A0A077ZLA9_TRITR Loading...

SBP bac 5 and oligo HPY and ABC tran and BPD tran sp 1 and OppC N domain containing protein

AlphaFold DB , UniProt , Accession A0A077ZLA9, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 1,710 aa.

						>A0A077ZLA9_TRITR|A0A077ZLA9
MRNKFAYGIIAICGLALAGCYGGNSATTDESSSSAKAKGNGTFNLVVQQEMPTADLSVATDTISFAALNNVYEGIYRLDKDNKPQPAGASEKVKVSDDGKTYTVKLREDAQWSNGDPVTAKDYVFGWQRTVKPETASEYAYLFEPVENAADISAGKKAPEELGIKAVGDYELEIKLAKPTPYFDYLLAFPSFFPQNQKVVEENGKEYATKSDKSVYNGPFTLEGFDGPGTDTEWEYKKNDTYWDKDEVKLSSVKVNVVKESSTSLNLFKDGEADDVILSGELAQQNANDSTYKSFKEARTSYLEYNQRKADSPWKNENLRKAVSYAINRKSLVNQVLGDGSVVSTGLVPSGMSKNPKTDEDFAKEAGKLAPYDKEKAKEYWDKAKKELGIDELSFELMASDTDSSKKVIEYIQGVLEDTLPGMTVKPTPVPFSVRLDRSNAGDFDVLLGGWGADYADPSSFTDLFVTGNSYNRGRWSNEEYDKLVDASGNKDASDEEARWEDLQKANEIISKESGVAPLYQLSEAHLVNEKVKGIVHHPAGASWDYKWTRHLMGSYLKYFLKRVFFMLITLWLIATITFFLMQLLPGTPYTNQERLSPETIAMLNKQVGLDKPVIVQYGIYLSNLVQGNFGISFQFKNQAVAALLAGRIGPSLQLGLQAIVFGTFVGIILGTISAMKQNSWADTASTLVAILGRSIPNFVFAVLLQYIFAMKLQVLPIAKWEGFAYTILPTLALAMSPLADSARFIRTEMVEVLHSDYVELARAKGLSRWEIAFRHGLRNSLIPLMTLLGPLAVALMTGSLVVENIFAIPGIGEQFVKSIMTNDYPTIMAVTILYSFMLVFVILVVDLLYGLVDPRIQEREEIAAPSLNFLQDSWRRLKKNKAAVISMVLLIVIVAISILTIFVSPHNPSKQNVDFINLPPRVPGLNINGLNGKTMVAGELVDKYAQADVPDNVNYLLGTDGLGRDVLSRLFMGTRISLLIAFIAALFDITIGVAYGLISGMLGGKVDNAMQRFLEILSGIPNLVVMILMLVVFEPGIFSIVAAMAITNWIPMARIVRAQTLKLKDQEYVLAGMTLGESKWKIAFKHIIPNISSVIIIQMMFSIPTAIFFEAFLSFIGLGLTPPAASLGTLLNDGYKTFLYLPYLLWIPAVTISLIMICFNLLADGLRDAFDPKMKDNANIDEGQILFKGQDIVNKSEKEMQKIRGREIAMIFQDPMTSLDPTMTIGKQVAESLRKHKDVSKKESLKAALDLLNLVGIPDAEKRLKNYPHQFSEILIADEPTTALDVTIQAQILELLKEIQEKIETSIIFITHDLGVVANVADRVAVMYAGKIVEVGTAEEIFYNPQHPYTWGLLGSMPTLESENDRLYAIPGSPPDLLDPPKGDAFYPRNEFALKIDAELEPPFFELSDTHKAATWLLAPQAPVIAPPAEIQRLGESGSGKSTTGRTIIRLNQKTDGEILFDGKDVTKIHGKSALTEFRRDVQMIFQDPYASLNPRMKVKDIIAEGIDVNGIAKTPKERDKLVNDLLETVGLNPSHGTRYPHEFSGGQRQRIGIARALAVRPRFIICDEPISALDVSIQAQVVNLLQDLQKEHNLTYLFIAHDLSMVKHISDRIGVMNNGHLLEVGTSNEIYHYGVHPYTESLLSAIPMPDPDHERQRRRIKYQTEPNDGKARSLREIAPGHFIYSSEDEVAYYKKKLQHLKNEKAIAV
					

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	30.3	Very low	36.6	Very low	228 Å²	228	131.4 Å²	131.4	100%	1.123	65%	0.646	S	S	*	*				0	-42.2	0	-65.7	-179.1	-175.8	0	0	114.2	N3 K4	M1-N3 VanDerWaalsContact C-N 3.28Å; M1-N3 PolarHBondContact O-N 3.38Å; M1-K4 PolarHBondContact O-N 3.09Å
2	R	38.1	Very low	36.6	Very low	240 Å²	240	129.2 Å²	129.2	91%	0.906	64%	0.637	S	S	*	*	T	Hydrogen-bonded Turn	trans	-50.5	-29.1	-164.7	-139.5	170.5	-176.3	172.9	-1.2	117.7
3	N	40.1	Very low	36.7	Very low	132 Å²	132	123.1 Å²	123.1	71%	0.706	61%	0.614	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.2	-8.8	-174.6	-64.2	21.6	0	0	0	115.3	M1 F5 Y7	M1-N3 VanDerWaalsContact C-N 3.28Å; M1-N3 PolarHBondContact O-N 3.38Å; N3-F5 VanDerWaalsContact C-N 3.31Å; N3-F5 PolarHBondContact O-N 2.86Å; N3-Y7 WeakPolarHBondContact O-CD2 3.34Å
4	K	37.8	Very low	36.6	Very low	181 Å²	181	117.4 Å²	117.4	79%	0.787	60%	0.602	S	S	*	*	H	α-helix	trans	-72.8	-21.9	178.6	-76.8	-162.8	172.1	-167.6	0	113.5	M1 A6 G8	M1-K4 PolarHBondContact O-N 3.09Å; K4-A6 PolarHBondContact O-N 2.93Å; K4-G8 PolarHBondContact O-N 3.48Å; K4-G8 VanDerWaalsContact O-N 3.17Å
5	F	34	Very low	36.5	Very low	167 Å²	167	117.7 Å²	117.7	73%	0.732	61%	0.605	S	S	*	*	H	α-helix	trans	-69.5	-34.7	-173	-140.3	-92.9	0	0	0	113.5	N3 G8 I9	N3-F5 VanDerWaalsContact C-N 3.31Å; N3-F5 PolarHBondContact O-N 2.86Å; F5-G8 PolarHBondContact O-N 2.94Å; F5-I9 HydrophobicContact CD1-CD1 3.97Å; F5-I9 HydrophobicContact CD1-CG1 4.46Å; F5-I9 HydrophobicContact CE1-CD1 4.26Å; F5-I9 WeakPolarHBondContact O-CG1 3.39Å; F5-I9 PolarHBondContact O-N 3.31Å; F5-I9 VanDerWaalsContact O-N 3.13Å
6	A	36.6	Very low	36.4	Very low	60 Å²	60	114.3 Å²	114.3	50%	0.496	60%	0.6	S	S	.	*	H	α-helix	trans	-65.9	-46.2	178.3	0	0	0	0	0	112.1	K4 G8 I9 I10	K4-A6 PolarHBondContact O-N 2.93Å; A6-G8 VanDerWaalsContact C-N 3.32Å; A6-G8 PolarHBondContact O-N 3.28Å; A6-I9 PolarHBondContact O-N 3.05Å; A6-I10 PolarHBondContact O-N 3.16Å
7	Y	35.5	Very low	36.4	Very low	176 Å²	176	112.6 Å²	112.6	69%	0.69	59%	0.59	S	S	*	*	H	α-helix	trans	-63.9	-36.7	175.4	-62.9	-69.9	0	0	0	112.3	N3 I9 I10 A11	N3-Y7 WeakPolarHBondContact O-CD2 3.34Å; Y7-I9 VanDerWaalsContact C-N 3.34Å; Y7-I9 PolarHBondContact O-N 2.81Å; Y7-I10 PolarHBondContact O-N 2.89Å; Y7-A11 PolarHBondContact O-N 3.42Å
8	G	31.9	Very low	36.3	Very low	30 Å²	30	109.6 Å²	109.6	31%	0.309	58%	0.584	S	S	.	*	H	α-helix	trans	-59.7	-41.1	173.3	0	0	0	0	0	113.1	K4 F5 A6 A11 I12	K4-G8 PolarHBondContact O-N 3.48Å; K4-G8 VanDerWaalsContact O-N 3.17Å; F5-G8 PolarHBondContact O-N 2.94Å; A6-G8 VanDerWaalsContact C-N 3.32Å; A6-G8 PolarHBondContact O-N 3.28Å; G8-A11 PolarHBondContact O-N 2.89Å; G8-I12 WeakPolarHBondContact O-CB 3.38Å; G8-I12 WeakPolarHBondContact O-CD1 3.42Å; G8-I12 VanDerWaalsContact O-CG1 3.24Å; G8-I12 WeakPolarHBondContact O-CG1 3.4Å; G8-I12 PolarHBondContact O-N 3.38Å
9	I	36.7	Very low	35.8	Very low	63 Å²	63	107 Å²	107	32%	0.323	59%	0.587	S	S	.	*	H	α-helix	trans	-67.5	-39.7	176.7	-67.8	168.4	0	0	0	111.4	F5 A6 Y7 A11 I12 C13	F5-I9 HydrophobicContact CD1-CD1 3.97Å; F5-I9 HydrophobicContact CD1-CG1 4.46Å; F5-I9 HydrophobicContact CE1-CD1 4.26Å; F5-I9 WeakPolarHBondContact O-CG1 3.39Å; F5-I9 PolarHBondContact O-N 3.31Å; F5-I9 VanDerWaalsContact O-N 3.13Å; A6-I9 PolarHBondContact O-N 3.05Å; Y7-I9 VanDerWaalsContact C-N 3.34Å; Y7-I9 PolarHBondContact O-N 2.81Å; I9-A11 VanDerWaalsContact C-N 3.34Å; I9-A11 PolarHBondContact O-N 2.96Å; I9-I12 PolarHBondContact O-N 2.85Å; I9-C13 PolarHBondContact O-N 2.88Å; I9-C13 PolarHBondContact O-SG 3.01Å; I9-C13 VanDerWaalsContact O-SG 3.42Å
10	I	41.2	Very low	35.4	Very low	114 Å²	114	107.8 Å²	107.8	59%	0.585	60%	0.599	S	S	*	*	H	α-helix	trans	-61.6	-43.5	175.6	-64.7	167.5	0	0	0	110.7	A6 Y7 C13 G14	A6-I10 PolarHBondContact O-N 3.16Å; Y7-I10 PolarHBondContact O-N 2.89Å; I10-C13 PolarHBondContact O-N 3.34Å; I10-G14 PolarHBondContact O-N 3.37Å
11	A	40.2	Very low	35	Very low	54 Å²	54	110.9 Å²	110.9	45%	0.446	60%	0.602	S	S	.	*	H	α-helix	trans	-63.4	-39.3	173.9	0	0	0	0	0	112.4	Y7 G8 I9 G14 L15	Y7-A11 PolarHBondContact O-N 3.42Å; G8-A11 PolarHBondContact O-N 2.89Å; I9-A11 VanDerWaalsContact C-N 3.34Å; I9-A11 PolarHBondContact O-N 2.96Å; A11-G14 PolarHBondContact O-N 3Å; A11-L15 WeakPolarHBondContact O-CB 3.33Å; A11-L15 WeakPolarHBondContact O-CG 3.43Å; A11-L15 PolarHBondContact O-N 3.5Å
12	I	37.1	Very low	34.6	Very low	105 Å²	105	104 Å²	104	54%	0.538	59%	0.591	S	S	.	*	H	α-helix	trans	-67.4	-34.3	176	-70.6	163.8	0	0	0	111.9	G8 I9 G14 L15 A16	G8-I12 WeakPolarHBondContact O-CB 3.38Å; G8-I12 WeakPolarHBondContact O-CD1 3.42Å; G8-I12 VanDerWaalsContact O-CG1 3.24Å; G8-I12 WeakPolarHBondContact O-CG1 3.4Å; G8-I12 PolarHBondContact O-N 3.38Å; I9-I12 PolarHBondContact O-N 2.85Å; I12-G14 VanDerWaalsContact C-N 3.3Å; I12-G14 PolarHBondContact O-N 3.08Å; I12-L15 PolarHBondContact O-N 2.96Å; I12-A16 WeakPolarHBondContact O-CB 3.4Å; I12-A16 PolarHBondContact O-N 3.03Å
13	C	38.1	Very low	33.8	Very low	50 Å²	50	95.3 Å²	95.3	34%	0.338	58%	0.575	S	S	.	*	H	α-helix	trans	-62.6	-38.3	171.8	-71.4	0	0	0	0	111.9	I9 I10 L17	I9-C13 PolarHBondContact O-N 2.88Å; I9-C13 PolarHBondContact O-SG 3.01Å; I9-C13 VanDerWaalsContact O-SG 3.42Å; I10-C13 PolarHBondContact O-N 3.34Å; C13-L17 WeakPolarHBondContact O-CG 3.32Å
14	G	35.2	Very low	33	Very low	44 Å²	44	95.6 Å²	95.6	45%	0.454	58%	0.577	S	S	.	*	H	α-helix	trans	-64.5	-51.8	170.1	0	0	0	0	0	112.3	I10 A11 I12 A16 L17 A18	I10-G14 PolarHBondContact O-N 3.37Å; A11-G14 PolarHBondContact O-N 3Å; I12-G14 VanDerWaalsContact C-N 3.3Å; I12-G14 PolarHBondContact O-N 3.08Å; G14-A16 PolarHBondContact O-N 3.07Å; G14-L17 PolarHBondContact O-N 3.31Å; G14-A18 VanDerWaalsContact O-CB 3.26Å; G14-A18 WeakPolarHBondContact O-CB 3.22Å; G14-A18 PolarHBondContact O-N 2.72Å
15	L	34.5	Very low	32.1	Very low	122 Å²	122	93.3 Å²	93.3	64%	0.639	58%	0.583	S	S	*	*	H	α-helix	trans	-70.1	-28.6	-175.2	-71.8	166.3	0	0	0	114.3	A11 I12 G19	A11-L15 WeakPolarHBondContact O-CB 3.33Å; A11-L15 WeakPolarHBondContact O-CG 3.43Å; A11-L15 PolarHBondContact O-N 3.5Å; I12-L15 PolarHBondContact O-N 2.96Å; L15-G19 WeakPolarHBondContact O-CA 3.47Å; L15-G19 PolarHBondContact O-N 3.32Å
16	A	35.6	Very low	31.7	Very low	63 Å²	63	90 Å²	90	52%	0.521	59%	0.587	S	S	.	*	H	α-helix	trans	-74.4	-27.7	175.9	0	0	0	0	0	112.6	I12 G14	I12-A16 WeakPolarHBondContact O-CB 3.4Å; I12-A16 PolarHBondContact O-N 3.03Å; G14-A16 PolarHBondContact O-N 3.07Å
17	L	36.5	Very low	30.9	Very low	85 Å²	85	93.4 Å²	93.4	45%	0.445	60%	0.602	S	S	.	*	H	α-helix	trans	-86.1	-38.7	172.9	-66.5	172.2	0	0	0	111.4	C13 G14 G19 M786 L849	C13-L17 WeakPolarHBondContact O-CG 3.32Å; G14-L17 PolarHBondContact O-N 3.31Å; L17-G19 PolarHBondContact O-N 3.39Å; L17-M786 HydrophobicContact CD2-CE 4.29Å; L17-L849 HydrophobicContact CD1-CD1 4Å
18	A	34.2	Very low	30.1	Very low	58 Å²	58	91.6 Å²	91.6	48%	0.479	61%	0.609	S	S	.	*	H	α-helix	trans	-70.9	-17.1	172.4	0	0	0	0	0	113.3	G14 C20 Y21	G14-A18 VanDerWaalsContact O-CB 3.26Å; G14-A18 WeakPolarHBondContact O-CB 3.22Å; G14-A18 PolarHBondContact O-N 2.72Å; A18-C20 PolarHBondContact O-N 2.86Å; A18-Y21 VanDerWaalsContact O-CB 3.3Å; A18-Y21 WeakPolarHBondContact O-CB 3.46Å; A18-Y21 PolarHBondContact O-N 3.29Å
19	G	26.2	Very low	29.6	Very low	61 Å²	61	97.5 Å²	97.5	63%	0.629	63%	0.634	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.3	-11.2	179.7	0	0	0	0	0	115	L15 L17 Y21	L15-G19 WeakPolarHBondContact O-CA 3.47Å; L15-G19 PolarHBondContact O-N 3.32Å; L17-G19 PolarHBondContact O-N 3.39Å; G19-Y21 VanDerWaalsContact C-N 3.28Å
20	C	29	Very low	28.8	Very low	123 Å²	123	103.1 Å²	103.1	83%	0.831	66%	0.659	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.2	-9.7	167.6	-66.7	0	0	0	0	113.5	A18 G22	A18-C20 PolarHBondContact O-N 2.86Å; C20-G22 PolarHBondContact O-N 2.83Å; C20-G22 VanDerWaalsContact O-N 3.13Å
21	Y	25.6	Very low	27.8	Very low	172 Å²	172	103.7 Å²	103.7	68%	0.675	67%	0.673	S	S	*	*			trans	-85.4	76.5	175.7	-165.6	-97.9	0	0	0	111.6	A18 G19 G23 N24	A18-Y21 VanDerWaalsContact O-CB 3.3Å; A18-Y21 WeakPolarHBondContact O-CB 3.46Å; A18-Y21 PolarHBondContact O-N 3.29Å; G19-Y21 VanDerWaalsContact C-N 3.28Å; Y21-G23 PolarHBondContact O-N 3.45Å; Y21-N24 HydrophobicContact CE1-CB 4.12Å
22	G	22.4	Very low	26.9	Very low	85 Å²	85	106.6 Å²	106.6	88%	0.876	69%	0.69	S	S	*	*			trans	-74	83	174.5	0	0	0	0	0	113.2	C20	C20-G22 PolarHBondContact O-N 2.83Å; C20-G22 VanDerWaalsContact O-N 3.13Å
23	G	21.1	Very low	26	Very low	56 Å²	56	107.2 Å²	107.2	58%	0.577	70%	0.703	S	S	*	*			trans	118.7	83.8	157.9	0	0	0	0	0	117	Y21	Y21-G23 PolarHBondContact O-N 3.45Å
24	N	22.8	Very low	25.3	Very low	139 Å²	139	111 Å²	111	74%	0.743	73%	0.73	S	S	*	*				-151.1	141.2	129.3	-124.3	12.1	0	0	0	110	Y21 A26	Y21-N24 HydrophobicContact CE1-CB 4.12Å; N24-A26 PolarHBondContact O-N 3.27Å
25	S	20.5	Very low	24.7	Very low	132 Å²	132	112.9 Å²	112.9	92%	0.923	74%	0.741	S	S	*	*			trans	-79	112.5	-175.3	-55.5	0	0	0	0	111.2
26	A	25.2	Very low	24.1	Very low	97 Å²	97	116.4 Å²	116.4	80%	0.802	75%	0.752	S	S	*	*			trans	-113.7	127.1	164.6	0	0	0	0	0	108.4	N24	N24-A26 PolarHBondContact O-N 3.27Å
27	T	20.5	Very low	23.6	Very low	132 Å²	132	118.4 Å²	118.4	81%	0.81	77%	0.768	S	S	*	*			trans	-70.4	140.6	-177.6	34.2	0	0	0	0	111.7	D29	T27-D29 PolarHBondContact O-N 3.33Å
28	T	18.3	Very low	23.1	Very low	138 Å²	138	121.3 Å²	121.3	85%	0.847	78%	0.777	S	S	*	*			trans	-79.2	111.3	170	44.8	0	0	0	0	110.2
29	D	20.7	Very low	23.2	Very low	155 Å²	155	120.3 Å²	120.3	83%	0.829	77%	0.772	S	S	*	*			trans	-104.1	151.4	161.1	-86.5	-57.4	0	0	0	111.2	T27	T27-D29 PolarHBondContact O-N 3.33Å
30	E	19.7	Very low	24.3	Very low	181 Å²	181	121 Å²	121	85%	0.846	76%	0.761	S	S	*	*			trans	-98.1	158.9	-163.5	-68.9	-158.4	124.4	0	0	115.6
31	S	20.2	Very low	26.2	Very low	126 Å²	126	115.2 Å²	115.2	88%	0.881	72%	0.723	S	S	*	*			trans	82.5	169.6	150.1	87.3	0	0	0	0	118.2
32	S	20.7	Very low	29	Very low	115 Å²	115	109.2 Å²	109.2	80%	0.804	70%	0.704	S	S	*	*			trans	-126.5	130.7	-158.5	58.7	0	0	0	0	112.5
33	S	20	Very low	32.3	Very low	118 Å²	118	105.1 Å²	105.1	83%	0.825	66%	0.662	S	S	*	*			trans	-145.6	155.7	157.3	69.4	0	0	0	0	111.4	A35	S33-A35 PolarHBondContact O-N 3.49Å; S33-A35 VanDerWaalsContact O-N 3.16Å
34	S	21.7	Very low	35.6	Very low	128 Å²	128	104.7 Å²	104.7	90%	0.895	65%	0.647	S	S	*	*			trans	-84.2	86	-174.5	54.8	0	0	0	0	111.7
35	A	23.1	Very low	39	Very low	84 Å²	84	98.4 Å²	98.4	69%	0.694	61%	0.613	S	S	*	*			trans	-75.9	135.4	175.2	0	0	0	0	0	112.1	S33	S33-A35 PolarHBondContact O-N 3.49Å; S33-A35 VanDerWaalsContact O-N 3.16Å
36	K	22	Very low	42.5	Very low	197 Å²	197	92.3 Å²	92.3	86%	0.857	57%	0.57	S	S	*	*			trans	-57.7	145.9	155.5	-67	174.2	179.9	173.4	0	107.7	K38	K36-K38 PolarHBondContact O-N 3.05Å
37	A	25.5	Very low	45.7	Very low	104 Å²	104	88.4 Å²	88.4	86%	0.86	54%	0.537	S	S	*	.			trans	-57.1	98.2	-178	0	0	0	0	0	112.1	G39	A37-G39 PolarHBondContact O-N 2.8Å; A37-G39 VanDerWaalsContact O-N 3.13Å
38	K	25.7	Very low	48.9	Very low	146 Å²	146	83.1 Å²	83.1	64%	0.635	50%	0.503	S	S	*	.			trans	-69.7	102.1	164.9	-79.8	-166.2	169.4	-168	0	106.5	K36 N40 D246	K36-K38 PolarHBondContact O-N 3.05Å; K38-N40 VanDerWaalsContact C-N 3.29Å; K38-N40 PolarHBondContact O-N 3.41Å; K38-D246 IonicContact NZ-OD1 2.72Å; K38-D246 PolarHBondContact NZ-OD1 3.02Å
39	G	35.5	Very low	52.1	Low	37 Å²	37	77.4 Å²	77.4	38%	0.381	47%	0.467	S	S	.	.			trans	-77.1	78.2	-179.9	0	0	0	0	0	111.3	A37 G41	A37-G39 PolarHBondContact O-N 2.8Å; A37-G39 VanDerWaalsContact O-N 3.13Å; G39-G41 PolarHBondContact O-N 3.16Å
40	N	49.7	Very low	55.4	Low	75 Å²	75	71.3 Å²	71.3	40%	0.401	43%	0.433	S	S	.	.			trans	-75.1	101	170.6	-66.7	22.6	0	0	0	108.3	K38 M553	K38-N40 VanDerWaalsContact C-N 3.29Å; K38-N40 PolarHBondContact O-N 3.41Å; N40-M553 VanDerWaalsContact O-CE 3.32Å; N40-M553 WeakPolarHBondContact O-CE 3.12Å
41	G	69.6	Low	58.8	Low	2 Å²	2	62.7 Å²	62.7	2%	0.021	39%	0.393	C	S	.	.			trans	-111.8	151.6	171.5	0	0	0	0	0	111.1	G39 L250 S251	G39-G41 PolarHBondContact O-N 3.16Å; G41-L250 CarbonylContact O-C 3.6Å; G41-L250 VanDerWaalsContact O-CA 3.3Å; G41-L250 WeakPolarHBondContact O-CA 3.29Å; G41-L250 WeakPolarHBondContact O-CD2 3.47Å; G41-S251 PolarHBondContact O-N 2.79Å; G41-S251 PolarHBondContact O-OG 3.27Å
42	T	84.2	Confident	62	Low	46 Å²	46	57.7 Å²	57.7	28%	0.282	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	150.7	160.8	-66.7	0	0	0	0	108.9	S251 S252 K254	T42-S251 PolarHBondContact N-OG 3.12Å; T42-S251 PolarHBondContact OG1-OG 3.46Å; T42-S252 CarbonylContact C-O 3.58Å; T42-S252 VanDerWaalsContact CA-O 3.26Å; T42-S252 WeakPolarHBondContact CA-O 3.38Å; T42-S252 WeakPolarHBondContact CG2-OG 3.43Å; T42-S252 PolarHBondContact OG1-OG 3.07Å; T42-K254 HydrophobicContact CG2-CB 4.49Å; T42-K254 HydrophobicContact CG2-CD 4.16Å; T42-K254 HydrophobicContact CG2-CG 3.9Å
43	F	91	Very high	65.3	Low	0 Å²	0	53.3 Å²	53.3	0%	0	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	122.6	176.6	170.7	-131.5	0	0	0	108.8	L45 L250 S252 V253 K254 D274 D275 V532 I535 Y546 T549	F43-L45 HydrophobicContact CE1-CB 4.28Å; F43-L45 HydrophobicContact CZ-CD1 4.41Å; F43-L250 HydrophobicContact CB-CD1 3.72Å; F43-L250 HydrophobicContact CB-CD2 4.14Å; F43-L250 HydrophobicContact CD1-CD1 4.38Å; F43-L250 HydrophobicContact CG-CD1 4.43Å; F43-S252 PolarHBondContact N-O 3.35Å; F43-V253 HydrophobicContact CB-CG2 4.46Å; F43-V253 HydrophobicContact CD1-CB 4.38Å; F43-V253 HydrophobicContact CD1-CG1 3.67Å; F43-V253 HydrophobicContact CD1-CG2 4.02Å; F43-V253 HydrophobicContact CE1-CG1 4.28Å; F43-V253 HydrophobicContact CG-CG1 4.48Å; F43-V253 CarbonylContact O-C 3.48Å; F43-V253 WeakPolarHBondContact O-CA 3.45Å; F43-K254 PolarHBondContact O-N 3.2Å; F43-D274 HydrophobicContact CD2-CB 3.52Å; F43-D274 HydrophobicContact CE2-CB 3.58Å; F43-D275 HydrophobicContact CE2-CB 3.66Å; F43-D275 HydrophobicContact CZ-CB 3.51Å; F43-V532 HydrophobicContact CD2-CG1 3.98Å; F43-V532 HydrophobicContact CD2-CG2 3.78Å; F43-V532 HydrophobicContact CE2-CB 4.37Å; F43-V532 HydrophobicContact CE2-CG1 3.87Å; F43-V532 HydrophobicContact CE2-CG2 3.96Å; F43-V532 HydrophobicContact CZ-CG1 4.47Å; F43-I535 HydrophobicContact CE1-CD1 4.25Å; F43-I535 HydrophobicContact CE2-CD1 4.18Å; F43-I535 HydrophobicContact CZ-CD1 3.61Å; F43-I535 HydrophobicContact CZ-CG1 4.38Å; F43-Y546 HydrophobicContact CD1-CD1 4.31Å; F43-Y546 AromaticContact CE1-CD1 3.85Å; F43-Y546 HydrophobicContact CE1-CD1 3.85Å; F43-Y546 AromaticContact CE1-CE1 3.69Å; F43-Y546 HydrophobicContact CE1-CE1 3.69Å; F43-T549 HydrophobicContact CD1-CG2 4.49Å
44	N	91.5	Very high	68.7	Low	47 Å²	47	47.9 Å²	47.9	25%	0.251	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	105.4	-177.8	-66.9	-10.1	0	0	0	110.8	E272 D274 D275	N44-E272 VanDerWaalsContact CB-O 3.22Å; N44-E272 WeakPolarHBondContact CB-O 3.48Å; N44-E272 PolarHBondContact ND2-O 3.45Å; N44-D274 PolarHBondContact N-OD2 3.42Å; N44-D274 VanDerWaalsContact N-OD2 3.16Å; N44-D274 WeakPolarHBondContact O-CA 3.12Å; N44-D274 WeakPolarHBondContact O-CB 3.32Å; N44-D274 PolarHBondContact O-N 3.39Å; N44-D275 PolarHBondContact O-N 2.84Å
45	L	93.9	Very high	72.1	Confident	6 Å²	6	42.4 Å²	42.4	3%	0.031	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	142.9	-179.2	177.7	66.2	0	0	0	111.2	F43 V47 V253 K254 V255 N256 D275 Y546	F43-L45 HydrophobicContact CE1-CB 4.28Å; F43-L45 HydrophobicContact CZ-CD1 4.41Å; L45-V47 HydrophobicContact CD2-CG1 4.07Å; L45-V47 HydrophobicContact CG-CG1 4.15Å; L45-V253 HydrophobicContact CB-CG1 4.15Å; L45-K254 PolarHBondContact N-O 3.29Å; L45-V255 HydrophobicContact CB-CG2 4.47Å; L45-V255 HydrophobicContact CD2-CG1 4.15Å; L45-V255 HydrophobicContact CD2-CG2 4.04Å; L45-V255 HydrophobicContact CG-CG1 4.39Å; L45-V255 WeakPolarHBondContact O-CA 3.46Å; L45-N256 PolarHBondContact O-N 2.97Å; L45-D275 HydrophobicContact CD1-CB 3.98Å; L45-Y546 HydrophobicContact CD2-CE2 4.15Å; L45-Y546 VanDerWaalsContact CD2-OH 3.24Å; L45-Y546 WeakPolarHBondContact CD2-OH 3.44Å
46	V	93.4	Very high	75.4	Confident	4 Å²	4	38.4 Å²	38.4	2%	0.024	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	133.7	167.4	174.4	0	0	0	0	110.4	N256 V258 A273 D275 V276	V46-N256 WeakPolarHBondContact CA-O 3.26Å; V46-V258 HydrophobicContact CG1-CB 3.59Å; V46-V258 HydrophobicContact CG1-CG2 3.74Å; V46-V258 HydrophobicContact CG2-CG2 4.46Å; V46-A273 HydrophobicContact CG2-CB 3.84Å; V46-D275 PolarHBondContact N-O 2.92Å; V46-V276 HydrophobicContact CB-CB 4.37Å; V46-V276 HydrophobicContact CB-CG1 3.97Å; V46-V276 HydrophobicContact CG2-CG1 3.87Å
47	V	92.2	Very high	78.7	Confident	16 Å²	16	29 Å²	29	10%	0.097	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	158.3	174.8	-61.4	0	0	0	0	110.5	L45 I63 W234 V255 N256 V257 V258	L45-V47 HydrophobicContact CD2-CG1 4.07Å; L45-V47 HydrophobicContact CG-CG1 4.15Å; V47-I63 HydrophobicContact CB-CD1 4.32Å; V47-I63 HydrophobicContact CG1-CD1 4.4Å; V47-W234 HydrophobicContact CG2-CH2 3.95Å; V47-W234 HydrophobicContact CG2-CZ2 4.33Å; V47-V255 HydrophobicContact CB-CG1 4.42Å; V47-V255 HydrophobicContact CG1-CG1 3.85Å; V47-V255 HydrophobicContact CG2-CG1 3.72Å; V47-N256 PolarHBondContact N-O 3.42Å; V47-V257 HydrophobicContact CG2-CG2 4.08Å; V47-V257 CarbonylContact O-C 3.59Å; V47-V257 WeakPolarHBondContact O-CA 3.45Å; V47-V258 PolarHBondContact O-N 2.89Å
48	Q	87.9	Confident	81.7	Confident	20 Å²	20	26.7 Å²	26.7	9%	0.093	15%	0.15	C	C	.	.	S	Bend	trans	-88.7	-6.9	-174.2	-68.4	-171.1	-7.5	0	0	115.4	K259 I277 T402	Q48-K259 WeakPolarHBondContact O-CG 3.35Å; Q48-I277 HydrophobicContact CG-CB 4.32Å; Q48-I277 HydrophobicContact CG-CD1 4.49Å; Q48-T402 HydrophobicContact CB-CG2 4.18Å
49	Q	86.4	Confident	84.8	Confident	19 Å²	19	19.8 Å²	19.8	9%	0.089	12%	0.12	C	C	.	.	S	Bend	trans	-150.2	157.3	-178	69.5	-173.5	26.8	0	0	112.8	I63 T402 F432	Q49-I63 HydrophobicContact CG-CD1 4.43Å; Q49-I63 HydrophobicContact CG-CG1 3.71Å; Q49-T402 HydrophobicContact CB-CG2 4.26Å; Q49-F432 VanDerWaalsContact CD-CD2 3.49Å; Q49-F432 VanDerWaalsContact NE2-CD2 3.32Å
50	E	89.5	Confident	87	Confident	26 Å²	26	18.8 Å²	18.8	12%	0.121	11%	0.106	C	C	.	.			trans	-67.2	153.5	179	-55.5	83.5	171.9	0	0	112.2	P52 V257 K259	E50-P52 WeakPolarHBondContact O-CD 3.5Å; E50-V257 HydrophobicContact CG-CG1 4.36Å; E50-V257 HydrophobicContact CG-CG2 4.45Å; E50-K259 VanDerWaalsContact CD-NZ 3.26Å; E50-K259 WeakPolarHBondContact OE1-CE 3.49Å; E50-K259 IonicContact OE1-NZ 3.55Å; E50-K259 PolarHBondContact OE1-NZ 2.89Å; E50-K259 WeakPolarHBondContact OE2-CE 3.2Å; E50-K259 IonicContact OE2-NZ 2.7Å; E50-K259 PolarHBondContact OE2-NZ 3.46Å
51	M	90.3	Very high	88.7	Confident	0 Å²	0	15.6 Å²	15.6	0%	0	9%	0.089	C	C	.	.			trans	-77.9	115.1	176.6	-172	-169.2	-45.9	0	0	110.9	T53 A54 I63 A67 L222 F225 G229 W234	M51-T53 PolarHBondContact O-N 2.96Å; M51-A54 HydrophobicContact SD-CB 4.27Å; M51-I63 HydrophobicContact CB-CG2 3.99Å; M51-I63 HydrophobicContact CG-CG2 4.25Å; M51-A67 HydrophobicContact CE-CB 3.55Å; M51-A67 HydrophobicContact SD-CB 3.82Å; M51-L222 HydrophobicContact CE-CD1 4.23Å; M51-F225 HydrophobicContact CB-CE2 4.06Å; M51-F225 HydrophobicContact CE-CD2 4.32Å; M51-F225 HydrophobicContact CE-CE2 4.48Å; M51-F225 HydrophobicContact CG-CE2 4.38Å; M51-F225 HydrophobicContact SD-CD2 4.32Å; M51-F225 HydrophobicContact SD-CE2 4Å; M51-F225 HydrophobicContact SD-CZ 4.17Å; M51-G229 PolarHBondContact O-N 2.96Å; M51-W234 HydrophobicContact CB-CE3 4.46Å; M51-W234 HydrophobicContact CB-CH2 3.92Å; M51-W234 HydrophobicContact CB-CZ2 4.2Å; M51-W234 HydrophobicContact CB-CZ3 4.05Å; M51-W234 HydrophobicContact CE-CD2 3.6Å; M51-W234 HydrophobicContact CE-CE3 4.26Å; M51-W234 HydrophobicContact CE-CG 3.82Å; M51-W234 HydrophobicContact CE-CH2 4.5Å; M51-W234 HydrophobicContact CE-CZ2 3.85Å
52	P	87.6	Confident	89.3	Confident	21 Å²	21	17.1 Å²	17.1	14%	0.136	10%	0.098	C	C	.	.			trans	-71.5	-26.6	-175.9	-22.8	36.7	0	0	0	115	E50 D61 S64 P228 F432	E50-P52 WeakPolarHBondContact O-CD 3.5Å; P52-D61 WeakPolarHBondContact CD-OD1 3.49Å; P52-D61 WeakPolarHBondContact CD-OD2 3.37Å; P52-D61 WeakPolarHBondContact CG-OD2 3.44Å; P52-S64 WeakPolarHBondContact CD-OG 3.47Å; P52-P228 WeakPolarHBondContact O-CB 3.28Å; P52-F432 HydrophobicContact CB-CD1 4.46Å; P52-F432 HydrophobicContact CG-CD1 3.5Å; P52-F432 VanDerWaalsContact CG-CD1 3.5Å; P52-F432 HydrophobicContact CG-CE1 3.74Å
53	T	90.4	Very high	89.6	Confident	23 Å²	23	16 Å²	16	14%	0.141	9%	0.09	C	C	.	.			trans	-163.7	153.7	175.3	-179	0	0	0	0	112.3	M51 D55 V58 A59 S64	M51-T53 PolarHBondContact O-N 2.96Å; T53-D55 PolarHBondContact OG1-N 2.82Å; T53-V58 HydrophobicContact CG2-CG2 4.41Å; T53-A59 VanDerWaalsContact CG2-CA 3.48Å; T53-A59 HydrophobicContact CG2-CB 3.88Å; T53-S64 PolarHBondContact N-OG 2.94Å; T53-S64 VanDerWaalsContact O-CB 3.3Å; T53-S64 WeakPolarHBondContact O-CB 3.48Å; T53-S64 PolarHBondContact O-OG 3.03Å
54	A	92.4	Very high	89.6	Confident	5 Å²	5	16 Å²	16	4%	0.041	9%	0.09	C	C	.	.	S	Bend	trans	-106.3	10.5	169.1	0	0	0	0	0	113.2	M51 L68 A208 L222 F225	M51-A54 HydrophobicContact SD-CB 4.27Å; A54-L68 WeakPolarHBondContact O-CD2 3.48Å; A54-A208 HydrophobicContact CB-CB 4.13Å; A54-L222 HydrophobicContact CB-CD2 3.93Å; A54-F225 HydrophobicContact CB-CD1 4.02Å; A54-F225 HydrophobicContact CB-CE1 3.59Å; A54-F225 HydrophobicContact CB-CZ 4.29Å
55	D	93.5	Very high	89.7	Confident	12 Å²	12	14 Å²	14	6%	0.064	8%	0.08	C	C	.	.			trans	-97.3	115.3	177.8	-176.5	-9.6	0	0	0	111.7	T53 S57 V58 A59 R129 Y207 A208	T53-D55 PolarHBondContact OG1-N 2.82Å; D55-S57 PolarHBondContact O-N 3.05Å; D55-S57 PolarHBondContact OD1-N 3.38Å; D55-V58 HydrophobicContact CB-CG2 3.74Å; D55-V58 PolarHBondContact O-N 3.28Å; D55-V58 VanDerWaalsContact O-N 3.11Å; D55-A59 PolarHBondContact O-N 2.84Å; D55-R129 VanDerWaalsContact CG-NH1 3.33Å; D55-R129 IonicContact OD1-CZ 2.81Å; D55-R129 IonicContact OD1-NH1 3.69Å; D55-R129 PolarHBondContact OD1-NH1 3.43Å; D55-R129 IonicContact OD1-NH2 3.84Å; D55-R129 IonicContact OD2-CZ 2.91Å; D55-R129 IonicContact OD2-NH1 3.46Å; D55-R129 PolarHBondContact OD2-NH1 2.99Å; D55-R129 VanDerWaalsContact OD2-NH1 3.09Å; D55-R129 IonicContact OD2-NH2 2.77Å; D55-R129 PolarHBondContact OD2-NH2 3.48Å; D55-Y207 HydrophobicContact CB-CE1 4.39Å; D55-A208 HydrophobicContact CB-CB 3.97Å
56	L	91.3	Very high	89.6	Confident	1 Å²	1	14 Å²	14	1%	0.005	8%	0.081	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.9	-14.1	-177.8	69.8	89.9	0	0	0	115.3	L68 Y72 F193 Q195	L56-L68 HydrophobicContact CB-CD1 3.78Å; L56-L68 HydrophobicContact CB-CD2 3.96Å; L56-L68 HydrophobicContact CB-CG 4.45Å; L56-Y72 HydrophobicContact CD2-CD1 4.26Å; L56-Y72 HydrophobicContact CD2-CD2 4.37Å; L56-Y72 HydrophobicContact CD2-CE1 4.27Å; L56-Y72 HydrophobicContact CD2-CE2 4.38Å; L56-Y72 HydrophobicContact CD2-CG 4.31Å; L56-F193 HydrophobicContact CD2-CB 4.12Å; L56-Q195 HydrophobicContact CD1-CG 3.9Å; L56-Q195 VanDerWaalsContact CD1-NE2 3.25Å; L56-Q195 HydrophobicContact CD2-CG 3.92Å; L56-Q195 HydrophobicContact CG-CG 4.01Å
57	S	91.3	Very high	89.7	Confident	0 Å²	0	14 Å²	14	0%	0	8%	0.08	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.7	-20.4	171.5	-71.9	0	0	0	0	113.5	D55 R129 T130 S137 Q195	D55-S57 PolarHBondContact O-N 3.05Å; D55-S57 PolarHBondContact OD1-N 3.38Å; S57-R129 PolarHBondContact OG-NH1 2.98Å; S57-T130 PolarHBondContact OG-OG1 3.42Å; S57-S137 WeakPolarHBondContact O-CB 3Å; S57-S137 PolarHBondContact O-OG 3.18Å; S57-Q195 PolarHBondContact OG-NE2 2.9Å
58	V	89.1	Confident	89.8	Confident	54 Å²	54	13.3 Å²	13.3	33%	0.327	8%	0.076	S	C	.	.	T	Hydrogen-bonded Turn	trans	-126.8	1.4	-176.7	-61.6	0	0	0	0	114.4	T53 D55 T135	T53-V58 HydrophobicContact CG2-CG2 4.41Å; D55-V58 HydrophobicContact CB-CG2 3.74Å; D55-V58 PolarHBondContact O-N 3.28Å; D55-V58 VanDerWaalsContact O-N 3.11Å; V58-T135 HydrophobicContact CG1-CG2 4.13Å; V58-T135 WeakPolarHBondContact CG1-O 3.42Å
59	A	89.6	Confident	90.2	Very high	1 Å²	1	12.7 Å²	12.7	1%	0.008	7%	0.074	C	C	.	.			trans	-62.1	139.3	168	0	0	0	0	0	111.7	T53 D55 F65 L68	T53-A59 VanDerWaalsContact CG2-CA 3.48Å; T53-A59 HydrophobicContact CG2-CB 3.88Å; D55-A59 PolarHBondContact O-N 2.84Å; A59-F65 HydrophobicContact CB-CD1 4.09Å; A59-F65 HydrophobicContact CB-CE1 3.67Å; A59-F65 HydrophobicContact CB-CZ 4.13Å; A59-F65 VanDerWaalsContact O-CZ 3.25Å; A59-F65 WeakPolarHBondContact O-CZ 3.49Å; A59-L68 HydrophobicContact CB-CD1 3.6Å
60	T	82.7	Confident	90.6	Very high	16 Å²	16	11.8 Å²	11.8	10%	0.098	7%	0.069	C	C	.	.			trans	-140.8	6.1	-178.1	59.7	0	0	0	0	113.7	E138 Y139	T60-E138 HydrophobicContact CG2-CB 3.86Å; T60-E138 HydrophobicContact CG2-CG 4.32Å; T60-Y139 HydrophobicContact CG2-CD2 3.83Å; T60-Y139 HydrophobicContact CG2-CE2 3.79Å; T60-Y139 PolarHBondContact O-OH 3.49Å; T60-Y139 VanDerWaalsContact O-OH 3.13Å
61	D	84.4	Confident	90.9	Very high	8 Å²	8	10.7 Å²	10.7	4%	0.043	6%	0.064	C	C	.	.	S	Bend	trans	-136.2	158.9	-167.6	75.7	91.7	0	0	0	113.5	P52 I63 S64 F65 F432	P52-D61 WeakPolarHBondContact CD-OD1 3.49Å; P52-D61 WeakPolarHBondContact CD-OD2 3.37Å; P52-D61 WeakPolarHBondContact CG-OD2 3.44Å; D61-I63 VanDerWaalsContact C-N 3.33Å; D61-I63 PolarHBondContact O-N 3.1Å; D61-I63 WeakPolarHBondContact OD1-CA 3.35Å; D61-I63 WeakPolarHBondContact OD1-CB 3.48Å; D61-I63 PolarHBondContact OD1-N 3.11Å; D61-S64 PolarHBondContact O-N 3.41Å; D61-S64 PolarHBondContact OD1-N 3.4Å; D61-S64 PolarHBondContact OD1-OG 3.2Å; D61-S64 WeakPolarHBondContact OD2-CB 3.41Å; D61-S64 PolarHBondContact OD2-OG 3.09Å; D61-F65 WeakPolarHBondContact O-CB 3.29Å; D61-F65 WeakPolarHBondContact O-CD2 3.33Å; D61-F65 WeakPolarHBondContact O-CG 3.27Å; D61-F65 PolarHBondContact O-N 3.43Å; D61-F432 HydrophobicContact CB-CE1 3.61Å; D61-F432 HydrophobicContact CB-CZ 3.5Å; D61-F432 VanDerWaalsContact CB-CZ 3.5Å
62	T	83.8	Confident	91.2	Very high	34 Å²	34	10.7 Å²	10.7	21%	0.209	6%	0.064	C	C	.	.	H	α-helix	trans	-67.5	-24.7	-173.9	53.7	0	0	0	0	114.5	A66	T62-A66 WeakPolarHBondContact O-CB 3.48Å; T62-A66 PolarHBondContact O-N 3.38Å
63	I	88.9	Confident	91.6	Very high	22 Å²	22	9.9 Å²	9.9	11%	0.113	6%	0.059	C	C	.	.	H	α-helix	trans	-79.3	-46.6	178.9	-57.8	-57.5	0	0	0	109.9	V47 Q49 M51 D61 A66 A67 W234	V47-I63 HydrophobicContact CB-CD1 4.32Å; V47-I63 HydrophobicContact CG1-CD1 4.4Å; Q49-I63 HydrophobicContact CG-CD1 4.43Å; Q49-I63 HydrophobicContact CG-CG1 3.71Å; M51-I63 HydrophobicContact CB-CG2 3.99Å; M51-I63 HydrophobicContact CG-CG2 4.25Å; D61-I63 VanDerWaalsContact C-N 3.33Å; D61-I63 PolarHBondContact O-N 3.1Å; D61-I63 WeakPolarHBondContact OD1-CA 3.35Å; D61-I63 WeakPolarHBondContact OD1-CB 3.48Å; D61-I63 PolarHBondContact OD1-N 3.11Å; I63-A66 PolarHBondContact O-N 2.88Å; I63-A67 WeakPolarHBondContact O-CB 3.27Å; I63-A67 PolarHBondContact O-N 3.46Å; I63-W234 HydrophobicContact CG2-CH2 3.8Å; I63-W234 HydrophobicContact CG2-CZ2 3.71Å
64	S	92.4	Very high	91.8	Very high	0 Å²	0	8.8 Å²	8.8	0%	0	5%	0.052	C	C	.	.	H	α-helix	trans	-58.8	-46.6	171.1	-57.4	0	0	0	0	110.8	P52 T53 D61 A66 A67 L68	P52-S64 WeakPolarHBondContact CD-OG 3.47Å; T53-S64 PolarHBondContact N-OG 2.94Å; T53-S64 VanDerWaalsContact O-CB 3.3Å; T53-S64 WeakPolarHBondContact O-CB 3.48Å; T53-S64 PolarHBondContact O-OG 3.03Å; D61-S64 PolarHBondContact O-N 3.41Å; D61-S64 PolarHBondContact OD1-N 3.4Å; D61-S64 PolarHBondContact OD1-OG 3.2Å; D61-S64 WeakPolarHBondContact OD2-CB 3.41Å; D61-S64 PolarHBondContact OD2-OG 3.09Å; S64-A66 PolarHBondContact O-N 3.42Å; S64-A67 PolarHBondContact O-N 3.35Å; S64-L68 WeakPolarHBondContact O-CB 3.48Å; S64-L68 WeakPolarHBondContact O-CG 3.43Å; S64-L68 PolarHBondContact O-N 3.2Å
65	F	93	Very high	91.9	Very high	7 Å²	7	8.6 Å²	8.6	3%	0.031	5%	0.05	C	C	.	.	H	α-helix	trans	-67.5	-35.6	178.2	-68	-46.4	0	0	0	113.7	A59 D61 L68 N69 Y139 F189 P190 A542	A59-F65 HydrophobicContact CB-CD1 4.09Å; A59-F65 HydrophobicContact CB-CE1 3.67Å; A59-F65 HydrophobicContact CB-CZ 4.13Å; A59-F65 VanDerWaalsContact O-CZ 3.25Å; A59-F65 WeakPolarHBondContact O-CZ 3.49Å; D61-F65 WeakPolarHBondContact O-CB 3.29Å; D61-F65 WeakPolarHBondContact O-CD2 3.33Å; D61-F65 WeakPolarHBondContact O-CG 3.27Å; D61-F65 PolarHBondContact O-N 3.43Å; F65-L68 HydrophobicContact CD1-CD1 4.16Å; F65-N69 WeakPolarHBondContact O-CB 3.48Å; F65-N69 PolarHBondContact O-N 3.41Å; F65-Y139 HydrophobicContact CE2-CD1 4.39Å; F65-Y139 AromaticContact CE2-CE1 3.55Å; F65-Y139 HydrophobicContact CE2-CE1 3.55Å; F65-Y139 AromaticContact CE2-CZ 3.67Å; F65-Y139 WeakPolarHBondContact CE2-OH 3.39Å; F65-Y139 AromaticContact CZ-CD1 3.83Å; F65-Y139 HydrophobicContact CZ-CD1 3.83Å; F65-Y139 AromaticContact CZ-CE1 3.45Å; F65-Y139 HydrophobicContact CZ-CE1 3.45Å; F65-Y139 VanDerWaalsContact CZ-CE1 3.45Å; F65-Y139 AromaticContact CZ-CZ 3.86Å; F65-F189 HydrophobicContact CD1-CE1 4.3Å; F65-F189 HydrophobicContact CD1-CZ 4.18Å; F65-F189 AromaticContact CD2-CZ 3.95Å; F65-F189 HydrophobicContact CD2-CZ 3.95Å; F65-F189 AromaticContact CE1-CE1 3.76Å; F65-F189 HydrophobicContact CE1-CE1 3.76Å; F65-F189 AromaticContact CE1-CZ 3.93Å; F65-F189 HydrophobicContact CE1-CZ 3.93Å; F65-F189 HydrophobicContact CE2-CE1 4.22Å; F65-F189 AromaticContact CE2-CZ 3.7Å; F65-F189 HydrophobicContact CE2-CZ 3.7Å; F65-F189 HydrophobicContact CG-CZ 4.2Å; F65-F189 AromaticContact CZ-CE1 3.72Å; F65-F189 HydrophobicContact CZ-CE1 3.72Å; F65-F189 AromaticContact CZ-CZ 3.69Å; F65-F189 HydrophobicContact CZ-CZ 3.69Å; F65-P190 HydrophobicContact CB-CG 4.39Å; F65-P190 HydrophobicContact CD1-CB 3.82Å; F65-P190 HydrophobicContact CD1-CG 3.88Å; F65-P190 HydrophobicContact CE1-CB 4.32Å; F65-P190 HydrophobicContact CG-CG 4.49Å; F65-A542 HydrophobicContact CB-CB 4.08Å; F65-A542 WeakPolarHBondContact O-CB 3.4Å
66	A	92.1	Very high	92	Very high	6 Å²	6	8 Å²	8	5%	0.05	5%	0.047	C	C	.	.	H	α-helix	trans	-63.7	-41.2	171.8	0	0	0	0	0	111.9	T62 I63 S64 N70 W544	T62-A66 WeakPolarHBondContact O-CB 3.48Å; T62-A66 PolarHBondContact O-N 3.38Å; I63-A66 PolarHBondContact O-N 2.88Å; S64-A66 PolarHBondContact O-N 3.42Å; A66-N70 PolarHBondContact O-N 3.47Å; A66-N70 PolarHBondContact O-ND2 3.3Å; A66-W544 HydrophobicContact CB-CB 4.23Å
67	A	94.1	Very high	92.1	Very high	2 Å²	2	8 Å²	8	2%	0.017	5%	0.047	C	C	.	.	H	α-helix	trans	-63.3	-53.4	174.2	0	0	0	0	0	111.3	M51 I63 S64 N69 N70 V71 Y236	M51-A67 HydrophobicContact CE-CB 3.55Å; M51-A67 HydrophobicContact SD-CB 3.82Å; I63-A67 WeakPolarHBondContact O-CB 3.27Å; I63-A67 PolarHBondContact O-N 3.46Å; S64-A67 PolarHBondContact O-N 3.35Å; A67-N69 PolarHBondContact O-N 2.7Å; A67-N70 PolarHBondContact O-N 2.96Å; A67-V71 WeakPolarHBondContact O-CG2 3.29Å; A67-V71 PolarHBondContact O-N 2.91Å; A67-Y236 WeakPolarHBondContact CA-OH 3.48Å; A67-Y236 HydrophobicContact CB-CE1 3.83Å; A67-Y236 WeakPolarHBondContact CB-OH 3.46Å
68	L	95.5	Very high	92.1	Very high	3 Å²	3	8.8 Å²	8.8	2%	0.016	5%	0.051	C	C	.	.	H	α-helix	trans	-57.8	-43.6	-179.9	-70.3	170.7	0	0	0	112.5	A54 L56 A59 S64 F65 N70 V71 Y72 P190	A54-L68 WeakPolarHBondContact O-CD2 3.48Å; L56-L68 HydrophobicContact CB-CD1 3.78Å; L56-L68 HydrophobicContact CB-CD2 3.96Å; L56-L68 HydrophobicContact CB-CG 4.45Å; A59-L68 HydrophobicContact CB-CD1 3.6Å; S64-L68 WeakPolarHBondContact O-CB 3.48Å; S64-L68 WeakPolarHBondContact O-CG 3.43Å; S64-L68 PolarHBondContact O-N 3.2Å; F65-L68 HydrophobicContact CD1-CD1 4.16Å; L68-N70 PolarHBondContact O-N 2.84Å; L68-V71 PolarHBondContact O-N 2.93Å; L68-Y72 HydrophobicContact CD2-CD2 3.59Å; L68-Y72 HydrophobicContact CD2-CE2 3.54Å; L68-Y72 WeakPolarHBondContact O-CB 3.44Å; L68-Y72 PolarHBondContact O-N 3.25Å; L68-P190 HydrophobicContact CB-CB 3.96Å; L68-P190 HydrophobicContact CB-CG 4.41Å; L68-P190 HydrophobicContact CD1-CB 4.32Å
69	N	95.3	Very high	92.2	Very high	7 Å²	7	8 Å²	8	4%	0.037	5%	0.045	C	C	.	.	H	α-helix	trans	-61.8	-28.1	176	-177.3	44.7	0	0	0	112.9	F65 A67 R77 A542 W544	F65-N69 WeakPolarHBondContact O-CB 3.48Å; F65-N69 PolarHBondContact O-N 3.41Å; A67-N69 PolarHBondContact O-N 2.7Å; N69-R77 VanDerWaalsContact O-CZ 3.22Å; N69-R77 PolarHBondContact O-NH1 3.5Å; N69-R77 PolarHBondContact O-NH2 3.21Å; N69-R77 PolarHBondContact OD1-NH1 3.22Å; N69-A542 HydrophobicContact CB-CB 3.49Å; N69-A542 VanDerWaalsContact CB-CB 3.49Å; N69-W544 PolarHBondContact ND2-O 2.7Å
70	N	96.1	Very high	92	Very high	0 Å²	0	13.2 Å²	13.2	0%	0	7%	0.068	C	C	.	.	H	α-helix	trans	-89	-23.7	178.4	-76.2	-83.1	0	0	0	113.2	A66 A67 L68 P219 F220 Y236 W544 Y546	A66-N70 PolarHBondContact O-N 3.47Å; A66-N70 PolarHBondContact O-ND2 3.3Å; A67-N70 PolarHBondContact O-N 2.96Å; L68-N70 PolarHBondContact O-N 2.84Å; N70-P219 WeakPolarHBondContact O-CD 3.28Å; N70-P219 WeakPolarHBondContact O-CG 3.31Å; N70-F220 HydrophobicContact CB-CD2 4.07Å; N70-F220 WeakPolarHBondContact O-CB 3.26Å; N70-F220 WeakPolarHBondContact O-CD2 3.32Å; N70-F220 PolarHBondContact O-N 2.86Å; N70-Y236 HydrophobicContact CB-CD2 4.22Å; N70-Y236 HydrophobicContact CB-CE2 4.46Å; N70-W544 PolarHBondContact ND2-O 2.87Å; N70-Y546 WeakPolarHBondContact OD1-CB 3.32Å; N70-Y546 WeakPolarHBondContact OD1-CD2 3.24Å; N70-Y546 PolarHBondContact OD1-N 2.94Å
71	V	96.2	Very high	92	Very high	2 Å²	2	17.7 Å²	17.7	1%	0.012	9%	0.091	C	C	.	.	H	α-helix	trans	-108.7	-11.2	-177.9	-50	0	0	0	0	115.2	A67 L68 Y216 N217 G218 F220 L222 Y236	A67-V71 WeakPolarHBondContact O-CG2 3.29Å; A67-V71 PolarHBondContact O-N 2.91Å; L68-V71 PolarHBondContact O-N 2.93Å; V71-Y216 HydrophobicContact CB-CD1 3.79Å; V71-Y216 HydrophobicContact CB-CE1 4.36Å; V71-Y216 HydrophobicContact CB-CG 4.28Å; V71-Y216 HydrophobicContact CG2-CD1 3.62Å; V71-Y216 HydrophobicContact CG2-CE1 3.87Å; V71-Y216 VanDerWaalsContact O-CB 3.29Å; V71-Y216 WeakPolarHBondContact O-CB 3.46Å; V71-N217 PolarHBondContact O-N 3.15Å; V71-G218 WeakPolarHBondContact O-CA 3.28Å; V71-G218 PolarHBondContact O-N 2.92Å; V71-F220 VanDerWaalsContact CA-O 3.3Å; V71-F220 WeakPolarHBondContact CA-O 3.49Å; V71-F220 HydrophobicContact CG1-CB 4.26Å; V71-L222 HydrophobicContact CG1-CB 4.08Å; V71-L222 HydrophobicContact CG2-CB 4.46Å; V71-Y236 HydrophobicContact CG1-CD1 3.99Å
72	Y	96.7	Very high	92.1	Very high	1 Å²	1	19.8 Å²	19.8	0%	0.004	10%	0.102	C	C	.	.			trans	-124	166.3	171.4	-67.2	-88	0	0	0	111.4	L56 L68 W112 Y207 V215 Y216 N217	L56-Y72 HydrophobicContact CD2-CD1 4.26Å; L56-Y72 HydrophobicContact CD2-CD2 4.37Å; L56-Y72 HydrophobicContact CD2-CE1 4.27Å; L56-Y72 HydrophobicContact CD2-CE2 4.38Å; L56-Y72 HydrophobicContact CD2-CG 4.31Å; L68-Y72 HydrophobicContact CD2-CD2 3.59Å; L68-Y72 HydrophobicContact CD2-CE2 3.54Å; L68-Y72 WeakPolarHBondContact O-CB 3.44Å; L68-Y72 PolarHBondContact O-N 3.25Å; Y72-W112 HydrophobicContact CD1-CH2 4.28Å; Y72-W112 AromaticContact CD1-CZ3 3.86Å; Y72-W112 HydrophobicContact CD1-CZ3 3.86Å; Y72-W112 HydrophobicContact CE1-CH2 4.22Å; Y72-W112 AromaticContact CE1-CZ3 3.74Å; Y72-W112 HydrophobicContact CE1-CZ3 3.74Å; Y72-Y207 PolarHBondContact OH-OH 2.61Å; Y72-Y207 VanDerWaalsContact OH-OH 3.13Å; Y72-V215 WeakPolarHBondContact CE1-O 3.2Å; Y72-V215 PolarHBondContact OH-O 3Å; Y72-Y216 HydrophobicContact CD2-CD1 4.49Å; Y72-Y216 HydrophobicContact CE1-CD1 4.46Å; Y72-Y216 AromaticContact CE2-CD1 3.98Å; Y72-Y216 HydrophobicContact CE2-CD1 3.98Å; Y72-Y216 HydrophobicContact CE2-CE1 4.12Å; Y72-Y216 AromaticContact CZ-CD1 3.97Å; Y72-N217 VanDerWaalsContact CA-OD1 3.23Å; Y72-N217 WeakPolarHBondContact CA-OD1 3.45Å
73	E	94.8	Very high	92.3	Very high	3 Å²	3	23.3 Å²	23.3	1%	0.014	12%	0.115	C	C	.	.			trans	-144.1	134.8	173.2	-173.8	169	-95.1	0	0	110.9	A87 P194 N217 Y242 W243 K547	E73-A87 HydrophobicContact CG-CB 3.7Å; E73-P194 VanDerWaalsContact O-CD 3.28Å; E73-P194 WeakPolarHBondContact O-CD 3.41Å; E73-N217 PolarHBondContact N-OD1 3.12Å; E73-N217 PolarHBondContact O-ND2 3.21Å; E73-Y242 PolarHBondContact OE1-OH 2.88Å; E73-Y242 WeakPolarHBondContact OE2-CE2 3.29Å; E73-W243 PolarHBondContact OE2-NE1 2.59Å; E73-K547 IonicContact OE1-NZ 3.08Å
74	G	94.3	Very high	92.3	Very high	0 Å²	0	23.6 Å²	23.6	0%	0	12%	0.118	C	C	.	.			trans	-94.9	-166.3	-179.5	0	0	0	0	0	114.6	Y76 G88	G74-Y76 VanDerWaalsContact C-N 3.25Å; G74-Y76 CarbonylContact C-O 3.53Å; G74-Y76 PolarHBondContact O-N 3.11Å; G74-G88 VanDerWaalsContact O-CA 3.27Å; G74-G88 WeakPolarHBondContact O-CA 3.37Å; G74-G88 PolarHBondContact O-N 3.29Å
75	I	95.9	Very high	92.3	Very high	1 Å²	1	26.6 Å²	26.6	1%	0.005	13%	0.132	C	C	.	.	S	Bend	trans	-54.8	-46.3	173.4	-75.6	162.9	0	0	0	110	A87 G88 A89 V93 V104 L106 Y123 W127 L172 I174 L187	I75-A87 PolarHBondContact O-N 2.88Å; I75-A87 VanDerWaalsContact O-N 3.14Å; I75-G88 PolarHBondContact O-N 3.21Å; I75-A89 HydrophobicContact CG2-CB 4.17Å; I75-A89 VanDerWaalsContact O-CB 3.3Å; I75-A89 WeakPolarHBondContact O-CB 3.49Å; I75-A89 PolarHBondContact O-N 3.22Å; I75-V93 HydrophobicContact CG2-CG2 3.9Å; I75-V104 HydrophobicContact CD1-CG2 4.3Å; I75-V104 HydrophobicContact CG1-CG1 4.24Å; I75-V104 HydrophobicContact CG2-CG1 3.85Å; I75-V104 HydrophobicContact CG2-CG2 4.34Å; I75-L106 HydrophobicContact CG1-CD2 4.35Å; I75-Y123 HydrophobicContact CD1-CD1 4.06Å; I75-Y123 HydrophobicContact CD1-CE1 4.15Å; I75-Y123 HydrophobicContact CG1-CD1 4.03Å; I75-Y123 HydrophobicContact CG1-CE1 3.61Å; I75-W127 HydrophobicContact CD1-CZ2 4.11Å; I75-L172 HydrophobicContact CD1-CD1 4.1Å; I75-I174 HydrophobicContact CD1-CD1 4.12Å; I75-L187 HydrophobicContact CB-CB 4.39Å; I75-L187 HydrophobicContact CB-CD2 4.49Å; I75-L187 HydrophobicContact CD1-CD2 3.85Å; I75-L187 HydrophobicContact CG2-CB 4.24Å; I75-L187 HydrophobicContact CG2-CD1 4.25Å; I75-L187 HydrophobicContact CG2-CD2 4.44Å
76	Y	95.3	Very high	92.3	Very high	1 Å²	1	28.9 Å²	28.9	0%	0.004	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	169.8	168.8	-66.9	-29.6	0	0	0	111.7	G74 P84 Q85 P86 K92 V93 D184 L187 A188	G74-Y76 VanDerWaalsContact C-N 3.25Å; G74-Y76 CarbonylContact C-O 3.53Å; G74-Y76 PolarHBondContact O-N 3.11Å; Y76-P84 HydrophobicContact CD2-CB 3.68Å; Y76-P84 HydrophobicContact CE2-CB 4.3Å; Y76-P84 HydrophobicContact CG-CB 4.17Å; Y76-Q85 WeakPolarHBondContact CA-O 3.49Å; Y76-Q85 WeakPolarHBondContact CB-O 3.37Å; Y76-Q85 WeakPolarHBondContact CD1-O 3.49Å; Y76-P86 HydrophobicContact CE1-CG 4.23Å; Y76-K92 WeakPolarHBondContact OH-CE 3.19Å; Y76-K92 VanDerWaalsContact OH-CG 3.28Å; Y76-K92 WeakPolarHBondContact OH-CG 3.32Å; Y76-V93 HydrophobicContact CE1-CG2 3.82Å; Y76-V93 HydrophobicContact CE2-CG2 4.36Å; Y76-V93 WeakPolarHBondContact OH-CB 3.32Å; Y76-V93 WeakPolarHBondContact OH-CG2 3.33Å; Y76-V93 PolarHBondContact OH-N 2.89Å; Y76-D184 HydrophobicContact CD2-CB 4.48Å; Y76-D184 WeakPolarHBondContact CD2-O 3.39Å; Y76-D184 HydrophobicContact CE2-CB 4.05Å; Y76-L187 HydrophobicContact CD2-CB 3.79Å; Y76-L187 HydrophobicContact CD2-CD1 4.37Å; Y76-L187 HydrophobicContact CE2-CB 4.41Å; Y76-L187 HydrophobicContact CE2-CD1 4.17Å; Y76-L187 HydrophobicContact CG-CB 4.37Å; Y76-L187 PolarHBondContact N-O 3.18Å; Y76-A188 WeakPolarHBondContact O-CA 3.39Å
77	R	93.4	Very high	92.4	Very high	1 Å²	1	28.8 Å²	28.8	0%	0.004	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	157.1	163.9	-167.8	-179.2	-171.7	82.4	1.9	107.2	N69 Q85 A87 D545	N69-R77 VanDerWaalsContact O-CZ 3.22Å; N69-R77 PolarHBondContact O-NH1 3.5Å; N69-R77 PolarHBondContact O-NH2 3.21Å; N69-R77 PolarHBondContact OD1-NH1 3.22Å; R77-Q85 PolarHBondContact N-O 2.96Å; R77-Q85 VanDerWaalsContact N-O 3.08Å; R77-Q85 WeakPolarHBondContact O-CG 3.48Å; R77-Q85 PolarHBondContact O-N 3.4Å; R77-A87 HydrophobicContact CB-CB 3.75Å; R77-D545 IonicContact CZ-OD1 2.94Å; R77-D545 IonicContact CZ-OD2 3.71Å; R77-D545 IonicContact NE-OD1 3.07Å; R77-D545 IonicContact NE-OD2 2.83Å; R77-D545 PolarHBondContact NE-OD2 3.12Å; R77-D545 IonicContact NH2-OD1 2.75Å; R77-D545 PolarHBondContact NH2-OD1 3.22Å; R77-D545 IonicContact NH2-OD2 2.72Å; R77-D545 PolarHBondContact NH2-OD2 3.38Å; R77-D545 VanDerWaalsContact NH2-OD2 3.12Å
78	L	91.6	Very high	92.3	Very high	16 Å²	16	28.9 Å²	28.9	8%	0.084	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71	153.1	168.8	-62	-177.7	0	0	0	111	K83 P84 Q85 Y185 A188 H538	L78-K83 CarbonylContact C-O 3.54Å; L78-K83 WeakPolarHBondContact CA-O 3.45Å; L78-P84 HydrophobicContact CD2-CG 4Å; L78-Q85 PolarHBondContact O-NE2 3.05Å; L78-Y185 HydrophobicContact CD2-CD1 3.99Å; L78-Y185 HydrophobicContact CD2-CE1 4.2Å; L78-A188 HydrophobicContact CD2-CB 4.09Å; L78-A188 HydrophobicContact CG-CB 4.38Å; L78-H538 HydrophobicContact CD1-CB 4.03Å
79	D	89.4	Confident	92.2	Very high	37 Å²	37	28.9 Å²	28.9	20%	0.198	15%	0.148	C	C	.	.			trans	-99.3	-180	168.9	80.5	3.2	0	0	0	111.6	D81 N82 K83 Q85 H538	D79-D81 PolarHBondContact O-N 2.98Å; D79-D81 VanDerWaalsContact OD1-C 3.28Å; D79-D81 WeakPolarHBondContact OD1-CA 3.45Å; D79-D81 WeakPolarHBondContact OD1-CB 3.11Å; D79-D81 PolarHBondContact OD1-N 2.76Å; D79-N82 WeakPolarHBondContact O-CA 3.48Å; D79-N82 PolarHBondContact O-N 2.63Å; D79-N82 PolarHBondContact OD1-N 3.34Å; D79-N82 VanDerWaalsContact OD1-N 3.1Å; D79-K83 PolarHBondContact N-O 3.27Å; D79-K83 PolarHBondContact OD1-N 2.97Å; D79-Q85 HydrophobicContact CB-CG 4.05Å; D79-H538 PolarHBondContact O-CE1 2.67Å
80	K	85.6	Confident	92	Very high	111 Å²	111	31.4 Å²	31.4	48%	0.483	17%	0.166	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.3	-13	-176.3	-51.4	-171	179.8	172.4	0	113.9	V536 W548	K80-V536 HydrophobicContact CD-CG2 4.17Å; K80-V536 HydrophobicContact CG-CG2 3.94Å; K80-W548 HydrophobicContact CG-CE3 4.3Å; K80-W548 HydrophobicContact CG-CZ3 4.33Å
