O-N 2.83Å; E761-V763 VanDerWaalsContact C-N 3.29Å; E761-V763 PolarHBondContact O-N 3.46Å; V763-S766 PolarHBondContact O-N 3.41Å; V763-V767 HydrophobicContact CG1-CG2 4.48Å; V763-V767 VanDerWaalsContact O-CG2 3.29Å; V763-V767 WeakPolarHBondContact O-CG2 3.28Å; V763-V767 PolarHBondContact O-N 3.29Å
764	L	97.1	Very high	95.1	Very high	3 Å²	3	32 Å²	32	2%	0.016	19%	0.193	C	C	.	.	H	α-helix	trans	-62.5	-46.2	179.2	-66.6	174.3	0	0	0	112.3	L729 T733 T760 E761 S766 V767 S768 L877 M881 V884	L729-L764 HydrophobicContact CD1-CD2 4.48Å; L729-L764 HydrophobicContact CD2-CD2 3.49Å; L729-L764 VanDerWaalsContact CD2-CD2 3.49Å; L729-L764 HydrophobicContact CG-CD2 4.25Å; T733-L764 HydrophobicContact CG2-CD1 3.72Å; T733-L764 HydrophobicContact CG2-CD2 3.49Å; T733-L764 VanDerWaalsContact CG2-CD2 3.49Å; T733-L764 HydrophobicContact CG2-CG 4.06Å; T760-L764 HydrophobicContact CG2-CD1 4.16Å; T760-L764 WeakPolarHBondContact O-CG 3.22Å; T760-L764 PolarHBondContact O-N 3.43Å; E761-L764 PolarHBondContact O-N 2.98Å; E761-L764 VanDerWaalsContact O-N 3.12Å; L764-S766 VanDerWaalsContact C-N 3.34Å; L764-S766 PolarHBondContact O-N 3.33Å; L764-V767 PolarHBondContact O-N 2.99Å; L764-S768 WeakPolarHBondContact O-CB 3.35Å; L764-S768 PolarHBondContact O-N 3.09Å; L764-L877 HydrophobicContact CD2-CD1 3.72Å; L764-M881 HydrophobicContact CB-CG 3.97Å; L764-M881 HydrophobicContact CB-SD 4.44Å; L764-M881 HydrophobicContact CD1-CG 4.25Å; L764-V884 HydrophobicContact CD1-CG2 4.12Å
765	L	97.4	Very high	95.2	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-62.2	-41.2	177.8	-69.4	172	0	0	0	111.7	E761 S768 T769 M836 E837 Q840 M881	E761-L765 WeakPolarHBondContact O-CB 3.41Å; E761-L765 VanDerWaalsContact O-CG 3.26Å; E761-L765 WeakPolarHBondContact O-CG 3.44Å; E761-L765 PolarHBondContact O-N 3.06Å; L765-S768 PolarHBondContact O-N 2.94Å; L765-T769 WeakPolarHBondContact O-CB 3.39Å; L765-T769 PolarHBondContact O-N 3.42Å; L765-T769 PolarHBondContact O-OG1 2.73Å; L765-M836 HydrophobicContact CB-CE 3.73Å; L765-M836 HydrophobicContact CD1-CB 4.28Å; L765-M836 HydrophobicContact CD1-CE 4.42Å; L765-E837 HydrophobicContact CD1-CB 3.92Å; L765-E837 HydrophobicContact CD2-CB 4.29Å; L765-E837 HydrophobicContact CD2-CG 4.2Å; L765-Q840 HydrophobicContact CD2-CB 4.06Å; L765-Q840 HydrophobicContact CD2-CG 3.95Å; L765-M881 HydrophobicContact CD2-SD 4.32Å
766	S	96.8	Very high	95.1	Very high	53 Å²	53	29 Å²	29	37%	0.371	18%	0.175	S	C	.	.	H	α-helix	trans	-64.5	-49.7	177.7	-60.9	0	0	0	0	111.7	L762 V763 L764 S768 T769 V770 M836	L762-S766 VanDerWaalsContact O-CB 3.29Å; L762-S766 WeakPolarHBondContact O-CB 3.16Å; L762-S766 PolarHBondContact O-N 2.87Å; L762-S766 PolarHBondContact O-OG 2.84Å; V763-S766 PolarHBondContact O-N 3.41Å; L764-S766 VanDerWaalsContact C-N 3.34Å; L764-S766 PolarHBondContact O-N 3.33Å; S766-S768 VanDerWaalsContact C-N 3.28Å; S766-S768 PolarHBondContact O-N 3.12Å; S766-T769 PolarHBondContact O-N 3.48Å; S766-V770 WeakPolarHBondContact O-CG2 3.25Å; S766-V770 PolarHBondContact O-N 3.35Å; S766-V770 VanDerWaalsContact O-N 3.07Å; S766-M836 WeakPolarHBondContact OG-CE 3.38Å
767	V	97.2	Very high	94.9	Very high	47 Å²	47	33.6 Å²	33.6	29%	0.285	19%	0.193	S	C	.	.	H	α-helix	trans	-62.9	-38	178	174.4	0	0	0	0	110.8	L729 V763 L764 T771 F873 L877	L729-V767 HydrophobicContact CD1-CG1 4.13Å; V763-V767 HydrophobicContact CG1-CG2 4.48Å; V763-V767 VanDerWaalsContact O-CG2 3.29Å; V763-V767 WeakPolarHBondContact O-CG2 3.28Å; V763-V767 PolarHBondContact O-N 3.29Å; L764-V767 PolarHBondContact O-N 2.99Å; V767-T771 WeakPolarHBondContact O-CB 3.47Å; V767-T771 PolarHBondContact O-N 3.12Å; V767-T771 PolarHBondContact O-OG1 2.86Å; V767-F873 HydrophobicContact CG1-CE1 3.74Å; V767-F873 HydrophobicContact CG1-CZ 3.69Å; V767-L877 HydrophobicContact CB-CD2 4.44Å; V767-L877 HydrophobicContact CG1-CD2 3.93Å
768	S	97	Very high	94.7	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-65.6	-47	177.3	-172.7	0	0	0	0	111.6	L764 L765 S766 V770 T771 C772 Q840 L877	L764-S768 WeakPolarHBondContact O-CB 3.35Å; L764-S768 PolarHBondContact O-N 3.09Å; L765-S768 PolarHBondContact O-N 2.94Å; S766-S768 VanDerWaalsContact C-N 3.28Å; S766-S768 PolarHBondContact O-N 3.12Å; S768-V770 PolarHBondContact O-N 3.31Å; S768-T771 PolarHBondContact O-N 2.85Å; S768-T771 VanDerWaalsContact O-N 3.14Å; S768-C772 WeakPolarHBondContact O-CB 3.33Å; S768-C772 PolarHBondContact O-N 3.4Å; S768-C772 PolarHBondContact O-SG 3.46Å; S768-C772 VanDerWaalsContact O-SG 3.4Å; S768-Q840 PolarHBondContact OG-NE2 3.41Å; S768-L877 VanDerWaalsContact CA-CD2 3.41Å
769	T	96.9	Very high	94.3	Very high	32 Å²	32	41.2 Å²	41.2	20%	0.196	22%	0.222	C	C	.	.	H	α-helix	trans	-56.6	-49.9	177.1	-58.3	0	0	0	0	111.3	L765 S766 T771 C772 L773 Q840 L843	L765-T769 WeakPolarHBondContact O-CB 3.39Å; L765-T769 PolarHBondContact O-N 3.42Å; L765-T769 PolarHBondContact O-OG1 2.73Å; S766-T769 PolarHBondContact O-N 3.48Å; T769-T771 VanDerWaalsContact C-N 3.32Å; T769-T771 PolarHBondContact O-N 3.2Å; T769-C772 PolarHBondContact O-N 3.42Å; T769-L773 WeakPolarHBondContact O-CG 3.22Å; T769-L773 PolarHBondContact O-N 3.37Å; T769-Q840 WeakPolarHBondContact OG1-CB 3.26Å; T769-Q840 WeakPolarHBondContact OG1-CG 2.99Å; T769-L843 HydrophobicContact CG2-CD2 3.85Å
770	V	96.4	Very high	93.7	Very high	83 Å²	83	43.8 Å²	43.8	50%	0.503	23%	0.225	S	C	.	.	H	α-helix	trans	-61	-42.4	177.6	173.8	0	0	0	0	111.3	S766 S768 L773 I774	S766-V770 WeakPolarHBondContact O-CG2 3.25Å; S766-V770 PolarHBondContact O-N 3.35Å; S766-V770 VanDerWaalsContact O-N 3.07Å; S768-V770 PolarHBondContact O-N 3.31Å; V770-L773 PolarHBondContact O-N 3.01Å; V770-I774 HydrophobicContact CG1-CD1 3.78Å; V770-I774 HydrophobicContact CG1-CG1 4.46Å; V770-I774 VanDerWaalsContact O-CG1 3.3Å; V770-I774 WeakPolarHBondContact O-CG1 3.08Å; V770-I774 PolarHBondContact O-N 3.07Å
771	T	95.4	Very high	92.9	Very high	8 Å²	8	45.2 Å²	45.2	5%	0.049	24%	0.24	C	C	.	.	H	α-helix	trans	-65.7	-41.2	179	-58.7	0	0	0	0	112.1	V767 S768 T769 I774 S775 F873 L874	V767-T771 WeakPolarHBondContact O-CB 3.47Å; V767-T771 PolarHBondContact O-N 3.12Å; V767-T771 PolarHBondContact O-OG1 2.86Å; S768-T771 PolarHBondContact O-N 2.85Å; S768-T771 VanDerWaalsContact O-N 3.14Å; T769-T771 VanDerWaalsContact C-N 3.32Å; T769-T771 PolarHBondContact O-N 3.2Å; T771-I774 PolarHBondContact O-N 2.98Å; T771-S775 VanDerWaalsContact O-CB 3.25Å; T771-S775 WeakPolarHBondContact O-CB 3.49Å; T771-S775 PolarHBondContact O-N 3.05Å; T771-S775 PolarHBondContact O-OG 3.31Å; T771-F873 HydrophobicContact CG2-CD1 3.69Å; T771-F873 HydrophobicContact CG2-CE1 4.26Å; T771-F873 VanDerWaalsContact OG1-CE1 3.29Å; T771-F873 WeakPolarHBondContact OG1-CE1 3.04Å; T771-L874 HydrophobicContact CG2-CB 3.91Å; T771-L874 HydrophobicContact CG2-CD1 4.03Å; T771-L874 HydrophobicContact CG2-CG 4.42Å
772	C	95.7	Very high	92.3	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-60.6	-46.5	174.8	-75.5	0	0	0	0	111.1	S768 T769 S775 L776 L843	S768-C772 WeakPolarHBondContact O-CB 3.33Å; S768-C772 PolarHBondContact O-N 3.4Å; S768-C772 PolarHBondContact O-SG 3.46Å; S768-C772 VanDerWaalsContact O-SG 3.4Å; T769-C772 PolarHBondContact O-N 3.42Å; C772-S775 PolarHBondContact O-N 3Å; C772-L776 WeakPolarHBondContact O-CB 3.21Å; C772-L776 WeakPolarHBondContact O-CG 3.42Å; C772-L776 PolarHBondContact O-N 3.16Å; C772-L843 HydrophobicContact CB-CD2 3.88Å; C772-L843 HydrophobicContact CB-CG 4.09Å
773	L	94.9	Very high	91.4	Very high	73 Å²	73	48.6 Å²	48.6	38%	0.382	25%	0.253	S	S	.	.	H	α-helix	trans	-59.3	-50.8	176.2	-68.7	174.6	0	0	0	111.8	T769 V770 S775 L776 F777 L843	T769-L773 WeakPolarHBondContact O-CG 3.22Å; T769-L773 PolarHBondContact O-N 3.37Å; V770-L773 PolarHBondContact O-N 3.01Å; L773-S775 VanDerWaalsContact C-N 3.27Å; L773-S775 PolarHBondContact O-N 2.84Å; L773-L776 WeakPolarHBondContact O-CB 3.36Å; L773-L776 PolarHBondContact O-N 3.11Å; L773-F777 HydrophobicContact CB-CE2 4.49Å; L773-F777 WeakPolarHBondContact O-CD2 3.41Å; L773-F777 PolarHBondContact O-N 3.03Å; L773-F777 VanDerWaalsContact O-N 3.1Å; L773-L843 HydrophobicContact CD2-CD1 3.94Å; L773-L843 HydrophobicContact CD2-CD2 3.78Å; L773-L843 HydrophobicContact CG-CD2 3.81Å
774	I	94	Very high	90.6	Very high	70 Å²	70	46.2 Å²	46.2	36%	0.359	24%	0.237	S	C	.	.	H	α-helix	trans	-60.3	-40.4	178.2	-65.1	168.3	0	0	0	110.6	V770 T771 F777 R778 M870	V770-I774 HydrophobicContact CG1-CD1 3.78Å; V770-I774 HydrophobicContact CG1-CG1 4.46Å; V770-I774 VanDerWaalsContact O-CG1 3.3Å; V770-I774 WeakPolarHBondContact O-CG1 3.08Å; V770-I774 PolarHBondContact O-N 3.07Å; T771-I774 PolarHBondContact O-N 2.98Å; I774-F777 PolarHBondContact O-N 3.43Å; I774-R778 HydrophobicContact CG2-CG 4.3Å; I774-R778 VanDerWaalsContact O-CG 3.23Å; I774-R778 WeakPolarHBondContact O-CG 3.33Å; I774-R778 PolarHBondContact O-N 3.25Å; I774-M870 HydrophobicContact CG2-CG 4.08Å; I774-M870 HydrophobicContact CG2-SD 3.88Å
775	S	92.4	Very high	89.3	Confident	0 Å²	0	46.9 Å²	46.9	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-65.5	-45	179.3	-59.7	0	0	0	0	111.7	T771 C772 L773 F777 R778 L779 M870	T771-S775 VanDerWaalsContact O-CB 3.25Å; T771-S775 WeakPolarHBondContact O-CB 3.49Å; T771-S775 PolarHBondContact O-N 3.05Å; T771-S775 PolarHBondContact O-OG 3.31Å; C772-S775 PolarHBondContact O-N 3Å; L773-S775 VanDerWaalsContact C-N 3.27Å; L773-S775 PolarHBondContact O-N 2.84Å; S775-F777 PolarHBondContact O-N 3Å; S775-R778 PolarHBondContact O-N 2.86Å; S775-L779 WeakPolarHBondContact O-CB 3.39Å; S775-L779 WeakPolarHBondContact O-CD1 3.32Å; S775-L779 PolarHBondContact O-N 3.38Å; S775-M870 VanDerWaalsContact OG-CB 3.24Å; S775-M870 WeakPolarHBondContact OG-CB 3.47Å
776	L	90.9	Very high	87.8	Confident	23 Å²	23	53.4 Å²	53.4	12%	0.12	28%	0.277	C	S	.	.	H	α-helix	trans	-52.2	-53.1	172.9	-82.3	164.7	0	0	0	111	C772 L773 R778 L779 Q780 L843 F846 F847	C772-L776 WeakPolarHBondContact O-CB 3.21Å; C772-L776 WeakPolarHBondContact O-CG 3.42Å; C772-L776 PolarHBondContact O-N 3.16Å; L773-L776 WeakPolarHBondContact O-CB 3.36Å; L773-L776 PolarHBondContact O-N 3.11Å; L776-R778 VanDerWaalsContact C-N 3.34Å; L776-R778 PolarHBondContact O-N 2.86Å; L776-L779 PolarHBondContact O-N 3.44Å; L776-Q780 WeakPolarHBondContact O-CG 3.14Å; L776-Q780 PolarHBondContact O-N 2.96Å; L776-L843 HydrophobicContact CD1-CD1 3.69Å; L776-L843 HydrophobicContact CD1-CG 4.47Å; L776-F846 HydrophobicContact CD1-CD1 4.03Å; L776-F846 HydrophobicContact CD1-CE1 4.28Å; L776-F846 HydrophobicContact CD2-CD1 3.96Å; L776-F846 HydrophobicContact CD2-CE1 3.86Å; L776-F847 HydrophobicContact CB-CD2 4.45Å; L776-F847 HydrophobicContact CD1-CB 4.29Å; L776-F847 HydrophobicContact CD2-CB 3.97Å; L776-F847 HydrophobicContact CD2-CD2 3.76Å; L776-F847 HydrophobicContact CD2-CG 4.37Å; L776-F847 HydrophobicContact CG-CB 3.92Å; L776-F847 HydrophobicContact CG-CD2 3.66Å; L776-F847 HydrophobicContact CG-CG 4.21Å
777	F	89	Confident	86.4	Confident	143 Å²	143	54.3 Å²	54.3	63%	0.627	28%	0.277	S	S	*	.	H	α-helix	trans	-61.5	-39.8	179.5	-70.9	-63.3	0	0	0	112.9	L773 I774 S775	L773-F777 HydrophobicContact CB-CE2 4.49Å; L773-F777 WeakPolarHBondContact O-CD2 3.41Å; L773-F777 PolarHBondContact O-N 3.03Å; L773-F777 VanDerWaalsContact O-N 3.1Å; I774-F777 PolarHBondContact O-N 3.43Å; S775-F777 PolarHBondContact O-N 3Å
778	R	89.1	Confident	84.8	Confident	160 Å²	160	53.7 Å²	53.7	60%	0.604	28%	0.275	S	S	*	.	H	α-helix	trans	-72.4	-32.7	-179.4	-68.3	-68.7	-171.5	175.6	0.7	112.8	I774 S775 L776 Q780	I774-R778 HydrophobicContact CG2-CG 4.3Å; I774-R778 VanDerWaalsContact O-CG 3.23Å; I774-R778 WeakPolarHBondContact O-CG 3.33Å; I774-R778 PolarHBondContact O-N 3.25Å; S775-R778 PolarHBondContact O-N 2.86Å; L776-R778 VanDerWaalsContact C-N 3.34Å; L776-R778 PolarHBondContact O-N 2.86Å; R778-Q780 VanDerWaalsContact C-N 3.34Å
779	L	85.1	Confident	83.2	Confident	2 Å²	2	59.6 Å²	59.6	1%	0.01	30%	0.302	C	S	.	.	H	α-helix	trans	-80.6	-14.5	-179.1	-90.1	75.5	0	0	0	113	S775 L776 A781 L782 F847 A851 R854 I871	S775-L779 WeakPolarHBondContact O-CB 3.39Å; S775-L779 WeakPolarHBondContact O-CD1 3.32Å; S775-L779 PolarHBondContact O-N 3.38Å; L776-L779 PolarHBondContact O-N 3.44Å; L779-A781 PolarHBondContact O-N 3.43Å; L779-L782 HydrophobicContact CB-CD1 4.4Å; L779-L782 HydrophobicContact CD2-CD1 4.38Å; L779-L782 HydrophobicContact CG-CD1 3.98Å; L779-L782 WeakPolarHBondContact O-CB 2.94Å; L779-L782 PolarHBondContact O-N 3.43Å; L779-F847 HydrophobicContact CD1-CE2 4.28Å; L779-F847 HydrophobicContact CD2-CE2 3.89Å; L779-F847 HydrophobicContact CD2-CZ 4.14Å; L779-F847 HydrophobicContact CG-CE2 4.49Å; L779-A851 HydrophobicContact CD2-CB 3.56Å; L779-R854 WeakPolarHBondContact O-CD 3.42Å; L779-R854 PolarHBondContact O-NH1 3.08Å; L779-I871 HydrophobicContact CD1-CD1 4.04Å; L779-I871 HydrophobicContact CD1-CG1 4.29Å; L779-I871 HydrophobicContact CD2-CD1 4.14Å
780	Q	81.1	Confident	81.5	Confident	83 Å²	83	59.3 Å²	59.3	39%	0.388	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.1	-17.2	174.1	-78.1	174.2	10	0	0	114.5	R18 L776 R778 L782	R18-Q780 VanDerWaalsContact CZ-O 3.25Å; R18-Q780 PolarHBondContact NH1-O 3.34Å; R18-Q780 PolarHBondContact NH2-O 3.1Å; L776-Q780 WeakPolarHBondContact O-CG 3.14Å; L776-Q780 PolarHBondContact O-N 2.96Å; R778-Q780 VanDerWaalsContact C-N 3.34Å; Q780-L782 VanDerWaalsContact C-N 3.34Å
781	A	77.2	Confident	80.3	Confident	52 Å²	52	56.5 Å²	56.5	43%	0.43	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.7	-18.6	175.2	0	0	0	0	0	114.2	L779 H861	L779-A781 PolarHBondContact O-N 3.43Å; A781-H861 PolarHBondContact O-CE1 2.83Å
782	L	81.6	Confident	79.4	Confident	1 Å²	1	57.6 Å²	57.6	1%	0.005	29%	0.292	C	S	.	.	S	Bend	trans	-79.8	152.6	-178.7	-66.7	162.9	0	0	0	111.5	L779 Q780 R854 A856 H861 P866	L779-L782 HydrophobicContact CB-CD1 4.4Å; L779-L782 HydrophobicContact CD2-CD1 4.38Å; L779-L782 HydrophobicContact CG-CD1 3.98Å; L779-L782 WeakPolarHBondContact O-CB 2.94Å; L779-L782 PolarHBondContact O-N 3.43Å; Q780-L782 VanDerWaalsContact C-N 3.34Å; L782-R854 HydrophobicContact CB-CB 3.87Å; L782-R854 HydrophobicContact CB-CG 4.3Å; L782-R854 HydrophobicContact CD1-CB 4.24Å; L782-A856 HydrophobicContact CD2-CB 4.27Å; L782-H861 HydrophobicContact CD2-CB 4.26Å; L782-P866 HydrophobicContact CD2-CG 4.37Å; L782-P866 HydrophobicContact CG-CG 4.47Å
783	K	77.5	Confident	78.6	Confident	97 Å²	97	58.5 Å²	58.5	42%	0.422	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	144.2	179.1	-165.4	-175.2	176.7	-172.1	0	109.3	R854 C855 E942	K783-R854 WeakPolarHBondContact O-CA 3.46Å; K783-C855 PolarHBondContact N-O 3.3Å; K783-C855 PolarHBondContact O-N 3.14Å; K783-E942 WeakPolarHBondContact CE-OE1 3.39Å; K783-E942 IonicContact NZ-OE1 3.5Å; K783-E942 PolarHBondContact NZ-OE1 3.02Å; K783-E942 IonicContact NZ-OE2 3.16Å; K783-E942 PolarHBondContact NZ-OE2 3.5Å
784	L	79	Confident	78.1	Confident	41 Å²	41	55.7 Å²	55.7	22%	0.215	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	134.1	170.8	-164.2	66.6	0	0	0	108.6	I15 R853	I15-L784 HydrophobicContact CG2-CD2 4.39Å; L784-R853 HydrophobicContact CD1-CB 3.8Å
785	S	70.6	Confident	77.8	Confident	16 Å²	16	52.9 Å²	52.9	11%	0.112	27%	0.267	C	S	.	.			trans	-118.9	152.9	175.2	176.2	0	0	0	0	108.3	L787 R853 R940	S785-L787 PolarHBondContact O-N 3.25Å; S785-R853 PolarHBondContact N-O 2.9Å; S785-R940 PolarHBondContact OG-NH1 3.17Å
786	D	65.4	Low	77.5	Confident	138 Å²	138	56.8 Å²	56.8	74%	0.738	29%	0.288	S	S	*	.	P	Polyproline II helix	trans	-57.5	137.4	169.9	-57	-31	0	0	0	110.1	S788	D786-S788 PolarHBondContact O-N 2.96Å
787	L	67	Low	77.4	Confident	71 Å²	71	56.5 Å²	56.5	37%	0.372	29%	0.286	S	S	.	.	P	Polyproline II helix	trans	-69.7	118.7	180	-174.7	65.4	0	0	0	108.2	S785 V791 A792 R853	S785-L787 PolarHBondContact O-N 3.25Å; L787-V791 HydrophobicContact CD1-CB 3.7Å; L787-V791 HydrophobicContact CD1-CG1 3.45Å; L787-V791 VanDerWaalsContact CD1-CG1 3.45Å; L787-A792 HydrophobicContact CD2-CB 3.85Å; L787-A792 HydrophobicContact CG-CB 4.24Å; L787-R853 HydrophobicContact CD1-CG 3.91Å
788	S	64.1	Low	77.5	Confident	35 Å²	35	49.7 Å²	49.7	25%	0.245	26%	0.256	C	S	.	.	P	Polyproline II helix	trans	-67.9	140	170.8	-179.9	0	0	0	0	109	D786 E790 V791 A792	D786-S788 PolarHBondContact O-N 2.96Å; S788-E790 PolarHBondContact O-N 3.42Å; S788-E790 VanDerWaalsContact O-N 3.08Å; S788-V791 WeakPolarHBondContact O-CB 3.31Å; S788-V791 PolarHBondContact O-N 3.36Å; S788-A792 PolarHBondContact O-N 3.11Å
789	E	62.9	Low	77.7	Confident	123 Å²	123	43.1 Å²	43.1	58%	0.575	23%	0.233	S	C	*	.	H	α-helix	trans	-51.8	-32.6	174.8	-171.1	-178.8	171.9	0	0	111.9	V791 A792 F793	E789-V791 PolarHBondContact O-N 2.98Å; E789-A792 PolarHBondContact O-N 3.37Å; E789-F793 PolarHBondContact O-N 3.45Å; E789-F793 VanDerWaalsContact O-N 3.16Å
790	E	63	Low	78	Confident	26 Å²	26	47.7 Å²	47.7	12%	0.121	26%	0.257	C	S	.	.	H	α-helix	trans	-66.2	-38	176.7	-58.2	-147.9	124.1	0	0	113.6	E468 K685 K689 S788 D794	E468-E790 WeakPolarHBondContact CB-OE2 3.15Å; E468-E790 VanDerWaalsContact O-OE1 3.05Å; K685-E790 PolarHBondContact NZ-O 3.22Å; K689-E790 IonicContact NZ-OE1 2.67Å; K689-E790 PolarHBondContact NZ-OE1 3.43Å; S788-E790 PolarHBondContact O-N 3.42Å; S788-E790 VanDerWaalsContact O-N 3.08Å; E790-D794 PolarHBondContact O-N 2.97Å