81	D	83	Confident	91.7	Very high	109 Å²	109	35.9 Å²	35.9	58%	0.583	19%	0.187	S	C	*	.	T	Hydrogen-bonded Turn	trans	-101.6	12.4	174.1	-60.8	-19.5	0	0	0	111.1	D79 K83	D79-D81 PolarHBondContact O-N 2.98Å; D79-D81 VanDerWaalsContact OD1-C 3.28Å; D79-D81 WeakPolarHBondContact OD1-CA 3.45Å; D79-D81 WeakPolarHBondContact OD1-CB 3.11Å; D79-D81 PolarHBondContact OD1-N 2.76Å; D81-K83 HydrophobicContact CB-CD 4.34Å; D81-K83 IonicContact OD2-NZ 3.76Å
82	N	86.8	Confident	91.4	Very high	53 Å²	53	42 Å²	42	28%	0.283	21%	0.214	S	C	.	.	S	Bend	trans	65.9	31.8	-178.8	-48.6	-60.7	0	0	0	115.2	D79 Y185 H538	D79-N82 WeakPolarHBondContact O-CA 3.48Å; D79-N82 PolarHBondContact O-N 2.63Å; D79-N82 PolarHBondContact OD1-N 3.34Å; D79-N82 VanDerWaalsContact OD1-N 3.1Å; N82-Y185 WeakPolarHBondContact O-CE1 3.46Å; N82-H538 WeakPolarHBondContact OD1-CA 3.4Å; N82-H538 PolarHBondContact OD1-ND1 3.34Å
83	K	87.6	Confident	91.2	Very high	108 Å²	108	42.5 Å²	42.5	47%	0.47	22%	0.216	S	C	.	.			trans	-107.1	140	179.7	-63.5	164.4	-170.4	152.9	0	112.2	L78 D79 D81 Q85	L78-K83 CarbonylContact C-O 3.54Å; L78-K83 WeakPolarHBondContact CA-O 3.45Å; D79-K83 PolarHBondContact N-O 3.27Å; D79-K83 PolarHBondContact OD1-N 2.97Å; D81-K83 HydrophobicContact CB-CD 4.34Å; D81-K83 IonicContact OD2-NZ 3.76Å; K83-Q85 PolarHBondContact O-N 2.66Å
84	P	90.3	Very high	91	Very high	27 Å²	27	49.4 Å²	49.4	18%	0.175	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-62	127.7	171.2	-23.5	34.5	0	0	0	112.4	Y76 L78 D184 Y185 A188	Y76-P84 HydrophobicContact CD2-CB 3.68Å; Y76-P84 HydrophobicContact CE2-CB 4.3Å; Y76-P84 HydrophobicContact CG-CB 4.17Å; L78-P84 HydrophobicContact CD2-CG 4Å; P84-D184 HydrophobicContact CB-CB 4.34Å; P84-D184 VanDerWaalsContact CB-O 3.24Å; P84-D184 WeakPolarHBondContact CB-O 3.49Å; P84-D184 HydrophobicContact CG-CB 4.25Å; P84-D184 VanDerWaalsContact CG-O 3.26Å; P84-D184 WeakPolarHBondContact CG-O 3.36Å; P84-Y185 HydrophobicContact CG-CD1 3.84Å; P84-Y185 HydrophobicContact CG-CD2 4.13Å; P84-Y185 HydrophobicContact CG-CE1 4.01Å; P84-Y185 HydrophobicContact CG-CE2 4.29Å; P84-Y185 HydrophobicContact CG-CG 3.89Å; P84-A188 HydrophobicContact CB-CB 4.43Å
85	Q	91.8	Very high	90.8	Very high	64 Å²	64	52 Å²	52	30%	0.299	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	149.5	177.6	51.3	170.6	-13.5	0	0	111.2	Y76 R77 L78 D79 K83 A87	Y76-Q85 WeakPolarHBondContact CA-O 3.49Å; Y76-Q85 WeakPolarHBondContact CB-O 3.37Å; Y76-Q85 WeakPolarHBondContact CD1-O 3.49Å; R77-Q85 PolarHBondContact N-O 2.96Å; R77-Q85 VanDerWaalsContact N-O 3.08Å; R77-Q85 WeakPolarHBondContact O-CG 3.48Å; R77-Q85 PolarHBondContact O-N 3.4Å; L78-Q85 PolarHBondContact O-NE2 3.05Å; D79-Q85 HydrophobicContact CB-CG 4.05Å; K83-Q85 PolarHBondContact O-N 2.66Å; Q85-A87 PolarHBondContact O-N 3.08Å
86	P	93	Very high	90.4	Very high	55 Å²	55	53.8 Å²	53.8	36%	0.357	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-49.8	123.4	172.2	-28.6	37	0	0	0	112.9	Y76 A89 K92	Y76-P86 HydrophobicContact CE1-CG 4.23Å; P86-A89 HydrophobicContact CB-CB 4.49Å; P86-K92 HydrophobicContact CG-CB 4.38Å
87	A	93.1	Very high	89.6	Confident	3 Å²	3	62.3 Å²	62.3	3%	0.025	32%	0.321	C	S	.	.	S	Bend	trans	-127.9	-84.3	-178.2	0	0	0	0	0	110.3	E73 I75 R77 Q85 A89 R107	E73-A87 HydrophobicContact CG-CB 3.7Å; I75-A87 PolarHBondContact O-N 2.88Å; I75-A87 VanDerWaalsContact O-N 3.14Å; R77-A87 HydrophobicContact CB-CB 3.75Å; Q85-A87 PolarHBondContact O-N 3.08Å; A87-A89 PolarHBondContact O-N 3.34Å; A87-R107 WeakPolarHBondContact O-CD 3.37Å
88	G	92.1	Very high	89	Confident	5 Å²	5	66.5 Å²	66.5	5%	0.052	34%	0.343	C	S	.	.	S	Bend	trans	-70.3	-19.2	164.9	0	0	0	0	0	113.3	G74 I75 L106 R107	G74-G88 VanDerWaalsContact O-CA 3.27Å; G74-G88 WeakPolarHBondContact O-CA 3.37Å; G74-G88 PolarHBondContact O-N 3.29Å; I75-G88 PolarHBondContact O-N 3.21Å; G88-L106 CarbonylContact O-C 3.56Å; G88-L106 WeakPolarHBondContact O-CA 3.3Å; G88-R107 PolarHBondContact O-N 3.03Å
89	A	93.6	Very high	88.6	Confident	2 Å²	2	66.6 Å²	66.6	2%	0.017	35%	0.348	C	S	.	.	B	Isolated β-bridge	trans	-78.7	139.6	165.7	0	0	0	0	0	112.1	I75 P86 A87 V104 K105	I75-A89 HydrophobicContact CG2-CB 4.17Å; I75-A89 VanDerWaalsContact O-CB 3.3Å; I75-A89 WeakPolarHBondContact O-CB 3.49Å; I75-A89 PolarHBondContact O-N 3.22Å; P86-A89 HydrophobicContact CB-CB 4.49Å; A87-A89 PolarHBondContact O-N 3.34Å; A89-V104 HydrophobicContact CB-CG1 3.96Å; A89-K105 CarbonylContact C-O 3.33Å; A89-K105 VanDerWaalsContact CA-O 3.25Å; A89-K105 WeakPolarHBondContact CA-O 3.38Å
90	S	90.9	Very high	88.6	Confident	60 Å²	60	68.4 Å²	68.4	42%	0.42	35%	0.354	S	S	.	.	S	Bend	trans	-81.2	-20.5	178.5	45.6	0	0	0	0	114	K105 L106	S90-K105 PolarHBondContact N-O 2.87Å; S90-K105 WeakPolarHBondContact OG-CB 3.43Å; S90-K105 PolarHBondContact OG-O 2.92Å; S90-L106 WeakPolarHBondContact CB-O 3.27Å; S90-L106 PolarHBondContact OG-O 3.18Å
91	E	90.5	Very high	88.9	Confident	94 Å²	94	64.9 Å²	64.9	44%	0.439	34%	0.342	S	S	.	.	S	Bend	trans	-146.4	175.2	174.1	60.6	-176.9	-168.6	0	0	110.5	V93 K105	E91-V93 PolarHBondContact O-N 3.02Å; E91-K105 WeakPolarHBondContact OE1-CD 3.46Å; E91-K105 VanDerWaalsContact OE1-CE 3.29Å; E91-K105 WeakPolarHBondContact OE1-CE 3.31Å; E91-K105 IonicContact OE1-NZ 2.77Å; E91-K105 PolarHBondContact OE1-NZ 3.48Å; E91-K105 IonicContact OE2-NZ 3.98Å
92	K	89.1	Confident	89.5	Confident	132 Å²	132	60.5 Å²	60.5	57%	0.574	32%	0.317	S	S	*	.			trans	-63.9	133.7	174.8	-169.8	174.9	178.2	165.7	0	109.5	Y76 P86 K94 D184	Y76-K92 WeakPolarHBondContact OH-CE 3.19Å; Y76-K92 VanDerWaalsContact OH-CG 3.28Å; Y76-K92 WeakPolarHBondContact OH-CG 3.32Å; P86-K92 HydrophobicContact CG-CB 4.38Å; K92-K94 PolarHBondContact O-N 3.33Å; K92-D184 VanDerWaalsContact CE-OD2 3.31Å; K92-D184 WeakPolarHBondContact CE-OD2 3.49Å; K92-D184 IonicContact NZ-OD2 2.72Å; K92-D184 PolarHBondContact NZ-OD2 2.86Å
93	V	92.9	Very high	89.9	Confident	10 Å²	10	59.9 Å²	59.9	6%	0.061	32%	0.316	C	S	.	.			trans	-56.5	133.1	-179.5	-179.4	0	0	0	0	110.5	I75 Y76 E91 V95 Y102 V104	I75-V93 HydrophobicContact CG2-CG2 3.9Å; Y76-V93 HydrophobicContact CE1-CG2 3.82Å; Y76-V93 HydrophobicContact CE2-CG2 4.36Å; Y76-V93 WeakPolarHBondContact OH-CB 3.32Å; Y76-V93 WeakPolarHBondContact OH-CG2 3.33Å; Y76-V93 PolarHBondContact OH-N 2.89Å; E91-V93 PolarHBondContact O-N 3.02Å; V93-V95 PolarHBondContact O-N 3.24Å; V93-Y102 HydrophobicContact CG1-CD1 3.69Å; V93-Y102 HydrophobicContact CG1-CG 4.2Å; V93-V104 HydrophobicContact CB-CG2 4.46Å; V93-V104 HydrophobicContact CG1-CG2 3.76Å; V93-V104 HydrophobicContact CG2-CB 4.28Å; V93-V104 HydrophobicContact CG2-CG1 4.05Å; V93-V104 HydrophobicContact CG2-CG2 3.8Å
94	K	90.4	Very high	90.3	Very high	149 Å²	149	54.8 Å²	54.8	65%	0.648	29%	0.293	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86.9	110.3	179.1	-177	-166	172.9	-163.4	0	109.3	K92 T103	K92-K94 PolarHBondContact O-N 3.33Å; K94-T103 PolarHBondContact N-O 2.9Å; K94-T103 PolarHBondContact O-N 2.89Å
95	V	89.9	Confident	90.5	Very high	53 Å²	53	57.8 Å²	57.8	32%	0.321	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	146.8	173.4	-165.1	0	0	0	0	110.1	V93 T101 Y102	V93-V95 PolarHBondContact O-N 3.24Å; V95-T101 CarbonylContact C-O 3.49Å; V95-T101 WeakPolarHBondContact CA-O 3.33Å; V95-Y102 HydrophobicContact CG1-CD2 3.97Å; V95-Y102 HydrophobicContact CG1-CE1 4.46Å; V95-Y102 HydrophobicContact CG1-CE2 3.6Å; V95-Y102 HydrophobicContact CG2-CD1 3.79Å; V95-Y102 HydrophobicContact CG2-CD2 4.4Å; V95-Y102 HydrophobicContact CG2-CE1 3.51Å; V95-Y102 HydrophobicContact CG2-CE2 4.17Å; V95-Y102 HydrophobicContact CG2-CG 4.21Å
96	S	88.9	Confident	90.7	Very high	39 Å²	39	55.1 Å²	55.1	27%	0.273	29%	0.291	S	S	.	.			trans	-74.9	159.8	170.3	51.5	0	0	0	0	112.8	D98 G99 T101	S96-D98 WeakPolarHBondContact CB-OD1 3.38Å; S96-D98 PolarHBondContact O-N 3.43Å; S96-D98 VanDerWaalsContact O-N 3.08Å; S96-D98 PolarHBondContact OG-OD1 3.38Å; S96-G99 PolarHBondContact O-N 3.34Å; S96-T101 PolarHBondContact N-O 3.05Å; S96-T101 WeakPolarHBondContact OG-CA 3.25Å; S96-T101 WeakPolarHBondContact OG-CB 3.45Å; S96-T101 PolarHBondContact OG-N 2.99Å; S96-T101 PolarHBondContact OG-O 3.03Å
97	D	77.2	Confident	90.8	Very high	181 Å²	181	55.1 Å²	55.1	97%	0.968	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.8	-18.5	-177.5	-54.9	-40.1	0	0	0	114
98	D	81.8	Confident	90.7	Very high	88 Å²	88	62.2 Å²	62.2	47%	0.471	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.7	-0.9	175	74.6	-21.6	0	0	0	113.9	S96 K100 P179	S96-D98 WeakPolarHBondContact CB-OD1 3.38Å; S96-D98 PolarHBondContact O-N 3.43Å; S96-D98 VanDerWaalsContact O-N 3.08Å; S96-D98 PolarHBondContact OG-OD1 3.38Å; D98-K100 VanDerWaalsContact C-N 3.27Å; D98-K100 PolarHBondContact O-N 2.91Å; D98-K100 PolarHBondContact OD1-N 3.05Å; D98-K100 VanDerWaalsContact OD1-N 3.1Å; D98-P179 WeakPolarHBondContact O-CG 3.45Å
99	G	82.2	Confident	90.7	Very high	19 Å²	19	65.6 Å²	65.6	20%	0.196	33%	0.334	C	S	.	.	S	Bend	trans	71.5	10.9	-179.6	0	0	0	0	0	115.5	S96	S96-G99 PolarHBondContact O-N 3.34Å
100	K	89.6	Confident	90.7	Very high	75 Å²	75	66 Å²	66	33%	0.326	34%	0.337	S	S	.	.			trans	-106.1	-27.8	-173.4	-62.5	-166.1	179.8	-156.2	0	115.9	D98 K175 L176 A177 P179	D98-K100 VanDerWaalsContact C-N 3.27Å; D98-K100 PolarHBondContact O-N 2.91Å; D98-K100 PolarHBondContact OD1-N 3.05Å; D98-K100 VanDerWaalsContact OD1-N 3.1Å; K100-K175 CarbonylContact O-C 3.54Å; K100-K175 WeakPolarHBondContact O-CA 3.39Å; K100-L176 PolarHBondContact O-N 3.18Å; K100-A177 PolarHBondContact NZ-O 3.41Å; K100-P179 HydrophobicContact CG-CG 4.33Å
101	T	93	Very high	90.9	Very high	37 Å²	37	67.3 Å²	67.3	23%	0.227	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	121.5	-176.4	-50.1	0	0	0	0	110.1	V95 S96 E173 I174 K175	V95-T101 CarbonylContact C-O 3.49Å; V95-T101 WeakPolarHBondContact CA-O 3.33Å; S96-T101 PolarHBondContact N-O 3.05Å; S96-T101 WeakPolarHBondContact OG-CA 3.25Å; S96-T101 WeakPolarHBondContact OG-CB 3.45Å; S96-T101 PolarHBondContact OG-N 2.99Å; S96-T101 PolarHBondContact OG-O 3.03Å; T101-E173 HydrophobicContact CG2-CG 4.2Å; T101-I174 WeakPolarHBondContact CA-O 3.41Å; T101-K175 HydrophobicContact CG2-CG 4.46Å
102	Y	95.5	Very high	91.2	Very high	17 Å²	17	62.9 Å²	62.9	7%	0.067	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	109.5	-178.7	-79.9	-117.6	0	0	0	108.5	V93 V95 I174 L176 F183 L187	V93-Y102 HydrophobicContact CG1-CD1 3.69Å; V93-Y102 HydrophobicContact CG1-CG 4.2Å; V95-Y102 HydrophobicContact CG1-CD2 3.97Å; V95-Y102 HydrophobicContact CG1-CE1 4.46Å; V95-Y102 HydrophobicContact CG1-CE2 3.6Å; V95-Y102 HydrophobicContact CG2-CD1 3.79Å; V95-Y102 HydrophobicContact CG2-CD2 4.4Å; V95-Y102 HydrophobicContact CG2-CE1 3.51Å; V95-Y102 HydrophobicContact CG2-CE2 4.17Å; V95-Y102 HydrophobicContact CG2-CG 4.21Å; Y102-I174 PolarHBondContact N-O 3.44Å; Y102-I174 PolarHBondContact O-N 2.98Å; Y102-L176 HydrophobicContact CD2-CD1 4.16Å; Y102-L176 HydrophobicContact CD2-CG 4.33Å; Y102-L176 HydrophobicContact CE2-CD1 3.61Å; Y102-L176 HydrophobicContact CE2-CG 4.27Å; Y102-F183 HydrophobicContact CD1-CD1 4Å; Y102-F183 HydrophobicContact CD1-CE1 4.36Å; Y102-F183 HydrophobicContact CD2-CD1 4.48Å; Y102-F183 AromaticContact CE1-CD1 3.74Å; Y102-F183 HydrophobicContact CE1-CD1 3.74Å; Y102-F183 HydrophobicContact CE2-CD1 4.25Å; Y102-F183 HydrophobicContact CG-CD1 4.4Å; Y102-F183 AromaticContact CZ-CD1 3.88Å; Y102-L187 HydrophobicContact CD1-CD1 4.17Å; Y102-L187 HydrophobicContact CE1-CD1 4.46Å
103	T	94.5	Very high	91.5	Very high	40 Å²	40	58.5 Å²	58.5	25%	0.245	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	110.3	173.7	-49.2	0	0	0	0	109.7	K94 E171 L172	K94-T103 PolarHBondContact N-O 2.9Å; K94-T103 PolarHBondContact O-N 2.89Å; T103-E171 HydrophobicContact CG2-CG 4.31Å; T103-L172 WeakPolarHBondContact CA-O 3.42Å
104	V	95.9	Very high	91.5	Very high	0 Å²	0	61.5 Å²	61.5	0%	0	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	124.9	179.3	-170.8	0	0	0	0	109.3	I75 A89 V93 L106 E171 L172 I174	I75-V104 HydrophobicContact CD1-CG2 4.3Å; I75-V104 HydrophobicContact CG1-CG1 4.24Å; I75-V104 HydrophobicContact CG2-CG1 3.85Å; I75-V104 HydrophobicContact CG2-CG2 4.34Å; A89-V104 HydrophobicContact CB-CG1 3.96Å; V93-V104 HydrophobicContact CB-CG2 4.46Å; V93-V104 HydrophobicContact CG1-CG2 3.76Å; V93-V104 HydrophobicContact CG2-CB 4.28Å; V93-V104 HydrophobicContact CG2-CG1 4.05Å; V93-V104 HydrophobicContact CG2-CG2 3.8Å; V104-L106 HydrophobicContact CG1-CD2 4.01Å; V104-E171 WeakPolarHBondContact O-CA 3.44Å; V104-L172 HydrophobicContact CB-CB 4.12Å; V104-L172 HydrophobicContact CG2-CB 4.4Å; V104-L172 PolarHBondContact N-O 3.2Å; V104-L172 PolarHBondContact O-N 3.34Å; V104-I174 HydrophobicContact CG2-CD1 3.85Å
105	K	95.3	Very high	91.5	Very high	91 Å²	91	56.3 Å²	56.3	40%	0.396	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	125.5	160.2	-63.1	-178.6	-166	150.3	0	108.7	A89 S90 E91	A89-K105 CarbonylContact C-O 3.33Å; A89-K105 VanDerWaalsContact CA-O 3.25Å; A89-K105 WeakPolarHBondContact CA-O 3.38Å; S90-K105 PolarHBondContact N-O 2.87Å; S90-K105 WeakPolarHBondContact OG-CB 3.43Å; S90-K105 PolarHBondContact OG-O 2.92Å; E91-K105 WeakPolarHBondContact OE1-CD 3.46Å; E91-K105 VanDerWaalsContact OE1-CE 3.29Å; E91-K105 WeakPolarHBondContact OE1-CE 3.31Å; E91-K105 IonicContact OE1-NZ 2.77Å; E91-K105 PolarHBondContact OE1-NZ 3.48Å; E91-K105 IonicContact OE2-NZ 3.98Å
106	L	95.5	Very high	91.6	Very high	7 Å²	7	56 Å²	56	4%	0.037	30%	0.303	C	S	.	.	B	Isolated β-bridge	trans	-82.1	173.9	175.7	-62.8	176.2	0	0	0	110.9	I75 G88 S90 V104 A120 Y123 Y170 L172	I75-L106 HydrophobicContact CG1-CD2 4.35Å; G88-L106 CarbonylContact O-C 3.56Å; G88-L106 WeakPolarHBondContact O-CA 3.3Å; S90-L106 WeakPolarHBondContact CB-O 3.27Å; S90-L106 PolarHBondContact OG-O 3.18Å; V104-L106 HydrophobicContact CG1-CD2 4.01Å; L106-A120 HydrophobicContact CD1-CB 3.99Å; L106-Y123 HydrophobicContact CD1-CD2 3.78Å; L106-Y123 HydrophobicContact CD1-CE2 3.74Å; L106-Y123 HydrophobicContact CD2-CD2 4.18Å; L106-Y123 HydrophobicContact CD2-CE2 3.6Å; L106-Y123 HydrophobicContact CG-CE2 4.34Å; L106-Y170 PolarHBondContact N-O 3.03Å; L106-L172 HydrophobicContact CD1-CD1 4.14Å; L106-L172 HydrophobicContact CD1-CG 4.4Å; L106-L172 HydrophobicContact CD2-CD1 4.2Å; L106-L172 HydrophobicContact CG-CD1 4.38Å
107	R	93.9	Very high	91.9	Very high	55 Å²	55	57 Å²	57	21%	0.208	31%	0.308	C	S	.	.	P	Polyproline II helix	trans	-89.3	126	172.4	-70.6	-165.5	70.4	105	3.4	111.4	A87 G88 D109 A110 W243	A87-R107 WeakPolarHBondContact O-CD 3.37Å; G88-R107 PolarHBondContact O-N 3.03Å; R107-D109 VanDerWaalsContact C-N 3.26Å; R107-D109 WeakPolarHBondContact CB-OD1 3.44Å; R107-D109 IonicContact CZ-OD1 3.81Å; R107-D109 IonicContact CZ-OD2 3.75Å; R107-D109 IonicContact NE-OD1 3.29Å; R107-D109 PolarHBondContact NE-OD1 3.16Å; R107-D109 IonicContact NE-OD2 2.84Å; R107-D109 VanDerWaalsContact NH2-CG 3.33Å; R107-D109 IonicContact NH2-OD1 3.25Å; R107-D109 PolarHBondContact NH2-OD1 3.43Å; R107-D109 VanDerWaalsContact NH2-OD1 3.08Å; R107-D109 IonicContact NH2-OD2 3.86Å; R107-D109 PolarHBondContact NH2-OD2 3.41Å; R107-D109 PolarHBondContact O-N 3.04Å; R107-A110 HydrophobicContact CB-CB 4.12Å; R107-W243 VanDerWaalsContact CZ-CZ3 3.45Å
108	E	92.2	Very high	92.8	Very high	153 Å²	153	48.6 Å²	48.6	72%	0.715	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.1	-15.8	175.1	-60.1	-176.4	-167.8	0	0	113.4	Y170	E108-Y170 HydrophobicContact CB-CE2 4.49Å; E108-Y170 HydrophobicContact CG-CD1 4.41Å; E108-Y170 HydrophobicContact CG-CD2 3.83Å; E108-Y170 HydrophobicContact CG-CE2 4.09Å; E108-Y170 HydrophobicContact CG-CG 4Å
109	D	92	Very high	93.5	Very high	76 Å²	76	45.4 Å²	45.4	41%	0.406	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97.2	3.5	179.2	64.5	-21.2	0	0	0	114.1	R107	R107-D109 VanDerWaalsContact C-N 3.26Å; R107-D109 WeakPolarHBondContact CB-OD1 3.44Å; R107-D109 IonicContact CZ-OD1 3.81Å; R107-D109 IonicContact CZ-OD2 3.75Å; R107-D109 IonicContact NE-OD1 3.29Å; R107-D109 PolarHBondContact NE-OD1 3.16Å; R107-D109 IonicContact NE-OD2 2.84Å; R107-D109 VanDerWaalsContact NH2-CG 3.33Å; R107-D109 IonicContact NH2-OD1 3.25Å; R107-D109 PolarHBondContact NH2-OD1 3.43Å; R107-D109 VanDerWaalsContact NH2-OD1 3.08Å; R107-D109 IonicContact NH2-OD2 3.86Å; R107-D109 PolarHBondContact NH2-OD2 3.41Å; R107-D109 PolarHBondContact O-N 3.04Å
110	A	93.7	Very high	94.1	Very high	10 Å²	10	44.5 Å²	44.5	8%	0.083	24%	0.238	C	C	.	.			trans	-78.4	128.4	175.5	0	0	0	0	0	111.6	R107 V118	R107-A110 HydrophobicContact CB-CB 4.12Å; A110-V118 HydrophobicContact CB-CB 4.01Å; A110-V118 HydrophobicContact CB-CG2 4.18Å; A110-V118 PolarHBondContact O-N 3.12Å
111	Q	95.5	Very high	94.3	Very high	87 Å²	87	46.1 Å²	46.1	41%	0.407	25%	0.245	S	C	.	.	B	Isolated β-bridge	trans	-131.6	145.3	-177.7	-66.4	-178.3	-2.1	0	0	111.8
112	W	96.5	Very high	94.5	Very high	1 Å²	1	45 Å²	45	0%	0.004	24%	0.238	C	C	.	.			trans	-68.7	159.6	165.7	-69.1	110.4	0	0	0	110.9	Y72 N114 G115 D116 V118 D122 P194 N196 V215 Y216 N217 T241	Y72-W112 HydrophobicContact CD1-CH2 4.28Å; Y72-W112 AromaticContact CD1-CZ3 3.86Å; Y72-W112 HydrophobicContact CD1-CZ3 3.86Å; Y72-W112 HydrophobicContact CE1-CH2 4.22Å; Y72-W112 AromaticContact CE1-CZ3 3.74Å; Y72-W112 HydrophobicContact CE1-CZ3 3.74Å; W112-N114 WeakPolarHBondContact CB-OD1 3.34Å; W112-N114 PolarHBondContact O-N 2.62Å; W112-N114 VanDerWaalsContact O-N 3.17Å; W112-G115 PolarHBondContact O-N 3.46Å; W112-D116 HydrophobicContact CB-CB 4.35Å; W112-D116 WeakPolarHBondContact CB-O 3.18Å; W112-D116 HydrophobicContact CG-CB 4.48Å; W112-D116 PolarHBondContact N-O 2.99Å; W112-V118 HydrophobicContact CD2-CG2 4.13Å; W112-V118 HydrophobicContact CG-CG2 4.15Å; W112-V118 HydrophobicContact CZ2-CG1 4.48Å; W112-D122 HydrophobicContact CZ2-CB 4.13Å; W112-P194 HydrophobicContact CH2-CB 4.25Å; W112-P194 HydrophobicContact CH2-CG 4Å; W112-P194 WeakPolarHBondContact CH2-O 3.43Å; W112-P194 HydrophobicContact CZ2-CB 4.06Å; W112-P194 HydrophobicContact CZ2-CG 4.13Å; W112-N196 HydrophobicContact CD2-CB 4.08Å; W112-N196 HydrophobicContact CH2-CB 4.46Å; W112-N196 HydrophobicContact CZ2-CB 3.94Å; W112-V215 HydrophobicContact CB-CG2 4.43Å; W112-V215 HydrophobicContact CD2-CG2 4.03Å; W112-V215 HydrophobicContact CE3-CB 4.27Å; W112-V215 HydrophobicContact CE3-CG2 3.76Å; W112-V215 HydrophobicContact CG-CG2 4.34Å; W112-V215 HydrophobicContact CZ3-CG2 4.37Å; W112-V215 WeakPolarHBondContact CZ3-O 3.37Å; W112-Y216 CarbonylContact C-O 3.34Å; W112-N217 HydrophobicContact CD2-CB 4.31Å; W112-N217 HydrophobicContact CE3-CB 3.75Å; W112-N217 HydrophobicContact CH2-CB 4.38Å; W112-N217 HydrophobicContact CZ3-CB 3.78Å; W112-T241 PolarHBondContact O-OG1 3.36Å
113	S	95	Very high	94.5	Very high	41 Å²	41	44.3 Å²	44.3	29%	0.287	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.2	-17.4	178.5	58.8	0	0	0	0	114	V215 Y216	S113-V215 WeakPolarHBondContact OG-CA 3.26Å; S113-Y216 WeakPolarHBondContact CB-O 3.4Å; S113-Y216 PolarHBondContact N-O 3.07Å; S113-Y216 PolarHBondContact OG-N 2.66Å
114	N	92.5	Very high	94.6	Very high	72 Å²	72	43.5 Å²	43.5	39%	0.385	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.7	-5	172.6	71.8	-9.6	0	0	0	113.8	W112 D116 V215	W112-N114 WeakPolarHBondContact CB-OD1 3.34Å; W112-N114 PolarHBondContact O-N 2.62Å; W112-N114 VanDerWaalsContact O-N 3.17Å; N114-D116 PolarHBondContact ND2-OD2 3.34Å; N114-D116 WeakPolarHBondContact OD1-CB 3.13Å; N114-D116 PolarHBondContact OD1-N 3.06Å; N114-V215 HydrophobicContact CB-CG1 3.89Å
115	G	90	Very high	94.6	Very high	40 Å²	40	45 Å²	45	41%	0.412	24%	0.237	S	C	.	.	S	Bend	trans	89.4	-0.8	-177.4	0	0	0	0	0	116.1	W112	W112-G115 PolarHBondContact O-N 3.46Å
116	D	93.6	Very high	94.5	Very high	48 Å²	48	40.7 Å²	40.7	26%	0.257	22%	0.218	S	C	.	.	P	Polyproline II helix	trans	-65.3	140.9	168	-68.6	-31.3	0	0	0	109	W112 N114 N196 K198	W112-D116 HydrophobicContact CB-CB 4.35Å; W112-D116 WeakPolarHBondContact CB-O 3.18Å; W112-D116 HydrophobicContact CG-CB 4.48Å; W112-D116 PolarHBondContact N-O 2.99Å; N114-D116 PolarHBondContact ND2-OD2 3.34Å; N114-D116 WeakPolarHBondContact OD1-CB 3.13Å; N114-D116 PolarHBondContact OD1-N 3.06Å; D116-N196 PolarHBondContact OD2-ND2 2.83Å; D116-K198 IonicContact OD1-NZ 3.13Å; D116-K198 PolarHBondContact OD1-NZ 2.85Å; D116-K198 IonicContact OD2-NZ 3.35Å; D116-K198 PolarHBondContact OD2-NZ 3.38Å
117	P	94.6	Very high	94.6	Very high	58 Å²	58	40.4 Å²	40.4	38%	0.377	22%	0.216	S	C	.	.	B	Isolated β-bridge	trans	-69.1	148.5	174.3	29.8	-34.7	0	0	0	111.1	T119	P117-T119 HydrophobicContact CB-CG2 4.47Å; P117-T119 HydrophobicContact CG-CG2 4.28Å
118	V	95.5	Very high	94.6	Very high	5 Å²	5	39.5 Å²	39.5	3%	0.03	21%	0.214	C	C	.	.	P	Polyproline II helix	trans	-84.9	122.3	171.6	-174.7	0	0	0	0	108.8	A110 W112 Y123 P194 N217	A110-V118 HydrophobicContact CB-CB 4.01Å; A110-V118 HydrophobicContact CB-CG2 4.18Å; A110-V118 PolarHBondContact O-N 3.12Å; W112-V118 HydrophobicContact CD2-CG2 4.13Å; W112-V118 HydrophobicContact CG-CG2 4.15Å; W112-V118 HydrophobicContact CZ2-CG1 4.48Å; V118-Y123 HydrophobicContact CG1-CE2 4.09Å; V118-P194 HydrophobicContact CG1-CB 4.26Å; V118-P194 HydrophobicContact CG1-CG 3.97Å; V118-N217 HydrophobicContact CG2-CB 3.87Å
119	T	95.9	Very high	94.7	Very high	21 Å²	21	34.3 Å²	34.3	13%	0.129	19%	0.188	C	C	.	.			trans	-122.7	165.2	-171.2	67.9	0	0	0	0	112.5	P117 K121 D122 Y123 D169	P117-T119 HydrophobicContact CB-CG2 4.47Å; P117-T119 HydrophobicContact CG-CG2 4.28Å; T119-K121 PolarHBondContact O-N 3.3Å; T119-K121 VanDerWaalsContact O-N 3.13Å; T119-K121 PolarHBondContact OG1-N 2.73Å; T119-D122 PolarHBondContact N-OD2 3.21Å; T119-D122 PolarHBondContact O-N 2.83Å; T119-D122 VanDerWaalsContact O-N 3.08Å; T119-D122 PolarHBondContact OG1-OD2 3.33Å; T119-Y123 WeakPolarHBondContact O-CD2 3.33Å; T119-D169 CarbonylContact C-O 3.45Å; T119-D169 WeakPolarHBondContact CA-O 3.22Å; T119-D169 WeakPolarHBondContact CB-O 3.47Å
120	A	95.3	Very high	94.8	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-55.8	-27.4	171.9	0	0	0	0	0	113	L106 Y123 V124 A166 G168 D169 L172	L106-A120 HydrophobicContact CD1-CB 3.99Å; A120-Y123 PolarHBondContact O-N 2.98Å; A120-V124 WeakPolarHBondContact O-CG2 3.47Å; A120-V124 PolarHBondContact O-N 2.92Å; A120-V124 VanDerWaalsContact O-N 3.15Å; A120-A166 HydrophobicContact CB-CB 3.62Å; A120-G168 WeakPolarHBondContact CB-O 3.12Å; A120-D169 PolarHBondContact N-O 3.09Å; A120-L172 HydrophobicContact CB-CD2 3.7Å; A120-L172 HydrophobicContact CB-CG 3.9Å; A120-L172 WeakPolarHBondContact O-CD2 3.27Å
121	K	94.9	Very high	94.7	Very high	110 Å²	110	30.2 Å²	30.2	48%	0.478	17%	0.165	S	C	.	.	H	α-helix	trans	-69.6	-34	177.9	-67.9	161.5	-178	147.6	0	112.3	T119 Y123 V124 F125 A166 D169	T119-K121 PolarHBondContact O-N 3.3Å; T119-K121 VanDerWaalsContact O-N 3.13Å; T119-K121 PolarHBondContact OG1-N 2.73Å; K121-Y123 VanDerWaalsContact C-N 3.31Å; K121-Y123 PolarHBondContact O-N 3.44Å; K121-V124 PolarHBondContact O-N 3.33Å; K121-F125 VanDerWaalsContact O-CB 3.29Å; K121-F125 WeakPolarHBondContact O-CB 3.19Å; K121-F125 PolarHBondContact O-N 2.82Å; K121-A166 HydrophobicContact CG-CB 4.48Å; K121-D169 IonicContact NZ-OD1 3.24Å; K121-D169 PolarHBondContact NZ-OD1 3.09Å
122	D	96.4	Very high	94.5	Very high	14 Å²	14	30.1 Å²	30.1	8%	0.075	16%	0.163	C	C	.	.	H	α-helix	trans	-68	-31.8	178.7	-56.6	-64	0	0	0	112.1	W112 T119 G126 P194 Q195	W112-D122 HydrophobicContact CZ2-CB 4.13Å; T119-D122 PolarHBondContact N-OD2 3.21Å; T119-D122 PolarHBondContact O-N 2.83Å; T119-D122 VanDerWaalsContact O-N 3.08Å; T119-D122 PolarHBondContact OG1-OD2 3.33Å; D122-G126 PolarHBondContact O-N 3.46Å; D122-P194 HydrophobicContact CB-CB 3.81Å; D122-Q195 WeakPolarHBondContact CA-O 3.45Å; D122-Q195 WeakPolarHBondContact CB-O 3.46Å; D122-Q195 PolarHBondContact O-N 2.9Å
123	Y	95.9	Very high	94	Very high	2 Å²	2	32.7 Å²	32.7	1%	0.008	18%	0.18	C	C	.	.	H	α-helix	trans	-71.8	-48.7	171.5	-71.6	-84.2	0	0	0	111.9	I75 L106 V118 T119 A120 K121 F125 G126 W127 L172 P194	I75-Y123 HydrophobicContact CD1-CD1 4.06Å; I75-Y123 HydrophobicContact CD1-CE1 4.15Å; I75-Y123 HydrophobicContact CG1-CD1 4.03Å; I75-Y123 HydrophobicContact CG1-CE1 3.61Å; L106-Y123 HydrophobicContact CD1-CD2 3.78Å; L106-Y123 HydrophobicContact CD1-CE2 3.74Å; L106-Y123 HydrophobicContact CD2-CD2 4.18Å; L106-Y123 HydrophobicContact CD2-CE2 3.6Å; L106-Y123 HydrophobicContact CG-CE2 4.34Å; V118-Y123 HydrophobicContact CG1-CE2 4.09Å; T119-Y123 WeakPolarHBondContact O-CD2 3.33Å; A120-Y123 PolarHBondContact O-N 2.98Å; K121-Y123 VanDerWaalsContact C-N 3.31Å; K121-Y123 PolarHBondContact O-N 3.44Å; Y123-F125 PolarHBondContact O-N 3.43Å; Y123-G126 PolarHBondContact O-N 3.27Å; Y123-W127 WeakPolarHBondContact O-CB 3.3Å; Y123-W127 PolarHBondContact O-N 2.89Å; Y123-L172 HydrophobicContact CD2-CD1 4.04Å; Y123-L172 HydrophobicContact CG-CD1 3.92Å; Y123-P194 HydrophobicContact CD1-CB 3.92Å; Y123-P194 HydrophobicContact CD1-CG 4.41Å; Y123-P194 HydrophobicContact CD2-CB 3.95Å; Y123-P194 HydrophobicContact CE1-CB 3.88Å; Y123-P194 VanDerWaalsContact CE1-CD 3.46Å; Y123-P194 HydrophobicContact CE1-CG 3.86Å; Y123-P194 HydrophobicContact CE2-CB 3.91Å; Y123-P194 HydrophobicContact CE2-CG 4.09Å; Y123-P194 HydrophobicContact CG-CB 3.96Å
124	V	96.4	Very high	93.5	Very high	22 Å²	22	37.8 Å²	37.8	13%	0.133	20%	0.2	C	C	.	.	H	α-helix	trans	-55.7	-51	176.6	171.7	0	0	0	0	110.4	A120 K121 Q128 I164 A166 L172	A120-V124 WeakPolarHBondContact O-CG2 3.47Å; A120-V124 PolarHBondContact O-N 2.92Å; A120-V124 VanDerWaalsContact O-N 3.15Å; K121-V124 PolarHBondContact O-N 3.33Å; V124-Q128 HydrophobicContact CG1-CG 4.41Å; V124-Q128 VanDerWaalsContact O-CB 3.25Å; V124-Q128 WeakPolarHBondContact O-CB 3.47Å; V124-Q128 WeakPolarHBondContact O-CG 3.25Å; V124-Q128 PolarHBondContact O-N 3.2Å; V124-I164 HydrophobicContact CG2-CD1 4.5Å; V124-I164 HydrophobicContact CG2-CG1 4.01Å; V124-I164 HydrophobicContact CG2-CG2 4.49Å; V124-A166 HydrophobicContact CG2-CB 4.29Å; V124-L172 HydrophobicContact CG2-CD2 3.92Å
125	F	95.9	Very high	93.3	Very high	33 Å²	33	35.8 Å²	35.8	15%	0.145	19%	0.19	C	C	.	.	H	α-helix	trans	-61.6	-47.2	178	174.4	-94	0	0	0	112.3	K121 Y123 W127 Q128 R129 Q195 Q197 V200	K121-F125 VanDerWaalsContact O-CB 3.29Å; K121-F125 WeakPolarHBondContact O-CB 3.19Å; K121-F125 PolarHBondContact O-N 2.82Å; Y123-F125 PolarHBondContact O-N 3.43Å; F125-W127 PolarHBondContact O-N 2.91Å; F125-Q128 PolarHBondContact O-N 3.46Å; F125-R129 WeakPolarHBondContact O-CB 3.29Å; F125-R129 PolarHBondContact O-N 2.83Å; F125-Q195 HydrophobicContact CD1-CB 4.09Å; F125-Q195 HydrophobicContact CE1-CB 4.29Å; F125-Q197 HydrophobicContact CB-CB 4.27Å; F125-Q197 HydrophobicContact CD1-CB 3.83Å; F125-Q197 HydrophobicContact CD1-CG 4.37Å; F125-Q197 HydrophobicContact CD2-CB 3.89Å; F125-Q197 HydrophobicContact CD2-CG 3.59Å; F125-Q197 HydrophobicContact CE1-CB 4.14Å; F125-Q197 HydrophobicContact CE1-CG 4.42Å; F125-Q197 HydrophobicContact CE2-CB 4.17Å; F125-Q197 HydrophobicContact CE2-CG 3.63Å; F125-Q197 HydrophobicContact CG-CB 3.71Å; F125-Q197 HydrophobicContact CG-CG 3.97Å; F125-Q197 HydrophobicContact CZ-CB 4.29Å; F125-Q197 HydrophobicContact CZ-CG 4.06Å; F125-V200 HydrophobicContact CE1-CB 3.89Å; F125-V200 HydrophobicContact CE1-CG1 4.03Å; F125-V200 HydrophobicContact CE1-CG2 3.98Å; F125-V200 HydrophobicContact CZ-CB 4.01Å; F125-V200 HydrophobicContact CZ-CG1 3.87Å
126	G	94.2	Very high	93	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-59.7	-45.8	-180	0	0	0	0	0	112.6	D122 Y123 R129 T130 Q195	D122-G126 PolarHBondContact O-N 3.46Å; Y123-G126 PolarHBondContact O-N 3.27Å; G126-R129 PolarHBondContact O-N 2.8Å; G126-T130 PolarHBondContact O-N 3Å; G126-T130 PolarHBondContact O-OG1 3.38Å; G126-T130 VanDerWaalsContact O-OG1 3.07Å; G126-Q195 PolarHBondContact O-NE2 2.92Å
127	W	96.1	Very high	92.6	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-66.8	-45.2	178.2	-68.7	26.3	0	0	0	111.2	I75 Y123 F125 R129 T130 V131 F143 V146 L162 I164 I174 F183 L187 F192	I75-W127 HydrophobicContact CD1-CZ2 4.11Å; Y123-W127 WeakPolarHBondContact O-CB 3.3Å; Y123-W127 PolarHBondContact O-N 2.89Å; F125-W127 PolarHBondContact O-N 2.91Å; W127-R129 VanDerWaalsContact C-N 3.27Å; W127-R129 PolarHBondContact O-N 2.96Å; W127-T130 PolarHBondContact O-N 3.17Å; W127-T130 VanDerWaalsContact O-N 3.16Å; W127-V131 WeakPolarHBondContact O-CG2 3.48Å; W127-V131 PolarHBondContact O-N 2.93Å; W127-F143 HydrophobicContact CB-CD1 4.47Å; W127-F143 HydrophobicContact CB-CE1 3.89Å; W127-F143 HydrophobicContact CD2-CD1 4.39Å; W127-F143 AromaticContact CD2-CE1 3.83Å; W127-F143 HydrophobicContact CD2-CE1 3.83Å; W127-F143 HydrophobicContact CE3-CD1 4.23Å; W127-F143 HydrophobicContact CE3-CE1 4.13Å; W127-F143 AromaticContact CG-CE1 3.71Å; W127-F143 HydrophobicContact CG-CE1 3.71Å; W127-V146 HydrophobicContact CE3-CG2 4.47Å; W127-V146 HydrophobicContact CZ3-CG2 3.96Å; W127-L162 HydrophobicContact CB-CD2 3.9Å; W127-I164 HydrophobicContact CB-CG2 4.13Å; W127-I164 HydrophobicContact CD2-CB 4.5Å; W127-I164 HydrophobicContact CD2-CD1 3.47Å; W127-I164 VanDerWaalsContact CD2-CD1 3.47Å; W127-I164 HydrophobicContact CD2-CG2 4.3Å; W127-I164 HydrophobicContact CE3-CB 3.81Å; W127-I164 HydrophobicContact CE3-CD1 3.53Å; W127-I164 HydrophobicContact CE3-CG1 4.22Å; W127-I164 HydrophobicContact CE3-CG2 3.83Å; W127-I164 HydrophobicContact CG-CD1 4.04Å; W127-I164 HydrophobicContact CG-CG2 4.48Å; W127-I164 HydrophobicContact CH2-CD1 4.05Å; W127-I164 HydrophobicContact CZ2-CD1 3.99Å; W127-I164 HydrophobicContact CZ3-CB 4.12Å; W127-I164 HydrophobicContact CZ3-CD1 3.83Å; W127-I164 HydrophobicContact CZ3-CG1 4.42Å; W127-I174 HydrophobicContact CH2-CD1 3.56Å; W127-I174 HydrophobicContact CH2-CG1 3.99Å; W127-I174 HydrophobicContact CH2-CG2 4.3Å; W127-I174 HydrophobicContact CZ2-CD1 4.21Å; W127-I174 HydrophobicContact CZ3-CD1 4.19Å; W127-I174 HydrophobicContact CZ3-CG1 4.1Å; W127-I174 HydrophobicContact CZ3-CG2 4.08Å; W127-F183 HydrophobicContact CH2-CZ 4.01Å; W127-F183 HydrophobicContact CZ3-CZ 4.33Å; W127-L187 HydrophobicContact CH2-CD2 3.8Å; W127-L187 HydrophobicContact CZ2-CD2 3.85Å; W127-F192 HydrophobicContact CD2-CD1 4.25Å; W127-F192 AromaticContact CE2-CD1 3.79Å; W127-F192 HydrophobicContact CE3-CD1 4.5Å; W127-F192 AromaticContact CH2-CD1 3.93Å; W127-F192 HydrophobicContact CH2-CD1 3.93Å; W127-F192 HydrophobicContact CH2-CE1 4.49Å; W127-F192 HydrophobicContact CZ2-CB 4.2Å; W127-F192 AromaticContact CZ2-CD1 3.64Å; W127-F192 HydrophobicContact CZ2-CD1 3.64Å; W127-F192 HydrophobicContact CZ2-CG 4.42Å; W127-F192 HydrophobicContact CZ3-CD1 4.35Å; W127-F192 PolarHBondContact NE1-O 3.49Å
128	Q	95.4	Very high	92	Very high	37 Å²	37	35 Å²	35	17%	0.173	19%	0.185	C	C	.	.	H	α-helix	trans	-60	-36.4	175.9	-75.2	175.7	-18.3	0	0	112.4	V124 F125 K132 P159 L162	V124-Q128 HydrophobicContact CG1-CG 4.41Å; V124-Q128 VanDerWaalsContact O-CB 3.25Å; V124-Q128 WeakPolarHBondContact O-CB 3.47Å; V124-Q128 WeakPolarHBondContact O-CG 3.25Å; V124-Q128 PolarHBondContact O-N 3.2Å; F125-Q128 PolarHBondContact O-N 3.46Å; Q128-K132 VanDerWaalsContact O-CB 3.31Å; Q128-K132 WeakPolarHBondContact O-CB 3.22Å; Q128-K132 PolarHBondContact O-N 3.03Å; Q128-P159 HydrophobicContact CB-CB 4.17Å; Q128-P159 HydrophobicContact CG-CB 4.32Å; Q128-P159 WeakPolarHBondContact CG-O 3.22Å; Q128-P159 PolarHBondContact NE2-O 3.43Å; Q128-P159 VanDerWaalsContact NE2-O 3.12Å; Q128-L162 HydrophobicContact CG-CB 4.34Å; Q128-L162 HydrophobicContact CG-CD2 4.06Å
129	R	94.3	Very high	91.5	Very high	43 Å²	43	35.1 Å²	35.1	16%	0.162	19%	0.185	C	C	.	.	H	α-helix	trans	-67.9	-41.8	173.8	-178.7	172.6	177.4	-94.2	-10.1	112.1	D55 S57 F125 G126 W127 K132 T135	D55-R129 VanDerWaalsContact CG-NH1 3.33Å; D55-R129 IonicContact OD1-CZ 2.81Å; D55-R129 IonicContact OD1-NH1 3.69Å; D55-R129 PolarHBondContact OD1-NH1 3.43Å; D55-R129 IonicContact OD1-NH2 3.84Å; D55-R129 IonicContact OD2-CZ 2.91Å; D55-R129 IonicContact OD2-NH1 3.46Å; D55-R129 PolarHBondContact OD2-NH1 2.99Å; D55-R129 VanDerWaalsContact OD2-NH1 3.09Å; D55-R129 IonicContact OD2-NH2 2.77Å; D55-R129 PolarHBondContact OD2-NH2 3.48Å; S57-R129 PolarHBondContact OG-NH1 2.98Å; F125-R129 WeakPolarHBondContact O-CB 3.29Å; F125-R129 PolarHBondContact O-N 2.83Å; G126-R129 PolarHBondContact O-N 2.8Å; W127-R129 VanDerWaalsContact C-N 3.27Å; W127-R129 PolarHBondContact O-N 2.96Å; R129-K132 PolarHBondContact O-N 3.22Å; R129-T135 HydrophobicContact CG-CG2 4.43Å; R129-T135 WeakPolarHBondContact O-CB 3.42Å; R129-T135 WeakPolarHBondContact O-CG2 3.25Å; R129-T135 PolarHBondContact O-OG1 3.46Å
130	T	93.3	Very high	91	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-69.4	-41.3	-179.1	-55.7	0	0	0	0	112.7	S57 G126 W127 K132 S137 F143	S57-T130 PolarHBondContact OG-OG1 3.42Å; G126-T130 PolarHBondContact O-N 3Å; G126-T130 PolarHBondContact O-OG1 3.38Å; G126-T130 VanDerWaalsContact O-OG1 3.07Å; W127-T130 PolarHBondContact O-N 3.17Å; W127-T130 VanDerWaalsContact O-N 3.16Å; T130-K132 VanDerWaalsContact C-N 3.26Å; T130-K132 PolarHBondContact O-N 3.13Å; T130-S137 WeakPolarHBondContact CG2-OG 3.37Å; T130-S137 WeakPolarHBondContact O-CB 3.37Å; T130-F143 HydrophobicContact CG2-CD2 4.31Å; T130-F143 HydrophobicContact CG2-CE2 3.49Å; T130-F143 VanDerWaalsContact CG2-CE2 3.49Å; T130-F143 HydrophobicContact CG2-CZ 3.94Å
131	V	92.3	Very high	90.4	Very high	1 Å²	1	36.1 Å²	36.1	1%	0.006	19%	0.189	C	C	.	.	S	Bend	trans	-76.4	-9.9	178.2	-56.9	0	0	0	0	114.2	W127 F143 I152 S153 L162	W127-V131 WeakPolarHBondContact O-CG2 3.48Å; W127-V131 PolarHBondContact O-N 2.93Å; V131-F143 HydrophobicContact CG1-CB 3.43Å; V131-F143 VanDerWaalsContact CG1-CB 3.43Å; V131-F143 HydrophobicContact CG1-CD1 3.77Å; V131-F143 HydrophobicContact CG1-CD2 3.99Å; V131-F143 HydrophobicContact CG1-CG 3.45Å; V131-F143 VanDerWaalsContact CG1-CG 3.45Å; V131-I152 HydrophobicContact CB-CG2 4.36Å; V131-I152 HydrophobicContact CG2-CB 4.47Å; V131-I152 HydrophobicContact CG2-CG2 3.66Å; V131-S153 WeakPolarHBondContact O-CA 3.18Å; V131-S153 PolarHBondContact O-OG 3.36Å; V131-L162 HydrophobicContact CG1-CD1 4.4Å; V131-L162 HydrophobicContact CG1-CD2 4.37Å; V131-L162 HydrophobicContact CG2-CD1 4.3Å; V131-L162 HydrophobicContact CG2-CD2 3.92Å
132	K	90.3	Very high	90	Very high	84 Å²	84	31.1 Å²	31.1	37%	0.365	17%	0.167	S	C	.	.			trans	-71.8	127.9	-173.5	179.5	165.6	-177.1	168	0	111.2	Q128 R129 T130 E134 T135 P159	Q128-K132 VanDerWaalsContact O-CB 3.31Å; Q128-K132 WeakPolarHBondContact O-CB 3.22Å; Q128-K132 PolarHBondContact O-N 3.03Å; R129-K132 PolarHBondContact O-N 3.22Å; T130-K132 VanDerWaalsContact C-N 3.26Å; T130-K132 PolarHBondContact O-N 3.13Å; K132-E134 VanDerWaalsContact C-N 3.26Å; K132-E134 VanDerWaalsContact CE-CD 3.49Å; K132-E134 WeakPolarHBondContact CE-OE2 3.48Å; K132-E134 HydrophobicContact CG-CB 4.45Å; K132-E134 WeakPolarHBondContact CG-OE2 3.37Å; K132-E134 PolarHBondContact O-N 3.46Å; K132-E134 VanDerWaalsContact O-N 3.15Å; K132-T135 WeakPolarHBondContact O-CB 3.34Å; K132-T135 PolarHBondContact O-N 2.91Å; K132-P159 HydrophobicContact CD-CG 4.42Å; K132-P159 HydrophobicContact CG-CG 4.43Å
133	P	85.3	Confident	89.8	Confident	56 Å²	56	30.4 Å²	30.4	36%	0.364	16%	0.164	S	C	.	.	G	3₁₀ helix	trans	-54	-38.3	-178.5	-28.3	35.2	0	0	0	114.2	T135 A136 I152	P133-T135 PolarHBondContact O-N 3.27Å; P133-A136 PolarHBondContact O-N 3.06Å; P133-A136 VanDerWaalsContact O-N 3.09Å; P133-I152 WeakPolarHBondContact CD-O 3.47Å; P133-I152 VanDerWaalsContact CG-O 3.25Å; P133-I152 WeakPolarHBondContact CG-O 3.43Å
134	E	85.5	Confident	89.4	Confident	148 Å²	148	35.2 Å²	35.2	69%	0.692	19%	0.186	S	C	*	.	G	3₁₀ helix	trans	-70.9	-13.4	179.6	-59.3	92.9	150	0	0	114.6	K132	K132-E134 VanDerWaalsContact C-N 3.26Å; K132-E134 VanDerWaalsContact CE-CD 3.49Å; K132-E134 WeakPolarHBondContact CE-OE2 3.48Å; K132-E134 HydrophobicContact CG-CB 4.45Å; K132-E134 WeakPolarHBondContact CG-OE2 3.37Å; K132-E134 PolarHBondContact O-N 3.46Å; K132-E134 VanDerWaalsContact O-N 3.15Å
135	T	87.6	Confident	89	Confident	29 Å²	29	34.5 Å²	34.5	18%	0.178	18%	0.182	C	C	.	.	G	3₁₀ helix	trans	-83.9	-15.8	171.6	-64.2	0	0	0	0	111.4	V58 R129 K132 P133 S137	V58-T135 HydrophobicContact CG1-CG2 4.13Å; V58-T135 WeakPolarHBondContact CG1-O 3.42Å; R129-T135 HydrophobicContact CG-CG2 4.43Å; R129-T135 WeakPolarHBondContact O-CB 3.42Å; R129-T135 WeakPolarHBondContact O-CG2 3.25Å; R129-T135 PolarHBondContact O-OG1 3.46Å; K132-T135 WeakPolarHBondContact O-CB 3.34Å; K132-T135 PolarHBondContact O-N 2.91Å; P133-T135 PolarHBondContact O-N 3.27Å; T135-S137 PolarHBondContact O-N 3.31Å
136	A	83.6	Confident	88.9	Confident	83 Å²	83	32.9 Å²	32.9	69%	0.686	18%	0.175	S	C	*	.			trans	53.5	33.6	176.3	0	0	0	0	0	115.2	P133 E138	P133-A136 PolarHBondContact O-N 3.06Å; P133-A136 VanDerWaalsContact O-N 3.09Å; A136-E138 PolarHBondContact O-N 2.92Å
137	S	86.5	Confident	88.9	Confident	15 Å²	15	36.7 Å²	36.7	11%	0.105	19%	0.193	C	C	.	.			trans	-64.8	117.7	178.1	-172.1	0	0	0	0	111.5	S57 T130 T135 Y139 A140	S57-S137 WeakPolarHBondContact O-CB 3Å; S57-S137 PolarHBondContact O-OG 3.18Å; T130-S137 WeakPolarHBondContact CG2-OG 3.37Å; T130-S137 WeakPolarHBondContact O-CB 3.37Å; T135-S137 PolarHBondContact O-N 3.31Å; S137-Y139 PolarHBondContact O-N 3.2Å; S137-Y139 PolarHBondContact OG-N 3.4Å; S137-A140 WeakPolarHBondContact O-CB 3.34Å; S137-A140 PolarHBondContact O-N 2.98Å
138	E	80.7	Confident	88.8	Confident	32 Å²	32	38.7 Å²	38.7	15%	0.15	20%	0.204	C	C	.	.	G	3₁₀ helix	trans	-60.8	-27.5	171.4	-74.1	-179.1	-123.6	0	0	112	T60 A136 Y141 N440 S470 R473	T60-E138 HydrophobicContact CG2-CB 3.86Å; T60-E138 HydrophobicContact CG2-CG 4.32Å; A136-E138 PolarHBondContact O-N 2.92Å; E138-Y141 WeakPolarHBondContact O-CD1 3.45Å; E138-N440 PolarHBondContact OE1-ND2 3.25Å; E138-N440 PolarHBondContact OE1-OD1 3.44Å; E138-S470 PolarHBondContact O-OG 2.88Å; E138-R473 IonicContact OE1-NH2 3.94Å; E138-R473 IonicContact OE2-CZ 3.31Å; E138-R473 IonicContact OE2-NH2 2.71Å; E138-R473 PolarHBondContact OE2-NH2 3.4Å
139	Y	85.8	Confident	88.5	Confident	8 Å²	8	37 Å²	37	3%	0.031	20%	0.196	C	C	.	.	G	3₁₀ helix	trans	-91.8	5.6	-176.1	-82.9	-130.7	0	0	0	113.2	T60 F65 S137 Y141 L142 F189 W451 D454	T60-Y139 HydrophobicContact CG2-CD2 3.83Å; T60-Y139 HydrophobicContact CG2-CE2 3.79Å; T60-Y139 PolarHBondContact O-OH 3.49Å; T60-Y139 VanDerWaalsContact O-OH 3.13Å; F65-Y139 HydrophobicContact CE2-CD1 4.39Å; F65-Y139 AromaticContact CE2-CE1 3.55Å; F65-Y139 HydrophobicContact CE2-CE1 3.55Å; F65-Y139 AromaticContact CE2-CZ 3.67Å; F65-Y139 WeakPolarHBondContact CE2-OH 3.39Å; F65-Y139 AromaticContact CZ-CD1 3.83Å; F65-Y139 HydrophobicContact CZ-CD1 3.83Å; F65-Y139 AromaticContact CZ-CE1 3.45Å; F65-Y139 HydrophobicContact CZ-CE1 3.45Å; F65-Y139 VanDerWaalsContact CZ-CE1 3.45Å; F65-Y139 AromaticContact CZ-CZ 3.86Å; S137-Y139 PolarHBondContact O-N 3.2Å; S137-Y139 PolarHBondContact OG-N 3.4Å; Y139-Y141 PolarHBondContact O-N 2.9Å; Y139-Y141 VanDerWaalsContact O-N 3.09Å; Y139-L142 HydrophobicContact CD1-CD1 3.61Å; Y139-L142 HydrophobicContact CD1-CG 4.48Å; Y139-L142 HydrophobicContact CE1-CD1 4.34Å; Y139-L142 HydrophobicContact CG-CD1 4.38Å; Y139-L142 WeakPolarHBondContact O-CB 3.25Å; Y139-L142 PolarHBondContact O-N 3.1Å; Y139-F189 AromaticContact CD1-CE1 3.89Å; Y139-F189 HydrophobicContact CD1-CE1 3.89Å; Y139-F189 HydrophobicContact CD1-CZ 4.33Å; Y139-F189 AromaticContact CE1-CE1 3.89Å; Y139-F189 HydrophobicContact CE1-CE1 3.89Å; Y139-F189 AromaticContact CE1-CZ 3.85Å; Y139-F189 HydrophobicContact CE1-CZ 3.85Å; Y139-W451 HydrophobicContact CE1-CH2 4.14Å; Y139-W451 AromaticContact CE2-CH2 3.75Å; Y139-W451 HydrophobicContact CE2-CH2 3.75Å; Y139-W451 HydrophobicContact CE2-CZ3 4.12Å; Y139-W451 AromaticContact CZ-CH2 3.42Å; Y139-W451 VanDerWaalsContact CZ-CH2 3.42Å; Y139-W451 AromaticContact CZ-CZ3 3.96Å; Y139-W451 WeakPolarHBondContact OH-CH2 3.28Å; Y139-W451 WeakPolarHBondContact OH-CZ3 3.47Å; Y139-D454 WeakPolarHBondContact CE1-OD1 3.46Å
140	A	85.8	Confident	88.1	Confident	13 Å²	13	37 Å²	37	11%	0.107	21%	0.205	C	C	.	.	G	3₁₀ helix	trans	-56.2	-25.7	174.8	0	0	0	0	0	113.3	S137 L142 F143	S137-A140 WeakPolarHBondContact O-CB 3.34Å; S137-A140 PolarHBondContact O-N 2.98Å; A140-L142 VanDerWaalsContact C-N 3.26Å; A140-L142 PolarHBondContact O-N 2.84Å; A140-F143 WeakPolarHBondContact O-CB 3.23Å; A140-F143 PolarHBondContact O-N 3.42Å; A140-F143 VanDerWaalsContact O-N 3.12Å
141	Y	81.9	Confident	87.9	Confident	28 Å²	28	39.3 Å²	39.3	11%	0.11	22%	0.217	C	C	.	.	G	3₁₀ helix	trans	-63.3	-28.9	177.5	83	-81.9	0	0	0	113.1	E138 Y139 F143 E144 W451 D463	E138-Y141 WeakPolarHBondContact O-CD1 3.45Å; Y139-Y141 PolarHBondContact O-N 2.9Å; Y139-Y141 VanDerWaalsContact O-N 3.09Å; Y141-F143 PolarHBondContact O-N 2.91Å; Y141-F143 VanDerWaalsContact O-N 3.11Å; Y141-E144 WeakPolarHBondContact O-CB 3.26Å; Y141-E144 WeakPolarHBondContact O-CG 3.49Å; Y141-E144 PolarHBondContact O-N 3.25Å; Y141-W451 WeakPolarHBondContact OH-CZ2 3.44Å; Y141-D463 HydrophobicContact CE2-CB 4.35Å
142	L	87.7	Confident	87.8	Confident	5 Å²	5	39.3 Å²	39.3	3%	0.026	22%	0.217	C	C	.	.	G	3₁₀ helix	trans	-61.1	-22.2	175.5	-65.1	-178.7	0	0	0	112.4	Y139 A140 P145 L186 F189 F192 Y455	Y139-L142 HydrophobicContact CD1-CD1 3.61Å; Y139-L142 HydrophobicContact CD1-CG 4.48Å; Y139-L142 HydrophobicContact CE1-CD1 4.34Å; Y139-L142 HydrophobicContact CG-CD1 4.38Å; Y139-L142 WeakPolarHBondContact O-CB 3.25Å; Y139-L142 PolarHBondContact O-N 3.1Å; A140-L142 VanDerWaalsContact C-N 3.26Å; A140-L142 PolarHBondContact O-N 2.84Å; L142-P145 WeakPolarHBondContact O-CD 3.29Å; L142-L186 HydrophobicContact CD1-CD2 4.49Å; L142-L186 HydrophobicContact CD2-CD2 4.21Å; L142-F189 HydrophobicContact CD1-CD1 4.24Å; L142-F189 HydrophobicContact CD1-CE1 4.22Å; L142-F192 HydrophobicContact CB-CE2 3.9Å; L142-F192 HydrophobicContact CB-CZ 3.96Å; L142-F192 HydrophobicContact CD1-CE2 4.35Å; L142-Y455 HydrophobicContact CD2-CD1 4.48Å; L142-Y455 HydrophobicContact CD2-CE1 3.84Å
143	F	90.8	Very high	87.6	Confident	0 Å²	0	37 Å²	37	0%	0	21%	0.212	C	C	.	.	G	3₁₀ helix	trans	-85.6	-11.3	177.7	-66.1	-100.6	0	0	0	113.3	W127 T130 V131 A140 Y141 P145 V146 A149 S191 F192	W127-F143 HydrophobicContact CB-CD1 4.47Å; W127-F143 HydrophobicContact CB-CE1 3.89Å; W127-F143 HydrophobicContact CD2-CD1 4.39Å; W127-F143 AromaticContact CD2-CE1 3.83Å; W127-F143 HydrophobicContact CD2-CE1 3.83Å; W127-F143 HydrophobicContact CE3-CD1 4.23Å; W127-F143 HydrophobicContact CE3-CE1 4.13Å; W127-F143 AromaticContact CG-CE1 3.71Å; W127-F143 HydrophobicContact CG-CE1 3.71Å; T130-F143 HydrophobicContact CG2-CD2 4.31Å; T130-F143 HydrophobicContact CG2-CE2 3.49Å; T130-F143 VanDerWaalsContact CG2-CE2 3.49Å; T130-F143 HydrophobicContact CG2-CZ 3.94Å; V131-F143 HydrophobicContact CG1-CB 3.43Å; V131-F143 VanDerWaalsContact CG1-CB 3.43Å; V131-F143 HydrophobicContact CG1-CD1 3.77Å; V131-F143 HydrophobicContact CG1-CD2 3.99Å; V131-F143 HydrophobicContact CG1-CG 3.45Å; V131-F143 VanDerWaalsContact CG1-CG 3.45Å; A140-F143 WeakPolarHBondContact O-CB 3.23Å; A140-F143 PolarHBondContact O-N 3.42Å; A140-F143 VanDerWaalsContact O-N 3.12Å; Y141-F143 PolarHBondContact O-N 2.91Å; Y141-F143 VanDerWaalsContact O-N 3.11Å; F143-P145 VanDerWaalsContact C-N 3.27Å; F143-P145 VanDerWaalsContact O-N 3.12Å; F143-V146 WeakPolarHBondContact O-CA 3.36Å; F143-V146 WeakPolarHBondContact O-CB 3.35Å; F143-V146 WeakPolarHBondContact O-CG2 3.28Å; F143-V146 PolarHBondContact O-N 3.05Å; F143-A149 HydrophobicContact CB-CB 4.04Å; F143-A149 WeakPolarHBondContact O-CB 3.12Å; F143-S191 WeakPolarHBondContact CZ-O 3.32Å; F143-F192 HydrophobicContact CD1-CD1 4.09Å; F143-F192 AromaticContact CD1-CE1 3.51Å; F143-F192 HydrophobicContact CD1-CE1 3.51Å; F143-F192 HydrophobicContact CD1-CZ 4Å; F143-F192 HydrophobicContact CD2-CE1 4.36Å; F143-F192 HydrophobicContact CD2-CZ 4.02Å; F143-F192 AromaticContact CE1-CD1 3.52Å; F143-F192 HydrophobicContact CE1-CD1 3.52Å; F143-F192 AromaticContact CE1-CE1 3.41Å; F143-F192 HydrophobicContact CE1-CE1 3.41Å; F143-F192 VanDerWaalsContact CE1-CE1 3.41Å; F143-F192 HydrophobicContact CE1-CG 4.19Å; F143-F192 AromaticContact CE1-CZ 3.97Å; F143-F192 HydrophobicContact CE1-CZ 3.97Å; F143-F192 HydrophobicContact CE2-CE1 4.27Å; F143-F192 HydrophobicContact CE2-CE2 4.14Å; F143-F192 AromaticContact CE2-CZ 3.97Å; F143-F192 HydrophobicContact CE2-CZ 3.97Å; F143-F192 HydrophobicContact CG-CE1 4Å; F143-F192 HydrophobicContact CG-CZ 4.03Å; F143-F192 AromaticContact CZ-CD1 3.86Å; F143-F192 HydrophobicContact CZ-CD1 3.86Å; F143-F192 HydrophobicContact CZ-CD2 4.23Å; F143-F192 AromaticContact CZ-CE1 3.81Å; F143-F192 HydrophobicContact CZ-CE1 3.81Å; F143-F192 HydrophobicContact CZ-CE2 4.16Å; F143-F192 HydrophobicContact CZ-CG 4.07Å; F143-F192 AromaticContact CZ-CZ 3.95Å; F143-F192 HydrophobicContact CZ-CZ 3.95Å
144	E	87.7	Confident	87.5	Confident	102 Å²	102	37.2 Å²	37.2	48%	0.477	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.1	-29.6	179.8	-69.4	-173.1	-169.7	0	0	116.1	Y141 V146 A150	Y141-E144 WeakPolarHBondContact O-CB 3.26Å; Y141-E144 WeakPolarHBondContact O-CG 3.49Å; Y141-E144 PolarHBondContact O-N 3.25Å; E144-V146 PolarHBondContact O-N 3.05Å; E144-A150 HydrophobicContact CB-CB 4.37Å; E144-A150 HydrophobicContact CG-CB 3.87Å
145	P	88.3	Confident	87.5	Confident	7 Å²	7	32.8 Å²	32.8	5%	0.045	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.3	-33.2	166.6	-31.4	39.3	0	0	0	114.7	L142 F143 L176 A177 T180 F183	L142-P145 WeakPolarHBondContact O-CD 3.29Å; F143-P145 VanDerWaalsContact C-N 3.27Å; F143-P145 VanDerWaalsContact O-N 3.12Å; P145-L176 HydrophobicContact CB-CD2 4.47Å; P145-L176 CarbonylContact O-C 3.57Å; P145-L176 WeakPolarHBondContact O-CA 3.37Å; P145-L176 VanDerWaalsContact O-CB 3.31Å; P145-L176 WeakPolarHBondContact O-CB 3.31Å; P145-A177 PolarHBondContact O-N 3.42Å; P145-T180 HydrophobicContact CB-CG2 4.03Å; P145-T180 HydrophobicContact CG-CG2 3.98Å; P145-F183 HydrophobicContact CB-CD2 4.35Å
146	V	93.1	Very high	87.5	Confident	0 Å²	0	38.2 Å²	38.2	0%	0	23%	0.233	C	C	.	.	B	Isolated β-bridge	trans	-71.9	138.7	-179.9	-175	0	0	0	0	110.2	W127 F143 E144 N148 A149 L162 L176 F183	W127-V146 HydrophobicContact CE3-CG2 4.47Å; W127-V146 HydrophobicContact CZ3-CG2 3.96Å; F143-V146 WeakPolarHBondContact O-CA 3.36Å; F143-V146 WeakPolarHBondContact O-CB 3.35Å; F143-V146 WeakPolarHBondContact O-CG2 3.28Å; F143-V146 PolarHBondContact O-N 3.05Å; E144-V146 PolarHBondContact O-N 3.05Å; V146-N148 PolarHBondContact O-N 2.85Å; V146-A149 HydrophobicContact CB-CB 4.23Å; V146-A149 WeakPolarHBondContact O-CB 3.47Å; V146-A149 PolarHBondContact O-N 2.98Å; V146-A149 VanDerWaalsContact O-N 3.15Å; V146-L162 HydrophobicContact CB-CD1 4.4Å; V146-L162 HydrophobicContact CG1-CD1 3.89Å; V146-L162 HydrophobicContact CG1-CG 4.19Å; V146-L176 HydrophobicContact CG2-CD2 4.17Å; V146-F183 HydrophobicContact CG2-CE2 3.91Å; V146-F183 HydrophobicContact CG2-CZ 4.06Å
147	E	94.2	Very high	87.9	Confident	80 Å²	80	37.1 Å²	37.1	37%	0.374	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.9	134.1	-178.6	-168.1	176.7	-161.4	0	0	111.1	A149 G163 K175	E147-A149 PolarHBondContact O-N 3.06Å; E147-G163 PolarHBondContact O-N 2.68Å; E147-K175 HydrophobicContact CB-CB 4.04Å; E147-K175 PolarHBondContact N-O 2.91Å; E147-K175 WeakPolarHBondContact OE2-CB 3.33Å; E147-K175 WeakPolarHBondContact OE2-CD 3.35Å
148	N	94.1	Very high	88.1	Confident	42 Å²	42	38.4 Å²	38.4	23%	0.225	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	64	-7.7	-177.1	-56.5	-45.8	0	0	0	117.9	V146 A150 D151 I152 K157 E161	V146-N148 PolarHBondContact O-N 2.85Å; N148-A150 PolarHBondContact O-N 2.6Å; N148-D151 PolarHBondContact O-N 2.69Å; N148-I152 HydrophobicContact CB-CD1 4Å; N148-I152 WeakPolarHBondContact O-CG1 3.38Å; N148-I152 PolarHBondContact O-N 2.98Å; N148-K157 HydrophobicContact CB-CD 3.89Å; N148-K157 PolarHBondContact OD1-NZ 3.43Å; N148-E161 WeakPolarHBondContact CB-O 3.34Å; N148-E161 PolarHBondContact ND2-O 3.06Å
149	A	90.4	Very high	88.5	Confident	1 Å²	1	38 Å²	38	1%	0.008	23%	0.225	C	C	.	.	H	α-helix	trans	-56.3	-47.9	-173.6	0	0	0	0	0	114	F143 V146 E147 D151 I152 S153 L162	F143-A149 HydrophobicContact CB-CB 4.04Å; F143-A149 WeakPolarHBondContact O-CB 3.12Å; V146-A149 HydrophobicContact CB-CB 4.23Å; V146-A149 WeakPolarHBondContact O-CB 3.47Å; V146-A149 PolarHBondContact O-N 2.98Å; V146-A149 VanDerWaalsContact O-N 3.15Å; E147-A149 PolarHBondContact O-N 3.06Å; A149-D151 PolarHBondContact O-N 2.89Å; A149-I152 PolarHBondContact O-N 3.07Å; A149-S153 PolarHBondContact O-N 3.31Å; A149-S153 PolarHBondContact O-OG 3.15Å; A149-L162 HydrophobicContact CB-CD1 3.65Å
150	A	85.7	Confident	88.8	Confident	42 Å²	42	44.5 Å²	44.5	35%	0.347	26%	0.255	S	S	.	.	H	α-helix	trans	-60.8	-28.8	177.9	0	0	0	0	0	113.6	E144 N148 A154	E144-A150 HydrophobicContact CB-CB 4.37Å; E144-A150 HydrophobicContact CG-CB 3.87Å; N148-A150 PolarHBondContact O-N 2.6Å; A150-A154 VanDerWaalsContact O-CB 3.23Å; A150-A154 WeakPolarHBondContact O-CB 3.32Å; A150-A154 PolarHBondContact O-N 3.06Å
151	D	88.8	Confident	89.1	Confident	50 Å²	50	48.2 Å²	48.2	27%	0.267	27%	0.27	S	S	.	.	H	α-helix	trans	-80.4	-32.3	174.4	-82.2	-25.2	0	0	0	112.1	N148 A149 A154 G155 K156 K157	N148-D151 PolarHBondContact O-N 2.69Å; A149-D151 PolarHBondContact O-N 2.89Å; D151-A154 CarbonylContact O-C 3.48Å; D151-G155 PolarHBondContact O-N 3.12Å; D151-K156 HydrophobicContact CB-CB 4.28Å; D151-K156 HydrophobicContact CB-CD 4.14Å; D151-K156 WeakPolarHBondContact O-CB 3.33Å; D151-K156 PolarHBondContact O-N 3.47Å; D151-K156 WeakPolarHBondContact OD1-CD 3.48Å; D151-K156 IonicContact OD1-NZ 3Å; D151-K156 PolarHBondContact OD1-NZ 3.29Å; D151-K157 HydrophobicContact CB-CB 4.17Å; D151-K157 HydrophobicContact CB-CD 3.74Å; D151-K157 HydrophobicContact CB-CG 3.94Å; D151-K157 PolarHBondContact O-N 2.92Å; D151-K157 WeakPolarHBondContact OD2-CE 3.39Å; D151-K157 IonicContact OD2-NZ 3.58Å; D151-K157 PolarHBondContact OD2-NZ 2.83Å
152	I	90.1	Very high	89.7	Confident	0 Å²	0	47.3 Å²	47.3	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-71.2	-48.9	177.5	-67.4	162.3	0	0	0	110.6	V131 P133 N148 A149 A154 G155 K157 A158 P159 L162	V131-I152 HydrophobicContact CB-CG2 4.36Å; V131-I152 HydrophobicContact CG2-CB 4.47Å; V131-I152 HydrophobicContact CG2-CG2 3.66Å; P133-I152 WeakPolarHBondContact CD-O 3.47Å; P133-I152 VanDerWaalsContact CG-O 3.25Å; P133-I152 WeakPolarHBondContact CG-O 3.43Å; N148-I152 HydrophobicContact CB-CD1 4Å; N148-I152 WeakPolarHBondContact O-CG1 3.38Å; N148-I152 PolarHBondContact O-N 2.98Å; A149-I152 PolarHBondContact O-N 3.07Å; I152-A154 PolarHBondContact O-N 3.3Å; I152-G155 WeakPolarHBondContact O-CA 3.44Å; I152-G155 PolarHBondContact O-N 3.35Å; I152-K157 HydrophobicContact CG1-CB 3.75Å; I152-A158 WeakPolarHBondContact CD1-O 3.26Å; I152-A158 WeakPolarHBondContact CG1-O 3.3Å; I152-P159 HydrophobicContact CG2-CB 4.27Å; I152-P159 HydrophobicContact CG2-CG 4.1Å; I152-L162 HydrophobicContact CD1-CB 3.74Å; I152-L162 HydrophobicContact CD1-CD1 4Å; I152-L162 HydrophobicContact CD1-CG 4.48Å
153	S	86	Confident	90.1	Very high	37 Å²	37	47.4 Å²	47.4	26%	0.259	27%	0.27	S	S	.	.	H	α-helix	trans	-63.7	-24.1	175.5	-54.3	0	0	0	0	112.4	V131 A149 G155	V131-S153 WeakPolarHBondContact O-CA 3.18Å; V131-S153 PolarHBondContact O-OG 3.36Å; A149-S153 PolarHBondContact O-N 3.31Å; A149-S153 PolarHBondContact O-OG 3.15Å; S153-G155 VanDerWaalsContact C-N 3.34Å
154	A	83.9	Confident	90.3	Very high	59 Å²	59	47.7 Å²	47.7	49%	0.488	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.3	3.4	170.4	0	0	0	0	0	114.3	A150 D151 I152 K156	A150-A154 VanDerWaalsContact O-CB 3.23Å; A150-A154 WeakPolarHBondContact O-CB 3.32Å; A150-A154 PolarHBondContact O-N 3.06Å; D151-A154 CarbonylContact O-C 3.48Å; I152-A154 PolarHBondContact O-N 3.3Å; A154-K156 VanDerWaalsContact C-N 3.3Å; A154-K156 HydrophobicContact CB-CD 4.01Å; A154-K156 HydrophobicContact CB-CG 4.14Å; A154-K156 PolarHBondContact O-N 3.48Å
155	G	84.8	Confident	90.6	Very high	56 Å²	56	48.6 Å²	48.6	58%	0.577	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.6	16.7	178.3	0	0	0	0	0	115.7	D151 I152 S153	D151-G155 PolarHBondContact O-N 3.12Å; I152-G155 WeakPolarHBondContact O-CA 3.44Å; I152-G155 PolarHBondContact O-N 3.35Å; S153-G155 VanDerWaalsContact C-N 3.34Å
156	K	88.6	Confident	90.9	Very high	142 Å²	142	49.8 Å²	49.8	62%	0.617	28%	0.284	S	S	*	.	S	Bend	trans	-91	-22.1	-178	-52.9	158.7	-175.4	155.3	0	113.4	D151 A154	D151-K156 HydrophobicContact CB-CB 4.28Å; D151-K156 HydrophobicContact CB-CD 4.14Å; D151-K156 WeakPolarHBondContact O-CB 3.33Å; D151-K156 PolarHBondContact O-N 3.47Å; D151-K156 WeakPolarHBondContact OD1-CD 3.48Å; D151-K156 IonicContact OD1-NZ 3Å; D151-K156 PolarHBondContact OD1-NZ 3.29Å; A154-K156 VanDerWaalsContact C-N 3.3Å; A154-K156 HydrophobicContact CB-CD 4.01Å; A154-K156 HydrophobicContact CB-CG 4.14Å; A154-K156 PolarHBondContact O-N 3.48Å
157	K	91.8	Very high	90.8	Very high	61 Å²	61	53.4 Å²	53.4	27%	0.265	31%	0.306	S	S	.	.	S	Bend	trans	-131.1	157	-178.6	-79.3	-176.8	-177.4	148.6	0	110.6	N148 D151 I152 E161	N148-K157 HydrophobicContact CB-CD 3.89Å; N148-K157 PolarHBondContact OD1-NZ 3.43Å; D151-K157 HydrophobicContact CB-CB 4.17Å; D151-K157 HydrophobicContact CB-CD 3.74Å; D151-K157 HydrophobicContact CB-CG 3.94Å; D151-K157 PolarHBondContact O-N 2.92Å; D151-K157 WeakPolarHBondContact OD2-CE 3.39Å; D151-K157 IonicContact OD2-NZ 3.58Å; D151-K157 PolarHBondContact OD2-NZ 2.83Å; I152-K157 HydrophobicContact CG1-CB 3.75Å; K157-E161 WeakPolarHBondContact CA-OE1 3.26Å; K157-E161 WeakPolarHBondContact CB-OE1 3.42Å
158	A	89.5	Confident	90.7	Very high	41 Å²	41	51.2 Å²	51.2	34%	0.339	31%	0.306	S	S	.	.			trans	-77.2	143.4	178.2	0	0	0	0	0	110.7	I152 E160 E161	I152-A158 WeakPolarHBondContact CD1-O 3.26Å; I152-A158 WeakPolarHBondContact CG1-O 3.3Å; A158-E160 WeakPolarHBondContact CB-OE2 3.28Å; A158-E160 PolarHBondContact O-N 3.45Å; A158-E160 VanDerWaalsContact O-N 3.08Å; A158-E161 HydrophobicContact CB-CG 4.42Å; A158-E161 PolarHBondContact N-OE1 3.14Å; A158-E161 WeakPolarHBondContact O-CB 3.29Å; A158-E161 PolarHBondContact O-N 3.38Å
159	P	89.8	Confident	90.5	Very high	24 Å²	24	53.2 Å²	53.2	16%	0.156	32%	0.316	C	S	.	.	G	3₁₀ helix	trans	-54.4	-28.2	176.1	-26.8	35.6	0	0	0	113.9	Q128 K132 I152 E161 L162	Q128-P159 HydrophobicContact CB-CB 4.17Å; Q128-P159 HydrophobicContact CG-CB 4.32Å; Q128-P159 WeakPolarHBondContact CG-O 3.22Å; Q128-P159 PolarHBondContact NE2-O 3.43Å; Q128-P159 VanDerWaalsContact NE2-O 3.12Å; K132-P159 HydrophobicContact CD-CG 4.42Å; K132-P159 HydrophobicContact CG-CG 4.43Å; I152-P159 HydrophobicContact CG2-CB 4.27Å; I152-P159 HydrophobicContact CG2-CG 4.1Å; P159-E161 PolarHBondContact O-N 2.95Å; P159-L162 WeakPolarHBondContact O-CB 3.19Å; P159-L162 PolarHBondContact O-N 2.72Å
160	E	91.9	Very high	90.8	Very high	145 Å²	145	56.6 Å²	56.6	68%	0.678	33%	0.329	S	S	*	.	G	3₁₀ helix	trans	-64.3	-14	174.6	-61.5	77.7	-172.7	0	0	113.8	A158	A158-E160 WeakPolarHBondContact CB-OE2 3.28Å; A158-E160 PolarHBondContact O-N 3.45Å; A158-E160 VanDerWaalsContact O-N 3.08Å
161	E	92.4	Very high	91.3	Very high	90 Å²	90	58 Å²	58	42%	0.421	33%	0.329	S	S	.	.	G	3₁₀ helix	trans	-87.9	-2.9	172.9	-61	178	-107.5	0	0	113.5	N148 K157 A158 P159	N148-E161 WeakPolarHBondContact CB-O 3.34Å; N148-E161 PolarHBondContact ND2-O 3.06Å; K157-E161 WeakPolarHBondContact CA-OE1 3.26Å; K157-E161 WeakPolarHBondContact CB-OE1 3.42Å; A158-E161 HydrophobicContact CB-CG 4.42Å; A158-E161 PolarHBondContact N-OE1 3.14Å; A158-E161 WeakPolarHBondContact O-CB 3.29Å; A158-E161 PolarHBondContact O-N 3.38Å; P159-E161 PolarHBondContact O-N 2.95Å
162	L	95.2	Very high	91.6	Very high	9 Å²	9	55.7 Å²	55.7	5%	0.047	32%	0.316	C	S	.	.	S	Bend	trans	-59	142.8	-178.4	-172.7	62.8	0	0	0	111.5	W127 Q128 V131 V146 A149 I152 P159 I164	W127-L162 HydrophobicContact CB-CD2 3.9Å; Q128-L162 HydrophobicContact CG-CB 4.34Å; Q128-L162 HydrophobicContact CG-CD2 4.06Å; V131-L162 HydrophobicContact CG1-CD1 4.4Å; V131-L162 HydrophobicContact CG1-CD2 4.37Å; V131-L162 HydrophobicContact CG2-CD1 4.3Å; V131-L162 HydrophobicContact CG2-CD2 3.92Å; V146-L162 HydrophobicContact CB-CD1 4.4Å; V146-L162 HydrophobicContact CG1-CD1 3.89Å; V146-L162 HydrophobicContact CG1-CG 4.19Å; A149-L162 HydrophobicContact CB-CD1 3.65Å; I152-L162 HydrophobicContact CD1-CB 3.74Å; I152-L162 HydrophobicContact CD1-CD1 4Å; I152-L162 HydrophobicContact CD1-CG 4.48Å; P159-L162 WeakPolarHBondContact O-CB 3.19Å; P159-L162 PolarHBondContact O-N 2.72Å; L162-I164 HydrophobicContact CD2-CG2 3.77Å; L162-I164 HydrophobicContact CG-CG2 4.01Å; L162-I164 PolarHBondContact O-N 3.45Å
163	G	94.3	Very high	91.9	Very high	8 Å²	8	58.2 Å²	58.2	8%	0.082	33%	0.328	C	S	.	.	S	Bend	trans	-66.8	37	177.6	0	0	0	0	0	116.2	E147 I174 K175	E147-G163 PolarHBondContact O-N 2.68Å; G163-I174 CarbonylContact O-C 3.4Å; G163-I174 VanDerWaalsContact O-CA 3.28Å; G163-I174 WeakPolarHBondContact O-CA 3.31Å; G163-K175 PolarHBondContact O-N 2.77Å
164	I	96.1	Very high	92.4	Very high	5 Å²	5	56.5 Å²	56.5	3%	0.026	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	129.2	168.8	-176.4	170.2	0	0	0	109.7	V124 W127 L162 L172 I174	V124-I164 HydrophobicContact CG2-CD1 4.5Å; V124-I164 HydrophobicContact CG2-CG1 4.01Å; V124-I164 HydrophobicContact CG2-CG2 4.49Å; W127-I164 HydrophobicContact CB-CG2 4.13Å; W127-I164 HydrophobicContact CD2-CB 4.5Å; W127-I164 HydrophobicContact CD2-CD1 3.47Å; W127-I164 VanDerWaalsContact CD2-CD1 3.47Å; W127-I164 HydrophobicContact CD2-CG2 4.3Å; W127-I164 HydrophobicContact CE3-CB 3.81Å; W127-I164 HydrophobicContact CE3-CD1 3.53Å; W127-I164 HydrophobicContact CE3-CG1 4.22Å; W127-I164 HydrophobicContact CE3-CG2 3.83Å; W127-I164 HydrophobicContact CG-CD1 4.04Å; W127-I164 HydrophobicContact CG-CG2 4.48Å; W127-I164 HydrophobicContact CH2-CD1 4.05Å; W127-I164 HydrophobicContact CZ2-CD1 3.99Å; W127-I164 HydrophobicContact CZ3-CB 4.12Å; W127-I164 HydrophobicContact CZ3-CD1 3.83Å; W127-I164 HydrophobicContact CZ3-CG1 4.42Å; L162-I164 HydrophobicContact CD2-CG2 3.77Å; L162-I164 HydrophobicContact CG-CG2 4.01Å; L162-I164 PolarHBondContact O-N 3.45Å; I164-L172 HydrophobicContact CD1-CD1 4.39Å; I164-L172 HydrophobicContact CD1-CD2 4.07Å; I164-L172 HydrophobicContact CG1-CD2 3.95Å; I164-I174 HydrophobicContact CB-CG1 4.21Å; I164-I174 HydrophobicContact CD1-CD1 4.41Å; I164-I174 HydrophobicContact CD1-CG1 4.03Å; I164-I174 HydrophobicContact CG1-CG1 3.79Å
165	K	94.6	Very high	92.9	Very high	121 Å²	121	57.1 Å²	57.1	53%	0.526	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140	129.7	-175.6	179.3	-174.9	171.3	-165.9	0	111.8	V167 L172 E173	K165-V167 PolarHBondContact O-N 3.35Å; K165-L172 WeakPolarHBondContact O-CA 3.27Å; K165-E173 PolarHBondContact N-O 3.03Å; K165-E173 PolarHBondContact O-N 3.17Å
166	A	94.4	Very high	93.4	Very high	33 Å²	33	54.8 Å²	54.8	27%	0.273	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69	115.2	163.7	0	0	0	0	0	110	A120 K121 V124	A120-A166 HydrophobicContact CB-CB 3.62Å; K121-A166 HydrophobicContact CG-CB 4.48Å; V124-A166 HydrophobicContact CG2-CB 4.29Å
167	V	90.8	Very high	93.3	Very high	75 Å²	75	50.6 Å²	50.6	46%	0.455	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	-32.2	174	-178.5	0	0	0	0	110.4	K165 E171 E173	K165-V167 PolarHBondContact O-N 3.35Å; V167-E171 HydrophobicContact CB-CB 4.37Å; V167-E171 HydrophobicContact CB-CG 4.35Å; V167-E171 PolarHBondContact N-O 3.1Å; V167-E173 HydrophobicContact CG2-CB 3.59Å
168	G	91.2	Very high	92.9	Very high	35 Å²	35	50.3 Å²	50.3	36%	0.361	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.7	-173.1	165.2	0	0	0	0	0	109.6	A120 Y170 E171	A120-G168 WeakPolarHBondContact CB-O 3.12Å; G168-Y170 PolarHBondContact O-N 3.18Å; G168-E171 PolarHBondContact N-O 3.34Å; G168-E171 PolarHBondContact O-N 3.46Å
169	D	90.6	Very high	92.5	Very high	83 Å²	83	51 Å²	51	44%	0.444	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66	-21.2	-178.7	-66.1	-55.1	0	0	0	113.7	T119 A120 K121	T119-D169 CarbonylContact C-O 3.45Å; T119-D169 WeakPolarHBondContact CA-O 3.22Å; T119-D169 WeakPolarHBondContact CB-O 3.47Å; A120-D169 PolarHBondContact N-O 3.09Å; K121-D169 IonicContact NZ-OD1 3.24Å; K121-D169 PolarHBondContact NZ-OD1 3.09Å
170	Y	95.9	Very high	92.3	Very high	73 Å²	73	50.1 Å²	50.1	29%	0.286	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-127.7	19.9	178.8	-56.2	-71.8	0	0	0	114	L106 E108 G168	L106-Y170 PolarHBondContact N-O 3.03Å; E108-Y170 HydrophobicContact CB-CE2 4.49Å; E108-Y170 HydrophobicContact CG-CD1 4.41Å; E108-Y170 HydrophobicContact CG-CD2 3.83Å; E108-Y170 HydrophobicContact CG-CE2 4.09Å; E108-Y170 HydrophobicContact CG-CG 4Å; G168-Y170 PolarHBondContact O-N 3.18Å
171	E	96.1	Very high	91.7	Very high	72 Å²	72	47.8 Å²	47.8	34%	0.336	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	129.1	177.2	-168.6	173.9	131.3	0	0	111.2	T103 V104 V167 G168	T103-E171 HydrophobicContact CG2-CG 4.31Å; V104-E171 WeakPolarHBondContact O-CA 3.44Å; V167-E171 HydrophobicContact CB-CB 4.37Å; V167-E171 HydrophobicContact CB-CG 4.35Å; V167-E171 PolarHBondContact N-O 3.1Å; G168-E171 PolarHBondContact N-O 3.34Å; G168-E171 PolarHBondContact O-N 3.46Å
172	L	95.4	Very high	91.3	Very high	0 Å²	0	45 Å²	45	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	135.8	176.9	-66.9	162.1	0	0	0	111	I75 T103 V104 L106 A120 Y123 V124 I164 K165	I75-L172 HydrophobicContact CD1-CD1 4.1Å; T103-L172 WeakPolarHBondContact CA-O 3.42Å; V104-L172 HydrophobicContact CB-CB 4.12Å; V104-L172 HydrophobicContact CG2-CB 4.4Å; V104-L172 PolarHBondContact N-O 3.2Å; V104-L172 PolarHBondContact O-N 3.34Å; L106-L172 HydrophobicContact CD1-CD1 4.14Å; L106-L172 HydrophobicContact CD1-CG 4.4Å; L106-L172 HydrophobicContact CD2-CD1 4.2Å; L106-L172 HydrophobicContact CG-CD1 4.38Å; A120-L172 HydrophobicContact CB-CD2 3.7Å; A120-L172 HydrophobicContact CB-CG 3.9Å; A120-L172 WeakPolarHBondContact O-CD2 3.27Å; Y123-L172 HydrophobicContact CD2-CD1 4.04Å; Y123-L172 HydrophobicContact CG-CD1 3.92Å; V124-L172 HydrophobicContact CG2-CD2 3.92Å; I164-L172 HydrophobicContact CD1-CD1 4.39Å; I164-L172 HydrophobicContact CD1-CD2 4.07Å; I164-L172 HydrophobicContact CG1-CD2 3.95Å; K165-L172 WeakPolarHBondContact O-CA 3.27Å
173	E	96.5	Very high	91.1	Very high	54 Å²	54	44.6 Å²	44.6	25%	0.252	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	113.5	161.4	178.7	179.9	99.4	0	0	107.7	T101 K165 V167 K175	T101-E173 HydrophobicContact CG2-CG 4.2Å; K165-E173 PolarHBondContact N-O 3.03Å; K165-E173 PolarHBondContact O-N 3.17Å; V167-E173 HydrophobicContact CG2-CB 3.59Å; E173-K175 VanDerWaalsContact OE1-CE 3.27Å; E173-K175 WeakPolarHBondContact OE1-CE 3.39Å; E173-K175 IonicContact OE1-NZ 2.92Å; E173-K175 PolarHBondContact OE1-NZ 3.31Å
174	I	96.6	Very high	90.9	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	137.1	170.8	-65	153.4	0	0	0	108.1	I75 T101 Y102 V104 W127 G163 I164 L176 F183 L187	I75-I174 HydrophobicContact CD1-CD1 4.12Å; T101-I174 WeakPolarHBondContact CA-O 3.41Å; Y102-I174 PolarHBondContact N-O 3.44Å; Y102-I174 PolarHBondContact O-N 2.98Å; V104-I174 HydrophobicContact CG2-CD1 3.85Å; W127-I174 HydrophobicContact CH2-CD1 3.56Å; W127-I174 HydrophobicContact CH2-CG1 3.99Å; W127-I174 HydrophobicContact CH2-CG2 4.3Å; W127-I174 HydrophobicContact CZ2-CD1 4.21Å; W127-I174 HydrophobicContact CZ3-CD1 4.19Å; W127-I174 HydrophobicContact CZ3-CG1 4.1Å; W127-I174 HydrophobicContact CZ3-CG2 4.08Å; G163-I174 CarbonylContact O-C 3.4Å; G163-I174 VanDerWaalsContact O-CA 3.28Å; G163-I174 WeakPolarHBondContact O-CA 3.31Å; I164-I174 HydrophobicContact CB-CG1 4.21Å; I164-I174 HydrophobicContact CD1-CD1 4.41Å; I164-I174 HydrophobicContact CD1-CG1 4.03Å; I164-I174 HydrophobicContact CG1-CG1 3.79Å; I174-L176 HydrophobicContact CG2-CD2 4.18Å; I174-F183 HydrophobicContact CG2-CE1 4.05Å; I174-F183 HydrophobicContact CG2-CZ 4Å; I174-L187 HydrophobicContact CD1-CD2 4.24Å
175	K	95.5	Very high	90.6	Very high	73 Å²	73	48.8 Å²	48.8	32%	0.317	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	135.1	174.8	-71.9	-178.3	-175.1	128.4	0	110.4	K100 T101 E147 G163 E173	K100-K175 CarbonylContact O-C 3.54Å; K100-K175 WeakPolarHBondContact O-CA 3.39Å; T101-K175 HydrophobicContact CG2-CG 4.46Å; E147-K175 HydrophobicContact CB-CB 4.04Å; E147-K175 PolarHBondContact N-O 2.91Å; E147-K175 WeakPolarHBondContact OE2-CB 3.33Å; E147-K175 WeakPolarHBondContact OE2-CD 3.35Å; G163-K175 PolarHBondContact O-N 2.77Å; E173-K175 VanDerWaalsContact OE1-CE 3.27Å; E173-K175 WeakPolarHBondContact OE1-CE 3.39Å; E173-K175 IonicContact OE1-NZ 2.92Å; E173-K175 PolarHBondContact OE1-NZ 3.31Å
176	L	93.5	Very high	90.5	Very high	6 Å²	6	43 Å²	43	3%	0.031	24%	0.239	C	C	.	.	B	Isolated β-bridge	trans	-103.1	140.7	173.7	-50.9	-174.7	0	0	0	109.9	K100 Y102 P145 V146 I174 K178 F183	K100-L176 PolarHBondContact O-N 3.18Å; Y102-L176 HydrophobicContact CD2-CD1 4.16Å; Y102-L176 HydrophobicContact CD2-CG 4.33Å; Y102-L176 HydrophobicContact CE2-CD1 3.61Å; Y102-L176 HydrophobicContact CE2-CG 4.27Å; P145-L176 HydrophobicContact CB-CD2 4.47Å; P145-L176 CarbonylContact O-C 3.57Å; P145-L176 WeakPolarHBondContact O-CA 3.37Å; P145-L176 VanDerWaalsContact O-CB 3.31Å; P145-L176 WeakPolarHBondContact O-CB 3.31Å; V146-L176 HydrophobicContact CG2-CD2 4.17Å; I174-L176 HydrophobicContact CG2-CD2 4.18Å; L176-K178 VanDerWaalsContact CB-O 3.23Å; L176-K178 WeakPolarHBondContact CB-O 3.1Å; L176-K178 PolarHBondContact O-N 3.32Å; L176-F183 HydrophobicContact CD1-CB 4.27Å; L176-F183 HydrophobicContact CD1-CD1 4.22Å; L176-F183 HydrophobicContact CD1-CD2 4.22Å; L176-F183 HydrophobicContact CD1-CG 3.97Å; L176-F183 HydrophobicContact CD2-CD1 4.25Å; L176-F183 HydrophobicContact CD2-CD2 3.87Å; L176-F183 HydrophobicContact CD2-CE1 3.95Å; L176-F183 HydrophobicContact CD2-CE2 3.57Å; L176-F183 HydrophobicContact CD2-CG 4.22Å; L176-F183 HydrophobicContact CD2-CZ 3.62Å
177	A	88.1	Confident	90.4	Very high	55 Å²	55	41.5 Å²	41.5	46%	0.455	23%	0.227	S	C	.	.	S	Bend	trans	-59.6	-33.6	170	0	0	0	0	0	111.2	K100 P145	K100-A177 PolarHBondContact NZ-O 3.41Å; P145-A177 PolarHBondContact O-N 3.42Å
178	K	82	Confident	90.5	Very high	55 Å²	55	38.3 Å²	38.3	24%	0.239	21%	0.208	C	C	.	.	S	Bend	trans	-145.7	152.6	-175.9	56.7	-176.1	176.9	177.1	0	111.8	L176 T180 G489 N490	L176-K178 VanDerWaalsContact CB-O 3.23Å; L176-K178 WeakPolarHBondContact CB-O 3.1Å; L176-K178 PolarHBondContact O-N 3.32Å; K178-T180 PolarHBondContact O-N 3.22Å; K178-T180 PolarHBondContact O-OG1 3.48Å; K178-T180 VanDerWaalsContact O-OG1 3.05Å; K178-G489 VanDerWaalsContact CD-O 3.27Å; K178-G489 WeakPolarHBondContact CD-O 3.36Å; K178-G489 WeakPolarHBondContact CE-O 3.28Å; K178-G489 PolarHBondContact NZ-O 2.96Å; K178-N490 VanDerWaalsContact CD-OD1 3.29Å; K178-N490 WeakPolarHBondContact CD-OD1 3.5Å; K178-N490 PolarHBondContact NZ-OD1 2.87Å
179	P	81	Confident	90.6	Very high	54 Å²	54	36.8 Å²	36.8	35%	0.351	19%	0.191	S	C	.	.			trans	-63	132.1	175.6	-12.2	29.1	0	0	0	108.8	D98 K100	D98-P179 WeakPolarHBondContact O-CG 3.45Å; K100-P179 HydrophobicContact CG-CG 4.33Å
180	T	85.8	Confident	90.8	Very high	7 Å²	7	32.9 Å²	32.9	4%	0.043	17%	0.17	C	C	.	.			trans	-132.2	98.3	-170.1	-59.9	0	0	0	0	109.5	P145 K178 Y182 F183	P145-T180 HydrophobicContact CB-CG2 4.03Å; P145-T180 HydrophobicContact CG-CG2 3.98Å; K178-T180 PolarHBondContact O-N 3.22Å; K178-T180 PolarHBondContact O-OG1 3.48Å; K178-T180 VanDerWaalsContact O-OG1 3.05Å; T180-Y182 HydrophobicContact CG2-CD1 4.17Å; T180-Y182 HydrophobicContact CG2-CD2 4.08Å; T180-Y182 HydrophobicContact CG2-CE1 3.8Å; T180-Y182 HydrophobicContact CG2-CE2 3.74Å; T180-Y182 HydrophobicContact CG2-CG 4.29Å; T180-Y182 PolarHBondContact O-N 3.26Å; T180-Y182 VanDerWaalsContact O-N 3.11Å; T180-F183 HydrophobicContact CG2-CB 4.23Å; T180-F183 VanDerWaalsContact O-CB 3.32Å; T180-F183 WeakPolarHBondContact O-CB 3.14Å; T180-F183 PolarHBondContact O-N 2.94Å
181	P	79.6	Confident	90.6	Very high	95 Å²	95	29.4 Å²	29.4	62%	0.617	16%	0.157	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.5	-30.7	-168.5	-28.9	36.3	0	0	0	115.2
182	Y	85	Confident	90.5	Very high	33 Å²	33	26 Å²	26	13%	0.129	14%	0.141	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91	4.2	-179.5	54.5	-90.3	0	0	0	114.4	T180 D184 Y185 L186 Y455	T180-Y182 HydrophobicContact CG2-CD1 4.17Å; T180-Y182 HydrophobicContact CG2-CD2 4.08Å; T180-Y182 HydrophobicContact CG2-CE1 3.8Å; T180-Y182 HydrophobicContact CG2-CE2 3.74Å; T180-Y182 HydrophobicContact CG2-CG 4.29Å; T180-Y182 PolarHBondContact O-N 3.26Å; T180-Y182 VanDerWaalsContact O-N 3.11Å; Y182-D184 VanDerWaalsContact C-N 3.26Å; Y182-D184 PolarHBondContact O-N 3.39Å; Y182-Y185 WeakPolarHBondContact O-CB 3.1Å; Y182-Y185 PolarHBondContact O-N 3Å; Y182-L186 HydrophobicContact CD2-CD1 4.17Å; Y182-L186 HydrophobicContact CD2-CG 4.29Å; Y182-L186 HydrophobicContact CE2-CD1 4.09Å; Y182-Y455 HydrophobicContact CD1-CD2 4.47Å; Y182-Y455 HydrophobicContact CD1-CE2 4.07Å; Y182-Y455 HydrophobicContact CD2-CD1 4.41Å; Y182-Y455 AromaticContact CD2-CD2 3.5Å; Y182-Y455 HydrophobicContact CD2-CD2 3.5Å; Y182-Y455 VanDerWaalsContact CD2-CD2 3.5Å; Y182-Y455 HydrophobicContact CD2-CE1 4.31Å; Y182-Y455 AromaticContact CD2-CE2 3.32Å; Y182-Y455 HydrophobicContact CD2-CE2 3.32Å; Y182-Y455 HydrophobicContact CD2-CG 4.06Å; Y182-Y455 AromaticContact CD2-CZ 3.78Å; Y182-Y455 HydrophobicContact CE1-CE2 4.25Å; Y182-Y455 HydrophobicContact CE2-CD2 4.15Å; Y182-Y455 HydrophobicContact CE2-CE1 4.18Å; Y182-Y455 AromaticContact CE2-CE2 3.5Å; Y182-Y455 HydrophobicContact CE2-CE2 3.5Å; Y182-Y455 AromaticContact CE2-CZ 3.53Å; Y182-Y455 AromaticContact CG-CD2 3.68Å; Y182-Y455 HydrophobicContact CG-CD2 3.68Å; Y182-Y455 AromaticContact CG-CE2 3.62Å; Y182-Y455 HydrophobicContact CG-CE2 3.62Å; Y182-Y455 AromaticContact CZ-CE2 3.97Å
183	F	90.8	Very high	90.6	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-61.4	-30.6	-174.4	-165.1	-103.1	0	0	0	113.8	Y102 W127 P145 V146 I174 L176 T180 Y185 L186 L187	Y102-F183 HydrophobicContact CD1-CD1 4Å; Y102-F183 HydrophobicContact CD1-CE1 4.36Å; Y102-F183 HydrophobicContact CD2-CD1 4.48Å; Y102-F183 AromaticContact CE1-CD1 3.74Å; Y102-F183 HydrophobicContact CE1-CD1 3.74Å; Y102-F183 HydrophobicContact CE2-CD1 4.25Å; Y102-F183 HydrophobicContact CG-CD1 4.4Å; Y102-F183 AromaticContact CZ-CD1 3.88Å; W127-F183 HydrophobicContact CH2-CZ 4.01Å; W127-F183 HydrophobicContact CZ3-CZ 4.33Å; P145-F183 HydrophobicContact CB-CD2 4.35Å; V146-F183 HydrophobicContact CG2-CE2 3.91Å; V146-F183 HydrophobicContact CG2-CZ 4.06Å; I174-F183 HydrophobicContact CG2-CE1 4.05Å; I174-F183 HydrophobicContact CG2-CZ 4Å; L176-F183 HydrophobicContact CD1-CB 4.27Å; L176-F183 HydrophobicContact CD1-CD1 4.22Å; L176-F183 HydrophobicContact CD1-CD2 4.22Å; L176-F183 HydrophobicContact CD1-CG 3.97Å; L176-F183 HydrophobicContact CD2-CD1 4.25Å; L176-F183 HydrophobicContact CD2-CD2 3.87Å; L176-F183 HydrophobicContact CD2-CE1 3.95Å; L176-F183 HydrophobicContact CD2-CE2 3.57Å; L176-F183 HydrophobicContact CD2-CG 4.22Å; L176-F183 HydrophobicContact CD2-CZ 3.62Å; T180-F183 HydrophobicContact CG2-CB 4.23Å; T180-F183 VanDerWaalsContact O-CB 3.32Å; T180-F183 WeakPolarHBondContact O-CB 3.14Å; T180-F183 PolarHBondContact O-N 2.94Å; F183-Y185 PolarHBondContact O-N 3.33Å; F183-L186 HydrophobicContact CD2-CB 4.46Å; F183-L186 HydrophobicContact CD2-CD1 3.99Å; F183-L186 HydrophobicContact CE2-CD1 4.41Å; F183-L186 PolarHBondContact O-N 2.97Å; F183-L186 VanDerWaalsContact O-N 3.11Å; F183-L187 HydrophobicContact CD1-CD1 3.96Å; F183-L187 HydrophobicContact CD1-CD2 4.41Å; F183-L187 HydrophobicContact CD1-CG 3.98Å; F183-L187 HydrophobicContact CE1-CD1 3.93Å; F183-L187 HydrophobicContact CE1-CD2 3.7Å; F183-L187 HydrophobicContact CE1-CG 3.78Å; F183-L187 HydrophobicContact CZ-CD2 4.11Å; F183-L187 HydrophobicContact CZ-CG 4.47Å; F183-L187 WeakPolarHBondContact O-CG 3.17Å; F183-L187 PolarHBondContact O-N 3.36Å; F183-L187 VanDerWaalsContact O-N 3.09Å
184	D	89.6	Confident	90.6	Very high	27 Å²	27	23.5 Å²	23.5	14%	0.144	13%	0.129	C	C	.	.	H	α-helix	trans	-57.6	-28.4	171.7	-89.5	9.7	0	0	0	112	Y76 P84 K92 Y182	Y76-D184 HydrophobicContact CD2-CB 4.48Å; Y76-D184 WeakPolarHBondContact CD2-O 3.39Å; Y76-D184 HydrophobicContact CE2-CB 4.05Å; P84-D184 HydrophobicContact CB-CB 4.34Å; P84-D184 VanDerWaalsContact CB-O 3.24Å; P84-D184 WeakPolarHBondContact CB-O 3.49Å; P84-D184 HydrophobicContact CG-CB 4.25Å; P84-D184 VanDerWaalsContact CG-O 3.26Å; P84-D184 WeakPolarHBondContact CG-O 3.36Å; K92-D184 VanDerWaalsContact CE-OD2 3.31Å; K92-D184 WeakPolarHBondContact CE-OD2 3.49Å; K92-D184 IonicContact NZ-OD2 2.72Å; K92-D184 PolarHBondContact NZ-OD2 2.86Å; Y182-D184 VanDerWaalsContact C-N 3.26Å; Y182-D184 PolarHBondContact O-N 3.39Å
185	Y	89.8	Confident	90.5	Very high	73 Å²	73	23.5 Å²	23.5	29%	0.286	13%	0.129	S	C	.	.	H	α-helix	trans	-77.5	-37.9	174.6	-72.3	-93.3	0	0	0	112.5	L78 N82 P84 Y182 F183 L187 A188 F189	L78-Y185 HydrophobicContact CD2-CD1 3.99Å; L78-Y185 HydrophobicContact CD2-CE1 4.2Å; N82-Y185 WeakPolarHBondContact O-CE1 3.46Å; P84-Y185 HydrophobicContact CG-CD1 3.84Å; P84-Y185 HydrophobicContact CG-CD2 4.13Å; P84-Y185 HydrophobicContact CG-CE1 4.01Å; P84-Y185 HydrophobicContact CG-CE2 4.29Å; P84-Y185 HydrophobicContact CG-CG 3.89Å; Y182-Y185 WeakPolarHBondContact O-CB 3.1Å; Y182-Y185 PolarHBondContact O-N 3Å; F183-Y185 PolarHBondContact O-N 3.33Å; Y185-L187 VanDerWaalsContact C-N 3.29Å; Y185-L187 PolarHBondContact O-N 3.06Å; Y185-A188 CarbonylContact O-C 3.5Å; Y185-A188 WeakPolarHBondContact O-CA 3.26Å; Y185-A188 WeakPolarHBondContact O-CB 3.4Å; Y185-A188 PolarHBondContact O-N 2.99Å; Y185-F189 PolarHBondContact O-N 3.37Å
186	L	91.8	Very high	90.5	Very high	1 Å²	1	20.4 Å²	20.4	1%	0.005	12%	0.116	C	C	.	.	H	α-helix	trans	-62.5	-37.9	175.9	-61.4	-178.1	0	0	0	111.2	L142 Y182 F183 A188 F189 F192 Y455	L142-L186 HydrophobicContact CD1-CD2 4.49Å; L142-L186 HydrophobicContact CD2-CD2 4.21Å; Y182-L186 HydrophobicContact CD2-CD1 4.17Å; Y182-L186 HydrophobicContact CD2-CG 4.29Å; Y182-L186 HydrophobicContact CE2-CD1 4.09Å; F183-L186 HydrophobicContact CD2-CB 4.46Å; F183-L186 HydrophobicContact CD2-CD1 3.99Å; F183-L186 HydrophobicContact CE2-CD1 4.41Å; F183-L186 PolarHBondContact O-N 2.97Å; F183-L186 VanDerWaalsContact O-N 3.11Å; L186-A188 PolarHBondContact O-N 2.91Å; L186-A188 VanDerWaalsContact O-N 3.08Å; L186-F189 WeakPolarHBondContact O-CB 3.41Å; L186-F189 PolarHBondContact O-N 3.12Å; L186-F192 HydrophobicContact CB-CD2 4.14Å; L186-F192 HydrophobicContact CB-CE1 4.33Å; L186-F192 HydrophobicContact CB-CE2 3.79Å; L186-F192 HydrophobicContact CB-CZ 3.89Å; L186-F192 HydrophobicContact CD1-CZ 4.12Å; L186-F192 HydrophobicContact CD2-CE2 4.15Å; L186-F192 HydrophobicContact CG-CE2 4.36Å; L186-F192 HydrophobicContact CG-CZ 4.41Å; L186-F192 WeakPolarHBondContact O-CB 3.34Å; L186-F192 WeakPolarHBondContact O-CD2 3.25Å; L186-F192 VanDerWaalsContact O-CG 3.29Å; L186-F192 WeakPolarHBondContact O-CG 3.5Å; L186-Y455 HydrophobicContact CD2-CD1 3.67Å; L186-Y455 HydrophobicContact CD2-CE1 4.13Å; L186-Y455 HydrophobicContact CD2-CG 4.36Å
187	L	94	Very high	90.5	Very high	1 Å²	1	24 Å²	24	1%	0.005	13%	0.132	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63	-11.4	172.4	-65.6	178.9	0	0	0	114.5	I75 Y76 Y102 W127 I174 F183 Y185	I75-L187 HydrophobicContact CB-CB 4.39Å; I75-L187 HydrophobicContact CB-CD2 4.49Å; I75-L187 HydrophobicContact CD1-CD2 3.85Å; I75-L187 HydrophobicContact CG2-CB 4.24Å; I75-L187 HydrophobicContact CG2-CD1 4.25Å; I75-L187 HydrophobicContact CG2-CD2 4.44Å; Y76-L187 HydrophobicContact CD2-CB 3.79Å; Y76-L187 HydrophobicContact CD2-CD1 4.37Å; Y76-L187 HydrophobicContact CE2-CB 4.41Å; Y76-L187 HydrophobicContact CE2-CD1 4.17Å; Y76-L187 HydrophobicContact CG-CB 4.37Å; Y76-L187 PolarHBondContact N-O 3.18Å; Y102-L187 HydrophobicContact CD1-CD1 4.17Å; Y102-L187 HydrophobicContact CE1-CD1 4.46Å; W127-L187 HydrophobicContact CH2-CD2 3.8Å; W127-L187 HydrophobicContact CZ2-CD2 3.85Å; I174-L187 HydrophobicContact CD1-CD2 4.24Å; F183-L187 HydrophobicContact CD1-CD1 3.96Å; F183-L187 HydrophobicContact CD1-CD2 4.41Å; F183-L187 HydrophobicContact CD1-CG 3.98Å; F183-L187 HydrophobicContact CE1-CD1 3.93Å; F183-L187 HydrophobicContact CE1-CD2 3.7Å; F183-L187 HydrophobicContact CE1-CG 3.78Å; F183-L187 HydrophobicContact CZ-CD2 4.11Å; F183-L187 HydrophobicContact CZ-CG 4.47Å; F183-L187 WeakPolarHBondContact O-CG 3.17Å; F183-L187 PolarHBondContact O-N 3.36Å; F183-L187 VanDerWaalsContact O-N 3.09Å; Y185-L187 VanDerWaalsContact C-N 3.29Å; Y185-L187 PolarHBondContact O-N 3.06Å
188	A	92.6	Very high	90.8	Very high	7 Å²	7	26.3 Å²	26.3	6%	0.058	13%	0.132	C	C	.	.	T	Hydrogen-bonded Turn	trans	-106.6	-0.3	173	0	0	0	0	0	113.7	Y76 L78 P84 Y185 L186 F193	Y76-A188 WeakPolarHBondContact O-CA 3.39Å; L78-A188 HydrophobicContact CD2-CB 4.09Å; L78-A188 HydrophobicContact CG-CB 4.38Å; P84-A188 HydrophobicContact CB-CB 4.43Å; Y185-A188 CarbonylContact O-C 3.5Å; Y185-A188 WeakPolarHBondContact O-CA 3.26Å; Y185-A188 WeakPolarHBondContact O-CB 3.4Å; Y185-A188 PolarHBondContact O-N 2.99Å; L186-A188 PolarHBondContact O-N 2.91Å; L186-A188 VanDerWaalsContact O-N 3.08Å; A188-F193 WeakPolarHBondContact O-CE1 3.39Å
189	F	93	Very high	91.4	Very high	4 Å²	4	24.2 Å²	24.2	2%	0.018	12%	0.124	C	C	.	.	S	Bend	trans	-95.7	141.1	-175.6	-168	-94.6	0	0	0	112.1	F65 Y139 L142 Y185 L186 S191 F192 F193 D454	F65-F189 HydrophobicContact CD1-CE1 4.3Å; F65-F189 HydrophobicContact CD1-CZ 4.18Å; F65-F189 AromaticContact CD2-CZ 3.95Å; F65-F189 HydrophobicContact CD2-CZ 3.95Å; F65-F189 AromaticContact CE1-CE1 3.76Å; F65-F189 HydrophobicContact CE1-CE1 3.76Å; F65-F189 AromaticContact CE1-CZ 3.93Å; F65-F189 HydrophobicContact CE1-CZ 3.93Å; F65-F189 HydrophobicContact CE2-CE1 4.22Å; F65-F189 AromaticContact CE2-CZ 3.7Å; F65-F189 HydrophobicContact CE2-CZ 3.7Å; F65-F189 HydrophobicContact CG-CZ 4.2Å; F65-F189 AromaticContact CZ-CE1 3.72Å; F65-F189 HydrophobicContact CZ-CE1 3.72Å; F65-F189 AromaticContact CZ-CZ 3.69Å; F65-F189 HydrophobicContact CZ-CZ 3.69Å; Y139-F189 AromaticContact CD1-CE1 3.89Å; Y139-F189 HydrophobicContact CD1-CE1 3.89Å; Y139-F189 HydrophobicContact CD1-CZ 4.33Å; Y139-F189 AromaticContact CE1-CE1 3.89Å; Y139-F189 HydrophobicContact CE1-CE1 3.89Å; Y139-F189 AromaticContact CE1-CZ 3.85Å; Y139-F189 HydrophobicContact CE1-CZ 3.85Å; L142-F189 HydrophobicContact CD1-CD1 4.24Å; L142-F189 HydrophobicContact CD1-CE1 4.22Å; Y185-F189 PolarHBondContact O-N 3.37Å; L186-F189 WeakPolarHBondContact O-CB 3.41Å; L186-F189 PolarHBondContact O-N 3.12Å; F189-S191 VanDerWaalsContact C-N 3.31Å; F189-S191 PolarHBondContact O-N 2.63Å; F189-S191 VanDerWaalsContact O-N 3.1Å; F189-F192 HydrophobicContact CB-CD2 4.4Å; F189-F192 PolarHBondContact O-N 3.48Å; F189-F193 VanDerWaalsContact O-CD1 3.3Å; F189-F193 WeakPolarHBondContact O-CD1 3.49Å; F189-F193 WeakPolarHBondContact O-CE1 3.22Å; F189-D454 HydrophobicContact CD2-CB 4.17Å; F189-D454 HydrophobicContact CE2-CB 3.82Å; F189-D454 WeakPolarHBondContact CE2-OD1 3.3Å; F189-D454 HydrophobicContact CZ-CB 4.18Å; F189-D454 WeakPolarHBondContact CZ-OD1 3.36Å
190	P	94.2	Very high	91.9	Very high	0 Å²	0	22.1 Å²	22.1	0%	0	11%	0.11	C	C	.	.	G	3₁₀ helix	trans	-56.7	-32.2	-168.7	-30.1	37.1	0	0	0	116.7	F65 L68 F192 F193 A542	F65-P190 HydrophobicContact CB-CG 4.39Å; F65-P190 HydrophobicContact CD1-CB 3.82Å; F65-P190 HydrophobicContact CD1-CG 3.88Å; F65-P190 HydrophobicContact CE1-CB 4.32Å; F65-P190 HydrophobicContact CG-CG 4.49Å; L68-P190 HydrophobicContact CB-CB 3.96Å; L68-P190 HydrophobicContact CB-CG 4.41Å; L68-P190 HydrophobicContact CD1-CB 4.32Å; P190-F192 PolarHBondContact O-N 2.64Å; P190-F193 HydrophobicContact CB-CD2 4.18Å; P190-F193 HydrophobicContact CB-CE2 4.17Å; P190-F193 HydrophobicContact CG-CE2 4.21Å; P190-F193 HydrophobicContact CG-CZ 4.36Å; P190-F193 WeakPolarHBondContact O-CB 3.4Å; P190-F193 WeakPolarHBondContact O-CG 3.26Å; P190-F193 PolarHBondContact O-N 2.76Å; P190-F193 VanDerWaalsContact O-N 3.08Å; P190-A542 HydrophobicContact CG-CB 4.23Å
191	S	92.4	Very high	92.2	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	14%	0.136	C	C	.	.	G	3₁₀ helix	trans	-62.4	-23	178.4	-51.8	0	0	0	0	113.9	F143 F189	F143-S191 WeakPolarHBondContact CZ-O 3.32Å; F189-S191 VanDerWaalsContact C-N 3.31Å; F189-S191 PolarHBondContact O-N 2.63Å; F189-S191 VanDerWaalsContact O-N 3.1Å
192	F	94.5	Very high	92.8	Very high	2 Å²	2	30.1 Å²	30.1	1%	0.009	14%	0.139	C	C	.	.	G	3₁₀ helix	trans	-93.9	3.6	178.5	-66.6	-98.5	0	0	0	113.2	W127 L142 F143 L186 F189 P190	W127-F192 HydrophobicContact CD2-CD1 4.25Å; W127-F192 AromaticContact CE2-CD1 3.79Å; W127-F192 HydrophobicContact CE3-CD1 4.5Å; W127-F192 AromaticContact CH2-CD1 3.93Å; W127-F192 HydrophobicContact CH2-CD1 3.93Å; W127-F192 HydrophobicContact CH2-CE1 4.49Å; W127-F192 HydrophobicContact CZ2-CB 4.2Å; W127-F192 AromaticContact CZ2-CD1 3.64Å; W127-F192 HydrophobicContact CZ2-CD1 3.64Å; W127-F192 HydrophobicContact CZ2-CG 4.42Å; W127-F192 HydrophobicContact CZ3-CD1 4.35Å; W127-F192 PolarHBondContact NE1-O 3.49Å; L142-F192 HydrophobicContact CB-CE2 3.9Å; L142-F192 HydrophobicContact CB-CZ 3.96Å; L142-F192 HydrophobicContact CD1-CE2 4.35Å; F143-F192 HydrophobicContact CD1-CD1 4.09Å; F143-F192 AromaticContact CD1-CE1 3.51Å; F143-F192 HydrophobicContact CD1-CE1 3.51Å; F143-F192 HydrophobicContact CD1-CZ 4Å; F143-F192 HydrophobicContact CD2-CE1 4.36Å; F143-F192 HydrophobicContact CD2-CZ 4.02Å; F143-F192 AromaticContact CE1-CD1 3.52Å; F143-F192 HydrophobicContact CE1-CD1 3.52Å; F143-F192 AromaticContact CE1-CE1 3.41Å; F143-F192 HydrophobicContact CE1-CE1 3.41Å; F143-F192 VanDerWaalsContact CE1-CE1 3.41Å; F143-F192 HydrophobicContact CE1-CG 4.19Å; F143-F192 AromaticContact CE1-CZ 3.97Å; F143-F192 HydrophobicContact CE1-CZ 3.97Å; F143-F192 HydrophobicContact CE2-CE1 4.27Å; F143-F192 HydrophobicContact CE2-CE2 4.14Å; F143-F192 AromaticContact CE2-CZ 3.97Å; F143-F192 HydrophobicContact CE2-CZ 3.97Å; F143-F192 HydrophobicContact CG-CE1 4Å; F143-F192 HydrophobicContact CG-CZ 4.03Å; F143-F192 AromaticContact CZ-CD1 3.86Å; F143-F192 HydrophobicContact CZ-CD1 3.86Å; F143-F192 HydrophobicContact CZ-CD2 4.23Å; F143-F192 AromaticContact CZ-CE1 3.81Å; F143-F192 HydrophobicContact CZ-CE1 3.81Å; F143-F192 HydrophobicContact CZ-CE2 4.16Å; F143-F192 HydrophobicContact CZ-CG 4.07Å; F143-F192 AromaticContact CZ-CZ 3.95Å; F143-F192 HydrophobicContact CZ-CZ 3.95Å; L186-F192 HydrophobicContact CB-CD2 4.14Å; L186-F192 HydrophobicContact CB-CE1 4.33Å; L186-F192 HydrophobicContact CB-CE2 3.79Å; L186-F192 HydrophobicContact CB-CZ 3.89Å; L186-F192 HydrophobicContact CD1-CZ 4.12Å; L186-F192 HydrophobicContact CD2-CE2 4.15Å; L186-F192 HydrophobicContact CG-CE2 4.36Å; L186-F192 HydrophobicContact CG-CZ 4.41Å; L186-F192 WeakPolarHBondContact O-CB 3.34Å; L186-F192 WeakPolarHBondContact O-CD2 3.25Å; L186-F192 VanDerWaalsContact O-CG 3.29Å; L186-F192 WeakPolarHBondContact O-CG 3.5Å; F189-F192 HydrophobicContact CB-CD2 4.4Å; F189-F192 PolarHBondContact O-N 3.48Å; P190-F192 PolarHBondContact O-N 2.64Å
193	F	96.3	Very high	93.1	Very high	1 Å²	1	30.4 Å²	30.4	0%	0.004	14%	0.143	C	C	.	.	S	Bend	trans	-72.9	157.1	178.1	-69	4.4	0	0	0	111	L56 A188 F189 P190	L56-F193 HydrophobicContact CD2-CB 4.12Å; A188-F193 WeakPolarHBondContact O-CE1 3.39Å; F189-F193 VanDerWaalsContact O-CD1 3.3Å; F189-F193 WeakPolarHBondContact O-CD1 3.49Å; F189-F193 WeakPolarHBondContact O-CE1 3.22Å; P190-F193 HydrophobicContact CB-CD2 4.18Å; P190-F193 HydrophobicContact CB-CE2 4.17Å; P190-F193 HydrophobicContact CG-CE2 4.21Å; P190-F193 HydrophobicContact CG-CZ 4.36Å; P190-F193 WeakPolarHBondContact O-CB 3.4Å; P190-F193 WeakPolarHBondContact O-CG 3.26Å; P190-F193 PolarHBondContact O-N 2.76Å; P190-F193 VanDerWaalsContact O-N 3.08Å
194	P	96.2	Very high	93.1	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	16%	0.163	C	C	.	.			trans	-70.8	158.1	-177	30.3	-32.5	0	0	0	111	E73 W112 V118 D122 Y123	E73-P194 VanDerWaalsContact O-CD 3.28Å; E73-P194 WeakPolarHBondContact O-CD 3.41Å; W112-P194 HydrophobicContact CH2-CB 4.25Å; W112-P194 HydrophobicContact CH2-CG 4Å; W112-P194 WeakPolarHBondContact CH2-O 3.43Å; W112-P194 HydrophobicContact CZ2-CB 4.06Å; W112-P194 HydrophobicContact CZ2-CG 4.13Å; V118-P194 HydrophobicContact CG1-CB 4.26Å; V118-P194 HydrophobicContact CG1-CG 3.97Å; D122-P194 HydrophobicContact CB-CB 3.81Å; Y123-P194 HydrophobicContact CD1-CB 3.92Å; Y123-P194 HydrophobicContact CD1-CG 4.41Å; Y123-P194 HydrophobicContact CD2-CB 3.95Å; Y123-P194 HydrophobicContact CE1-CB 3.88Å; Y123-P194 VanDerWaalsContact CE1-CD 3.46Å; Y123-P194 HydrophobicContact CE1-CG 3.86Å; Y123-P194 HydrophobicContact CE2-CB 3.91Å; Y123-P194 HydrophobicContact CE2-CG 4.09Å; Y123-P194 HydrophobicContact CG-CB 3.96Å
195	Q	95.7	Very high	92.9	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	20%	0.199	C	C	.	.			trans	-130.2	127.5	171.4	-67.6	179.1	54.2	0	0	109.9	L56 S57 D122 F125 G126 Q197 V200	L56-Q195 HydrophobicContact CD1-CG 3.9Å; L56-Q195 VanDerWaalsContact CD1-NE2 3.25Å; L56-Q195 HydrophobicContact CD2-CG 3.92Å; L56-Q195 HydrophobicContact CG-CG 4.01Å; S57-Q195 PolarHBondContact OG-NE2 2.9Å; D122-Q195 WeakPolarHBondContact CA-O 3.45Å; D122-Q195 WeakPolarHBondContact CB-O 3.46Å; D122-Q195 PolarHBondContact O-N 2.9Å; F125-Q195 HydrophobicContact CD1-CB 4.09Å; F125-Q195 HydrophobicContact CE1-CB 4.29Å; G126-Q195 PolarHBondContact O-NE2 2.92Å; Q195-Q197 PolarHBondContact O-N 3.32Å; Q195-V200 HydrophobicContact CB-CG2 4.39Å
196	N	95.4	Very high	92.9	Very high	8 Å²	8	42.4 Å²	42.4	4%	0.043	21%	0.209	C	C	.	.			trans	-66.8	103	175.9	-175.3	-61.4	0	0	0	109.7	W112 D116 K198 V199 V200 V215	W112-N196 HydrophobicContact CD2-CB 4.08Å; W112-N196 HydrophobicContact CH2-CB 4.46Å; W112-N196 HydrophobicContact CZ2-CB 3.94Å; D116-N196 PolarHBondContact OD2-ND2 2.83Å; N196-K198 VanDerWaalsContact C-N 3.28Å; N196-K198 PolarHBondContact O-N 3.43Å; N196-K198 PolarHBondContact OD1-N 2.92Å; N196-V199 HydrophobicContact CB-CB 4.29Å; N196-V199 HydrophobicContact CB-CG2 4.41Å; N196-V199 PolarHBondContact O-N 2.98Å; N196-V199 VanDerWaalsContact O-N 3.12Å; N196-V199 WeakPolarHBondContact OD1-CG2 3.48Å; N196-V199 PolarHBondContact OD1-N 3.22Å; N196-V199 VanDerWaalsContact OD1-N 3.08Å; N196-V200 PolarHBondContact O-N 3.45Å; N196-V200 VanDerWaalsContact O-N 3.13Å; N196-V215 HydrophobicContact CB-CG2 3.51Å