791	V	70	Confident	78.6	Confident	25 Å²	25	43.8 Å²	43.8	15%	0.152	24%	0.238	C	C	.	.	H	α-helix	trans	-73.2	-38.5	179	-179.4	0	0	0	0	109.2	L787 S788 E789 F793 D794 D795 S852	L787-V791 HydrophobicContact CD1-CB 3.7Å; L787-V791 HydrophobicContact CD1-CG1 3.45Å; L787-V791 VanDerWaalsContact CD1-CG1 3.45Å; S788-V791 WeakPolarHBondContact O-CB 3.31Å; S788-V791 PolarHBondContact O-N 3.36Å; E789-V791 PolarHBondContact O-N 2.98Å; V791-F793 VanDerWaalsContact C-N 3.3Å; V791-F793 PolarHBondContact O-N 3.41Å; V791-D794 PolarHBondContact O-N 3.34Å; V791-D795 WeakPolarHBondContact O-CB 3.28Å; V791-D795 PolarHBondContact O-N 3.28Å; V791-S852 VanDerWaalsContact CG1-CB 3.41Å
792	A	76.3	Confident	79.5	Confident	30 Å²	30	41.3 Å²	41.3	25%	0.248	22%	0.218	C	C	.	.	H	α-helix	trans	-58.9	-39.2	174.5	0	0	0	0	0	112.7	L787 S788 E789 D795 N796	L787-A792 HydrophobicContact CD2-CB 3.85Å; L787-A792 HydrophobicContact CG-CB 4.24Å; S788-A792 PolarHBondContact O-N 3.11Å; E789-A792 PolarHBondContact O-N 3.37Å; A792-D795 PolarHBondContact O-N 2.96Å; A792-N796 VanDerWaalsContact O-CG 3.27Å; A792-N796 PolarHBondContact O-N 2.92Å; A792-N796 PolarHBondContact O-ND2 2.7Å
793	F	79.9	Confident	80.2	Confident	19 Å²	19	43.3 Å²	43.3	8%	0.083	23%	0.23	C	C	.	.	H	α-helix	trans	-65.4	-45	174.7	176.6	-100.2	0	0	0	112.6	A681 Y684 K685 E789 V791 D795 N796 L797	A681-F793 HydrophobicContact CB-CZ 4.26Å; A681-F793 VanDerWaalsContact O-CZ 3.31Å; A681-F793 WeakPolarHBondContact O-CZ 3.32Å; Y684-F793 AromaticContact CD1-CE2 3.69Å; Y684-F793 HydrophobicContact CD1-CE2 3.69Å; Y684-F793 HydrophobicContact CD1-CZ 4.42Å; Y684-F793 HydrophobicContact CE1-CE2 4.15Å; K685-F793 HydrophobicContact CB-CD1 4.28Å; K685-F793 HydrophobicContact CB-CE1 3.81Å; K685-F793 HydrophobicContact CB-CE2 4.31Å; K685-F793 HydrophobicContact CB-CZ 3.85Å; K685-F793 HydrophobicContact CD-CD1 3.56Å; K685-F793 HydrophobicContact CD-CE1 3.72Å; K685-F793 HydrophobicContact CD-CG 4.23Å; K685-F793 HydrophobicContact CG-CD1 3.99Å; K685-F793 HydrophobicContact CG-CE1 4.03Å; K685-F793 HydrophobicContact CG-CG 4.27Å; K685-F793 HydrophobicContact CG-CZ 4.45Å; E789-F793 PolarHBondContact O-N 3.45Å; E789-F793 VanDerWaalsContact O-N 3.16Å; V791-F793 VanDerWaalsContact C-N 3.3Å; V791-F793 PolarHBondContact O-N 3.41Å; F793-D795 VanDerWaalsContact C-N 3.28Å; F793-D795 PolarHBondContact O-N 2.98Å; F793-N796 PolarHBondContact O-N 2.88Å; F793-L797 HydrophobicContact CD1-CD1 3.67Å; F793-L797 HydrophobicContact CE1-CD1 3.14Å; F793-L797 HydrophobicContact CE1-CG 4.14Å; F793-L797 HydrophobicContact CE2-CD1 4.3Å; F793-L797 HydrophobicContact CG-CD1 4.49Å; F793-L797 HydrophobicContact CZ-CD1 3.5Å; F793-L797 VanDerWaalsContact CZ-CD1 3.5Å; F793-L797 HydrophobicContact CZ-CD2 4.43Å; F793-L797 HydrophobicContact CZ-CG 4.06Å; F793-L797 PolarHBondContact O-N 3.47Å; F793-L797 VanDerWaalsContact O-N 3.09Å
794	D	83.4	Confident	80.9	Confident	14 Å²	14	38.8 Å²	38.8	8%	0.075	21%	0.211	C	C	.	.	H	α-helix	trans	-66.5	-33.2	177.8	-67.3	-16.8	0	0	0	110.8	K685 E790 V791 L798 H924	K685-D794 IonicContact NZ-OD1 3.94Å; E790-D794 PolarHBondContact O-N 2.97Å; V791-D794 PolarHBondContact O-N 3.34Å; D794-L798 PolarHBondContact O-N 3.15Å; D794-H924 PolarHBondContact O-NE2 2.78Å
795	D	87.4	Confident	81.6	Confident	12 Å²	12	36.9 Å²	36.9	6%	0.064	20%	0.201	C	C	.	.	H	α-helix	trans	-65.1	-42.3	172.4	-69.9	-17.8	0	0	0	111.4	V791 A792 F793 L797 L798 L799 L849 S852	V791-D795 WeakPolarHBondContact O-CB 3.28Å; V791-D795 PolarHBondContact O-N 3.28Å; A792-D795 PolarHBondContact O-N 2.96Å; F793-D795 VanDerWaalsContact C-N 3.28Å; F793-D795 PolarHBondContact O-N 2.98Å; D795-L797 PolarHBondContact O-N 3.15Å; D795-L798 WeakPolarHBondContact O-CB 3.29Å; D795-L798 PolarHBondContact O-N 3.39Å; D795-L799 WeakPolarHBondContact O-CG 3.42Å; D795-L799 PolarHBondContact O-N 3.48Å; D795-L849 HydrophobicContact CB-CD2 3.65Å; D795-L849 VanDerWaalsContact CG-CD2 3.48Å; D795-S852 PolarHBondContact OD2-OG 3.46Å
796	N	86.8	Confident	82.8	Confident	82 Å²	82	36.1 Å²	36.1	44%	0.439	20%	0.195	S	C	.	.	H	α-helix	trans	-62.1	-43.6	175.8	-72.5	-20.5	0	0	0	112.6	A792 F793 L798 L799 I800	A792-N796 VanDerWaalsContact O-CG 3.27Å; A792-N796 PolarHBondContact O-N 2.92Å; A792-N796 PolarHBondContact O-ND2 2.7Å; F793-N796 PolarHBondContact O-N 2.88Å; N796-L798 VanDerWaalsContact C-N 3.29Å; N796-L798 PolarHBondContact O-N 2.81Å; N796-L799 PolarHBondContact O-N 3.4Å; N796-I800 WeakPolarHBondContact O-CG1 3.39Å; N796-I800 PolarHBondContact O-N 2.78Å; N796-I800 VanDerWaalsContact O-N 3.08Å
797	L	88.1	Confident	84.2	Confident	17 Å²	17	31.3 Å²	31.3	9%	0.089	17%	0.168	C	C	.	.	H	α-helix	trans	-60.6	-39.8	174.2	-77.6	159.5	0	0	0	112	A681 F793 D795 L799 I800 G801 F920 H924	A681-L797 HydrophobicContact CB-CD1 4.27Å; A681-L797 HydrophobicContact CB-CD2 3.64Å; F793-L797 HydrophobicContact CD1-CD1 3.67Å; F793-L797 HydrophobicContact CE1-CD1 3.14Å; F793-L797 HydrophobicContact CE1-CG 4.14Å; F793-L797 HydrophobicContact CE2-CD1 4.3Å; F793-L797 HydrophobicContact CG-CD1 4.49Å; F793-L797 HydrophobicContact CZ-CD1 3.5Å; F793-L797 VanDerWaalsContact CZ-CD1 3.5Å; F793-L797 HydrophobicContact CZ-CD2 4.43Å; F793-L797 HydrophobicContact CZ-CG 4.06Å; F793-L797 PolarHBondContact O-N 3.47Å; F793-L797 VanDerWaalsContact O-N 3.09Å; D795-L797 PolarHBondContact O-N 3.15Å; L797-L799 VanDerWaalsContact C-N 3.33Å; L797-L799 PolarHBondContact O-N 3.29Å; L797-I800 PolarHBondContact O-N 3.35Å; L797-G801 PolarHBondContact O-N 3.02Å; L797-G801 VanDerWaalsContact O-N 3.14Å; L797-F920 HydrophobicContact CB-CZ 4.42Å; L797-F920 HydrophobicContact CD2-CE1 4.42Å; L797-F920 HydrophobicContact CD2-CZ 3.95Å; L797-H924 WeakPolarHBondContact CB-NE2 3.48Å
798	L	92.5	Very high	85.6	Confident	0 Å²	0	28 Å²	28	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-62.7	-40.8	176.1	-178	66.9	0	0	0	111.8	D794 D795 N796 G801 L802 V845 I848 F921 H924 S925	D794-L798 PolarHBondContact O-N 3.15Å; D795-L798 WeakPolarHBondContact O-CB 3.29Å; D795-L798 PolarHBondContact O-N 3.39Å; N796-L798 VanDerWaalsContact C-N 3.29Å; N796-L798 PolarHBondContact O-N 2.81Å; L798-G801 PolarHBondContact O-N 3.17Å; L798-L802 PolarHBondContact O-N 3.14Å; L798-V845 HydrophobicContact CD1-CG2 4.33Å; L798-V845 HydrophobicContact CD2-CB 4.43Å; L798-V845 HydrophobicContact CD2-CG1 4.03Å; L798-V845 HydrophobicContact CD2-CG2 4.14Å; L798-V845 HydrophobicContact CG-CG1 4.35Å; L798-V845 HydrophobicContact CG-CG2 4Å; L798-I848 HydrophobicContact CD1-CD1 4.37Å; L798-I848 HydrophobicContact CD2-CB 3.86Å; L798-I848 HydrophobicContact CD2-CD1 3.89Å; L798-I848 HydrophobicContact CD2-CG1 4.49Å; L798-I848 HydrophobicContact CD2-CG2 3.56Å; L798-F921 HydrophobicContact CD1-CD2 4.07Å; L798-F921 HydrophobicContact CD1-CE2 3.84Å; L798-H924 PolarHBondContact N-CD2 3.48Å; L798-S925 VanDerWaalsContact CD1-OG 3.29Å; L798-S925 WeakPolarHBondContact CD1-OG 3.38Å
799	L	93.4	Very high	87	Confident	21 Å²	21	26.3 Å²	26.3	11%	0.11	14%	0.139	C	C	.	.	H	α-helix	trans	-66.7	-37.2	177.6	-65.7	167.4	0	0	0	112.3	L28 L29 L32 D795 N796 L797 G801 L802 V803 V845	L28-L799 HydrophobicContact CD2-CD1 3.75Å; L28-L799 HydrophobicContact CD2-CD2 4.25Å; L29-L799 HydrophobicContact CD2-CD2 4.39Å; L32-L799 HydrophobicContact CD1-CB 4.39Å; L32-L799 HydrophobicContact CD1-CD2 3.68Å; D795-L799 WeakPolarHBondContact O-CG 3.42Å; D795-L799 PolarHBondContact O-N 3.48Å; N796-L799 PolarHBondContact O-N 3.4Å; L797-L799 VanDerWaalsContact C-N 3.33Å; L797-L799 PolarHBondContact O-N 3.29Å; L799-G801 VanDerWaalsContact C-N 3.33Å; L799-L802 HydrophobicContact CD2-CD2 4.49Å; L799-L802 WeakPolarHBondContact O-CB 3.23Å; L799-L802 PolarHBondContact O-N 3.39Å; L799-V803 WeakPolarHBondContact O-CG2 3.28Å; L799-V803 PolarHBondContact O-N 2.76Å; L799-V845 HydrophobicContact CD2-CG1 3.93Å
800	I	91.7	Very high	88.6	Confident	99 Å²	99	20.8 Å²	20.8	51%	0.508	11%	0.113	S	C	.	.	H	α-helix	trans	-61.6	-43.7	173.3	-66.1	166.1	0	0	0	110.6	N796 L797 L802 V803 G804	N796-I800 WeakPolarHBondContact O-CG1 3.39Å; N796-I800 PolarHBondContact O-N 2.78Å; N796-I800 VanDerWaalsContact O-N 3.08Å; L797-I800 PolarHBondContact O-N 3.35Å; I800-L802 VanDerWaalsContact C-N 3.34Å; I800-L802 PolarHBondContact O-N 3.11Å; I800-V803 WeakPolarHBondContact O-CB 3.47Å; I800-V803 PolarHBondContact O-N 3.47Å; I800-G804 PolarHBondContact O-N 3.48Å
801	G	92.8	Very high	90	Very high	0 Å²	0	19.6 Å²	19.6	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-61.4	-41.7	173.8	0	0	0	0	0	112.6	L797 L798 L799 V803 G804 M805 F921	L797-G801 PolarHBondContact O-N 3.02Å; L797-G801 VanDerWaalsContact O-N 3.14Å; L798-G801 PolarHBondContact O-N 3.17Å; L799-G801 VanDerWaalsContact C-N 3.33Å; G801-V803 VanDerWaalsContact C-N 3.33Å; G801-V803 PolarHBondContact O-N 3.5Å; G801-G804 PolarHBondContact O-N 3.49Å; G801-M805 PolarHBondContact O-N 3.12Å; G801-F921 VanDerWaalsContact C-CD2 3.49Å
802	L	96.2	Very high	91.1	Very high	0 Å²	0	18.4 Å²	18.4	0%	0	10%	0.101	C	C	.	.	H	α-helix	trans	-60.6	-42.4	176.5	-178	66.3	0	0	0	111.6	L29 L32 L798 L799 I800 G804 M805 L806 V845 F921	L29-L802 HydrophobicContact CD2-CD2 3.4Å; L29-L802 VanDerWaalsContact CD2-CD2 3.4Å; L32-L802 HydrophobicContact CD1-CD2 4.42Å; L798-L802 PolarHBondContact O-N 3.14Å; L799-L802 HydrophobicContact CD2-CD2 4.49Å; L799-L802 WeakPolarHBondContact O-CB 3.23Å; L799-L802 PolarHBondContact O-N 3.39Å; I800-L802 VanDerWaalsContact C-N 3.34Å; I800-L802 PolarHBondContact O-N 3.11Å; L802-G804 VanDerWaalsContact C-N 3.32Å; L802-G804 PolarHBondContact O-N 3.11Å; L802-M805 WeakPolarHBondContact O-CB 3.28Å; L802-M805 PolarHBondContact O-N 3.14Å; L802-L806 HydrophobicContact CD1-CD1 4.44Å; L802-L806 HydrophobicContact CD1-CG 4.25Å; L802-L806 HydrophobicContact CG-CD1 4.08Å; L802-L806 HydrophobicContact CG-CG 4.29Å; L802-L806 WeakPolarHBondContact O-CG 3.25Å; L802-L806 PolarHBondContact O-N 3.22Å; L802-V845 HydrophobicContact CB-CG2 4.23Å; L802-V845 HydrophobicContact CD1-CG2 3.98Å; L802-V845 HydrophobicContact CD2-CB 4.25Å; L802-V845 HydrophobicContact CD2-CG1 4.24Å; L802-V845 HydrophobicContact CD2-CG2 4.05Å; L802-V845 HydrophobicContact CG-CG2 4.3Å; L802-F921 HydrophobicContact CB-CD2 4.36Å; L802-F921 HydrophobicContact CB-CE2 4.05Å; L802-F921 HydrophobicContact CD1-CE2 4.2Å; L802-F921 HydrophobicContact CD1-CZ 4.26Å
803	V	95.3	Very high	92	Very high	43 Å²	43	18 Å²	18	26%	0.261	9%	0.094	S	C	.	.	H	α-helix	trans	-57.7	-46	175.9	164.4	0	0	0	0	110.8	L32 M36 L799 I800 G801 M805 L806 F807	L32-V803 HydrophobicContact CD2-CG2 3.95Å; M36-V803 HydrophobicContact CE-CG1 4.11Å; M36-V803 HydrophobicContact SD-CG1 3.72Å; L799-V803 WeakPolarHBondContact O-CG2 3.28Å; L799-V803 PolarHBondContact O-N 2.76Å; I800-V803 WeakPolarHBondContact O-CB 3.47Å; I800-V803 PolarHBondContact O-N 3.47Å; G801-V803 VanDerWaalsContact C-N 3.33Å; G801-V803 PolarHBondContact O-N 3.5Å; V803-M805 PolarHBondContact O-N 2.92Å; V803-L806 PolarHBondContact O-N 3.39Å; V803-F807 VanDerWaalsContact O-CB 3.23Å; V803-F807 WeakPolarHBondContact O-CB 3.45Å; V803-F807 PolarHBondContact O-N 3.19Å
804	G	92.7	Very high	92.5	Very high	2 Å²	2	17.5 Å²	17.5	2%	0.021	9%	0.092	C	C	.	.	H	α-helix	trans	-63.5	-38.3	176.1	0	0	0	0	0	113.7	I800 G801 L802 Y808	I800-G804 PolarHBondContact O-N 3.48Å; G801-G804 PolarHBondContact O-N 3.49Å; L802-G804 VanDerWaalsContact C-N 3.32Å; L802-G804 PolarHBondContact O-N 3.11Å; G804-Y808 PolarHBondContact O-N 3.22Å; G804-Y808 VanDerWaalsContact O-N 3.14Å
805	M	94.8	Very high	92.8	Very high	1 Å²	1	17 Å²	17	1%	0.005	9%	0.09	C	C	.	.	H	α-helix	trans	-63.7	-52.1	175.8	-168.9	79.8	-99.1	0	0	111.7	G801 L802 V803 F807 Y808 D809 E837 I918 F921	G801-M805 PolarHBondContact O-N 3.12Å; L802-M805 WeakPolarHBondContact O-CB 3.28Å; L802-M805 PolarHBondContact O-N 3.14Å; V803-M805 PolarHBondContact O-N 2.92Å; M805-F807 VanDerWaalsContact C-N 3.3Å; M805-F807 PolarHBondContact O-N 2.62Å; M805-Y808 HydrophobicContact CE-CD1 4.41Å; M805-Y808 PolarHBondContact O-N 2.93Å; M805-D809 PolarHBondContact O-N 3.21Å; M805-E837 HydrophobicContact CE-CG 4.15Å; M805-E837 VanDerWaalsContact CE-OE1 3.3Å; M805-E837 WeakPolarHBondContact CE-OE1 3.33Å; M805-E837 HydrophobicContact SD-CG 4.33Å; M805-I918 HydrophobicContact CE-CB 4.21Å; M805-I918 HydrophobicContact CE-CD1 3.77Å; M805-I918 HydrophobicContact CE-CG1 3.59Å; M805-I918 HydrophobicContact CE-CG2 3.67Å; M805-I918 HydrophobicContact SD-CB 4.29Å; M805-I918 HydrophobicContact SD-CG1 4.09Å; M805-I918 HydrophobicContact SD-CG2 3.73Å; M805-F921 HydrophobicContact CB-CD1 4.35Å; M805-F921 HydrophobicContact CG-CD1 4.28Å; M805-F921 HydrophobicContact CG-CE1 4.44Å; M805-F921 HydrophobicContact SD-CD1 4.11Å
806	L	96.2	Very high	93	Very high	0 Å²	0	16.4 Å²	16.4	0%	0	9%	0.087	C	C	.	.	H	α-helix	trans	-61.9	-39	178.4	-67.2	177.5	0	0	0	111.9	F33 M36 L802 V803 L810 M838 M842	F33-L806 HydrophobicContact CB-CD1 4.49Å; F33-L806 HydrophobicContact CD2-CD1 4.41Å; F33-L806 HydrophobicContact CD2-CD2 4.32Å; M36-L806 HydrophobicContact CB-CB 4.38Å; M36-L806 HydrophobicContact CG-CB 4.12Å; M36-L806 HydrophobicContact CG-CD1 4.44Å; L802-L806 HydrophobicContact CD1-CD1 4.44Å; L802-L806 HydrophobicContact CD1-CG 4.25Å; L802-L806 HydrophobicContact CG-CD1 4.08Å; L802-L806 HydrophobicContact CG-CG 4.29Å; L802-L806 WeakPolarHBondContact O-CG 3.25Å; L802-L806 PolarHBondContact O-N 3.22Å; V803-L806 PolarHBondContact O-N 3.39Å; L806-L810 WeakPolarHBondContact O-CB 3.4Å; L806-L810 VanDerWaalsContact O-CG 3.27Å; L806-L810 WeakPolarHBondContact O-CG 3.31Å; L806-L810 PolarHBondContact O-N 2.87Å; L806-L810 VanDerWaalsContact O-N 3.11Å; L806-M838 HydrophobicContact CD2-CB 4.11Å; L806-M838 HydrophobicContact CD2-CG 4.02Å; L806-M842 HydrophobicContact CD2-CG 4.25Å; L806-M842 HydrophobicContact CD2-SD 4.43Å
807	F	94.8	Very high	93.3	Very high	37 Å²	37	14.6 Å²	14.6	16%	0.162	8%	0.077	C	C	.	.	H	α-helix	trans	-56.1	-51.3	174.9	174.7	-89.4	0	0	0	110.9	F39 V40 V803 M805 F811 I910 A914	F39-F807 HydrophobicContact CD1-CD2 4.35Å; F39-F807 HydrophobicContact CD1-CE2 4.26Å; F39-F807 HydrophobicContact CE1-CD2 4.36Å; F39-F807 AromaticContact CE1-CE2 3.91Å; F39-F807 HydrophobicContact CE1-CE2 3.91Å; V40-F807 HydrophobicContact CG2-CD2 3.61Å; V40-F807 HydrophobicContact CG2-CE2 4.14Å; V40-F807 HydrophobicContact CG2-CG 4.33Å; V803-F807 VanDerWaalsContact O-CB 3.23Å; V803-F807 WeakPolarHBondContact O-CB 3.45Å; V803-F807 PolarHBondContact O-N 3.19Å; M805-F807 VanDerWaalsContact C-N 3.3Å; M805-F807 PolarHBondContact O-N 2.62Å; F807-F811 HydrophobicContact CD1-CD2 4.17Å; F807-F811 HydrophobicContact CD1-CE2 4.33Å; F807-F811 HydrophobicContact CD2-CE2 4.05Å; F807-F811 AromaticContact CE1-CD2 3.88Å; F807-F811 HydrophobicContact CE1-CD2 3.88Å; F807-F811 AromaticContact CE1-CE2 3.79Å; F807-F811 HydrophobicContact CE1-CE2 3.79Å; F807-F811 HydrophobicContact CE2-CD2 4.25Å; F807-F811 AromaticContact CE2-CE2 3.48Å; F807-F811 HydrophobicContact CE2-CE2 3.48Å; F807-F811 VanDerWaalsContact CE2-CE2 3.48Å; F807-F811 HydrophobicContact CE2-CZ 4.41Å; F807-F811 HydrophobicContact CG-CD2 4.48Å; F807-F811 HydrophobicContact CG-CE2 4.44Å; F807-F811 AromaticContact CZ-CD2 3.93Å; F807-F811 HydrophobicContact CZ-CD2 3.93Å; F807-F811 AromaticContact CZ-CE2 3.34Å; F807-F811 HydrophobicContact CZ-CE2 3.34Å; F807-F811 HydrophobicContact CZ-CZ 4.25Å; F807-F811 VanDerWaalsContact O-CD2 3.28Å; F807-F811 WeakPolarHBondContact O-CD2 3.34Å; F807-F811 PolarHBondContact O-N 3.01Å; F807-I910 HydrophobicContact CE1-CG2 4.37Å; F807-A914 HydrophobicContact CD1-CB 4.19Å; F807-A914 HydrophobicContact CE1-CB 4.43Å
808	Y	94.5	Very high	93.2	Very high	2 Å²	2	16.2 Å²	16.2	1%	0.008	8%	0.084	C	C	.	.	H	α-helix	trans	-63.5	-48.7	-179.9	-172.3	-112.3	0	0	0	113.1	G804 M805 L810 F811 L812 V889 D893 W907 T911 A914 I918	G804-Y808 PolarHBondContact O-N 3.22Å; G804-Y808 VanDerWaalsContact O-N 3.14Å; M805-Y808 HydrophobicContact CE-CD1 4.41Å; M805-Y808 PolarHBondContact O-N 2.93Å; Y808-L810 PolarHBondContact O-N 3.34Å; Y808-F811 PolarHBondContact O-N 2.64Å; Y808-L812 PolarHBondContact O-N 3.01Å; Y808-V889 HydrophobicContact CE1-CG1 4.18Å; Y808-D893 WeakPolarHBondContact CE1-OD2 3.41Å; Y808-D893 WeakPolarHBondContact OH-CB 3.49Å; Y808-D893 PolarHBondContact OH-OD2 3.21Å; Y808-W907 HydrophobicContact CE2-CH2 4.23Å; Y808-T911 HydrophobicContact CE2-CG2 4.08Å; Y808-A914 HydrophobicContact CD2-CB 3.52Å; Y808-A914 HydrophobicContact CE2-CB 4.44Å; Y808-A914 HydrophobicContact CG-CB 4.05Å; Y808-I918 HydrophobicContact CD1-CD1 3.39Å; Y808-I918 HydrophobicContact CD2-CD1 4.04Å; Y808-I918 HydrophobicContact CE1-CD1 4.01Å; Y808-I918 HydrophobicContact CG-CD1 3.39Å
809	D	95.5	Very high	93	Very high	0 Å²	0	16.7 Å²	16.7	0%	0	9%	0.088	C	C	.	.	H	α-helix	trans	-64.2	-32.2	-175.3	-70.9	-25.7	0	0	0	111.9	M805 L812 L813 A834 E837 M838	M805-D809 PolarHBondContact O-N 3.21Å; D809-L812 PolarHBondContact O-N 3.42Å; D809-L813 WeakPolarHBondContact O-CB 3.37Å; D809-L813 PolarHBondContact O-N 2.95Å; D809-A834 HydrophobicContact CB-CB 4.38Å; D809-E837 WeakPolarHBondContact OD2-CG 3.31Å; D809-M838 HydrophobicContact CB-CG 3.49Å; D809-M838 VanDerWaalsContact CB-CG 3.49Å; D809-M838 HydrophobicContact CB-SD 3.84Å
810	L	94.4	Very high	92.8	Very high	6 Å²	6	18.5 Å²	18.5	3%	0.031	10%	0.097	C	C	.	.	H	α-helix	trans	-66.1	-41.5	172.9	-74.8	169.7	0	0	0	112.3	M36 V40 L806 Y808 L812 L813 V814 M838	M36-L810 HydrophobicContact CB-CD1 3.92Å; V40-L810 HydrophobicContact CB-CB 4.09Å; V40-L810 HydrophobicContact CB-CD1 4.01Å; V40-L810 HydrophobicContact CG1-CB 3.56Å; V40-L810 HydrophobicContact CG1-CD1 4.42Å; V40-L810 HydrophobicContact CG2-CB 4.46Å; V40-L810 HydrophobicContact CG2-CD1 4.13Å; L806-L810 WeakPolarHBondContact O-CB 3.4Å; L806-L810 VanDerWaalsContact O-CG 3.27Å; L806-L810 WeakPolarHBondContact O-CG 3.31Å; L806-L810 PolarHBondContact O-N 2.87Å; L806-L810 VanDerWaalsContact O-N 3.11Å; Y808-L810 PolarHBondContact O-N 3.34Å; L810-L812 VanDerWaalsContact C-N 3.29Å; L810-L812 PolarHBondContact O-N 3.49Å; L810-L813 PolarHBondContact O-N 3.38Å; L810-V814 WeakPolarHBondContact O-CG2 3.49Å; L810-V814 PolarHBondContact O-N 3.08Å; L810-M838 HydrophobicContact CD2-CE 4.02Å; L810-M838 HydrophobicContact CG-CE 4.39Å
811	F	93.9	Very high	92.5	Very high	2 Å²	2	19 Å²	19	1%	0.009	11%	0.107	C	C	.	.	H	α-helix	trans	-67	-29.4	173	-83.6	-74.1	0	0	0	112.7	V40 I43 C44 F807 Y808 P815 Y902 W907 I910	V40-F811 HydrophobicContact CB-CE2 4.29Å; V40-F811 HydrophobicContact CG1-CD1 4.41Å; V40-F811 HydrophobicContact CG1-CD2 3.65Å; V40-F811 HydrophobicContact CG1-CE1 4.32Å; V40-F811 HydrophobicContact CG1-CE2 3.5Å; V40-F811 VanDerWaalsContact CG1-CE2 3.5Å; V40-F811 HydrophobicContact CG1-CG 4.09Å; V40-F811 HydrophobicContact CG1-CZ 3.86Å; V40-F811 HydrophobicContact CG2-CE2 4.05Å; I43-F811 HydrophobicContact CB-CE1 4.49Å; I43-F811 HydrophobicContact CB-CZ 4.01Å; I43-F811 HydrophobicContact CG2-CE1 3.93Å; I43-F811 HydrophobicContact CG2-CZ 3.57Å; C44-F811 WeakPolarHBondContact SG-CD1 3.26Å; C44-F811 VanDerWaalsContact SG-CE1 3.54Å; F807-F811 HydrophobicContact CD1-CD2 4.17Å; F807-F811 HydrophobicContact CD1-CE2 4.33Å; F807-F811 HydrophobicContact CD2-CE2 4.05Å; F807-F811 AromaticContact CE1-CD2 3.88Å; F807-F811 HydrophobicContact CE1-CD2 3.88Å; F807-F811 AromaticContact CE1-CE2 3.79Å; F807-F811 HydrophobicContact CE1-CE2 3.79Å; F807-F811 HydrophobicContact CE2-CD2 4.25Å; F807-F811 AromaticContact CE2-CE2 3.48Å; F807-F811 HydrophobicContact CE2-CE2 3.48Å; F807-F811 VanDerWaalsContact CE2-CE2 3.48Å; F807-F811 HydrophobicContact CE2-CZ 4.41Å; F807-F811 HydrophobicContact CG-CD2 4.48Å; F807-F811 HydrophobicContact CG-CE2 4.44Å; F807-F811 AromaticContact CZ-CD2 3.93Å; F807-F811 HydrophobicContact CZ-CD2 3.93Å; F807-F811 AromaticContact CZ-CE2 3.34Å; F807-F811 HydrophobicContact CZ-CE2 3.34Å; F807-F811 HydrophobicContact CZ-CZ 4.25Å; F807-F811 VanDerWaalsContact O-CD2 3.28Å; F807-F811 WeakPolarHBondContact O-CD2 3.34Å; F807-F811 PolarHBondContact O-N 3.01Å; Y808-F811 PolarHBondContact O-N 2.64Å; F811-P815 WeakPolarHBondContact O-CD 3.44Å; F811-P815 WeakPolarHBondContact O-CG 3.01Å; F811-Y902 HydrophobicContact CD1-CE1 4.02Å; F811-Y902 HydrophobicContact CD1-CE2 4.04Å; F811-Y902 AromaticContact CD1-CZ 3.58Å; F811-Y902 WeakPolarHBondContact CD1-OH 3.41Å; F811-Y902 HydrophobicContact CE1-CE1 4.25Å; F811-Y902 WeakPolarHBondContact O-CE2 3.33Å; F811-Y902 PolarHBondContact O-OH 3.04Å; F811-W907 HydrophobicContact CB-CZ3 4.33Å; F811-I910 HydrophobicContact CB-CG2 3.94Å; F811-I910 HydrophobicContact CD1-CD1 3.64Å; F811-I910 HydrophobicContact CD1-CG1 4.38Å; F811-I910 HydrophobicContact CD1-CG2 4.22Å; F811-I910 HydrophobicContact CD2-CG2 3.86Å; F811-I910 HydrophobicContact CE1-CD1 3.64Å; F811-I910 HydrophobicContact CE1-CG1 4.29Å; F811-I910 HydrophobicContact CE2-CG2 4.48Å; F811-I910 HydrophobicContact CG-CD1 4.29Å; F811-I910 HydrophobicContact CG-CG2 3.75Å; F811-I910 HydrophobicContact CZ-CD1 4.3Å; F811-I910 HydrophobicContact CZ-CG1 4.49Å
812	L	93.5	Very high	92	Very high	0 Å²	0	24.9 Å²	24.9	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-74.6	-40.2	174.3	-164.4	72.7	0	0	0	111.5	Y808 D809 L810 A816 Y830 K833 A834 H898 W907	Y808-L812 PolarHBondContact O-N 3.01Å; D809-L812 PolarHBondContact O-N 3.42Å; L810-L812 VanDerWaalsContact C-N 3.29Å; L810-L812 PolarHBondContact O-N 3.49Å; L812-A816 WeakPolarHBondContact O-CB 3.28Å; L812-A816 PolarHBondContact O-N 3.48Å; L812-Y830 HydrophobicContact CD1-CD1 3.94Å; L812-Y830 HydrophobicContact CD1-CE1 4.28Å; L812-Y830 HydrophobicContact CD2-CD1 4.21Å; L812-Y830 HydrophobicContact CG-CD1 4.19Å; L812-K833 HydrophobicContact CD2-CD 4.08Å; L812-A834 HydrophobicContact CB-CB 4.46Å; L812-A834 HydrophobicContact CD2-CB 4.32Å; L812-H898 WeakPolarHBondContact CD1-CE1 3.34Å; L812-H898 WeakPolarHBondContact CD1-NE2 3.31Å; L812-H898 PolarHBondContact O-CE1 3.14Å; L812-W907 HydrophobicContact CD1-CH2 3.99Å; L812-W907 HydrophobicContact CD1-CZ2 4.37Å
813	L	94.2	Very high	91.2	Very high	22 Å²	22	27.4 Å²	27.4	12%	0.115	16%	0.164	C	C	.	.	H	α-helix	trans	-68.6	-47.4	-173.6	-179.2	60	0	0	0	112.9	D809 L810 A816 L817 A831 A834 I835 M838	D809-L813 WeakPolarHBondContact O-CB 3.37Å; D809-L813 PolarHBondContact O-N 2.95Å; L810-L813 PolarHBondContact O-N 3.38Å; L813-A816 WeakPolarHBondContact O-CB 3.34Å; L813-A816 PolarHBondContact O-N 2.79Å; L813-L817 HydrophobicContact CD1-CD1 3.88Å; L813-L817 HydrophobicContact CD1-CD2 4.07Å; L813-L817 HydrophobicContact CD1-CG 3.74Å; L813-L817 HydrophobicContact CD2-CD1 4.39Å; L813-L817 HydrophobicContact CG-CD1 3.8Å; L813-L817 HydrophobicContact CG-CG 4.1Å; L813-L817 WeakPolarHBondContact O-CG 3.16Å; L813-L817 PolarHBondContact O-N 2.83Å; L813-A831 HydrophobicContact CD1-CB 4.19Å; L813-A834 HydrophobicContact CB-CB 3.88Å; L813-A834 HydrophobicContact CD1-CB 4.19Å; L813-I835 HydrophobicContact CD1-CD1 4.08Å; L813-I835 HydrophobicContact CD1-CG1 3.8Å; L813-I835 HydrophobicContact CD2-CG1 4.3Å; L813-M838 HydrophobicContact CD2-SD 4.41Å
814	V	91.4	Very high	90.6	Very high	7 Å²	7	28.3 Å²	28.3	4%	0.042	17%	0.17	C	C	.	.	H	α-helix	trans	-59.6	-51.5	-172.2	173.2	0	0	0	0	112.5	L41 C44 Y58 L810 A816 L817 E818 Y901	L41-V814 HydrophobicContact CD2-CG2 3.8Å; C44-V814 HydrophobicContact CB-CB 4.45Å; C44-V814 HydrophobicContact CB-CG1 4.22Å; C44-V814 HydrophobicContact CB-CG2 4.41Å; Y58-V814 HydrophobicContact CD2-CG1 4.18Å; L810-V814 WeakPolarHBondContact O-CG2 3.49Å; L810-V814 PolarHBondContact O-N 3.08Å; V814-A816 VanDerWaalsContact C-N 3.3Å; V814-A816 PolarHBondContact O-N 3.47Å; V814-L817 PolarHBondContact O-N 3.17Å; V814-E818 PolarHBondContact O-N 2.89Å; V814-Y901 HydrophobicContact CG1-CE1 4.4Å
815	P	89.7	Confident	90.4	Very high	3 Å²	3	34.1 Å²	34.1	2%	0.019	20%	0.199	C	C	.	.	H	α-helix	trans	-63.9	-35.1	175.9	-19.6	32	0	0	0	112.8	F811 E818 A819 I897 Y901 Y902	F811-P815 WeakPolarHBondContact O-CD 3.44Å; F811-P815 WeakPolarHBondContact O-CG 3.01Å; P815-E818 PolarHBondContact O-N 3.04Å; P815-A819 WeakPolarHBondContact O-CB 3.4Å; P815-A819 PolarHBondContact O-N 3.33Å; P815-I897 HydrophobicContact CB-CG2 4.25Å; P815-Y901 HydrophobicContact CB-CD1 4.22Å; P815-Y901 HydrophobicContact CB-CD2 4.11Å; P815-Y901 HydrophobicContact CB-CG 3.78Å; P815-Y901 HydrophobicContact CG-CD1 3.72Å; P815-Y901 HydrophobicContact CG-CD2 4.45Å; P815-Y901 HydrophobicContact CG-CE1 4.26Å; P815-Y901 HydrophobicContact CG-CG 3.81Å; P815-Y902 HydrophobicContact CG-CD2 4.24Å; P815-Y902 HydrophobicContact CG-CE2 3.38Å
816	A	91.7	Very high	90	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-63.3	-46.3	178.8	0	0	0	0	0	110.9	L812 L813 V814 E818 A819 I820 A831	L812-A816 WeakPolarHBondContact O-CB 3.28Å; L812-A816 PolarHBondContact O-N 3.48Å; L813-A816 WeakPolarHBondContact O-CB 3.34Å; L813-A816 PolarHBondContact O-N 2.79Å; V814-A816 VanDerWaalsContact C-N 3.3Å; V814-A816 PolarHBondContact O-N 3.47Å; A816-E818 PolarHBondContact O-N 2.96Å; A816-A819 PolarHBondContact O-N 3.31Å; A816-A819 VanDerWaalsContact O-N 3.15Å; A816-I820 WeakPolarHBondContact O-CG1 3.42Å; A816-I820 PolarHBondContact O-N 2.82Å; A816-A831 HydrophobicContact CB-CB 4.02Å
817	L	91.1	Very high	89.8	Confident	45 Å²	45	34.9 Å²	34.9	24%	0.236	21%	0.206	C	C	.	.	H	α-helix	trans	-62	-41.2	177.6	-67.1	175.5	0	0	0	112.5	Y58 L813 V814 A819 I820 A831	Y58-L817 HydrophobicContact CD1-CD1 4.46Å; Y58-L817 HydrophobicContact CE1-CB 4.39Å; Y58-L817 HydrophobicContact CE1-CD1 3.77Å; Y58-L817 HydrophobicContact CE2-CB 4.44Å; Y58-L817 VanDerWaalsContact OH-CB 3.25Å; Y58-L817 WeakPolarHBondContact OH-CB 3.05Å; L813-L817 HydrophobicContact CD1-CD1 3.88Å; L813-L817 HydrophobicContact CD1-CD2 4.07Å; L813-L817 HydrophobicContact CD1-CG 3.74Å; L813-L817 HydrophobicContact CD2-CD1 4.39Å; L813-L817 HydrophobicContact CG-CD1 3.8Å; L813-L817 HydrophobicContact CG-CG 4.1Å; L813-L817 WeakPolarHBondContact O-CG 3.16Å; L813-L817 PolarHBondContact O-N 2.83Å; V814-L817 PolarHBondContact O-N 3.17Å; L817-A819 VanDerWaalsContact C-N 3.26Å; L817-A819 PolarHBondContact O-N 3.16Å; L817-I820 HydrophobicContact CD2-CD1 3.85Å; L817-I820 PolarHBondContact O-N 2.96Å; L817-A831 HydrophobicContact CD2-CB 4.09Å
818	E	87.6	Confident	89.7	Confident	50 Å²	50	38.9 Å²	38.9	23%	0.234	22%	0.223	C	C	.	.	H	α-helix	trans	-68	-24.9	176	-71.8	-162.5	-150.8	0	0	113.4	R48 Y58 V814 P815 A816 P821 Y901	R48-E818 IonicContact CZ-OE1 2.77Å; R48-E818 IonicContact CZ-OE2 3.82Å; R48-E818 IonicContact NE-OE2 2.64Å; R48-E818 PolarHBondContact NE-OE2 3.07Å; R48-E818 IonicContact NH1-OE1 3.93Å; R48-E818 IonicContact NH1-OE2 3.39Å; R48-E818 IonicContact NH2-OE2 3.97Å; R48-E818 PolarHBondContact NH2-OE2 3.16Å; Y58-E818 HydrophobicContact CE2-CG 3.79Å; V814-E818 PolarHBondContact O-N 2.89Å; P815-E818 PolarHBondContact O-N 3.04Å; A816-E818 PolarHBondContact O-N 2.96Å; E818-P821 WeakPolarHBondContact O-CD 3.41Å; E818-Y901 VanDerWaalsContact CD-CE2 3.41Å; E818-Y901 HydrophobicContact CG-CE2 4.34Å; E818-Y901 WeakPolarHBondContact OE1-CE2 3.4Å; E818-Y901 PolarHBondContact OE1-OH 3.39Å; E818-Y901 WeakPolarHBondContact OE2-CE2 3.38Å
819	A	87.9	Confident	89.7	Confident	11 Å²	11	40.6 Å²	40.6	9%	0.091	23%	0.232	C	C	.	.	H	α-helix	trans	-87.5	-12.4	178.3	0	0	0	0	0	113.9	P815 A816 L817 N822 A827 I897	P815-A819 WeakPolarHBondContact O-CB 3.4Å; P815-A819 PolarHBondContact O-N 3.33Å; A816-A819 PolarHBondContact O-N 3.31Å; A816-A819 VanDerWaalsContact O-N 3.15Å; L817-A819 VanDerWaalsContact C-N 3.26Å; L817-A819 PolarHBondContact O-N 3.16Å; A819-N822 WeakPolarHBondContact O-CB 3.12Å; A819-N822 PolarHBondContact O-N 2.94Å; A819-A827 HydrophobicContact CB-CB 3.69Å; A819-I897 HydrophobicContact CB-CD1 4.47Å; A819-I897 HydrophobicContact CB-CG2 3.83Å
820	I	88.4	Confident	89.6	Confident	58 Å²	58	40.6 Å²	40.6	30%	0.297	23%	0.232	S	C	.	.	G	3₁₀ helix	trans	-57	-45	178	-70.3	170.6	0	0	0	112.9	A816 L817 N822 G823 A827 K828 A831	A816-I820 WeakPolarHBondContact O-CG1 3.42Å; A816-I820 PolarHBondContact O-N 2.82Å; L817-I820 HydrophobicContact CD2-CD1 3.85Å; L817-I820 PolarHBondContact O-N 2.96Å; I820-N822 PolarHBondContact O-N 3.35Å; I820-N822 VanDerWaalsContact O-N 3.11Å; I820-G823 PolarHBondContact O-N 2.96Å; I820-A827 HydrophobicContact CG1-CB 4.44Å; I820-K828 HydrophobicContact CG1-CG 4.35Å; I820-A831 HydrophobicContact CD1-CB 4.1Å
821	P	86.4	Confident	89.6	Confident	109 Å²	109	40.6 Å²	40.6	71%	0.708	23%	0.233	S	C	*	.	G	3₁₀ helix	trans	-58.6	-24	179.1	-25.6	35.8	0	0	0	113.9	E818 G823	E818-P821 WeakPolarHBondContact O-CD 3.41Å; P821-G823 PolarHBondContact O-N 2.77Å
822	N	82.4	Confident	89.7	Confident	125 Å²	125	42.3 Å²	42.3	67%	0.668	25%	0.247	S	C	*	.	G	3₁₀ helix	trans	-75.1	-0.4	178	-57.7	-30.2	0	0	0	113	A819 I820 V824	A819-N822 WeakPolarHBondContact O-CB 3.12Å; A819-N822 PolarHBondContact O-N 2.94Å; I820-N822 PolarHBondContact O-N 3.35Å; I820-N822 VanDerWaalsContact O-N 3.11Å; N822-V824 HydrophobicContact CB-CG2 4.15Å; N822-V824 PolarHBondContact O-N 3.1Å
823	G	79.1	Confident	89.8	Confident	53 Å²	53	42.3 Å²	42.3	55%	0.546	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	74	10.3	176.2	0	0	0	0	0	114.7	I820 P821 I825	I820-G823 PolarHBondContact O-N 2.96Å; P821-G823 PolarHBondContact O-N 2.77Å; G823-I825 PolarHBondContact O-N 3.3Å
824	V	82.5	Confident	89.8	Confident	61 Å²	61	41.3 Å²	41.3	37%	0.37	24%	0.242	S	C	.	.			trans	-75.1	117.9	-177.8	-174.8	0	0	0	0	109.8	N822 A826 A827 I897	N822-V824 HydrophobicContact CB-CG2 4.15Å; N822-V824 PolarHBondContact O-N 3.1Å; V824-A826 HydrophobicContact CG1-CB 3.97Å; V824-A826 PolarHBondContact O-N 2.92Å; V824-A827 HydrophobicContact CB-CB 4.23Å; V824-A827 WeakPolarHBondContact O-CB 3.38Å; V824-A827 PolarHBondContact O-N 3.08Å; V824-A827 VanDerWaalsContact O-N 3.09Å; V824-I897 HydrophobicContact CG1-CD1 4.32Å
825	I	88.3	Confident	90.1	Very high	125 Å²	125	44.7 Å²	44.7	64%	0.641	26%	0.259	S	S	*	.	H	α-helix	trans	-57.6	-39.3	179.7	-63.8	164.5	0	0	0	111	G823 A827 K828 L829	G823-I825 PolarHBondContact O-N 3.3Å; I825-A827 VanDerWaalsContact C-N 3.31Å; I825-A827 PolarHBondContact O-N 3.5Å; I825-K828 PolarHBondContact O-N 3.49Å; I825-L829 HydrophobicContact CG2-CD1 4.23Å; I825-L829 HydrophobicContact CG2-CG 4.5Å; I825-L829 PolarHBondContact O-N 2.7Å; I825-L829 VanDerWaalsContact O-N 3.14Å
826	A	87.5	Confident	90.4	Very high	17 Å²	17	47 Å²	47	14%	0.14	27%	0.27	C	S	.	.	H	α-helix	trans	-57.7	-41.7	177	0	0	0	0	0	112.2	V824 K828 L829 Y830 I897	V824-A826 HydrophobicContact CG1-CB 3.97Å; V824-A826 PolarHBondContact O-N 2.92Å; A826-K828 VanDerWaalsContact C-N 3.3Å; A826-K828 PolarHBondContact O-N 3.46Å; A826-L829 PolarHBondContact O-N 3.29Å; A826-L829 VanDerWaalsContact O-N 3.11Å; A826-Y830 HydrophobicContact CB-CD2 4.36Å; A826-Y830 HydrophobicContact CB-CE2 4.24Å; A826-Y830 WeakPolarHBondContact O-CD2 3.27Å; A826-Y830 PolarHBondContact O-N 3.25Å; A826-I897 HydrophobicContact CB-CD1 4.4Å
827	A	90.7	Very high	90.6	Very high	0 Å²	0	47 Å²	47	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-59.5	-40.8	178.7	0	0	0	0	0	112.1	A819 I820 V824 I825 Y830 A831 I897	A819-A827 HydrophobicContact CB-CB 3.69Å; I820-A827 HydrophobicContact CG1-CB 4.44Å; V824-A827 HydrophobicContact CB-CB 4.23Å; V824-A827 WeakPolarHBondContact O-CB 3.38Å; V824-A827 PolarHBondContact O-N 3.08Å; V824-A827 VanDerWaalsContact O-N 3.09Å; I825-A827 VanDerWaalsContact C-N 3.31Å; I825-A827 PolarHBondContact O-N 3.5Å; A827-Y830 PolarHBondContact O-N 2.9Å; A827-A831 WeakPolarHBondContact O-CB 3.27Å; A827-A831 PolarHBondContact O-N 2.87Å; A827-I897 HydrophobicContact CB-CD1 4.05Å
828	K	93.1	Very high	90.9	Very high	121 Å²	121	45.6 Å²	45.6	53%	0.526	26%	0.262	S	S	.	.	H	α-helix	trans	-64.7	-41.3	175.7	-63.2	-178.1	-179.2	179.9	0	111.8	I820 I825 A826 A832	I820-K828 HydrophobicContact CG1-CG 4.35Å; I825-K828 PolarHBondContact O-N 3.49Å; A826-K828 VanDerWaalsContact C-N 3.3Å; A826-K828 PolarHBondContact O-N 3.46Å; K828-A832 WeakPolarHBondContact O-CB 3.31Å; K828-A832 PolarHBondContact O-N 2.99Å
829	L	93.8	Very high	91.3	Very high	38 Å²	38	47.8 Å²	47.8	20%	0.199	28%	0.275	C	S	.	.	H	α-helix	trans	-65.4	-44.5	177.7	-67.5	173.9	0	0	0	111.6	T755 Q758 L762 I825 A826 A832 K833	T755-L829 HydrophobicContact CG2-CD1 4.16Å; Q758-L829 HydrophobicContact CB-CB 4.06Å; Q758-L829 HydrophobicContact CB-CD1 4.22Å; Q758-L829 HydrophobicContact CG-CB 4.25Å; L762-L829 HydrophobicContact CD1-CD2 3.91Å; I825-L829 HydrophobicContact CG2-CD1 4.23Å; I825-L829 HydrophobicContact CG2-CG 4.5Å; I825-L829 PolarHBondContact O-N 2.7Å; I825-L829 VanDerWaalsContact O-N 3.14Å; A826-L829 PolarHBondContact O-N 3.29Å; A826-L829 VanDerWaalsContact O-N 3.11Å; L829-A832 PolarHBondContact O-N 3.34Å; L829-K833 WeakPolarHBondContact O-CB 3.24Å; L829-K833 PolarHBondContact O-N 3.5Å
830	Y	93.7	Very high	91.7	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-60.8	-45	175.6	-80	-68.4	0	0	0	112.5	I754 L812 A826 A827 K833 A834 A892 H895 I897 H898	I754-Y830 HydrophobicContact CG2-CE2 4.32Å; I754-Y830 WeakPolarHBondContact CG2-OH 3.23Å; L812-Y830 HydrophobicContact CD1-CD1 3.94Å; L812-Y830 HydrophobicContact CD1-CE1 4.28Å; L812-Y830 HydrophobicContact CD2-CD1 4.21Å; L812-Y830 HydrophobicContact CG-CD1 4.19Å; A826-Y830 HydrophobicContact CB-CD2 4.36Å; A826-Y830 HydrophobicContact CB-CE2 4.24Å; A826-Y830 WeakPolarHBondContact O-CD2 3.27Å; A826-Y830 PolarHBondContact O-N 3.25Å; A827-Y830 PolarHBondContact O-N 2.9Å; Y830-K833 PolarHBondContact O-N 3.34Å; Y830-A834 WeakPolarHBondContact O-CB 3.43Å; Y830-A834 PolarHBondContact O-N 3.34Å; Y830-A892 PolarHBondContact OH-O 3.26Å; Y830-H895 HydrophobicContact CE2-CB 4.22Å; Y830-H895 AromaticContact CE2-CD2 3.81Å; Y830-H895 WeakPolarHBondContact OH-CB 3.32Å; Y830-I897 HydrophobicContact CD2-CD1 4.48Å; Y830-H898 AromaticContact CD1-NE2 3.78Å; Y830-H898 AromaticContact CE1-NE2 3.88Å; Y830-H898 AromaticContact CG-NE2 3.96Å
831	A	94.4	Very high	92.2	Very high	5 Å²	5	44.5 Å²	44.5	4%	0.041	26%	0.256	C	S	.	.	H	α-helix	trans	-63.6	-42.7	176.7	0	0	0	0	0	111.6	L813 A816 L817 I820 A827 I835	L813-A831 HydrophobicContact CD1-CB 4.19Å; A816-A831 HydrophobicContact CB-CB 4.02Å; L817-A831 HydrophobicContact CD2-CB 4.09Å; I820-A831 HydrophobicContact CD1-CB 4.1Å; A827-A831 WeakPolarHBondContact O-CB 3.27Å; A827-A831 PolarHBondContact O-N 2.87Å; A831-I835 WeakPolarHBondContact O-CD1 3.44Å; A831-I835 VanDerWaalsContact O-CG1 3.29Å; A831-I835 WeakPolarHBondContact O-CG1 3.34Å; A831-I835 PolarHBondContact O-N 2.88Å; A831-I835 VanDerWaalsContact O-N 3.09Å