197	Q	93.7	Very high	92.9	Very high	80 Å²	80	43 Å²	43	37%	0.374	21%	0.211	S	C	.	.	H	α-helix	trans	-51.2	-47.2	-174.4	173.8	169.4	10.3	0	0	112.5	F125 Q195 V199 V200 E201	F125-Q197 HydrophobicContact CB-CB 4.27Å; F125-Q197 HydrophobicContact CD1-CB 3.83Å; F125-Q197 HydrophobicContact CD1-CG 4.37Å; F125-Q197 HydrophobicContact CD2-CB 3.89Å; F125-Q197 HydrophobicContact CD2-CG 3.59Å; F125-Q197 HydrophobicContact CE1-CB 4.14Å; F125-Q197 HydrophobicContact CE1-CG 4.42Å; F125-Q197 HydrophobicContact CE2-CB 4.17Å; F125-Q197 HydrophobicContact CE2-CG 3.63Å; F125-Q197 HydrophobicContact CG-CB 3.71Å; F125-Q197 HydrophobicContact CG-CG 3.97Å; F125-Q197 HydrophobicContact CZ-CB 4.29Å; F125-Q197 HydrophobicContact CZ-CG 4.06Å; Q195-Q197 PolarHBondContact O-N 3.32Å; Q197-V199 PolarHBondContact O-N 3.19Å; Q197-V200 PolarHBondContact O-N 3.39Å; Q197-E201 HydrophobicContact CG-CG 4.27Å; Q197-E201 WeakPolarHBondContact CG-OE1 3.11Å; Q197-E201 PolarHBondContact NE2-OE1 3.29Å; Q197-E201 WeakPolarHBondContact O-CB 3.45Å; Q197-E201 WeakPolarHBondContact O-CG 3.3Å; Q197-E201 PolarHBondContact O-N 2.95Å
198	K	92.4	Very high	92.8	Very high	105 Å²	105	43.1 Å²	43.1	46%	0.457	21%	0.212	S	C	.	.	H	α-helix	trans	-59.2	-43.7	-178.9	165.5	-174.9	150.3	-146.1	0	112.1	D116 N196 E201 E202	D116-K198 IonicContact OD1-NZ 3.13Å; D116-K198 PolarHBondContact OD1-NZ 2.85Å; D116-K198 IonicContact OD2-NZ 3.35Å; D116-K198 PolarHBondContact OD2-NZ 3.38Å; N196-K198 VanDerWaalsContact C-N 3.28Å; N196-K198 PolarHBondContact O-N 3.43Å; N196-K198 PolarHBondContact OD1-N 2.92Å; K198-E201 PolarHBondContact O-N 3.49Å; K198-E202 WeakPolarHBondContact O-CB 3.5Å; K198-E202 PolarHBondContact O-N 3.41Å
199	V	94.6	Very high	92.6	Very high	11 Å²	11	44.4 Å²	44.4	7%	0.067	22%	0.219	C	C	.	.	H	α-helix	trans	-72.6	-32.6	-179.8	173.7	0	0	0	0	112	N196 Q197 N203 Y207 V215	N196-V199 HydrophobicContact CB-CB 4.29Å; N196-V199 HydrophobicContact CB-CG2 4.41Å; N196-V199 PolarHBondContact O-N 2.98Å; N196-V199 VanDerWaalsContact O-N 3.12Å; N196-V199 WeakPolarHBondContact OD1-CG2 3.48Å; N196-V199 PolarHBondContact OD1-N 3.22Å; N196-V199 VanDerWaalsContact OD1-N 3.08Å; Q197-V199 PolarHBondContact O-N 3.19Å; V199-N203 PolarHBondContact O-N 3.02Å; V199-N203 PolarHBondContact O-ND2 3.16Å; V199-Y207 HydrophobicContact CG1-CD2 4.49Å; V199-Y207 HydrophobicContact CG1-CE2 4.44Å; V199-V215 HydrophobicContact CB-CG2 4.12Å; V199-V215 HydrophobicContact CG1-CG1 4.35Å; V199-V215 HydrophobicContact CG1-CG2 4.25Å; V199-V215 HydrophobicContact CG2-CG1 3.9Å; V199-V215 HydrophobicContact CG2-CG2 3.83Å
200	V	92.7	Very high	92.5	Very high	10 Å²	10	47.6 Å²	47.6	6%	0.061	23%	0.233	C	C	.	.	H	α-helix	trans	-67.9	-45.1	172.3	176.1	0	0	0	0	110.9	F125 Q195 N196 Q197 G204 Y207	F125-V200 HydrophobicContact CE1-CB 3.89Å; F125-V200 HydrophobicContact CE1-CG1 4.03Å; F125-V200 HydrophobicContact CE1-CG2 3.98Å; F125-V200 HydrophobicContact CZ-CB 4.01Å; F125-V200 HydrophobicContact CZ-CG1 3.87Å; Q195-V200 HydrophobicContact CB-CG2 4.39Å; N196-V200 PolarHBondContact O-N 3.45Å; N196-V200 VanDerWaalsContact O-N 3.13Å; Q197-V200 PolarHBondContact O-N 3.39Å; V200-G204 WeakPolarHBondContact O-CA 3.42Å; V200-G204 PolarHBondContact O-N 3.01Å; V200-Y207 HydrophobicContact CB-CD2 4.35Å; V200-Y207 HydrophobicContact CB-CG 4.46Å; V200-Y207 HydrophobicContact CG1-CG 4.46Å; V200-Y207 HydrophobicContact CG2-CD1 4.1Å; V200-Y207 HydrophobicContact CG2-CD2 3.76Å; V200-Y207 HydrophobicContact CG2-CE1 3.9Å; V200-Y207 HydrophobicContact CG2-CE2 3.56Å; V200-Y207 HydrophobicContact CG2-CG 4.03Å
201	E	92.6	Very high	92.4	Very high	123 Å²	123	48.7 Å²	48.7	58%	0.575	24%	0.241	S	C	*	.	H	α-helix	trans	-68.7	-35.2	178.5	-71.6	176.1	175.3	0	0	113	Q197 K198	Q197-E201 HydrophobicContact CG-CG 4.27Å; Q197-E201 WeakPolarHBondContact CG-OE1 3.11Å; Q197-E201 PolarHBondContact NE2-OE1 3.29Å; Q197-E201 WeakPolarHBondContact O-CB 3.45Å; Q197-E201 WeakPolarHBondContact O-CG 3.3Å; Q197-E201 PolarHBondContact O-N 2.95Å; K198-E201 PolarHBondContact O-N 3.49Å
202	E	91.2	Very high	92.2	Very high	146 Å²	146	53.9 Å²	53.9	68%	0.682	27%	0.269	S	S	*	.	H	α-helix	trans	-70.2	-36.7	179.3	-176.5	169.3	-174.3	0	0	112.8	K198	K198-E202 WeakPolarHBondContact O-CB 3.5Å; K198-E202 PolarHBondContact O-N 3.41Å
203	N	92.2	Very high	92.2	Very high	39 Å²	39	55.9 Å²	55.9	21%	0.209	28%	0.277	C	S	.	.	H	α-helix	trans	-94.6	-25.9	179.8	-65	-75.7	0	0	0	113.3	V199 K205 E206 K213	V199-N203 PolarHBondContact O-N 3.02Å; V199-N203 PolarHBondContact O-ND2 3.16Å; N203-K205 PolarHBondContact O-N 3.46Å; N203-K205 VanDerWaalsContact O-N 3.08Å; N203-E206 HydrophobicContact CB-CB 4.4Å; N203-E206 PolarHBondContact O-N 3.24Å; N203-K213 HydrophobicContact CB-CD 4.49Å; N203-K213 WeakPolarHBondContact OD1-CD 3.21Å
204	G	90.3	Very high	92	Very high	42 Å²	42	56.3 Å²	56.3	43%	0.433	28%	0.281	S	S	.	.	G	3₁₀ helix	trans	58.1	-111.6	176.8	0	0	0	0	0	112.6	V200 E206 Y207	V200-G204 WeakPolarHBondContact O-CA 3.42Å; V200-G204 PolarHBondContact O-N 3.01Å; G204-E206 VanDerWaalsContact C-N 3.29Å; G204-E206 PolarHBondContact O-N 3.13Å; G204-Y207 WeakPolarHBondContact O-CB 3.44Å; G204-Y207 PolarHBondContact O-N 3.17Å
205	K	85.6	Confident	92	Very high	204 Å²	204	57 Å²	57	89%	0.887	29%	0.285	S	S	*	.	G	3₁₀ helix	trans	-73.7	-17.6	177	-71	-166.1	174.2	-166.1	0	114.2	N203 Y207	N203-K205 PolarHBondContact O-N 3.46Å; N203-K205 VanDerWaalsContact O-N 3.08Å; K205-Y207 VanDerWaalsContact C-N 3.32Å
206	E	89.3	Confident	92	Very high	107 Å²	107	57.4 Å²	57.4	50%	0.5	29%	0.286	S	S	.	.	G	3₁₀ helix	trans	-88	-1.1	174.7	-60.1	-62.1	157	0	0	112.2	N203 G204 A208 T209 K213	N203-E206 HydrophobicContact CB-CB 4.4Å; N203-E206 PolarHBondContact O-N 3.24Å; G204-E206 VanDerWaalsContact C-N 3.29Å; G204-E206 PolarHBondContact O-N 3.13Å; E206-A208 PolarHBondContact O-N 2.82Å; E206-T209 PolarHBondContact O-N 3.48Å; E206-T209 PolarHBondContact O-OG1 3.13Å; E206-T209 PolarHBondContact OE2-OG1 3.41Å; E206-K213 HydrophobicContact CB-CD 4.03Å; E206-K213 HydrophobicContact CB-CG 4.48Å; E206-K213 WeakPolarHBondContact O-CB 3.12Å; E206-K213 VanDerWaalsContact O-CG 3.3Å; E206-K213 WeakPolarHBondContact O-CG 3.26Å
207	Y	92.1	Very high	92	Very high	13 Å²	13	57.4 Å²	57.4	5%	0.051	29%	0.286	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.8	126.6	177.8	175.5	-108.4	0	0	0	110.4	D55 Y72 V199 V200 G204 K205 T209 K213 S214	D55-Y207 HydrophobicContact CB-CE1 4.39Å; Y72-Y207 PolarHBondContact OH-OH 2.61Å; Y72-Y207 VanDerWaalsContact OH-OH 3.13Å; V199-Y207 HydrophobicContact CG1-CD2 4.49Å; V199-Y207 HydrophobicContact CG1-CE2 4.44Å; V200-Y207 HydrophobicContact CB-CD2 4.35Å; V200-Y207 HydrophobicContact CB-CG 4.46Å; V200-Y207 HydrophobicContact CG1-CG 4.46Å; V200-Y207 HydrophobicContact CG2-CD1 4.1Å; V200-Y207 HydrophobicContact CG2-CD2 3.76Å; V200-Y207 HydrophobicContact CG2-CE1 3.9Å; V200-Y207 HydrophobicContact CG2-CE2 3.56Å; V200-Y207 HydrophobicContact CG2-CG 4.03Å; G204-Y207 WeakPolarHBondContact O-CB 3.44Å; G204-Y207 PolarHBondContact O-N 3.17Å; K205-Y207 VanDerWaalsContact C-N 3.32Å; Y207-T209 PolarHBondContact O-N 2.93Å; Y207-K213 VanDerWaalsContact CD2-O 3.28Å; Y207-K213 WeakPolarHBondContact CD2-O 3.33Å; Y207-S214 WeakPolarHBondContact CE2-OG 3.35Å
208	A	90.9	Very high	92.1	Very high	4 Å²	4	53.6 Å²	53.6	3%	0.033	27%	0.269	C	S	.	.	T	Hydrogen-bonded Turn	trans	56.5	13.6	-177.8	0	0	0	0	0	116.6	A54 D55 E206 K210 K213 S214	A54-A208 HydrophobicContact CB-CB 4.13Å; D55-A208 HydrophobicContact CB-CB 3.97Å; E206-A208 PolarHBondContact O-N 2.82Å; A208-K210 PolarHBondContact O-N 3.26Å; A208-K213 PolarHBondContact N-O 3.39Å; A208-S214 VanDerWaalsContact CA-OG 3.24Å; A208-S214 WeakPolarHBondContact CA-OG 3.45Å; A208-S214 VanDerWaalsContact CB-OG 3.29Å; A208-S214 WeakPolarHBondContact CB-OG 3.25Å; A208-S214 PolarHBondContact N-OG 3.03Å
209	T	90.3	Very high	92.3	Very high	34 Å²	34	48.6 Å²	48.6	21%	0.209	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.1	-21.6	169.7	62.5	0	0	0	0	112	E206 Y207 P228	E206-T209 PolarHBondContact O-N 3.48Å; E206-T209 PolarHBondContact O-OG1 3.13Å; E206-T209 PolarHBondContact OE2-OG1 3.41Å; Y207-T209 PolarHBondContact O-N 2.93Å; T209-P228 WeakPolarHBondContact O-CD 3.34Å
210	K	90.1	Very high	92.4	Very high	71 Å²	71	48.1 Å²	48.1	31%	0.309	24%	0.244	S	C	.	.	S	Bend	trans	-142.7	160.3	173.5	-58.4	-174.7	168.9	-74.8	0	111	A208 D212 K213 D226	A208-K210 PolarHBondContact O-N 3.26Å; K210-D212 PolarHBondContact O-N 2.89Å; K210-K213 HydrophobicContact CB-CG 3.99Å; K210-K213 WeakPolarHBondContact O-CB 3.43Å; K210-K213 PolarHBondContact O-N 3.45Å; K210-D226 PolarHBondContact NZ-O 3.45Å; K210-D226 IonicContact NZ-OD1 3.06Å; K210-D226 PolarHBondContact NZ-OD1 3.27Å
211	S	91	Very high	92.6	Very high	22 Å²	22	48.4 Å²	48.4	15%	0.154	25%	0.246	C	C	.	.	G	3₁₀ helix	trans	-57.9	-26.3	174.2	46.4	0	0	0	0	114.6	K213 Y216 L222 G224 F225	S211-K213 VanDerWaalsContact C-N 3.33Å; S211-Y216 PolarHBondContact O-OH 3.13Å; S211-L222 VanDerWaalsContact CB-O 3.32Å; S211-L222 WeakPolarHBondContact CB-O 3.39Å; S211-G224 PolarHBondContact OG-N 3.48Å; S211-F225 WeakPolarHBondContact CB-O 3.49Å; S211-F225 PolarHBondContact N-O 3.09Å; S211-F225 PolarHBondContact OG-N 3.01Å; S211-F225 PolarHBondContact OG-O 3.23Å
212	D	90.1	Very high	92.8	Very high	110 Å²	110	42.8 Å²	42.8	59%	0.588	22%	0.219	S	C	*	.	G	3₁₀ helix	trans	-89.6	8.7	175.7	86.4	-35.4	0	0	0	113.8	K210	K210-D212 PolarHBondContact O-N 2.89Å
213	K	92.9	Very high	92.8	Very high	43 Å²	43	39.7 Å²	39.7	19%	0.187	21%	0.205	C	C	.	.	G	3₁₀ helix	trans	-111.9	13.5	179.8	-55.5	-74	157.8	-84.8	0	113.5	N203 E206 Y207 A208 K210 S211	N203-K213 HydrophobicContact CB-CD 4.49Å; N203-K213 WeakPolarHBondContact OD1-CD 3.21Å; E206-K213 HydrophobicContact CB-CD 4.03Å; E206-K213 HydrophobicContact CB-CG 4.48Å; E206-K213 WeakPolarHBondContact O-CB 3.12Å; E206-K213 VanDerWaalsContact O-CG 3.3Å; E206-K213 WeakPolarHBondContact O-CG 3.26Å; Y207-K213 VanDerWaalsContact CD2-O 3.28Å; Y207-K213 WeakPolarHBondContact CD2-O 3.33Å; A208-K213 PolarHBondContact N-O 3.39Å; K210-K213 HydrophobicContact CB-CG 3.99Å; K210-K213 WeakPolarHBondContact O-CB 3.43Å; K210-K213 PolarHBondContact O-N 3.45Å; S211-K213 VanDerWaalsContact C-N 3.33Å
214	S	93	Very high	92.6	Very high	11 Å²	11	39.8 Å²	39.8	8%	0.077	22%	0.216	C	C	.	.			trans	-143.5	169.8	177.9	-60.6	0	0	0	0	111.3	Y207 A208	Y207-S214 WeakPolarHBondContact CE2-OG 3.35Å; A208-S214 VanDerWaalsContact CA-OG 3.24Å; A208-S214 WeakPolarHBondContact CA-OG 3.45Å; A208-S214 VanDerWaalsContact CB-OG 3.29Å; A208-S214 WeakPolarHBondContact CB-OG 3.25Å; A208-S214 PolarHBondContact N-OG 3.03Å
215	V	95.3	Very high	92.6	Very high	14 Å²	14	37.8 Å²	37.8	9%	0.085	20%	0.195	C	C	.	.			trans	-131	152.1	171.3	-68.6	0	0	0	0	109.4	Y72 W112 S113 N114 N196 V199	Y72-V215 WeakPolarHBondContact CE1-O 3.2Å; Y72-V215 PolarHBondContact OH-O 3Å; W112-V215 HydrophobicContact CB-CG2 4.43Å; W112-V215 HydrophobicContact CD2-CG2 4.03Å; W112-V215 HydrophobicContact CE3-CB 4.27Å; W112-V215 HydrophobicContact CE3-CG2 3.76Å; W112-V215 HydrophobicContact CG-CG2 4.34Å; W112-V215 HydrophobicContact CZ3-CG2 4.37Å; W112-V215 WeakPolarHBondContact CZ3-O 3.37Å; S113-V215 WeakPolarHBondContact OG-CA 3.26Å; N114-V215 HydrophobicContact CB-CG1 3.89Å; N196-V215 HydrophobicContact CB-CG2 3.51Å; V199-V215 HydrophobicContact CB-CG2 4.12Å; V199-V215 HydrophobicContact CG1-CG1 4.35Å; V199-V215 HydrophobicContact CG1-CG2 4.25Å; V199-V215 HydrophobicContact CG2-CG1 3.9Å; V199-V215 HydrophobicContact CG2-CG2 3.83Å
216	Y	96.6	Very high	92.6	Very high	8 Å²	8	31.4 Å²	31.4	3%	0.031	17%	0.17	C	C	.	.			trans	-126.7	134.7	-160.4	-58.3	-60.6	0	0	0	110.2	V71 Y72 W112 S113 S211 T221 L222	V71-Y216 HydrophobicContact CB-CD1 3.79Å; V71-Y216 HydrophobicContact CB-CE1 4.36Å; V71-Y216 HydrophobicContact CB-CG 4.28Å; V71-Y216 HydrophobicContact CG2-CD1 3.62Å; V71-Y216 HydrophobicContact CG2-CE1 3.87Å; V71-Y216 VanDerWaalsContact O-CB 3.29Å; V71-Y216 WeakPolarHBondContact O-CB 3.46Å; Y72-Y216 HydrophobicContact CD2-CD1 4.49Å; Y72-Y216 HydrophobicContact CE1-CD1 4.46Å; Y72-Y216 AromaticContact CE2-CD1 3.98Å; Y72-Y216 HydrophobicContact CE2-CD1 3.98Å; Y72-Y216 HydrophobicContact CE2-CE1 4.12Å; Y72-Y216 AromaticContact CZ-CD1 3.97Å; W112-Y216 CarbonylContact C-O 3.34Å; S113-Y216 WeakPolarHBondContact CB-O 3.4Å; S113-Y216 PolarHBondContact N-O 3.07Å; S113-Y216 PolarHBondContact OG-N 2.66Å; S211-Y216 PolarHBondContact O-OH 3.13Å; Y216-T221 HydrophobicContact CD2-CG2 4.04Å; Y216-T221 HydrophobicContact CG-CG2 4.47Å; Y216-L222 HydrophobicContact CE1-CB 3.99Å; Y216-L222 HydrophobicContact CE2-CB 4.17Å; Y216-L222 WeakPolarHBondContact CE2-O 3.36Å
217	N	96.1	Very high	92.3	Very high	9 Å²	9	26.8 Å²	26.8	5%	0.048	15%	0.151	C	C	.	.			trans	-116.4	1.4	177	75.6	-36.1	0	0	0	113.5	V71 Y72 E73 W112 V118 Y242	V71-N217 PolarHBondContact O-N 3.15Å; Y72-N217 VanDerWaalsContact CA-OD1 3.23Å; Y72-N217 WeakPolarHBondContact CA-OD1 3.45Å; E73-N217 PolarHBondContact N-OD1 3.12Å; E73-N217 PolarHBondContact O-ND2 3.21Å; W112-N217 HydrophobicContact CD2-CB 4.31Å; W112-N217 HydrophobicContact CE3-CB 3.75Å; W112-N217 HydrophobicContact CH2-CB 4.38Å; W112-N217 HydrophobicContact CZ3-CB 3.78Å; V118-N217 HydrophobicContact CG2-CB 3.87Å; N217-Y242 VanDerWaalsContact O-CD2 3.28Å; N217-Y242 WeakPolarHBondContact O-CD2 3.18Å
218	G	95.6	Very high	91.9	Very high	0 Å²	0	29 Å²	29	0%	0	17%	0.168	C	C	.	.	S	Bend	trans	-86.6	-174.4	179.5	0	0	0	0	0	114.3	V71 F220 N239 Y242	V71-G218 WeakPolarHBondContact O-CA 3.28Å; V71-G218 PolarHBondContact O-N 2.92Å; G218-F220 PolarHBondContact O-N 2.83Å; G218-N239 WeakPolarHBondContact O-CB 3.46Å; G218-N239 PolarHBondContact O-ND2 2.67Å; G218-Y242 VanDerWaalsContact C-CD2 3.49Å; G218-Y242 WeakPolarHBondContact O-CD2 3.3Å
219	P	95.5	Very high	91.3	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	17%	0.173	C	C	.	.	S	Bend	trans	-63.6	-20.8	-177.9	22.1	-30.9	0	0	0	114.8	N70 N239 Y242 V248 K547	N70-P219 WeakPolarHBondContact O-CD 3.28Å; N70-P219 WeakPolarHBondContact O-CG 3.31Å; P219-N239 PolarHBondContact O-N 2.88Å; P219-Y242 HydrophobicContact CB-CD1 4.06Å; P219-Y242 HydrophobicContact CB-CE1 3.73Å; P219-V248 HydrophobicContact CB-CG2 3.46Å; P219-V248 VanDerWaalsContact CB-CG2 3.46Å; P219-K547 HydrophobicContact CB-CB 4.31Å; P219-K547 HydrophobicContact CB-CG 4.24Å; P219-K547 HydrophobicContact CG-CB 4.12Å; P219-K547 HydrophobicContact CG-CG 4.41Å
220	F	97.2	Very high	90.7	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	169.3	176.2	-56.3	-87.1	0	0	0	111.5	N70 V71 G218 Y236 K237 V248 L250 V253	N70-F220 HydrophobicContact CB-CD2 4.07Å; N70-F220 WeakPolarHBondContact O-CB 3.26Å; N70-F220 WeakPolarHBondContact O-CD2 3.32Å; N70-F220 PolarHBondContact O-N 2.86Å; V71-F220 VanDerWaalsContact CA-O 3.3Å; V71-F220 WeakPolarHBondContact CA-O 3.49Å; V71-F220 HydrophobicContact CG1-CB 4.26Å; G218-F220 PolarHBondContact O-N 2.83Å; F220-Y236 VanDerWaalsContact CD1-O 3.29Å; F220-Y236 WeakPolarHBondContact CD1-O 3.29Å; F220-K237 CarbonylContact C-O 3.55Å; F220-K237 WeakPolarHBondContact CA-O 3.47Å; F220-K237 VanDerWaalsContact CB-O 3.29Å; F220-K237 WeakPolarHBondContact CB-O 3.2Å; F220-V248 HydrophobicContact CE1-CG1 3.85Å; F220-V248 HydrophobicContact CE2-CG1 4.46Å; F220-V248 HydrophobicContact CZ-CG1 3.79Å; F220-L250 HydrophobicContact CE1-CB 4.22Å; F220-L250 HydrophobicContact CZ-CB 4.44Å; F220-L250 HydrophobicContact CZ-CD1 4.41Å; F220-V253 HydrophobicContact CE1-CG2 4.4Å; F220-V253 HydrophobicContact CZ-CG2 4.34Å
221	T	96.9	Very high	90.3	Very high	17 Å²	17	30.3 Å²	30.3	10%	0.104	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	139.2	166.9	59.5	0	0	0	0	108.1	Y216 K237 N239	Y216-T221 HydrophobicContact CD2-CG2 4.04Å; Y216-T221 HydrophobicContact CG-CG2 4.47Å; T221-K237 PolarHBondContact N-O 3.13Å; T221-K237 PolarHBondContact O-N 3.09Å; T221-K237 PolarHBondContact OG1-O 3.18Å; T221-N239 HydrophobicContact CG2-CB 3.93Å
222	L	96	Very high	90.1	Very high	4 Å²	4	31.4 Å²	31.4	2%	0.021	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	128.6	171.9	-172.2	63.5	0	0	0	108.8	M51 A54 V71 S211 Y216 F225 W234 Y236	M51-L222 HydrophobicContact CE-CD1 4.23Å; A54-L222 HydrophobicContact CB-CD2 3.93Å; V71-L222 HydrophobicContact CG1-CB 4.08Å; V71-L222 HydrophobicContact CG2-CB 4.46Å; S211-L222 VanDerWaalsContact CB-O 3.32Å; S211-L222 WeakPolarHBondContact CB-O 3.39Å; Y216-L222 HydrophobicContact CE1-CB 3.99Å; Y216-L222 HydrophobicContact CE2-CB 4.17Å; Y216-L222 WeakPolarHBondContact CE2-O 3.36Å; L222-F225 HydrophobicContact CD1-CB 4.23Å; L222-F225 HydrophobicContact CD2-CB 3.68Å; L222-F225 HydrophobicContact CD2-CD1 3.84Å; L222-F225 HydrophobicContact CD2-CG 3.89Å; L222-F225 HydrophobicContact CG-CB 3.83Å; L222-W234 HydrophobicContact CD1-CB 4.09Å; L222-W234 HydrophobicContact CD1-CG 4.15Å; L222-Y236 HydrophobicContact CD1-CD1 3.88Å; L222-Y236 HydrophobicContact CD1-CE1 3.89Å
223	E	92.4	Very high	90	Very high	81 Å²	81	29.6 Å²	29.6	38%	0.379	18%	0.177	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	148.9	173.9	-72.9	-135.1	-141.7	0	0	110.1	F225 E235 K237	E223-F225 PolarHBondContact O-N 3.32Å; E223-E235 PolarHBondContact N-O 2.97Å; E223-E235 PolarHBondContact O-N 3.18Å; E223-K237 HydrophobicContact CG-CB 4.39Å; E223-K237 HydrophobicContact CG-CD 4.09Å; E223-K237 WeakPolarHBondContact OE1-CD 3.18Å; E223-K237 WeakPolarHBondContact OE1-CE 3.15Å; E223-K237 IonicContact OE1-NZ 2.73Å; E223-K237 PolarHBondContact OE1-NZ 3.49Å
224	G	87.3	Confident	90.1	Very high	42 Å²	42	27.9 Å²	27.9	43%	0.433	17%	0.169	S	C	.	.	S	Bend	trans	77.3	-2.9	177.5	0	0	0	0	0	115.7	S211	S211-G224 PolarHBondContact OG-N 3.48Å
225	F	90.8	Very high	90.2	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	18%	0.177	C	C	.	.			trans	-74.6	126.5	164.8	-176.9	-111.7	0	0	0	109.3	M51 A54 S211 L222 E223 P228 D231 W234	M51-F225 HydrophobicContact CB-CE2 4.06Å; M51-F225 HydrophobicContact CE-CD2 4.32Å; M51-F225 HydrophobicContact CE-CE2 4.48Å; M51-F225 HydrophobicContact CG-CE2 4.38Å; M51-F225 HydrophobicContact SD-CD2 4.32Å; M51-F225 HydrophobicContact SD-CE2 4Å; M51-F225 HydrophobicContact SD-CZ 4.17Å; A54-F225 HydrophobicContact CB-CD1 4.02Å; A54-F225 HydrophobicContact CB-CE1 3.59Å; A54-F225 HydrophobicContact CB-CZ 4.29Å; S211-F225 WeakPolarHBondContact CB-O 3.49Å; S211-F225 PolarHBondContact N-O 3.09Å; S211-F225 PolarHBondContact OG-N 3.01Å; S211-F225 PolarHBondContact OG-O 3.23Å; L222-F225 HydrophobicContact CD1-CB 4.23Å; L222-F225 HydrophobicContact CD2-CB 3.68Å; L222-F225 HydrophobicContact CD2-CD1 3.84Å; L222-F225 HydrophobicContact CD2-CG 3.89Å; L222-F225 HydrophobicContact CG-CB 3.83Å; E223-F225 PolarHBondContact O-N 3.32Å; F225-P228 HydrophobicContact CZ-CB 4.21Å; F225-D231 WeakPolarHBondContact CA-OD2 3.47Å; F225-D231 HydrophobicContact CD2-CB 4.2Å; F225-D231 WeakPolarHBondContact CD2-OD2 3.41Å; F225-D231 HydrophobicContact CE2-CB 4.41Å; F225-W234 HydrophobicContact CB-CB 4.28Å
226	D	85.1	Confident	90.2	Very high	69 Å²	69	29.3 Å²	29.3	37%	0.369	17%	0.174	S	C	.	.			trans	-133	-10.2	-169.6	-99.2	-51.7	0	0	0	113.3	K210 D231	K210-D226 PolarHBondContact NZ-O 3.45Å; K210-D226 IonicContact NZ-OD1 3.06Å; K210-D226 PolarHBondContact NZ-OD1 3.27Å; D226-D231 PolarHBondContact N-OD2 2.79Å
227	G	82.6	Confident	90.1	Very high	10 Å²	10	33.5 Å²	33.5	10%	0.103	19%	0.192	C	C	.	.	S	Bend	trans	-169.5	120	-179	0	0	0	0	0	115.6	G229 T230 D231	G227-G229 PolarHBondContact O-N 2.97Å; G227-T230 PolarHBondContact O-N 3.35Å; G227-T230 PolarHBondContact O-OG1 2.97Å; G227-T230 VanDerWaalsContact O-OG1 3.1Å; G227-D231 PolarHBondContact N-OD1 3.38Å; G227-D231 VanDerWaalsContact N-OD1 3.11Å; G227-D231 PolarHBondContact N-OD2 2.96Å; G227-D231 PolarHBondContact O-N 3.09Å
228	P	84.2	Confident	90.1	Very high	61 Å²	61	34.9 Å²	34.9	40%	0.396	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.4	130.4	175.9	22.9	-32.3	0	0	0	112.8	P52 T209 F225 T230	P52-P228 WeakPolarHBondContact O-CB 3.28Å; T209-P228 WeakPolarHBondContact O-CD 3.34Å; F225-P228 HydrophobicContact CZ-CB 4.21Å; P228-T230 PolarHBondContact O-N 3.21Å
229	G	79.6	Confident	90.1	Very high	14 Å²	14	35.1 Å²	35.1	14%	0.144	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	70.9	1.5	177.4	0	0	0	0	0	115.7	M51 G227	M51-G229 PolarHBondContact O-N 2.96Å; G227-G229 PolarHBondContact O-N 2.97Å
230	T	75.9	Confident	89.9	Confident	97 Å²	97	40.4 Å²	40.4	60%	0.595	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	-114.1	-25.2	177	52.8	0	0	0	0	113.7	G227 P228	G227-T230 PolarHBondContact O-N 3.35Å; G227-T230 PolarHBondContact O-OG1 2.97Å; G227-T230 VanDerWaalsContact O-OG1 3.1Å; P228-T230 PolarHBondContact O-N 3.21Å
231	D	82.9	Confident	89.7	Confident	24 Å²	24	42.2 Å²	42.2	13%	0.128	24%	0.238	C	C	.	.			trans	-77	127.7	-170.6	-69.7	-5.6	0	0	0	113.3	F225 D226 G227	F225-D231 WeakPolarHBondContact CA-OD2 3.47Å; F225-D231 HydrophobicContact CD2-CB 4.2Å; F225-D231 WeakPolarHBondContact CD2-OD2 3.41Å; F225-D231 HydrophobicContact CE2-CB 4.41Å; D226-D231 PolarHBondContact N-OD2 2.79Å; G227-D231 PolarHBondContact N-OD1 3.38Å; G227-D231 VanDerWaalsContact N-OD1 3.11Å; G227-D231 PolarHBondContact N-OD2 2.96Å; G227-D231 PolarHBondContact O-N 3.09Å
232	T	86.2	Confident	89.6	Confident	45 Å²	45	41.5 Å²	41.5	28%	0.276	23%	0.234	S	C	.	.	S	Bend	trans	-94.3	-5.7	176.3	61.1	0	0	0	0	113.6	N256 V257	T232-N256 CarbonylContact O-C 3.24Å; T232-N256 WeakPolarHBondContact O-CA 3.37Å; T232-V257 PolarHBondContact O-N 3.27Å
233	E	88.3	Confident	89.4	Confident	72 Å²	72	44.6 Å²	44.6	34%	0.336	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.9	154.9	171.8	74	174.3	-178.1	0	0	113.2	V255 K1263	E233-V255 WeakPolarHBondContact CA-O 3.44Å; E233-V255 WeakPolarHBondContact CB-O 3.28Å; E233-K1263 HydrophobicContact CG-CD 4.43Å; E233-K1263 WeakPolarHBondContact OE1-CD 3.42Å; E233-K1263 WeakPolarHBondContact OE1-CE 3.43Å; E233-K1263 WeakPolarHBondContact OE1-CG 3.38Å; E233-K1263 IonicContact OE1-NZ 2.59Å; E233-K1263 WeakPolarHBondContact OE2-CE 3.47Å; E233-K1263 IonicContact OE2-NZ 3.24Å; E233-K1263 PolarHBondContact OE2-NZ 3.45Å
234	W	94.4	Very high	89.4	Confident	7 Å²	7	42.5 Å²	42.5	3%	0.027	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.8	164.9	166.5	56.8	92.2	0	0	0	111.2	V47 M51 I63 L222 F225 Y236 V255 V257	V47-W234 HydrophobicContact CG2-CH2 3.95Å; V47-W234 HydrophobicContact CG2-CZ2 4.33Å; M51-W234 HydrophobicContact CB-CE3 4.46Å; M51-W234 HydrophobicContact CB-CH2 3.92Å; M51-W234 HydrophobicContact CB-CZ2 4.2Å; M51-W234 HydrophobicContact CB-CZ3 4.05Å; M51-W234 HydrophobicContact CE-CD2 3.6Å; M51-W234 HydrophobicContact CE-CE3 4.26Å; M51-W234 HydrophobicContact CE-CG 3.82Å; M51-W234 HydrophobicContact CE-CH2 4.5Å; M51-W234 HydrophobicContact CE-CZ2 3.85Å; I63-W234 HydrophobicContact CG2-CH2 3.8Å; I63-W234 HydrophobicContact CG2-CZ2 3.71Å; L222-W234 HydrophobicContact CD1-CB 4.09Å; L222-W234 HydrophobicContact CD1-CG 4.15Å; F225-W234 HydrophobicContact CB-CB 4.28Å; W234-Y236 AromaticContact CD1-CD1 3.97Å; W234-Y236 AromaticContact CD1-CE1 3.33Å; W234-Y236 AromaticContact CD1-CZ 3.8Å; W234-Y236 AromaticContact NE1-CE1 3.31Å; W234-Y236 VanDerWaalsContact NE1-CE1 3.31Å; W234-Y236 AromaticContact NE1-CZ 3.3Å; W234-Y236 VanDerWaalsContact NE1-CZ 3.3Å; W234-Y236 PolarHBondContact NE1-OH 3.31Å; W234-V255 HydrophobicContact CD2-CB 4.06Å; W234-V255 HydrophobicContact CD2-CG1 4.37Å; W234-V255 HydrophobicContact CG-CB 4.24Å; W234-V255 HydrophobicContact CH2-CG1 4.11Å; W234-V255 HydrophobicContact CZ2-CB 4.08Å; W234-V255 HydrophobicContact CZ2-CG1 3.53Å; W234-V255 PolarHBondContact N-O 3.09Å; W234-V255 VanDerWaalsContact N-O 3.07Å; W234-V255 PolarHBondContact O-N 3.25Å; W234-V257 HydrophobicContact CH2-CG2 4.06Å; W234-V257 HydrophobicContact CZ3-CG2 3.73Å
235	E	94.8	Very high	89.6	Confident	51 Å²	51	44.6 Å²	44.6	24%	0.238	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	122.4	-179.2	-175.3	158.9	-150.4	0	0	111.9	E223 K237 S252 V253 K254	E223-E235 PolarHBondContact N-O 2.97Å; E223-E235 PolarHBondContact O-N 3.18Å; E235-K237 PolarHBondContact O-N 2.77Å; E235-S252 WeakPolarHBondContact OE1-CB 3.29Å; E235-S252 PolarHBondContact OE1-OG 2.95Å; E235-V253 CarbonylContact C-O 3.6Å; E235-V253 WeakPolarHBondContact CA-O 3.35Å; E235-K254 HydrophobicContact CB-CG 4.42Å; E235-K254 HydrophobicContact CG-CG 4.01Å; E235-K254 WeakPolarHBondContact OE1-CE 3.5Å; E235-K254 WeakPolarHBondContact OE1-CG 3.04Å; E235-K254 VanDerWaalsContact OE2-CE 3.31Å; E235-K254 WeakPolarHBondContact OE2-CE 3.4Å; E235-K254 IonicContact OE2-NZ 3.95Å
236	Y	96	Very high	89.4	Confident	5 Å²	5	49.3 Å²	49.3	2%	0.02	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	92.4	164.6	-46.6	-39.7	0	0	0	108	A67 N70 V71 F220 L222 W234 S252 V253 V255 Y546	A67-Y236 WeakPolarHBondContact CA-OH 3.48Å; A67-Y236 HydrophobicContact CB-CE1 3.83Å; A67-Y236 WeakPolarHBondContact CB-OH 3.46Å; N70-Y236 HydrophobicContact CB-CD2 4.22Å; N70-Y236 HydrophobicContact CB-CE2 4.46Å; V71-Y236 HydrophobicContact CG1-CD1 3.99Å; F220-Y236 VanDerWaalsContact CD1-O 3.29Å; F220-Y236 WeakPolarHBondContact CD1-O 3.29Å; L222-Y236 HydrophobicContact CD1-CD1 3.88Å; L222-Y236 HydrophobicContact CD1-CE1 3.89Å; W234-Y236 AromaticContact CD1-CD1 3.97Å; W234-Y236 AromaticContact CD1-CE1 3.33Å; W234-Y236 AromaticContact CD1-CZ 3.8Å; W234-Y236 AromaticContact NE1-CE1 3.31Å; W234-Y236 VanDerWaalsContact NE1-CE1 3.31Å; W234-Y236 AromaticContact NE1-CZ 3.3Å; W234-Y236 VanDerWaalsContact NE1-CZ 3.3Å; W234-Y236 PolarHBondContact NE1-OH 3.31Å; Y236-S252 CarbonylContact O-C 3.11Å; Y236-S252 WeakPolarHBondContact O-CA 3.44Å; Y236-S252 WeakPolarHBondContact O-CB 3.02Å; Y236-V253 HydrophobicContact CD2-CB 3.77Å; Y236-V253 HydrophobicContact CD2-CG1 4.05Å; Y236-V253 HydrophobicContact CD2-CG2 4.24Å; Y236-V253 HydrophobicContact CG-CB 4.33Å; Y236-V253 PolarHBondContact N-O 3.26Å; Y236-V253 PolarHBondContact O-N 2.88Å; Y236-V255 HydrophobicContact CD2-CG2 4.34Å; Y236-V255 HydrophobicContact CE2-CG2 3.82Å; Y236-Y546 HydrophobicContact CD2-CD2 4.19Å; Y236-Y546 HydrophobicContact CD2-CE2 4.47Å; Y236-Y546 HydrophobicContact CE2-CD2 4.21Å; Y236-Y546 HydrophobicContact CE2-CE2 4.06Å
237	K	94.9	Very high	89.6	Confident	96 Å²	96	49 Å²	49	42%	0.417	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	142.1	-179.9	179.3	-174.8	174	-176.2	0	110.2	F220 T221 E223 E235 N239	F220-K237 CarbonylContact C-O 3.55Å; F220-K237 WeakPolarHBondContact CA-O 3.47Å; F220-K237 VanDerWaalsContact CB-O 3.29Å; F220-K237 WeakPolarHBondContact CB-O 3.2Å; T221-K237 PolarHBondContact N-O 3.13Å; T221-K237 PolarHBondContact O-N 3.09Å; T221-K237 PolarHBondContact OG1-O 3.18Å; E223-K237 HydrophobicContact CG-CB 4.39Å; E223-K237 HydrophobicContact CG-CD 4.09Å; E223-K237 WeakPolarHBondContact OE1-CD 3.18Å; E223-K237 WeakPolarHBondContact OE1-CE 3.15Å; E223-K237 IonicContact OE1-NZ 2.73Å; E223-K237 PolarHBondContact OE1-NZ 3.49Å; E235-K237 PolarHBondContact O-N 2.77Å; K237-N239 PolarHBondContact O-N 3.38Å
238	K	95.5	Very high	90	Very high	37 Å²	37	48.6 Å²	48.6	16%	0.161	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.1	131	-178.1	173.7	170.2	176.9	164.5	0	111.8	K245 V248 L250 S251	K238-K245 VanDerWaalsContact CE-O 3.31Å; K238-K245 WeakPolarHBondContact CE-O 3.24Å; K238-K245 PolarHBondContact NZ-O 3.48Å; K238-V248 HydrophobicContact CD-CB 4.36Å; K238-V248 HydrophobicContact CD-CG1 4.03Å; K238-V248 HydrophobicContact CG-CG1 4.03Å; K238-V248 PolarHBondContact NZ-O 2.84Å; K238-L250 WeakPolarHBondContact CD-O 3.15Å; K238-S251 WeakPolarHBondContact CB-O 3.47Å; K238-S251 PolarHBondContact N-O 3.42Å
239	N	95.7	Very high	90.2	Very high	5 Å²	5	48.3 Å²	48.3	3%	0.027	24%	0.244	C	C	.	.	P	Polyproline II helix	trans	-83.1	118.3	175.3	-173.3	1.8	0	0	0	111	G218 P219 T221 K237 T241	G218-N239 WeakPolarHBondContact O-CB 3.46Å; G218-N239 PolarHBondContact O-ND2 2.67Å; P219-N239 PolarHBondContact O-N 2.88Å; T221-N239 HydrophobicContact CG2-CB 3.93Å; K237-N239 PolarHBondContact O-N 3.38Å; N239-T241 PolarHBondContact OD1-N 2.89Å; N239-T241 PolarHBondContact OD1-OG1 3.4Å; N239-T241 VanDerWaalsContact OD1-OG1 3.06Å
240	D	91.7	Very high	90.8	Very high	112 Å²	112	47.7 Å²	47.7	60%	0.599	24%	0.237	S	C	*	.	S	Bend	trans	-88.9	-5.2	177.5	-81.2	-38.3	0	0	0	113.9	K245	D240-K245 VanDerWaalsContact O-CD 3.22Å; D240-K245 WeakPolarHBondContact O-CD 3.13Å; D240-K245 WeakPolarHBondContact O-CE 3.42Å; D240-K245 PolarHBondContact O-NZ 2.8Å
241	T	92	Very high	91.4	Very high	37 Å²	37	45 Å²	45	23%	0.227	22%	0.222	C	C	.	.	S	Bend	trans	-92.9	-15.5	167.5	68.2	0	0	0	0	113.2	W112 N239 W243	W112-T241 PolarHBondContact O-OG1 3.36Å; N239-T241 PolarHBondContact OD1-N 2.89Å; N239-T241 PolarHBondContact OD1-OG1 3.4Å; N239-T241 VanDerWaalsContact OD1-OG1 3.06Å; T241-W243 PolarHBondContact O-N 3.4Å
242	Y	95	Very high	91.8	Very high	2 Å²	2	44.1 Å²	44.1	1%	0.008	22%	0.218	C	C	.	.			trans	-57.2	134.5	178.5	-178.5	-122.4	0	0	0	112.7	E73 N217 G218 P219 D244 K245 V248 K547	E73-Y242 PolarHBondContact OE1-OH 2.88Å; E73-Y242 WeakPolarHBondContact OE2-CE2 3.29Å; N217-Y242 VanDerWaalsContact O-CD2 3.28Å; N217-Y242 WeakPolarHBondContact O-CD2 3.18Å; G218-Y242 VanDerWaalsContact C-CD2 3.49Å; G218-Y242 WeakPolarHBondContact O-CD2 3.3Å; P219-Y242 HydrophobicContact CB-CD1 4.06Å; P219-Y242 HydrophobicContact CB-CE1 3.73Å; Y242-D244 VanDerWaalsContact CD1-C 3.43Å; Y242-D244 HydrophobicContact CD1-CB 4.31Å; Y242-D244 HydrophobicContact CE1-CB 3.64Å; Y242-D244 PolarHBondContact O-N 2.65Å; Y242-K245 HydrophobicContact CD1-CB 4.33Å; Y242-K245 VanDerWaalsContact CD1-N 3.34Å; Y242-K245 WeakPolarHBondContact O-CB 3.48Å; Y242-K245 WeakPolarHBondContact O-CD 3.28Å; Y242-K245 WeakPolarHBondContact O-CG 2.99Å; Y242-K245 PolarHBondContact O-N 3.44Å; Y242-V248 HydrophobicContact CD1-CG2 3.98Å; Y242-V248 HydrophobicContact CE1-CG2 3.96Å; Y242-K547 VanDerWaalsContact OH-CE 3.28Å; Y242-K547 WeakPolarHBondContact OH-CE 3.3Å; Y242-K547 PolarHBondContact OH-NZ 2.8Å
243	W	92.7	Very high	92.3	Very high	69 Å²	69	42 Å²	42	26%	0.261	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.1	-41	-172.8	70.9	-89.2	0	0	0	112.4	E73 R107 T241 K245	E73-W243 PolarHBondContact OE2-NE1 2.59Å; R107-W243 VanDerWaalsContact CZ-CZ3 3.45Å; T241-W243 PolarHBondContact O-N 3.4Å; W243-K245 VanDerWaalsContact C-N 3.31Å; W243-K245 PolarHBondContact O-N 3.31Å
244	D	92.5	Very high	92.5	Very high	38 Å²	38	42.9 Å²	42.9	20%	0.203	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.9	29.4	177.2	-165.5	21.2	0	0	0	112.8	Y242 D246 E247 K547	Y242-D244 VanDerWaalsContact CD1-C 3.43Å; Y242-D244 HydrophobicContact CD1-CB 4.31Å; Y242-D244 HydrophobicContact CE1-CB 3.64Å; Y242-D244 PolarHBondContact O-N 2.65Å; D244-D246 PolarHBondContact O-N 3.03Å; D244-E247 PolarHBondContact O-N 3.22Å; D244-K547 WeakPolarHBondContact OD2-CE 3.36Å; D244-K547 IonicContact OD2-NZ 2.68Å; D244-K547 PolarHBondContact OD2-NZ 2.93Å
245	K	90.8	Very high	92.6	Very high	85 Å²	85	42.6 Å²	42.6	37%	0.37	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.9	-16.4	177.7	64.7	-173.3	165.4	-176	0	114	K238 D240 Y242 W243	K238-K245 VanDerWaalsContact CE-O 3.31Å; K238-K245 WeakPolarHBondContact CE-O 3.24Å; K238-K245 PolarHBondContact NZ-O 3.48Å; D240-K245 VanDerWaalsContact O-CD 3.22Å; D240-K245 WeakPolarHBondContact O-CD 3.13Å; D240-K245 WeakPolarHBondContact O-CE 3.42Å; D240-K245 PolarHBondContact O-NZ 2.8Å; Y242-K245 HydrophobicContact CD1-CB 4.33Å; Y242-K245 VanDerWaalsContact CD1-N 3.34Å; Y242-K245 WeakPolarHBondContact O-CB 3.48Å; Y242-K245 WeakPolarHBondContact O-CD 3.28Å; Y242-K245 WeakPolarHBondContact O-CG 2.99Å; Y242-K245 PolarHBondContact O-N 3.44Å; W243-K245 VanDerWaalsContact C-N 3.31Å; W243-K245 PolarHBondContact O-N 3.31Å
246	D	87.6	Confident	92.4	Very high	100 Å²	100	42.6 Å²	42.6	54%	0.535	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.3	-25.1	175	-117.5	-38.7	0	0	0	112.3	K38 D244 K249	K38-D246 IonicContact NZ-OD1 2.72Å; K38-D246 PolarHBondContact NZ-OD1 3.02Å; D244-D246 PolarHBondContact O-N 3.03Å; D246-K249 PolarHBondContact O-NZ 3.13Å
247	E	88.5	Confident	92.1	Very high	61 Å²	61	43.3 Å²	43.3	29%	0.285	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.1	-27.7	170.1	-92.1	-55.8	106.3	0	0	114.3	D244 K249 R550	D244-E247 PolarHBondContact O-N 3.22Å; E247-K249 WeakPolarHBondContact O-CD 3.45Å; E247-K249 WeakPolarHBondContact O-CE 3.46Å; E247-K249 VanDerWaalsContact O-CG 3.3Å; E247-K249 WeakPolarHBondContact O-CG 3.47Å; E247-K249 PolarHBondContact O-N 3.44Å; E247-K249 VanDerWaalsContact O-N 3.12Å; E247-K249 WeakPolarHBondContact OE1-CE 3.31Å; E247-K249 IonicContact OE1-NZ 2.76Å; E247-K249 PolarHBondContact OE1-NZ 2.95Å; E247-K249 IonicContact OE2-NZ 2.67Å; E247-R550 IonicContact OE1-NH2 3.91Å; E247-R550 IonicContact OE2-NH2 2.63Å; E247-R550 PolarHBondContact OE2-NH2 3.46Å
248	V	91.7	Very high	91.9	Very high	3 Å²	3	39.8 Å²	39.8	2%	0.018	20%	0.2	C	C	.	.			trans	-66.7	108.4	173.2	-173.3	0	0	0	0	110.2	P219 F220 K238 Y242 K547	P219-V248 HydrophobicContact CB-CG2 3.46Å; P219-V248 VanDerWaalsContact CB-CG2 3.46Å; F220-V248 HydrophobicContact CE1-CG1 3.85Å; F220-V248 HydrophobicContact CE2-CG1 4.46Å; F220-V248 HydrophobicContact CZ-CG1 3.79Å; K238-V248 HydrophobicContact CD-CB 4.36Å; K238-V248 HydrophobicContact CD-CG1 4.03Å; K238-V248 HydrophobicContact CG-CG1 4.03Å; K238-V248 PolarHBondContact NZ-O 2.84Å; Y242-V248 HydrophobicContact CD1-CG2 3.98Å; Y242-V248 HydrophobicContact CE1-CG2 3.96Å; V248-K547 WeakPolarHBondContact CA-O 3.5Å; V248-K547 HydrophobicContact CG2-CG 4.4Å
249	K	88.2	Confident	91.5	Very high	55 Å²	55	39.7 Å²	39.7	24%	0.239	20%	0.199	C	C	.	.			trans	-98.4	-19.5	-175.7	-44.7	-52.3	178.4	-175.5	0	114.8	D246 E247 R550	D246-K249 PolarHBondContact O-NZ 3.13Å; E247-K249 WeakPolarHBondContact O-CD 3.45Å; E247-K249 WeakPolarHBondContact O-CE 3.46Å; E247-K249 VanDerWaalsContact O-CG 3.3Å; E247-K249 WeakPolarHBondContact O-CG 3.47Å; E247-K249 PolarHBondContact O-N 3.44Å; E247-K249 VanDerWaalsContact O-N 3.12Å; E247-K249 WeakPolarHBondContact OE1-CE 3.31Å; E247-K249 IonicContact OE1-NZ 2.76Å; E247-K249 PolarHBondContact OE1-NZ 2.95Å; E247-K249 IonicContact OE2-NZ 2.67Å; K249-R550 HydrophobicContact CB-CG 4.01Å; K249-R550 VanDerWaalsContact CE-NH2 3.31Å; K249-R550 HydrophobicContact CG-CG 3.81Å
250	L	90.9	Very high	91	Very high	1 Å²	1	42.1 Å²	42.1	1%	0.005	21%	0.21	C	C	.	.			trans	-71.2	154.1	173.3	-63.2	-178.2	0	0	0	111.2	G41 F43 F220 K238 V253 T549 H551	G41-L250 CarbonylContact O-C 3.6Å; G41-L250 VanDerWaalsContact O-CA 3.3Å; G41-L250 WeakPolarHBondContact O-CA 3.29Å; G41-L250 WeakPolarHBondContact O-CD2 3.47Å; F43-L250 HydrophobicContact CB-CD1 3.72Å; F43-L250 HydrophobicContact CB-CD2 4.14Å; F43-L250 HydrophobicContact CD1-CD1 4.38Å; F43-L250 HydrophobicContact CG-CD1 4.43Å; F220-L250 HydrophobicContact CE1-CB 4.22Å; F220-L250 HydrophobicContact CZ-CB 4.44Å; F220-L250 HydrophobicContact CZ-CD1 4.41Å; K238-L250 WeakPolarHBondContact CD-O 3.15Å; L250-V253 HydrophobicContact CD1-CG2 3.59Å; L250-T549 HydrophobicContact CD1-CG2 3.86Å; L250-T549 HydrophobicContact CD2-CG2 4.27Å; L250-T549 HydrophobicContact CG-CG2 4.3Å; L250-H551 HydrophobicContact CD2-CB 3.88Å
251	S	88.7	Confident	90.8	Very high	40 Å²	40	36.9 Å²	36.9	28%	0.28	18%	0.182	S	C	.	.	S	Bend	trans	-82	-37.8	162.5	40.7	0	0	0	0	111.5	G41 T42 K238	G41-S251 PolarHBondContact O-N 2.79Å; G41-S251 PolarHBondContact O-OG 3.27Å; T42-S251 PolarHBondContact N-OG 3.12Å; T42-S251 PolarHBondContact OG1-OG 3.46Å; K238-S251 WeakPolarHBondContact CB-O 3.47Å; K238-S251 PolarHBondContact N-O 3.42Å
252	S	92.8	Very high	90.5	Very high	6 Å²	6	38 Å²	38	4%	0.042	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-162.3	164.5	173.7	56.3	0	0	0	0	112.4	T42 F43 E235 Y236	T42-S252 CarbonylContact C-O 3.58Å; T42-S252 VanDerWaalsContact CA-O 3.26Å; T42-S252 WeakPolarHBondContact CA-O 3.38Å; T42-S252 WeakPolarHBondContact CG2-OG 3.43Å; T42-S252 PolarHBondContact OG1-OG 3.07Å; F43-S252 PolarHBondContact N-O 3.35Å; E235-S252 WeakPolarHBondContact OE1-CB 3.29Å; E235-S252 PolarHBondContact OE1-OG 2.95Å; Y236-S252 CarbonylContact O-C 3.11Å; Y236-S252 WeakPolarHBondContact O-CA 3.44Å; Y236-S252 WeakPolarHBondContact O-CB 3.02Å
253	V	94.7	Very high	89.9	Confident	0 Å²	0	41.1 Å²	41.1	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	127.5	160.2	-176.5	0	0	0	0	107.3	F43 L45 F220 E235 Y236 L250 V255 Y546	F43-V253 HydrophobicContact CB-CG2 4.46Å; F43-V253 HydrophobicContact CD1-CB 4.38Å; F43-V253 HydrophobicContact CD1-CG1 3.67Å; F43-V253 HydrophobicContact CD1-CG2 4.02Å; F43-V253 HydrophobicContact CE1-CG1 4.28Å; F43-V253 HydrophobicContact CG-CG1 4.48Å; F43-V253 CarbonylContact O-C 3.48Å; F43-V253 WeakPolarHBondContact O-CA 3.45Å; L45-V253 HydrophobicContact CB-CG1 4.15Å; F220-V253 HydrophobicContact CE1-CG2 4.4Å; F220-V253 HydrophobicContact CZ-CG2 4.34Å; E235-V253 CarbonylContact C-O 3.6Å; E235-V253 WeakPolarHBondContact CA-O 3.35Å; Y236-V253 HydrophobicContact CD2-CB 3.77Å; Y236-V253 HydrophobicContact CD2-CG1 4.05Å; Y236-V253 HydrophobicContact CD2-CG2 4.24Å; Y236-V253 HydrophobicContact CG-CB 4.33Å; Y236-V253 PolarHBondContact N-O 3.26Å; Y236-V253 PolarHBondContact O-N 2.88Å; L250-V253 HydrophobicContact CD1-CG2 3.59Å; V253-V255 HydrophobicContact CG1-CG2 4.17Å; V253-Y546 HydrophobicContact CG2-CD2 4.17Å; V253-Y546 HydrophobicContact CG2-CG 4.14Å
254	K	93.8	Very high	89.6	Confident	90 Å²	90	37.8 Å²	37.8	39%	0.391	20%	0.198	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	129	170.7	-71.1	-170.5	169.3	-152	0	109	T42 F43 L45 E235	T42-K254 HydrophobicContact CG2-CB 4.49Å; T42-K254 HydrophobicContact CG2-CD 4.16Å; T42-K254 HydrophobicContact CG2-CG 3.9Å; F43-K254 PolarHBondContact O-N 3.2Å; L45-K254 PolarHBondContact N-O 3.29Å; E235-K254 HydrophobicContact CB-CG 4.42Å; E235-K254 HydrophobicContact CG-CG 4.01Å; E235-K254 WeakPolarHBondContact OE1-CE 3.5Å; E235-K254 WeakPolarHBondContact OE1-CG 3.04Å; E235-K254 VanDerWaalsContact OE2-CE 3.31Å; E235-K254 WeakPolarHBondContact OE2-CE 3.4Å; E235-K254 IonicContact OE2-NZ 3.95Å
255	V	95.2	Very high	89.4	Confident	1 Å²	1	36.4 Å²	36.4	1%	0.006	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	132.6	-178.7	-168	0	0	0	0	108.5	L45 V47 E233 W234 Y236 V253	L45-V255 HydrophobicContact CB-CG2 4.47Å; L45-V255 HydrophobicContact CD2-CG1 4.15Å; L45-V255 HydrophobicContact CD2-CG2 4.04Å; L45-V255 HydrophobicContact CG-CG1 4.39Å; L45-V255 WeakPolarHBondContact O-CA 3.46Å; V47-V255 HydrophobicContact CB-CG1 4.42Å; V47-V255 HydrophobicContact CG1-CG1 3.85Å; V47-V255 HydrophobicContact CG2-CG1 3.72Å; E233-V255 WeakPolarHBondContact CA-O 3.44Å; E233-V255 WeakPolarHBondContact CB-O 3.28Å; W234-V255 HydrophobicContact CD2-CB 4.06Å; W234-V255 HydrophobicContact CD2-CG1 4.37Å; W234-V255 HydrophobicContact CG-CB 4.24Å; W234-V255 HydrophobicContact CH2-CG1 4.11Å; W234-V255 HydrophobicContact CZ2-CB 4.08Å; W234-V255 HydrophobicContact CZ2-CG1 3.53Å; W234-V255 PolarHBondContact N-O 3.09Å; W234-V255 VanDerWaalsContact N-O 3.07Å; W234-V255 PolarHBondContact O-N 3.25Å; Y236-V255 HydrophobicContact CD2-CG2 4.34Å; Y236-V255 HydrophobicContact CE2-CG2 3.82Å; V253-V255 HydrophobicContact CG1-CG2 4.17Å
256	N	91.5	Very high	88.8	Confident	52 Å²	52	36.5 Å²	36.5	28%	0.278	20%	0.195	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	142.5	173.7	-60.6	-95	0	0	0	109.7	L45 V46 V47 T232	L45-N256 PolarHBondContact O-N 2.97Å; V46-N256 WeakPolarHBondContact CA-O 3.26Å; V47-N256 PolarHBondContact N-O 3.42Å; T232-N256 CarbonylContact O-C 3.24Å; T232-N256 WeakPolarHBondContact O-CA 3.37Å
257	V	90.6	Very high	88.4	Confident	20 Å²	20	33.9 Å²	33.9	12%	0.121	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	117.6	175.4	-177.7	0	0	0	0	109.3	V47 E50 T232 W234 K259	V47-V257 HydrophobicContact CG2-CG2 4.08Å; V47-V257 CarbonylContact O-C 3.59Å; V47-V257 WeakPolarHBondContact O-CA 3.45Å; E50-V257 HydrophobicContact CG-CG1 4.36Å; E50-V257 HydrophobicContact CG-CG2 4.45Å; T232-V257 PolarHBondContact O-N 3.27Å; W234-V257 HydrophobicContact CH2-CG2 4.06Å; W234-V257 HydrophobicContact CZ3-CG2 3.73Å; V257-K259 HydrophobicContact CG1-CG 4.41Å
258	V	89.7	Confident	88.2	Confident	22 Å²	22	32.2 Å²	32.2	13%	0.133	17%	0.173	C	C	.	.			trans	-134.4	106.1	173.8	-174.1	0	0	0	0	108.4	V46 V47 E260 T263 S264 L267	V46-V258 HydrophobicContact CG1-CB 3.59Å; V46-V258 HydrophobicContact CG1-CG2 3.74Å; V46-V258 HydrophobicContact CG2-CG2 4.46Å; V47-V258 PolarHBondContact O-N 2.89Å; V258-E260 VanDerWaalsContact C-N 3.33Å; V258-E260 PolarHBondContact O-N 2.91Å; V258-T263 HydrophobicContact CG1-CG2 3.75Å; V258-S264 WeakPolarHBondContact CG1-OG 3.32Å; V258-L267 HydrophobicContact CG2-CD1 3.93Å
259	K	86.8	Confident	87.7	Confident	35 Å²	35	38.3 Å²	38.3	15%	0.152	20%	0.199	C	C	.	.			trans	-72.1	-26.8	-173.9	-50.8	-154.6	176.2	-169.8	0	113.3	Q48 E50 V257 D401 D403	Q48-K259 WeakPolarHBondContact O-CG 3.35Å; E50-K259 VanDerWaalsContact CD-NZ 3.26Å; E50-K259 WeakPolarHBondContact OE1-CE 3.49Å; E50-K259 IonicContact OE1-NZ 3.55Å; E50-K259 PolarHBondContact OE1-NZ 2.89Å; E50-K259 WeakPolarHBondContact OE2-CE 3.2Å; E50-K259 IonicContact OE2-NZ 2.7Å; E50-K259 PolarHBondContact OE2-NZ 3.46Å; V257-K259 HydrophobicContact CG1-CG 4.41Å; K259-D401 IonicContact NZ-OD1 3.43Å; K259-D401 PolarHBondContact NZ-OD1 3.06Å; K259-D401 IonicContact NZ-OD2 3.54Å; K259-D401 PolarHBondContact NZ-OD2 2.73Å; K259-D403 WeakPolarHBondContact O-CB 3.23Å; K259-D403 PolarHBondContact O-N 2.67Å
260	E	86.5	Confident	86.8	Confident	56 Å²	56	41.8 Å²	41.8	26%	0.262	22%	0.22	S	C	.	.			trans	-100.2	124.1	-172.1	-64.1	-58.8	148.4	0	0	113.1	V258 S262 T263 S264 K406	V258-E260 VanDerWaalsContact C-N 3.33Å; V258-E260 PolarHBondContact O-N 2.91Å; E260-S262 PolarHBondContact O-N 2.77Å; E260-S262 VanDerWaalsContact O-N 3.17Å; E260-T263 PolarHBondContact O-N 3.05Å; E260-S264 PolarHBondContact O-N 3.41Å; E260-S264 PolarHBondContact O-OG 2.96Å; E260-K406 IonicContact OE1-NZ 2.69Å
261	S	87.1	Confident	86	Confident	1 Å²	1	43.9 Å²	43.9	1%	0.007	24%	0.242	C	C	.	.	H	α-helix	trans	-60.3	-26.5	-177.6	-68	0	0	0	0	114.6	L265 L278 S279 D403	S261-L265 WeakPolarHBondContact O-CB 3.49Å; S261-L265 PolarHBondContact O-N 2.94Å; S261-L278 WeakPolarHBondContact O-CD2 3.47Å; S261-S279 PolarHBondContact OG-N 3.28Å; S261-D403 WeakPolarHBondContact CB-OD2 3.44Å; S261-D403 PolarHBondContact OG-OD2 2.86Å
262	S	85.6	Confident	85.5	Confident	60 Å²	60	46.7 Å²	46.7	42%	0.42	25%	0.251	S	S	.	.	H	α-helix	trans	-72	-47.4	-179.6	49.7	0	0	0	0	112.3	E260 S264 L265 N266	E260-S262 PolarHBondContact O-N 2.77Å; E260-S262 VanDerWaalsContact O-N 3.17Å; S262-S264 VanDerWaalsContact C-N 3.34Å; S262-L265 PolarHBondContact O-N 2.87Å; S262-N266 PolarHBondContact O-N 3.17Å
263	T	81.6	Confident	85.2	Confident	68 Å²	68	46.6 Å²	46.6	42%	0.417	25%	0.25	S	S	.	.	H	α-helix	trans	-60.7	-45.3	174.5	-54.7	0	0	0	0	110.6	V258 E260 L265 N266 L267	V258-T263 HydrophobicContact CG1-CG2 3.75Å; E260-T263 PolarHBondContact O-N 3.05Å; T263-L265 VanDerWaalsContact C-N 3.34Å; T263-L265 PolarHBondContact O-N 3.23Å; T263-N266 PolarHBondContact O-N 2.85Å; T263-N266 VanDerWaalsContact O-N 3.15Å; T263-L267 HydrophobicContact CG2-CD1 4.32Å; T263-L267 WeakPolarHBondContact O-CG 3.48Å; T263-L267 PolarHBondContact O-N 2.96Å; T263-L267 VanDerWaalsContact O-N 3.08Å
264	S	86.6	Confident	85.1	Confident	0 Å²	0	47 Å²	47	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-55.4	-44.9	174.2	-65.8	0	0	0	0	112.7	V258 E260 S262 N266 F268	V258-S264 WeakPolarHBondContact CG1-OG 3.32Å; E260-S264 PolarHBondContact O-N 3.41Å; E260-S264 PolarHBondContact O-OG 2.96Å; S262-S264 VanDerWaalsContact C-N 3.34Å; S264-N266 VanDerWaalsContact C-N 3.31Å; S264-N266 PolarHBondContact O-N 2.96Å; S264-F268 PolarHBondContact O-N 3.41Å