832	A	95.4	Very high	92.6	Very high	38 Å²	38	41.4 Å²	41.4	31%	0.314	23%	0.233	S	C	.	.	H	α-helix	trans	-63.1	-43.7	176.1	0	0	0	0	0	111.9	L762 K828 L829 M836	L762-A832 HydrophobicContact CD2-CB 4.12Å; K828-A832 WeakPolarHBondContact O-CB 3.31Å; K828-A832 PolarHBondContact O-N 2.99Å; L829-A832 PolarHBondContact O-N 3.34Å; A832-M836 VanDerWaalsContact O-CB 3.3Å; A832-M836 WeakPolarHBondContact O-CB 3.3Å; A832-M836 WeakPolarHBondContact O-CG 3.13Å; A832-M836 PolarHBondContact O-N 3.5Å
833	K	95.6	Very high	93.3	Very high	1 Å²	1	36.9 Å²	36.9	0%	0.004	21%	0.209	C	C	.	.	H	α-helix	trans	-57.1	-57.4	175.4	175.2	-167.7	175.3	-73.3	0	110.1	Q758 L762 L812 L829 Y830 I835 M836 E837	Q758-K833 VanDerWaalsContact OE1-CD 3.32Å; L762-K833 HydrophobicContact CD2-CB 4.39Å; L812-K833 HydrophobicContact CD2-CD 4.08Å; L829-K833 WeakPolarHBondContact O-CB 3.24Å; L829-K833 PolarHBondContact O-N 3.5Å; Y830-K833 PolarHBondContact O-N 3.34Å; K833-I835 VanDerWaalsContact C-N 3.34Å; K833-I835 PolarHBondContact O-N 2.94Å; K833-M836 PolarHBondContact O-N 3.32Å; K833-E837 WeakPolarHBondContact CE-OE2 3.21Å; K833-E837 IonicContact NZ-OE2 3.71Å; K833-E837 PolarHBondContact NZ-OE2 3.5Å; K833-E837 VanDerWaalsContact O-CB 3.26Å; K833-E837 WeakPolarHBondContact O-CB 3.24Å; K833-E837 PolarHBondContact O-N 3.47Å
834	A	95.8	Very high	94.1	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-57.1	-46.9	-175.7	0	0	0	0	0	111.7	D809 L812 L813 Y830 E837 M838	D809-A834 HydrophobicContact CB-CB 4.38Å; L812-A834 HydrophobicContact CB-CB 4.46Å; L812-A834 HydrophobicContact CD2-CB 4.32Å; L813-A834 HydrophobicContact CB-CB 3.88Å; L813-A834 HydrophobicContact CD1-CB 4.19Å; Y830-A834 WeakPolarHBondContact O-CB 3.43Å; Y830-A834 PolarHBondContact O-N 3.34Å; A834-E837 PolarHBondContact O-N 3.25Å; A834-M838 WeakPolarHBondContact O-CB 3.33Å; A834-M838 WeakPolarHBondContact O-CG 3.49Å; A834-M838 PolarHBondContact O-N 3.23Å
835	I	96.4	Very high	94.8	Very high	78 Å²	78	31.5 Å²	31.5	40%	0.4	17%	0.165	S	C	.	.	H	α-helix	trans	-63.4	-47	178.6	-66.3	167.2	0	0	0	111.2	L813 A831 K833 E837 I839	L813-I835 HydrophobicContact CD1-CD1 4.08Å; L813-I835 HydrophobicContact CD1-CG1 3.8Å; L813-I835 HydrophobicContact CD2-CG1 4.3Å; A831-I835 WeakPolarHBondContact O-CD1 3.44Å; A831-I835 VanDerWaalsContact O-CG1 3.29Å; A831-I835 WeakPolarHBondContact O-CG1 3.34Å; A831-I835 PolarHBondContact O-N 2.88Å; A831-I835 VanDerWaalsContact O-N 3.09Å; K833-I835 VanDerWaalsContact C-N 3.34Å; K833-I835 PolarHBondContact O-N 2.94Å; I835-E837 VanDerWaalsContact C-N 3.33Å; I835-E837 PolarHBondContact O-N 2.85Å; I835-I839 HydrophobicContact CG2-CD1 3.84Å; I835-I839 VanDerWaalsContact O-CG1 3.3Å; I835-I839 WeakPolarHBondContact O-CG1 3.48Å; I835-I839 PolarHBondContact O-N 2.94Å; I835-I839 VanDerWaalsContact O-N 3.08Å
836	M	96.3	Very high	95.1	Very high	53 Å²	53	27 Å²	27	26%	0.261	14%	0.141	S	C	.	.	H	α-helix	trans	-65.9	-36.9	179.6	-78.7	-178.6	24.3	0	0	112.3	L762 L765 S766 A832 K833 I839 Q840	L762-M836 HydrophobicContact CB-CE 4.04Å; L762-M836 HydrophobicContact CD2-CE 3.42Å; L762-M836 VanDerWaalsContact CD2-CE 3.42Å; L762-M836 HydrophobicContact CD2-SD 3.6Å; L762-M836 HydrophobicContact CG-CE 4.34Å; L762-M836 VanDerWaalsContact O-CE 3.24Å; L762-M836 WeakPolarHBondContact O-CE 3.48Å; L765-M836 HydrophobicContact CB-CE 3.73Å; L765-M836 HydrophobicContact CD1-CB 4.28Å; L765-M836 HydrophobicContact CD1-CE 4.42Å; S766-M836 WeakPolarHBondContact OG-CE 3.38Å; A832-M836 VanDerWaalsContact O-CB 3.3Å; A832-M836 WeakPolarHBondContact O-CB 3.3Å; A832-M836 WeakPolarHBondContact O-CG 3.13Å; A832-M836 PolarHBondContact O-N 3.5Å; K833-M836 PolarHBondContact O-N 3.32Å; M836-I839 PolarHBondContact O-N 3.15Å; M836-Q840 WeakPolarHBondContact O-CB 3.3Å; M836-Q840 PolarHBondContact O-N 2.72Å
837	E	96.5	Very high	95.4	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-69	-41.6	-180	-170.4	160.1	-155	0	0	111.8	L765 M805 D809 K833 A834 I835 Q840 S841 R922	L765-E837 HydrophobicContact CD1-CB 3.92Å; L765-E837 HydrophobicContact CD2-CB 4.29Å; L765-E837 HydrophobicContact CD2-CG 4.2Å; M805-E837 HydrophobicContact CE-CG 4.15Å; M805-E837 VanDerWaalsContact CE-OE1 3.3Å; M805-E837 WeakPolarHBondContact CE-OE1 3.33Å; M805-E837 HydrophobicContact SD-CG 4.33Å; D809-E837 WeakPolarHBondContact OD2-CG 3.31Å; K833-E837 WeakPolarHBondContact CE-OE2 3.21Å; K833-E837 IonicContact NZ-OE2 3.71Å; K833-E837 PolarHBondContact NZ-OE2 3.5Å; K833-E837 VanDerWaalsContact O-CB 3.26Å; K833-E837 WeakPolarHBondContact O-CB 3.24Å; K833-E837 PolarHBondContact O-N 3.47Å; A834-E837 PolarHBondContact O-N 3.25Å; I835-E837 VanDerWaalsContact C-N 3.33Å; I835-E837 PolarHBondContact O-N 2.85Å; E837-Q840 PolarHBondContact O-N 2.9Å; E837-S841 WeakPolarHBondContact O-CB 2.86Å; E837-S841 PolarHBondContact O-N 2.99Å; E837-S841 PolarHBondContact O-OG 3.03Å; E837-R922 IonicContact OE1-CZ 3.61Å; E837-R922 IonicContact OE1-NH2 3.86Å; E837-R922 PolarHBondContact OE1-NH2 3.39Å
838	M	97	Very high	95.6	Very high	14 Å²	14	26.2 Å²	26.2	7%	0.069	14%	0.135	C	C	.	.	H	α-helix	trans	-61	-47.9	172.3	-66.5	164.8	61.3	0	0	111.5	F33 L806 D809 L810 L813 A834 S841 M842	F33-M838 HydrophobicContact CD2-CE 4.11Å; F33-M838 HydrophobicContact CE2-CE 3.16Å; F33-M838 HydrophobicContact CZ-CE 3.75Å; L806-M838 HydrophobicContact CD2-CB 4.11Å; L806-M838 HydrophobicContact CD2-CG 4.02Å; D809-M838 HydrophobicContact CB-CG 3.49Å; D809-M838 VanDerWaalsContact CB-CG 3.49Å; D809-M838 HydrophobicContact CB-SD 3.84Å; L810-M838 HydrophobicContact CD2-CE 4.02Å; L810-M838 HydrophobicContact CG-CE 4.39Å; L813-M838 HydrophobicContact CD2-SD 4.41Å; A834-M838 WeakPolarHBondContact O-CB 3.33Å; A834-M838 WeakPolarHBondContact O-CG 3.49Å; A834-M838 PolarHBondContact O-N 3.23Å; M838-S841 PolarHBondContact O-OG 3.37Å; M838-S841 VanDerWaalsContact O-OG 3.04Å; M838-M842 WeakPolarHBondContact O-CB 3.49Å; M838-M842 VanDerWaalsContact O-CG 3.22Å; M838-M842 WeakPolarHBondContact O-CG 3.26Å; M838-M842 PolarHBondContact O-N 2.84Å
839	I	96.2	Very high	95.5	Very high	97 Å²	97	21 Å²	21	50%	0.497	11%	0.112	S	C	.	.	H	α-helix	trans	-63.1	-45.9	177.9	-68	168.8	0	0	0	110.9	I835 M836 L843	I835-I839 HydrophobicContact CG2-CD1 3.84Å; I835-I839 VanDerWaalsContact O-CG1 3.3Å; I835-I839 WeakPolarHBondContact O-CG1 3.48Å; I835-I839 PolarHBondContact O-N 2.94Å; I835-I839 VanDerWaalsContact O-N 3.08Å; M836-I839 PolarHBondContact O-N 3.15Å; I839-L843 VanDerWaalsContact O-CB 3.25Å; I839-L843 WeakPolarHBondContact O-CB 3.3Å; I839-L843 PolarHBondContact O-N 3.04Å
840	Q	97.4	Very high	95.2	Very high	0 Å²	0	19.5 Å²	19.5	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-65.1	-45.3	-177.7	-174.1	-76	-45.1	0	0	111.4	L765 S768 T769 M836 E837 L843 Q844	L765-Q840 HydrophobicContact CD2-CB 4.06Å; L765-Q840 HydrophobicContact CD2-CG 3.95Å; S768-Q840 PolarHBondContact OG-NE2 3.41Å; T769-Q840 WeakPolarHBondContact OG1-CB 3.26Å; T769-Q840 WeakPolarHBondContact OG1-CG 2.99Å; M836-Q840 WeakPolarHBondContact O-CB 3.3Å; M836-Q840 PolarHBondContact O-N 2.72Å; E837-Q840 PolarHBondContact O-N 2.9Å; Q840-L843 PolarHBondContact O-N 3.11Å; Q840-Q844 VanDerWaalsContact O-CB 3.28Å; Q840-Q844 WeakPolarHBondContact O-CB 3.4Å; Q840-Q844 PolarHBondContact O-N 2.89Å
841	S	97.2	Very high	94.9	Very high	0 Å²	0	19.6 Å²	19.6	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-65.9	-45.5	-179.8	58.6	0	0	0	0	111.5	E837 M838 L843 Q844 V845	E837-S841 WeakPolarHBondContact O-CB 2.86Å; E837-S841 PolarHBondContact O-N 2.99Å; E837-S841 PolarHBondContact O-OG 3.03Å; M838-S841 PolarHBondContact O-OG 3.37Å; M838-S841 VanDerWaalsContact O-OG 3.04Å; S841-L843 PolarHBondContact O-N 3.44Å; S841-Q844 PolarHBondContact O-N 3.25Å; S841-V845 WeakPolarHBondContact O-CG2 3.43Å; S841-V845 PolarHBondContact O-N 2.91Å
842	M	96.3	Very high	94.5	Very high	43 Å²	43	20.6 Å²	20.6	21%	0.212	11%	0.112	C	C	.	.	H	α-helix	trans	-60.1	-45.2	174.3	-69.9	177.5	74.7	0	0	111.9	L29 F33 L806 M838 Q844 V845 F846	L29-M842 HydrophobicContact CB-CE 4.28Å; F33-M842 HydrophobicContact CB-CE 3.84Å; F33-M842 HydrophobicContact CB-SD 4.28Å; F33-M842 HydrophobicContact CD2-SD 4.36Å; F33-M842 HydrophobicContact CG-CE 4.24Å; F33-M842 HydrophobicContact CG-SD 4.24Å; L806-M842 HydrophobicContact CD2-CG 4.25Å; L806-M842 HydrophobicContact CD2-SD 4.43Å; M838-M842 WeakPolarHBondContact O-CB 3.49Å; M838-M842 VanDerWaalsContact O-CG 3.22Å; M838-M842 WeakPolarHBondContact O-CG 3.26Å; M838-M842 PolarHBondContact O-N 2.84Å; M842-Q844 VanDerWaalsContact C-N 3.35Å; M842-Q844 PolarHBondContact O-N 3.36Å; M842-V845 PolarHBondContact O-N 3.23Å; M842-F846 WeakPolarHBondContact O-CB 3.3Å; M842-F846 PolarHBondContact O-N 3.39Å
843	L	96.5	Very high	93.8	Very high	31 Å²	31	20.1 Å²	20.1	16%	0.162	10%	0.102	C	C	.	.	H	α-helix	trans	-64.3	-39.2	177.6	-179.8	67.6	0	0	0	112.2	T769 C772 L773 L776 I839 Q840 S841 F846 F847	T769-L843 HydrophobicContact CG2-CD2 3.85Å; C772-L843 HydrophobicContact CB-CD2 3.88Å; C772-L843 HydrophobicContact CB-CG 4.09Å; L773-L843 HydrophobicContact CD2-CD1 3.94Å; L773-L843 HydrophobicContact CD2-CD2 3.78Å; L773-L843 HydrophobicContact CG-CD2 3.81Å; L776-L843 HydrophobicContact CD1-CD1 3.69Å; L776-L843 HydrophobicContact CD1-CG 4.47Å; I839-L843 VanDerWaalsContact O-CB 3.25Å; I839-L843 WeakPolarHBondContact O-CB 3.3Å; I839-L843 PolarHBondContact O-N 3.04Å; Q840-L843 PolarHBondContact O-N 3.11Å; S841-L843 PolarHBondContact O-N 3.44Å; L843-F846 PolarHBondContact O-N 2.88Å; L843-F847 WeakPolarHBondContact O-CB 3.4Å; L843-F847 PolarHBondContact O-N 3.45Å
844	Q	96.6	Very high	93.2	Very high	0 Å²	0	20.8 Å²	20.8	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-67.7	-42.6	178.3	-178.8	171.3	-57.6	0	0	111.7	Q840 S841 M842 F847 I848 N878 S925	Q840-Q844 VanDerWaalsContact O-CB 3.28Å; Q840-Q844 WeakPolarHBondContact O-CB 3.4Å; Q840-Q844 PolarHBondContact O-N 2.89Å; S841-Q844 PolarHBondContact O-N 3.25Å; M842-Q844 VanDerWaalsContact C-N 3.35Å; M842-Q844 PolarHBondContact O-N 3.36Å; Q844-F847 WeakPolarHBondContact O-CB 3.46Å; Q844-F847 PolarHBondContact O-N 3.47Å; Q844-I848 HydrophobicContact CG-CD1 3.96Å; Q844-I848 WeakPolarHBondContact O-CG1 3.45Å; Q844-I848 PolarHBondContact O-N 3.43Å; Q844-N878 PolarHBondContact NE2-OD1 3.42Å; Q844-N878 PolarHBondContact OE1-ND2 2.88Å; Q844-N878 VanDerWaalsContact OE1-ND2 3.11Å; Q844-N878 PolarHBondContact OE1-OD1 3.01Å; Q844-N878 VanDerWaalsContact OE1-OD1 3.13Å; Q844-S925 PolarHBondContact NE2-OG 3.18Å
845	V	96.5	Very high	92.3	Very high	0 Å²	0	21.7 Å²	21.7	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-63.5	-45.2	174.8	175.8	0	0	0	0	110.3	L29 L798 L799 L802 S841 M842 F847 I848 L849 F921	L29-V845 HydrophobicContact CD2-CB 4.16Å; L29-V845 HydrophobicContact CD2-CG1 3.8Å; L798-V845 HydrophobicContact CD1-CG2 4.33Å; L798-V845 HydrophobicContact CD2-CB 4.43Å; L798-V845 HydrophobicContact CD2-CG1 4.03Å; L798-V845 HydrophobicContact CD2-CG2 4.14Å; L798-V845 HydrophobicContact CG-CG1 4.35Å; L798-V845 HydrophobicContact CG-CG2 4Å; L799-V845 HydrophobicContact CD2-CG1 3.93Å; L802-V845 HydrophobicContact CB-CG2 4.23Å; L802-V845 HydrophobicContact CD1-CG2 3.98Å; L802-V845 HydrophobicContact CD2-CB 4.25Å; L802-V845 HydrophobicContact CD2-CG1 4.24Å; L802-V845 HydrophobicContact CD2-CG2 4.05Å; L802-V845 HydrophobicContact CG-CG2 4.3Å; S841-V845 WeakPolarHBondContact O-CG2 3.43Å; S841-V845 PolarHBondContact O-N 2.91Å; M842-V845 PolarHBondContact O-N 3.23Å; V845-F847 VanDerWaalsContact C-N 3.28Å; V845-F847 PolarHBondContact O-N 2.96Å; V845-I848 PolarHBondContact O-N 3.47Å; V845-I848 VanDerWaalsContact O-N 3.09Å; V845-L849 HydrophobicContact CG1-CD1 3.99Å; V845-L849 HydrophobicContact CG1-CG 4.13Å; V845-L849 WeakPolarHBondContact O-CG 3.31Å; V845-L849 PolarHBondContact O-N 3.16Å; V845-F921 HydrophobicContact CG2-CE2 3.57Å; V845-F921 HydrophobicContact CG2-CZ 3.88Å
846	F	94.6	Very high	91.3	Very high	31 Å²	31	18 Å²	18	14%	0.136	9%	0.092	C	C	.	.	H	α-helix	trans	-54.1	-46	173.4	178.6	-108	0	0	0	112	A22 L26 L29 L776 M842 L843 E850	A22-F846 HydrophobicContact CB-CE2 4.35Å; A22-F846 HydrophobicContact CB-CZ 4.16Å; L26-F846 HydrophobicContact CD1-CE2 4.32Å; L26-F846 HydrophobicContact CD2-CD2 3.94Å; L26-F846 HydrophobicContact CD2-CE2 3.96Å; L26-F846 HydrophobicContact CD2-CG 4.45Å; L26-F846 HydrophobicContact CD2-CZ 4.47Å; L26-F846 HydrophobicContact CG-CD2 4.05Å; L26-F846 HydrophobicContact CG-CE2 3.67Å; L26-F846 HydrophobicContact CG-CZ 4.3Å; L29-F846 HydrophobicContact CD1-CB 3.61Å; L29-F846 HydrophobicContact CD1-CD2 4.27Å; L29-F846 HydrophobicContact CD1-CG 4.41Å; L776-F846 HydrophobicContact CD1-CD1 4.03Å; L776-F846 HydrophobicContact CD1-CE1 4.28Å; L776-F846 HydrophobicContact CD2-CD1 3.96Å; L776-F846 HydrophobicContact CD2-CE1 3.86Å; M842-F846 WeakPolarHBondContact O-CB 3.3Å; M842-F846 PolarHBondContact O-N 3.39Å; L843-F846 PolarHBondContact O-N 2.88Å; F846-E850 HydrophobicContact CD2-CG 4.46Å; F846-E850 HydrophobicContact CE1-CG 4.35Å; F846-E850 HydrophobicContact CE2-CG 3.95Å; F846-E850 HydrophobicContact CZ-CG 3.9Å; F846-E850 WeakPolarHBondContact O-CB 3.41Å; F846-E850 PolarHBondContact O-N 2.9Å
847	F	94.3	Very high	90	Very high	1 Å²	1	17 Å²	17	0%	0.004	10%	0.095	C	C	.	.	H	α-helix	trans	-60.1	-45.5	175.1	169	-112.7	0	0	0	112.8	L776 L779 L843 Q844 V845 E850 A851 I871 L874 L929	L776-F847 HydrophobicContact CB-CD2 4.45Å; L776-F847 HydrophobicContact CD1-CB 4.29Å; L776-F847 HydrophobicContact CD2-CB 3.97Å; L776-F847 HydrophobicContact CD2-CD2 3.76Å; L776-F847 HydrophobicContact CD2-CG 4.37Å; L776-F847 HydrophobicContact CG-CB 3.92Å; L776-F847 HydrophobicContact CG-CD2 3.66Å; L776-F847 HydrophobicContact CG-CG 4.21Å; L779-F847 HydrophobicContact CD1-CE2 4.28Å; L779-F847 HydrophobicContact CD2-CE2 3.89Å; L779-F847 HydrophobicContact CD2-CZ 4.14Å; L779-F847 HydrophobicContact CG-CE2 4.49Å; L843-F847 WeakPolarHBondContact O-CB 3.4Å; L843-F847 PolarHBondContact O-N 3.45Å; Q844-F847 WeakPolarHBondContact O-CB 3.46Å; Q844-F847 PolarHBondContact O-N 3.47Å; V845-F847 VanDerWaalsContact C-N 3.28Å; V845-F847 PolarHBondContact O-N 2.96Å; F847-E850 PolarHBondContact O-N 3.28Å; F847-A851 HydrophobicContact CD2-CB 4.36Å; F847-A851 HydrophobicContact CE2-CB 4.02Å; F847-A851 HydrophobicContact CZ-CB 4.17Å; F847-A851 WeakPolarHBondContact O-CB 3.38Å; F847-A851 PolarHBondContact O-N 3.47Å; F847-I871 HydrophobicContact CZ-CG1 4.29Å; F847-L874 HydrophobicContact CD1-CD2 3.94Å; F847-L874 HydrophobicContact CE1-CD2 3.63Å; F847-L929 HydrophobicContact CD1-CD2 4.13Å; F847-L929 HydrophobicContact CE1-CD2 3.59Å
848	I	93.3	Very high	88.9	Confident	0 Å²	0	19.9 Å²	19.9	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-64.2	-47.4	-179.4	-69.6	166.4	0	0	0	110.6	L798 Q844 V845 E850 A851 S852 C928 L929 I932	L798-I848 HydrophobicContact CD1-CD1 4.37Å; L798-I848 HydrophobicContact CD2-CB 3.86Å; L798-I848 HydrophobicContact CD2-CD1 3.89Å; L798-I848 HydrophobicContact CD2-CG1 4.49Å; L798-I848 HydrophobicContact CD2-CG2 3.56Å; Q844-I848 HydrophobicContact CG-CD1 3.96Å; Q844-I848 WeakPolarHBondContact O-CG1 3.45Å; Q844-I848 PolarHBondContact O-N 3.43Å; V845-I848 PolarHBondContact O-N 3.47Å; V845-I848 VanDerWaalsContact O-N 3.09Å; I848-E850 VanDerWaalsContact C-N 3.31Å; I848-E850 PolarHBondContact O-N 3.42Å; I848-A851 PolarHBondContact O-N 2.84Å; I848-S852 VanDerWaalsContact O-CB 3.23Å; I848-S852 WeakPolarHBondContact O-CB 3.24Å; I848-S852 PolarHBondContact O-N 3.06Å; I848-S852 PolarHBondContact O-OG 3.09Å; I848-C928 HydrophobicContact CD1-CB 4.44Å; I848-C928 HydrophobicContact CG2-CB 3.6Å; I848-L929 HydrophobicContact CD1-CD2 4.47Å; I848-L929 HydrophobicContact CD1-CG 4.22Å; I848-L929 HydrophobicContact CG1-CD2 4.03Å; I848-L929 HydrophobicContact CG1-CG 4.28Å; I848-I932 HydrophobicContact CB-CD1 4.42Å; I848-I932 HydrophobicContact CG1-CD1 4.44Å; I848-I932 HydrophobicContact CG2-CD1 4.04Å
849	L	90.8	Very high	87.8	Confident	11 Å²	11	24.3 Å²	24.3	6%	0.058	14%	0.136	C	C	.	.	H	α-helix	trans	-59.2	-41.3	177.7	-65.3	177.3	0	0	0	112.1	D795 V845 S852 R853	D795-L849 HydrophobicContact CB-CD2 3.65Å; D795-L849 VanDerWaalsContact CG-CD2 3.48Å; V845-L849 HydrophobicContact CG1-CD1 3.99Å; V845-L849 HydrophobicContact CG1-CG 4.13Å; V845-L849 WeakPolarHBondContact O-CG 3.31Å; V845-L849 PolarHBondContact O-N 3.16Å; L849-S852 PolarHBondContact O-OG 3.38Å; L849-S852 VanDerWaalsContact O-OG 3.08Å; L849-R853 WeakPolarHBondContact O-CG 3.29Å
850	E	88.3	Confident	86.7	Confident	6 Å²	6	25.3 Å²	25.3	3%	0.028	14%	0.139	C	C	.	.	H	α-helix	trans	-74.3	-32.4	177.4	-79.6	-66.1	128.5	0	0	113	S21 A22 F846 F847 I848 R854	S21-E850 PolarHBondContact OG-OE1 3.43Å; A22-E850 WeakPolarHBondContact CA-OE1 3.2Å; A22-E850 PolarHBondContact N-OE1 3.26Å; F846-E850 HydrophobicContact CD2-CG 4.46Å; F846-E850 HydrophobicContact CE1-CG 4.35Å; F846-E850 HydrophobicContact CE2-CG 3.95Å; F846-E850 HydrophobicContact CZ-CG 3.9Å; F846-E850 WeakPolarHBondContact O-CB 3.41Å; F846-E850 PolarHBondContact O-N 2.9Å; F847-E850 PolarHBondContact O-N 3.28Å; I848-E850 VanDerWaalsContact C-N 3.31Å; I848-E850 PolarHBondContact O-N 3.42Å; E850-R854 WeakPolarHBondContact O-CD 3.3Å; E850-R854 WeakPolarHBondContact O-CG 3.23Å; E850-R854 PolarHBondContact O-NE 2.96Å; E850-R854 IonicContact OE2-CZ 3.32Å; E850-R854 IonicContact OE2-NE 3.72Å; E850-R854 IonicContact OE2-NH2 3.06Å; E850-R854 PolarHBondContact OE2-NH2 2.99Å
851	A	88.4	Confident	85.8	Confident	2 Å²	2	27.3 Å²	27.3	2%	0.017	15%	0.148	C	C	.	.	H	α-helix	trans	-80.7	-31.9	-179.1	0	0	0	0	0	112.4	L779 F847 I848 R853 R854 I932	L779-A851 HydrophobicContact CD2-CB 3.56Å; F847-A851 HydrophobicContact CD2-CB 4.36Å; F847-A851 HydrophobicContact CE2-CB 4.02Å; F847-A851 HydrophobicContact CZ-CB 4.17Å; F847-A851 WeakPolarHBondContact O-CB 3.38Å; F847-A851 PolarHBondContact O-N 3.47Å; I848-A851 PolarHBondContact O-N 2.84Å; A851-R853 PolarHBondContact O-N 3.46Å; A851-R854 PolarHBondContact O-N 3.36Å; A851-R854 VanDerWaalsContact O-N 3.14Å; A851-I932 HydrophobicContact CB-CD1 3.7Å; A851-I932 HydrophobicContact CB-CG1 4.25Å; A851-I932 HydrophobicContact CB-CG2 3.93Å
852	S	84.8	Confident	84.6	Confident	26 Å²	26	27.9 Å²	27.9	18%	0.182	15%	0.151	C	C	.	.	H	α-helix	trans	-64.8	-29.9	177.8	76.8	0	0	0	0	111.8	V791 D795 I848 L849 R854	V791-S852 VanDerWaalsContact CG1-CB 3.41Å; D795-S852 PolarHBondContact OD2-OG 3.46Å; I848-S852 VanDerWaalsContact O-CB 3.23Å; I848-S852 WeakPolarHBondContact O-CB 3.24Å; I848-S852 PolarHBondContact O-N 3.06Å; I848-S852 PolarHBondContact O-OG 3.09Å; L849-S852 PolarHBondContact O-OG 3.38Å; L849-S852 VanDerWaalsContact O-OG 3.08Å; S852-R854 VanDerWaalsContact C-N 3.33Å; S852-R854 PolarHBondContact O-N 3.02Å
853	R	82.3	Confident	83.5	Confident	29 Å²	29	31 Å²	31	11%	0.109	17%	0.165	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.5	3.7	175.4	-61.3	177.3	68.3	165.3	7.6	114.6	I15 S21 L784 S785 L787 L849 A851	I15-R853 VanDerWaalsContact CB-NH2 3.28Å; I15-R853 VanDerWaalsContact CD1-NH1 3.28Å; S21-R853 VanDerWaalsContact OG-CZ 3.3Å; S21-R853 PolarHBondContact OG-NH1 2.95Å; L784-R853 HydrophobicContact CD1-CB 3.8Å; S785-R853 PolarHBondContact N-O 2.9Å; L787-R853 HydrophobicContact CD1-CG 3.91Å; L849-R853 WeakPolarHBondContact O-CG 3.29Å; A851-R853 PolarHBondContact O-N 3.46Å
854	R	80.9	Confident	82.6	Confident	15 Å²	15	34.8 Å²	34.8	6%	0.057	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	133.9	-173.8	-75.1	172	-165.8	-90.4	-2.9	112.7	L779 L782 K783 E850 A851 S852	L779-R854 WeakPolarHBondContact O-CD 3.42Å; L779-R854 PolarHBondContact O-NH1 3.08Å; L782-R854 HydrophobicContact CB-CB 3.87Å; L782-R854 HydrophobicContact CB-CG 4.3Å; L782-R854 HydrophobicContact CD1-CB 4.24Å; K783-R854 WeakPolarHBondContact O-CA 3.46Å; E850-R854 WeakPolarHBondContact O-CD 3.3Å; E850-R854 WeakPolarHBondContact O-CG 3.23Å; E850-R854 PolarHBondContact O-NE 2.96Å; E850-R854 IonicContact OE2-CZ 3.32Å; E850-R854 IonicContact OE2-NE 3.72Å; E850-R854 IonicContact OE2-NH2 3.06Å; E850-R854 PolarHBondContact OE2-NH2 2.99Å; A851-R854 PolarHBondContact O-N 3.36Å; A851-R854 VanDerWaalsContact O-N 3.14Å; S852-R854 VanDerWaalsContact C-N 3.33Å; S852-R854 PolarHBondContact O-N 3.02Å
855	C	78	Confident	81.9	Confident	19 Å²	19	36.2 Å²	36.2	13%	0.128	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133	159.7	178	-73.9	0	0	0	0	112	K783 G857 A936	K783-C855 PolarHBondContact N-O 3.3Å; K783-C855 PolarHBondContact O-N 3.14Å; C855-G857 PolarHBondContact O-N 2.92Å; C855-G857 VanDerWaalsContact O-N 3.1Å; C855-A936 CarbonylContact C-O 3.56Å
856	A	75.9	Confident	81.3	Confident	1 Å²	1	37.1 Å²	37.1	1%	0.008	19%	0.193	C	C	.	.	B	Isolated β-bridge	trans	-74.8	101.1	176.9	0	0	0	0	0	110.9	L782 H861 V862 A936 F939	L782-A856 HydrophobicContact CD2-CB 4.27Å; A856-H861 HydrophobicContact CB-CB 4Å; A856-V862 HydrophobicContact CB-CG2 3.62Å; A856-A936 PolarHBondContact N-O 2.69Å; A856-F939 WeakPolarHBondContact O-CD2 3.36Å
857	G	68.5	Low	80.9	Confident	32 Å²	32	36.2 Å²	36.2	33%	0.33	19%	0.192	S	C	.	.			trans	-77.3	-14	178.3	0	0	0	0	0	115.5	C855	C855-G857 PolarHBondContact O-N 2.92Å; C855-G857 VanDerWaalsContact O-N 3.1Å
858	T	72.7	Confident	80.6	Confident	60 Å²	60	37.4 Å²	37.4	37%	0.368	20%	0.196	S	C	.	.	S	Bend	trans	-132.4	154.2	179.8	68.9	0	0	0	0	110.9	E860 H861 V862	T858-E860 PolarHBondContact O-N 3.49Å; T858-H861 WeakPolarHBondContact O-CB 3.44Å; T858-H861 PolarHBondContact O-N 3.06Å; T858-H861 VanDerWaalsContact O-N 3.11Å; T858-H861 PolarHBondContact OG1-N 3.29Å; T858-H861 PolarHBondContact OG1-ND1 2.82Å; T858-H861 VanDerWaalsContact OG1-ND1 3.09Å; T858-V862 PolarHBondContact O-N 2.95Å
859	L	73.6	Confident	80.5	Confident	106 Å²	106	39.2 Å²	39.2	56%	0.555	21%	0.207	S	C	*	.	H	α-helix	trans	-61.6	-31.7	174.5	-170.8	66.7	0	0	0	111.8	H861 V862 Q863	L859-H861 VanDerWaalsContact C-N 3.34Å; L859-H861 PolarHBondContact O-N 3.43Å; L859-V862 WeakPolarHBondContact O-CB 3.4Å; L859-V862 PolarHBondContact O-N 3.37Å; L859-Q863 WeakPolarHBondContact O-CG 3.38Å; L859-Q863 PolarHBondContact O-N 3.35Å
860	E	73.5	Confident	80.6	Confident	119 Å²	119	41.3 Å²	41.3	56%	0.556	22%	0.218	S	C	*	.	H	α-helix	trans	-61.6	-41.6	173.9	-167.8	-170	158.8	0	0	111.3	T858 V862 Q863 K864	T858-E860 PolarHBondContact O-N 3.49Å; E860-V862 VanDerWaalsContact C-N 3.32Å; E860-V862 PolarHBondContact O-N 3.09Å; E860-Q863 PolarHBondContact O-N 2.89Å; E860-K864 VanDerWaalsContact O-CB 3.23Å; E860-K864 WeakPolarHBondContact O-CB 3.36Å; E860-K864 PolarHBondContact O-N 3.2Å
861	H	79.2	Confident	80.8	Confident	41 Å²	41	41 Å²	41	19%	0.19	22%	0.217	C	C	.	.	H	α-helix	trans	-63.8	-37.8	176.3	-65.3	153.3	0	0	0	112.4	A781 L782 A856 T858 L859 Q863 K865	A781-H861 PolarHBondContact O-CE1 2.83Å; L782-H861 HydrophobicContact CD2-CB 4.26Å; A856-H861 HydrophobicContact CB-CB 4Å; T858-H861 WeakPolarHBondContact O-CB 3.44Å; T858-H861 PolarHBondContact O-N 3.06Å; T858-H861 VanDerWaalsContact O-N 3.11Å; T858-H861 PolarHBondContact OG1-N 3.29Å; T858-H861 PolarHBondContact OG1-ND1 2.82Å; T858-H861 VanDerWaalsContact OG1-ND1 3.09Å; L859-H861 VanDerWaalsContact C-N 3.34Å; L859-H861 PolarHBondContact O-N 3.43Å; H861-Q863 VanDerWaalsContact C-N 3.34Å; H861-Q863 PolarHBondContact O-N 2.82Å; H861-K865 WeakPolarHBondContact O-CA 3.21Å; H861-K865 PolarHBondContact O-N 3.14Å
862	V	72.9	Confident	81	Confident	13 Å²	13	41.4 Å²	41.4	8%	0.079	22%	0.218	C	C	.	.	H	α-helix	trans	-63.6	-39.1	175.4	178.9	0	0	0	0	111.4	A856 T858 L859 E860 K865 F939	A856-V862 HydrophobicContact CB-CG2 3.62Å; T858-V862 PolarHBondContact O-N 2.95Å; L859-V862 WeakPolarHBondContact O-CB 3.4Å; L859-V862 PolarHBondContact O-N 3.37Å; E860-V862 VanDerWaalsContact C-N 3.32Å; E860-V862 PolarHBondContact O-N 3.09Å; V862-K865 WeakPolarHBondContact O-CE 3.34Å; V862-K865 WeakPolarHBondContact O-CG 3.4Å; V862-F939 HydrophobicContact CG2-CB 4.05Å; V862-F939 HydrophobicContact CG2-CD2 4.19Å
863	Q	72.1	Confident	81.5	Confident	108 Å²	108	41.1 Å²	41.1	51%	0.505	21%	0.214	S	C	.	.	H	α-helix	trans	-78.7	-44.1	179.2	-69.4	179.8	-4.4	0	0	112.9	R718 L859 E860 H861	R718-Q863 PolarHBondContact NH1-O 3.29Å; L859-Q863 WeakPolarHBondContact O-CG 3.38Å; L859-Q863 PolarHBondContact O-N 3.35Å; E860-Q863 PolarHBondContact O-N 2.89Å; H861-Q863 VanDerWaalsContact C-N 3.34Å; H861-Q863 PolarHBondContact O-N 2.82Å
864	K	77.8	Confident	82.1	Confident	111 Å²	111	39.7 Å²	39.7	48%	0.483	21%	0.209	S	C	.	.	H	α-helix	trans	-72.4	-31.2	-176.7	-166.4	172.9	-176	173.7	0	112.4	R718 E860	R718-K864 PolarHBondContact NE-O 2.96Å; R718-K864 PolarHBondContact NH1-O 3.38Å; E860-K864 VanDerWaalsContact O-CB 3.23Å; E860-K864 WeakPolarHBondContact O-CB 3.36Å; E860-K864 PolarHBondContact O-N 3.2Å
865	K	81.3	Confident	82.7	Confident	30 Å²	30	40.2 Å²	40.2	13%	0.13	21%	0.212	C	C	.	.			trans	46.2	59.3	-176.9	-57.9	-174.8	-179.9	177.7	0	112.4	E715 H861 V862 G867 R868 Y937	E715-K865 PolarHBondContact O-NZ 3.32Å; H861-K865 WeakPolarHBondContact O-CA 3.21Å; H861-K865 PolarHBondContact O-N 3.14Å; V862-K865 WeakPolarHBondContact O-CE 3.34Å; V862-K865 WeakPolarHBondContact O-CG 3.4Å; K865-G867 PolarHBondContact O-N 3.42Å; K865-R868 HydrophobicContact CB-CB 3.83Å; K865-R868 HydrophobicContact CB-CG 4.31Å; K865-R868 VanDerWaalsContact O-CB 3.24Å; K865-R868 WeakPolarHBondContact O-CB 3.29Å; K865-R868 PolarHBondContact O-N 3.4Å; K865-Y937 VanDerWaalsContact C-CE1 3.45Å; K865-Y937 VanDerWaalsContact CA-CE1 3.43Å; K865-Y937 HydrophobicContact CB-CD1 3.86Å; K865-Y937 HydrophobicContact CB-CE1 3.89Å; K865-Y937 HydrophobicContact CB-CG 4.36Å; K865-Y937 HydrophobicContact CG-CD1 4.02Å; K865-Y937 HydrophobicContact CG-CG 4.19Å
866	P	83.6	Confident	83.5	Confident	19 Å²	19	40 Å²	40	12%	0.123	21%	0.21	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57	132.5	-177	25.9	-35.1	0	0	0	111.2	L782 R868 Y937	L782-P866 HydrophobicContact CD2-CG 4.37Å; L782-P866 HydrophobicContact CG-CG 4.47Å; P866-R868 VanDerWaalsContact C-N 3.26Å; P866-R868 PolarHBondContact O-N 3.08Å; P866-Y937 HydrophobicContact CG-CE1 4.42Å; P866-Y937 WeakPolarHBondContact O-CE1 3.36Å; P866-Y937 PolarHBondContact O-OH 3.11Å
867	G	86.9	Confident	84.5	Confident	12 Å²	12	40 Å²	40	12%	0.124	21%	0.21	C	C	.	.	T	Hydrogen-bonded Turn	trans	79.3	-8.2	179	0	0	0	0	0	116	K865 T869 M870 I871	K865-G867 PolarHBondContact O-N 3.42Å; G867-T869 VanDerWaalsContact C-N 3.3Å; G867-T869 PolarHBondContact O-N 2.92Å; G867-M870 WeakPolarHBondContact O-CA 3.26Å; G867-M870 WeakPolarHBondContact O-CB 3.48Å; G867-M870 PolarHBondContact O-N 2.89Å; G867-I871 PolarHBondContact O-N 3.41Å
868	R	88.5	Confident	85.8	Confident	25 Å²	25	38.4 Å²	38.4	9%	0.094	19%	0.194	C	C	.	.	H	α-helix	trans	-55.1	-42.4	-174.3	178.5	54.2	161.7	-128.6	17.3	113.7	K865 P866 M870 I871 T872 W933 Y937	K865-R868 HydrophobicContact CB-CB 3.83Å; K865-R868 HydrophobicContact CB-CG 4.31Å; K865-R868 VanDerWaalsContact O-CB 3.24Å; K865-R868 WeakPolarHBondContact O-CB 3.29Å; K865-R868 PolarHBondContact O-N 3.4Å; P866-R868 VanDerWaalsContact C-N 3.26Å; P866-R868 PolarHBondContact O-N 3.08Å; R868-M870 VanDerWaalsContact C-N 3.33Å; R868-I871 PolarHBondContact O-N 3.4Å; R868-T872 WeakPolarHBondContact O-CB 3.3Å; R868-T872 PolarHBondContact O-N 2.97Å; R868-T872 PolarHBondContact O-OG1 3.04Å; R868-W933 VanDerWaalsContact CZ-CD2 3.44Å; R868-W933 VanDerWaalsContact NE-CD1 3.32Å; R868-W933 VanDerWaalsContact NE-CE2 3.25Å; R868-W933 PolarHBondContact NH1-O 3.36Å; R868-W933 VanDerWaalsContact NH2-CH2 3.26Å; R868-W933 VanDerWaalsContact NH2-CZ3 3.34Å; R868-W933 PolarHBondContact NH2-O 3.28Å; R868-Y937 VanDerWaalsContact CA-OH 3.31Å; R868-Y937 WeakPolarHBondContact CA-OH 3.2Å; R868-Y937 HydrophobicContact CB-CE2 4.18Å; R868-Y937 HydrophobicContact CG-CE2 4.47Å; R868-Y937 PolarHBondContact N-OH 3.48Å; R868-Y937 VanDerWaalsContact NH1-CE2 3.27Å
869	T	91	Very high	86.8	Confident	38 Å²	38	38.6 Å²	38.6	23%	0.233	19%	0.192	C	C	.	.	H	α-helix	trans	-62.4	-40.6	176.9	-49.9	0	0	0	0	111.6	R718 K721 G722 G867 T872 F873	R718-T869 PolarHBondContact O-OG1 2.62Å; K721-T869 HydrophobicContact CB-CG2 4.02Å; G722-T869 VanDerWaalsContact N-CG2 3.26Å; G867-T869 VanDerWaalsContact C-N 3.3Å; G867-T869 PolarHBondContact O-N 2.92Å; T869-T872 PolarHBondContact O-N 3.2Å; T869-F873 PolarHBondContact O-N 3.16Å
870	M	92.4	Very high	87.8	Confident	56 Å²	56	33.5 Å²	33.5	28%	0.276	17%	0.166	S	C	.	.	H	α-helix	trans	-70	-43.3	179.2	-57.2	-67.7	100.1	0	0	111.3	I774 S775 G867 R868 T872 F873 L874	I774-M870 HydrophobicContact CG2-CG 4.08Å; I774-M870 HydrophobicContact CG2-SD 3.88Å; S775-M870 VanDerWaalsContact OG-CB 3.24Å; S775-M870 WeakPolarHBondContact OG-CB 3.47Å; G867-M870 WeakPolarHBondContact O-CA 3.26Å; G867-M870 WeakPolarHBondContact O-CB 3.48Å; G867-M870 PolarHBondContact O-N 2.89Å; R868-M870 VanDerWaalsContact C-N 3.33Å; M870-T872 VanDerWaalsContact C-N 3.27Å; M870-T872 PolarHBondContact O-N 2.89Å; M870-F873 PolarHBondContact O-N 2.93Å; M870-L874 WeakPolarHBondContact O-CB 3.26Å; M870-L874 PolarHBondContact O-N 2.75Å
871	I	92.4	Very high	88.8	Confident	0 Å²	0	27.9 Å²	27.9	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-59.6	-41.2	174.1	-59.5	171.6	0	0	0	110.6	L779 F847 G867 R868 L874 L875 I932 W933 Y937	L779-I871 HydrophobicContact CD1-CD1 4.04Å; L779-I871 HydrophobicContact CD1-CG1 4.29Å; L779-I871 HydrophobicContact CD2-CD1 4.14Å; F847-I871 HydrophobicContact CZ-CG1 4.29Å; G867-I871 PolarHBondContact O-N 3.41Å; R868-I871 PolarHBondContact O-N 3.4Å; I871-L874 PolarHBondContact O-N 2.95Å; I871-L875 HydrophobicContact CG2-CD1 4.45Å; I871-L875 WeakPolarHBondContact O-CB 3.29Å; I871-L875 WeakPolarHBondContact O-CG 3.38Å; I871-L875 PolarHBondContact O-N 3.34Å; I871-I932 HydrophobicContact CD1-CG2 4.05Å; I871-W933 HydrophobicContact CG2-CB 3.93Å; I871-W933 HydrophobicContact CG2-CG 4.47Å; I871-Y937 HydrophobicContact CD1-CE2 4.42Å
872	T	92.7	Very high	89.5	Confident	9 Å²	9	27.6 Å²	27.6	6%	0.055	14%	0.137	C	C	.	.	H	α-helix	trans	-64.9	-40.9	177.9	-50.4	0	0	0	0	111.8	S719 L723 R868 T869 M870 L875 V876 W933	S719-T872 PolarHBondContact OG-OG1 2.73Å; L723-T872 HydrophobicContact CB-CG2 3.88Å; L723-T872 HydrophobicContact CD1-CG2 4.24Å; R868-T872 WeakPolarHBondContact O-CB 3.3Å; R868-T872 PolarHBondContact O-N 2.97Å; R868-T872 PolarHBondContact O-OG1 3.04Å; T869-T872 PolarHBondContact O-N 3.2Å; M870-T872 VanDerWaalsContact C-N 3.27Å; M870-T872 PolarHBondContact O-N 2.89Å; T872-L875 WeakPolarHBondContact O-CB 3.37Å; T872-V876 PolarHBondContact O-N 2.91Å; T872-W933 PolarHBondContact OG1-NE1 3.19Å
873	F	95.1	Very high	90.4	Very high	20 Å²	20	29.7 Å²	29.7	9%	0.088	15%	0.145	C	C	.	.	H	α-helix	trans	-64.6	-46.7	174.6	176.1	-116.6	0	0	0	111.3	V725 G726 L729 V767 T771 T869 M870 L875 V876 L877	V725-F873 HydrophobicContact CB-CD2 4.32Å; V725-F873 HydrophobicContact CB-CE2 4.38Å; V725-F873 HydrophobicContact CG1-CD2 4.12Å; V725-F873 HydrophobicContact CG1-CE2 3.74Å; V725-F873 HydrophobicContact CG1-CZ 4.42Å; G726-F873 VanDerWaalsContact CA-CD2 3.46Å; L729-F873 HydrophobicContact CD1-CE2 4.38Å; L729-F873 HydrophobicContact CD1-CZ 4.07Å; V767-F873 HydrophobicContact CG1-CE1 3.74Å; V767-F873 HydrophobicContact CG1-CZ 3.69Å; T771-F873 HydrophobicContact CG2-CD1 3.69Å; T771-F873 HydrophobicContact CG2-CE1 4.26Å; T771-F873 VanDerWaalsContact OG1-CE1 3.29Å; T771-F873 WeakPolarHBondContact OG1-CE1 3.04Å; T869-F873 PolarHBondContact O-N 3.16Å; M870-F873 PolarHBondContact O-N 2.93Å; F873-L875 VanDerWaalsContact C-N 3.27Å; F873-L875 PolarHBondContact O-N 2.88Å; F873-V876 PolarHBondContact O-N 3.38Å; F873-V876 VanDerWaalsContact O-N 3.16Å; F873-L877 HydrophobicContact CE1-CD2 4.14Å; F873-L877 HydrophobicContact CZ-CD2 4.41Å; F873-L877 WeakPolarHBondContact O-CB 3.13Å; F873-L877 PolarHBondContact O-N 2.83Å
874	L	95.1	Very high	91.4	Very high	0 Å²	0	24.5 Å²	24.5	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-62	-32.8	179.4	-171.1	61.6	0	0	0	112.8	T771 F847 M870 I871 L877 N878 L929	T771-L874 HydrophobicContact CG2-CB 3.91Å; T771-L874 HydrophobicContact CG2-CD1 4.03Å; T771-L874 HydrophobicContact CG2-CG 4.42Å; F847-L874 HydrophobicContact CD1-CD2 3.94Å; F847-L874 HydrophobicContact CE1-CD2 3.63Å; M870-L874 WeakPolarHBondContact O-CB 3.26Å; M870-L874 PolarHBondContact O-N 2.75Å; I871-L874 PolarHBondContact O-N 2.95Å; L874-L877 HydrophobicContact CD1-CD2 4.4Å; L874-N878 WeakPolarHBondContact O-CB 3.39Å; L874-N878 PolarHBondContact O-N 3.33Å; L874-N878 PolarHBondContact O-ND2 3.41Å; L874-L929 HydrophobicContact CD2-CD1 4.18Å; L874-L929 HydrophobicContact CD2-CD2 3.85Å; L874-L929 HydrophobicContact CG-CD1 3.96Å; L874-L929 HydrophobicContact CG-CD2 4.46Å
875	L	93.9	Very high	92	Very high	25 Å²	25	19.5 Å²	19.5	13%	0.131	10%	0.099	C	C	.	.	H	α-helix	trans	-60.4	-50.8	172.3	-88.2	168.8	0	0	0	112	I871 T872 F873 L877 N878 L879 T926 L929 W933	I871-L875 HydrophobicContact CG2-CD1 4.45Å; I871-L875 WeakPolarHBondContact O-CB 3.29Å; I871-L875 WeakPolarHBondContact O-CG 3.38Å; I871-L875 PolarHBondContact O-N 3.34Å; T872-L875 WeakPolarHBondContact O-CB 3.37Å; F873-L875 VanDerWaalsContact C-N 3.27Å; F873-L875 PolarHBondContact O-N 2.88Å; L875-L877 VanDerWaalsContact C-N 3.33Å; L875-N878 PolarHBondContact O-N 3.2Å; L875-L879 PolarHBondContact O-N 3.34Å; L875-T926 HydrophobicContact CD2-CG2 3.91Å; L875-T926 WeakPolarHBondContact CD2-O 3.48Å; L875-L929 HydrophobicContact CD2-CB 3.48Å; L875-L929 VanDerWaalsContact CD2-CB 3.48Å; L875-L929 HydrophobicContact CG-CB 3.93Å; L875-W933 HydrophobicContact CD1-CB 3.99Å; L875-W933 HydrophobicContact CD1-CG 4Å
876	V	95	Very high	92.3	Very high	15 Å²	15	19.3 Å²	19.3	9%	0.091	10%	0.101	C	C	.	.	H	α-helix	trans	-69.6	-35.6	179.9	-176	0	0	0	0	111	L723 G726 L727 F730 T872 F873 L879 A880	L723-V876 HydrophobicContact CD1-CG2 4.04Å; G726-V876 VanDerWaalsContact O-CG1 3.31Å; G726-V876 WeakPolarHBondContact O-CG1 3.21Å; L727-V876 HydrophobicContact CD2-CG1 4.41Å; F730-V876 HydrophobicContact CB-CG1 3.92Å; F730-V876 HydrophobicContact CG-CG1 4.46Å; T872-V876 PolarHBondContact O-N 2.91Å; F873-V876 PolarHBondContact O-N 3.38Å; F873-V876 VanDerWaalsContact O-N 3.16Å; V876-L879 WeakPolarHBondContact O-CB 3.45Å; V876-L879 PolarHBondContact O-N 3.05Å; V876-A880 PolarHBondContact O-N 3.04Å