265	L	87.9	Confident	85.1	Confident	9 Å²	9	42.8 Å²	42.8	5%	0.047	23%	0.234	C	C	.	.	H	α-helix	trans	-64.2	-32.6	177.9	-177.7	58.4	0	0	0	113.4	S261 S262 T263 K269 L278 L282 L527	S261-L265 WeakPolarHBondContact O-CB 3.49Å; S261-L265 PolarHBondContact O-N 2.94Å; S262-L265 PolarHBondContact O-N 2.87Å; T263-L265 VanDerWaalsContact C-N 3.34Å; T263-L265 PolarHBondContact O-N 3.23Å; L265-K269 HydrophobicContact CD1-CD 4.47Å; L265-K269 HydrophobicContact CG-CD 4.3Å; L265-K269 WeakPolarHBondContact O-CD 3.22Å; L265-K269 VanDerWaalsContact O-CG 3.29Å; L265-K269 WeakPolarHBondContact O-CG 3.47Å; L265-K269 PolarHBondContact O-N 3.03Å; L265-L278 HydrophobicContact CB-CD2 3.87Å; L265-L278 HydrophobicContact CD1-CD1 4.22Å; L265-L278 HydrophobicContact CD1-CD2 4.34Å; L265-L282 HydrophobicContact CD2-CD1 4.38Å; L265-L282 HydrophobicContact CD2-CD2 3.95Å; L265-L527 HydrophobicContact CD1-CD1 3.5Å; L265-L527 VanDerWaalsContact CD1-CD1 3.5Å
266	N	79.2	Confident	85.1	Confident	87 Å²	87	42.7 Å²	42.7	47%	0.465	23%	0.234	S	C	.	.	H	α-helix	trans	-73.1	-51.1	177.4	-67.4	-16.3	0	0	0	110.9	S262 T263 S264 F268 K269 D270	S262-N266 PolarHBondContact O-N 3.17Å; T263-N266 PolarHBondContact O-N 2.85Å; T263-N266 VanDerWaalsContact O-N 3.15Å; S264-N266 VanDerWaalsContact C-N 3.31Å; S264-N266 PolarHBondContact O-N 2.96Å; N266-F268 PolarHBondContact O-N 2.85Å; N266-K269 PolarHBondContact O-N 3.39Å; N266-D270 PolarHBondContact O-N 2.97Å; N266-D270 VanDerWaalsContact O-OD2 3.09Å
267	L	77.8	Confident	85.1	Confident	44 Å²	44	40.9 Å²	40.9	23%	0.23	22%	0.224	C	C	.	.	H	α-helix	trans	-51.2	-35.7	176.4	-68.1	170.4	0	0	0	112.8	V258 T263 G271 E272 A273	V258-L267 HydrophobicContact CG2-CD1 3.93Å; T263-L267 HydrophobicContact CG2-CD1 4.32Å; T263-L267 WeakPolarHBondContact O-CG 3.48Å; T263-L267 PolarHBondContact O-N 2.96Å; T263-L267 VanDerWaalsContact O-N 3.08Å; L267-G271 PolarHBondContact O-N 2.99Å; L267-E272 HydrophobicContact CD2-CB 4.26Å; L267-E272 PolarHBondContact O-N 2.92Å; L267-A273 HydrophobicContact CB-CB 4.01Å; L267-A273 PolarHBondContact O-N 3.05Å
268	F	85.6	Confident	85.1	Confident	27 Å²	27	40 Å²	40	12%	0.118	22%	0.219	C	C	.	.	H	α-helix	trans	-71.4	-43.3	174.5	-173.1	-95.9	0	0	0	113.9	S264 N266 G271 V276 T291 L527 N529	S264-F268 PolarHBondContact O-N 3.41Å; N266-F268 PolarHBondContact O-N 2.85Å; F268-G271 PolarHBondContact O-N 3.34Å; F268-V276 HydrophobicContact CB-CG1 3.94Å; F268-V276 HydrophobicContact CB-CG2 3.67Å; F268-V276 HydrophobicContact CD2-CG1 4.28Å; F268-V276 HydrophobicContact CD2-CG2 4.03Å; F268-V276 HydrophobicContact CG-CG2 3.99Å; F268-T291 HydrophobicContact CE1-CG2 4.17Å; F268-T291 HydrophobicContact CZ-CG2 3.89Å; F268-L527 HydrophobicContact CD1-CB 3.83Å; F268-L527 HydrophobicContact CD1-CD1 3.73Å; F268-L527 HydrophobicContact CD1-CG 4.46Å; F268-L527 HydrophobicContact CD2-CB 4.03Å; F268-L527 HydrophobicContact CE1-CB 3.63Å; F268-L527 HydrophobicContact CE1-CD1 4Å; F268-L527 HydrophobicContact CE1-CG 4.45Å; F268-L527 VanDerWaalsContact CE2-C 3.49Å; F268-L527 HydrophobicContact CE2-CB 3.84Å; F268-L527 WeakPolarHBondContact CE2-O 3.45Å; F268-L527 HydrophobicContact CG-CB 4.02Å; F268-L527 HydrophobicContact CG-CD1 4.35Å; F268-L527 HydrophobicContact CZ-CB 3.63Å; F268-N529 HydrophobicContact CE2-CB 3.98Å; F268-N529 HydrophobicContact CZ-CB 4.31Å
269	K	80.2	Confident	84.9	Confident	130 Å²	130	39.2 Å²	39.2	57%	0.565	21%	0.214	S	C	*	.	H	α-helix	trans	-65.5	-39.3	179	-76	167.8	-179.7	168.7	0	112.3	L265 N266 G271	L265-K269 HydrophobicContact CD1-CD 4.47Å; L265-K269 HydrophobicContact CG-CD 4.3Å; L265-K269 WeakPolarHBondContact O-CD 3.22Å; L265-K269 VanDerWaalsContact O-CG 3.29Å; L265-K269 WeakPolarHBondContact O-CG 3.47Å; L265-K269 PolarHBondContact O-N 3.03Å; N266-K269 PolarHBondContact O-N 3.39Å; K269-G271 PolarHBondContact O-N 3.11Å
270	D	70.1	Confident	84.8	Confident	128 Å²	128	37.6 Å²	37.6	68%	0.684	21%	0.208	S	C	*	.	H	α-helix	trans	-76.6	-16.2	178.4	-58.8	-40.1	0	0	0	111.7	N266	N266-D270 PolarHBondContact O-N 2.97Å; N266-D270 VanDerWaalsContact O-OD2 3.09Å
271	G	74.6	Confident	84.6	Confident	45 Å²	45	40.8 Å²	40.8	46%	0.464	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	84.7	19.2	174.2	0	0	0	0	0	114	L267 F268 K269	L267-G271 PolarHBondContact O-N 2.99Å; F268-G271 PolarHBondContact O-N 3.34Å; K269-G271 PolarHBondContact O-N 3.11Å
272	E	76.6	Confident	84.6	Confident	99 Å²	99	42.8 Å²	42.8	46%	0.463	23%	0.233	S	C	.	.	S	Bend	trans	-80.1	-34	172.7	-54.7	-145.8	135.8	0	0	111.2	N44 L267 Q858	N44-E272 VanDerWaalsContact CB-O 3.22Å; N44-E272 WeakPolarHBondContact CB-O 3.48Å; N44-E272 PolarHBondContact ND2-O 3.45Å; L267-E272 HydrophobicContact CD2-CB 4.26Å; L267-E272 PolarHBondContact O-N 2.92Å; E272-Q858 PolarHBondContact OE1-NE2 3.43Å
273	A	87.6	Confident	84.7	Confident	4 Å²	4	39.9 Å²	39.9	3%	0.033	21%	0.213	C	C	.	.			trans	-101.3	141.6	168.9	0	0	0	0	0	111.8	V46 L267 V276	V46-A273 HydrophobicContact CG2-CB 3.84Å; L267-A273 HydrophobicContact CB-CB 4.01Å; L267-A273 PolarHBondContact O-N 3.05Å; A273-V276 HydrophobicContact CB-CG1 3.33Å
274	D	91.5	Very high	84.8	Confident	9 Å²	9	40.6 Å²	40.6	5%	0.048	21%	0.211	C	C	.	.	S	Bend	trans	-96	-22	171.5	-80.2	-53.7	0	0	0	113	F43 N44 N529 V532 H551	F43-D274 HydrophobicContact CD2-CB 3.52Å; F43-D274 HydrophobicContact CE2-CB 3.58Å; N44-D274 PolarHBondContact N-OD2 3.42Å; N44-D274 VanDerWaalsContact N-OD2 3.16Å; N44-D274 WeakPolarHBondContact O-CA 3.12Å; N44-D274 WeakPolarHBondContact O-CB 3.32Å; N44-D274 PolarHBondContact O-N 3.39Å; D274-N529 HydrophobicContact CB-CB 4.12Å; D274-N529 WeakPolarHBondContact O-CB 3.45Å; D274-N529 PolarHBondContact O-N 3.39Å; D274-N529 VanDerWaalsContact OD1-CG 3.28Å; D274-N529 PolarHBondContact OD1-ND2 3.48Å; D274-V532 HydrophobicContact CB-CG2 3.91Å; D274-H551 IonicContact OD1-CD2 3.7Å; D274-H551 IonicContact OD1-NE2 3.75Å; D274-H551 IonicContact OD2-CD2 2.77Å; D274-H551 PolarHBondContact OD2-CD2 3.34Å
275	D	94.7	Very high	84.8	Confident	1 Å²	1	45.9 Å²	45.9	1%	0.005	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.9	124.7	-178.2	-158.2	-35.4	0	0	0	109.6	F43 N44 L45 V46 H526 L527 V528 I535	F43-D275 HydrophobicContact CE2-CB 3.66Å; F43-D275 HydrophobicContact CZ-CB 3.51Å; N44-D275 PolarHBondContact O-N 2.84Å; L45-D275 HydrophobicContact CD1-CB 3.98Å; V46-D275 PolarHBondContact N-O 2.92Å; D275-H526 IonicContact OD1-CE1 3.05Å; D275-H526 IonicContact OD1-CG 2.81Å; D275-H526 IonicContact OD1-ND1 2.9Å; D275-H526 PolarHBondContact OD1-ND1 2.95Å; D275-L527 WeakPolarHBondContact CA-O 3.25Å; D275-V528 WeakPolarHBondContact OD2-CG2 3.3Å; D275-I535 VanDerWaalsContact OD2-CD1 3.22Å; D275-I535 WeakPolarHBondContact OD2-CD1 3.33Å
276	V	94.8	Very high	84.8	Confident	0 Å²	0	46.9 Å²	46.9	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	142.2	-175.5	-54.3	0	0	0	0	112.1	V46 F268 A273 L278 H526 L527	V46-V276 HydrophobicContact CB-CB 4.37Å; V46-V276 HydrophobicContact CB-CG1 3.97Å; V46-V276 HydrophobicContact CG2-CG1 3.87Å; F268-V276 HydrophobicContact CB-CG1 3.94Å; F268-V276 HydrophobicContact CB-CG2 3.67Å; F268-V276 HydrophobicContact CD2-CG1 4.28Å; F268-V276 HydrophobicContact CD2-CG2 4.03Å; F268-V276 HydrophobicContact CG-CG2 3.99Å; A273-V276 HydrophobicContact CB-CG1 3.33Å; V276-L278 HydrophobicContact CG2-CD2 4.47Å; V276-H526 CarbonylContact O-C 3.52Å; V276-H526 VanDerWaalsContact O-CA 3.24Å; V276-H526 WeakPolarHBondContact O-CA 3.13Å; V276-L527 HydrophobicContact CG2-CB 4.03Å; V276-L527 HydrophobicContact CG2-CG 4.47Å; V276-L527 PolarHBondContact N-O 3.07Å; V276-L527 VanDerWaalsContact N-O 3.17Å; V276-L527 PolarHBondContact O-N 3.32Å
277	I	91.8	Very high	85.1	Confident	14 Å²	14	45 Å²	45	7%	0.072	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	131.6	178	-49.7	176.4	0	0	0	110.2	Q48 E524	Q48-I277 HydrophobicContact CG-CB 4.32Å; Q48-I277 HydrophobicContact CG-CD1 4.49Å; I277-E524 HydrophobicContact CG2-CB 4.41Å
278	L	90.9	Very high	85.3	Confident	2 Å²	2	50.5 Å²	50.5	1%	0.01	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	154.4	174.3	-56.4	-177.3	0	0	0	111.1	S261 L265 V276 A283 N286 A525 L527	S261-L278 WeakPolarHBondContact O-CD2 3.47Å; L265-L278 HydrophobicContact CB-CD2 3.87Å; L265-L278 HydrophobicContact CD1-CD1 4.22Å; L265-L278 HydrophobicContact CD1-CD2 4.34Å; V276-L278 HydrophobicContact CG2-CD2 4.47Å; L278-A283 HydrophobicContact CB-CB 4.16Å; L278-N286 HydrophobicContact CD1-CB 4.16Å; L278-A525 PolarHBondContact N-O 3.38Å; L278-L527 HydrophobicContact CD1-CD1 3.92Å; L278-L527 HydrophobicContact CD1-CD2 4.16Å; L278-L527 HydrophobicContact CD1-CG 3.76Å; L278-L527 HydrophobicContact CG-CG 4.37Å
279	S	85.4	Confident	85.4	Confident	4 Å²	4	52.8 Å²	52.8	3%	0.028	28%	0.281	C	S	.	.			trans	-136.7	169.6	168	88.5	0	0	0	0	112.5	S261 L282 D403 K407	S261-S279 PolarHBondContact OG-N 3.28Å; S279-L282 PolarHBondContact O-N 3.11Å; S279-D403 PolarHBondContact OG-OD2 2.95Å; S279-K407 PolarHBondContact OG-NZ 3.49Å
280	G	84.4	Confident	85.6	Confident	2 Å²	2	51 Å²	51	2%	0.021	29%	0.285	C	S	.	.	H	α-helix	trans	60.7	-141.7	175.1	0	0	0	0	0	113.1	L282 A283 Q284 L337	G280-L282 PolarHBondContact O-N 3.36Å; G280-A283 PolarHBondContact O-N 3.2Å; G280-Q284 PolarHBondContact O-N 3.11Å; G280-L337 WeakPolarHBondContact CA-O 3.25Å; G280-L337 PolarHBondContact N-O 3.31Å
281	E	81.8	Confident	86.5	Confident	123 Å²	123	45.7 Å²	45.7	58%	0.575	26%	0.257	S	S	*	.	H	α-helix	trans	-59.7	-31.5	-178.6	-155.1	-168.1	147	0	0	112.8	A283 Q284 Q285	E281-A283 PolarHBondContact O-N 2.85Å; E281-Q284 PolarHBondContact O-N 3.14Å; E281-Q285 HydrophobicContact CG-CG 4.29Å; E281-Q285 WeakPolarHBondContact O-CB 3.28Å; E281-Q285 VanDerWaalsContact O-CG 3.3Å; E281-Q285 WeakPolarHBondContact O-CG 3.47Å; E281-Q285 PolarHBondContact O-N 3.1Å; E281-Q285 PolarHBondContact OE1-NE2 3.27Å
282	L	87.8	Confident	87.3	Confident	42 Å²	42	45.6 Å²	45.6	22%	0.22	24%	0.243	C	C	.	.	H	α-helix	trans	-66.5	-37.1	178.7	-64.8	-178.7	0	0	0	112.2	L265 S279 G280 N286	L265-L282 HydrophobicContact CD2-CD1 4.38Å; L265-L282 HydrophobicContact CD2-CD2 3.95Å; S279-L282 PolarHBondContact O-N 3.11Å; G280-L282 PolarHBondContact O-N 3.36Å; L282-N286 PolarHBondContact O-N 3.09Å; L282-N286 PolarHBondContact O-ND2 3.07Å
283	A	87.3	Confident	87.9	Confident	0 Å²	0	44.5 Å²	44.5	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-63.1	-45.4	171.9	0	0	0	0	0	110.6	L278 G280 E281 N286 A287 Y292 A525	L278-A283 HydrophobicContact CB-CB 4.16Å; G280-A283 PolarHBondContact O-N 3.2Å; E281-A283 PolarHBondContact O-N 2.85Å; A283-N286 PolarHBondContact O-N 3.13Å; A283-A287 WeakPolarHBondContact O-CB 3.48Å; A283-A287 PolarHBondContact O-N 3.07Å; A283-Y292 HydrophobicContact CB-CE2 4.41Å; A283-Y292 VanDerWaalsContact O-CE2 3.29Å; A283-Y292 WeakPolarHBondContact O-CE2 3.46Å; A283-A525 HydrophobicContact CB-CB 3.77Å
284	Q	84.6	Confident	88.1	Confident	83 Å²	83	46.8 Å²	46.8	39%	0.388	25%	0.252	S	S	.	.	H	α-helix	trans	-63.9	-44.2	179.8	-60.7	-175.8	-1.4	0	0	113.4	G280 E281 N286 A287 N334	G280-Q284 PolarHBondContact O-N 3.11Å; E281-Q284 PolarHBondContact O-N 3.14Å; Q284-N286 VanDerWaalsContact C-N 3.32Å; Q284-N286 PolarHBondContact O-N 3.35Å; Q284-A287 WeakPolarHBondContact O-CB 3.47Å; Q284-A287 PolarHBondContact O-N 3.47Å; Q284-N334 PolarHBondContact NE2-O 3.28Å
285	Q	86.6	Confident	88	Confident	111 Å²	111	48 Å²	48	52%	0.519	26%	0.257	S	S	.	.	H	α-helix	trans	-61.4	-39.4	178	-74.2	175.8	10	0	0	111.9	E281	E281-Q285 HydrophobicContact CG-CG 4.29Å; E281-Q285 WeakPolarHBondContact O-CB 3.28Å; E281-Q285 VanDerWaalsContact O-CG 3.3Å; E281-Q285 WeakPolarHBondContact O-CG 3.47Å; E281-Q285 PolarHBondContact O-N 3.1Å; E281-Q285 PolarHBondContact OE1-NE2 3.27Å
286	N	87.5	Confident	87.8	Confident	29 Å²	29	52 Å²	52	16%	0.155	27%	0.274	C	S	.	.	H	α-helix	trans	-91.3	-1.6	-178.4	-62.3	-86.7	0	0	0	113.6	L278 L282 A283 Q284 N288 D289 Y292 L527	L278-N286 HydrophobicContact CD1-CB 4.16Å; L282-N286 PolarHBondContact O-N 3.09Å; L282-N286 PolarHBondContact O-ND2 3.07Å; A283-N286 PolarHBondContact O-N 3.13Å; Q284-N286 VanDerWaalsContact C-N 3.32Å; Q284-N286 PolarHBondContact O-N 3.35Å; N286-N288 PolarHBondContact O-N 3.04Å; N286-D289 WeakPolarHBondContact O-CB 3.39Å; N286-D289 PolarHBondContact O-N 3.37Å; N286-Y292 HydrophobicContact CB-CD2 4.41Å; N286-Y292 WeakPolarHBondContact O-CB 3.24Å; N286-L527 HydrophobicContact CB-CD2 3.99Å
287	A	85.1	Confident	87.5	Confident	47 Å²	47	52.2 Å²	52.2	39%	0.388	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-11.1	-177.2	0	0	0	0	0	115.6	A283 Q284 Y292	A283-A287 WeakPolarHBondContact O-CB 3.48Å; A283-A287 PolarHBondContact O-N 3.07Å; Q284-A287 WeakPolarHBondContact O-CB 3.47Å; Q284-A287 PolarHBondContact O-N 3.47Å; A287-Y292 HydrophobicContact CB-CD1 4.49Å; A287-Y292 HydrophobicContact CB-CE1 4.2Å; A287-Y292 HydrophobicContact CB-CE2 4.29Å
288	N	82.5	Confident	87.4	Confident	161 Å²	161	51.7 Å²	51.7	86%	0.861	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.4	-0.2	174.8	-66.1	-76.7	0	0	0	113.8	N286	N286-N288 PolarHBondContact O-N 3.04Å
289	D	87	Confident	87.4	Confident	75 Å²	75	53.9 Å²	53.9	40%	0.401	28%	0.282	S	S	.	.	S	Bend	trans	-77	147	179.8	-168.8	-85.5	0	0	0	111.9	N286 T291 Y292	N286-D289 WeakPolarHBondContact O-CB 3.39Å; N286-D289 PolarHBondContact O-N 3.37Å; D289-T291 PolarHBondContact O-N 2.99Å; D289-T291 WeakPolarHBondContact OD1-CB 3.38Å; D289-T291 PolarHBondContact OD1-N 3.49Å; D289-T291 PolarHBondContact OD1-OG1 3.21Å; D289-Y292 WeakPolarHBondContact O-CB 3.29Å; D289-Y292 PolarHBondContact O-N 3.46Å; D289-Y292 VanDerWaalsContact O-N 3.12Å
290	S	84.3	Confident	87.7	Confident	93 Å²	93	53.7 Å²	53.7	65%	0.65	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.9	-12.9	-179.2	62.7	0	0	0	0	114.3	E530	S290-E530 PolarHBondContact OG-OE1 2.99Å
291	T	89	Confident	88.2	Confident	15 Å²	15	53.9 Å²	53.9	9%	0.092	28%	0.281	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.9	-16.7	172.7	64	0	0	0	0	113.5	F268 D289 V528 E530	F268-T291 HydrophobicContact CE1-CG2 4.17Å; F268-T291 HydrophobicContact CZ-CG2 3.89Å; D289-T291 PolarHBondContact O-N 2.99Å; D289-T291 WeakPolarHBondContact OD1-CB 3.38Å; D289-T291 PolarHBondContact OD1-N 3.49Å; D289-T291 PolarHBondContact OD1-OG1 3.21Å; T291-V528 WeakPolarHBondContact CB-O 3.45Å; T291-V528 PolarHBondContact O-N 3.32Å; T291-E530 HydrophobicContact CG2-CG 4Å
292	Y	92.1	Very high	88.8	Confident	44 Å²	44	48 Å²	48	17%	0.173	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.1	134.1	-176.1	-172.8	-85.7	0	0	0	112.4	A283 N286 A287 D289 D339 A525 H526 L527	A283-Y292 HydrophobicContact CB-CE2 4.41Å; A283-Y292 VanDerWaalsContact O-CE2 3.29Å; A283-Y292 WeakPolarHBondContact O-CE2 3.46Å; N286-Y292 HydrophobicContact CB-CD2 4.41Å; N286-Y292 WeakPolarHBondContact O-CB 3.24Å; A287-Y292 HydrophobicContact CB-CD1 4.49Å; A287-Y292 HydrophobicContact CB-CE1 4.2Å; A287-Y292 HydrophobicContact CB-CE2 4.29Å; D289-Y292 WeakPolarHBondContact O-CB 3.29Å; D289-Y292 PolarHBondContact O-N 3.46Å; D289-Y292 VanDerWaalsContact O-N 3.12Å; Y292-D339 PolarHBondContact OH-O 3.03Å; Y292-A525 HydrophobicContact CE2-CB 3.88Å; Y292-A525 VanDerWaalsContact OH-CB 3.27Å; Y292-A525 WeakPolarHBondContact OH-CB 3.3Å; Y292-H526 CarbonylContact C-O 3.51Å; Y292-H526 WeakPolarHBondContact CA-O 3.32Å; Y292-L527 HydrophobicContact CD2-CD2 3.79Å; Y292-L527 HydrophobicContact CG-CD2 4.34Å
293	K	90.2	Very high	89.2	Confident	76 Å²	76	46 Å²	46	33%	0.33	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	133.9	173.3	-57.9	177.1	-161.5	157.8	0	109.2	F295 H526 V528	K293-F295 HydrophobicContact CB-CD2 4.22Å; K293-F295 HydrophobicContact CB-CE2 3.72Å; K293-F295 HydrophobicContact CB-CZ 4.21Å; K293-F295 HydrophobicContact CD-CE2 3.98Å; K293-F295 HydrophobicContact CD-CZ 3.78Å; K293-H526 PolarHBondContact N-O 3.28Å; K293-H526 PolarHBondContact O-N 3.39Å; K293-V528 HydrophobicContact CD-CB 4.25Å; K293-V528 HydrophobicContact CD-CG2 3.84Å; K293-V528 HydrophobicContact CG-CG2 4.45Å; K293-V528 VanDerWaalsContact NZ-CG1 3.3Å
294	S	90	Very high	89.6	Confident	52 Å²	52	46.2 Å²	46.2	36%	0.364	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	124.8	167.7	-169.1	0	0	0	0	109.3	D339 S523 E524	S294-D339 WeakPolarHBondContact CB-O 3.4Å; S294-D339 PolarHBondContact OG-O 3.21Å; S294-S523 WeakPolarHBondContact OG-CB 3.3Å; S294-S523 PolarHBondContact OG-OG 3.33Å; S294-E524 CarbonylContact C-O 3.6Å; S294-E524 VanDerWaalsContact CA-O 3.3Å; S294-E524 WeakPolarHBondContact CA-O 3.23Å
295	F	90.5	Very high	90.1	Very high	34 Å²	34	42.3 Å²	42.3	15%	0.149	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	108.7	179.9	-69.6	-86.9	0	0	0	109.6	K293 S523 E524 H526 V528 H537 W544	K293-F295 HydrophobicContact CB-CD2 4.22Å; K293-F295 HydrophobicContact CB-CE2 3.72Å; K293-F295 HydrophobicContact CB-CZ 4.21Å; K293-F295 HydrophobicContact CD-CE2 3.98Å; K293-F295 HydrophobicContact CD-CZ 3.78Å; F295-S523 CarbonylContact O-C 3.54Å; F295-S523 VanDerWaalsContact O-CA 3.24Å; F295-S523 WeakPolarHBondContact O-CA 3.48Å; F295-S523 PolarHBondContact O-OG 3.4Å; F295-E524 PolarHBondContact N-O 2.9Å; F295-E524 PolarHBondContact O-N 3.41Å; F295-H526 HydrophobicContact CD2-CB 4.18Å; F295-H526 AromaticContact CD2-CD2 3.54Å; F295-H526 AromaticContact CD2-CG 3.84Å; F295-H526 HydrophobicContact CE2-CB 4Å; F295-H526 AromaticContact CE2-CG 3.94Å; F295-V528 HydrophobicContact CE2-CG2 4.31Å; F295-H537 HydrophobicContact CD1-CB 3.62Å; F295-H537 AromaticContact CD1-CG 3.66Å; F295-H537 HydrophobicContact CE1-CB 3.89Å; F295-W544 HydrophobicContact CB-CH2 4.25Å; F295-W544 HydrophobicContact CD1-CH2 4.2Å; F295-W544 HydrophobicContact CD1-CZ3 4.38Å; F295-W544 AromaticContact CD2-CH2 3.77Å; F295-W544 HydrophobicContact CD2-CH2 3.77Å; F295-W544 HydrophobicContact CD2-CZ3 4.47Å; F295-W544 HydrophobicContact CE1-CH2 4.45Å; F295-W544 HydrophobicContact CE1-CZ3 4.29Å; F295-W544 HydrophobicContact CE2-CH2 4.03Å; F295-W544 HydrophobicContact CE2-CZ3 4.37Å; F295-W544 AromaticContact CG-CH2 3.84Å; F295-W544 HydrophobicContact CG-CH2 3.84Å; F295-W544 HydrophobicContact CG-CZ3 4.45Å; F295-W544 HydrophobicContact CZ-CH2 4.35Å; F295-W544 HydrophobicContact CZ-CZ3 4.27Å
296	K	89.6	Confident	90.5	Very high	84 Å²	84	37.2 Å²	37.2	37%	0.365	20%	0.203	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	120.8	-178.8	-173.5	179.8	-65.2	-173.5	0	111.1	Q521 S523 H537	K296-Q521 HydrophobicContact CG-CG 4.4Å; K296-S523 WeakPolarHBondContact CA-OG 3.05Å; K296-S523 PolarHBondContact N-OG 2.82Å; K296-H537 PolarHBondContact O-CE1 3.05Å
297	E	88.1	Confident	90.8	Very high	5 Å²	5	36.7 Å²	36.7	2%	0.023	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	153.4	171.4	-65.8	-161.7	126.6	0	0	110.8	R299 Q521 L522 S543	E297-R299 HydrophobicContact CB-CB 3.63Å; E297-R299 PolarHBondContact O-N 2.96Å; E297-R299 WeakPolarHBondContact OE2-CD 3.32Å; E297-R299 IonicContact OE2-CZ 3.76Å; E297-R299 IonicContact OE2-NE 3.34Å; E297-R299 IonicContact OE2-NH1 2.8Å; E297-R299 PolarHBondContact OE2-NH1 3.39Å; E297-Q521 WeakPolarHBondContact O-CG 3.28Å; E297-Q521 PolarHBondContact O-NE2 3.09Å; E297-L522 PolarHBondContact N-O 2.95Å; E297-L522 VanDerWaalsContact N-O 3.12Å; E297-S543 WeakPolarHBondContact OE1-CB 3.26Å; E297-S543 PolarHBondContact OE1-OG 3.23Å
298	A	90.2	Very high	91.1	Very high	4 Å²	4	38.5 Å²	38.5	3%	0.033	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	58.9	160.3	0	0	0	0	0	108.7	P349 M352 A453 F461 P539 A540	A298-P349 HydrophobicContact CB-CG 4.09Å; A298-M352 HydrophobicContact CB-CB 4.09Å; A298-M352 HydrophobicContact CB-CG 3.93Å; A298-M352 HydrophobicContact CB-SD 3.98Å; A298-A453 HydrophobicContact CB-CB 4.05Å; A298-A453 PolarHBondContact O-N 3.48Å; A298-F461 WeakPolarHBondContact O-CZ 3.27Å; A298-P539 WeakPolarHBondContact CA-O 3.26Å; A298-P539 HydrophobicContact CB-CB 4.25Å; A298-P539 WeakPolarHBondContact CB-O 3.35Å; A298-P539 PolarHBondContact N-O 2.72Å; A298-A540 HydrophobicContact CB-CB 4.4Å
299	R	90.7	Very high	91.3	Very high	47 Å²	47	36.8 Å²	36.8	18%	0.177	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	124.1	-174.9	178.6	175.9	-177.1	-166	-1.9	111.5	E297 W451 Q521 L522	E297-R299 HydrophobicContact CB-CB 3.63Å; E297-R299 PolarHBondContact O-N 2.96Å; E297-R299 WeakPolarHBondContact OE2-CD 3.32Å; E297-R299 IonicContact OE2-CZ 3.76Å; E297-R299 IonicContact OE2-NE 3.34Å; E297-R299 IonicContact OE2-NH1 2.8Å; E297-R299 PolarHBondContact OE2-NH1 3.39Å; R299-W451 CarbonylContact C-O 3.55Å; R299-W451 WeakPolarHBondContact CA-O 3.41Å; R299-W451 WeakPolarHBondContact CG-O 3.13Å; R299-Q521 CarbonylContact O-C 3.5Å; R299-Q521 WeakPolarHBondContact O-CA 3.35Å; R299-Q521 WeakPolarHBondContact O-CG 3.41Å; R299-L522 HydrophobicContact CB-CB 4.49Å; R299-L522 VanDerWaalsContact NH1-CD2 3.31Å; R299-L522 PolarHBondContact O-N 3.26Å
300	T	93.3	Very high	91	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103	121.7	174.7	-59.2	0	0	0	0	109.5	Y302 L347 G450 W451 P518	T300-Y302 HydrophobicContact CG2-CD1 4.28Å; T300-Y302 VanDerWaalsContact O-CD1 3.27Å; T300-Y302 WeakPolarHBondContact O-CD1 3.34Å; T300-L347 VanDerWaalsContact CB-O 3.23Å; T300-L347 WeakPolarHBondContact CB-O 3.27Å; T300-L347 PolarHBondContact OG1-O 3.23Å; T300-G450 CarbonylContact O-C 3.55Å; T300-G450 WeakPolarHBondContact O-CA 3.36Å; T300-W451 PolarHBondContact N-O 2.9Å; T300-W451 PolarHBondContact O-N 2.98Å; T300-P518 HydrophobicContact CG2-CB 4.09Å
301	S	94.4	Very high	91.1	Very high	6 Å²	6	39.6 Å²	39.6	4%	0.042	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	137.6	167.6	-69.3	0	0	0	0	110.7	G449 L519 Y520	S301-G449 WeakPolarHBondContact CA-O 3.42Å; S301-L519 WeakPolarHBondContact O-CB 3.29Å; S301-L519 PolarHBondContact O-N 3.38Å; S301-Y520 PolarHBondContact N-O 3.36Å; S301-Y520 WeakPolarHBondContact OG-CE2 3.47Å; S301-Y520 PolarHBondContact OG-OH 2.97Å
302	Y	94.6	Very high	91.2	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.7	157.4	-173.1	51.7	-104.4	0	0	0	113	T300 E304 L347 G449 W451 F465 Y471 V516 A517	T300-Y302 HydrophobicContact CG2-CD1 4.28Å; T300-Y302 VanDerWaalsContact O-CD1 3.27Å; T300-Y302 WeakPolarHBondContact O-CD1 3.34Å; Y302-E304 HydrophobicContact CD2-CB 4.36Å; Y302-E304 HydrophobicContact CE2-CB 4.32Å; Y302-L347 HydrophobicContact CD1-CD1 4.05Å; Y302-L347 HydrophobicContact CE1-CD1 3.93Å; Y302-G449 PolarHBondContact N-O 3.14Å; Y302-G449 CarbonylContact O-C 3.59Å; Y302-G449 PolarHBondContact O-N 2.83Å; Y302-G449 VanDerWaalsContact O-O 3.09Å; Y302-W451 HydrophobicContact CE1-CB 4.08Å; Y302-F465 AromaticContact CE2-CZ 3.83Å; Y302-F465 HydrophobicContact CE2-CZ 3.83Å; Y302-F465 AromaticContact CZ-CZ 3.75Å; Y302-Y471 WeakPolarHBondContact OH-CE1 3.38Å; Y302-V516 HydrophobicContact CD2-CB 3.89Å; Y302-V516 HydrophobicContact CD2-CG1 3.85Å; Y302-V516 HydrophobicContact CD2-CG2 4.24Å; Y302-V516 HydrophobicContact CE2-CG1 4.03Å; Y302-V516 HydrophobicContact CG-CB 4.24Å; Y302-V516 HydrophobicContact CG-CG2 4.2Å; Y302-A517 CarbonylContact C-O 3.51Å; Y302-A517 VanDerWaalsContact CA-O 3.23Å; Y302-A517 WeakPolarHBondContact CA-O 3.18Å; Y302-A517 WeakPolarHBondContact CB-O 3.41Å
303	L	96	Very high	91.2	Very high	1 Å²	1	39.1 Å²	39.1	1%	0.005	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	126.6	164.8	-58.7	-178.3	0	0	0	110.2	Y305 V323 I327 L397 I412 V446 L447 L448 V516 A517 L519	L303-Y305 HydrophobicContact CB-CE1 4.37Å; L303-V323 HydrophobicContact CD1-CG1 3.82Å; L303-I327 HydrophobicContact CD1-CD1 3.81Å; L303-L397 HydrophobicContact CD2-CD1 3.78Å; L303-I412 HydrophobicContact CD1-CD1 4.31Å; L303-I412 HydrophobicContact CD1-CG2 4.29Å; L303-I412 HydrophobicContact CD2-CD1 4.03Å; L303-I412 HydrophobicContact CG-CD1 4.41Å; L303-V446 HydrophobicContact CB-CG1 3.99Å; L303-V446 HydrophobicContact CD1-CG1 4.39Å; L303-V446 HydrophobicContact CD2-CG1 4.22Å; L303-V446 HydrophobicContact CG-CG1 4.43Å; L303-L447 WeakPolarHBondContact CA-O 3.3Å; L303-L448 HydrophobicContact CD2-CB 4.28Å; L303-L448 HydrophobicContact CD2-CD1 4.16Å; L303-V516 CarbonylContact O-C 2.94Å; L303-V516 VanDerWaalsContact O-CA 3.29Å; L303-V516 WeakPolarHBondContact O-CA 3.49Å; L303-V516 VanDerWaalsContact O-CB 3.29Å; L303-V516 WeakPolarHBondContact O-CB 3.41Å; L303-A517 HydrophobicContact CB-CB 4.26Å; L303-A517 PolarHBondContact N-O 3.09Å; L303-A517 PolarHBondContact O-N 2.82Å; L303-L519 HydrophobicContact CD2-CD1 4.21Å; L303-L519 HydrophobicContact CG-CD1 4.23Å; L303-L519 HydrophobicContact CG-CD2 4.34Å
304	E	95.2	Very high	91.4	Very high	3 Å²	3	35.5 Å²	35.5	1%	0.014	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	137.4	171.5	-178	176.6	-163.8	0	0	110.2	Y302 F444 V446 L447 R473 G474 V516	Y302-E304 HydrophobicContact CD2-CB 4.36Å; Y302-E304 HydrophobicContact CE2-CB 4.32Å; E304-F444 HydrophobicContact CG-CE2 4.44Å; E304-F444 HydrophobicContact CG-CZ 4.46Å; E304-V446 WeakPolarHBondContact O-CA 3.35Å; E304-L447 HydrophobicContact CB-CB 4.42Å; E304-L447 PolarHBondContact N-O 2.95Å; E304-L447 PolarHBondContact O-N 3.43Å; E304-R473 WeakPolarHBondContact OE1-CA 3.3Å; E304-R473 PolarHBondContact OE1-N 3.18Å; E304-G474 PolarHBondContact OE1-N 3.47Å; E304-V516 HydrophobicContact CB-CG1 4.21Å; E304-V516 HydrophobicContact CG-CG1 4.32Å
305	Y	95.8	Very high	91.6	Very high	1 Å²	1	37.7 Å²	37.7	0%	0.004	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	127.5	-169.7	-50.6	-83.6	0	0	0	112	L303 Q307 W314 R320 V323 V446 G474 A517	L303-Y305 HydrophobicContact CB-CE1 4.37Å; Y305-Q307 PolarHBondContact O-N 3.37Å; Y305-Q307 PolarHBondContact O-NE2 2.81Å; Y305-W314 AromaticContact CD1-CD2 3.86Å; Y305-W314 HydrophobicContact CD1-CD2 3.86Å; Y305-W314 AromaticContact CD1-CE3 3.29Å; Y305-W314 HydrophobicContact CD1-CE3 3.29Å; Y305-W314 HydrophobicContact CD1-CH2 4.27Å; Y305-W314 AromaticContact CD1-CZ3 3.52Å; Y305-W314 HydrophobicContact CD1-CZ3 3.52Å; Y305-W314 AromaticContact CE1-CE3 3.86Å; Y305-W314 HydrophobicContact CE1-CE3 3.86Å; Y305-W314 HydrophobicContact CE1-CH2 4.37Å; Y305-W314 AromaticContact CE1-CZ3 3.62Å; Y305-W314 HydrophobicContact CE1-CZ3 3.62Å; Y305-W314 HydrophobicContact CG-CD2 4.43Å; Y305-W314 AromaticContact CG-CE3 3.99Å; Y305-W314 HydrophobicContact CG-CE3 3.99Å; Y305-R320 HydrophobicContact CD2-CB 4.3Å; Y305-R320 HydrophobicContact CD2-CG 3.84Å; Y305-R320 HydrophobicContact CE2-CB 3.95Å; Y305-R320 HydrophobicContact CE2-CG 4.01Å; Y305-R320 HydrophobicContact CG-CG 4.08Å; Y305-V323 HydrophobicContact CE1-CB 4.41Å; Y305-V323 HydrophobicContact CE1-CG1 4.09Å; Y305-V323 WeakPolarHBondContact OH-CG1 3.43Å; Y305-V446 HydrophobicContact CD1-CG1 3.99Å; Y305-V446 HydrophobicContact CD1-CG2 3.87Å; Y305-V446 HydrophobicContact CE1-CG1 4.16Å; Y305-V446 HydrophobicContact CE1-CG2 4.41Å; Y305-G474 WeakPolarHBondContact O-CA 3.48Å; Y305-A517 HydrophobicContact CE2-CB 4.25Å; Y305-A517 VanDerWaalsContact OH-CB 3.26Å; Y305-A517 WeakPolarHBondContact OH-CB 3.17Å
306	N	95.2	Very high	91.8	Very high	5 Å²	5	37.1 Å²	37.1	3%	0.027	19%	0.19	C	C	.	.			trans	-75.4	106.9	-175.6	-172.6	-1.4	0	0	0	112.8	R308 S312 G442 F444 D445	N306-R308 VanDerWaalsContact OD1-CB 3.26Å; N306-R308 WeakPolarHBondContact OD1-CB 3.42Å; N306-R308 VanDerWaalsContact OD1-CG 3.27Å; N306-R308 WeakPolarHBondContact OD1-CG 3.29Å; N306-R308 PolarHBondContact OD1-N 2.85Å; N306-S312 WeakPolarHBondContact O-CB 3.28Å; N306-S312 PolarHBondContact O-OG 2.96Å; N306-G442 PolarHBondContact ND2-O 3.47Å; N306-F444 HydrophobicContact CB-CD2 3.98Å; N306-F444 HydrophobicContact CB-CE2 3.85Å; N306-F444 HydrophobicContact CB-CG 4.44Å; N306-F444 HydrophobicContact CB-CZ 4.19Å; N306-F444 WeakPolarHBondContact CB-O 3.1Å; N306-F444 PolarHBondContact ND2-O 2.95Å; N306-D445 WeakPolarHBondContact CB-O 3.13Å; N306-D445 PolarHBondContact N-O 2.82Å
307	Q	93.3	Very high	92	Very high	17 Å²	17	36.7 Å²	36.7	8%	0.079	19%	0.189	C	C	.	.			trans	-108.3	11.1	178.6	-66.5	165	87.7	0	0	112.3	Y305 K309 W314 K315 R320 G474	Y305-Q307 PolarHBondContact O-N 3.37Å; Y305-Q307 PolarHBondContact O-NE2 2.81Å; Q307-K309 PolarHBondContact O-N 3.43Å; Q307-W314 HydrophobicContact CG-CB 4Å; Q307-W314 PolarHBondContact OE1-O 3.42Å; Q307-K315 HydrophobicContact CB-CG 3.95Å; Q307-K315 HydrophobicContact CG-CG 3.96Å; Q307-K315 WeakPolarHBondContact O-CE 3.3Å; Q307-K315 PolarHBondContact O-NZ 2.77Å; Q307-R320 VanDerWaalsContact OE1-NH1 3.12Å; Q307-G474 CarbonylContact C-O 3.56Å; Q307-G474 VanDerWaalsContact CA-O 3.31Å; Q307-G474 WeakPolarHBondContact CA-O 3.27Å; Q307-G474 WeakPolarHBondContact CB-O 3.26Å; Q307-G474 PolarHBondContact N-O 2.89Å
308	R	90.3	Very high	92.3	Very high	85 Å²	85	37.6 Å²	37.6	32%	0.321	19%	0.194	S	C	.	.			trans	-58.9	-44.1	178.7	-66.2	-177.3	-172.1	-157.8	5.2	112.8	N306 S439 N440 A441 R473 G474 R475	N306-R308 VanDerWaalsContact OD1-CB 3.26Å; N306-R308 WeakPolarHBondContact OD1-CB 3.42Å; N306-R308 VanDerWaalsContact OD1-CG 3.27Å; N306-R308 WeakPolarHBondContact OD1-CG 3.29Å; N306-R308 PolarHBondContact OD1-N 2.85Å; R308-S439 PolarHBondContact NH2-O 3.14Å; R308-N440 PolarHBondContact NH1-O 2.89Å; R308-N440 PolarHBondContact NH2-O 2.75Å; R308-A441 PolarHBondContact NH1-O 3.06Å; R308-R473 VanDerWaalsContact CZ-O 3.29Å; R308-R473 PolarHBondContact NE-O 3.1Å; R308-R473 PolarHBondContact NH2-O 3.16Å; R308-G474 PolarHBondContact N-O 2.81Å; R308-R475 HydrophobicContact CG-CB 4.3Å; R308-R475 HydrophobicContact CG-CG 3.73Å
309	K	86.6	Confident	92.6	Very high	125 Å²	125	37.4 Å²	37.4	54%	0.543	19%	0.193	S	C	.	.	S	Bend	trans	-75	145.8	-177.4	-57.8	176.4	-176.5	163.1	0	111.2	Q307 D311 S312 K315	Q307-K309 PolarHBondContact O-N 3.43Å; K309-D311 VanDerWaalsContact C-N 3.27Å; K309-D311 WeakPolarHBondContact CB-OD1 3.44Å; K309-D311 PolarHBondContact O-N 3.4Å; K309-S312 PolarHBondContact O-N 3.47Å; K309-K315 WeakPolarHBondContact O-CE 3.46Å; K309-K315 PolarHBondContact O-NZ 3.05Å
310	A	81.2	Confident	92.9	Very high	93 Å²	93	35.6 Å²	35.6	77%	0.769	19%	0.186	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.5	-36.7	-177.6	0	0	0	0	0	112.5
311	D	85.9	Confident	92.9	Very high	135 Å²	135	37 Å²	37	72%	0.722	19%	0.192	S	C	*	.	T	Hydrogen-bonded Turn	trans	-95.1	6.1	-177.3	58	-33.2	0	0	0	114.1	K309	K309-D311 VanDerWaalsContact C-N 3.27Å; K309-D311 WeakPolarHBondContact CB-OD1 3.44Å; K309-D311 PolarHBondContact O-N 3.4Å
312	S	91.6	Very high	93	Very high	14 Å²	14	36.7 Å²	36.7	10%	0.098	19%	0.19	C	C	.	.			trans	-62.8	126.4	-179.9	179.9	0	0	0	0	111.5	N306 K309 W314 K315	N306-S312 WeakPolarHBondContact O-CB 3.28Å; N306-S312 PolarHBondContact O-OG 2.96Å; K309-S312 PolarHBondContact O-N 3.47Å; S312-W314 PolarHBondContact O-N 3.24Å; S312-W314 VanDerWaalsContact O-N 3.16Å; S312-W314 PolarHBondContact OG-N 3.32Å; S312-K315 PolarHBondContact O-N 2.86Å
313	P	93.1	Very high	93	Very high	34 Å²	34	36.7 Å²	36.7	22%	0.221	19%	0.19	C	C	.	.	G	3₁₀ helix	trans	-61.9	-26.4	178.8	26.8	-34.8	0	0	0	111.8	K315 N316 L319 L388 L393	P313-K315 PolarHBondContact O-N 3.18Å; P313-K315 VanDerWaalsContact O-N 3.11Å; P313-N316 VanDerWaalsContact O-CB 3.22Å; P313-N316 WeakPolarHBondContact O-CB 3.47Å; P313-N316 PolarHBondContact O-N 2.87Å; P313-L319 HydrophobicContact CB-CD2 3.95Å; P313-L388 HydrophobicContact CB-CD1 3.86Å; P313-L388 HydrophobicContact CB-CD2 4.21Å; P313-L393 HydrophobicContact CB-CD1 4.44Å; P313-L393 HydrophobicContact CG-CD1 4.02Å
314	W	94.8	Very high	92.9	Very high	1 Å²	1	36.7 Å²	36.7	0%	0.004	19%	0.19	C	C	.	.	G	3₁₀ helix	trans	-64.4	-12.4	179.5	-63.3	116.6	0	0	0	115.2	Y305 Q307 S312 N316 L319 R320 V323 F395 V446	Y305-W314 AromaticContact CD1-CD2 3.86Å; Y305-W314 HydrophobicContact CD1-CD2 3.86Å; Y305-W314 AromaticContact CD1-CE3 3.29Å; Y305-W314 HydrophobicContact CD1-CE3 3.29Å; Y305-W314 HydrophobicContact CD1-CH2 4.27Å; Y305-W314 AromaticContact CD1-CZ3 3.52Å; Y305-W314 HydrophobicContact CD1-CZ3 3.52Å; Y305-W314 AromaticContact CE1-CE3 3.86Å; Y305-W314 HydrophobicContact CE1-CE3 3.86Å; Y305-W314 HydrophobicContact CE1-CH2 4.37Å; Y305-W314 AromaticContact CE1-CZ3 3.62Å; Y305-W314 HydrophobicContact CE1-CZ3 3.62Å; Y305-W314 HydrophobicContact CG-CD2 4.43Å; Y305-W314 AromaticContact CG-CE3 3.99Å; Y305-W314 HydrophobicContact CG-CE3 3.99Å; Q307-W314 HydrophobicContact CG-CB 4Å; Q307-W314 PolarHBondContact OE1-O 3.42Å; S312-W314 PolarHBondContact O-N 3.24Å; S312-W314 VanDerWaalsContact O-N 3.16Å; S312-W314 PolarHBondContact OG-N 3.32Å; W314-N316 PolarHBondContact O-N 2.63Å; W314-L319 HydrophobicContact CD2-CD2 4.09Å; W314-L319 HydrophobicContact CE3-CD2 3.64Å; W314-L319 HydrophobicContact CE3-CG 3.81Å; W314-L319 HydrophobicContact CH2-CD1 4.39Å; W314-L319 HydrophobicContact CH2-CD2 4.23Å; W314-L319 HydrophobicContact CH2-CG 4.31Å; W314-L319 HydrophobicContact CZ3-CD1 4.04Å; W314-L319 HydrophobicContact CZ3-CD2 3.74Å; W314-L319 HydrophobicContact CZ3-CG 3.58Å; W314-R320 HydrophobicContact CE3-CG 4.38Å; W314-R320 WeakPolarHBondContact O-CD 3.35Å; W314-R320 WeakPolarHBondContact O-CG 3.08Å; W314-R320 PolarHBondContact O-NH1 3.03Å; W314-V323 HydrophobicContact CH2-CG2 4.17Å; W314-V323 HydrophobicContact CZ3-CG2 3.99Å; W314-F395 HydrophobicContact CH2-CD1 4.11Å; W314-F395 HydrophobicContact CH2-CD2 4.47Å; W314-F395 AromaticContact CH2-CE1 3.9Å; W314-F395 HydrophobicContact CH2-CE1 3.9Å; W314-F395 HydrophobicContact CH2-CE2 4.29Å; W314-F395 HydrophobicContact CH2-CG 4.39Å; W314-F395 AromaticContact CH2-CZ 3.99Å; W314-F395 HydrophobicContact CH2-CZ 3.99Å; W314-F395 HydrophobicContact CZ2-CB 4.11Å; W314-F395 AromaticContact CZ2-CD1 3.72Å; W314-F395 HydrophobicContact CZ2-CD1 3.72Å; W314-F395 AromaticContact CZ2-CD2 3.82Å; W314-F395 HydrophobicContact CZ2-CD2 3.82Å; W314-F395 AromaticContact CZ2-CE1 3.97Å; W314-F395 HydrophobicContact CZ2-CE1 3.97Å; W314-F395 HydrophobicContact CZ2-CE2 4.07Å; W314-F395 AromaticContact CZ2-CG 3.63Å; W314-F395 HydrophobicContact CZ2-CG 3.63Å; W314-F395 HydrophobicContact CZ2-CZ 4.14Å; W314-V446 HydrophobicContact CD2-CG2 4.15Å; W314-V446 VanDerWaalsContact CE2-CG2 3.46Å; W314-V446 HydrophobicContact CE3-CG2 4.49Å; W314-V446 HydrophobicContact CH2-CG2 3.67Å; W314-V446 HydrophobicContact CZ2-CG2 3.21Å; W314-V446 HydrophobicContact CZ3-CG2 4.27Å
315	K	92.8	Very high	92.8	Very high	98 Å²	98	37.7 Å²	37.7	43%	0.426	19%	0.194	S	C	.	.	G	3₁₀ helix	trans	-65.9	-25.7	168.7	-71.2	-172.2	174.2	179.2	0	112.3	Q307 K309 S312 P313 E317 R320	Q307-K315 HydrophobicContact CB-CG 3.95Å; Q307-K315 HydrophobicContact CG-CG 3.96Å; Q307-K315 WeakPolarHBondContact O-CE 3.3Å; Q307-K315 PolarHBondContact O-NZ 2.77Å; K309-K315 WeakPolarHBondContact O-CE 3.46Å; K309-K315 PolarHBondContact O-NZ 3.05Å; S312-K315 PolarHBondContact O-N 2.86Å; P313-K315 PolarHBondContact O-N 3.18Å; P313-K315 VanDerWaalsContact O-N 3.11Å; K315-E317 PolarHBondContact O-N 2.92Å; K315-R320 PolarHBondContact O-NH1 2.82Å
316	N	94.3	Very high	92.8	Very high	22 Å²	22	37.7 Å²	37.7	12%	0.118	19%	0.194	C	C	.	.			trans	-68.1	115.5	176.8	-173.2	-82.5	0	0	0	110.9	P313 W314 N318 L319 R320 A384 E387 L388	P313-N316 VanDerWaalsContact O-CB 3.22Å; P313-N316 WeakPolarHBondContact O-CB 3.47Å; P313-N316 PolarHBondContact O-N 2.87Å; W314-N316 PolarHBondContact O-N 2.63Å; N316-N318 VanDerWaalsContact C-N 3.32Å; N316-N318 PolarHBondContact O-N 2.67Å; N316-N318 WeakPolarHBondContact OD1-CA 3.22Å; N316-N318 WeakPolarHBondContact OD1-CB 3.47Å; N316-N318 PolarHBondContact OD1-N 2.78Å; N316-N318 VanDerWaalsContact OD1-N 3.07Å; N316-L319 HydrophobicContact CB-CB 4.09Å; N316-L319 WeakPolarHBondContact O-CB 3.33Å; N316-L319 PolarHBondContact O-N 3.21Å; N316-L319 PolarHBondContact OD1-N 2.76Å; N316-R320 PolarHBondContact O-N 3.45Å; N316-A384 WeakPolarHBondContact OD1-CB 3.35Å; N316-E387 WeakPolarHBondContact ND2-CB 3.41Å; N316-E387 PolarHBondContact ND2-OE2 2.68Å; N316-L388 HydrophobicContact CB-CD1 4.11Å; N316-L388 HydrophobicContact CB-CD2 4.03Å; N316-L388 HydrophobicContact CB-CG 4.11Å
317	E	94.3	Very high	92.8	Very high	74 Å²	74	37.4 Å²	37.4	35%	0.346	19%	0.192	S	C	.	.	H	α-helix	trans	-62.6	-38	-180	-169.8	-161.9	135.7	0	0	112.3	K315 L319 R320 K321 E513	K315-E317 PolarHBondContact O-N 2.92Å; E317-L319 VanDerWaalsContact C-N 3.32Å; E317-L319 PolarHBondContact O-N 3.08Å; E317-R320 PolarHBondContact O-N 2.86Å; E317-K321 HydrophobicContact CG-CD 4.26Å; E317-K321 WeakPolarHBondContact O-CB 3.47Å; E317-K321 WeakPolarHBondContact O-CG 3.23Å; E317-K321 PolarHBondContact O-N 3.34Å; E317-K321 VanDerWaalsContact OE1-CE 3.25Å; E317-K321 WeakPolarHBondContact OE1-CE 3.47Å; E317-K321 IonicContact OE1-NZ 3.86Å; E317-K321 PolarHBondContact OE1-NZ 3.24Å; E317-E513 HydrophobicContact CG-CB 4.49Å
318	N	95.8	Very high	92.8	Very high	25 Å²	25	38.5 Å²	38.5	13%	0.134	20%	0.199	C	C	.	.	H	α-helix	trans	-65.6	-33.6	177.1	-66.1	-62.4	0	0	0	111.6	N316 A322 Y380 K383 A384 E387	N316-N318 VanDerWaalsContact C-N 3.32Å; N316-N318 PolarHBondContact O-N 2.67Å; N316-N318 WeakPolarHBondContact OD1-CA 3.22Å; N316-N318 WeakPolarHBondContact OD1-CB 3.47Å; N316-N318 PolarHBondContact OD1-N 2.78Å; N316-N318 VanDerWaalsContact OD1-N 3.07Å; N318-A322 WeakPolarHBondContact O-CB 3.48Å; N318-A322 PolarHBondContact O-N 3.36Å; N318-Y380 HydrophobicContact CB-CD1 4.47Å; N318-Y380 WeakPolarHBondContact CB-O 2.98Å; N318-Y380 WeakPolarHBondContact O-CB 3.29Å; N318-Y380 VanDerWaalsContact OD1-CD1 3.29Å; N318-Y380 WeakPolarHBondContact OD1-CD1 3.36Å; N318-K383 HydrophobicContact CB-CB 4.1Å; N318-A384 HydrophobicContact CB-CB 4.1Å; N318-E387 VanDerWaalsContact ND2-CD 3.29Å; N318-E387 PolarHBondContact ND2-OE1 2.68Å; N318-E387 PolarHBondContact ND2-OE2 3Å
319	L	96.2	Very high	92.9	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-65.1	-49.3	173.6	174.2	58.5	0	0	0	111.5	P313 W314 N316 E317 K321 A322 V323 W381 A384 L388 L393 M423	P313-L319 HydrophobicContact CB-CD2 3.95Å; W314-L319 HydrophobicContact CD2-CD2 4.09Å; W314-L319 HydrophobicContact CE3-CD2 3.64Å; W314-L319 HydrophobicContact CE3-CG 3.81Å; W314-L319 HydrophobicContact CH2-CD1 4.39Å; W314-L319 HydrophobicContact CH2-CD2 4.23Å; W314-L319 HydrophobicContact CH2-CG 4.31Å; W314-L319 HydrophobicContact CZ3-CD1 4.04Å; W314-L319 HydrophobicContact CZ3-CD2 3.74Å; W314-L319 HydrophobicContact CZ3-CG 3.58Å; N316-L319 HydrophobicContact CB-CB 4.09Å; N316-L319 WeakPolarHBondContact O-CB 3.33Å; N316-L319 PolarHBondContact O-N 3.21Å; N316-L319 PolarHBondContact OD1-N 2.76Å; E317-L319 VanDerWaalsContact C-N 3.32Å; E317-L319 PolarHBondContact O-N 3.08Å; L319-K321 VanDerWaalsContact C-N 3.29Å; L319-K321 PolarHBondContact O-N 3Å; L319-A322 WeakPolarHBondContact O-CB 3.39Å; L319-A322 PolarHBondContact O-N 3.18Å; L319-V323 HydrophobicContact CD1-CG2 4.45Å; L319-V323 PolarHBondContact O-N 3.11Å; L319-V323 VanDerWaalsContact O-N 3.08Å; L319-W381 HydrophobicContact CD1-CE3 4.03Å; L319-W381 HydrophobicContact CD1-CZ3 3.85Å; L319-A384 HydrophobicContact CB-CB 3.98Å; L319-L388 HydrophobicContact CD2-CD1 4.24Å; L319-L393 HydrophobicContact CD1-CD2 3.91Å; L319-L393 HydrophobicContact CD2-CD2 3.68Å; L319-L393 HydrophobicContact CG-CD2 4.47Å; L319-M423 HydrophobicContact CD1-CE 3.9Å
320	R	95.7	Very high	93.1	Very high	8 Å²	8	35.4 Å²	35.4	3%	0.03	19%	0.187	C	C	.	.	H	α-helix	trans	-61.6	-39.6	177.7	-59.1	-169.8	-51.9	-89.2	-2.4	111.4	Y305 Q307 W314 K315 N316 E317 S324 E513 S514	Y305-R320 HydrophobicContact CD2-CB 4.3Å; Y305-R320 HydrophobicContact CD2-CG 3.84Å; Y305-R320 HydrophobicContact CE2-CB 3.95Å; Y305-R320 HydrophobicContact CE2-CG 4.01Å; Y305-R320 HydrophobicContact CG-CG 4.08Å; Q307-R320 VanDerWaalsContact OE1-NH1 3.12Å; W314-R320 HydrophobicContact CE3-CG 4.38Å; W314-R320 WeakPolarHBondContact O-CD 3.35Å; W314-R320 WeakPolarHBondContact O-CG 3.08Å; W314-R320 PolarHBondContact O-NH1 3.03Å; K315-R320 PolarHBondContact O-NH1 2.82Å; N316-R320 PolarHBondContact O-N 3.45Å; E317-R320 PolarHBondContact O-N 2.86Å; R320-S324 WeakPolarHBondContact O-CB 3.21Å; R320-S324 PolarHBondContact O-N 3.06Å; R320-E513 PolarHBondContact NE-O 3.49Å; R320-E513 PolarHBondContact NH2-O 3.17Å; R320-S514 WeakPolarHBondContact CB-O 3.31Å; R320-S514 WeakPolarHBondContact CD-O 3.4Å; R320-S514 PolarHBondContact NE-O 3.05Å
321	K	94.5	Very high	93.5	Very high	29 Å²	29	32.1 Å²	32.1	13%	0.126	16%	0.159	C	C	.	.	H	α-helix	trans	-62.4	-44.9	172.4	-77.2	175.9	167.7	177.5	0	112.9	E317 L319 V323 S324 Y325 Y380 K512	E317-K321 HydrophobicContact CG-CD 4.26Å; E317-K321 WeakPolarHBondContact O-CB 3.47Å; E317-K321 WeakPolarHBondContact O-CG 3.23Å; E317-K321 PolarHBondContact O-N 3.34Å; E317-K321 VanDerWaalsContact OE1-CE 3.25Å; E317-K321 WeakPolarHBondContact OE1-CE 3.47Å; E317-K321 IonicContact OE1-NZ 3.86Å; E317-K321 PolarHBondContact OE1-NZ 3.24Å; L319-K321 VanDerWaalsContact C-N 3.29Å; L319-K321 PolarHBondContact O-N 3Å; K321-V323 VanDerWaalsContact C-N 3.34Å; K321-V323 PolarHBondContact O-N 3.42Å; K321-S324 PolarHBondContact O-N 2.87Å; K321-Y325 VanDerWaalsContact O-CB 3.28Å; K321-Y325 WeakPolarHBondContact O-CB 3.41Å; K321-Y325 VanDerWaalsContact O-CD2 3.28Å; K321-Y325 WeakPolarHBondContact O-CD2 3.11Å; K321-Y325 PolarHBondContact O-N 2.85Å; K321-Y380 HydrophobicContact CB-CD1 4.25Å; K321-Y380 HydrophobicContact CB-CD2 3.8Å; K321-Y380 HydrophobicContact CB-CE2 4.14Å; K321-Y380 HydrophobicContact CB-CG 3.87Å; K321-Y380 HydrophobicContact CD-CD1 4.27Å; K321-Y380 HydrophobicContact CD-CE1 3.94Å; K321-Y380 HydrophobicContact CD-CE2 4.4Å; K321-K512 WeakPolarHBondContact CE-O 3.29Å; K321-K512 PolarHBondContact NZ-O 3.47Å
322	A	94.9	Very high	93.8	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-57.4	-47.3	177.8	0	0	0	0	0	111.7	N318 L319 A326 A377 W381 L420	N318-A322 WeakPolarHBondContact O-CB 3.48Å; N318-A322 PolarHBondContact O-N 3.36Å; L319-A322 WeakPolarHBondContact O-CB 3.39Å; L319-A322 PolarHBondContact O-N 3.18Å; A322-A326 WeakPolarHBondContact O-CB 3.42Å; A322-A326 PolarHBondContact O-N 3.5Å; A322-A326 VanDerWaalsContact O-N 3.13Å; A322-A377 WeakPolarHBondContact CB-O 3.46Å; A322-W381 HydrophobicContact CB-CB 3.93Å; A322-L420 HydrophobicContact CB-CD1 4.18Å; A322-L420 HydrophobicContact CB-CD2 4.31Å
323	V	95.1	Very high	93.8	Very high	1 Å²	1	25.2 Å²	25.2	1%	0.006	12%	0.121	C	C	.	.	H	α-helix	trans	-62.2	-51.5	175.1	171.9	0	0	0	0	111.2	L303 Y305 W314 L319 K321 Y325 A326 I327 L416 L420	L303-V323 HydrophobicContact CD1-CG1 3.82Å; Y305-V323 HydrophobicContact CE1-CB 4.41Å; Y305-V323 HydrophobicContact CE1-CG1 4.09Å; Y305-V323 WeakPolarHBondContact OH-CG1 3.43Å; W314-V323 HydrophobicContact CH2-CG2 4.17Å; W314-V323 HydrophobicContact CZ3-CG2 3.99Å; L319-V323 HydrophobicContact CD1-CG2 4.45Å; L319-V323 PolarHBondContact O-N 3.11Å; L319-V323 VanDerWaalsContact O-N 3.08Å; K321-V323 VanDerWaalsContact C-N 3.34Å; K321-V323 PolarHBondContact O-N 3.42Å; V323-Y325 VanDerWaalsContact C-N 3.33Å; V323-Y325 PolarHBondContact O-N 3.37Å; V323-A326 PolarHBondContact O-N 3.39Å; V323-I327 HydrophobicContact CG1-CD1 4.28Å; V323-I327 WeakPolarHBondContact O-CG1 3.39Å; V323-L416 HydrophobicContact CB-CD2 4.22Å; V323-L416 HydrophobicContact CG1-CD1 4.02Å; V323-L416 HydrophobicContact CG1-CD2 4.04Å; V323-L416 HydrophobicContact CG2-CD1 4.41Å; V323-L416 HydrophobicContact CG2-CD2 4.18Å; V323-L420 HydrophobicContact CG2-CD1 4.42Å
324	S	94.4	Very high	93.6	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-61.7	-37.6	-177.7	-172	0	0	0	0	113.2	R320 K321 R329	R320-S324 WeakPolarHBondContact O-CB 3.21Å; R320-S324 PolarHBondContact O-N 3.06Å; K321-S324 PolarHBondContact O-N 2.87Å; S324-R329 PolarHBondContact O-NH1 2.81Å; S324-R329 PolarHBondContact O-NH2 3.18Å; S324-R329 PolarHBondContact OG-NH2 2.86Å