877	L	96.3	Very high	92.4	Very high	0 Å²	0	21.7 Å²	21.7	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-65.2	-41.5	175.5	-178.2	60.1	0	0	0	112.4	L729 L764 V767 S768 F873 L874 L875 L879 A880 M881	L729-L877 HydrophobicContact CD1-CD1 3.94Å; L729-L877 HydrophobicContact CD2-CD1 3.5Å; L729-L877 VanDerWaalsContact CD2-CD1 3.5Å; L729-L877 HydrophobicContact CG-CD1 4.4Å; L764-L877 HydrophobicContact CD2-CD1 3.72Å; V767-L877 HydrophobicContact CB-CD2 4.44Å; V767-L877 HydrophobicContact CG1-CD2 3.93Å; S768-L877 VanDerWaalsContact CA-CD2 3.41Å; F873-L877 HydrophobicContact CE1-CD2 4.14Å; F873-L877 HydrophobicContact CZ-CD2 4.41Å; F873-L877 WeakPolarHBondContact O-CB 3.13Å; F873-L877 PolarHBondContact O-N 2.83Å; L874-L877 HydrophobicContact CD1-CD2 4.4Å; L875-L877 VanDerWaalsContact C-N 3.33Å; L877-L879 VanDerWaalsContact C-N 3.32Å; L877-A880 WeakPolarHBondContact O-CB 3.47Å; L877-A880 PolarHBondContact O-N 3.46Å; L877-M881 HydrophobicContact CG-CE 4.31Å; L877-M881 PolarHBondContact O-N 3.28Å
878	N	95.4	Very high	92.4	Very high	0 Å²	0	21.2 Å²	21.2	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-65.1	-37.2	173.1	-91.4	-80.4	0	0	0	112.4	Q844 L874 L875 A880 M881 W882 T926 L929	Q844-N878 PolarHBondContact NE2-OD1 3.42Å; Q844-N878 PolarHBondContact OE1-ND2 2.88Å; Q844-N878 VanDerWaalsContact OE1-ND2 3.11Å; Q844-N878 PolarHBondContact OE1-OD1 3.01Å; Q844-N878 VanDerWaalsContact OE1-OD1 3.13Å; L874-N878 WeakPolarHBondContact O-CB 3.39Å; L874-N878 PolarHBondContact O-N 3.33Å; L874-N878 PolarHBondContact O-ND2 3.41Å; L875-N878 PolarHBondContact O-N 3.2Å; N878-A880 VanDerWaalsContact C-N 3.32Å; N878-A880 PolarHBondContact O-N 3.03Å; N878-M881 HydrophobicContact CB-CE 4.25Å; N878-M881 PolarHBondContact O-N 3.39Å; N878-M881 WeakPolarHBondContact OD1-CE 3.41Å; N878-W882 WeakPolarHBondContact O-CB 3.22Å; N878-W882 PolarHBondContact O-N 2.86Å; N878-T926 WeakPolarHBondContact CB-OG1 3.39Å; N878-L929 HydrophobicContact CB-CD1 4.32Å; N878-L929 WeakPolarHBondContact ND2-CD1 3.36Å
879	L	93.4	Very high	92.2	Very high	63 Å²	63	20 Å²	20	33%	0.33	10%	0.1	S	C	.	.	H	α-helix	trans	-61.7	-40.7	171.5	-171	68.9	0	0	0	111.4	F730 L875 V876 L877 W882 F883	F730-L879 HydrophobicContact CE2-CD2 4.38Å; F730-L879 HydrophobicContact CE2-CG 4.16Å; L875-L879 PolarHBondContact O-N 3.34Å; V876-L879 WeakPolarHBondContact O-CB 3.45Å; V876-L879 PolarHBondContact O-N 3.05Å; L877-L879 VanDerWaalsContact C-N 3.32Å; L879-W882 HydrophobicContact CD1-CE3 3.73Å; L879-W882 HydrophobicContact CD1-CZ3 4.21Å; L879-W882 WeakPolarHBondContact O-CB 3.38Å; L879-W882 PolarHBondContact O-N 3.31Å; L879-F883 HydrophobicContact CD1-CD2 4.39Å; L879-F883 HydrophobicContact CD1-CE2 4.19Å; L879-F883 HydrophobicContact CG-CD2 4.22Å; L879-F883 HydrophobicContact CG-CE2 4.18Å; L879-F883 WeakPolarHBondContact O-CD2 3.32Å; L879-F883 PolarHBondContact O-N 3.3Å
880	A	95.5	Very high	91.8	Very high	0 Å²	0	20.6 Å²	20.6	0%	0	10%	0.099	C	C	.	.	H	α-helix	trans	-59.7	-49.9	174.9	0	0	0	0	0	112.3	L729 F730 T733 V876 L877 N878 W882 F883 V884	L729-A880 HydrophobicContact CD2-CB 4.16Å; F730-A880 HydrophobicContact CD2-CB 3.72Å; F730-A880 HydrophobicContact CE2-CB 4.44Å; T733-A880 HydrophobicContact CG2-CB 4.2Å; V876-A880 PolarHBondContact O-N 3.04Å; L877-A880 WeakPolarHBondContact O-CB 3.47Å; L877-A880 PolarHBondContact O-N 3.46Å; N878-A880 VanDerWaalsContact C-N 3.32Å; N878-A880 PolarHBondContact O-N 3.03Å; A880-W882 VanDerWaalsContact C-N 3.29Å; A880-W882 PolarHBondContact O-N 3.46Å; A880-F883 WeakPolarHBondContact O-CB 3.19Å; A880-F883 PolarHBondContact O-N 2.94Å; A880-V884 PolarHBondContact O-N 3.5Å; A880-V884 VanDerWaalsContact O-N 3.09Å
881	M	95	Very high	91.3	Very high	0 Å²	0	21.6 Å²	21.6	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-62.5	-36.6	176.7	-67.4	-178.8	-65.1	0	0	111.9	L764 L765 L877 N878 V884 N885	L764-M881 HydrophobicContact CB-CG 3.97Å; L764-M881 HydrophobicContact CB-SD 4.44Å; L764-M881 HydrophobicContact CD1-CG 4.25Å; L765-M881 HydrophobicContact CD2-SD 4.32Å; L877-M881 HydrophobicContact CG-CE 4.31Å; L877-M881 PolarHBondContact O-N 3.28Å; N878-M881 HydrophobicContact CB-CE 4.25Å; N878-M881 PolarHBondContact O-N 3.39Å; N878-M881 WeakPolarHBondContact OD1-CE 3.41Å; M881-V884 PolarHBondContact O-N 2.89Å; M881-N885 WeakPolarHBondContact O-CB 3.25Å; M881-N885 PolarHBondContact O-N 3.12Å; M881-N885 PolarHBondContact O-ND2 2.9Å
882	W	93.7	Very high	90.7	Very high	36 Å²	36	21.6 Å²	21.6	14%	0.136	10%	0.103	C	C	.	.	H	α-helix	trans	-62.5	-42.3	174.4	176.7	68.6	0	0	0	112	F481 N878 L879 A880 N885 T886 V919 R922	F481-W882 HydrophobicContact CE1-CH2 4.33Å; F481-W882 AromaticContact CE1-CZ2 3.9Å; F481-W882 HydrophobicContact CE1-CZ2 3.9Å; F481-W882 HydrophobicContact CZ-CH2 4.2Å; F481-W882 AromaticContact CZ-CZ2 3.59Å; F481-W882 HydrophobicContact CZ-CZ2 3.59Å; N878-W882 WeakPolarHBondContact O-CB 3.22Å; N878-W882 PolarHBondContact O-N 2.86Å; L879-W882 HydrophobicContact CD1-CE3 3.73Å; L879-W882 HydrophobicContact CD1-CZ3 4.21Å; L879-W882 WeakPolarHBondContact O-CB 3.38Å; L879-W882 PolarHBondContact O-N 3.31Å; A880-W882 VanDerWaalsContact C-N 3.29Å; A880-W882 PolarHBondContact O-N 3.46Å; W882-N885 PolarHBondContact O-N 3.45Å; W882-T886 WeakPolarHBondContact O-CB 3.28Å; W882-T886 PolarHBondContact O-N 3.24Å; W882-T886 PolarHBondContact O-OG1 3.31Å; W882-V919 VanDerWaalsContact CD1-O 3.3Å; W882-V919 VanDerWaalsContact NE1-CG1 3.25Å; W882-R922 HydrophobicContact CB-CB 3.83Å; W882-R922 HydrophobicContact CG-CB 4.29Å
883	F	91.5	Very high	90.1	Very high	56 Å²	56	21.2 Å²	21.2	25%	0.246	10%	0.1	C	C	.	.	H	α-helix	trans	-61.1	-49	175.1	-96.2	-98.3	0	0	0	112	F730 L734 M737 L879 A880 N885 T886 F887	F730-F883 HydrophobicContact CE2-CB 4.44Å; F730-F883 AromaticContact CE2-CD2 3.6Å; F730-F883 HydrophobicContact CE2-CD2 3.6Å; F730-F883 AromaticContact CE2-CE2 4Å; F730-F883 HydrophobicContact CE2-CE2 4Å; F730-F883 HydrophobicContact CE2-CG 4.05Å; F730-F883 HydrophobicContact CZ-CD1 4.5Å; F730-F883 AromaticContact CZ-CD2 3.71Å; F730-F883 HydrophobicContact CZ-CD2 3.71Å; F730-F883 HydrophobicContact CZ-CE1 4.46Å; F730-F883 AromaticContact CZ-CE2 3.66Å; F730-F883 HydrophobicContact CZ-CE2 3.66Å; F730-F883 HydrophobicContact CZ-CG 4.15Å; F730-F883 HydrophobicContact CZ-CZ 4.06Å; L734-F883 HydrophobicContact CD2-CD1 4.16Å; M737-F883 WeakPolarHBondContact CE-O 3.31Å; M737-F883 HydrophobicContact SD-CB 4.27Å; L879-F883 HydrophobicContact CD1-CD2 4.39Å; L879-F883 HydrophobicContact CD1-CE2 4.19Å; L879-F883 HydrophobicContact CG-CD2 4.22Å; L879-F883 HydrophobicContact CG-CE2 4.18Å; L879-F883 WeakPolarHBondContact O-CD2 3.32Å; L879-F883 PolarHBondContact O-N 3.3Å; A880-F883 WeakPolarHBondContact O-CB 3.19Å; A880-F883 PolarHBondContact O-N 2.94Å; F883-N885 VanDerWaalsContact C-N 3.32Å; F883-N885 PolarHBondContact O-N 3.48Å; F883-T886 PolarHBondContact O-N 3.36Å; F883-F887 HydrophobicContact CD1-CD2 4.21Å; F883-F887 AromaticContact CD1-CE2 3.81Å; F883-F887 HydrophobicContact CD1-CE2 3.81Å; F883-F887 HydrophobicContact CE1-CE2 4.14Å; F883-F887 VanDerWaalsContact O-CD2 3.26Å; F883-F887 WeakPolarHBondContact O-CD2 3.32Å; F883-F887 PolarHBondContact O-N 3.34Å
884	V	92.8	Very high	89.4	Confident	0 Å²	0	22.6 Å²	22.6	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-59.6	-46.1	178.1	178.5	0	0	0	0	110.7	M737 Y757 E761 L764 A880 M881 T886 F887 E888	M737-V884 HydrophobicContact CG-CG2 4.03Å; M737-V884 HydrophobicContact SD-CG2 3.87Å; Y757-V884 HydrophobicContact CD2-CG1 4.07Å; Y757-V884 HydrophobicContact CE2-CG1 3.62Å; E761-V884 HydrophobicContact CG-CG1 4.04Å; E761-V884 WeakPolarHBondContact OE1-CB 3.3Å; E761-V884 WeakPolarHBondContact OE1-CG1 3.4Å; L764-V884 HydrophobicContact CD1-CG2 4.12Å; A880-V884 PolarHBondContact O-N 3.5Å; A880-V884 VanDerWaalsContact O-N 3.09Å; M881-V884 PolarHBondContact O-N 2.89Å; V884-T886 VanDerWaalsContact C-N 3.31Å; V884-T886 PolarHBondContact O-N 2.9Å; V884-F887 PolarHBondContact O-N 2.99Å; V884-E888 HydrophobicContact CG1-CB 4.33Å; V884-E888 PolarHBondContact O-N 3.37Å
885	N	90.5	Very high	88.9	Confident	5 Å²	5	23.9 Å²	23.9	3%	0.027	11%	0.114	C	C	.	.	H	α-helix	trans	-63.9	-33.7	-179.7	-79.6	-27.8	0	0	0	114.2	M881 W882 F883 V889 I918 R922	M881-N885 WeakPolarHBondContact O-CB 3.25Å; M881-N885 PolarHBondContact O-N 3.12Å; M881-N885 PolarHBondContact O-ND2 2.9Å; W882-N885 PolarHBondContact O-N 3.45Å; F883-N885 VanDerWaalsContact C-N 3.32Å; F883-N885 PolarHBondContact O-N 3.48Å; N885-V889 VanDerWaalsContact CA-CG2 3.49Å; N885-V889 HydrophobicContact CB-CG2 4.11Å; N885-V889 WeakPolarHBondContact O-CG2 3.45Å; N885-V889 WeakPolarHBondContact OD1-CG2 3.47Å; N885-I918 HydrophobicContact CB-CG2 4.23Å; N885-R922 PolarHBondContact ND2-NE 3.48Å
886	T	87.9	Confident	88.5	Confident	27 Å²	27	25.7 Å²	25.7	17%	0.166	13%	0.129	C	C	.	.	H	α-helix	trans	-71.2	-37.7	-179.7	-57.3	0	0	0	0	112.3	P670 W882 F883 V884	P670-T886 HydrophobicContact CB-CG2 4.17Å; W882-T886 WeakPolarHBondContact O-CB 3.28Å; W882-T886 PolarHBondContact O-N 3.24Å; W882-T886 PolarHBondContact O-OG1 3.31Å; F883-T886 PolarHBondContact O-N 3.36Å; V884-T886 VanDerWaalsContact C-N 3.31Å; V884-T886 PolarHBondContact O-N 2.9Å
887	F	85.6	Confident	88.1	Confident	68 Å²	68	26 Å²	26	30%	0.298	13%	0.13	S	C	.	.	H	α-helix	trans	-107.9	-32.7	-168.2	-65.4	-68.4	0	0	0	114.4	Y667 M737 F741 F883 V884 H891	Y667-F887 HydrophobicContact CD1-CD1 4.36Å; Y667-F887 HydrophobicContact CD1-CE1 4.48Å; M737-F887 HydrophobicContact CE-CB 3.66Å; M737-F887 HydrophobicContact CE-CD2 3.92Å; M737-F887 HydrophobicContact CE-CG 4.22Å; F741-F887 HydrophobicContact CE2-CB 4.29Å; F741-F887 HydrophobicContact CZ-CB 4.1Å; F741-F887 WeakPolarHBondContact CZ-O 3.43Å; F883-F887 HydrophobicContact CD1-CD2 4.21Å; F883-F887 AromaticContact CD1-CE2 3.81Å; F883-F887 HydrophobicContact CD1-CE2 3.81Å; F883-F887 HydrophobicContact CE1-CE2 4.14Å; F883-F887 VanDerWaalsContact O-CD2 3.26Å; F883-F887 WeakPolarHBondContact O-CD2 3.32Å; F883-F887 PolarHBondContact O-N 3.34Å; V884-F887 PolarHBondContact O-N 2.99Å; F887-H891 PolarHBondContact O-ND1 3.1Å
888	E	86.7	Confident	87.8	Confident	2 Å²	2	26 Å²	26	1%	0.009	13%	0.13	C	C	.	.	T	Hydrogen-bonded Turn	trans	-103.4	-32.8	-168.1	-59.9	-164.3	148.3	0	0	114.6	M737 F740 F741 Y757 V884 K890 H891 A892	M737-E888 WeakPolarHBondContact CA-OE1 3.4Å; M737-E888 WeakPolarHBondContact CB-OE1 3.17Å; M737-E888 HydrophobicContact CE-CG 3.9Å; M737-E888 HydrophobicContact CG-CG 4.38Å; M737-E888 WeakPolarHBondContact CG-OE1 3.36Å; F740-E888 VanDerWaalsContact CB-OE1 3.31Å; F740-E888 WeakPolarHBondContact CB-OE1 3.39Å; F740-E888 HydrophobicContact CD1-CB 4.21Å; F740-E888 VanDerWaalsContact CD1-CD 3.49Å; F740-E888 HydrophobicContact CD1-CG 3.75Å; F740-E888 WeakPolarHBondContact CD1-OE1 3.29Å; F740-E888 HydrophobicContact CE1-CB 3.99Å; F740-E888 HydrophobicContact CE1-CG 3.97Å; F740-E888 WeakPolarHBondContact CG-OE1 3.48Å; F741-E888 HydrophobicContact CE2-CG 4.12Å; F741-E888 HydrophobicContact CZ-CG 4.26Å; Y757-E888 HydrophobicContact CD2-CB 3.72Å; Y757-E888 VanDerWaalsContact CD2-OE2 3.3Å; Y757-E888 WeakPolarHBondContact CD2-OE2 3.26Å; Y757-E888 HydrophobicContact CE2-CB 3.64Å; V884-E888 HydrophobicContact CG1-CB 4.33Å; V884-E888 PolarHBondContact O-N 3.37Å; E888-K890 VanDerWaalsContact C-N 3.31Å; E888-K890 PolarHBondContact O-N 3.45Å; E888-H891 PolarHBondContact O-N 3.49Å; E888-A892 PolarHBondContact O-N 3.08Å
889	V	84.7	Confident	87.4	Confident	1 Å²	1	27.6 Å²	27.6	1%	0.006	14%	0.138	C	C	.	.	H	α-helix	trans	-54.4	-47	-171.1	-179.1	0	0	0	0	111.5	Y757 Y808 N885 H891 A892 D893 L915	Y757-V889 VanDerWaalsContact OH-CG2 3.24Å; Y757-V889 WeakPolarHBondContact OH-CG2 3.36Å; Y808-V889 HydrophobicContact CE1-CG1 4.18Å; N885-V889 VanDerWaalsContact CA-CG2 3.49Å; N885-V889 HydrophobicContact CB-CG2 4.11Å; N885-V889 WeakPolarHBondContact O-CG2 3.45Å; N885-V889 WeakPolarHBondContact OD1-CG2 3.47Å; V889-H891 PolarHBondContact O-N 3.15Å; V889-A892 PolarHBondContact O-N 3.08Å; V889-D893 HydrophobicContact CG1-CB 4.46Å; V889-D893 WeakPolarHBondContact CG1-OD2 3.48Å; V889-D893 WeakPolarHBondContact O-CB 3.5Å; V889-D893 PolarHBondContact O-N 3.4Å; V889-L915 HydrophobicContact CB-CD2 3.74Å; V889-L915 HydrophobicContact CG1-CD2 3.31Å
890	K	81.8	Confident	87	Confident	49 Å²	49	30.2 Å²	30.2	21%	0.213	15%	0.153	C	C	.	.	H	α-helix	trans	-56.1	-37.5	179.1	-172.9	175	-172.9	166.9	0	112.6	E567 E571 E888 N894 H912 L915	E567-K890 IonicContact OE1-NZ 3.69Å; E567-K890 PolarHBondContact OE1-NZ 3.18Å; E571-K890 VanDerWaalsContact OE1-CE 3.24Å; E571-K890 WeakPolarHBondContact OE1-CE 3.43Å; E888-K890 VanDerWaalsContact C-N 3.31Å; E888-K890 PolarHBondContact O-N 3.45Å; K890-N894 WeakPolarHBondContact O-CB 3.18Å; K890-H912 PolarHBondContact NZ-NE2 3.46Å; K890-L915 HydrophobicContact CB-CD1 4.18Å; K890-L915 HydrophobicContact CG-CD1 4.45Å
891	H	81.9	Confident	86.6	Confident	78 Å²	78	31.3 Å²	31.3	36%	0.361	16%	0.157	S	C	.	.	H	α-helix	trans	-83.8	-40.6	-177.5	-63.6	88.3	0	0	0	112.3	F740 F887 E888 V889	F740-H891 HydrophobicContact CE1-CB 3.94Å; F740-H891 HydrophobicContact CZ-CB 3.79Å; F887-H891 PolarHBondContact O-ND1 3.1Å; E888-H891 PolarHBondContact O-N 3.49Å; V889-H891 PolarHBondContact O-N 3.15Å
892	A	79.8	Confident	86.3	Confident	0 Å²	0	31.3 Å²	31.3	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-76.6	-43.1	-174.4	0	0	0	0	0	112.3	F740 Y757 Y830 E888 V889 N894	F740-A892 HydrophobicContact CE2-CB 3.97Å; F740-A892 HydrophobicContact CZ-CB 3.91Å; Y757-A892 HydrophobicContact CD1-CB 3.21Å; Y757-A892 HydrophobicContact CD2-CB 4.11Å; Y757-A892 HydrophobicContact CE1-CB 3.32Å; Y757-A892 HydrophobicContact CE2-CB 4.21Å; Y757-A892 HydrophobicContact CG-CB 3.61Å; Y830-A892 PolarHBondContact OH-O 3.26Å; E888-A892 PolarHBondContact O-N 3.08Å; V889-A892 PolarHBondContact O-N 3.08Å; A892-N894 VanDerWaalsContact C-N 3.29Å; A892-N894 PolarHBondContact O-N 3.31Å
893	D	80.5	Confident	85.9	Confident	1 Å²	1	31.8 Å²	31.8	1%	0.005	17%	0.166	C	C	.	.	S	Bend	trans	-84.3	-4.7	-173.8	-66.5	-3.3	0	0	0	112.6	Y808 V889 H895 W907	Y808-D893 WeakPolarHBondContact CE1-OD2 3.41Å; Y808-D893 WeakPolarHBondContact OH-CB 3.49Å; Y808-D893 PolarHBondContact OH-OD2 3.21Å; V889-D893 HydrophobicContact CG1-CB 4.46Å; V889-D893 WeakPolarHBondContact CG1-OD2 3.48Å; V889-D893 WeakPolarHBondContact O-CB 3.5Å; V889-D893 PolarHBondContact O-N 3.4Å; D893-H895 PolarHBondContact O-N 3.43Å; D893-W907 HydrophobicContact CB-CZ2 4.3Å; D893-W907 WeakPolarHBondContact O-CZ2 3.43Å; D893-W907 PolarHBondContact O-NE1 2.98Å; D893-W907 VanDerWaalsContact O-NE1 3.14Å
894	N	81.1	Confident	85.5	Confident	49 Å²	49	30.8 Å²	30.8	26%	0.262	17%	0.165	S	C	.	.			trans	-75.6	50.3	167.9	-159.1	12.6	0	0	0	111.8	H574 K890 A892 I899	H574-N894 PolarHBondContact CE1-ND2 3.29Å; H574-N894 PolarHBondContact NE2-ND2 3.14Å; H574-N894 PolarHBondContact NE2-OD1 3.2Å; K890-N894 WeakPolarHBondContact O-CB 3.18Å; A892-N894 VanDerWaalsContact C-N 3.29Å; A892-N894 PolarHBondContact O-N 3.31Å; N894-I899 VanDerWaalsContact OD1-CD1 3.32Å; N894-I899 WeakPolarHBondContact OD1-CD1 3.38Å
895	H	84.8	Confident	85	Confident	26 Å²	26	36.1 Å²	36.1	12%	0.12	19%	0.192	C	C	.	.			trans	-95.4	150.5	-176.5	-165.1	64.5	0	0	0	111.4	I754 Y830 D893 I897 H898 I899	I754-H895 VanDerWaalsContact CD1-ND1 3.3Å; I754-H895 WeakPolarHBondContact CD1-ND1 3.46Å; Y830-H895 HydrophobicContact CE2-CB 4.22Å; Y830-H895 AromaticContact CE2-CD2 3.81Å; Y830-H895 WeakPolarHBondContact OH-CB 3.32Å; D893-H895 PolarHBondContact O-N 3.43Å; H895-I897 PolarHBondContact O-N 2.83Å; H895-I897 VanDerWaalsContact O-N 3.09Å; H895-H898 PolarHBondContact O-N 3.49Å; H895-H898 VanDerWaalsContact O-N 3.16Å; H895-I899 PolarHBondContact O-N 3.46Å
896	S	84.6	Confident	84.9	Confident	63 Å²	63	36.3 Å²	36.3	44%	0.441	19%	0.194	S	C	.	.	H	α-helix	trans	-60.4	-26.4	-174.1	58.1	0	0	0	0	113.8	H898 N900	S896-H898 VanDerWaalsContact C-N 3.33Å; S896-H898 PolarHBondContact O-N 3.31Å; S896-N900 WeakPolarHBondContact O-CB 3.36Å; S896-N900 PolarHBondContact O-N 3.4Å; S896-N900 PolarHBondContact O-ND2 3.16Å; S896-N900 VanDerWaalsContact O-ND2 3.12Å
897	I	86.5	Confident	84.9	Confident	23 Å²	23	35.1 Å²	35.1	12%	0.118	19%	0.186	C	C	.	.	H	α-helix	trans	-57.3	-45.3	177.3	-64.3	172.9	0	0	0	111.2	P815 A819 V824 A826 A827 Y830 H895 Y901	P815-I897 HydrophobicContact CB-CG2 4.25Å; A819-I897 HydrophobicContact CB-CD1 4.47Å; A819-I897 HydrophobicContact CB-CG2 3.83Å; V824-I897 HydrophobicContact CG1-CD1 4.32Å; A826-I897 HydrophobicContact CB-CD1 4.4Å; A827-I897 HydrophobicContact CB-CD1 4.05Å; Y830-I897 HydrophobicContact CD2-CD1 4.48Å; H895-I897 PolarHBondContact O-N 2.83Å; H895-I897 VanDerWaalsContact O-N 3.09Å; I897-Y901 WeakPolarHBondContact O-CB 3.42Å; I897-Y901 PolarHBondContact O-N 3.24Å
898	H	89.6	Confident	84.8	Confident	0 Å²	0	32.5 Å²	32.5	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-78.9	-41.4	-177.2	-54.9	-66	0	0	0	111.8	L812 Y830 H895 S896 N900 Y901 Y902 W907	L812-H898 WeakPolarHBondContact CD1-CE1 3.34Å; L812-H898 WeakPolarHBondContact CD1-NE2 3.31Å; L812-H898 PolarHBondContact O-CE1 3.14Å; Y830-H898 AromaticContact CD1-NE2 3.78Å; Y830-H898 AromaticContact CE1-NE2 3.88Å; Y830-H898 AromaticContact CG-NE2 3.96Å; H895-H898 PolarHBondContact O-N 3.49Å; H895-H898 VanDerWaalsContact O-N 3.16Å; S896-H898 VanDerWaalsContact C-N 3.33Å; S896-H898 PolarHBondContact O-N 3.31Å; H898-N900 PolarHBondContact O-N 2.82Å; H898-Y901 PolarHBondContact O-N 3.43Å; H898-Y901 VanDerWaalsContact O-N 3.14Å; H898-Y902 PolarHBondContact O-N 3.03Å; H898-W907 HydrophobicContact CB-CD2 3.63Å; H898-W907 HydrophobicContact CB-CE3 3.91Å; H898-W907 HydrophobicContact CB-CG 4.18Å; H898-W907 HydrophobicContact CB-CH2 4.04Å; H898-W907 HydrophobicContact CB-CZ2 3.75Å; H898-W907 HydrophobicContact CB-CZ3 4.11Å; H898-W907 AromaticContact CD2-CZ2 3.95Å; H898-W907 AromaticContact CG-CH2 3.89Å; H898-W907 AromaticContact CG-CZ2 3.75Å
899	I	86.9	Confident	84.8	Confident	33 Å²	33	35.7 Å²	35.7	17%	0.169	19%	0.191	C	C	.	.	H	α-helix	trans	-61.2	-44	177.3	-60.8	172.8	0	0	0	111.1	N894 H895 Y901 S903	N894-I899 VanDerWaalsContact OD1-CD1 3.32Å; N894-I899 WeakPolarHBondContact OD1-CD1 3.38Å; H895-I899 PolarHBondContact O-N 3.46Å; I899-Y901 PolarHBondContact O-N 2.91Å; I899-S903 CarbonylContact O-C 3.59Å; I899-S903 WeakPolarHBondContact O-CA 3.29Å; I899-S903 PolarHBondContact O-N 3.41Å
900	N	85.6	Confident	85	Confident	117 Å²	117	36.1 Å²	36.1	63%	0.626	19%	0.194	S	C	*	.	H	α-helix	trans	-66.9	-27.2	178.6	-69.6	-17.8	0	0	0	112.2	S896 H898	S896-N900 WeakPolarHBondContact O-CB 3.36Å; S896-N900 PolarHBondContact O-N 3.4Å; S896-N900 PolarHBondContact O-ND2 3.16Å; S896-N900 VanDerWaalsContact O-ND2 3.12Å; H898-N900 PolarHBondContact O-N 2.82Å
901	Y	87.4	Confident	85.3	Confident	23 Å²	23	34.4 Å²	34.4	9%	0.09	19%	0.187	C	C	.	.	H	α-helix	trans	-79.7	-52	179.5	-167.8	-90.5	0	0	0	112.3	R48 V49 V814 P815 E818 I897 H898 I899	R48-Y901 CarbonylContact C-O 3.59Å; R48-Y901 WeakPolarHBondContact CA-O 3.43Å; R48-Y901 HydrophobicContact CB-CE1 4.15Å; R48-Y901 HydrophobicContact CG-CD2 4.39Å; R48-Y901 HydrophobicContact CG-CE1 4.24Å; R48-Y901 HydrophobicContact CG-CE2 3.88Å; V49-Y901 PolarHBondContact N-O 3.17Å; V814-Y901 HydrophobicContact CG1-CE1 4.4Å; P815-Y901 HydrophobicContact CB-CD1 4.22Å; P815-Y901 HydrophobicContact CB-CD2 4.11Å; P815-Y901 HydrophobicContact CB-CG 3.78Å; P815-Y901 HydrophobicContact CG-CD1 3.72Å; P815-Y901 HydrophobicContact CG-CD2 4.45Å; P815-Y901 HydrophobicContact CG-CE1 4.26Å; P815-Y901 HydrophobicContact CG-CG 3.81Å; E818-Y901 VanDerWaalsContact CD-CE2 3.41Å; E818-Y901 HydrophobicContact CG-CE2 4.34Å; E818-Y901 WeakPolarHBondContact OE1-CE2 3.4Å; E818-Y901 PolarHBondContact OE1-OH 3.39Å; E818-Y901 WeakPolarHBondContact OE2-CE2 3.38Å; I897-Y901 WeakPolarHBondContact O-CB 3.42Å; I897-Y901 PolarHBondContact O-N 3.24Å; H898-Y901 PolarHBondContact O-N 3.43Å; H898-Y901 VanDerWaalsContact O-N 3.14Å; I899-Y901 PolarHBondContact O-N 2.91Å
902	Y	88.5	Confident	85.4	Confident	1 Å²	1	30.9 Å²	30.9	0%	0.004	17%	0.171	C	C	.	.	H	α-helix	trans	-96.4	-15.5	-171.9	-67.4	-59.1	0	0	0	115.4	C44 F47 F811 P815 H898 A906 W907 I910	C44-Y902 HydrophobicContact CB-CE1 4.28Å; C44-Y902 PolarHBondContact SG-OH 3.4Å; F47-Y902 HydrophobicContact CB-CD1 3.69Å; F47-Y902 HydrophobicContact CB-CE1 4.39Å; F47-Y902 WeakPolarHBondContact O-CA 3.21Å; F811-Y902 HydrophobicContact CD1-CE1 4.02Å; F811-Y902 HydrophobicContact CD1-CE2 4.04Å; F811-Y902 AromaticContact CD1-CZ 3.58Å; F811-Y902 WeakPolarHBondContact CD1-OH 3.41Å; F811-Y902 HydrophobicContact CE1-CE1 4.25Å; F811-Y902 WeakPolarHBondContact O-CE2 3.33Å; F811-Y902 PolarHBondContact O-OH 3.04Å; P815-Y902 HydrophobicContact CG-CD2 4.24Å; P815-Y902 HydrophobicContact CG-CE2 3.38Å; H898-Y902 PolarHBondContact O-N 3.03Å; Y902-A906 VanDerWaalsContact O-CB 3.26Å; Y902-A906 WeakPolarHBondContact O-CB 3.26Å; Y902-W907 AromaticContact CD2-CE3 3.76Å; Y902-W907 HydrophobicContact CD2-CE3 3.76Å; Y902-W907 HydrophobicContact CD2-CZ3 4.28Å; Y902-W907 HydrophobicContact CE2-CE3 4.16Å; Y902-W907 HydrophobicContact CE2-CZ3 4.21Å; Y902-I910 HydrophobicContact CD2-CD1 4.45Å; Y902-I910 HydrophobicContact CG-CD1 4.35Å
903	S	85.9	Confident	85.7	Confident	46 Å²	46	34.5 Å²	34.5	32%	0.322	19%	0.189	S	C	.	.			trans	82.4	155.6	-155.8	81.6	0	0	0	0	113.3	I899 M905 A906 W907	I899-S903 CarbonylContact O-C 3.59Å; I899-S903 WeakPolarHBondContact O-CA 3.29Å; I899-S903 PolarHBondContact O-N 3.41Å; S903-M905 PolarHBondContact O-N 3.39Å; S903-A906 PolarHBondContact OG-N 3.45Å; S903-W907 WeakPolarHBondContact O-CB 3.49Å; S903-W907 PolarHBondContact O-N 2.71Å; S903-W907 VanDerWaalsContact O-N 3.1Å
904	S	82.3	Confident	86.1	Confident	34 Å²	34	34.4 Å²	34.4	24%	0.238	19%	0.189	C	C	.	.	H	α-helix	trans	-60.1	-45.4	178.8	-178.3	0	0	0	0	112.5	H574 K908	H574-S904 PolarHBondContact CD2-OG 3.09Å; S904-K908 VanDerWaalsContact O-CG 3.32Å; S904-K908 WeakPolarHBondContact O-CG 3.39Å; S904-K908 PolarHBondContact O-N 3.32Å
905	M	82.8	Confident	86.4	Confident	113 Å²	113	33 Å²	33	56%	0.557	18%	0.181	S	C	*	.	H	α-helix	trans	-68.3	-44.5	-177	-170	65.4	-168.3	0	0	112	S903 K908 I909	S903-M905 PolarHBondContact O-N 3.39Å; M905-K908 PolarHBondContact O-N 3.48Å; M905-I909 HydrophobicContact CE-CD1 3.97Å; M905-I909 HydrophobicContact CE-CG1 4.12Å; M905-I909 HydrophobicContact CG-CD1 4.13Å; M905-I909 WeakPolarHBondContact O-CG1 3.48Å; M905-I909 PolarHBondContact O-N 3.23Å
906	A	87.3	Confident	86.5	Confident	8 Å²	8	32.1 Å²	32.1	7%	0.066	18%	0.178	C	C	.	.	H	α-helix	trans	-65.2	-43.1	180	0	0	0	0	0	111.5	F47 Y902 S903 K908 I909 I910	F47-A906 HydrophobicContact CD1-CB 3.95Å; F47-A906 HydrophobicContact CE1-CB 4.36Å; F47-A906 HydrophobicContact CG-CB 4.38Å; Y902-A906 VanDerWaalsContact O-CB 3.26Å; Y902-A906 WeakPolarHBondContact O-CB 3.26Å; S903-A906 PolarHBondContact OG-N 3.45Å; A906-K908 PolarHBondContact O-N 3.34Å; A906-I909 PolarHBondContact O-N 3.14Å; A906-I910 WeakPolarHBondContact O-CD1 3.45Å; A906-I910 VanDerWaalsContact O-CG1 3.25Å; A906-I910 WeakPolarHBondContact O-CG1 3.47Å; A906-I910 PolarHBondContact O-N 3.06Å
907	W	89.4	Confident	86.7	Confident	2 Å²	2	30.7 Å²	30.7	1%	0.008	17%	0.165	C	C	.	.	H	α-helix	trans	-60.6	-44.2	176	-175.5	-121.1	0	0	0	111.8	Y808 F811 L812 D893 H898 Y902 S903 I909 I910 T911	Y808-W907 HydrophobicContact CE2-CH2 4.23Å; F811-W907 HydrophobicContact CB-CZ3 4.33Å; L812-W907 HydrophobicContact CD1-CH2 3.99Å; L812-W907 HydrophobicContact CD1-CZ2 4.37Å; D893-W907 HydrophobicContact CB-CZ2 4.3Å; D893-W907 WeakPolarHBondContact O-CZ2 3.43Å; D893-W907 PolarHBondContact O-NE1 2.98Å; D893-W907 VanDerWaalsContact O-NE1 3.14Å; H898-W907 HydrophobicContact CB-CD2 3.63Å; H898-W907 HydrophobicContact CB-CE3 3.91Å; H898-W907 HydrophobicContact CB-CG 4.18Å; H898-W907 HydrophobicContact CB-CH2 4.04Å; H898-W907 HydrophobicContact CB-CZ2 3.75Å; H898-W907 HydrophobicContact CB-CZ3 4.11Å; H898-W907 AromaticContact CD2-CZ2 3.95Å; H898-W907 AromaticContact CG-CH2 3.89Å; H898-W907 AromaticContact CG-CZ2 3.75Å; Y902-W907 AromaticContact CD2-CE3 3.76Å; Y902-W907 HydrophobicContact CD2-CE3 3.76Å; Y902-W907 HydrophobicContact CD2-CZ3 4.28Å; Y902-W907 HydrophobicContact CE2-CE3 4.16Å; Y902-W907 HydrophobicContact CE2-CZ3 4.21Å; S903-W907 WeakPolarHBondContact O-CB 3.49Å; S903-W907 PolarHBondContact O-N 2.71Å; S903-W907 VanDerWaalsContact O-N 3.1Å; W907-I909 PolarHBondContact O-N 2.96Å; W907-I910 HydrophobicContact CE3-CG2 4.41Å; W907-I910 HydrophobicContact CZ3-CG2 4.27Å; W907-I910 PolarHBondContact O-N 3.11Å; W907-T911 HydrophobicContact CD2-CG2 3.79Å; W907-T911 HydrophobicContact CE3-CG2 4.29Å; W907-T911 HydrophobicContact CG-CG2 4.26Å; W907-T911 HydrophobicContact CH2-CG2 4.13Å; W907-T911 HydrophobicContact CZ2-CG2 3.6Å; W907-T911 HydrophobicContact CZ3-CG2 4.45Å; W907-T911 VanDerWaalsContact O-CG2 3.3Å; W907-T911 WeakPolarHBondContact O-CG2 3.39Å; W907-T911 PolarHBondContact O-N 3.37Å; W907-T911 PolarHBondContact O-OG1 3Å; W907-T911 VanDerWaalsContact O-OG1 3.09Å
908	K	83.6	Confident	86.9	Confident	14 Å²	14	29.7 Å²	29.7	6%	0.061	16%	0.16	C	C	.	.	H	α-helix	trans	-57.6	-45.4	174.7	-76.5	-174	178.8	-147.9	0	112.6	E571 P572 H574 S904 M905 A906 T911 H912	E571-K908 PolarHBondContact O-NZ 3.11Å; E571-K908 VanDerWaalsContact OE2-CD 3.31Å; E571-K908 WeakPolarHBondContact OE2-CD 3.37Å; E571-K908 WeakPolarHBondContact OE2-CE 3.44Å; E571-K908 IonicContact OE2-NZ 2.74Å; E571-K908 PolarHBondContact OE2-NZ 3.02Å; E571-K908 VanDerWaalsContact OE2-NZ 3.16Å; P572-K908 PolarHBondContact O-NZ 3.48Å; H574-K908 WeakPolarHBondContact CD2-CE 3.46Å; S904-K908 VanDerWaalsContact O-CG 3.32Å; S904-K908 WeakPolarHBondContact O-CG 3.39Å; S904-K908 PolarHBondContact O-N 3.32Å; M905-K908 PolarHBondContact O-N 3.48Å; A906-K908 PolarHBondContact O-N 3.34Å; K908-T911 PolarHBondContact O-OG1 2.89Å; K908-H912 WeakPolarHBondContact O-CB 3.39Å; K908-H912 PolarHBondContact O-N 3.16Å; K908-H912 PolarHBondContact O-ND1 2.77Å
909	I	85.2	Confident	87	Confident	68 Å²	68	30.2 Å²	30.2	35%	0.349	16%	0.163	S	C	.	.	H	α-helix	trans	-62.9	-47	178.4	-67.1	165.8	0	0	0	110.4	M905 A906 W907 T911 H912 I913	M905-I909 HydrophobicContact CE-CD1 3.97Å; M905-I909 HydrophobicContact CE-CG1 4.12Å; M905-I909 HydrophobicContact CG-CD1 4.13Å; M905-I909 WeakPolarHBondContact O-CG1 3.48Å; M905-I909 PolarHBondContact O-N 3.23Å; A906-I909 PolarHBondContact O-N 3.14Å; W907-I909 PolarHBondContact O-N 2.96Å; I909-T911 PolarHBondContact O-N 3.14Å; I909-H912 PolarHBondContact O-N 3.41Å; I909-I913 HydrophobicContact CG2-CD1 3.71Å; I909-I913 WeakPolarHBondContact O-CG1 3.01Å; I909-I913 PolarHBondContact O-N 3.36Å; I909-I913 VanDerWaalsContact O-N 3.11Å
910	I	88.8	Confident	87.1	Confident	11 Å²	11	29.1 Å²	29.1	6%	0.056	16%	0.157	C	C	.	.	H	α-helix	trans	-59.6	-49	-179.8	-69.2	160.6	0	0	0	110.5	F807 F811 Y902 A906 W907 A914	F807-I910 HydrophobicContact CE1-CG2 4.37Å; F811-I910 HydrophobicContact CB-CG2 3.94Å; F811-I910 HydrophobicContact CD1-CD1 3.64Å; F811-I910 HydrophobicContact CD1-CG1 4.38Å; F811-I910 HydrophobicContact CD1-CG2 4.22Å; F811-I910 HydrophobicContact CD2-CG2 3.86Å; F811-I910 HydrophobicContact CE1-CD1 3.64Å; F811-I910 HydrophobicContact CE1-CG1 4.29Å; F811-I910 HydrophobicContact CE2-CG2 4.48Å; F811-I910 HydrophobicContact CG-CD1 4.29Å; F811-I910 HydrophobicContact CG-CG2 3.75Å; F811-I910 HydrophobicContact CZ-CD1 4.3Å; F811-I910 HydrophobicContact CZ-CG1 4.49Å; Y902-I910 HydrophobicContact CD2-CD1 4.45Å; Y902-I910 HydrophobicContact CG-CD1 4.35Å; A906-I910 WeakPolarHBondContact O-CD1 3.45Å; A906-I910 VanDerWaalsContact O-CG1 3.25Å; A906-I910 WeakPolarHBondContact O-CG1 3.47Å; A906-I910 PolarHBondContact O-N 3.06Å; W907-I910 HydrophobicContact CE3-CG2 4.41Å; W907-I910 HydrophobicContact CZ3-CG2 4.27Å; W907-I910 PolarHBondContact O-N 3.11Å; I910-A914 VanDerWaalsContact O-CB 3.27Å; I910-A914 WeakPolarHBondContact O-CB 3.46Å; I910-A914 PolarHBondContact O-N 3.46Å; I910-A914 VanDerWaalsContact O-N 3.12Å
911	T	88.2	Confident	87.5	Confident	13 Å²	13	23.5 Å²	23.5	8%	0.08	13%	0.127	C	C	.	.	H	α-helix	trans	-63.6	-47.6	-179.1	56.2	0	0	0	0	111.3	Y808 W907 K908 I909 I913 A914 L915	Y808-T911 HydrophobicContact CE2-CG2 4.08Å; W907-T911 HydrophobicContact CD2-CG2 3.79Å; W907-T911 HydrophobicContact CE3-CG2 4.29Å; W907-T911 HydrophobicContact CG-CG2 4.26Å; W907-T911 HydrophobicContact CH2-CG2 4.13Å; W907-T911 HydrophobicContact CZ2-CG2 3.6Å; W907-T911 HydrophobicContact CZ3-CG2 4.45Å; W907-T911 VanDerWaalsContact O-CG2 3.3Å; W907-T911 WeakPolarHBondContact O-CG2 3.39Å; W907-T911 PolarHBondContact O-N 3.37Å; W907-T911 PolarHBondContact O-OG1 3Å; W907-T911 VanDerWaalsContact O-OG1 3.09Å; K908-T911 PolarHBondContact O-OG1 2.89Å; I909-T911 PolarHBondContact O-N 3.14Å; T911-I913 VanDerWaalsContact C-N 3.33Å; T911-I913 PolarHBondContact O-N 3.38Å; T911-A914 PolarHBondContact O-N 2.86Å; T911-L915 WeakPolarHBondContact O-CB 3.4Å; T911-L915 WeakPolarHBondContact O-CG 3.47Å; T911-L915 PolarHBondContact O-N 3.26Å
912	H	84.7	Confident	87.8	Confident	3 Å²	3	22.4 Å²	22.4	1%	0.014	12%	0.123	C	C	.	.	H	α-helix	trans	-69.1	-27.8	-176.1	-73.5	76.6	0	0	0	113.9	I564 E567 I568 E571 K890 K908 I909 P916	I564-H912 HydrophobicContact CG2-CB 4.46Å; E567-H912 IonicContact OE1-CD2 3.56Å; E567-H912 IonicContact OE1-NE2 2.92Å; I568-H912 HydrophobicContact CD1-CB 3.72Å; I568-H912 HydrophobicContact CG1-CB 3.41Å; I568-H912 VanDerWaalsContact CG1-CB 3.41Å; I568-H912 VanDerWaalsContact CG1-CG 3.4Å; E571-H912 IonicContact OE2-CE1 3.96Å; E571-H912 PolarHBondContact OE2-CE1 3.4Å; K890-H912 PolarHBondContact NZ-NE2 3.46Å; K908-H912 WeakPolarHBondContact O-CB 3.39Å; K908-H912 PolarHBondContact O-N 3.16Å; K908-H912 PolarHBondContact O-ND1 2.77Å; I909-H912 PolarHBondContact O-N 3.41Å; H912-P916 WeakPolarHBondContact O-CD 3.47Å; H912-P916 WeakPolarHBondContact O-CG 3.48Å
913	I	85.4	Confident	88	Confident	76 Å²	76	23.7 Å²	23.7	39%	0.39	13%	0.128	S	C	.	.	H	α-helix	trans	-74	-39.5	172.4	-68.6	171.9	0	0	0	110.8	I909 T911	I909-I913 HydrophobicContact CG2-CD1 3.71Å; I909-I913 WeakPolarHBondContact O-CG1 3.01Å; I909-I913 PolarHBondContact O-N 3.36Å; I909-I913 VanDerWaalsContact O-N 3.11Å; T911-I913 VanDerWaalsContact C-N 3.33Å; T911-I913 PolarHBondContact O-N 3.38Å
914	A	90.2	Very high	88.3	Confident	0 Å²	0	21.5 Å²	21.5	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-81.5	-41.7	-172.2	0	0	0	0	0	114.1	F807 Y808 I910 T911 L917 I918	F807-A914 HydrophobicContact CD1-CB 4.19Å; F807-A914 HydrophobicContact CE1-CB 4.43Å; Y808-A914 HydrophobicContact CD2-CB 3.52Å; Y808-A914 HydrophobicContact CE2-CB 4.44Å; Y808-A914 HydrophobicContact CG-CB 4.05Å; I910-A914 VanDerWaalsContact O-CB 3.27Å; I910-A914 WeakPolarHBondContact O-CB 3.46Å; I910-A914 PolarHBondContact O-N 3.46Å; I910-A914 VanDerWaalsContact O-N 3.12Å; T911-A914 PolarHBondContact O-N 2.86Å; A914-L917 PolarHBondContact O-N 3.35Å; A914-I918 HydrophobicContact CB-CD1 4.41Å; A914-I918 WeakPolarHBondContact O-CG1 3.38Å; A914-I918 PolarHBondContact O-N 3.35Å; A914-I918 VanDerWaalsContact O-N 3.08Å
915	L	87.5	Confident	88.8	Confident	19 Å²	19	19.9 Å²	19.9	10%	0.099	10%	0.102	C	C	.	.	H	α-helix	trans	-52	-46.1	-175.4	-72.6	168.7	0	0	0	113.5	V889 K890 T911 L917 I918 V919	V889-L915 HydrophobicContact CB-CD2 3.74Å; V889-L915 HydrophobicContact CG1-CD2 3.31Å; K890-L915 HydrophobicContact CB-CD1 4.18Å; K890-L915 HydrophobicContact CG-CD1 4.45Å; T911-L915 WeakPolarHBondContact O-CB 3.4Å; T911-L915 WeakPolarHBondContact O-CG 3.47Å; T911-L915 PolarHBondContact O-N 3.26Å; L915-L917 VanDerWaalsContact C-N 3.3Å; L915-L917 PolarHBondContact O-N 3.43Å; L915-I918 PolarHBondContact O-N 3.28Å; L915-V919 WeakPolarHBondContact O-CG2 3.32Å; L915-V919 PolarHBondContact O-N 2.9Å
916	P	85.4	Confident	89.3	Confident	7 Å²	7	15.7 Å²	15.7	5%	0.045	8%	0.082	C	C	.	.	H	α-helix	trans	-51.2	-45.5	172.4	-34.8	41.8	0	0	0	114.4	I564 I673 H912 I918 F920	I564-P916 HydrophobicContact CD1-CG 4.1Å; I564-P916 HydrophobicContact CG1-CG 4.23Å; I673-P916 HydrophobicContact CD1-CG 4.04Å; I673-P916 HydrophobicContact CG2-CB 3.38Å; I673-P916 HydrophobicContact CG2-CG 3.65Å; H912-P916 WeakPolarHBondContact O-CD 3.47Å; H912-P916 WeakPolarHBondContact O-CG 3.48Å; P916-I918 VanDerWaalsContact C-N 3.34Å; P916-F920 WeakPolarHBondContact O-CB 3.3Å; P916-F920 PolarHBondContact O-N 3.46Å
917	L	88.8	Confident	89.5	Confident	34 Å²	34	15.4 Å²	15.4	18%	0.178	8%	0.08	C	C	.	.	H	α-helix	trans	-73.2	-31.5	-176.1	-62.5	175.9	0	0	0	111.4	A914 L915 F921	A914-L917 PolarHBondContact O-N 3.35Å; L915-L917 VanDerWaalsContact C-N 3.3Å; L915-L917 PolarHBondContact O-N 3.43Å; L917-F921 WeakPolarHBondContact O-CB 3.1Å; L917-F921 PolarHBondContact O-N 3.28Å
918	I	92.3	Very high	89.6	Confident	2 Å²	2	15.7 Å²	15.7	1%	0.01	8%	0.082	C	C	.	.	H	α-helix	trans	-67.5	-49.2	175.3	-63.5	169.1	0	0	0	110.7	M805 Y808 N885 A914 L915 P916 F920 F921 R922	M805-I918 HydrophobicContact CE-CB 4.21Å; M805-I918 HydrophobicContact CE-CD1 3.77Å; M805-I918 HydrophobicContact CE-CG1 3.59Å; M805-I918 HydrophobicContact CE-CG2 3.67Å; M805-I918 HydrophobicContact SD-CB 4.29Å; M805-I918 HydrophobicContact SD-CG1 4.09Å; M805-I918 HydrophobicContact SD-CG2 3.73Å; Y808-I918 HydrophobicContact CD1-CD1 3.39Å; Y808-I918 HydrophobicContact CD2-CD1 4.04Å; Y808-I918 HydrophobicContact CE1-CD1 4.01Å; Y808-I918 HydrophobicContact CG-CD1 3.39Å; N885-I918 HydrophobicContact CB-CG2 4.23Å; A914-I918 HydrophobicContact CB-CD1 4.41Å; A914-I918 WeakPolarHBondContact O-CG1 3.38Å; A914-I918 PolarHBondContact O-N 3.35Å; A914-I918 VanDerWaalsContact O-N 3.08Å; L915-I918 PolarHBondContact O-N 3.28Å; P916-I918 VanDerWaalsContact C-N 3.34Å; I918-F920 VanDerWaalsContact C-N 3.34Å; I918-F921 WeakPolarHBondContact O-CB 3.36Å; I918-F921 PolarHBondContact O-N 2.96Å; I918-R922 WeakPolarHBondContact O-CG 3.47Å; I918-R922 PolarHBondContact O-N 3.43Å; I918-R922 VanDerWaalsContact O-N 3.1Å
919	V	90.4	Very high	90	Very high	10 Å²	10	15 Å²	15	6%	0.061	8%	0.079	C	C	.	.	H	α-helix	trans	-62.6	-45.7	178.1	178.6	0	0	0	0	109.6	E674 W882 L915 F921 R922 F923	E674-V919 HydrophobicContact CG-CG1 4.15Å; E674-V919 VanDerWaalsContact OE1-CB 3.25Å; E674-V919 WeakPolarHBondContact OE1-CB 3.42Å; E674-V919 WeakPolarHBondContact OE1-CG1 2.92Å; W882-V919 VanDerWaalsContact CD1-O 3.3Å; W882-V919 VanDerWaalsContact NE1-CG1 3.25Å; L915-V919 WeakPolarHBondContact O-CG2 3.32Å; L915-V919 PolarHBondContact O-N 2.9Å; V919-F921 PolarHBondContact O-N 3.43Å; V919-R922 PolarHBondContact O-N 2.81Å; V919-F923 WeakPolarHBondContact O-CB 3.22Å; V919-F923 PolarHBondContact O-N 3.36Å