325	Y	94.1	Very high	93.1	Very high	25 Å²	25	34.3 Å²	34.3	10%	0.098	16%	0.164	C	C	.	.	H	α-helix	trans	-81.4	-21.8	-177.7	-81.8	-126.7	0	0	0	113	K321 V323 P371 Y372 D373 K376 Y380	K321-Y325 VanDerWaalsContact O-CB 3.28Å; K321-Y325 WeakPolarHBondContact O-CB 3.41Å; K321-Y325 VanDerWaalsContact O-CD2 3.28Å; K321-Y325 WeakPolarHBondContact O-CD2 3.11Å; K321-Y325 PolarHBondContact O-N 2.85Å; V323-Y325 VanDerWaalsContact C-N 3.33Å; V323-Y325 PolarHBondContact O-N 3.37Å; Y325-P371 HydrophobicContact CE1-CG 3.84Å; Y325-Y372 VanDerWaalsContact O-CD2 3.27Å; Y325-Y372 WeakPolarHBondContact O-CD2 3.16Å; Y325-D373 HydrophobicContact CD1-CB 4.1Å; Y325-D373 PolarHBondContact O-N 3.45Å; Y325-K376 HydrophobicContact CD1-CB 3.86Å; Y325-K376 HydrophobicContact CD1-CD 4.19Å; Y325-K376 HydrophobicContact CE1-CB 4.42Å; Y325-K376 HydrophobicContact CE1-CD 3.97Å; Y325-Y380 HydrophobicContact CD1-CD2 4.46Å; Y325-Y380 HydrophobicContact CD1-CE2 4.01Å; Y325-Y380 HydrophobicContact CE1-CE2 4Å; Y325-Y380 HydrophobicContact CG-CD2 4.47Å; Y325-Y380 HydrophobicContact CG-CE2 4.33Å
326	A	94.7	Very high	92.8	Very high	0 Å²	0	30 Å²	30	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-71.9	-27.7	175	0	0	0	0	0	113.2	A322 V323 N328 Y372 A377 V415 L416 T419	A322-A326 WeakPolarHBondContact O-CB 3.42Å; A322-A326 PolarHBondContact O-N 3.5Å; A322-A326 VanDerWaalsContact O-N 3.13Å; V323-A326 PolarHBondContact O-N 3.39Å; A326-N328 PolarHBondContact O-N 3Å; A326-Y372 WeakPolarHBondContact O-CD2 3.12Å; A326-Y372 WeakPolarHBondContact O-CE2 3.24Å; A326-A377 HydrophobicContact CB-CB 3.97Å; A326-V415 HydrophobicContact CB-CG1 4.44Å; A326-V415 WeakPolarHBondContact O-CG1 3.27Å; A326-L416 HydrophobicContact CB-CD2 3.77Å; A326-T419 HydrophobicContact CB-CG2 3.62Å
327	I	94.7	Very high	92.5	Very high	0 Å²	0	29 Å²	29	0%	0	14%	0.14	C	C	.	.			trans	-79.5	110.7	-170.6	-62.4	167.1	0	0	0	111.7	L303 V323 R329 Y411 I412 L519	L303-I327 HydrophobicContact CD1-CD1 3.81Å; V323-I327 HydrophobicContact CG1-CD1 4.28Å; V323-I327 WeakPolarHBondContact O-CG1 3.39Å; I327-R329 VanDerWaalsContact C-N 3.31Å; I327-R329 HydrophobicContact CG2-CG 4.21Å; I327-R329 PolarHBondContact O-N 2.56Å; I327-R329 PolarHBondContact O-NH1 3.02Å; I327-Y411 HydrophobicContact CG2-CE1 4.38Å; I327-I412 HydrophobicContact CD1-CD1 4.26Å; I327-I412 HydrophobicContact CD1-CG1 4.16Å; I327-I412 HydrophobicContact CD1-CG2 4.31Å; I327-I412 HydrophobicContact CG1-CG1 4.46Å; I327-L519 HydrophobicContact CD1-CD2 3.73Å; I327-L519 HydrophobicContact CG2-CD2 3.94Å
328	N	93.6	Very high	92.1	Very high	39 Å²	39	26 Å²	26	21%	0.209	13%	0.13	C	C	.	.			trans	-78	79.1	173.2	179.7	10.5	0	0	0	111.3	A326 K330 S331 L332 Y372 Y411	A326-N328 PolarHBondContact O-N 3Å; N328-K330 PolarHBondContact O-N 3.37Å; N328-K330 PolarHBondContact OD1-N 3.18Å; N328-S331 PolarHBondContact ND2-OG 3.2Å; N328-S331 WeakPolarHBondContact O-CB 3.11Å; N328-S331 PolarHBondContact O-N 3.24Å; N328-L332 PolarHBondContact O-N 3.14Å; N328-Y372 HydrophobicContact CB-CD1 4.08Å; N328-Y372 HydrophobicContact CB-CD2 3.9Å; N328-Y372 HydrophobicContact CB-CE1 3.96Å; N328-Y372 HydrophobicContact CB-CE2 3.8Å; N328-Y372 HydrophobicContact CB-CG 4.05Å; N328-Y411 WeakPolarHBondContact CB-OH 3.43Å; N328-Y411 PolarHBondContact O-OH 3.48Å; N328-Y411 VanDerWaalsContact O-OH 3.06Å
329	R	93.1	Very high	91.8	Very high	5 Å²	5	25 Å²	25	2%	0.019	12%	0.124	C	C	.	.	H	α-helix	trans	-50	-27.2	179.5	-61.9	161.7	174.6	80.4	-2.6	114.6	S324 I327 L332 V333 V343 S344 P518 L519	S324-R329 PolarHBondContact O-NH1 2.81Å; S324-R329 PolarHBondContact O-NH2 3.18Å; S324-R329 PolarHBondContact OG-NH2 2.86Å; I327-R329 VanDerWaalsContact C-N 3.31Å; I327-R329 HydrophobicContact CG2-CG 4.21Å; I327-R329 PolarHBondContact O-N 2.56Å; I327-R329 PolarHBondContact O-NH1 3.02Å; R329-L332 PolarHBondContact O-N 3.48Å; R329-V333 PolarHBondContact O-N 2.96Å; R329-V333 VanDerWaalsContact O-N 3.09Å; R329-V343 HydrophobicContact CB-CG1 3.76Å; R329-V343 HydrophobicContact CB-CG2 4.3Å; R329-S344 WeakPolarHBondContact CD-O 3.44Å; R329-S344 PolarHBondContact NE-O 3.21Å; R329-P518 PolarHBondContact NE-O 2.92Å; R329-P518 PolarHBondContact NH2-O 3.21Å; R329-L519 WeakPolarHBondContact CG-O 3.11Å
330	K	90.7	Very high	91.3	Very high	140 Å²	140	26.9 Å²	26.9	61%	0.609	14%	0.144	S	C	*	.	H	α-helix	trans	-69.7	-38.2	175.2	-77.3	-174.7	172.1	-171.4	0	112.9	N328 N334 V343	N328-K330 PolarHBondContact O-N 3.37Å; N328-K330 PolarHBondContact OD1-N 3.18Å; K330-N334 VanDerWaalsContact O-CB 3.22Å; K330-N334 WeakPolarHBondContact O-CB 3.41Å; K330-N334 VanDerWaalsContact O-CG 3.32Å; K330-N334 PolarHBondContact O-N 3.42Å; K330-N334 VanDerWaalsContact O-N 3.13Å; K330-N334 PolarHBondContact O-ND2 2.59Å; K330-V343 HydrophobicContact CB-CG2 4.5Å; K330-V343 HydrophobicContact CG-CG2 3.9Å
331	S	90.4	Very high	91.2	Very high	24 Å²	24	26.8 Å²	26.8	17%	0.168	14%	0.144	C	C	.	.	H	α-helix	trans	-67.8	-43.6	171.7	-82.7	0	0	0	0	110.5	N328 V333 N334 Q335 V336 Y411	N328-S331 PolarHBondContact ND2-OG 3.2Å; N328-S331 WeakPolarHBondContact O-CB 3.11Å; N328-S331 PolarHBondContact O-N 3.24Å; S331-V333 PolarHBondContact O-N 3.02Å; S331-N334 PolarHBondContact O-N 2.55Å; S331-Q335 WeakPolarHBondContact O-CA 3.26Å; S331-Q335 VanDerWaalsContact O-CB 3.3Å; S331-Q335 WeakPolarHBondContact O-CB 3.27Å; S331-Q335 PolarHBondContact O-N 2.98Å; S331-Q335 PolarHBondContact OG-OE1 3.29Å; S331-V336 PolarHBondContact O-N 2.63Å; S331-Y411 WeakPolarHBondContact CB-OH 3.48Å
332	L	92.2	Very high	91	Very high	0 Å²	0	27.4 Å²	27.4	0%	0	15%	0.15	C	C	.	.	I	π-helix	trans	-53	-52.7	177.6	-175.5	52.3	0	0	0	112.2	N328 R329 V336 L337 V408 Y411 L519 Y520	N328-L332 PolarHBondContact O-N 3.14Å; R329-L332 PolarHBondContact O-N 3.48Å; L332-V336 HydrophobicContact CD1-CB 4Å; L332-V336 HydrophobicContact CD1-CG1 3.89Å; L332-V336 WeakPolarHBondContact O-CB 3.39Å; L332-V336 PolarHBondContact O-N 3.13Å; L332-L337 HydrophobicContact CG-CD1 4.45Å; L332-L337 PolarHBondContact O-N 2.95Å; L332-V408 HydrophobicContact CD1-CB 4.39Å; L332-V408 HydrophobicContact CD1-CG1 4.3Å; L332-V408 HydrophobicContact CD1-CG2 4.05Å; L332-V408 HydrophobicContact CD2-CG1 4.38Å; L332-Y411 HydrophobicContact CB-CD1 4.19Å; L332-Y411 HydrophobicContact CB-CE1 3.85Å; L332-Y411 HydrophobicContact CD1-CD1 3.73Å; L332-Y411 HydrophobicContact CD1-CE1 4.28Å; L332-Y411 HydrophobicContact CD1-CG 4.3Å; L332-Y411 HydrophobicContact CG-CD1 4.38Å; L332-Y411 HydrophobicContact CG-CE1 4.48Å; L332-L519 HydrophobicContact CD2-CB 3.97Å; L332-L519 HydrophobicContact CD2-CD2 4.45Å; L332-Y520 HydrophobicContact CD2-CD1 3.89Å; L332-Y520 HydrophobicContact CD2-CE1 4.35Å; L332-Y520 HydrophobicContact CG-CD1 4.28Å
333	V	91.6	Very high	90.8	Very high	5 Å²	5	30.2 Å²	30.2	3%	0.03	17%	0.167	C	C	.	.	I	π-helix	trans	-74.2	-39.9	-179.9	-57.3	0	0	0	0	113.9	R329 S331 L337 G338 S341 V343 Y520	R329-V333 PolarHBondContact O-N 2.96Å; R329-V333 VanDerWaalsContact O-N 3.09Å; S331-V333 PolarHBondContact O-N 3.02Å; V333-L337 HydrophobicContact CG1-CD1 4.41Å; V333-G338 PolarHBondContact O-N 3.38Å; V333-S341 WeakPolarHBondContact CB-O 3.34Å; V333-V343 HydrophobicContact CG2-CG2 3.67Å; V333-Y520 VanDerWaalsContact CG1-CB 3.49Å; V333-Y520 HydrophobicContact CG1-CG 4.37Å
334	N	87	Confident	90.6	Very high	104 Å²	104	30.6 Å²	30.6	56%	0.556	17%	0.17	S	C	*	.	I	π-helix	trans	-87.3	-18.7	-171.4	-65.6	-27.7	0	0	0	114.9	Q284 K330 S331	Q284-N334 PolarHBondContact NE2-O 3.28Å; K330-N334 VanDerWaalsContact O-CB 3.22Å; K330-N334 WeakPolarHBondContact O-CB 3.41Å; K330-N334 VanDerWaalsContact O-CG 3.32Å; K330-N334 PolarHBondContact O-N 3.42Å; K330-N334 VanDerWaalsContact O-N 3.13Å; K330-N334 PolarHBondContact O-ND2 2.59Å; S331-N334 PolarHBondContact O-N 2.55Å
335	Q	84.3	Confident	90.2	Very high	122 Å²	122	31.9 Å²	31.9	57%	0.57	18%	0.178	S	C	*	.	I	π-helix	trans	-122.8	-37.7	-173	-57.3	178.2	-58.5	0	0	112.1	S331	S331-Q335 WeakPolarHBondContact O-CA 3.26Å; S331-Q335 VanDerWaalsContact O-CB 3.3Å; S331-Q335 WeakPolarHBondContact O-CB 3.27Å; S331-Q335 PolarHBondContact O-N 2.98Å; S331-Q335 PolarHBondContact OG-OE1 3.29Å
336	V	86.8	Confident	89.8	Confident	7 Å²	7	31 Å²	31	4%	0.042	18%	0.176	C	C	.	.	I	π-helix	trans	-93.2	-49.3	-174	179.5	0	0	0	0	110.8	S331 L332 K407 Y411	S331-V336 PolarHBondContact O-N 2.63Å; L332-V336 HydrophobicContact CD1-CB 4Å; L332-V336 HydrophobicContact CD1-CG1 3.89Å; L332-V336 WeakPolarHBondContact O-CB 3.39Å; L332-V336 PolarHBondContact O-N 3.13Å; V336-K407 HydrophobicContact CG1-CB 3.55Å; V336-K407 VanDerWaalsContact CG1-O 3.3Å; V336-K407 WeakPolarHBondContact CG1-O 3.33Å; V336-K407 VanDerWaalsContact O-CD 3.26Å; V336-K407 WeakPolarHBondContact O-CD 3.24Å; V336-Y411 HydrophobicContact CG2-CD2 3.56Å; V336-Y411 HydrophobicContact CG2-CE2 4.16Å; V336-Y411 HydrophobicContact CG2-CG 3.81Å
337	L	88.8	Confident	89.6	Confident	0 Å²	0	31 Å²	31	0%	0	18%	0.176	C	C	.	.	I	π-helix	trans	-83.7	-52.3	178.5	-69.6	172.6	0	0	0	113.1	G280 L332 V333 D339 V408 Y520	G280-L337 WeakPolarHBondContact CA-O 3.25Å; G280-L337 PolarHBondContact N-O 3.31Å; L332-L337 HydrophobicContact CG-CD1 4.45Å; L332-L337 PolarHBondContact O-N 2.95Å; V333-L337 HydrophobicContact CG1-CD1 4.41Å; L337-D339 PolarHBondContact O-N 2.84Å; L337-V408 HydrophobicContact CD2-CG2 3.84Å; L337-V408 HydrophobicContact CG-CG2 4.4Å; L337-Y520 HydrophobicContact CD1-CD1 3.71Å; L337-Y520 HydrophobicContact CD1-CD2 3.65Å; L337-Y520 HydrophobicContact CD1-CE1 3.77Å; L337-Y520 HydrophobicContact CD1-CE2 3.67Å; L337-Y520 HydrophobicContact CD1-CG 3.68Å
338	G	86.5	Confident	89.4	Confident	12 Å²	12	31.1 Å²	31.1	12%	0.124	18%	0.177	C	C	.	.			trans	65.2	2.6	172.2	0	0	0	0	0	117.1	V333	V333-G338 PolarHBondContact O-N 3.38Å
339	D	88	Confident	89.3	Confident	5 Å²	5	29.3 Å²	29.3	3%	0.027	17%	0.167	C	C	.	.	S	Bend	trans	-88.8	-15	-170.7	51.5	19.6	0	0	0	114.6	Y292 S294 L337 S341 S523 A525	Y292-D339 PolarHBondContact OH-O 3.03Å; S294-D339 WeakPolarHBondContact CB-O 3.4Å; S294-D339 PolarHBondContact OG-O 3.21Å; L337-D339 PolarHBondContact O-N 2.84Å; D339-S341 VanDerWaalsContact CG-OG 3.29Å; D339-S341 WeakPolarHBondContact OD1-CB 3.18Å; D339-S341 PolarHBondContact OD1-N 3.39Å; D339-S341 PolarHBondContact OD1-OG 2.94Å; D339-S341 PolarHBondContact OD2-OG 3.09Å; D339-S523 VanDerWaalsContact CB-O 3.32Å; D339-S523 WeakPolarHBondContact CB-O 3.47Å; D339-A525 HydrophobicContact CB-CB 3.73Å
340	G	86.9	Confident	89	Confident	39 Å²	39	31 Å²	31	40%	0.402	18%	0.18	S	C	.	.	S	Bend	trans	109.9	0.6	-174.1	0	0	0	0	0	114	S523	G340-S523 WeakPolarHBondContact O-CB 3.43Å
341	S	92.9	Very high	88.8	Confident	6 Å²	6	27.8 Å²	27.8	4%	0.042	19%	0.187	C	C	.	.			trans	-50.2	147	169.8	-65.6	0	0	0	0	110.9	V333 D339 Q521 S523	V333-S341 WeakPolarHBondContact CB-O 3.34Å; D339-S341 VanDerWaalsContact CG-OG 3.29Å; D339-S341 WeakPolarHBondContact OD1-CB 3.18Å; D339-S341 PolarHBondContact OD1-N 3.39Å; D339-S341 PolarHBondContact OD1-OG 2.94Å; D339-S341 PolarHBondContact OD2-OG 3.09Å; S341-Q521 CarbonylContact C-O 3.55Å; S341-Q521 VanDerWaalsContact CA-O 3.32Å; S341-Q521 WeakPolarHBondContact CA-O 3.33Å; S341-Q521 WeakPolarHBondContact CB-O 3.2Å; S341-S523 PolarHBondContact OG-N 3.26Å
342	V	90.9	Very high	88.4	Confident	41 Å²	41	27.9 Å²	27.9	25%	0.248	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	148.6	-176.8	-60.8	0	0	0	0	111.8	S344 Y520 Q521	V342-S344 PolarHBondContact O-N 3.47Å; V342-Y520 CarbonylContact O-C 3.5Å; V342-Y520 VanDerWaalsContact O-CA 3.29Å; V342-Y520 WeakPolarHBondContact O-CA 3.46Å; V342-Y520 WeakPolarHBondContact O-CB 3.31Å; V342-Q521 HydrophobicContact CG2-CB 3.79Å; V342-Q521 HydrophobicContact CG2-CG 4.25Å; V342-Q521 PolarHBondContact N-O 3.38Å; V342-Q521 PolarHBondContact O-N 3.46Å
343	V	90.9	Very high	88	Confident	59 Å²	59	28.4 Å²	28.4	36%	0.358	19%	0.188	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.4	121	179.2	173.4	0	0	0	0	110	R329 K330 V333 T345	R329-V343 HydrophobicContact CB-CG1 3.76Å; R329-V343 HydrophobicContact CB-CG2 4.3Å; K330-V343 HydrophobicContact CB-CG2 4.5Å; K330-V343 HydrophobicContact CG-CG2 3.9Å; V333-V343 HydrophobicContact CG2-CG2 3.67Å; V343-T345 HydrophobicContact CG1-CG2 4.02Å
344	S	90.3	Very high	87.7	Confident	9 Å²	9	33.4 Å²	33.4	6%	0.063	21%	0.21	C	C	.	.			trans	-105.8	132.5	169.9	-172	0	0	0	0	110.4	R329 V342 G346	R329-S344 WeakPolarHBondContact CD-O 3.44Å; R329-S344 PolarHBondContact NE-O 3.21Å; V342-S344 PolarHBondContact O-N 3.47Å; S344-G346 PolarHBondContact OG-O 2.97Å
345	T	84.8	Confident	87.4	Confident	27 Å²	27	29.3 Å²	29.3	17%	0.166	19%	0.188	C	C	.	.			trans	-123.3	13.3	178.3	52.4	0	0	0	0	112.7	V343 L369 A370	V343-T345 HydrophobicContact CG1-CG2 4.02Å; T345-L369 WeakPolarHBondContact O-CB 3.39Å; T345-L369 PolarHBondContact O-N 2.98Å; T345-A370 WeakPolarHBondContact CG2-O 3.44Å; T345-A370 PolarHBondContact O-N 3.39Å
346	G	87.1	Confident	87	Confident	7 Å²	7	26.8 Å²	26.8	7%	0.072	18%	0.182	C	C	.	.	S	Bend	trans	-147	172.7	175.4	0	0	0	0	0	109.5	S344 P518	S344-G346 PolarHBondContact OG-O 2.97Å; G346-P518 VanDerWaalsContact C-CG 3.44Å; G346-P518 WeakPolarHBondContact O-CB 3.46Å; G346-P518 VanDerWaalsContact O-CG 3.25Å; G346-P518 WeakPolarHBondContact O-CG 3.32Å
347	L	89.3	Confident	86.5	Confident	0 Å²	0	33.1 Å²	33.1	0%	0	21%	0.209	C	C	.	.	S	Bend	trans	-71.8	-45.5	-177.8	-178.8	66.2	0	0	0	111.4	T300 Y302 F461 F465 N507 I510 V516	T300-L347 VanDerWaalsContact CB-O 3.23Å; T300-L347 WeakPolarHBondContact CB-O 3.27Å; T300-L347 PolarHBondContact OG1-O 3.23Å; Y302-L347 HydrophobicContact CD1-CD1 4.05Å; Y302-L347 HydrophobicContact CE1-CD1 3.93Å; L347-F461 HydrophobicContact CD1-CD1 4.28Å; L347-F461 HydrophobicContact CD2-CB 3.95Å; L347-F461 WeakPolarHBondContact CD2-O 3.46Å; L347-F461 HydrophobicContact CG-CB 4Å; L347-F461 HydrophobicContact CG-CD1 4.01Å; L347-F461 HydrophobicContact CG-CG 4.43Å; L347-F461 WeakPolarHBondContact O-CD1 3.4Å; L347-F465 HydrophobicContact CD1-CD2 4.47Å; L347-F465 HydrophobicContact CD1-CE2 3.77Å; L347-F465 HydrophobicContact CD2-CD2 3.67Å; L347-F465 HydrophobicContact CD2-CE2 3.8Å; L347-F465 HydrophobicContact CG-CE2 4.45Å; L347-N507 PolarHBondContact N-OD1 3.38Å; L347-I510 HydrophobicContact CB-CG2 4.33Å; L347-I510 HydrophobicContact CD2-CD1 4.39Å; L347-I510 HydrophobicContact CD2-CG2 4.36Å; L347-V516 HydrophobicContact CD1-CG2 3.98Å
348	V	91.1	Very high	86.3	Confident	2 Å²	2	36.8 Å²	36.8	1%	0.012	23%	0.231	C	C	.	.	S	Bend	trans	-76.5	130.8	-176.6	-175.1	0	0	0	0	110.8	M352 F362 P458 F461 N507	V348-M352 HydrophobicContact CG1-CE 3.69Å; V348-F362 HydrophobicContact CB-CD1 3.58Å; V348-F362 HydrophobicContact CB-CE1 3.61Å; V348-F362 HydrophobicContact CG1-CD1 3.53Å; V348-F362 HydrophobicContact CG1-CE1 3.96Å; V348-F362 HydrophobicContact CG1-CG 4.21Å; V348-F362 HydrophobicContact CG2-CD1 3.93Å; V348-F362 HydrophobicContact CG2-CE1 3.44Å; V348-F362 VanDerWaalsContact CG2-CE1 3.44Å; V348-F362 HydrophobicContact CG2-CZ 4.19Å; V348-P458 HydrophobicContact CG1-CB 4.28Å; V348-P458 HydrophobicContact CG2-CB 4.19Å; V348-F461 HydrophobicContact CG2-CB 4.01Å; V348-F461 HydrophobicContact CG2-CG 4.45Å; V348-N507 HydrophobicContact CG2-CB 4.42Å
349	P	90.8	Very high	86.1	Confident	1 Å²	1	41.4 Å²	41.4	1%	0.006	25%	0.253	C	S	.	.	P	Polyproline II helix	trans	-76.6	160.6	-178.7	31.2	-36	0	0	0	112.9	A298 M352 F461 Q521	A298-P349 HydrophobicContact CB-CG 4.09Å; P349-M352 HydrophobicContact CG-CB 4.43Å; P349-M352 HydrophobicContact CG-SD 4.06Å; P349-F461 HydrophobicContact CG-CE1 4.45Å; P349-F461 HydrophobicContact CG-CE2 3.61Å; P349-F461 HydrophobicContact CG-CZ 3.59Å; P349-Q521 HydrophobicContact CB-CB 4.46Å; P349-Q521 HydrophobicContact CB-CG 3.93Å
350	S	88.4	Confident	86	Confident	42 Å²	42	44.8 Å²	44.8	29%	0.294	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.1	145.4	178.9	70.9	0	0	0	0	113.1	Q521	S350-Q521 PolarHBondContact O-NE2 2.9Å; S350-Q521 PolarHBondContact O-OE1 3.43Å; S350-Q521 PolarHBondContact OG-OE1 3.35Å
351	G	85	Confident	86.1	Confident	72 Å²	72	44.1 Å²	44.1	74%	0.742	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	85	4.7	177.9	0	0	0	0	0	115	D361	G351-D361 WeakPolarHBondContact CA-OD2 3.44Å; G351-D361 PolarHBondContact N-OD2 2.99Å
352	M	83.5	Confident	86	Confident	25 Å²	25	43.8 Å²	43.8	12%	0.123	25%	0.254	C	S	.	.	S	Bend	trans	-89.2	-50.1	-175.2	-174.3	-176.6	77.1	0	0	113.2	A298 V348 P349 A453 A456 D457 F461	A298-M352 HydrophobicContact CB-CB 4.09Å; A298-M352 HydrophobicContact CB-CG 3.93Å; A298-M352 HydrophobicContact CB-SD 3.98Å; V348-M352 HydrophobicContact CG1-CE 3.69Å; P349-M352 HydrophobicContact CG-CB 4.43Å; P349-M352 HydrophobicContact CG-SD 4.06Å; M352-A453 HydrophobicContact SD-CB 3.39Å; M352-A453 WeakPolarHBondContact SD-CB 3.43Å; M352-A456 HydrophobicContact CG-CB 4.43Å; M352-D457 VanDerWaalsContact CE-C 3.46Å; M352-D457 WeakPolarHBondContact CE-O 3.38Å; M352-F461 HydrophobicContact CE-CD2 4.04Å; M352-F461 HydrophobicContact CE-CE2 4.12Å; M352-F461 HydrophobicContact SD-CD2 4.25Å; M352-F461 HydrophobicContact SD-CE2 3.74Å
353	S	83.8	Confident	85.8	Confident	11 Å²	11	43 Å²	43	8%	0.077	25%	0.252	C	S	.	.			trans	-139.4	146.1	-171.5	-48.7	0	0	0	0	110.5	F362 A456 D457 P458	S353-F362 PolarHBondContact O-N 2.87Å; S353-A456 PolarHBondContact OG-O 3.35Å; S353-D457 WeakPolarHBondContact OG-CA 3.09Å; S353-P458 WeakPolarHBondContact OG-CD 3.27Å
354	K	84.2	Confident	85.6	Confident	111 Å²	111	46.5 Å²	46.5	48%	0.483	26%	0.262	S	S	.	.	B	Isolated β-bridge	trans	-125.1	148.5	-176.2	-68.7	-173	174.1	-166.3	0	112.6	D359 E360 W500	K354-D359 WeakPolarHBondContact CD-O 3.49Å; K354-D359 WeakPolarHBondContact CD-OD1 3.44Å; K354-D359 IonicContact NZ-OD1 3.99Å; K354-D359 PolarHBondContact NZ-OD1 3.22Å; K354-D359 IonicContact NZ-OD2 2.75Å; K354-D359 PolarHBondContact NZ-OD2 2.97Å; K354-E360 CarbonylContact C-O 3.6Å; K354-E360 VanDerWaalsContact CA-O 3.26Å; K354-E360 WeakPolarHBondContact CA-O 3.33Å; K354-W500 VanDerWaalsContact C-CZ3 3.42Å; K354-W500 WeakPolarHBondContact O-CH2 3.39Å; K354-W500 VanDerWaalsContact O-CZ3 3.3Å; K354-W500 WeakPolarHBondContact O-CZ3 3.09Å
355	N	81.9	Confident	85.4	Confident	18 Å²	18	49.9 Å²	49.9	10%	0.096	28%	0.277	C	S	.	.			trans	-62.3	120.6	173.8	179	-43.8	0	0	0	109	K357 T358 D359 E360 E365 W500	N355-K357 PolarHBondContact O-N 2.93Å; N355-K357 VanDerWaalsContact O-N 3.08Å; N355-K357 PolarHBondContact OD1-N 3.48Å; N355-T358 WeakPolarHBondContact CB-OG1 3.34Å; N355-T358 PolarHBondContact ND2-OG1 3.23Å; N355-T358 PolarHBondContact O-N 2.82Å; N355-T358 PolarHBondContact OD1-N 2.93Å; N355-T358 VanDerWaalsContact OD1-N 3.1Å; N355-T358 PolarHBondContact OD1-OG1 3.11Å; N355-D359 WeakPolarHBondContact O-CA 3.39Å; N355-D359 PolarHBondContact O-N 2.77Å; N355-E360 PolarHBondContact N-O 3.43Å; N355-E365 PolarHBondContact ND2-OE1 2.75Å; N355-E365 VanDerWaalsContact ND2-OE1 3.17Å; N355-E365 PolarHBondContact ND2-OE2 3.06Å; N355-E365 VanDerWaalsContact ND2-OE2 3.15Å; N355-W500 VanDerWaalsContact CA-CZ2 3.46Å; N355-W500 HydrophobicContact CB-CD2 4.35Å; N355-W500 HydrophobicContact CB-CH2 4.24Å; N355-W500 HydrophobicContact CB-CZ2 3.55Å; N355-W500 PolarHBondContact ND2-NE1 3.47Å
356	P	74.4	Confident	85.3	Confident	69 Å²	69	49.6 Å²	49.6	45%	0.448	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.1	-13.2	-170.4	21.6	-29.4	0	0	0	114.3	E496	P356-E496 HydrophobicContact CG-CB 3.88Å
357	K	77.3	Confident	85	Confident	139 Å²	139	50.9 Å²	50.9	60%	0.604	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.5	-34.9	174.4	-68	-165.4	-174.8	177.7	0	114.6	N355 E497	N355-K357 PolarHBondContact O-N 2.93Å; N355-K357 VanDerWaalsContact O-N 3.08Å; N355-K357 PolarHBondContact OD1-N 3.48Å; K357-E497 HydrophobicContact CD-CG 4.17Å; K357-E497 VanDerWaalsContact CD-OE1 3.3Å; K357-E497 WeakPolarHBondContact CD-OE1 3.38Å; K357-E497 VanDerWaalsContact CE-OE1 3.25Å; K357-E497 WeakPolarHBondContact CE-OE1 3.45Å; K357-E497 WeakPolarHBondContact CE-OE2 3.47Å; K357-E497 IonicContact NZ-OE1 2.68Å; K357-E497 PolarHBondContact NZ-OE1 2.78Å; K357-E497 IonicContact NZ-OE2 3.95Å; K357-E497 PolarHBondContact NZ-OE2 3.19Å
358	T	84.1	Confident	84.5	Confident	77 Å²	77	59.3 Å²	59.3	47%	0.472	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.6	-13.8	-175	68.7	0	0	0	0	114	N355 E360	N355-T358 WeakPolarHBondContact CB-OG1 3.34Å; N355-T358 PolarHBondContact ND2-OG1 3.23Å; N355-T358 PolarHBondContact O-N 2.82Å; N355-T358 PolarHBondContact OD1-N 2.93Å; N355-T358 VanDerWaalsContact OD1-N 3.1Å; N355-T358 PolarHBondContact OD1-OG1 3.11Å; T358-E360 PolarHBondContact O-N 3.06Å; T358-E360 VanDerWaalsContact O-N 3.16Å; T358-E360 WeakPolarHBondContact OG1-CB 3.32Å; T358-E360 WeakPolarHBondContact OG1-CG 3.5Å; T358-E360 PolarHBondContact OG1-N 3.47Å
359	D	82.7	Confident	84	Confident	109 Å²	109	60 Å²	60	58%	0.583	33%	0.331	S	S	*	.			trans	58.7	13.1	-170.7	-166.6	67.4	0	0	0	113.5	K354 N355	K354-D359 WeakPolarHBondContact CD-O 3.49Å; K354-D359 WeakPolarHBondContact CD-OD1 3.44Å; K354-D359 IonicContact NZ-OD1 3.99Å; K354-D359 PolarHBondContact NZ-OD1 3.22Å; K354-D359 IonicContact NZ-OD2 2.75Å; K354-D359 PolarHBondContact NZ-OD2 2.97Å; N355-D359 WeakPolarHBondContact O-CA 3.39Å; N355-D359 PolarHBondContact O-N 2.77Å
360	E	86.6	Confident	83.5	Confident	76 Å²	76	60 Å²	60	36%	0.355	33%	0.33	S	S	.	.			trans	-77.7	144.4	174.4	-58.8	-127.6	103.1	0	0	111.3	K354 N355 T358 K364	K354-E360 CarbonylContact C-O 3.6Å; K354-E360 VanDerWaalsContact CA-O 3.26Å; K354-E360 WeakPolarHBondContact CA-O 3.33Å; N355-E360 PolarHBondContact N-O 3.43Å; T358-E360 PolarHBondContact O-N 3.06Å; T358-E360 VanDerWaalsContact O-N 3.16Å; T358-E360 WeakPolarHBondContact OG1-CB 3.32Å; T358-E360 WeakPolarHBondContact OG1-CG 3.5Å; T358-E360 PolarHBondContact OG1-N 3.47Å; E360-K364 IonicContact OE1-NZ 3.98Å; E360-K364 PolarHBondContact OE1-NZ 3.27Å
361	D	89	Confident	83.3	Confident	25 Å²	25	59.9 Å²	59.9	13%	0.134	33%	0.329	C	S	.	.	B	Isolated β-bridge	trans	-70.7	138.8	177.8	168.6	-102.6	0	0	0	112	G351 A363 K364 E365	G351-D361 WeakPolarHBondContact CA-OD2 3.44Å; G351-D361 PolarHBondContact N-OD2 2.99Å; D361-A363 PolarHBondContact O-N 3.35Å; D361-A363 PolarHBondContact OD1-N 2.93Å; D361-K364 HydrophobicContact CB-CB 3.85Å; D361-K364 WeakPolarHBondContact O-CB 3.25Å; D361-K364 PolarHBondContact O-N 2.81Å; D361-K364 VanDerWaalsContact O-N 3.14Å; D361-K364 PolarHBondContact OD1-N 2.72Å; D361-E365 PolarHBondContact O-N 2.91Å
362	F	89.1	Confident	83.6	Confident	0 Å²	0	61.5 Å²	61.5	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-54.3	-49.2	-176.8	-173.5	-86.2	0	0	0	112.9	V348 S353 K364 E365 A366 P458 W500 L503 Q504 N507	V348-F362 HydrophobicContact CB-CD1 3.58Å; V348-F362 HydrophobicContact CB-CE1 3.61Å; V348-F362 HydrophobicContact CG1-CD1 3.53Å; V348-F362 HydrophobicContact CG1-CE1 3.96Å; V348-F362 HydrophobicContact CG1-CG 4.21Å; V348-F362 HydrophobicContact CG2-CD1 3.93Å; V348-F362 HydrophobicContact CG2-CE1 3.44Å; V348-F362 VanDerWaalsContact CG2-CE1 3.44Å; V348-F362 HydrophobicContact CG2-CZ 4.19Å; S353-F362 PolarHBondContact O-N 2.87Å; F362-K364 VanDerWaalsContact C-N 3.35Å; F362-E365 PolarHBondContact O-N 3.24Å; F362-A366 WeakPolarHBondContact O-CB 3.43Å; F362-A366 PolarHBondContact O-N 3.2Å; F362-P458 HydrophobicContact CB-CG 4.48Å; F362-P458 HydrophobicContact CD2-CB 4.02Å; F362-P458 HydrophobicContact CD2-CG 3.46Å; F362-P458 VanDerWaalsContact CD2-CG 3.46Å; F362-P458 HydrophobicContact CE1-CB 4.31Å; F362-P458 HydrophobicContact CE2-CB 3.76Å; F362-P458 HydrophobicContact CE2-CG 3.67Å; F362-P458 HydrophobicContact CG-CB 4.41Å; F362-P458 HydrophobicContact CG-CG 3.91Å; F362-P458 HydrophobicContact CZ-CB 3.9Å; F362-P458 HydrophobicContact CZ-CG 4.27Å; F362-W500 HydrophobicContact CB-CH2 3.56Å; F362-W500 HydrophobicContact CB-CZ2 3.84Å; F362-W500 HydrophobicContact CB-CZ3 4.46Å; F362-W500 HydrophobicContact CD2-CD2 4.26Å; F362-W500 AromaticContact CD2-CE2 3.94Å; F362-W500 HydrophobicContact CD2-CE3 4.2Å; F362-W500 AromaticContact CD2-CH2 3.55Å; F362-W500 HydrophobicContact CD2-CH2 3.55Å; F362-W500 AromaticContact CD2-CZ2 3.6Å; F362-W500 HydrophobicContact CD2-CZ2 3.6Å; F362-W500 AromaticContact CD2-CZ3 3.86Å; F362-W500 HydrophobicContact CD2-CZ3 3.86Å; F362-W500 HydrophobicContact CG-CH2 4.04Å; F362-W500 HydrophobicContact CG-CZ2 4.15Å; F362-L503 HydrophobicContact CE2-CB 3.91Å; F362-L503 HydrophobicContact CZ-CB 4.17Å; F362-Q504 HydrophobicContact CD2-CG 4.19Å; F362-Q504 HydrophobicContact CE2-CB 4.48Å; F362-Q504 HydrophobicContact CE2-CG 3.67Å; F362-Q504 HydrophobicContact CZ-CG 4.07Å; F362-Q504 PolarHBondContact O-NE2 2.93Å; F362-N507 HydrophobicContact CE1-CB 3.84Å; F362-N507 WeakPolarHBondContact CE1-ND2 3.29Å; F362-N507 HydrophobicContact CZ-CB 3.98Å
363	A	88.5	Confident	84.1	Confident	25 Å²	25	62.7 Å²	62.7	21%	0.207	32%	0.32	C	S	.	.	H	α-helix	trans	-71.8	-29.9	-178.3	0	0	0	0	0	112.3	D361 G367	D361-A363 PolarHBondContact O-N 3.35Å; D361-A363 PolarHBondContact OD1-N 2.93Å; A363-G367 PolarHBondContact O-N 3.37Å
364	K	85.7	Confident	84.4	Confident	132 Å²	132	64.7 Å²	64.7	57%	0.574	33%	0.327	S	S	*	.	H	α-helix	trans	-65.8	-45.2	171.4	-173.3	-160.3	175.8	-166.1	0	112	E360 D361 F362 G367	E360-K364 IonicContact OE1-NZ 3.98Å; E360-K364 PolarHBondContact OE1-NZ 3.27Å; D361-K364 HydrophobicContact CB-CB 3.85Å; D361-K364 WeakPolarHBondContact O-CB 3.25Å; D361-K364 PolarHBondContact O-N 2.81Å; D361-K364 VanDerWaalsContact O-N 3.14Å; D361-K364 PolarHBondContact OD1-N 2.72Å; F362-K364 VanDerWaalsContact C-N 3.35Å; K364-G367 PolarHBondContact O-N 2.85Å
365	E	86.4	Confident	84.8	Confident	80 Å²	80	64.9 Å²	64.9	37%	0.374	33%	0.33	S	S	.	.	H	α-helix	trans	-69.2	-38.1	178.9	-174.7	171.3	-151.1	0	0	111.5	N355 D361 F362 G367 W500	N355-E365 PolarHBondContact ND2-OE1 2.75Å; N355-E365 VanDerWaalsContact ND2-OE1 3.17Å; N355-E365 PolarHBondContact ND2-OE2 3.06Å; N355-E365 VanDerWaalsContact ND2-OE2 3.15Å; D361-E365 PolarHBondContact O-N 2.91Å; F362-E365 PolarHBondContact O-N 3.24Å; E365-G367 PolarHBondContact O-N 2.99Å; E365-W500 PolarHBondContact OE2-NE1 3.37Å
366	A	83.4	Confident	85.3	Confident	21 Å²	21	68 Å²	68	17%	0.174	34%	0.343	C	S	.	.	H	α-helix	trans	-61.7	-28	172.3	0	0	0	0	0	113.9	F362 L369	F362-A366 WeakPolarHBondContact O-CB 3.43Å; F362-A366 PolarHBondContact O-N 3.2Å; A366-L369 HydrophobicContact CB-CD1 4.18Å; A366-L369 WeakPolarHBondContact O-CD2 3.39Å
367	G	79.8	Confident	86.2	Confident	33 Å²	33	64.8 Å²	64.8	34%	0.34	32%	0.322	S	S	.	.			trans	68.9	-144.4	179.2	0	0	0	0	0	114.4	A363 K364 E365	A363-G367 PolarHBondContact O-N 3.37Å; K364-G367 PolarHBondContact O-N 2.85Å; E365-G367 PolarHBondContact O-N 2.99Å
368	K	78.9	Confident	87	Confident	177 Å²	177	61.3 Å²	61.3	77%	0.77	31%	0.307	S	S	*	.			trans	-106.2	79.3	-170.8	-66.7	-178.8	-174.9	168.1	0	112.1
369	L	81.1	Confident	87.5	Confident	17 Å²	17	62.5 Å²	62.5	9%	0.089	31%	0.307	C	S	.	.	S	Bend	trans	-72.8	-42.4	-174	-54.4	169.8	0	0	0	112.9	T345 A366 P371 N507 E508	T345-L369 WeakPolarHBondContact O-CB 3.39Å; T345-L369 PolarHBondContact O-N 2.98Å; A366-L369 HydrophobicContact CB-CD1 4.18Å; A366-L369 WeakPolarHBondContact O-CD2 3.39Å; L369-P371 WeakPolarHBondContact O-CD 3.22Å; L369-N507 WeakPolarHBondContact CD1-ND2 3.49Å; L369-E508 HydrophobicContact CD2-CB 4.16Å; L369-E508 HydrophobicContact CD2-CG 3.92Å
370	A	80.1	Confident	88.1	Confident	0 Å²	0	59.2 Å²	59.2	0%	0	29%	0.287	C	S	.	.	S	Bend	trans	-110.4	82.4	175.9	0	0	0	0	0	112.4	T345	T345-A370 WeakPolarHBondContact CG2-O 3.44Å; T345-A370 PolarHBondContact O-N 3.39Å
371	P	84.2	Confident	88.6	Confident	41 Å²	41	55.7 Å²	55.7	27%	0.266	27%	0.27	S	S	.	.			trans	-76.8	152.3	178.5	32.3	-36.6	0	0	0	113.3	Y325 L369	Y325-P371 HydrophobicContact CE1-CG 3.84Å; L369-P371 WeakPolarHBondContact O-CD 3.22Å
372	Y	91	Very high	88.8	Confident	106 Å²	106	58 Å²	58	42%	0.416	28%	0.283	S	S	.	.			trans	-79.6	125.4	164.7	167.4	-113.7	0	0	0	110.4	Y325 A326 N328 K374	Y325-Y372 VanDerWaalsContact O-CD2 3.27Å; Y325-Y372 WeakPolarHBondContact O-CD2 3.16Å; A326-Y372 WeakPolarHBondContact O-CD2 3.12Å; A326-Y372 WeakPolarHBondContact O-CE2 3.24Å; N328-Y372 HydrophobicContact CB-CD1 4.08Å; N328-Y372 HydrophobicContact CB-CD2 3.9Å; N328-Y372 HydrophobicContact CB-CE1 3.96Å; N328-Y372 HydrophobicContact CB-CE2 3.8Å; N328-Y372 HydrophobicContact CB-CG 4.05Å; Y372-K374 HydrophobicContact CE2-CB 4.39Å
373	D	93.2	Very high	89.1	Confident	50 Å²	50	61.3 Å²	61.3	27%	0.267	30%	0.297	S	S	.	.			trans	-156.9	99	179.3	-177.1	-26.5	0	0	0	109.1	Y325 E375 K376 A377	Y325-D373 HydrophobicContact CD1-CB 4.1Å; Y325-D373 PolarHBondContact O-N 3.45Å; D373-E375 VanDerWaalsContact C-N 3.26Å; D373-E375 PolarHBondContact O-N 2.88Å; D373-E375 PolarHBondContact OD1-N 3.37Å; D373-K376 HydrophobicContact CB-CB 4.13Å; D373-K376 HydrophobicContact CB-CD 4.33Å; D373-K376 HydrophobicContact CB-CG 4.45Å; D373-K376 PolarHBondContact O-N 2.89Å; D373-K376 PolarHBondContact OD1-N 2.97Å; D373-K376 VanDerWaalsContact OD1-N 3.07Å; D373-K376 WeakPolarHBondContact OD2-CD 3.34Å; D373-K376 WeakPolarHBondContact OD2-CE 3.06Å; D373-K376 WeakPolarHBondContact OD2-CG 3.5Å; D373-K376 IonicContact OD2-NZ 2.69Å; D373-K376 PolarHBondContact OD2-NZ 3.28Å; D373-A377 WeakPolarHBondContact O-CB 3.34Å; D373-A377 PolarHBondContact O-N 2.93Å
374	K	91.8	Very high	89.4	Confident	52 Å²	52	60.1 Å²	60.1	23%	0.226	29%	0.287	C	S	.	.	H	α-helix	trans	-63.7	-27.1	-172.6	-166.5	172.6	178.4	171.8	0	113.3	Y372 K378 D418 T419	Y372-K374 HydrophobicContact CE2-CB 4.39Å; K374-K378 WeakPolarHBondContact O-CG 3.15Å; K374-K378 PolarHBondContact O-N 3.05Å; K374-D418 IonicContact NZ-OD1 3.21Å; K374-D418 PolarHBondContact NZ-OD1 3.36Å; K374-D418 IonicContact NZ-OD2 2.72Å; K374-D418 PolarHBondContact NZ-OD2 3.27Å; K374-T419 HydrophobicContact CD-CG2 4.36Å; K374-T419 VanDerWaalsContact CE-OG1 3.29Å; K374-T419 WeakPolarHBondContact CE-OG1 3.26Å; K374-T419 HydrophobicContact CG-CG2 3.66Å
375	E	92	Very high	89.8	Confident	116 Å²	116	55.6 Å²	55.6	54%	0.542	27%	0.267	S	S	.	.	H	α-helix	trans	-84.5	-37.9	180	-59.6	-48.2	118.8	0	0	111.8	D373 A377 K378 E379	D373-E375 VanDerWaalsContact C-N 3.26Å; D373-E375 PolarHBondContact O-N 2.88Å; D373-E375 PolarHBondContact OD1-N 3.37Å; E375-A377 VanDerWaalsContact C-N 3.3Å; E375-A377 PolarHBondContact O-N 3.22Å; E375-K378 PolarHBondContact O-N 3.5Å; E375-K378 IonicContact OE1-NZ 3.98Å; E375-K378 PolarHBondContact OE1-NZ 2.84Å; E375-K378 IonicContact OE2-NZ 2.68Å; E375-K378 PolarHBondContact OE2-NZ 2.95Å; E375-E379 PolarHBondContact O-N 2.86Å
376	K	92.2	Very high	90	Very high	84 Å²	84	59.5 Å²	59.5	37%	0.365	28%	0.283	S	S	.	.	H	α-helix	trans	-63.9	-35.4	168.4	-75.1	-177	-167.1	153.9	0	112.7	Y325 D373 K378 E379 Y380	Y325-K376 HydrophobicContact CD1-CB 3.86Å; Y325-K376 HydrophobicContact CD1-CD 4.19Å; Y325-K376 HydrophobicContact CE1-CB 4.42Å; Y325-K376 HydrophobicContact CE1-CD 3.97Å; D373-K376 HydrophobicContact CB-CB 4.13Å; D373-K376 HydrophobicContact CB-CD 4.33Å; D373-K376 HydrophobicContact CB-CG 4.45Å; D373-K376 PolarHBondContact O-N 2.89Å; D373-K376 PolarHBondContact OD1-N 2.97Å; D373-K376 VanDerWaalsContact OD1-N 3.07Å; D373-K376 WeakPolarHBondContact OD2-CD 3.34Å; D373-K376 WeakPolarHBondContact OD2-CE 3.06Å; D373-K376 WeakPolarHBondContact OD2-CG 3.5Å; D373-K376 IonicContact OD2-NZ 2.69Å; D373-K376 PolarHBondContact OD2-NZ 3.28Å; K376-K378 VanDerWaalsContact C-N 3.27Å; K376-K378 PolarHBondContact O-N 3.05Å; K376-E379 PolarHBondContact O-N 3.47Å; K376-E379 VanDerWaalsContact O-N 3.15Å; K376-Y380 HydrophobicContact CB-CD2 4.23Å; K376-Y380 HydrophobicContact CB-CE2 4.07Å; K376-Y380 WeakPolarHBondContact O-CB 3.49Å; K376-Y380 WeakPolarHBondContact O-CD2 3.17Å; K376-Y380 PolarHBondContact O-N 3.26Å
377	A	94	Very high	90.5	Very high	0 Å²	0	63.7 Å²	63.7	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-55.5	-44.7	174.9	0	0	0	0	0	111.6	A322 A326 D373 E375 W381 T419 L420	A322-A377 WeakPolarHBondContact CB-O 3.46Å; A326-A377 HydrophobicContact CB-CB 3.97Å; D373-A377 WeakPolarHBondContact O-CB 3.34Å; D373-A377 PolarHBondContact O-N 2.93Å; E375-A377 VanDerWaalsContact C-N 3.3Å; E375-A377 PolarHBondContact O-N 3.22Å; A377-W381 WeakPolarHBondContact O-CB 3.35Å; A377-W381 PolarHBondContact O-N 2.99Å; A377-T419 HydrophobicContact CB-CG2 3.92Å; A377-L420 HydrophobicContact CB-CD2 4.22Å
378	K	94	Very high	91.1	Very high	67 Å²	67	64.9 Å²	64.9	29%	0.291	30%	0.298	S	S	.	.	H	α-helix	trans	-66.2	-44.3	172.9	-62.9	165.1	-174.2	168.4	0	112.6	K374 E375 K376 Y380 W381 D382	K374-K378 WeakPolarHBondContact O-CG 3.15Å; K374-K378 PolarHBondContact O-N 3.05Å; E375-K378 PolarHBondContact O-N 3.5Å; E375-K378 IonicContact OE1-NZ 3.98Å; E375-K378 PolarHBondContact OE1-NZ 2.84Å; E375-K378 IonicContact OE2-NZ 2.68Å; E375-K378 PolarHBondContact OE2-NZ 2.95Å; K376-K378 VanDerWaalsContact C-N 3.27Å; K376-K378 PolarHBondContact O-N 3.05Å; K378-Y380 VanDerWaalsContact C-N 3.29Å; K378-Y380 PolarHBondContact O-N 3.35Å; K378-W381 PolarHBondContact O-N 3.16Å; K378-W381 VanDerWaalsContact O-N 3.13Å; K378-D382 PolarHBondContact O-N 3.45Å
379	E	94.2	Very high	91.7	Very high	102 Å²	102	59.8 Å²	59.8	48%	0.477	30%	0.295	S	S	.	.	H	α-helix	trans	-58.9	-41.2	178.7	-165	-158.8	140	0	0	111.7	E375 K376 K383	E375-E379 PolarHBondContact O-N 2.86Å; K376-E379 PolarHBondContact O-N 3.47Å; K376-E379 VanDerWaalsContact O-N 3.15Å; E379-K383 WeakPolarHBondContact O-CG 3.22Å; E379-K383 PolarHBondContact O-N 3.37Å; E379-K383 VanDerWaalsContact OE1-CE 3.3Å; E379-K383 WeakPolarHBondContact OE1-CE 3.5Å; E379-K383 IonicContact OE1-NZ 3.81Å; E379-K383 PolarHBondContact OE1-NZ 2.85Å
380	Y	95.7	Very high	92.2	Very high	40 Å²	40	61.3 Å²	61.3	16%	0.157	30%	0.303	C	S	.	.	H	α-helix	trans	-69.3	-39.6	174.3	-70.6	-52.6	0	0	0	112	N318 K321 Y325 K376 K378 K383 A384	N318-Y380 HydrophobicContact CB-CD1 4.47Å; N318-Y380 WeakPolarHBondContact CB-O 2.98Å; N318-Y380 WeakPolarHBondContact O-CB 3.29Å; N318-Y380 VanDerWaalsContact OD1-CD1 3.29Å; N318-Y380 WeakPolarHBondContact OD1-CD1 3.36Å; K321-Y380 HydrophobicContact CB-CD1 4.25Å; K321-Y380 HydrophobicContact CB-CD2 3.8Å; K321-Y380 HydrophobicContact CB-CE2 4.14Å; K321-Y380 HydrophobicContact CB-CG 3.87Å; K321-Y380 HydrophobicContact CD-CD1 4.27Å; K321-Y380 HydrophobicContact CD-CE1 3.94Å; K321-Y380 HydrophobicContact CD-CE2 4.4Å; Y325-Y380 HydrophobicContact CD1-CD2 4.46Å; Y325-Y380 HydrophobicContact CD1-CE2 4.01Å; Y325-Y380 HydrophobicContact CE1-CE2 4Å; Y325-Y380 HydrophobicContact CG-CD2 4.47Å; Y325-Y380 HydrophobicContact CG-CE2 4.33Å; K376-Y380 HydrophobicContact CB-CD2 4.23Å; K376-Y380 HydrophobicContact CB-CE2 4.07Å; K376-Y380 WeakPolarHBondContact O-CB 3.49Å; K376-Y380 WeakPolarHBondContact O-CD2 3.17Å; K376-Y380 PolarHBondContact O-N 3.26Å; K378-Y380 VanDerWaalsContact C-N 3.29Å; K378-Y380 PolarHBondContact O-N 3.35Å; Y380-K383 HydrophobicContact CD1-CD 4.45Å; Y380-K383 WeakPolarHBondContact O-CB 3.49Å; Y380-K383 PolarHBondContact O-N 3.48Å; Y380-K383 VanDerWaalsContact O-N 3.17Å; Y380-A384 WeakPolarHBondContact O-CB 3.31Å; Y380-A384 PolarHBondContact O-N 3.36Å
381	W	96.1	Very high	92.5	Very high	1 Å²	1	68.2 Å²	68.2	0%	0.004	34%	0.34	C	S	.	.	H	α-helix	trans	-65.2	-39.7	175.7	179.7	-135.8	0	0	0	113	L319 A322 A377 K378 K383 A384 K385 I390 L393 L420 P421 M423	L319-W381 HydrophobicContact CD1-CE3 4.03Å; L319-W381 HydrophobicContact CD1-CZ3 3.85Å; A322-W381 HydrophobicContact CB-CB 3.93Å; A377-W381 WeakPolarHBondContact O-CB 3.35Å; A377-W381 PolarHBondContact O-N 2.99Å; K378-W381 PolarHBondContact O-N 3.16Å; K378-W381 VanDerWaalsContact O-N 3.13Å; W381-K383 PolarHBondContact O-N 3.24Å; W381-A384 HydrophobicContact CE3-CB 4.06Å; W381-A384 HydrophobicContact CZ3-CB 4.47Å; W381-A384 PolarHBondContact O-N 3.13Å; W381-K385 HydrophobicContact CD2-CD 4.08Å; W381-K385 HydrophobicContact CD2-CG 3.92Å; W381-K385 HydrophobicContact CE3-CG 3.97Å; W381-K385 HydrophobicContact CH2-CD 4.2Å; W381-K385 HydrophobicContact CH2-CG 3.7Å; W381-K385 HydrophobicContact CZ2-CD 3.65Å; W381-K385 HydrophobicContact CZ2-CG 3.69Å; W381-K385 HydrophobicContact CZ3-CG 3.84Å; W381-K385 WeakPolarHBondContact O-CB 3.31Å; W381-K385 WeakPolarHBondContact O-CE 3.28Å; W381-K385 WeakPolarHBondContact O-CG 3.47Å; W381-K385 PolarHBondContact O-N 2.96Å; W381-I390 HydrophobicContact CH2-CD1 4.49Å; W381-L393 HydrophobicContact CH2-CB 3.82Å; W381-L393 HydrophobicContact CH2-CD2 4.42Å; W381-L393 HydrophobicContact CZ3-CD2 4.41Å; W381-L420 HydrophobicContact CB-CD2 3.85Å; W381-L420 HydrophobicContact CG-CB 4.21Å; W381-L420 HydrophobicContact CG-CD2 4.13Å; W381-P421 PolarHBondContact NE1-O 3.32Å; W381-M423 HydrophobicContact CD2-CE 4.1Å; W381-M423 HydrophobicContact CE3-CE 3.87Å; W381-M423 HydrophobicContact CH2-CE 3.7Å; W381-M423 HydrophobicContact CZ2-CE 3.87Å; W381-M423 HydrophobicContact CZ3-CE 3.69Å
382	D	93.7	Very high	92.8	Very high	74 Å²	74	73.7 Å²	73.7	40%	0.396	36%	0.362	S	S	.	.	H	α-helix	trans	-71.1	-14.3	174.3	-81.4	-11.9	0	0	0	113.7	K378 K385 K386	K378-D382 PolarHBondContact O-N 3.45Å; D382-K385 WeakPolarHBondContact OD1-CE 3.22Å; D382-K385 IonicContact OD1-NZ 3.8Å; D382-K385 PolarHBondContact OD1-NZ 3.45Å; D382-K386 WeakPolarHBondContact O-CD 3.44Å; D382-K386 WeakPolarHBondContact O-CE 3.18Å; D382-K386 VanDerWaalsContact O-CG 3.31Å; D382-K386 WeakPolarHBondContact O-CG 3.34Å; D382-K386 PolarHBondContact O-NZ 3.46Å
383	K	95.2	Very high	93	Very high	69 Å²	69	69.7 Å²	69.7	30%	0.3	35%	0.347	S	S	.	.	H	α-helix	trans	-83.4	-51.1	165.1	-70.2	166.9	-170.3	168.6	0	110.5	N318 E379 Y380 W381 K385 K386 E387	N318-K383 HydrophobicContact CB-CB 4.1Å; E379-K383 WeakPolarHBondContact O-CG 3.22Å; E379-K383 PolarHBondContact O-N 3.37Å; E379-K383 VanDerWaalsContact OE1-CE 3.3Å; E379-K383 WeakPolarHBondContact OE1-CE 3.5Å; E379-K383 IonicContact OE1-NZ 3.81Å; E379-K383 PolarHBondContact OE1-NZ 2.85Å; Y380-K383 HydrophobicContact CD1-CD 4.45Å; Y380-K383 WeakPolarHBondContact O-CB 3.49Å; Y380-K383 PolarHBondContact O-N 3.48Å; Y380-K383 VanDerWaalsContact O-N 3.17Å; W381-K383 PolarHBondContact O-N 3.24Å; K383-K385 VanDerWaalsContact C-N 3.35Å; K383-K385 PolarHBondContact O-N 2.96Å; K383-K386 WeakPolarHBondContact O-CB 3.41Å; K383-K386 PolarHBondContact O-N 2.81Å; K383-E387 WeakPolarHBondContact O-CG 3.4Å; K383-E387 PolarHBondContact O-N 2.91Å
384	A	94.8	Very high	93.1	Very high	0 Å²	0	69.8 Å²	69.8	0%	0	35%	0.352	C	S	.	.	H	α-helix	trans	-53.9	-46.8	-179.9	0	0	0	0	0	112.6	N316 N318 L319 Y380 W381 K386 E387 L388	N316-A384 WeakPolarHBondContact OD1-CB 3.35Å; N318-A384 HydrophobicContact CB-CB 4.1Å; L319-A384 HydrophobicContact CB-CB 3.98Å; Y380-A384 WeakPolarHBondContact O-CB 3.31Å; Y380-A384 PolarHBondContact O-N 3.36Å; W381-A384 HydrophobicContact CE3-CB 4.06Å; W381-A384 HydrophobicContact CZ3-CB 4.47Å; W381-A384 PolarHBondContact O-N 3.13Å; A384-K386 VanDerWaalsContact C-N 3.33Å; A384-K386 PolarHBondContact O-N 3.34Å; A384-E387 PolarHBondContact O-N 2.77Å; A384-L388 VanDerWaalsContact O-CB 3.27Å; A384-L388 WeakPolarHBondContact O-CB 3.3Å; A384-L388 WeakPolarHBondContact O-CG 3.25Å; A384-L388 PolarHBondContact O-N 3.27Å
385	K	94.1	Very high	93.3	Very high	37 Å²	37	67.6 Å²	67.6	16%	0.161	34%	0.343	C	S	.	.	H	α-helix	trans	-56.7	-42	174.7	-77.2	-176.7	-69.3	-179.7	0	113.3	W381 D382 K383 G389 I390	W381-K385 HydrophobicContact CD2-CD 4.08Å; W381-K385 HydrophobicContact CD2-CG 3.92Å; W381-K385 HydrophobicContact CE3-CG 3.97Å; W381-K385 HydrophobicContact CH2-CD 4.2Å; W381-K385 HydrophobicContact CH2-CG 3.7Å; W381-K385 HydrophobicContact CZ2-CD 3.65Å; W381-K385 HydrophobicContact CZ2-CG 3.69Å; W381-K385 HydrophobicContact CZ3-CG 3.84Å; W381-K385 WeakPolarHBondContact O-CB 3.31Å; W381-K385 WeakPolarHBondContact O-CE 3.28Å; W381-K385 WeakPolarHBondContact O-CG 3.47Å; W381-K385 PolarHBondContact O-N 2.96Å; D382-K385 WeakPolarHBondContact OD1-CE 3.22Å; D382-K385 IonicContact OD1-NZ 3.8Å; D382-K385 PolarHBondContact OD1-NZ 3.45Å; K383-K385 VanDerWaalsContact C-N 3.35Å; K383-K385 PolarHBondContact O-N 2.96Å; K385-G389 WeakPolarHBondContact O-CA 3.34Å; K385-G389 PolarHBondContact O-N 3.47Å; K385-I390 WeakPolarHBondContact CA-O 3.06Å; K385-I390 WeakPolarHBondContact CB-O 3.46Å; K385-I390 VanDerWaalsContact CG-O 3.24Å; K385-I390 WeakPolarHBondContact CG-O 3.46Å; K385-I390 PolarHBondContact O-N 3.47Å; K385-I390 VanDerWaalsContact O-N 3.14Å
386	K	91.5	Very high	93.5	Very high	163 Å²	163	63.8 Å²	63.8	71%	0.709	33%	0.325	S	S	*	.	H	α-helix	trans	-71.9	-32.4	178.3	-65.9	179	-172.1	107.6	0	113	D382 K383 A384	D382-K386 WeakPolarHBondContact O-CD 3.44Å; D382-K386 WeakPolarHBondContact O-CE 3.18Å; D382-K386 VanDerWaalsContact O-CG 3.31Å; D382-K386 WeakPolarHBondContact O-CG 3.34Å; D382-K386 PolarHBondContact O-NZ 3.46Å; K383-K386 WeakPolarHBondContact O-CB 3.41Å; K383-K386 PolarHBondContact O-N 2.81Å; A384-K386 VanDerWaalsContact C-N 3.33Å; A384-K386 PolarHBondContact O-N 3.34Å
387	E	93.8	Very high	93.7	Very high	109 Å²	109	59.8 Å²	59.8	51%	0.509	31%	0.308	S	S	.	.	H	α-helix	trans	-81.3	-32.4	180	-70.6	164.2	-179.2	0	0	112.4	N316 N318 K383 A384	N316-E387 WeakPolarHBondContact ND2-CB 3.41Å; N316-E387 PolarHBondContact ND2-OE2 2.68Å; N318-E387 VanDerWaalsContact ND2-CD 3.29Å; N318-E387 PolarHBondContact ND2-OE1 2.68Å; N318-E387 PolarHBondContact ND2-OE2 3Å; K383-E387 WeakPolarHBondContact O-CG 3.4Å; K383-E387 PolarHBondContact O-N 2.91Å; A384-E387 PolarHBondContact O-N 2.77Å
388	L	92.3	Very high	93.9	Very high	58 Å²	58	59.8 Å²	59.8	30%	0.304	31%	0.308	S	S	.	.	H	α-helix	trans	-89	-21.4	176.4	-68.4	171.1	0	0	0	113.2	P313 N316 L319 A384 I390	P313-L388 HydrophobicContact CB-CD1 3.86Å; P313-L388 HydrophobicContact CB-CD2 4.21Å; N316-L388 HydrophobicContact CB-CD1 4.11Å; N316-L388 HydrophobicContact CB-CD2 4.03Å; N316-L388 HydrophobicContact CB-CG 4.11Å; L319-L388 HydrophobicContact CD2-CD1 4.24Å; A384-L388 VanDerWaalsContact O-CB 3.27Å; A384-L388 WeakPolarHBondContact O-CB 3.3Å; A384-L388 WeakPolarHBondContact O-CG 3.25Å; A384-L388 PolarHBondContact O-N 3.27Å; L388-I390 HydrophobicContact CB-CD1 4.05Å; L388-I390 HydrophobicContact CB-CG1 3.96Å; L388-I390 HydrophobicContact CB-CG2 4.44Å; L388-I390 HydrophobicContact CD1-CD1 3.87Å
389	G	90.7	Very high	93.9	Very high	70 Å²	70	56.6 Å²	56.6	72%	0.722	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	74.3	32.6	-176.9	0	0	0	0	0	114	K385	K385-G389 WeakPolarHBondContact O-CA 3.34Å; K385-G389 PolarHBondContact O-N 3.47Å
390	I	91.2	Very high	93.8	Very high	49 Å²	49	52.2 Å²	52.2	25%	0.251	27%	0.274	S	S	.	.			trans	-125.7	146.3	-176.2	68.2	-176.8	0	0	0	111.3	W381 K385 L388 L393	W381-I390 HydrophobicContact CH2-CD1 4.49Å; K385-I390 WeakPolarHBondContact CA-O 3.06Å; K385-I390 WeakPolarHBondContact CB-O 3.46Å; K385-I390 VanDerWaalsContact CG-O 3.24Å; K385-I390 WeakPolarHBondContact CG-O 3.46Å; K385-I390 PolarHBondContact O-N 3.47Å; K385-I390 VanDerWaalsContact O-N 3.14Å; L388-I390 HydrophobicContact CB-CD1 4.05Å; L388-I390 HydrophobicContact CB-CG1 3.96Å; L388-I390 HydrophobicContact CB-CG2 4.44Å; L388-I390 HydrophobicContact CD1-CD1 3.87Å; I390-L393 HydrophobicContact CD1-CB 4.11Å; I390-L393 HydrophobicContact CD1-CD1 4.37Å
391	D	87.8	Confident	93.5	Very high	145 Å²	145	51.8 Å²	51.8	78%	0.775	28%	0.275	S	S	*	.	S	Bend	trans	-98	-30.8	171.7	-70.5	-57.9	0	0	0	112.5
392	E	90.9	Very high	93	Very high	155 Å²	155	52 Å²	52	72%	0.724	28%	0.276	S	S	*	.			trans	-126.9	152.8	-179.6	-63.4	-176.6	166.1	0	0	111.1	G422	E392-G422 CarbonylContact C-O 3.44Å; E392-G422 VanDerWaalsContact CA-O 3.23Å; E392-G422 WeakPolarHBondContact CA-O 3.29Å
393	L	93.8	Very high	92.6	Very high	22 Å²	22	48.4 Å²	48.4	12%	0.115	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	126.6	175.9	177.7	61.2	0	0	0	110.5	P313 L319 W381 I390 G422 M423 T424	P313-L393 HydrophobicContact CB-CD1 4.44Å; P313-L393 HydrophobicContact CG-CD1 4.02Å; L319-L393 HydrophobicContact CD1-CD2 3.91Å; L319-L393 HydrophobicContact CD2-CD2 3.68Å; L319-L393 HydrophobicContact CG-CD2 4.47Å; W381-L393 HydrophobicContact CH2-CB 3.82Å; W381-L393 HydrophobicContact CH2-CD2 4.42Å; W381-L393 HydrophobicContact CZ3-CD2 4.41Å; I390-L393 HydrophobicContact CD1-CB 4.11Å; I390-L393 HydrophobicContact CD1-CD1 4.37Å; L393-G422 PolarHBondContact N-O 3.48Å; L393-M423 HydrophobicContact CB-SD 3.94Å; L393-M423 HydrophobicContact CD2-CE 4.24Å; L393-M423 HydrophobicContact CD2-SD 3.89Å; L393-M423 HydrophobicContact CG-SD 4.01Å; L393-M423 CarbonylContact O-C 3.56Å; L393-M423 WeakPolarHBondContact O-CA 3.26Å; L393-T424 PolarHBondContact O-N 3.28Å
394	S	95.5	Very high	92.3	Very high	53 Å²	53	46.1 Å²	46.1	37%	0.371	25%	0.25	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	138.1	171.3	-175	0	0	0	0	111.5	T424 K426	S394-T424 WeakPolarHBondContact CA-O 3.28Å; S394-T424 WeakPolarHBondContact CB-O 3.32Å; S394-T424 PolarHBondContact OG-O 3.43Å; S394-K426 VanDerWaalsContact OG-CE 3.24Å; S394-K426 WeakPolarHBondContact OG-CE 3.43Å; S394-K426 PolarHBondContact OG-NZ 3.31Å
395	F	95.3	Very high	92.1	Very high	5 Å²	5	47 Å²	47	2%	0.022	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.8	158.1	-171.7	69.1	-93.1	0	0	0	112.7	W314 L397 L416 M423 T424 V425 K426 D445 V446	W314-F395 HydrophobicContact CH2-CD1 4.11Å; W314-F395 HydrophobicContact CH2-CD2 4.47Å; W314-F395 AromaticContact CH2-CE1 3.9Å; W314-F395 HydrophobicContact CH2-CE1 3.9Å; W314-F395 HydrophobicContact CH2-CE2 4.29Å; W314-F395 HydrophobicContact CH2-CG 4.39Å; W314-F395 AromaticContact CH2-CZ 3.99Å; W314-F395 HydrophobicContact CH2-CZ 3.99Å; W314-F395 HydrophobicContact CZ2-CB 4.11Å; W314-F395 AromaticContact CZ2-CD1 3.72Å; W314-F395 HydrophobicContact CZ2-CD1 3.72Å; W314-F395 AromaticContact CZ2-CD2 3.82Å; W314-F395 HydrophobicContact CZ2-CD2 3.82Å; W314-F395 AromaticContact CZ2-CE1 3.97Å; W314-F395 HydrophobicContact CZ2-CE1 3.97Å; W314-F395 HydrophobicContact CZ2-CE2 4.07Å; W314-F395 AromaticContact CZ2-CG 3.63Å; W314-F395 HydrophobicContact CZ2-CG 3.63Å; W314-F395 HydrophobicContact CZ2-CZ 4.14Å; F395-L397 HydrophobicContact CE2-CB 4.13Å; F395-L416 HydrophobicContact CZ-CD1 4.23Å; F395-M423 HydrophobicContact CD1-SD 4.07Å; F395-M423 HydrophobicContact CE1-CG 4.06Å; F395-M423 HydrophobicContact CE1-SD 3.67Å; F395-T424 PolarHBondContact N-O 2.96Å; F395-V425 HydrophobicContact CE1-CG2 3.84Å; F395-V425 HydrophobicContact CE2-CG1 3.89Å; F395-V425 HydrophobicContact CZ-CB 4.27Å; F395-V425 HydrophobicContact CZ-CG1 3.86Å; F395-V425 HydrophobicContact CZ-CG2 3.7Å; F395-K426 WeakPolarHBondContact O-CB 3.22Å; F395-K426 PolarHBondContact O-N 2.83Å; F395-D445 WeakPolarHBondContact CA-OD2 3.22Å; F395-D445 HydrophobicContact CB-CB 3.79Å; F395-D445 HydrophobicContact CD2-CB 4.46Å; F395-V446 HydrophobicContact CD2-CB 4.02Å; F395-V446 HydrophobicContact CD2-CG2 3.49Å; F395-V446 VanDerWaalsContact CD2-CG2 3.49Å; F395-V446 HydrophobicContact CE2-CB 3.83Å; F395-V446 HydrophobicContact CE2-CG2 3.43Å; F395-V446 VanDerWaalsContact CE2-CG2 3.43Å; F395-V446 HydrophobicContact CG-CG2 4.4Å; F395-V446 HydrophobicContact CZ-CG2 4.3Å
396	E	96.5	Very high	91.9	Very high	37 Å²	37	46.7 Å²	46.7	17%	0.173	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	125	172.3	-161.7	-169.2	135.7	0	0	111.8	T428 R438 D445 V446	E396-T428 HydrophobicContact CG-CG2 4.26Å; E396-T428 WeakPolarHBondContact CG-OG1 3.43Å; E396-T428 WeakPolarHBondContact OE1-CB 3.48Å; E396-T428 VanDerWaalsContact OE1-CG2 3.24Å; E396-T428 WeakPolarHBondContact OE1-CG2 3.47Å; E396-R438 IonicContact OE1-CZ 2.63Å; E396-R438 IonicContact OE1-NH1 3.75Å; E396-R438 PolarHBondContact OE1-NH1 3.46Å; E396-R438 IonicContact OE1-NH2 3.48Å; E396-R438 PolarHBondContact OE1-NH2 3.46Å; E396-R438 IonicContact OE2-CZ 3.64Å; E396-R438 IonicContact OE2-NH1 3.47Å; E396-R438 IonicContact OE2-NH2 3.9Å; E396-R438 PolarHBondContact OE2-NH2 3.23Å; E396-D445 PolarHBondContact N-OD2 3.36Å; E396-V446 PolarHBondContact O-N 3.14Å
397	L	97.3	Very high	91.9	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	94.6	168.9	176.5	55.1	0	0	0	109.2	L303 F395 I409 I412 V425 K426 T428 V446	L303-L397 HydrophobicContact CD2-CD1 3.78Å; F395-L397 HydrophobicContact CE2-CB 4.13Å; L397-I409 HydrophobicContact CD1-CG2 4.27Å; L397-I409 HydrophobicContact CD2-CB 3.79Å; L397-I409 HydrophobicContact CD2-CG2 3.9Å; L397-I409 HydrophobicContact CG-CB 3.98Å; L397-I409 HydrophobicContact CG-CG2 3.72Å; L397-I412 HydrophobicContact CD2-CB 4.1Å; L397-I412 HydrophobicContact CD2-CG2 3.69Å; L397-V425 HydrophobicContact CB-CG1 3.56Å; L397-V425 HydrophobicContact CD2-CG1 3.75Å; L397-V425 HydrophobicContact CG-CG1 4.31Å; L397-K426 PolarHBondContact N-O 3.05Å; L397-T428 PolarHBondContact O-N 3.4Å; L397-V446 WeakPolarHBondContact CA-O 3.38Å; L397-V446 HydrophobicContact CD1-CB 4.07Å; L397-V446 HydrophobicContact CD1-CG1 3.8Å
398	M	96.9	Very high	91.9	Very high	0 Å²	0	34 Å²	34	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85	142.2	-176	-164.1	-164.6	-48.5	0	0	112	T428 V430 R435 R438 D443 F444 V446 L447 L448	M398-T428 WeakPolarHBondContact CA-O 3.45Å; M398-T428 WeakPolarHBondContact CG-O 3.41Å; M398-V430 HydrophobicContact CG-CG2 3.99Å; M398-V430 HydrophobicContact SD-CG2 3.98Å; M398-R435 HydrophobicContact CG-CG 4.42Å; M398-R435 HydrophobicContact SD-CB 4.38Å; M398-R435 HydrophobicContact SD-CG 3.93Å; M398-R438 HydrophobicContact CE-CB 3.79Å; M398-R438 VanDerWaalsContact CE-CZ 3.5Å; M398-R438 HydrophobicContact SD-CB 4.09Å; M398-D443 WeakPolarHBondContact CE-O 3.49Å; M398-F444 HydrophobicContact CE-CB 3.54Å; M398-V446 PolarHBondContact N-O 3.36Å; M398-L447 HydrophobicContact CB-CD1 4.38Å; M398-L447 HydrophobicContact SD-CD1 4.48Å; M398-L448 PolarHBondContact O-N 3.35Å
399	A	94.8	Very high	92	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.9	179.3	170.9	0	0	0	0	0	112.4	I409 T428 P429 V430 L448	A399-I409 HydrophobicContact CB-CD1 4.07Å; A399-I409 HydrophobicContact CB-CG2 3.59Å; A399-T428 PolarHBondContact N-O 2.79Å; A399-T428 VanDerWaalsContact N-O 3.12Å; A399-P429 WeakPolarHBondContact O-CA 3.42Å; A399-V430 PolarHBondContact O-N 3.03Å; A399-L448 HydrophobicContact CB-CB 3.89Å; A399-L448 HydrophobicContact CB-CD2 3.94Å; A399-L448 HydrophobicContact CB-CG 4.38Å
400	S	91.6	Very high	92.1	Very high	10 Å²	10	28.7 Å²	28.7	7%	0.07	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.9	153.3	169.5	-61.7	0	0	0	0	110.5	T402 S405 V430 R435	S400-T402 PolarHBondContact O-N 3.04Å; S400-S405 VanDerWaalsContact O-CB 3.27Å; S400-S405 WeakPolarHBondContact O-CB 3.43Å; S400-V430 CarbonylContact C-O 3.6Å; S400-V430 VanDerWaalsContact CA-O 3.29Å; S400-V430 WeakPolarHBondContact CA-O 3.44Å; S400-R435 PolarHBondContact OG-NE 3.03Å; S400-R435 VanDerWaalsContact OG-NE 3.17Å
401	D	89.1	Confident	92.3	Very high	30 Å²	30	27.7 Å²	27.7	16%	0.16	15%	0.146	C	C	.	.	S	Bend	trans	-78.8	2.9	179.1	71.8	-28.6	0	0	0	115.1	K259 K406 P429 V430	K259-D401 IonicContact NZ-OD1 3.43Å; K259-D401 PolarHBondContact NZ-OD1 3.06Å; K259-D401 IonicContact NZ-OD2 3.54Å; K259-D401 PolarHBondContact NZ-OD2 2.73Å; D401-K406 WeakPolarHBondContact O-CE 3.27Å; D401-K406 PolarHBondContact O-NZ 3.09Å; D401-P429 HydrophobicContact CB-CB 4.43Å; D401-V430 PolarHBondContact N-O 3.33Å
402	T	86.6	Confident	92.7	Very high	5 Å²	5	20.8 Å²	20.8	3%	0.031	11%	0.109	C	C	.	.	S	Bend	trans	-54.4	143.2	169.7	55.9	0	0	0	0	112.3	Q48 Q49 S400 S404 S405 K406	Q48-T402 HydrophobicContact CB-CG2 4.18Å; Q49-T402 HydrophobicContact CB-CG2 4.26Å; S400-T402 PolarHBondContact O-N 3.04Å; T402-S404 PolarHBondContact O-N 3.25Å; T402-S405 PolarHBondContact O-N 3.42Å; T402-S405 VanDerWaalsContact O-N 3.15Å; T402-S405 WeakPolarHBondContact OG1-CB 2.97Å; T402-S405 PolarHBondContact OG1-N 3.06Å; T402-S405 PolarHBondContact OG1-OG 2.91Å; T402-K406 PolarHBondContact O-N 3.06Å
403	D	85.1	Confident	92.9	Very high	0 Å²	0	15.7 Å²	15.7	0%	0	9%	0.085	C	C	.	.	H	α-helix	trans	-42.5	-55.9	172.5	174.5	45	0	0	0	113.1	K259 S261 S279 S405 K406 K407 N1669	K259-D403 WeakPolarHBondContact O-CB 3.23Å; K259-D403 PolarHBondContact O-N 2.67Å; S261-D403 WeakPolarHBondContact CB-OD2 3.44Å; S261-D403 PolarHBondContact OG-OD2 2.86Å; S279-D403 PolarHBondContact OG-OD2 2.95Å; D403-S405 PolarHBondContact O-N 3.41Å; D403-K406 PolarHBondContact O-N 2.83Å; D403-K407 WeakPolarHBondContact O-CG 3.3Å; D403-K407 PolarHBondContact O-N 3.42Å; D403-K407 IonicContact OD1-NZ 2.67Å; D403-K407 PolarHBondContact OD1-NZ 2.65Å; D403-K407 IonicContact OD2-NZ 3.04Å; D403-K407 PolarHBondContact OD2-NZ 2.88Å; D403-K407 VanDerWaalsContact OD2-NZ 3.11Å; D403-N1669 WeakPolarHBondContact OD1-CB 3.49Å; D403-N1669 VanDerWaalsContact OD1-CG 3.24Å; D403-N1669 PolarHBondContact OD1-ND2 3.2Å
404	S	88.3	Confident	92.8	Very high	21 Å²	21	15.9 Å²	15.9	15%	0.147	9%	0.092	C	C	.	.	H	α-helix	trans	-62.5	-37.4	-178.8	54.8	0	0	0	0	114.7	T402 K407 V408	T402-S404 PolarHBondContact O-N 3.25Å; S404-K407 WeakPolarHBondContact O-CB 3.39Å; S404-K407 PolarHBondContact O-N 3.48Å; S404-V408 WeakPolarHBondContact O-CG2 3.2Å; S404-V408 PolarHBondContact O-N 3.47Å
405	S	90.7	Very high	92.8	Very high	19 Å²	19	14.4 Å²	14.4	13%	0.133	8%	0.081	C	C	.	.	H	α-helix	trans	-71.4	-35.2	-178.9	-62.3	0	0	0	0	113	S400 T402 D403 V408 I409	S400-S405 VanDerWaalsContact O-CB 3.27Å; S400-S405 WeakPolarHBondContact O-CB 3.43Å; T402-S405 PolarHBondContact O-N 3.42Å; T402-S405 VanDerWaalsContact O-N 3.15Å; T402-S405 WeakPolarHBondContact OG1-CB 2.97Å; T402-S405 PolarHBondContact OG1-N 3.06Å; T402-S405 PolarHBondContact OG1-OG 2.91Å; D403-S405 PolarHBondContact O-N 3.41Å; S405-V408 PolarHBondContact O-N 2.9Å; S405-I409 PolarHBondContact O-N 2.83Å; S405-I409 VanDerWaalsContact O-N 3.08Å
406	K	90.6	Very high	92.7	Very high	29 Å²	29	14.2 Å²	14.2	13%	0.126	8%	0.08	C	C	.	.	H	α-helix	trans	-56.8	-50.8	171.2	-73.1	156.8	166.5	159.7	0	110.2	E260 D401 T402 D403 V408 I409 E410 P429 P1668 N1669	E260-K406 IonicContact OE1-NZ 2.69Å; D401-K406 WeakPolarHBondContact O-CE 3.27Å; D401-K406 PolarHBondContact O-NZ 3.09Å; T402-K406 PolarHBondContact O-N 3.06Å; D403-K406 PolarHBondContact O-N 2.83Å; K406-V408 VanDerWaalsContact C-N 3.28Å; K406-V408 PolarHBondContact O-N 2.9Å; K406-I409 WeakPolarHBondContact O-CG1 3.29Å; K406-I409 PolarHBondContact O-N 3.43Å; K406-I409 VanDerWaalsContact O-N 3.14Å; K406-E410 PolarHBondContact O-N 3.49Å; K406-P429 HydrophobicContact CG-CB 4.09Å; K406-P429 HydrophobicContact CG-CG 4.43Å; K406-P1668 HydrophobicContact CB-CB 4.08Å; K406-P1668 HydrophobicContact CD-CB 3.74Å; K406-P1668 HydrophobicContact CG-CB 3.79Å; K406-N1669 WeakPolarHBondContact CB-O 3.42Å
407	K	90.6	Very high	92.6	Very high	5 Å²	5	15.8 Å²	15.8	2%	0.022	9%	0.088	C	C	.	.	H	α-helix	trans	-47.7	-46.6	172.1	-56.3	-163	165.2	85	0	113.7	S279 V336 D403 S404 Y411 N1669 D1670	S279-K407 PolarHBondContact OG-NZ 3.49Å; V336-K407 HydrophobicContact CG1-CB 3.55Å; V336-K407 VanDerWaalsContact CG1-O 3.3Å; V336-K407 WeakPolarHBondContact CG1-O 3.33Å; V336-K407 VanDerWaalsContact O-CD 3.26Å; V336-K407 WeakPolarHBondContact O-CD 3.24Å; D403-K407 WeakPolarHBondContact O-CG 3.3Å; D403-K407 PolarHBondContact O-N 3.42Å; D403-K407 IonicContact OD1-NZ 2.67Å; D403-K407 PolarHBondContact OD1-NZ 2.65Å; D403-K407 IonicContact OD2-NZ 3.04Å; D403-K407 PolarHBondContact OD2-NZ 2.88Å; D403-K407 VanDerWaalsContact OD2-NZ 3.11Å; S404-K407 WeakPolarHBondContact O-CB 3.39Å; S404-K407 PolarHBondContact O-N 3.48Å; K407-Y411 WeakPolarHBondContact O-CB 3.39Å; K407-Y411 PolarHBondContact O-N 2.76Å; K407-N1669 VanDerWaalsContact CE-OD1 3.27Å; K407-N1669 WeakPolarHBondContact CE-OD1 3.36Å; K407-N1669 WeakPolarHBondContact CG-O 3.25Å; K407-N1669 PolarHBondContact N-O 2.83Å; K407-N1669 VanDerWaalsContact N-O 3.12Å; K407-N1669 VanDerWaalsContact NZ-CG 3.33Å; K407-N1669 PolarHBondContact NZ-ND2 2.84Å; K407-N1669 VanDerWaalsContact NZ-ND2 3.17Å; K407-D1670 WeakPolarHBondContact CA-O 3.41Å
408	V	93.9	Very high	92.4	Very high	0 Å²	0	21 Å²	21	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-68.3	-46.2	-179.4	178.7	0	0	0	0	112.1	L332 L337 S404 S405 K406 I412 L448 L519 Y520	L332-V408 HydrophobicContact CD1-CB 4.39Å; L332-V408 HydrophobicContact CD1-CG1 4.3Å; L332-V408 HydrophobicContact CD1-CG2 4.05Å; L332-V408 HydrophobicContact CD2-CG1 4.38Å; L337-V408 HydrophobicContact CD2-CG2 3.84Å; L337-V408 HydrophobicContact CG-CG2 4.4Å; S404-V408 WeakPolarHBondContact O-CG2 3.2Å; S404-V408 PolarHBondContact O-N 3.47Å; S405-V408 PolarHBondContact O-N 2.9Å; K406-V408 VanDerWaalsContact C-N 3.28Å; K406-V408 PolarHBondContact O-N 2.9Å; V408-I412 HydrophobicContact CG1-CD1 3.72Å; V408-I412 WeakPolarHBondContact O-CB 3.39Å; V408-I412 WeakPolarHBondContact O-CD1 2.99Å; V408-I412 WeakPolarHBondContact O-CG1 2.96Å; V408-I412 PolarHBondContact O-N 3.5Å; V408-L448 HydrophobicContact CB-CD2 3.61Å; V408-L448 HydrophobicContact CG1-CD1 3.76Å; V408-L448 HydrophobicContact CG1-CD2 3.49Å; V408-L448 VanDerWaalsContact CG1-CD2 3.49Å; V408-L448 HydrophobicContact CG1-CG 4.3Å; V408-L448 HydrophobicContact CG2-CD2 4.45Å; V408-L519 HydrophobicContact CG1-CD1 4Å; V408-Y520 HydrophobicContact CG1-CE1 4.21Å; V408-Y520 HydrophobicContact CG2-CE1 3.83Å
409	I	95.6	Very high	92.2	Very high	0 Å²	0	21.1 Å²	21.1	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-71.9	-36.2	-175.6	61.4	178	0	0	0	113.6	L397 A399 S405 K406 I412 Q413 P427 P429 L448	L397-I409 HydrophobicContact CD1-CG2 4.27Å; L397-I409 HydrophobicContact CD2-CB 3.79Å; L397-I409 HydrophobicContact CD2-CG2 3.9Å; L397-I409 HydrophobicContact CG-CB 3.98Å; L397-I409 HydrophobicContact CG-CG2 3.72Å; A399-I409 HydrophobicContact CB-CD1 4.07Å; A399-I409 HydrophobicContact CB-CG2 3.59Å; S405-I409 PolarHBondContact O-N 2.83Å; S405-I409 VanDerWaalsContact O-N 3.08Å; K406-I409 WeakPolarHBondContact O-CG1 3.29Å; K406-I409 PolarHBondContact O-N 3.43Å; K406-I409 VanDerWaalsContact O-N 3.14Å; I409-I412 PolarHBondContact O-N 3.22Å; I409-Q413 PolarHBondContact O-N 2.83Å; I409-P427 HydrophobicContact CB-CB 4.42Å; I409-P427 HydrophobicContact CD1-CB 3.56Å; I409-P427 HydrophobicContact CG1-CB 3.88Å; I409-P429 HydrophobicContact CD1-CB 4.41Å; I409-L448 HydrophobicContact CG2-CB 3.95Å; I409-L448 HydrophobicContact CG2-CD2 3.69Å; I409-L448 HydrophobicContact CG2-CG 4.46Å
410	E	92.8	Very high	92.1	Very high	17 Å²	17	21.1 Å²	21.1	8%	0.079	12%	0.116	C	C	.	.	H	α-helix	trans	-79.4	-30.3	-179.1	-74.1	168.3	-99.2	0	0	112.4	K406 G414 P427 P1668 D1670	K406-E410 PolarHBondContact O-N 3.49Å; E410-G414 PolarHBondContact O-N 2.63Å; E410-G414 VanDerWaalsContact O-N 3.11Å; E410-P427 HydrophobicContact CG-CB 4.15Å; E410-P427 HydrophobicContact CG-CG 4.23Å; E410-P1668 VanDerWaalsContact OE1-CB 3.3Å; E410-P1668 WeakPolarHBondContact OE1-CB 3.27Å; E410-P1668 WeakPolarHBondContact OE1-CG 3.25Å; E410-P1668 WeakPolarHBondContact OE2-CG 3.36Å; E410-D1670 HydrophobicContact CB-CB 3.55Å; E410-D1670 HydrophobicContact CG-CB 4.26Å
411	Y	94.6	Very high	91.9	Very high	29 Å²	29	24.9 Å²	24.9	11%	0.114	14%	0.14	C	C	.	.	H	α-helix	trans	-60.8	-45.1	163.1	173.2	-101.2	0	0	0	111.6	I327 N328 S331 L332 V336 K407 G414 V415	I327-Y411 HydrophobicContact CG2-CE1 4.38Å; N328-Y411 WeakPolarHBondContact CB-OH 3.43Å; N328-Y411 PolarHBondContact O-OH 3.48Å; N328-Y411 VanDerWaalsContact O-OH 3.06Å; S331-Y411 WeakPolarHBondContact CB-OH 3.48Å; L332-Y411 HydrophobicContact CB-CD1 4.19Å; L332-Y411 HydrophobicContact CB-CE1 3.85Å; L332-Y411 HydrophobicContact CD1-CD1 3.73Å; L332-Y411 HydrophobicContact CD1-CE1 4.28Å; L332-Y411 HydrophobicContact CD1-CG 4.3Å; L332-Y411 HydrophobicContact CG-CD1 4.38Å; L332-Y411 HydrophobicContact CG-CE1 4.48Å; V336-Y411 HydrophobicContact CG2-CD2 3.56Å; V336-Y411 HydrophobicContact CG2-CE2 4.16Å; V336-Y411 HydrophobicContact CG2-CG 3.81Å; K407-Y411 WeakPolarHBondContact O-CB 3.39Å; K407-Y411 PolarHBondContact O-N 2.76Å; Y411-G414 PolarHBondContact O-N 3.46Å; Y411-V415 HydrophobicContact CD1-CG2 4.44Å; Y411-V415 HydrophobicContact CD2-CG2 4.19Å; Y411-V415 HydrophobicContact CE1-CG2 3.96Å; Y411-V415 HydrophobicContact CE2-CG2 3.67Å; Y411-V415 WeakPolarHBondContact O-CB 3.38Å; Y411-V415 WeakPolarHBondContact O-CG2 3.26Å; Y411-V415 PolarHBondContact O-N 3.49Å
412	I	95.4	Very high	92	Very high	0 Å²	0	24.7 Å²	24.7	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-66	-40.2	179.1	-72.9	169.9	0	0	0	111.1	L303 I327 L397 V408 I409 V415 L416 L519	L303-I412 HydrophobicContact CD1-CD1 4.31Å; L303-I412 HydrophobicContact CD1-CG2 4.29Å; L303-I412 HydrophobicContact CD2-CD1 4.03Å; L303-I412 HydrophobicContact CG-CD1 4.41Å; I327-I412 HydrophobicContact CD1-CD1 4.26Å; I327-I412 HydrophobicContact CD1-CG1 4.16Å; I327-I412 HydrophobicContact CD1-CG2 4.31Å; I327-I412 HydrophobicContact CG1-CG1 4.46Å; L397-I412 HydrophobicContact CD2-CB 4.1Å; L397-I412 HydrophobicContact CD2-CG2 3.69Å; V408-I412 HydrophobicContact CG1-CD1 3.72Å; V408-I412 WeakPolarHBondContact O-CB 3.39Å; V408-I412 WeakPolarHBondContact O-CD1 2.99Å; V408-I412 WeakPolarHBondContact O-CG1 2.96Å; V408-I412 PolarHBondContact O-N 3.5Å; I409-I412 PolarHBondContact O-N 3.22Å; I412-V415 PolarHBondContact O-N 2.9Å; I412-L416 HydrophobicContact CG2-CD1 3.56Å; I412-L416 HydrophobicContact CG2-CG 4.12Å; I412-L416 WeakPolarHBondContact O-CB 3.4Å; I412-L416 WeakPolarHBondContact O-CG 3.21Å; I412-L416 PolarHBondContact O-N 3.25Å; I412-L519 HydrophobicContact CD1-CD1 3.87Å; I412-L519 HydrophobicContact CD1-CD2 4.06Å
413	Q	96.2	Very high	92.3	Very high	47 Å²	47	24.9 Å²	24.9	22%	0.22	15%	0.146	C	C	.	.	H	α-helix	trans	-53.8	-60	171.6	172.1	175.5	19.9	0	0	110.9	I409 V415 L416 E417 V425 P427	I409-Q413 PolarHBondContact O-N 2.83Å; Q413-V415 VanDerWaalsContact C-N 3.28Å; Q413-V415 PolarHBondContact O-N 3.24Å; Q413-L416 PolarHBondContact O-N 3.14Å; Q413-L416 VanDerWaalsContact O-N 3.13Å; Q413-E417 HydrophobicContact CG-CG 4.35Å; Q413-E417 WeakPolarHBondContact CG-OE1 3.46Å; Q413-E417 PolarHBondContact NE2-OE1 3.38Å; Q413-E417 WeakPolarHBondContact O-CG 3.41Å; Q413-E417 PolarHBondContact O-N 3.27Å; Q413-V425 HydrophobicContact CB-CB 4.01Å; Q413-V425 HydrophobicContact CB-CG1 4.29Å; Q413-V425 HydrophobicContact CG-CB 4.02Å; Q413-V425 PolarHBondContact NE2-O 3.46Å; Q413-V425 VanDerWaalsContact NE2-O 3.1Å; Q413-P427 VanDerWaalsContact OE1-CD 3.32Å
414	G	92.5	Very high	92.8	Very high	26 Å²	26	28.1 Å²	28.1	27%	0.268	17%	0.166	S	C	.	.	H	α-helix	trans	-58.2	-39.9	-176	0	0	0	0	0	112.8	E410 Y411 D418	E410-G414 PolarHBondContact O-N 2.63Å; E410-G414 VanDerWaalsContact O-N 3.11Å; Y411-G414 PolarHBondContact O-N 3.46Å; G414-D418 VanDerWaalsContact O-CB 3.32Å; G414-D418 WeakPolarHBondContact O-CB 3.5Å; G414-D418 PolarHBondContact O-N 2.92Å; G414-D418 VanDerWaalsContact O-N 3.13Å
415	V	93.6	Very high	93.2	Very high	23 Å²	23	27.2 Å²	27.2	14%	0.139	16%	0.16	C	C	.	.	H	α-helix	trans	-68	-40.5	177.3	168.5	0	0	0	0	112.8	A326 Y411 I412 Q413 T419	A326-V415 HydrophobicContact CB-CG1 4.44Å; A326-V415 WeakPolarHBondContact O-CG1 3.27Å; Y411-V415 HydrophobicContact CD1-CG2 4.44Å; Y411-V415 HydrophobicContact CD2-CG2 4.19Å; Y411-V415 HydrophobicContact CE1-CG2 3.96Å; Y411-V415 HydrophobicContact CE2-CG2 3.67Å; Y411-V415 WeakPolarHBondContact O-CB 3.38Å; Y411-V415 WeakPolarHBondContact O-CG2 3.26Å; Y411-V415 PolarHBondContact O-N 3.49Å; I412-V415 PolarHBondContact O-N 2.9Å; Q413-V415 VanDerWaalsContact C-N 3.28Å; Q413-V415 PolarHBondContact O-N 3.24Å; V415-T419 WeakPolarHBondContact O-CB 3.25Å; V415-T419 PolarHBondContact O-N 3.46Å; V415-T419 PolarHBondContact O-OG1 3.28Å
416	L	94.8	Very high	93.4	Very high	1 Å²	1	31.8 Å²	31.8	1%	0.005	18%	0.177	C	C	.	.	H	α-helix	trans	-73.4	-40	-179.3	-68.4	177	0	0	0	111.8	V323 A326 F395 I412 Q413 T419 L420 V425	V323-L416 HydrophobicContact CB-CD2 4.22Å; V323-L416 HydrophobicContact CG1-CD1 4.02Å; V323-L416 HydrophobicContact CG1-CD2 4.04Å; V323-L416 HydrophobicContact CG2-CD1 4.41Å; V323-L416 HydrophobicContact CG2-CD2 4.18Å; A326-L416 HydrophobicContact CB-CD2 3.77Å; F395-L416 HydrophobicContact CZ-CD1 4.23Å; I412-L416 HydrophobicContact CG2-CD1 3.56Å; I412-L416 HydrophobicContact CG2-CG 4.12Å; I412-L416 WeakPolarHBondContact O-CB 3.4Å; I412-L416 WeakPolarHBondContact O-CG 3.21Å; I412-L416 PolarHBondContact O-N 3.25Å; Q413-L416 PolarHBondContact O-N 3.14Å; Q413-L416 VanDerWaalsContact O-N 3.13Å; L416-T419 PolarHBondContact O-N 3.05Å; L416-L420 HydrophobicContact CD2-CD1 3.86Å; L416-L420 WeakPolarHBondContact O-CB 3.29Å; L416-L420 PolarHBondContact O-N 2.9Å; L416-V425 HydrophobicContact CB-CG2 3.98Å; L416-V425 HydrophobicContact CD1-CG2 3.99Å
417	E	94.6	Very high	93.7	Very high	70 Å²	70	32.2 Å²	32.2	33%	0.327	18%	0.183	S	C	.	.	H	α-helix	trans	-70	-35.2	178.8	-65.4	-176.9	-178.7	0	0	112.4	Q413 T424 V425	Q413-E417 HydrophobicContact CG-CG 4.35Å; Q413-E417 WeakPolarHBondContact CG-OE1 3.46Å; Q413-E417 PolarHBondContact NE2-OE1 3.38Å; Q413-E417 WeakPolarHBondContact O-CG 3.41Å; Q413-E417 PolarHBondContact O-N 3.27Å; E417-T424 WeakPolarHBondContact OE1-CA 3.16Å; E417-V425 HydrophobicContact CG-CG2 4.41Å; E417-V425 PolarHBondContact OE1-N 3.2Å
418	D	92.5	Very high	93.9	Very high	110 Å²	110	33.9 Å²	33.9	59%	0.588	19%	0.194	S	C	*	.	H	α-helix	trans	-72.5	-32.1	170.3	160.6	63.3	0	0	0	113.4	K374 G414	K374-D418 IonicContact NZ-OD1 3.21Å; K374-D418 PolarHBondContact NZ-OD1 3.36Å; K374-D418 IonicContact NZ-OD2 2.72Å; K374-D418 PolarHBondContact NZ-OD2 3.27Å; G414-D418 VanDerWaalsContact O-CB 3.32Å; G414-D418 WeakPolarHBondContact O-CB 3.5Å; G414-D418 PolarHBondContact O-N 2.92Å; G414-D418 VanDerWaalsContact O-N 3.13Å
419	T	91.6	Very high	93.9	Very high	2 Å²	2	36.2 Å²	36.2	1%	0.012	21%	0.209	C	C	.	.	H	α-helix	trans	-90.2	-33.4	-174	-60.2	0	0	0	0	113.7	A326 K374 A377 V415 L416 P421	A326-T419 HydrophobicContact CB-CG2 3.62Å; K374-T419 HydrophobicContact CD-CG2 4.36Å; K374-T419 VanDerWaalsContact CE-OG1 3.29Å; K374-T419 WeakPolarHBondContact CE-OG1 3.26Å; K374-T419 HydrophobicContact CG-CG2 3.66Å; A377-T419 HydrophobicContact CB-CG2 3.92Å; V415-T419 WeakPolarHBondContact O-CB 3.25Å; V415-T419 PolarHBondContact O-N 3.46Å; V415-T419 PolarHBondContact O-OG1 3.28Å; L416-T419 PolarHBondContact O-N 3.05Å; T419-P421 WeakPolarHBondContact O-CD 3.43Å
420	L	93.6	Very high	93.6	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	22%	0.215	C	C	.	.	S	Bend	trans	-123	87.4	-168.6	-52.7	-177.8	0	0	0	110.4	A322 V323 A377 W381 L416 G422 M423	A322-L420 HydrophobicContact CB-CD1 4.18Å; A322-L420 HydrophobicContact CB-CD2 4.31Å; V323-L420 HydrophobicContact CG2-CD1 4.42Å; A377-L420 HydrophobicContact CB-CD2 4.22Å; W381-L420 HydrophobicContact CB-CD2 3.85Å; W381-L420 HydrophobicContact CG-CB 4.21Å; W381-L420 HydrophobicContact CG-CD2 4.13Å; L416-L420 HydrophobicContact CD2-CD1 3.86Å; L416-L420 WeakPolarHBondContact O-CB 3.29Å; L416-L420 PolarHBondContact O-N 2.9Å; L420-G422 PolarHBondContact O-N 3.05Å; L420-M423 HydrophobicContact CB-CB 4.03Å; L420-M423 HydrophobicContact CB-CE 4.26Å; L420-M423 HydrophobicContact CD1-CE 3.89Å; L420-M423 WeakPolarHBondContact O-CB 3.41Å; L420-M423 PolarHBondContact O-N 3.16Å
421	P	88.1	Confident	93.2	Very high	88 Å²	88	38.8 Å²	38.8	57%	0.571	23%	0.226	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.6	130.5	-177.2	-26.1	34.9	0	0	0	112.3	W381 T419	W381-P421 PolarHBondContact NE1-O 3.32Å; T419-P421 WeakPolarHBondContact O-CD 3.43Å
422	G	89.7	Confident	92.7	Very high	27 Å²	27	38.1 Å²	38.1	28%	0.278	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	93.2	-5	-173.3	0	0	0	0	0	114.5	E392 L393 L420	E392-G422 CarbonylContact C-O 3.44Å; E392-G422 VanDerWaalsContact CA-O 3.23Å; E392-G422 WeakPolarHBondContact CA-O 3.29Å; L393-G422 PolarHBondContact N-O 3.48Å; L420-G422 PolarHBondContact O-N 3.05Å
423	M	94.2	Very high	92.1	Very high	8 Å²	8	39.7 Å²	39.7	4%	0.039	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	145	171.7	-158	66.2	67.6	0	0	111	L319 W381 L393 F395 L420 V425	L319-M423 HydrophobicContact CD1-CE 3.9Å; W381-M423 HydrophobicContact CD2-CE 4.1Å; W381-M423 HydrophobicContact CE3-CE 3.87Å; W381-M423 HydrophobicContact CH2-CE 3.7Å; W381-M423 HydrophobicContact CZ2-CE 3.87Å; W381-M423 HydrophobicContact CZ3-CE 3.69Å; L393-M423 HydrophobicContact CB-SD 3.94Å; L393-M423 HydrophobicContact CD2-CE 4.24Å; L393-M423 HydrophobicContact CD2-SD 3.89Å; L393-M423 HydrophobicContact CG-SD 4.01Å; L393-M423 CarbonylContact O-C 3.56Å; L393-M423 WeakPolarHBondContact O-CA 3.26Å; F395-M423 HydrophobicContact CD1-SD 4.07Å; F395-M423 HydrophobicContact CE1-CG 4.06Å; F395-M423 HydrophobicContact CE1-SD 3.67Å; L420-M423 HydrophobicContact CB-CB 4.03Å; L420-M423 HydrophobicContact CB-CE 4.26Å; L420-M423 HydrophobicContact CD1-CE 3.89Å; L420-M423 WeakPolarHBondContact O-CB 3.41Å; L420-M423 PolarHBondContact O-N 3.16Å; M423-V425 HydrophobicContact CG-CG2 4.33Å
424	T	94.8	Very high	91.7	Very high	69 Å²	69	40.2 Å²	40.2	42%	0.423	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	109.4	171.1	-58.3	0	0	0	0	110.7	L393 S394 F395 E417	L393-T424 PolarHBondContact O-N 3.28Å; S394-T424 WeakPolarHBondContact CA-O 3.28Å; S394-T424 WeakPolarHBondContact CB-O 3.32Å; S394-T424 PolarHBondContact OG-O 3.43Å; F395-T424 PolarHBondContact N-O 2.96Å; E417-T424 WeakPolarHBondContact OE1-CA 3.16Å
425	V	96.2	Very high	91.6	Very high	2 Å²	2	39.7 Å²	39.7	1%	0.012	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	127.9	-173	-171	0	0	0	0	109.5	F395 L397 Q413 L416 E417 M423 P427	F395-V425 HydrophobicContact CE1-CG2 3.84Å; F395-V425 HydrophobicContact CE2-CG1 3.89Å; F395-V425 HydrophobicContact CZ-CB 4.27Å; F395-V425 HydrophobicContact CZ-CG1 3.86Å; F395-V425 HydrophobicContact CZ-CG2 3.7Å; L397-V425 HydrophobicContact CB-CG1 3.56Å; L397-V425 HydrophobicContact CD2-CG1 3.75Å; L397-V425 HydrophobicContact CG-CG1 4.31Å; Q413-V425 HydrophobicContact CB-CB 4.01Å; Q413-V425 HydrophobicContact CB-CG1 4.29Å; Q413-V425 HydrophobicContact CG-CB 4.02Å; Q413-V425 PolarHBondContact NE2-O 3.46Å; Q413-V425 VanDerWaalsContact NE2-O 3.1Å; L416-V425 HydrophobicContact CB-CG2 3.98Å; L416-V425 HydrophobicContact CD1-CG2 3.99Å; E417-V425 HydrophobicContact CG-CG2 4.41Å; E417-V425 PolarHBondContact OE1-N 3.2Å; M423-V425 HydrophobicContact CG-CG2 4.33Å; V425-P427 VanDerWaalsContact O-CD 3.26Å; V425-P427 WeakPolarHBondContact O-CD 3.29Å
426	K	95.3	Very high	91.2	Very high	115 Å²	115	39.6 Å²	39.6	50%	0.5	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	98.3	176.2	-67	165.8	-178.7	153.4	0	109.3	S394 F395 L397 T428	S394-K426 VanDerWaalsContact OG-CE 3.24Å; S394-K426 WeakPolarHBondContact OG-CE 3.43Å; S394-K426 PolarHBondContact OG-NZ 3.31Å; F395-K426 WeakPolarHBondContact O-CB 3.22Å; F395-K426 PolarHBondContact O-N 2.83Å; L397-K426 PolarHBondContact N-O 3.05Å; K426-T428 PolarHBondContact O-N 3.45Å
427	P	96.4	Very high	90.7	Very high	38 Å²	38	44.7 Å²	44.7	25%	0.247	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.5	131.4	173.2	26.9	-34.9	0	0	0	109.4	I409 E410 Q413 V425	I409-P427 HydrophobicContact CB-CB 4.42Å; I409-P427 HydrophobicContact CD1-CB 3.56Å; I409-P427 HydrophobicContact CG1-CB 3.88Å; E410-P427 HydrophobicContact CG-CB 4.15Å; E410-P427 HydrophobicContact CG-CG 4.23Å; Q413-P427 VanDerWaalsContact OE1-CD 3.32Å; V425-P427 VanDerWaalsContact O-CD 3.26Å; V425-P427 WeakPolarHBondContact O-CD 3.29Å
428	T	95.8	Very high	90.6	Very high	39 Å²	39	43.9 Å²	43.9	24%	0.239	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	80.6	178.8	-63.2	0	0	0	0	109.6	E396 L397 M398 A399 K426 V430	E396-T428 HydrophobicContact CG-CG2 4.26Å; E396-T428 WeakPolarHBondContact CG-OG1 3.43Å; E396-T428 WeakPolarHBondContact OE1-CB 3.48Å; E396-T428 VanDerWaalsContact OE1-CG2 3.24Å; E396-T428 WeakPolarHBondContact OE1-CG2 3.47Å; L397-T428 PolarHBondContact O-N 3.4Å; M398-T428 WeakPolarHBondContact CA-O 3.45Å; M398-T428 WeakPolarHBondContact CG-O 3.41Å; A399-T428 PolarHBondContact N-O 2.79Å; A399-T428 VanDerWaalsContact N-O 3.12Å; K426-T428 PolarHBondContact O-N 3.45Å; T428-V430 HydrophobicContact CG2-CG1 3.95Å
429	P	93.2	Very high	90.5	Very high	49 Å²	49	38.6 Å²	38.6	32%	0.318	22%	0.223	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.7	127.8	171.4	28.8	-31.6	0	0	0	109.9	A399 D401 K406 I409	A399-P429 WeakPolarHBondContact O-CA 3.42Å; D401-P429 HydrophobicContact CB-CB 4.43Å; K406-P429 HydrophobicContact CG-CB 4.09Å; K406-P429 HydrophobicContact CG-CG 4.43Å; I409-P429 HydrophobicContact CD1-CB 4.41Å
430	V	90.1	Very high	90.1	Very high	21 Å²	21	40.9 Å²	40.9	13%	0.127	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135	157.9	176.7	-61.6	0	0	0	0	110.5	M398 A399 S400 D401 T428 V434 R435	M398-V430 HydrophobicContact CG-CG2 3.99Å; M398-V430 HydrophobicContact SD-CG2 3.98Å; A399-V430 PolarHBondContact O-N 3.03Å; S400-V430 CarbonylContact C-O 3.6Å; S400-V430 VanDerWaalsContact CA-O 3.29Å; S400-V430 WeakPolarHBondContact CA-O 3.44Å; D401-V430 PolarHBondContact N-O 3.33Å; T428-V430 HydrophobicContact CG2-CG1 3.95Å; V430-V434 HydrophobicContact CB-CB 4.2Å; V430-V434 HydrophobicContact CB-CG1 4.01Å; V430-V434 HydrophobicContact CG1-CG1 4.46Å; V430-V434 HydrophobicContact CG2-CB 4.23Å; V430-V434 HydrophobicContact CG2-CG1 4.1Å; V430-R435 HydrophobicContact CG2-CB 3.75Å; V430-R435 HydrophobicContact CG2-CG 4.46Å
431	P	84.6	Confident	89.8	Confident	50 Å²	50	44.4 Å²	44.4	33%	0.325	26%	0.264	S	S	.	.			trans	-52.6	148	175.2	-27.5	35.8	0	0	0	112.3	S433 V434 R435	P431-S433 VanDerWaalsContact C-N 3.26Å; P431-S433 PolarHBondContact O-N 3.12Å; P431-S433 VanDerWaalsContact O-N 3.16Å; P431-V434 HydrophobicContact CB-CG2 4.22Å; P431-V434 HydrophobicContact CG-CG2 4.34Å; P431-V434 PolarHBondContact O-N 3.39Å; P431-R435 PolarHBondContact O-N 3.4Å
432	F	83.9	Confident	89.8	Confident	16 Å²	16	40.8 Å²	40.8	7%	0.07	24%	0.243	C	C	.	.	H	α-helix	trans	-56.1	-39	-171.6	-176.3	-81.5	0	0	0	113.2	Q49 P52 D61 R435 L436	Q49-F432 VanDerWaalsContact CD-CD2 3.49Å; Q49-F432 VanDerWaalsContact NE2-CD2 3.32Å; P52-F432 HydrophobicContact CB-CD1 4.46Å; P52-F432 HydrophobicContact CG-CD1 3.5Å; P52-F432 VanDerWaalsContact CG-CD1 3.5Å; P52-F432 HydrophobicContact CG-CE1 3.74Å; D61-F432 HydrophobicContact CB-CE1 3.61Å; D61-F432 HydrophobicContact CB-CZ 3.5Å; D61-F432 VanDerWaalsContact CB-CZ 3.5Å; F432-R435 PolarHBondContact O-N 3.12Å; F432-L436 WeakPolarHBondContact O-CB 3.35Å; F432-L436 PolarHBondContact O-N 3.36Å
433	S	82.6	Confident	89.9	Confident	32 Å²	32	43.8 Å²	43.8	22%	0.224	25%	0.252	C	S	.	.	H	α-helix	trans	-60	-51.3	173.6	45.8	0	0	0	0	112	P431 R435 L436 D437	P431-S433 VanDerWaalsContact C-N 3.26Å; P431-S433 PolarHBondContact O-N 3.12Å; P431-S433 VanDerWaalsContact O-N 3.16Å; S433-R435 VanDerWaalsContact C-N 3.3Å; S433-R435 PolarHBondContact O-N 3.45Å; S433-L436 WeakPolarHBondContact O-CB 3.33Å; S433-L436 PolarHBondContact O-N 3Å; S433-L436 VanDerWaalsContact O-N 3.09Å; S433-D437 PolarHBondContact O-N 2.76Å
434	V	86.9	Confident	90	Very high	58 Å²	58	43.6 Å²	43.6	35%	0.352	25%	0.251	S	S	.	.	H	α-helix	trans	-61.1	-38.6	176.9	-179.3	0	0	0	0	111.6	V430 P431 R438	V430-V434 HydrophobicContact CB-CB 4.2Å; V430-V434 HydrophobicContact CB-CG1 4.01Å; V430-V434 HydrophobicContact CG1-CG1 4.46Å; V430-V434 HydrophobicContact CG2-CB 4.23Å; V430-V434 HydrophobicContact CG2-CG1 4.1Å; P431-V434 HydrophobicContact CB-CG2 4.22Å; P431-V434 HydrophobicContact CG-CG2 4.34Å; P431-V434 PolarHBondContact O-N 3.39Å; V434-R438 HydrophobicContact CG1-CG 4.36Å; V434-R438 WeakPolarHBondContact O-CB 3.48Å; V434-R438 WeakPolarHBondContact O-CG 3.33Å; V434-R438 PolarHBondContact O-N 3Å
435	R	91.3	Very high	90	Very high	15 Å²	15	43 Å²	43	6%	0.057	25%	0.245	C	C	.	.	H	α-helix	trans	-62.2	-46.1	173.6	-170	-165.7	57.6	62.3	15.4	110.7	M398 S400 V430 P431 F432 S433 S439 L447	M398-R435 HydrophobicContact CG-CG 4.42Å; M398-R435 HydrophobicContact SD-CB 4.38Å; M398-R435 HydrophobicContact SD-CG 3.93Å; S400-R435 PolarHBondContact OG-NE 3.03Å; S400-R435 VanDerWaalsContact OG-NE 3.17Å; V430-R435 HydrophobicContact CG2-CB 3.75Å; V430-R435 HydrophobicContact CG2-CG 4.46Å; P431-R435 PolarHBondContact O-N 3.4Å; F432-R435 PolarHBondContact O-N 3.12Å; S433-R435 VanDerWaalsContact C-N 3.3Å; S433-R435 PolarHBondContact O-N 3.45Å; R435-S439 WeakPolarHBondContact O-CB 3.11Å; R435-S439 PolarHBondContact O-N 2.83Å; R435-S439 PolarHBondContact O-OG 3.34Å; R435-L447 HydrophobicContact CG-CD1 3.79Å
436	L	84.3	Confident	90	Very high	22 Å²	22	42.9 Å²	42.9	12%	0.115	25%	0.245	C	C	.	.	H	α-helix	trans	-60	-54.4	178.3	-177.7	61.2	0	0	0	110.4	F432 S433 R438 S439 N440	F432-L436 WeakPolarHBondContact O-CB 3.35Å; F432-L436 PolarHBondContact O-N 3.36Å; S433-L436 WeakPolarHBondContact O-CB 3.33Å; S433-L436 PolarHBondContact O-N 3Å; S433-L436 VanDerWaalsContact O-N 3.09Å; L436-R438 PolarHBondContact O-N 3.29Å; L436-S439 PolarHBondContact O-N 2.94Å; L436-S439 PolarHBondContact O-OG 2.95Å; L436-N440 WeakPolarHBondContact O-CB 3.17Å; L436-N440 VanDerWaalsContact O-CG 3.31Å; L436-N440 PolarHBondContact O-N 3.48Å
437	D	85.1	Confident	90	Very high	108 Å²	108	37.5 Å²	37.5	58%	0.578	22%	0.221	S	C	*	.	H	α-helix	trans	-55.1	-52.5	179	-72.4	-25.3	0	0	0	112.7	S433 S439 N440 A441	S433-D437 PolarHBondContact O-N 2.76Å; D437-S439 PolarHBondContact O-N 3.01Å; D437-N440 PolarHBondContact O-N 3.34Å; D437-A441 WeakPolarHBondContact O-CB 3.3Å; D437-A441 PolarHBondContact O-N 3.02Å
438	R	92.4	Very high	90	Very high	52 Å²	52	36.1 Å²	36.1	20%	0.196	21%	0.212	C	C	.	.	H	α-helix	trans	-63.5	-41.1	178.7	-68.8	-177	73.9	-151.5	-5	111.6	E396 M398 V434 L436 N440 A441 G442 D443	E396-R438 IonicContact OE1-CZ 2.63Å; E396-R438 IonicContact OE1-NH1 3.75Å; E396-R438 PolarHBondContact OE1-NH1 3.46Å; E396-R438 IonicContact OE1-NH2 3.48Å; E396-R438 PolarHBondContact OE1-NH2 3.46Å; E396-R438 IonicContact OE2-CZ 3.64Å; E396-R438 IonicContact OE2-NH1 3.47Å; E396-R438 IonicContact OE2-NH2 3.9Å; E396-R438 PolarHBondContact OE2-NH2 3.23Å; M398-R438 HydrophobicContact CE-CB 3.79Å; M398-R438 VanDerWaalsContact CE-CZ 3.5Å; M398-R438 HydrophobicContact SD-CB 4.09Å; V434-R438 HydrophobicContact CG1-CG 4.36Å; V434-R438 WeakPolarHBondContact O-CB 3.48Å; V434-R438 WeakPolarHBondContact O-CG 3.33Å; V434-R438 PolarHBondContact O-N 3Å; L436-R438 PolarHBondContact O-N 3.29Å; R438-N440 PolarHBondContact O-N 3.47Å; R438-A441 PolarHBondContact O-N 2.7Å; R438-G442 PolarHBondContact O-N 2.99Å; R438-D443 HydrophobicContact CB-CB 4.29Å; R438-D443 IonicContact CZ-OD2 3.67Å; R438-D443 VanDerWaalsContact CZ-OD2 3.28Å; R438-D443 PolarHBondContact NE-O 2.87Å; R438-D443 IonicContact NE-OD2 3.63Å; R438-D443 PolarHBondContact NE-OD2 2.74Å; R438-D443 PolarHBondContact NH2-O 3.3Å; R438-D443 IonicContact NH2-OD2 2.73Å; R438-D443 PolarHBondContact NH2-OD2 3.06Å; R438-D443 PolarHBondContact O-N 3.46Å
439	S	89.9	Confident	89.7	Confident	0 Å²	0	34.7 Å²	34.7	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-64.7	-39.6	177.9	74	0	0	0	0	112.5	R308 R435 L436 D437 G442 R473	R308-S439 PolarHBondContact NH2-O 3.14Å; R435-S439 WeakPolarHBondContact O-CB 3.11Å; R435-S439 PolarHBondContact O-N 2.83Å; R435-S439 PolarHBondContact O-OG 3.34Å; L436-S439 PolarHBondContact O-N 2.94Å; L436-S439 PolarHBondContact O-OG 2.95Å; D437-S439 PolarHBondContact O-N 3.01Å; S439-G442 PolarHBondContact O-N 3.4Å; S439-R473 WeakPolarHBondContact O-CD 3.48Å; S439-R473 WeakPolarHBondContact OG-CD 3.27Å; S439-R473 PolarHBondContact OG-NE 3.12Å
440	N	83.8	Confident	89.5	Confident	50 Å²	50	32.9 Å²	32.9	27%	0.267	20%	0.196	S	C	.	.	H	α-helix	trans	-65.1	-49.3	175.4	-75.8	-13.6	0	0	0	111.2	E138 R308 L436 D437 R438 G442 R473	E138-N440 PolarHBondContact OE1-ND2 3.25Å; E138-N440 PolarHBondContact OE1-OD1 3.44Å; R308-N440 PolarHBondContact NH1-O 2.89Å; R308-N440 PolarHBondContact NH2-O 2.75Å; L436-N440 WeakPolarHBondContact O-CB 3.17Å; L436-N440 VanDerWaalsContact O-CG 3.31Å; L436-N440 PolarHBondContact O-N 3.48Å; D437-N440 PolarHBondContact O-N 3.34Å; R438-N440 PolarHBondContact O-N 3.47Å; N440-G442 PolarHBondContact O-N 2.91Å; N440-R473 PolarHBondContact OD1-NE 3.21Å; N440-R473 PolarHBondContact OD1-NH2 3.12Å; N440-R473 VanDerWaalsContact OD1-NH2 3.14Å
441	A	87.4	Confident	89.5	Confident	74 Å²	74	32.1 Å²	32.1	61%	0.612	19%	0.19	S	C	*	.	H	α-helix	trans	-58	-27.2	172.9	0	0	0	0	0	113	R308 D437 R438	R308-A441 PolarHBondContact NH1-O 3.06Å; D437-A441 WeakPolarHBondContact O-CB 3.3Å; D437-A441 PolarHBondContact O-N 3.02Å; R438-A441 PolarHBondContact O-N 2.7Å
442	G	88.4	Confident	89.7	Confident	11 Å²	11	30.8 Å²	30.8	11%	0.113	19%	0.185	C	C	.	.	T	Hydrogen-bonded Turn	trans	83.4	25.7	-174.9	0	0	0	0	0	113	N306 R438 S439 N440 F444	N306-G442 PolarHBondContact ND2-O 3.47Å; R438-G442 PolarHBondContact O-N 2.99Å; S439-G442 PolarHBondContact O-N 3.4Å; N440-G442 PolarHBondContact O-N 2.91Å; G442-F444 VanDerWaalsContact C-N 3.33Å; G442-F444 PolarHBondContact O-N 3.49Å
443	D	92.4	Very high	89.9	Confident	90 Å²	90	30.1 Å²	30.1	48%	0.481	18%	0.183	S	C	.	.			trans	-92.2	63.3	177.1	-175	54.7	0	0	0	110.5	M398 R438	M398-D443 WeakPolarHBondContact CE-O 3.49Å; R438-D443 HydrophobicContact CB-CB 4.29Å; R438-D443 IonicContact CZ-OD2 3.67Å; R438-D443 VanDerWaalsContact CZ-OD2 3.28Å; R438-D443 PolarHBondContact NE-O 2.87Å; R438-D443 IonicContact NE-OD2 3.63Å; R438-D443 PolarHBondContact NE-OD2 2.74Å; R438-D443 PolarHBondContact NH2-O 3.3Å; R438-D443 IonicContact NH2-OD2 2.73Å; R438-D443 PolarHBondContact NH2-OD2 3.06Å; R438-D443 PolarHBondContact O-N 3.46Å
444	F	94.8	Very high	89.8	Confident	5 Å²	5	29 Å²	29	2%	0.022	17%	0.174	C	C	.	.			trans	-151.5	154.7	176.3	68	-85.6	0	0	0	109.5	E304 N306 M398 G442 L447 R473	E304-F444 HydrophobicContact CG-CE2 4.44Å; E304-F444 HydrophobicContact CG-CZ 4.46Å; N306-F444 HydrophobicContact CB-CD2 3.98Å; N306-F444 HydrophobicContact CB-CE2 3.85Å; N306-F444 HydrophobicContact CB-CG 4.44Å; N306-F444 HydrophobicContact CB-CZ 4.19Å; N306-F444 WeakPolarHBondContact CB-O 3.1Å; N306-F444 PolarHBondContact ND2-O 2.95Å; M398-F444 HydrophobicContact CE-CB 3.54Å; G442-F444 VanDerWaalsContact C-N 3.33Å; G442-F444 PolarHBondContact O-N 3.49Å; F444-L447 HydrophobicContact CD2-CB 3.66Å; F444-L447 HydrophobicContact CE2-CB 3.76Å; F444-L447 HydrophobicContact CG-CB 4.27Å; F444-L447 HydrophobicContact CZ-CB 4.46Å; F444-R473 HydrophobicContact CE1-CB 4.03Å; F444-R473 HydrophobicContact CZ-CB 4.02Å
445	D	95.3	Very high	89.6	Confident	55 Å²	55	26.4 Å²	26.4	29%	0.294	16%	0.158	S	C	.	.	S	Bend	trans	-93.3	-53.9	165.7	-65.4	-43.3	0	0	0	110	N306 F395 E396	N306-D445 WeakPolarHBondContact CB-O 3.13Å; N306-D445 PolarHBondContact N-O 2.82Å; F395-D445 WeakPolarHBondContact CA-OD2 3.22Å; F395-D445 HydrophobicContact CB-CB 3.79Å; F395-D445 HydrophobicContact CD2-CB 4.46Å; E396-D445 PolarHBondContact N-OD2 3.36Å
446	V	97.2	Very high	89.2	Confident	1 Å²	1	27.5 Å²	27.5	1%	0.006	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	135.7	172.2	-172.2	0	0	0	0	109.6	L303 E304 Y305 W314 F395 E396 L397 M398	L303-V446 HydrophobicContact CB-CG1 3.99Å; L303-V446 HydrophobicContact CD1-CG1 4.39Å; L303-V446 HydrophobicContact CD2-CG1 4.22Å; L303-V446 HydrophobicContact CG-CG1 4.43Å; E304-V446 WeakPolarHBondContact O-CA 3.35Å; Y305-V446 HydrophobicContact CD1-CG1 3.99Å; Y305-V446 HydrophobicContact CD1-CG2 3.87Å; Y305-V446 HydrophobicContact CE1-CG1 4.16Å; Y305-V446 HydrophobicContact CE1-CG2 4.41Å; W314-V446 HydrophobicContact CD2-CG2 4.15Å; W314-V446 VanDerWaalsContact CE2-CG2 3.46Å; W314-V446 HydrophobicContact CE3-CG2 4.49Å; W314-V446 HydrophobicContact CH2-CG2 3.67Å; W314-V446 HydrophobicContact CZ2-CG2 3.21Å; W314-V446 HydrophobicContact CZ3-CG2 4.27Å; F395-V446 HydrophobicContact CD2-CB 4.02Å; F395-V446 HydrophobicContact CD2-CG2 3.49Å; F395-V446 VanDerWaalsContact CD2-CG2 3.49Å; F395-V446 HydrophobicContact CE2-CB 3.83Å; F395-V446 HydrophobicContact CE2-CG2 3.43Å; F395-V446 VanDerWaalsContact CE2-CG2 3.43Å; F395-V446 HydrophobicContact CG-CG2 4.4Å; F395-V446 HydrophobicContact CZ-CG2 4.3Å; E396-V446 PolarHBondContact O-N 3.14Å; L397-V446 WeakPolarHBondContact CA-O 3.38Å; L397-V446 HydrophobicContact CD1-CB 4.07Å; L397-V446 HydrophobicContact CD1-CG1 3.8Å; M398-V446 PolarHBondContact N-O 3.36Å
447	L	95.5	Very high	89.3	Confident	1 Å²	1	27.6 Å²	27.6	1%	0.005	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	124.4	178.7	176	66.7	0	0	0	109.2	L303 E304 M398 R435 F444 G449	L303-L447 WeakPolarHBondContact CA-O 3.3Å; E304-L447 HydrophobicContact CB-CB 4.42Å; E304-L447 PolarHBondContact N-O 2.95Å; E304-L447 PolarHBondContact O-N 3.43Å; M398-L447 HydrophobicContact CB-CD1 4.38Å; M398-L447 HydrophobicContact SD-CD1 4.48Å; R435-L447 HydrophobicContact CG-CD1 3.79Å; F444-L447 HydrophobicContact CD2-CB 3.66Å; F444-L447 HydrophobicContact CE2-CB 3.76Å; F444-L447 HydrophobicContact CG-CB 4.27Å; F444-L447 HydrophobicContact CZ-CB 4.46Å; L447-G449 PolarHBondContact O-N 2.79Å
448	L	95.6	Very high	89.4	Confident	9 Å²	9	22.5 Å²	22.5	5%	0.047	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	101.4	157.1	176.7	62.1	0	0	0	107.7	L303 M398 A399 V408 I409 L519	L303-L448 HydrophobicContact CD2-CB 4.28Å; L303-L448 HydrophobicContact CD2-CD1 4.16Å; M398-L448 PolarHBondContact O-N 3.35Å; A399-L448 HydrophobicContact CB-CB 3.89Å; A399-L448 HydrophobicContact CB-CD2 3.94Å; A399-L448 HydrophobicContact CB-CG 4.38Å; V408-L448 HydrophobicContact CB-CD2 3.61Å; V408-L448 HydrophobicContact CG1-CD1 3.76Å; V408-L448 HydrophobicContact CG1-CD2 3.49Å; V408-L448 VanDerWaalsContact CG1-CD2 3.49Å; V408-L448 HydrophobicContact CG1-CG 4.3Å; V408-L448 HydrophobicContact CG2-CD2 4.45Å; I409-L448 HydrophobicContact CG2-CB 3.95Å; I409-L448 HydrophobicContact CG2-CD2 3.69Å; I409-L448 HydrophobicContact CG2-CG 4.46Å; L448-L519 HydrophobicContact CD1-CD1 3.44Å; L448-L519 VanDerWaalsContact CD1-CD1 3.44Å
449	G	89.3	Confident	89.2	Confident	9 Å²	9	20.1 Å²	20.1	9%	0.093	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	-170.2	176.4	0	0	0	0	0	111.6	S301 Y302 L447	S301-G449 WeakPolarHBondContact CA-O 3.42Å; Y302-G449 PolarHBondContact N-O 3.14Å; Y302-G449 CarbonylContact O-C 3.59Å; Y302-G449 PolarHBondContact O-N 2.83Å; Y302-G449 VanDerWaalsContact O-O 3.09Å; L447-G449 PolarHBondContact O-N 2.79Å
450	G	89.4	Confident	89.2	Confident	12 Å²	12	20.1 Å²	20.1	12%	0.124	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	173.1	140.4	172.5	0	0	0	0	0	111.3	T300	T300-G450 CarbonylContact O-C 3.55Å; T300-G450 WeakPolarHBondContact O-CA 3.36Å