920	F	89.4	Confident	90.2	Very high	10 Å²	10	12 Å²	12	4%	0.044	6%	0.064	C	C	.	.	H	α-helix	trans	-58.7	-43.8	174.2	-179.9	-100.1	0	0	0	112.3	E674 L677 I678 L797 P916 I918 R922 F923 H924	E674-F920 PolarHBondContact OE1-N 3.42Å; L677-F920 HydrophobicContact CB-CD2 4.2Å; L677-F920 HydrophobicContact CB-CE2 4.4Å; L677-F920 HydrophobicContact CD1-CB 4.13Å; L677-F920 HydrophobicContact CD1-CD2 4.25Å; L677-F920 HydrophobicContact CD1-CG 4.22Å; I678-F920 HydrophobicContact CG1-CE2 4.35Å; L797-F920 HydrophobicContact CB-CZ 4.42Å; L797-F920 HydrophobicContact CD2-CE1 4.42Å; L797-F920 HydrophobicContact CD2-CZ 3.95Å; P916-F920 WeakPolarHBondContact O-CB 3.3Å; P916-F920 PolarHBondContact O-N 3.46Å; I918-F920 VanDerWaalsContact C-N 3.34Å; F920-R922 PolarHBondContact O-N 3.38Å; F920-F923 PolarHBondContact O-N 3.48Å; F920-H924 HydrophobicContact CE1-CB 4.17Å; F920-H924 HydrophobicContact CE2-CB 4.47Å; F920-H924 HydrophobicContact CZ-CB 4.1Å; F920-H924 VanDerWaalsContact O-CB 3.24Å; F920-H924 WeakPolarHBondContact O-CB 3.25Å; F920-H924 PolarHBondContact O-N 3.49Å
921	F	94	Very high	90	Very high	0 Å²	0	13.3 Å²	13.3	0%	0	7%	0.071	C	C	.	.	H	α-helix	trans	-58.3	-46.6	178	171.5	-106.7	0	0	0	112.3	L798 G801 L802 M805 V845 L917 I918 V919 S925	L798-F921 HydrophobicContact CD1-CD2 4.07Å; L798-F921 HydrophobicContact CD1-CE2 3.84Å; G801-F921 VanDerWaalsContact C-CD2 3.49Å; L802-F921 HydrophobicContact CB-CD2 4.36Å; L802-F921 HydrophobicContact CB-CE2 4.05Å; L802-F921 HydrophobicContact CD1-CE2 4.2Å; L802-F921 HydrophobicContact CD1-CZ 4.26Å; M805-F921 HydrophobicContact CB-CD1 4.35Å; M805-F921 HydrophobicContact CG-CD1 4.28Å; M805-F921 HydrophobicContact CG-CE1 4.44Å; M805-F921 HydrophobicContact SD-CD1 4.11Å; V845-F921 HydrophobicContact CG2-CE2 3.57Å; V845-F921 HydrophobicContact CG2-CZ 3.88Å; L917-F921 WeakPolarHBondContact O-CB 3.1Å; L917-F921 PolarHBondContact O-N 3.28Å; I918-F921 WeakPolarHBondContact O-CB 3.36Å; I918-F921 PolarHBondContact O-N 2.96Å; V919-F921 PolarHBondContact O-N 3.43Å; F921-S925 WeakPolarHBondContact O-CB 3.43Å; F921-S925 PolarHBondContact O-N 3.02Å; F921-S925 PolarHBondContact O-OG 2.91Å
922	R	94.7	Very high	89.9	Confident	0 Å²	0	12.9 Å²	12.9	0%	0	7%	0.069	C	C	.	.	H	α-helix	trans	-68.9	-39.6	179.5	-62	-65.1	-177.1	-175.3	0.6	111.6	E837 W882 N885 I918 V919 F920 T926	E837-R922 IonicContact OE1-CZ 3.61Å; E837-R922 IonicContact OE1-NH2 3.86Å; E837-R922 PolarHBondContact OE1-NH2 3.39Å; W882-R922 HydrophobicContact CB-CB 3.83Å; W882-R922 HydrophobicContact CG-CB 4.29Å; N885-R922 PolarHBondContact ND2-NE 3.48Å; I918-R922 WeakPolarHBondContact O-CG 3.47Å; I918-R922 PolarHBondContact O-N 3.43Å; I918-R922 VanDerWaalsContact O-N 3.1Å; V919-R922 PolarHBondContact O-N 2.81Å; F920-R922 PolarHBondContact O-N 3.38Å; R922-T926 PolarHBondContact O-N 2.98Å; R922-T926 PolarHBondContact O-OG1 3.22Å
923	F	91.8	Very high	90	Very high	27 Å²	27	15.8 Å²	15.8	12%	0.118	8%	0.079	C	C	.	.	H	α-helix	trans	-63.1	-53	175	177.3	-105.4	0	0	0	111.4	L474 F481 I678 V919 F920 S925 T926 V927	L474-F923 HydrophobicContact CD1-CE1 4.12Å; F481-F923 HydrophobicContact CE2-CD1 4.48Å; F481-F923 HydrophobicContact CE2-CD2 4.22Å; F481-F923 HydrophobicContact CE2-CE1 4.29Å; F481-F923 HydrophobicContact CE2-CE2 4.02Å; F481-F923 HydrophobicContact CE2-CG 4.47Å; F481-F923 HydrophobicContact CE2-CZ 4.08Å; F481-F923 HydrophobicContact CZ-CD2 4.34Å; F481-F923 HydrophobicContact CZ-CE2 4.44Å; I678-F923 HydrophobicContact CD1-CD1 4.14Å; I678-F923 HydrophobicContact CD1-CE1 3.57Å; I678-F923 HydrophobicContact CD1-CZ 4.25Å; I678-F923 HydrophobicContact CG1-CE1 4.25Å; V919-F923 WeakPolarHBondContact O-CB 3.22Å; V919-F923 PolarHBondContact O-N 3.36Å; F920-F923 PolarHBondContact O-N 3.48Å; F923-S925 PolarHBondContact O-N 3.47Å; F923-T926 WeakPolarHBondContact O-CA 3.42Å; F923-T926 VanDerWaalsContact O-CB 3.23Å; F923-T926 WeakPolarHBondContact O-CB 3.24Å; F923-T926 PolarHBondContact O-N 2.94Å; F923-V927 HydrophobicContact CD1-CG2 4.34Å; F923-V927 HydrophobicContact CE1-CG2 3.86Å; F923-V927 HydrophobicContact CE2-CG2 4.44Å; F923-V927 HydrophobicContact CZ-CG2 3.89Å; F923-V927 PolarHBondContact O-N 3.36Å
924	H	91.2	Very high	89.8	Confident	1 Å²	1	14 Å²	14	1%	0.005	8%	0.075	C	C	.	.	H	α-helix	trans	-68.2	-35.6	-177	-166.4	68.4	0	0	0	112.2	D794 L797 L798 F920 T926 V927 C928	D794-H924 PolarHBondContact O-NE2 2.78Å; L797-H924 WeakPolarHBondContact CB-NE2 3.48Å; L798-H924 PolarHBondContact N-CD2 3.48Å; F920-H924 HydrophobicContact CE1-CB 4.17Å; F920-H924 HydrophobicContact CE2-CB 4.47Å; F920-H924 HydrophobicContact CZ-CB 4.1Å; F920-H924 VanDerWaalsContact O-CB 3.24Å; F920-H924 WeakPolarHBondContact O-CB 3.25Å; F920-H924 PolarHBondContact O-N 3.49Å; H924-T926 VanDerWaalsContact C-N 3.25Å; H924-T926 PolarHBondContact O-N 2.93Å; H924-V927 CarbonylContact O-C 3.59Å; H924-V927 WeakPolarHBondContact O-CA 3.46Å; H924-V927 WeakPolarHBondContact O-CB 3.18Å; H924-V927 PolarHBondContact O-N 2.98Å; H924-C928 PolarHBondContact O-N 3.36Å; H924-C928 PolarHBondContact O-SG 2.9Å; H924-C928 VanDerWaalsContact O-SG 3.4Å
925	S	94.4	Very high	89.2	Confident	0 Å²	0	16 Å²	16	0%	0	9%	0.086	C	C	.	.	H	α-helix	trans	-54.4	-43.1	167.5	-71.7	0	0	0	0	112.1	L798 Q844 F921 F923 V927 C928 L929	L798-S925 VanDerWaalsContact CD1-OG 3.29Å; L798-S925 WeakPolarHBondContact CD1-OG 3.38Å; Q844-S925 PolarHBondContact NE2-OG 3.18Å; F921-S925 WeakPolarHBondContact O-CB 3.43Å; F921-S925 PolarHBondContact O-N 3.02Å; F921-S925 PolarHBondContact O-OG 2.91Å; F923-S925 PolarHBondContact O-N 3.47Å; S925-V927 VanDerWaalsContact C-N 3.34Å; S925-C928 PolarHBondContact O-N 3.37Å; S925-L929 WeakPolarHBondContact O-CB 3.46Å; S925-L929 VanDerWaalsContact O-CG 3.23Å; S925-L929 WeakPolarHBondContact O-CG 3.36Å; S925-L929 PolarHBondContact O-N 3.21Å
926	T	93.5	Very high	88.8	Confident	24 Å²	24	15.2 Å²	15.2	15%	0.147	8%	0.083	C	C	.	.	H	α-helix	trans	-64.7	-39.6	176.4	-54.6	0	0	0	0	111.1	L875 N878 R922 F923 H924 L929 S930	L875-T926 HydrophobicContact CD2-CG2 3.91Å; L875-T926 WeakPolarHBondContact CD2-O 3.48Å; N878-T926 WeakPolarHBondContact CB-OG1 3.39Å; R922-T926 PolarHBondContact O-N 2.98Å; R922-T926 PolarHBondContact O-OG1 3.22Å; F923-T926 WeakPolarHBondContact O-CA 3.42Å; F923-T926 VanDerWaalsContact O-CB 3.23Å; F923-T926 WeakPolarHBondContact O-CB 3.24Å; F923-T926 PolarHBondContact O-N 2.94Å; H924-T926 VanDerWaalsContact C-N 3.25Å; H924-T926 PolarHBondContact O-N 2.93Å; T926-L929 PolarHBondContact O-N 2.73Å; T926-S930 WeakPolarHBondContact O-CB 3.44Å; T926-S930 PolarHBondContact O-N 2.97Å
927	V	90.5	Very high	88.4	Confident	3 Å²	3	15.5 Å²	15.5	2%	0.018	8%	0.083	C	C	.	.	H	α-helix	trans	-61.4	-49.2	174.2	176.1	0	0	0	0	111.1	N471 L474 F923 H924 S925 L929 S930 D931	N471-V927 HydrophobicContact CB-CG1 4.21Å; N471-V927 WeakPolarHBondContact ND2-CG1 3.46Å; N471-V927 PolarHBondContact ND2-O 2.92Å; L474-V927 HydrophobicContact CB-CG1 4.14Å; L474-V927 HydrophobicContact CD1-CG1 4.47Å; L474-V927 HydrophobicContact CD1-CG2 4.38Å; F923-V927 HydrophobicContact CD1-CG2 4.34Å; F923-V927 HydrophobicContact CE1-CG2 3.86Å; F923-V927 HydrophobicContact CE2-CG2 4.44Å; F923-V927 HydrophobicContact CZ-CG2 3.89Å; F923-V927 PolarHBondContact O-N 3.36Å; H924-V927 CarbonylContact O-C 3.59Å; H924-V927 WeakPolarHBondContact O-CA 3.46Å; H924-V927 WeakPolarHBondContact O-CB 3.18Å; H924-V927 PolarHBondContact O-N 2.98Å; S925-V927 VanDerWaalsContact C-N 3.34Å; V927-L929 PolarHBondContact O-N 3.38Å; V927-S930 WeakPolarHBondContact O-CB 3.48Å; V927-S930 PolarHBondContact O-N 3.4Å; V927-S930 VanDerWaalsContact O-N 3.14Å; V927-S930 PolarHBondContact O-OG 3.39Å; V927-D931 PolarHBondContact O-N 3.15Å
928	C	90.7	Very high	87.5	Confident	7 Å²	7	19.7 Å²	19.7	5%	0.047	10%	0.096	C	C	.	.	H	α-helix	trans	-62.4	-43.8	178.2	-63.3	0	0	0	0	112	I848 H924 S925 S930 D931 I932	I848-C928 HydrophobicContact CD1-CB 4.44Å; I848-C928 HydrophobicContact CG2-CB 3.6Å; H924-C928 PolarHBondContact O-N 3.36Å; H924-C928 PolarHBondContact O-SG 2.9Å; H924-C928 VanDerWaalsContact O-SG 3.4Å; S925-C928 PolarHBondContact O-N 3.37Å; C928-S930 PolarHBondContact O-N 3.12Å; C928-D931 WeakPolarHBondContact O-CB 3.35Å; C928-D931 PolarHBondContact O-N 3.04Å; C928-D931 VanDerWaalsContact O-N 3.17Å; C928-I932 WeakPolarHBondContact O-CG1 3.36Å; C928-I932 PolarHBondContact O-N 2.9Å
929	L	92.5	Very high	86.2	Confident	0 Å²	0	23 Å²	23	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-59.8	-35.6	174.8	-73.6	171.8	0	0	0	112.3	F847 I848 L874 L875 N878 S925 T926 V927 D931 W933	F847-L929 HydrophobicContact CD1-CD2 4.13Å; F847-L929 HydrophobicContact CE1-CD2 3.59Å; I848-L929 HydrophobicContact CD1-CD2 4.47Å; I848-L929 HydrophobicContact CD1-CG 4.22Å; I848-L929 HydrophobicContact CG1-CD2 4.03Å; I848-L929 HydrophobicContact CG1-CG 4.28Å; L874-L929 HydrophobicContact CD2-CD1 4.18Å; L874-L929 HydrophobicContact CD2-CD2 3.85Å; L874-L929 HydrophobicContact CG-CD1 3.96Å; L874-L929 HydrophobicContact CG-CD2 4.46Å; L875-L929 HydrophobicContact CD2-CB 3.48Å; L875-L929 VanDerWaalsContact CD2-CB 3.48Å; L875-L929 HydrophobicContact CG-CB 3.93Å; N878-L929 HydrophobicContact CB-CD1 4.32Å; N878-L929 WeakPolarHBondContact ND2-CD1 3.36Å; S925-L929 WeakPolarHBondContact O-CB 3.46Å; S925-L929 VanDerWaalsContact O-CG 3.23Å; S925-L929 WeakPolarHBondContact O-CG 3.36Å; S925-L929 PolarHBondContact O-N 3.21Å; T926-L929 PolarHBondContact O-N 2.73Å; V927-L929 PolarHBondContact O-N 3.38Å; L929-D931 VanDerWaalsContact C-N 3.35Å; L929-W933 VanDerWaalsContact O-CB 3.28Å; L929-W933 WeakPolarHBondContact O-CB 3.13Å; L929-W933 PolarHBondContact O-N 3.44Å
930	S	88.9	Confident	84.8	Confident	4 Å²	4	27.4 Å²	27.4	3%	0.028	13%	0.126	C	C	.	.	H	α-helix	trans	-72.1	-33	179.5	77	0	0	0	0	111.7	Y473 T926 V927 C928 W933 A934	Y473-S930 WeakPolarHBondContact CD2-OG 3.26Å; Y473-S930 WeakPolarHBondContact CE2-OG 3.26Å; T926-S930 WeakPolarHBondContact O-CB 3.44Å; T926-S930 PolarHBondContact O-N 2.97Å; V927-S930 WeakPolarHBondContact O-CB 3.48Å; V927-S930 PolarHBondContact O-N 3.4Å; V927-S930 VanDerWaalsContact O-N 3.14Å; V927-S930 PolarHBondContact O-OG 3.39Å; C928-S930 PolarHBondContact O-N 3.12Å; S930-W933 WeakPolarHBondContact O-CB 3.25Å; S930-W933 PolarHBondContact O-N 3.36Å; S930-A934 WeakPolarHBondContact O-CB 3.44Å; S930-A934 PolarHBondContact O-N 3.18Å
931	D	84.7	Confident	83	Confident	39 Å²	39	30.6 Å²	30.6	21%	0.209	15%	0.147	C	C	.	.	H	α-helix	trans	-68.4	-48.2	173.7	-164.7	68.2	0	0	0	111.2	V927 C928 L929 W933 A934 N935	V927-D931 PolarHBondContact O-N 3.15Å; C928-D931 WeakPolarHBondContact O-CB 3.35Å; C928-D931 PolarHBondContact O-N 3.04Å; C928-D931 VanDerWaalsContact O-N 3.17Å; L929-D931 VanDerWaalsContact C-N 3.35Å; D931-W933 PolarHBondContact O-N 3.09Å; D931-A934 CarbonylContact O-C 3.6Å; D931-A934 WeakPolarHBondContact O-CA 3.39Å; D931-A934 PolarHBondContact O-N 3.34Å; D931-N935 WeakPolarHBondContact O-CB 3.49Å; D931-N935 PolarHBondContact O-N 3.41Å; D931-N935 PolarHBondContact OD1-ND2 3.47Å; D931-N935 PolarHBondContact OD2-ND2 3.13Å
932	I	86.9	Confident	80.5	Confident	5 Å²	5	39.6 Å²	39.6	3%	0.026	19%	0.189	C	C	.	.	H	α-helix	trans	-55.1	-45.6	173	-65.5	160.5	0	0	0	109.6	I848 A851 I871 C928 A934 N935 A936	I848-I932 HydrophobicContact CB-CD1 4.42Å; I848-I932 HydrophobicContact CG1-CD1 4.44Å; I848-I932 HydrophobicContact CG2-CD1 4.04Å; A851-I932 HydrophobicContact CB-CD1 3.7Å; A851-I932 HydrophobicContact CB-CG1 4.25Å; A851-I932 HydrophobicContact CB-CG2 3.93Å; I871-I932 HydrophobicContact CD1-CG2 4.05Å; C928-I932 WeakPolarHBondContact O-CG1 3.36Å; C928-I932 PolarHBondContact O-N 2.9Å; I932-A934 VanDerWaalsContact C-N 3.31Å; I932-A934 PolarHBondContact O-N 3.37Å; I932-N935 PolarHBondContact O-N 3.46Å; I932-A936 HydrophobicContact CG2-CB 4.07Å; I932-A936 WeakPolarHBondContact O-CB 3.4Å; I932-A936 PolarHBondContact O-N 3.18Å
933	W	86.6	Confident	79.8	Confident	64 Å²	64	41.6 Å²	41.6	24%	0.242	20%	0.198	C	C	.	.	H	α-helix	trans	-60	-38.4	174.8	-175.6	99.4	0	0	0	111.7	R868 I871 T872 L875 L929 S930 D931	R868-W933 VanDerWaalsContact CZ-CD2 3.44Å; R868-W933 VanDerWaalsContact NE-CD1 3.32Å; R868-W933 VanDerWaalsContact NE-CE2 3.25Å; R868-W933 PolarHBondContact NH1-O 3.36Å; R868-W933 VanDerWaalsContact NH2-CH2 3.26Å; R868-W933 VanDerWaalsContact NH2-CZ3 3.34Å; R868-W933 PolarHBondContact NH2-O 3.28Å; I871-W933 HydrophobicContact CG2-CB 3.93Å; I871-W933 HydrophobicContact CG2-CG 4.47Å; T872-W933 PolarHBondContact OG1-NE1 3.19Å; L875-W933 HydrophobicContact CD1-CB 3.99Å; L875-W933 HydrophobicContact CD1-CG 4Å; L929-W933 VanDerWaalsContact O-CB 3.28Å; L929-W933 WeakPolarHBondContact O-CB 3.13Å; L929-W933 PolarHBondContact O-N 3.44Å; S930-W933 WeakPolarHBondContact O-CB 3.25Å; S930-W933 PolarHBondContact O-N 3.36Å; D931-W933 PolarHBondContact O-N 3.09Å
934	A	81.7	Confident	79.2	Confident	37 Å²	37	42.3 Å²	42.3	31%	0.306	20%	0.202	S	C	.	.	H	α-helix	trans	-75.5	-35.3	178.6	0	0	0	0	0	113.6	S930 D931 I932 R938	S930-A934 WeakPolarHBondContact O-CB 3.44Å; S930-A934 PolarHBondContact O-N 3.18Å; D931-A934 CarbonylContact O-C 3.6Å; D931-A934 WeakPolarHBondContact O-CA 3.39Å; D931-A934 PolarHBondContact O-N 3.34Å; I932-A934 VanDerWaalsContact C-N 3.31Å; I932-A934 PolarHBondContact O-N 3.37Å; A934-R938 PolarHBondContact O-NE 3.2Å
935	N	76.8	Confident	78.5	Confident	42 Å²	42	44.6 Å²	44.6	23%	0.225	21%	0.213	C	C	.	.	H	α-helix	trans	-109.1	-31.7	-162.8	-67	-30.5	0	0	0	114.7	D931 I932 Y937 R938	D931-N935 WeakPolarHBondContact O-CB 3.49Å; D931-N935 PolarHBondContact O-N 3.41Å; D931-N935 PolarHBondContact OD1-ND2 3.47Å; D931-N935 PolarHBondContact OD2-ND2 3.13Å; I932-N935 PolarHBondContact O-N 3.46Å; N935-Y937 PolarHBondContact O-N 3.29Å; N935-R938 WeakPolarHBondContact O-CB 3.35Å; N935-R938 PolarHBondContact O-N 3.29Å; N935-R938 PolarHBondContact OD1-NH1 3.11Å
936	A	79.5	Confident	77.6	Confident	3 Å²	3	47.2 Å²	47.2	3%	0.025	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.9	-21.1	-172.9	0	0	0	0	0	114.5	C855 A856 I932	C855-A936 CarbonylContact C-O 3.56Å; A856-A936 PolarHBondContact N-O 2.69Å; I932-A936 HydrophobicContact CG2-CB 4.07Å; I932-A936 WeakPolarHBondContact O-CB 3.4Å; I932-A936 PolarHBondContact O-N 3.18Å
937	Y	78.1	Confident	76.6	Confident	14 Å²	14	48.7 Å²	48.7	6%	0.055	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	trans	-108.9	11.6	-178.4	-49.9	-81.2	0	0	0	113.6	K865 P866 R868 I871 N935	K865-Y937 VanDerWaalsContact C-CE1 3.45Å; K865-Y937 VanDerWaalsContact CA-CE1 3.43Å; K865-Y937 HydrophobicContact CB-CD1 3.86Å; K865-Y937 HydrophobicContact CB-CE1 3.89Å; K865-Y937 HydrophobicContact CB-CG 4.36Å; K865-Y937 HydrophobicContact CG-CD1 4.02Å; K865-Y937 HydrophobicContact CG-CG 4.19Å; P866-Y937 HydrophobicContact CG-CE1 4.42Å; P866-Y937 WeakPolarHBondContact O-CE1 3.36Å; P866-Y937 PolarHBondContact O-OH 3.11Å; R868-Y937 VanDerWaalsContact CA-OH 3.31Å; R868-Y937 WeakPolarHBondContact CA-OH 3.2Å; R868-Y937 HydrophobicContact CB-CE2 4.18Å; R868-Y937 HydrophobicContact CG-CE2 4.47Å; R868-Y937 PolarHBondContact N-OH 3.48Å; R868-Y937 VanDerWaalsContact NH1-CE2 3.27Å; I871-Y937 HydrophobicContact CD1-CE2 4.42Å; N935-Y937 PolarHBondContact O-N 3.29Å
938	R	70	Confident	75.7	Confident	121 Å²	121	51.7 Å²	51.7	46%	0.457	25%	0.245	S	C	.	.	S	Bend	trans	-79.9	134.8	169.1	-67.3	-178.3	174.6	-178.4	-0.1	108.6	A934 N935 R940	A934-R938 PolarHBondContact O-NE 3.2Å; N935-R938 WeakPolarHBondContact O-CB 3.35Å; N935-R938 PolarHBondContact O-N 3.29Å; N935-R938 PolarHBondContact OD1-NH1 3.11Å; R938-R940 PolarHBondContact O-N 2.99Å
939	F	64.2	Low	74.6	Confident	72 Å²	72	54.9 Å²	54.9	32%	0.316	26%	0.259	S	S	.	.	B	Isolated β-bridge	trans	-76	117.9	175.1	-166.6	-112.5	0	0	0	108.9	T710 A856 V862 T941	T710-F939 HydrophobicContact CG2-CB 3.86Å; A856-F939 WeakPolarHBondContact O-CD2 3.36Å; V862-F939 HydrophobicContact CG2-CB 4.05Å; V862-F939 HydrophobicContact CG2-CD2 4.19Å; F939-T941 HydrophobicContact CD1-CG2 3.76Å; F939-T941 HydrophobicContact CE1-CG2 3.32Å; F939-T941 HydrophobicContact CZ-CG2 4.31Å
940	R	60.2	Low	73.2	Confident	102 Å²	102	59.2 Å²	59.2	39%	0.385	28%	0.279	S	S	.	.			trans	-105	106.2	170.8	-171.5	172.7	-86.7	155.8	-6.5	106	S785 R938 E942	S785-R940 PolarHBondContact OG-NH1 3.17Å; R938-R940 PolarHBondContact O-N 2.99Å; R940-E942 PolarHBondContact O-N 2.76Å
941	T	52.2	Low	71.9	Confident	78 Å²	78	63.8 Å²	63.8	48%	0.479	30%	0.3	S	S	.	.			trans	-70.2	112.2	167.5	46	0	0	0	0	106.6	F939	F939-T941 HydrophobicContact CD1-CG2 3.76Å; F939-T941 HydrophobicContact CE1-CG2 3.32Å; F939-T941 HydrophobicContact CZ-CG2 4.31Å
942	E	42.2	Very low	70.7	Confident	188 Å²	188	66 Å²	66	88%	0.879	31%	0.308	S	S	*	.			trans	-60.9	0	152.8	-78.9	163.4	-143.2	0	0	109.8	K783 R940	K783-E942 WeakPolarHBondContact CE-OE1 3.39Å; K783-E942 IonicContact NZ-OE1 3.5Å; K783-E942 PolarHBondContact NZ-OE1 3.02Å; K783-E942 IonicContact NZ-OE2 3.16Å; K783-E942 PolarHBondContact NZ-OE2 3.5Å; R940-E942 PolarHBondContact O-N 2.76Å

Retrieved 942 of 942 residues in 1372.8 ms (Link to these results)

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