451	W	88.8	Confident	89.6	Confident	5 Å²	5	17.8 Å²	17.8	2%	0.019	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	131.3	-178	-174.5	-104	0	0	0	110.9	Y139 Y141 R299 T300 Y302 D454 S460 F461 L464 Y471	Y139-W451 HydrophobicContact CE1-CH2 4.14Å; Y139-W451 AromaticContact CE2-CH2 3.75Å; Y139-W451 HydrophobicContact CE2-CH2 3.75Å; Y139-W451 HydrophobicContact CE2-CZ3 4.12Å; Y139-W451 AromaticContact CZ-CH2 3.42Å; Y139-W451 VanDerWaalsContact CZ-CH2 3.42Å; Y139-W451 AromaticContact CZ-CZ3 3.96Å; Y139-W451 WeakPolarHBondContact OH-CH2 3.28Å; Y139-W451 WeakPolarHBondContact OH-CZ3 3.47Å; Y141-W451 WeakPolarHBondContact OH-CZ2 3.44Å; R299-W451 CarbonylContact C-O 3.55Å; R299-W451 WeakPolarHBondContact CA-O 3.41Å; R299-W451 WeakPolarHBondContact CG-O 3.13Å; T300-W451 PolarHBondContact N-O 2.9Å; T300-W451 PolarHBondContact O-N 2.98Å; Y302-W451 HydrophobicContact CE1-CB 4.08Å; W451-D454 VanDerWaalsContact CZ2-OD2 3.29Å; W451-D454 WeakPolarHBondContact CZ2-OD2 3.32Å; W451-S460 PolarHBondContact NE1-O 3.01Å; W451-F461 HydrophobicContact CB-CD1 4.33Å; W451-F461 HydrophobicContact CB-CE1 3.94Å; W451-F461 AromaticContact CD1-CD1 3.89Å; W451-F461 AromaticContact CD1-CE1 3.69Å; W451-F461 AromaticContact CD1-CZ 3.89Å; W451-F461 HydrophobicContact CG-CD1 4.5Å; W451-F461 HydrophobicContact CG-CE1 4.23Å; W451-F461 VanDerWaalsContact O-CE1 3.25Å; W451-F461 WeakPolarHBondContact O-CE1 3.33Å; W451-F461 WeakPolarHBondContact O-CZ 3.37Å; W451-L464 HydrophobicContact CB-CD1 3.76Å; W451-L464 HydrophobicContact CD2-CD1 3.65Å; W451-L464 HydrophobicContact CD2-CD2 3.9Å; W451-L464 HydrophobicContact CD2-CG 4.41Å; W451-L464 HydrophobicContact CE3-CD1 4.36Å; W451-L464 HydrophobicContact CE3-CD2 4.22Å; W451-L464 HydrophobicContact CG-CD1 3.37Å; W451-L464 HydrophobicContact CG-CD2 4.48Å; W451-L464 HydrophobicContact CH2-CD2 3.9Å; W451-L464 HydrophobicContact CZ2-CD2 3.59Å; W451-L464 HydrophobicContact CZ3-CD2 4.23Å; W451-Y471 HydrophobicContact CE3-CD1 4.13Å; W451-Y471 HydrophobicContact CE3-CD2 4.04Å; W451-Y471 AromaticContact CE3-CE1 3.72Å; W451-Y471 HydrophobicContact CE3-CE1 3.72Å; W451-Y471 AromaticContact CE3-CE2 3.57Å; W451-Y471 HydrophobicContact CE3-CE2 3.57Å; W451-Y471 HydrophobicContact CE3-CG 4.29Å; W451-Y471 AromaticContact CE3-CZ 3.39Å; W451-Y471 HydrophobicContact CH2-CD2 4.39Å; W451-Y471 HydrophobicContact CZ3-CD1 4.33Å; W451-Y471 AromaticContact CZ3-CD2 3.5Å; W451-Y471 HydrophobicContact CZ3-CD2 3.5Å; W451-Y471 HydrophobicContact CZ3-CE1 4.2Å; W451-Y471 AromaticContact CZ3-CE2 3.3Å; W451-Y471 HydrophobicContact CZ3-CE2 3.3Å; W451-Y471 HydrophobicContact CZ3-CG 4.01Å; W451-Y471 AromaticContact CZ3-CZ 3.69Å
452	G	88.8	Confident	89.8	Confident	21 Å²	21	14.2 Å²	14.2	22%	0.216	9%	0.094	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97	137.9	168	0	0	0	0	0	109	D454	G452-D454 PolarHBondContact O-N 2.89Å
453	A	88	Confident	89.8	Confident	2 Å²	2	15.1 Å²	15.1	2%	0.017	10%	0.096	C	C	.	.			trans	-63.7	121.6	-177.6	0	0	0	0	0	111.4	A298 M352 Y455 F461 A540 G541	A298-A453 HydrophobicContact CB-CB 4.05Å; A298-A453 PolarHBondContact O-N 3.48Å; M352-A453 HydrophobicContact SD-CB 3.39Å; M352-A453 WeakPolarHBondContact SD-CB 3.43Å; A453-Y455 PolarHBondContact O-N 2.84Å; A453-F461 HydrophobicContact CB-CE2 3.73Å; A453-F461 HydrophobicContact CB-CZ 4.34Å; A453-A540 HydrophobicContact CB-CB 3.85Å; A453-A540 CarbonylContact O-C 3.51Å; A453-A540 WeakPolarHBondContact O-CA 3.5Å; A453-A540 WeakPolarHBondContact O-CB 3.29Å; A453-G541 PolarHBondContact O-N 3.47Å
454	D	81.8	Confident	89.6	Confident	9 Å²	9	10.8 Å²	10.8	5%	0.048	7%	0.073	C	C	.	.	S	Bend	trans	-65.3	-30.7	171	-67.8	-32.9	0	0	0	112	Y139 F189 W451 G452 S460 G541	Y139-D454 WeakPolarHBondContact CE1-OD1 3.46Å; F189-D454 HydrophobicContact CD2-CB 4.17Å; F189-D454 HydrophobicContact CE2-CB 3.82Å; F189-D454 WeakPolarHBondContact CE2-OD1 3.3Å; F189-D454 HydrophobicContact CZ-CB 4.18Å; F189-D454 WeakPolarHBondContact CZ-OD1 3.36Å; W451-D454 VanDerWaalsContact CZ2-OD2 3.29Å; W451-D454 WeakPolarHBondContact CZ2-OD2 3.32Å; G452-D454 PolarHBondContact O-N 2.89Å; D454-S460 PolarHBondContact N-OG 3.29Å; D454-G541 VanDerWaalsContact O-CA 3.32Å; D454-G541 WeakPolarHBondContact O-CA 3.38Å; D454-G541 PolarHBondContact O-N 3.36Å
455	Y	81.3	Confident	89.5	Confident	3 Å²	3	10.6 Å²	10.6	1%	0.012	7%	0.072	C	C	.	.	S	Bend	trans	-149.5	153.4	-177.9	55.7	-87.7	0	0	0	109.9	L142 Y182 L186 A453 D457 S459 S460 D463	L142-Y455 HydrophobicContact CD2-CD1 4.48Å; L142-Y455 HydrophobicContact CD2-CE1 3.84Å; Y182-Y455 HydrophobicContact CD1-CD2 4.47Å; Y182-Y455 HydrophobicContact CD1-CE2 4.07Å; Y182-Y455 HydrophobicContact CD2-CD1 4.41Å; Y182-Y455 AromaticContact CD2-CD2 3.5Å; Y182-Y455 HydrophobicContact CD2-CD2 3.5Å; Y182-Y455 VanDerWaalsContact CD2-CD2 3.5Å; Y182-Y455 HydrophobicContact CD2-CE1 4.31Å; Y182-Y455 AromaticContact CD2-CE2 3.32Å; Y182-Y455 HydrophobicContact CD2-CE2 3.32Å; Y182-Y455 HydrophobicContact CD2-CG 4.06Å; Y182-Y455 AromaticContact CD2-CZ 3.78Å; Y182-Y455 HydrophobicContact CE1-CE2 4.25Å; Y182-Y455 HydrophobicContact CE2-CD2 4.15Å; Y182-Y455 HydrophobicContact CE2-CE1 4.18Å; Y182-Y455 AromaticContact CE2-CE2 3.5Å; Y182-Y455 HydrophobicContact CE2-CE2 3.5Å; Y182-Y455 AromaticContact CE2-CZ 3.53Å; Y182-Y455 AromaticContact CG-CD2 3.68Å; Y182-Y455 HydrophobicContact CG-CD2 3.68Å; Y182-Y455 AromaticContact CG-CE2 3.62Å; Y182-Y455 HydrophobicContact CG-CE2 3.62Å; Y182-Y455 AromaticContact CZ-CE2 3.97Å; L186-Y455 HydrophobicContact CD2-CD1 3.67Å; L186-Y455 HydrophobicContact CD2-CE1 4.13Å; L186-Y455 HydrophobicContact CD2-CG 4.36Å; A453-Y455 PolarHBondContact O-N 2.84Å; Y455-D457 HydrophobicContact CD2-CB 3.73Å; Y455-D457 HydrophobicContact CE2-CB 3.82Å; Y455-D457 PolarHBondContact O-N 3.5Å; Y455-S459 WeakPolarHBondContact CE2-OG 3.35Å; Y455-S459 PolarHBondContact OH-OG 3.13Å; Y455-S460 PolarHBondContact OH-N 3.47Å; Y455-D463 PolarHBondContact OH-OD2 2.68Å
456	A	83.1	Confident	89.2	Confident	38 Å²	38	10 Å²	10	31%	0.314	7%	0.07	S	C	.	.	S	Bend	trans	-79.7	46.8	-166.3	0	0	0	0	0	115.1	M352 S353	M352-A456 HydrophobicContact CG-CB 4.43Å; S353-A456 PolarHBondContact OG-O 3.35Å
457	D	86.4	Confident	88.8	Confident	25 Å²	25	13.5 Å²	13.5	13%	0.134	9%	0.092	C	C	.	.	S	Bend	trans	-133.7	145.8	-178.8	-172.1	97.9	0	0	0	111.3	M352 S353 Y455 S459 S460 R499	M352-D457 VanDerWaalsContact CE-C 3.46Å; M352-D457 WeakPolarHBondContact CE-O 3.38Å; S353-D457 WeakPolarHBondContact OG-CA 3.09Å; Y455-D457 HydrophobicContact CD2-CB 3.73Å; Y455-D457 HydrophobicContact CE2-CB 3.82Å; Y455-D457 PolarHBondContact O-N 3.5Å; D457-S459 PolarHBondContact O-N 3.49Å; D457-S459 VanDerWaalsContact O-N 3.12Å; D457-S459 PolarHBondContact OD2-N 3Å; D457-S459 PolarHBondContact OD2-OG 2.68Å; D457-S460 WeakPolarHBondContact O-CB 3.36Å; D457-S460 PolarHBondContact O-N 3.42Å; D457-S460 VanDerWaalsContact O-N 3.12Å; D457-R499 IonicContact OD1-CZ 2.68Å; D457-R499 IonicContact OD1-NH1 3.72Å; D457-R499 PolarHBondContact OD1-NH1 3.07Å; D457-R499 IonicContact OD1-NH2 3.8Å; D457-R499 IonicContact OD2-CZ 3.84Å; D457-R499 IonicContact OD2-NH1 3.8Å; D457-R499 PolarHBondContact OD2-NH1 3.25Å; D457-R499 IonicContact OD2-NH2 2.77Å; D457-R499 PolarHBondContact OD2-NH2 3.16Å
458	P	87.9	Confident	88.1	Confident	1 Å²	1	16 Å²	16	1%	0.006	12%	0.117	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.8	-23.3	-178.7	-22.8	34.6	0	0	0	114.4	V348 S353 F362 S460 F461 T462 W500 L503	V348-P458 HydrophobicContact CG1-CB 4.28Å; V348-P458 HydrophobicContact CG2-CB 4.19Å; S353-P458 WeakPolarHBondContact OG-CD 3.27Å; F362-P458 HydrophobicContact CB-CG 4.48Å; F362-P458 HydrophobicContact CD2-CB 4.02Å; F362-P458 HydrophobicContact CD2-CG 3.46Å; F362-P458 VanDerWaalsContact CD2-CG 3.46Å; F362-P458 HydrophobicContact CE1-CB 4.31Å; F362-P458 HydrophobicContact CE2-CB 3.76Å; F362-P458 HydrophobicContact CE2-CG 3.67Å; F362-P458 HydrophobicContact CG-CB 4.41Å; F362-P458 HydrophobicContact CG-CG 3.91Å; F362-P458 HydrophobicContact CZ-CB 3.9Å; F362-P458 HydrophobicContact CZ-CG 4.27Å; P458-S460 PolarHBondContact O-N 2.82Å; P458-F461 PolarHBondContact O-N 3.42Å; P458-T462 PolarHBondContact O-N 3.47Å; P458-T462 VanDerWaalsContact O-N 3.11Å; P458-W500 HydrophobicContact CG-CZ3 4.36Å; P458-L503 HydrophobicContact CB-CB 4.42Å; P458-L503 HydrophobicContact CB-CD1 4.22Å; P458-L503 HydrophobicContact CG-CD1 4.46Å
459	S	89.1	Confident	87.5	Confident	2 Å²	2	16.6 Å²	16.6	1%	0.014	12%	0.12	C	C	.	.	H	α-helix	trans	-63.4	-28.5	177.2	70.6	0	0	0	0	113.1	Y455 D457 F461 T462 D463 R499	Y455-S459 WeakPolarHBondContact CE2-OG 3.35Å; Y455-S459 PolarHBondContact OH-OG 3.13Å; D457-S459 PolarHBondContact O-N 3.49Å; D457-S459 VanDerWaalsContact O-N 3.12Å; D457-S459 PolarHBondContact OD2-N 3Å; D457-S459 PolarHBondContact OD2-OG 2.68Å; S459-F461 CarbonylContact O-C 3.59Å; S459-F461 PolarHBondContact O-N 3.37Å; S459-T462 WeakPolarHBondContact CA-OG1 3.34Å; S459-T462 PolarHBondContact O-N 3.14Å; S459-T462 VanDerWaalsContact O-N 3.13Å; S459-D463 WeakPolarHBondContact CB-OD1 3.2Å; S459-D463 VanDerWaalsContact O-CB 3.29Å; S459-D463 WeakPolarHBondContact O-CB 3.44Å; S459-D463 PolarHBondContact O-N 3.02Å; S459-R499 PolarHBondContact OG-NH2 2.98Å
460	S	89.3	Confident	86.9	Confident	0 Å²	0	18.4 Å²	18.4	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-55.5	-22.6	172.9	-170.5	0	0	0	0	112.7	W451 D454 Y455 D457 P458	W451-S460 PolarHBondContact NE1-O 3.01Å; D454-S460 PolarHBondContact N-OG 3.29Å; Y455-S460 PolarHBondContact OH-N 3.47Å; D457-S460 WeakPolarHBondContact O-CB 3.36Å; D457-S460 PolarHBondContact O-N 3.42Å; D457-S460 VanDerWaalsContact O-N 3.12Å; P458-S460 PolarHBondContact O-N 2.82Å
461	F	91.6	Very high	86.6	Confident	0 Å²	0	18.8 Å²	18.8	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-99.5	-42.8	170.6	-75	-90.3	0	0	0	113.9	A298 L347 V348 P349 M352 W451 A453 P458 S459 D463 L464	A298-F461 WeakPolarHBondContact O-CZ 3.27Å; L347-F461 HydrophobicContact CD1-CD1 4.28Å; L347-F461 HydrophobicContact CD2-CB 3.95Å; L347-F461 WeakPolarHBondContact CD2-O 3.46Å; L347-F461 HydrophobicContact CG-CB 4Å; L347-F461 HydrophobicContact CG-CD1 4.01Å; L347-F461 HydrophobicContact CG-CG 4.43Å; L347-F461 WeakPolarHBondContact O-CD1 3.4Å; V348-F461 HydrophobicContact CG2-CB 4.01Å; V348-F461 HydrophobicContact CG2-CG 4.45Å; P349-F461 HydrophobicContact CG-CE1 4.45Å; P349-F461 HydrophobicContact CG-CE2 3.61Å; P349-F461 HydrophobicContact CG-CZ 3.59Å; M352-F461 HydrophobicContact CE-CD2 4.04Å; M352-F461 HydrophobicContact CE-CE2 4.12Å; M352-F461 HydrophobicContact SD-CD2 4.25Å; M352-F461 HydrophobicContact SD-CE2 3.74Å; W451-F461 HydrophobicContact CB-CD1 4.33Å; W451-F461 HydrophobicContact CB-CE1 3.94Å; W451-F461 AromaticContact CD1-CD1 3.89Å; W451-F461 AromaticContact CD1-CE1 3.69Å; W451-F461 AromaticContact CD1-CZ 3.89Å; W451-F461 HydrophobicContact CG-CD1 4.5Å; W451-F461 HydrophobicContact CG-CE1 4.23Å; W451-F461 VanDerWaalsContact O-CE1 3.25Å; W451-F461 WeakPolarHBondContact O-CE1 3.33Å; W451-F461 WeakPolarHBondContact O-CZ 3.37Å; A453-F461 HydrophobicContact CB-CE2 3.73Å; A453-F461 HydrophobicContact CB-CZ 4.34Å; P458-F461 PolarHBondContact O-N 3.42Å; S459-F461 CarbonylContact O-C 3.59Å; S459-F461 PolarHBondContact O-N 3.37Å; F461-D463 VanDerWaalsContact C-N 3.34Å; F461-D463 PolarHBondContact O-N 2.82Å; F461-L464 WeakPolarHBondContact O-CB 3.44Å; F461-L464 WeakPolarHBondContact O-CD1 3.43Å; F461-L464 WeakPolarHBondContact O-CG 3.28Å
462	T	90.9	Very high	86.6	Confident	0 Å²	0	18.6 Å²	18.6	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-70.2	-33.7	-172.7	58.7	0	0	0	0	112.7	P458 S459 L464 F465 Y481 L503 A506	P458-T462 PolarHBondContact O-N 3.47Å; P458-T462 VanDerWaalsContact O-N 3.11Å; S459-T462 WeakPolarHBondContact CA-OG1 3.34Å; S459-T462 PolarHBondContact O-N 3.14Å; S459-T462 VanDerWaalsContact O-N 3.13Å; T462-L464 PolarHBondContact O-N 3.28Å; T462-F465 PolarHBondContact O-N 3.47Å; T462-Y481 VanDerWaalsContact C-OH 3.32Å; T462-Y481 WeakPolarHBondContact CA-OH 3.47Å; T462-Y481 WeakPolarHBondContact O-CE1 3.35Å; T462-Y481 PolarHBondContact O-OH 3.08Å; T462-L503 HydrophobicContact CG2-CD2 4.09Å; T462-L503 VanDerWaalsContact OG1-CD2 3.29Å; T462-L503 WeakPolarHBondContact OG1-CD2 3.47Å; T462-A506 HydrophobicContact CG2-CB 4.28Å
463	D	88.9	Confident	86.6	Confident	29 Å²	29	17.7 Å²	17.7	16%	0.155	12%	0.119	C	C	.	.	G	3₁₀ helix	trans	-63.3	-29.1	-176.3	-59.8	-7.7	0	0	0	111.8	Y141 Y455 S459 F461 F465 V466 N469 V485	Y141-D463 HydrophobicContact CE2-CB 4.35Å; Y455-D463 PolarHBondContact OH-OD2 2.68Å; S459-D463 WeakPolarHBondContact CB-OD1 3.2Å; S459-D463 VanDerWaalsContact O-CB 3.29Å; S459-D463 WeakPolarHBondContact O-CB 3.44Å; S459-D463 PolarHBondContact O-N 3.02Å; F461-D463 VanDerWaalsContact C-N 3.34Å; F461-D463 PolarHBondContact O-N 2.82Å; D463-F465 PolarHBondContact O-N 3.24Å; D463-V466 PolarHBondContact O-N 3.27Å; D463-N469 PolarHBondContact O-ND2 3.35Å; D463-V485 WeakPolarHBondContact OD1-CG1 3.47Å
464	L	89.2	Confident	86.7	Confident	0 Å²	0	17.6 Å²	17.6	0%	0	12%	0.118	C	C	.	.	G	3₁₀ helix	trans	-58.5	-31.2	-178.3	-54.8	174.6	0	0	0	113.9	W451 F461 T462 N469 Y471 N472	W451-L464 HydrophobicContact CB-CD1 3.76Å; W451-L464 HydrophobicContact CD2-CD1 3.65Å; W451-L464 HydrophobicContact CD2-CD2 3.9Å; W451-L464 HydrophobicContact CD2-CG 4.41Å; W451-L464 HydrophobicContact CE3-CD1 4.36Å; W451-L464 HydrophobicContact CE3-CD2 4.22Å; W451-L464 HydrophobicContact CG-CD1 3.37Å; W451-L464 HydrophobicContact CG-CD2 4.48Å; W451-L464 HydrophobicContact CH2-CD2 3.9Å; W451-L464 HydrophobicContact CZ2-CD2 3.59Å; W451-L464 HydrophobicContact CZ3-CD2 4.23Å; F461-L464 WeakPolarHBondContact O-CB 3.44Å; F461-L464 WeakPolarHBondContact O-CD1 3.43Å; F461-L464 WeakPolarHBondContact O-CG 3.28Å; T462-L464 PolarHBondContact O-N 3.28Å; L464-N469 WeakPolarHBondContact O-CB 3.27Å; L464-Y471 HydrophobicContact CD2-CD1 4.39Å; L464-Y471 HydrophobicContact CD2-CG 4.4Å; L464-N472 WeakPolarHBondContact O-CB 3.45Å; L464-N472 PolarHBondContact O-N 3.33Å
465	F	91.4	Very high	87.2	Confident	1 Å²	1	22 Å²	22	0%	0.004	13%	0.134	C	C	.	.	G	3₁₀ helix	trans	-108.1	5.7	-171.8	-66.7	-75.3	0	0	0	113.8	Y302 L347 T462 D463 N472 W476 Y481 I510 V516	Y302-F465 AromaticContact CE2-CZ 3.83Å; Y302-F465 HydrophobicContact CE2-CZ 3.83Å; Y302-F465 AromaticContact CZ-CZ 3.75Å; L347-F465 HydrophobicContact CD1-CD2 4.47Å; L347-F465 HydrophobicContact CD1-CE2 3.77Å; L347-F465 HydrophobicContact CD2-CD2 3.67Å; L347-F465 HydrophobicContact CD2-CE2 3.8Å; L347-F465 HydrophobicContact CG-CE2 4.45Å; T462-F465 PolarHBondContact O-N 3.47Å; D463-F465 PolarHBondContact O-N 3.24Å; F465-N472 PolarHBondContact O-ND2 2.76Å; F465-N472 VanDerWaalsContact O-ND2 3.14Å; F465-W476 HydrophobicContact CB-CE3 4.02Å; F465-W476 HydrophobicContact CB-CZ3 4.11Å; F465-Y481 HydrophobicContact CB-CE1 3.99Å; F465-I510 HydrophobicContact CB-CD1 3.57Å; F465-I510 HydrophobicContact CD1-CD1 3.92Å; F465-I510 HydrophobicContact CD2-CD1 3.56Å; F465-I510 HydrophobicContact CE2-CD1 4.25Å; F465-I510 HydrophobicContact CG-CD1 3.37Å; F465-V516 HydrophobicContact CD1-CG1 4.31Å; F465-V516 HydrophobicContact CE1-CG1 3.4Å; F465-V516 HydrophobicContact CE2-CG1 4.47Å; F465-V516 HydrophobicContact CZ-CG1 3.5Å; F465-V516 VanDerWaalsContact CZ-CG1 3.5Å; F465-V516 HydrophobicContact CZ-CG2 4.25Å
466	V	90.6	Very high	87.7	Confident	43 Å²	43	22.3 Å²	22.3	26%	0.261	14%	0.136	S	C	.	.	S	Bend	trans	-58.1	141	168.8	176.7	0	0	0	0	109.6	D463 G468 N469 N472 Y481 D482 V485	D463-V466 PolarHBondContact O-N 3.27Å; V466-G468 PolarHBondContact O-N 3.35Å; V466-N469 PolarHBondContact O-N 2.87Å; V466-N469 VanDerWaalsContact O-N 3.14Å; V466-N472 PolarHBondContact O-ND2 2.98Å; V466-Y481 HydrophobicContact CG2-CE1 4.39Å; V466-D482 WeakPolarHBondContact CA-OD1 3.37Å; V466-V485 HydrophobicContact CG2-CB 3.9Å; V466-V485 HydrophobicContact CG2-CG1 3.63Å; V466-V485 HydrophobicContact CG2-CG2 4.21Å
467	T	88.5	Confident	88.2	Confident	74 Å²	74	23.9 Å²	23.9	45%	0.454	14%	0.144	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.9	105.1	-178	-62	0	0	0	0	111.2	S477 D482	T467-S477 WeakPolarHBondContact OG1-CB 3.33Å; T467-D482 WeakPolarHBondContact CB-OD2 3.49Å; T467-D482 PolarHBondContact N-OD1 2.55Å; T467-D482 PolarHBondContact OG1-OD1 2.77Å; T467-D482 PolarHBondContact OG1-OD2 2.92Å
468	G	79.9	Confident	88.5	Confident	52 Å²	52	23.9 Å²	23.9	54%	0.536	14%	0.144	S	C	.	.	T	Hydrogen-bonded Turn	trans	121	-21.2	177.2	0	0	0	0	0	114.8	V466 R475	V466-G468 PolarHBondContact O-N 3.35Å; G468-R475 PolarHBondContact O-NH1 3.39Å
469	N	83.5	Confident	88.7	Confident	23 Å²	23	30.5 Å²	30.5	12%	0.123	18%	0.175	C	C	.	.			trans	-50.1	140.5	-179.9	-171.7	-49.8	0	0	0	111.8	D463 L464 V466 Y471 N472 R475	D463-N469 PolarHBondContact O-ND2 3.35Å; L464-N469 WeakPolarHBondContact O-CB 3.27Å; V466-N469 PolarHBondContact O-N 2.87Å; V466-N469 VanDerWaalsContact O-N 3.14Å; N469-Y471 VanDerWaalsContact C-N 3.32Å; N469-Y471 PolarHBondContact O-N 2.82Å; N469-Y471 PolarHBondContact OD1-N 3.38Å; N469-N472 HydrophobicContact CB-CB 4.22Å; N469-N472 WeakPolarHBondContact O-CB 3.36Å; N469-N472 PolarHBondContact O-N 3.1Å; N469-R475 PolarHBondContact O-NH1 2.87Å
470	S	77	Confident	88.9	Confident	47 Å²	47	36.4 Å²	36.4	33%	0.329	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.2	-44.6	176.4	38.1	0	0	0	0	112.6	E138 N472	E138-S470 PolarHBondContact O-OG 2.88Å; S470-N472 VanDerWaalsContact C-N 3.32Å; S470-N472 PolarHBondContact O-N 2.94Å
471	Y	81.9	Confident	89.2	Confident	19 Å²	19	36.4 Å²	36.4	8%	0.075	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.6	-12.6	-176.9	-153.5	-87	0	0	0	113.7	Y302 W451 L464 N469 R473	Y302-Y471 WeakPolarHBondContact OH-CE1 3.38Å; W451-Y471 HydrophobicContact CE3-CD1 4.13Å; W451-Y471 HydrophobicContact CE3-CD2 4.04Å; W451-Y471 AromaticContact CE3-CE1 3.72Å; W451-Y471 HydrophobicContact CE3-CE1 3.72Å; W451-Y471 AromaticContact CE3-CE2 3.57Å; W451-Y471 HydrophobicContact CE3-CE2 3.57Å; W451-Y471 HydrophobicContact CE3-CG 4.29Å; W451-Y471 AromaticContact CE3-CZ 3.39Å; W451-Y471 HydrophobicContact CH2-CD2 4.39Å; W451-Y471 HydrophobicContact CZ3-CD1 4.33Å; W451-Y471 AromaticContact CZ3-CD2 3.5Å; W451-Y471 HydrophobicContact CZ3-CD2 3.5Å; W451-Y471 HydrophobicContact CZ3-CE1 4.2Å; W451-Y471 AromaticContact CZ3-CE2 3.3Å; W451-Y471 HydrophobicContact CZ3-CE2 3.3Å; W451-Y471 HydrophobicContact CZ3-CG 4.01Å; W451-Y471 AromaticContact CZ3-CZ 3.69Å; L464-Y471 HydrophobicContact CD2-CD1 4.39Å; L464-Y471 HydrophobicContact CD2-CG 4.4Å; N469-Y471 VanDerWaalsContact C-N 3.32Å; N469-Y471 PolarHBondContact O-N 2.82Å; N469-Y471 PolarHBondContact OD1-N 3.38Å; Y471-R473 PolarHBondContact O-N 2.86Å; Y471-R473 PolarHBondContact OH-NH1 2.96Å
472	N	88.6	Confident	89.2	Confident	1 Å²	1	38.1 Å²	38.1	1%	0.005	21%	0.211	C	C	.	.			trans	-72.3	62.9	167.4	-168.1	-16.4	0	0	0	109.6	L464 F465 V466 N469 S470 G474 R475 W476	L464-N472 WeakPolarHBondContact O-CB 3.45Å; L464-N472 PolarHBondContact O-N 3.33Å; F465-N472 PolarHBondContact O-ND2 2.76Å; F465-N472 VanDerWaalsContact O-ND2 3.14Å; V466-N472 PolarHBondContact O-ND2 2.98Å; N469-N472 HydrophobicContact CB-CB 4.22Å; N469-N472 WeakPolarHBondContact O-CB 3.36Å; N469-N472 PolarHBondContact O-N 3.1Å; S470-N472 VanDerWaalsContact C-N 3.32Å; S470-N472 PolarHBondContact O-N 2.94Å; N472-G474 VanDerWaalsContact C-N 3.27Å; N472-G474 PolarHBondContact O-N 3.46Å; N472-R475 VanDerWaalsContact O-CD 3.25Å; N472-R475 WeakPolarHBondContact O-CD 3.48Å; N472-R475 PolarHBondContact O-N 3.47Å; N472-R475 WeakPolarHBondContact OD1-CA 3.39Å; N472-R475 PolarHBondContact OD1-N 2.95Å; N472-W476 PolarHBondContact ND2-O 2.81Å; N472-W476 PolarHBondContact OD1-N 2.88Å; N472-W476 PolarHBondContact OD1-O 3.04Å
473	R	89.3	Confident	89.3	Confident	2 Å²	2	43.9 Å²	43.9	1%	0.008	24%	0.236	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.2	-33.2	-171.7	-66.9	178.7	176.4	108.9	6.7	111.2	E138 E304 R308 S439 N440 F444 Y471 R475	E138-R473 IonicContact OE1-NH2 3.94Å; E138-R473 IonicContact OE2-CZ 3.31Å; E138-R473 IonicContact OE2-NH2 2.71Å; E138-R473 PolarHBondContact OE2-NH2 3.4Å; E304-R473 WeakPolarHBondContact OE1-CA 3.3Å; E304-R473 PolarHBondContact OE1-N 3.18Å; R308-R473 VanDerWaalsContact CZ-O 3.29Å; R308-R473 PolarHBondContact NE-O 3.1Å; R308-R473 PolarHBondContact NH2-O 3.16Å; S439-R473 WeakPolarHBondContact O-CD 3.48Å; S439-R473 WeakPolarHBondContact OG-CD 3.27Å; S439-R473 PolarHBondContact OG-NE 3.12Å; N440-R473 PolarHBondContact OD1-NE 3.21Å; N440-R473 PolarHBondContact OD1-NH2 3.12Å; N440-R473 VanDerWaalsContact OD1-NH2 3.14Å; F444-R473 HydrophobicContact CE1-CB 4.03Å; F444-R473 HydrophobicContact CZ-CB 4.02Å; Y471-R473 PolarHBondContact O-N 2.86Å; Y471-R473 PolarHBondContact OH-NH1 2.96Å; R473-R475 VanDerWaalsContact C-N 3.28Å; R473-R475 PolarHBondContact O-N 3.14Å
474	G	90	Very high	89.5	Confident	1 Å²	1	43.5 Å²	43.5	1%	0.01	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68	-24.5	173	0	0	0	0	0	113.4	E304 Y305 Q307 R308 N472	E304-G474 PolarHBondContact OE1-N 3.47Å; Y305-G474 WeakPolarHBondContact O-CA 3.48Å; Q307-G474 CarbonylContact C-O 3.56Å; Q307-G474 VanDerWaalsContact CA-O 3.31Å; Q307-G474 WeakPolarHBondContact CA-O 3.27Å; Q307-G474 WeakPolarHBondContact CB-O 3.26Å; Q307-G474 PolarHBondContact N-O 2.89Å; R308-G474 PolarHBondContact N-O 2.81Å; N472-G474 VanDerWaalsContact C-N 3.27Å; N472-G474 PolarHBondContact O-N 3.46Å
475	R	91.8	Very high	89.6	Confident	102 Å²	102	44 Å²	44	39%	0.385	24%	0.237	S	C	.	.			trans	57.3	47.9	-171	-54.3	-65.5	-178.4	-172.9	4.1	112.4	R308 G468 N469 N472 R473	R308-R475 HydrophobicContact CG-CB 4.3Å; R308-R475 HydrophobicContact CG-CG 3.73Å; G468-R475 PolarHBondContact O-NH1 3.39Å; N469-R475 PolarHBondContact O-NH1 2.87Å; N472-R475 VanDerWaalsContact O-CD 3.25Å; N472-R475 WeakPolarHBondContact O-CD 3.48Å; N472-R475 PolarHBondContact O-N 3.47Å; N472-R475 WeakPolarHBondContact OD1-CA 3.39Å; N472-R475 PolarHBondContact OD1-N 2.95Å; R473-R475 VanDerWaalsContact C-N 3.28Å; R473-R475 PolarHBondContact O-N 3.14Å
476	W	92.8	Very high	89.4	Confident	9 Å²	9	48.4 Å²	48.4	3%	0.034	26%	0.261	C	S	.	.			trans	-68.7	150.2	159.7	177.7	73.1	0	0	0	109	F465 N472 N478 Y481 I509 I510	F465-W476 HydrophobicContact CB-CE3 4.02Å; F465-W476 HydrophobicContact CB-CZ3 4.11Å; N472-W476 PolarHBondContact ND2-O 2.81Å; N472-W476 PolarHBondContact OD1-N 2.88Å; N472-W476 PolarHBondContact OD1-O 3.04Å; W476-N478 HydrophobicContact CH2-CB 3.67Å; W476-N478 HydrophobicContact CZ2-CB 3.53Å; W476-N478 HydrophobicContact CZ3-CB 4.4Å; W476-Y481 HydrophobicContact CH2-CD1 4.28Å; W476-Y481 AromaticContact CH2-CD2 3.7Å; W476-Y481 HydrophobicContact CH2-CD2 3.7Å; W476-Y481 HydrophobicContact CH2-CE2 4.24Å; W476-Y481 AromaticContact CH2-CG 3.71Å; W476-Y481 HydrophobicContact CH2-CG 3.71Å; W476-Y481 AromaticContact CZ3-CD1 3.86Å; W476-Y481 HydrophobicContact CZ3-CD1 3.86Å; W476-Y481 AromaticContact CZ3-CD2 3.93Å; W476-Y481 HydrophobicContact CZ3-CD2 3.93Å; W476-Y481 HydrophobicContact CZ3-CE1 4.1Å; W476-Y481 HydrophobicContact CZ3-CE2 4.14Å; W476-Y481 AromaticContact CZ3-CG 3.77Å; W476-Y481 HydrophobicContact CZ3-CG 3.77Å; W476-I509 HydrophobicContact CH2-CG2 4.34Å; W476-I509 HydrophobicContact CZ2-CG2 4.43Å; W476-I510 HydrophobicContact CD2-CG1 4.5Å; W476-I510 HydrophobicContact CE3-CD1 3.9Å; W476-I510 HydrophobicContact CE3-CG1 4.11Å; W476-I510 HydrophobicContact CH2-CB 3.68Å; W476-I510 HydrophobicContact CH2-CD1 4.23Å; W476-I510 HydrophobicContact CH2-CG1 3.76Å; W476-I510 HydrophobicContact CZ2-CB 4.29Å; W476-I510 HydrophobicContact CZ2-CG1 4.19Å; W476-I510 HydrophobicContact CZ3-CB 4Å; W476-I510 HydrophobicContact CZ3-CD1 3.67Å; W476-I510 HydrophobicContact CZ3-CG1 3.73Å
477	S	92.6	Very high	89.3	Confident	71 Å²	71	47 Å²	47	50%	0.497	25%	0.254	S	S	.	.			trans	-152.3	143.6	178	51.5	0	0	0	0	110.8	T467	T467-S477 WeakPolarHBondContact OG1-CB 3.33Å
478	N	93.9	Very high	89.3	Confident	24 Å²	24	43.6 Å²	43.6	13%	0.128	23%	0.233	C	C	.	.			trans	-152.1	120.6	176.3	178.8	-58	0	0	0	109.2	W476 E480 Y481 D482 E513	W476-N478 HydrophobicContact CH2-CB 3.67Å; W476-N478 HydrophobicContact CZ2-CB 3.53Å; W476-N478 HydrophobicContact CZ3-CB 4.4Å; N478-E480 VanDerWaalsContact C-N 3.27Å; N478-E480 PolarHBondContact O-N 2.85Å; N478-E480 WeakPolarHBondContact OD1-CA 3.27Å; N478-E480 WeakPolarHBondContact OD1-CB 3.26Å; N478-E480 PolarHBondContact OD1-N 2.83Å; N478-Y481 WeakPolarHBondContact O-CB 3.48Å; N478-Y481 PolarHBondContact O-N 3.06Å; N478-Y481 PolarHBondContact OD1-N 3.28Å; N478-D482 PolarHBondContact O-N 3.14Å; N478-E513 PolarHBondContact ND2-OE1 2.8Å; N478-E513 PolarHBondContact ND2-OE2 2.78Å
479	E	92.7	Very high	89.3	Confident	140 Å²	140	42 Å²	42	65%	0.654	22%	0.217	S	C	*	.	H	α-helix	trans	-65.7	-24.8	-175	-73.6	-165.4	-153.9	0	0	114.6	K483	E479-K483 WeakPolarHBondContact O-CD 3.46Å; E479-K483 WeakPolarHBondContact O-CE 3.24Å; E479-K483 WeakPolarHBondContact O-CG 3.05Å; E479-K483 PolarHBondContact O-N 3.34Å; E479-K483 PolarHBondContact O-NZ 3.07Å; E479-K483 IonicContact OE2-NZ 2.81Å; E479-K483 PolarHBondContact OE2-NZ 3.38Å
480	E	93.2	Very high	89.2	Confident	127 Å²	127	45 Å²	45	59%	0.593	23%	0.233	S	C	*	.	H	α-helix	trans	-79.9	-41.3	177.7	-170.4	171.4	176.2	0	0	110.1	N478 K483 L484 I509	N478-E480 VanDerWaalsContact C-N 3.27Å; N478-E480 PolarHBondContact O-N 2.85Å; N478-E480 WeakPolarHBondContact OD1-CA 3.27Å; N478-E480 WeakPolarHBondContact OD1-CB 3.26Å; N478-E480 PolarHBondContact OD1-N 2.83Å; E480-K483 PolarHBondContact O-N 3.08Å; E480-L484 HydrophobicContact CG-CD1 4.12Å; E480-L484 WeakPolarHBondContact O-CD1 3.46Å; E480-L484 VanDerWaalsContact O-CG 3.28Å; E480-L484 WeakPolarHBondContact O-CG 3.48Å; E480-L484 PolarHBondContact O-N 2.98Å; E480-I509 HydrophobicContact CB-CD1 4.13Å; E480-I509 HydrophobicContact CG-CD1 3.83Å
481	Y	93.7	Very high	89.3	Confident	0 Å²	0	50 Å²	50	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-55.8	-51.6	170.6	-174.1	-86.7	0	0	0	112	T462 F465 V466 W476 N478 K483 L484 V485 A506 I509 I510	T462-Y481 VanDerWaalsContact C-OH 3.32Å; T462-Y481 WeakPolarHBondContact CA-OH 3.47Å; T462-Y481 WeakPolarHBondContact O-CE1 3.35Å; T462-Y481 PolarHBondContact O-OH 3.08Å; F465-Y481 HydrophobicContact CB-CE1 3.99Å; V466-Y481 HydrophobicContact CG2-CE1 4.39Å; W476-Y481 HydrophobicContact CH2-CD1 4.28Å; W476-Y481 AromaticContact CH2-CD2 3.7Å; W476-Y481 HydrophobicContact CH2-CD2 3.7Å; W476-Y481 HydrophobicContact CH2-CE2 4.24Å; W476-Y481 AromaticContact CH2-CG 3.71Å; W476-Y481 HydrophobicContact CH2-CG 3.71Å; W476-Y481 AromaticContact CZ3-CD1 3.86Å; W476-Y481 HydrophobicContact CZ3-CD1 3.86Å; W476-Y481 AromaticContact CZ3-CD2 3.93Å; W476-Y481 HydrophobicContact CZ3-CD2 3.93Å; W476-Y481 HydrophobicContact CZ3-CE1 4.1Å; W476-Y481 HydrophobicContact CZ3-CE2 4.14Å; W476-Y481 AromaticContact CZ3-CG 3.77Å; W476-Y481 HydrophobicContact CZ3-CG 3.77Å; N478-Y481 WeakPolarHBondContact O-CB 3.48Å; N478-Y481 PolarHBondContact O-N 3.06Å; N478-Y481 PolarHBondContact OD1-N 3.28Å; Y481-K483 VanDerWaalsContact C-N 3.29Å; Y481-K483 PolarHBondContact O-N 2.96Å; Y481-L484 PolarHBondContact O-N 2.92Å; Y481-L484 VanDerWaalsContact O-N 3.14Å; Y481-V485 HydrophobicContact CD1-CG2 4.12Å; Y481-V485 HydrophobicContact CE1-CG2 3.79Å; Y481-V485 WeakPolarHBondContact O-CG2 3.38Å; Y481-V485 PolarHBondContact O-N 3.36Å; Y481-A506 HydrophobicContact CD2-CB 3.89Å; Y481-A506 VanDerWaalsContact CD2-O 3.24Å; Y481-A506 WeakPolarHBondContact CD2-O 3.49Å; Y481-A506 HydrophobicContact CE2-CB 3.84Å; Y481-A506 WeakPolarHBondContact CE2-O 3.27Å; Y481-I509 HydrophobicContact CD2-CB 4.46Å; Y481-I509 HydrophobicContact CD2-CG2 4.48Å; Y481-I510 HydrophobicContact CD2-CB 4.12Å; Y481-I510 HydrophobicContact CE2-CB 3.71Å; Y481-I510 HydrophobicContact CE2-CD1 4.41Å; Y481-I510 HydrophobicContact CE2-CG2 3.82Å
482	D	93	Very high	89.4	Confident	35 Å²	35	49.8 Å²	49.8	19%	0.187	25%	0.249	C	C	.	.	H	α-helix	trans	-57.7	-41.5	179	-69.2	-33.6	0	0	0	111.8	V466 T467 N478 D486	V466-D482 WeakPolarHBondContact CA-OD1 3.37Å; T467-D482 WeakPolarHBondContact CB-OD2 3.49Å; T467-D482 PolarHBondContact N-OD1 2.55Å; T467-D482 PolarHBondContact OG1-OD1 2.77Å; T467-D482 PolarHBondContact OG1-OD2 2.92Å; N478-D482 PolarHBondContact O-N 3.14Å; D482-D486 VanDerWaalsContact O-CB 3.28Å; D482-D486 WeakPolarHBondContact O-CB 3.37Å; D482-D486 PolarHBondContact O-N 2.81Å
483	K	92.5	Very high	88.9	Confident	121 Å²	121	50.6 Å²	50.6	53%	0.526	26%	0.256	S	S	.	.	H	α-helix	trans	-69.1	-34.1	178.4	-71.9	163.1	-159.6	151.2	0	112.8	E479 E480 Y481 A487	E479-K483 WeakPolarHBondContact O-CD 3.46Å; E479-K483 WeakPolarHBondContact O-CE 3.24Å; E479-K483 WeakPolarHBondContact O-CG 3.05Å; E479-K483 PolarHBondContact O-N 3.34Å; E479-K483 PolarHBondContact O-NZ 3.07Å; E479-K483 IonicContact OE2-NZ 2.81Å; E479-K483 PolarHBondContact OE2-NZ 3.38Å; E480-K483 PolarHBondContact O-N 3.08Å; Y481-K483 VanDerWaalsContact C-N 3.29Å; Y481-K483 PolarHBondContact O-N 2.96Å; K483-A487 WeakPolarHBondContact O-CB 3.15Å; K483-A487 PolarHBondContact O-N 3.06Å
484	L	93.5	Very high	88.3	Confident	21 Å²	21	56 Å²	56	11%	0.11	29%	0.294	C	S	.	.	H	α-helix	trans	-73.4	-42.5	177.6	-73.1	162.6	0	0	0	111.7	E480 Y481 A487 S488 D502 K505 A506 I509	E480-L484 HydrophobicContact CG-CD1 4.12Å; E480-L484 WeakPolarHBondContact O-CD1 3.46Å; E480-L484 VanDerWaalsContact O-CG 3.28Å; E480-L484 WeakPolarHBondContact O-CG 3.48Å; E480-L484 PolarHBondContact O-N 2.98Å; Y481-L484 PolarHBondContact O-N 2.92Å; Y481-L484 VanDerWaalsContact O-N 3.14Å; L484-A487 PolarHBondContact O-N 2.99Å; L484-S488 WeakPolarHBondContact O-CB 3.37Å; L484-S488 PolarHBondContact O-N 2.52Å; L484-S488 PolarHBondContact O-OG 2.87Å; L484-D502 HydrophobicContact CD2-CB 3.99Å; L484-K505 HydrophobicContact CD1-CB 3.64Å; L484-K505 HydrophobicContact CD2-CB 4.05Å; L484-K505 HydrophobicContact CD2-CD 3.85Å; L484-K505 HydrophobicContact CG-CB 4.45Å; L484-A506 HydrophobicContact CB-CB 4.19Å; L484-I509 HydrophobicContact CD1-CD1 3.48Å; L484-I509 VanDerWaalsContact CD1-CD1 3.48Å
485	V	90.8	Very high	87.9	Confident	10 Å²	10	59.6 Å²	59.6	6%	0.061	31%	0.313	C	S	.	.	H	α-helix	trans	-64.9	-45.4	174.6	-179.3	0	0	0	0	110.2	D463 V466 Y481 A487 S488 G489 A506	D463-V485 WeakPolarHBondContact OD1-CG1 3.47Å; V466-V485 HydrophobicContact CG2-CB 3.9Å; V466-V485 HydrophobicContact CG2-CG1 3.63Å; V466-V485 HydrophobicContact CG2-CG2 4.21Å; Y481-V485 HydrophobicContact CD1-CG2 4.12Å; Y481-V485 HydrophobicContact CE1-CG2 3.79Å; Y481-V485 WeakPolarHBondContact O-CG2 3.38Å; Y481-V485 PolarHBondContact O-N 3.36Å; V485-A487 PolarHBondContact O-N 2.96Å; V485-S488 PolarHBondContact O-N 3.31Å; V485-S488 PolarHBondContact O-OG 2.83Å; V485-G489 PolarHBondContact O-N 2.91Å; V485-A506 HydrophobicContact CG2-CB 4.02Å
486	D	87.6	Confident	87.3	Confident	95 Å²	95	61.3 Å²	61.3	51%	0.508	33%	0.325	S	S	.	.	H	α-helix	trans	-58.2	-45.4	173.5	-179	71.3	0	0	0	112.7	D482 G489 N490	D482-D486 VanDerWaalsContact O-CB 3.28Å; D482-D486 WeakPolarHBondContact O-CB 3.37Å; D482-D486 PolarHBondContact O-N 2.81Å; D486-G489 CarbonylContact O-C 3.51Å; D486-G489 PolarHBondContact O-N 2.95Å; D486-N490 VanDerWaalsContact O-CB 3.27Å; D486-N490 WeakPolarHBondContact O-CB 3.46Å; D486-N490 PolarHBondContact O-N 3.17Å; D486-N490 PolarHBondContact OD1-ND2 2.87Å
487	A	87.9	Confident	86.8	Confident	14 Å²	14	65.7 Å²	65.7	12%	0.116	35%	0.346	C	S	.	.	H	α-helix	trans	-58.8	-53.1	176.2	0	0	0	0	0	111.6	K483 L484 V485 G489 N490 K491 D492 D502	K483-A487 WeakPolarHBondContact O-CB 3.15Å; K483-A487 PolarHBondContact O-N 3.06Å; L484-A487 PolarHBondContact O-N 2.99Å; V485-A487 PolarHBondContact O-N 2.96Å; A487-G489 PolarHBondContact O-N 2.84Å; A487-G489 VanDerWaalsContact O-N 3.17Å; A487-N490 PolarHBondContact O-N 3.36Å; A487-N490 VanDerWaalsContact O-N 3.13Å; A487-K491 PolarHBondContact O-N 3.1Å; A487-D492 PolarHBondContact O-N 2.83Å; A487-D502 WeakPolarHBondContact CB-OD2 3.06Å
488	S	88.5	Confident	86.5	Confident	1 Å²	1	63.4 Å²	63.4	1%	0.007	33%	0.332	C	S	.	.	H	α-helix	trans	-58.2	-28.9	177.4	84.5	0	0	0	0	113.4	L484 V485 R499	L484-S488 WeakPolarHBondContact O-CB 3.37Å; L484-S488 PolarHBondContact O-N 2.52Å; L484-S488 PolarHBondContact O-OG 2.87Å; V485-S488 PolarHBondContact O-N 3.31Å; V485-S488 PolarHBondContact O-OG 2.83Å; S488-R499 WeakPolarHBondContact O-CD 3.47Å; S488-R499 WeakPolarHBondContact O-CG 3.42Å; S488-R499 PolarHBondContact O-NE 3.21Å
489	G	80.1	Confident	86.2	Confident	20 Å²	20	63.5 Å²	63.5	21%	0.206	33%	0.33	C	S	.	.	H	α-helix	trans	-91.8	-19.2	179.5	0	0	0	0	0	114.7	K178 V485 D486 A487	K178-G489 VanDerWaalsContact CD-O 3.27Å; K178-G489 WeakPolarHBondContact CD-O 3.36Å; K178-G489 WeakPolarHBondContact CE-O 3.28Å; K178-G489 PolarHBondContact NZ-O 2.96Å; V485-G489 PolarHBondContact O-N 2.91Å; D486-G489 CarbonylContact O-C 3.51Å; D486-G489 PolarHBondContact O-N 2.95Å; A487-G489 PolarHBondContact O-N 2.84Å; A487-G489 VanDerWaalsContact O-N 3.17Å
490	N	80.8	Confident	86	Confident	86 Å²	86	58 Å²	58	46%	0.46	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	-131.3	-64.2	-171.7	-71.2	-37.7	0	0	0	113.8	K178 D486 A487	K178-N490 VanDerWaalsContact CD-OD1 3.29Å; K178-N490 WeakPolarHBondContact CD-OD1 3.5Å; K178-N490 PolarHBondContact NZ-OD1 2.87Å; D486-N490 VanDerWaalsContact O-CB 3.27Å; D486-N490 WeakPolarHBondContact O-CB 3.46Å; D486-N490 PolarHBondContact O-N 3.17Å; D486-N490 PolarHBondContact OD1-ND2 2.87Å; A487-N490 PolarHBondContact O-N 3.36Å; A487-N490 VanDerWaalsContact O-N 3.13Å
491	K	80	Confident	85.8	Confident	152 Å²	152	57.6 Å²	57.6	66%	0.661	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.3	-41.3	-175.8	171.5	-175.3	151.3	-72.9	0	111.7	A487	A487-K491 PolarHBondContact O-N 3.1Å
492	D	85	Confident	85.7	Confident	13 Å²	13	58.3 Å²	58.3	7%	0.07	31%	0.305	C	S	.	.	S	Bend	trans	-112.1	4.3	-168.4	-58.5	-75.2	0	0	0	112.1	A487 S494 D495 A498	A487-D492 PolarHBondContact O-N 2.83Å; D492-S494 PolarHBondContact O-N 3.42Å; D492-D495 CarbonylContact O-C 3.54Å; D492-D495 PolarHBondContact O-N 3.31Å; D492-A498 HydrophobicContact CB-CB 3.8Å; D492-A498 WeakPolarHBondContact OD1-CB 3.3Å
493	A	76.8	Confident	85.6	Confident	19 Å²	19	56.6 Å²	56.6	16%	0.157	30%	0.296	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.3	-19.7	-177.9	0	0	0	0	0	115.4
494	S	76.2	Confident	85.5	Confident	114 Å²	114	52.1 Å²	52.1	80%	0.797	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.5	4.2	174.8	60.1	0	0	0	0	114.4	D492	D492-S494 PolarHBondContact O-N 3.42Å
495	D	81.9	Confident	85.4	Confident	78 Å²	78	54.6 Å²	54.6	42%	0.417	29%	0.287	S	S	.	.			trans	-112	99.8	171.6	-172.6	-42.4	0	0	0	108.4	D492 E497 A498 R499	D492-D495 CarbonylContact O-C 3.54Å; D492-D495 PolarHBondContact O-N 3.31Å; D495-E497 PolarHBondContact O-N 2.85Å; D495-E497 PolarHBondContact OD1-N 3.4Å; D495-E497 VanDerWaalsContact OD1-N 3.09Å; D495-A498 HydrophobicContact CB-CB 4.04Å; D495-A498 PolarHBondContact O-N 2.95Å; D495-A498 PolarHBondContact OD1-N 2.64Å; D495-R499 VanDerWaalsContact O-CB 3.28Å; D495-R499 WeakPolarHBondContact O-CB 3.31Å; D495-R499 PolarHBondContact O-N 3.13Å
496	E	79.9	Confident	85.5	Confident	137 Å²	137	54.1 Å²	54.1	64%	0.64	28%	0.284	S	S	*	.	H	α-helix	trans	-60.1	-25.9	-175.2	-67.5	-176.6	170	0	0	113.8	P356 W500	P356-E496 HydrophobicContact CG-CB 3.88Å; E496-W500 VanDerWaalsContact O-CB 3.22Å; E496-W500 WeakPolarHBondContact O-CB 3.49Å; E496-W500 PolarHBondContact O-N 3.08Å
497	E	82.7	Confident	85.6	Confident	102 Å²	102	49.7 Å²	49.7	48%	0.477	26%	0.26	S	S	.	.	H	α-helix	trans	-80.7	-49.8	176.5	-77.2	-179.1	130.8	0	0	111.4	K357 D495 R499 W500 E501	K357-E497 HydrophobicContact CD-CG 4.17Å; K357-E497 VanDerWaalsContact CD-OE1 3.3Å; K357-E497 WeakPolarHBondContact CD-OE1 3.38Å; K357-E497 VanDerWaalsContact CE-OE1 3.25Å; K357-E497 WeakPolarHBondContact CE-OE1 3.45Å; K357-E497 WeakPolarHBondContact CE-OE2 3.47Å; K357-E497 IonicContact NZ-OE1 2.68Å; K357-E497 PolarHBondContact NZ-OE1 2.78Å; K357-E497 IonicContact NZ-OE2 3.95Å; K357-E497 PolarHBondContact NZ-OE2 3.19Å; D495-E497 PolarHBondContact O-N 2.85Å; D495-E497 PolarHBondContact OD1-N 3.4Å; D495-E497 VanDerWaalsContact OD1-N 3.09Å; E497-R499 VanDerWaalsContact C-N 3.35Å; E497-R499 PolarHBondContact O-N 2.78Å; E497-W500 PolarHBondContact O-N 3.46Å; E497-E501 PolarHBondContact O-N 2.92Å
498	A	84.8	Confident	85.7	Confident	23 Å²	23	52.6 Å²	52.6	19%	0.19	27%	0.272	C	S	.	.	H	α-helix	trans	-63.5	-42.2	-179.4	0	0	0	0	0	111.3	D492 D495 W500 E501 D502	D492-A498 HydrophobicContact CB-CB 3.8Å; D492-A498 WeakPolarHBondContact OD1-CB 3.3Å; D495-A498 HydrophobicContact CB-CB 4.04Å; D495-A498 PolarHBondContact O-N 2.95Å; D495-A498 PolarHBondContact OD1-N 2.64Å; A498-W500 VanDerWaalsContact C-N 3.34Å; A498-W500 PolarHBondContact O-N 3.28Å; A498-E501 PolarHBondContact O-N 3.21Å; A498-D502 WeakPolarHBondContact O-CB 3.12Å; A498-D502 VanDerWaalsContact O-CG 3.3Å; A498-D502 PolarHBondContact O-N 3.18Å
499	R	87.6	Confident	85.9	Confident	26 Å²	26	53.7 Å²	53.7	10%	0.098	28%	0.277	C	S	.	.	H	α-helix	trans	-58.3	-43.7	172.9	-177.4	172.2	-172.4	-91.3	-7	112.4	D457 S459 S488 D495 E497 D502 L503	D457-R499 IonicContact OD1-CZ 2.68Å; D457-R499 IonicContact OD1-NH1 3.72Å; D457-R499 PolarHBondContact OD1-NH1 3.07Å; D457-R499 IonicContact OD1-NH2 3.8Å; D457-R499 IonicContact OD2-CZ 3.84Å; D457-R499 IonicContact OD2-NH1 3.8Å; D457-R499 PolarHBondContact OD2-NH1 3.25Å; D457-R499 IonicContact OD2-NH2 2.77Å; D457-R499 PolarHBondContact OD2-NH2 3.16Å; S459-R499 PolarHBondContact OG-NH2 2.98Å; S488-R499 WeakPolarHBondContact O-CD 3.47Å; S488-R499 WeakPolarHBondContact O-CG 3.42Å; S488-R499 PolarHBondContact O-NE 3.21Å; D495-R499 VanDerWaalsContact O-CB 3.28Å; D495-R499 WeakPolarHBondContact O-CB 3.31Å; D495-R499 PolarHBondContact O-N 3.13Å; E497-R499 VanDerWaalsContact C-N 3.35Å; E497-R499 PolarHBondContact O-N 2.78Å; R499-D502 PolarHBondContact O-N 3.42Å; R499-L503 HydrophobicContact CG-CD1 3.94Å; R499-L503 VanDerWaalsContact O-CG 3.3Å; R499-L503 WeakPolarHBondContact O-CG 3.37Å; R499-L503 PolarHBondContact O-N 3.48Å
500	W	89.1	Confident	86.5	Confident	25 Å²	25	52.8 Å²	52.8	10%	0.095	27%	0.267	C	S	.	.	H	α-helix	trans	-67.2	-44	-179.9	-174.8	-93.8	0	0	0	111.8	K354 N355 F362 E365 P458 E496 E497 A498 D502 Q504	K354-W500 VanDerWaalsContact C-CZ3 3.42Å; K354-W500 WeakPolarHBondContact O-CH2 3.39Å; K354-W500 VanDerWaalsContact O-CZ3 3.3Å; K354-W500 WeakPolarHBondContact O-CZ3 3.09Å; N355-W500 VanDerWaalsContact CA-CZ2 3.46Å; N355-W500 HydrophobicContact CB-CD2 4.35Å; N355-W500 HydrophobicContact CB-CH2 4.24Å; N355-W500 HydrophobicContact CB-CZ2 3.55Å; N355-W500 PolarHBondContact ND2-NE1 3.47Å; F362-W500 HydrophobicContact CB-CH2 3.56Å; F362-W500 HydrophobicContact CB-CZ2 3.84Å; F362-W500 HydrophobicContact CB-CZ3 4.46Å; F362-W500 HydrophobicContact CD2-CD2 4.26Å; F362-W500 AromaticContact CD2-CE2 3.94Å; F362-W500 HydrophobicContact CD2-CE3 4.2Å; F362-W500 AromaticContact CD2-CH2 3.55Å; F362-W500 HydrophobicContact CD2-CH2 3.55Å; F362-W500 AromaticContact CD2-CZ2 3.6Å; F362-W500 HydrophobicContact CD2-CZ2 3.6Å; F362-W500 AromaticContact CD2-CZ3 3.86Å; F362-W500 HydrophobicContact CD2-CZ3 3.86Å; F362-W500 HydrophobicContact CG-CH2 4.04Å; F362-W500 HydrophobicContact CG-CZ2 4.15Å; E365-W500 PolarHBondContact OE2-NE1 3.37Å; P458-W500 HydrophobicContact CG-CZ3 4.36Å; E496-W500 VanDerWaalsContact O-CB 3.22Å; E496-W500 WeakPolarHBondContact O-CB 3.49Å; E496-W500 PolarHBondContact O-N 3.08Å; E497-W500 PolarHBondContact O-N 3.46Å; A498-W500 VanDerWaalsContact C-N 3.34Å; A498-W500 PolarHBondContact O-N 3.28Å; W500-D502 VanDerWaalsContact C-N 3.34Å; W500-D502 PolarHBondContact O-N 2.88Å; W500-Q504 WeakPolarHBondContact O-CB 3.35Å; W500-Q504 VanDerWaalsContact O-CG 3.3Å; W500-Q504 WeakPolarHBondContact O-CG 3.38Å; W500-Q504 PolarHBondContact O-N 3.16Å
501	E	88.8	Confident	86.9	Confident	117 Å²	117	48.8 Å²	48.8	55%	0.547	25%	0.246	S	C	.	.	H	α-helix	trans	-57.8	-44.1	173.1	-98.5	-157.8	-148.9	0	0	112.4	E497 A498 Q504 K505	E497-E501 PolarHBondContact O-N 2.92Å; A498-E501 PolarHBondContact O-N 3.21Å; E501-Q504 PolarHBondContact O-N 2.76Å; E501-K505 WeakPolarHBondContact O-CD 3.45Å; E501-K505 WeakPolarHBondContact O-CE 3.41Å; E501-K505 WeakPolarHBondContact O-CG 3.26Å; E501-K505 PolarHBondContact O-N 3.42Å; E501-K505 VanDerWaalsContact OE2-CE 3.23Å; E501-K505 WeakPolarHBondContact OE2-CE 3.45Å; E501-K505 IonicContact OE2-NZ 3.07Å; E501-K505 PolarHBondContact OE2-NZ 3.16Å
502	D	91.4	Very high	87.3	Confident	15 Å²	15	46.1 Å²	46.1	8%	0.08	24%	0.235	C	C	.	.	H	α-helix	trans	-71.6	-39.1	-176.5	-70	-13.8	0	0	0	112.3	L484 A487 A498 R499 W500 K505 A506	L484-D502 HydrophobicContact CD2-CB 3.99Å; A487-D502 WeakPolarHBondContact CB-OD2 3.06Å; A498-D502 WeakPolarHBondContact O-CB 3.12Å; A498-D502 VanDerWaalsContact O-CG 3.3Å; A498-D502 PolarHBondContact O-N 3.18Å; R499-D502 PolarHBondContact O-N 3.42Å; W500-D502 VanDerWaalsContact C-N 3.34Å; W500-D502 PolarHBondContact O-N 2.88Å; D502-K505 PolarHBondContact O-N 3.45Å; D502-K505 IonicContact OD1-NZ 3.8Å; D502-K505 PolarHBondContact OD1-NZ 3.48Å; D502-A506 WeakPolarHBondContact O-CB 3.42Å; D502-A506 PolarHBondContact O-N 2.9Å
503	L	91.7	Very high	87.6	Confident	0 Å²	0	47.9 Å²	47.9	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-63.1	-40.6	171.2	-70.2	166.8	0	0	0	111.8	F362 P458 T462 R499 A506 N507	F362-L503 HydrophobicContact CE2-CB 3.91Å; F362-L503 HydrophobicContact CZ-CB 4.17Å; P458-L503 HydrophobicContact CB-CB 4.42Å; P458-L503 HydrophobicContact CB-CD1 4.22Å; P458-L503 HydrophobicContact CG-CD1 4.46Å; T462-L503 HydrophobicContact CG2-CD2 4.09Å; T462-L503 VanDerWaalsContact OG1-CD2 3.29Å; T462-L503 WeakPolarHBondContact OG1-CD2 3.47Å; R499-L503 HydrophobicContact CG-CD1 3.94Å; R499-L503 VanDerWaalsContact O-CG 3.3Å; R499-L503 WeakPolarHBondContact O-CG 3.37Å; R499-L503 PolarHBondContact O-N 3.48Å; L503-A506 PolarHBondContact O-N 3.19Å; L503-N507 WeakPolarHBondContact O-CB 3.11Å; L503-N507 PolarHBondContact O-N 3.41Å
504	Q	91.1	Very high	88.2	Confident	26 Å²	26	47 Å²	47	12%	0.121	24%	0.235	C	C	.	.	H	α-helix	trans	-62.5	-44.1	175.1	-76.5	-70.7	15.8	0	0	111.8	F362 W500 E501 N507 E508	F362-Q504 HydrophobicContact CD2-CG 4.19Å; F362-Q504 HydrophobicContact CE2-CB 4.48Å; F362-Q504 HydrophobicContact CE2-CG 3.67Å; F362-Q504 HydrophobicContact CZ-CG 4.07Å; F362-Q504 PolarHBondContact O-NE2 2.93Å; W500-Q504 WeakPolarHBondContact O-CB 3.35Å; W500-Q504 VanDerWaalsContact O-CG 3.3Å; W500-Q504 WeakPolarHBondContact O-CG 3.38Å; W500-Q504 PolarHBondContact O-N 3.16Å; E501-Q504 PolarHBondContact O-N 2.76Å; Q504-N507 PolarHBondContact O-N 3.2Å; Q504-E508 VanDerWaalsContact O-CB 3.31Å; Q504-E508 WeakPolarHBondContact O-CB 3.48Å; Q504-E508 PolarHBondContact O-N 3.3Å
505	K	91.5	Very high	88.9	Confident	74 Å²	74	41.6 Å²	41.6	32%	0.322	20%	0.198	S	C	.	.	H	α-helix	trans	-63.6	-41.9	175.9	-66.1	158.9	-154.9	160	0	111.7	L484 E501 D502 E508 I509	L484-K505 HydrophobicContact CD1-CB 3.64Å; L484-K505 HydrophobicContact CD2-CB 4.05Å; L484-K505 HydrophobicContact CD2-CD 3.85Å; L484-K505 HydrophobicContact CG-CB 4.45Å; E501-K505 WeakPolarHBondContact O-CD 3.45Å; E501-K505 WeakPolarHBondContact O-CE 3.41Å; E501-K505 WeakPolarHBondContact O-CG 3.26Å; E501-K505 PolarHBondContact O-N 3.42Å; E501-K505 VanDerWaalsContact OE2-CE 3.23Å; E501-K505 WeakPolarHBondContact OE2-CE 3.45Å; E501-K505 IonicContact OE2-NZ 3.07Å; E501-K505 PolarHBondContact OE2-NZ 3.16Å; D502-K505 PolarHBondContact O-N 3.45Å; D502-K505 IonicContact OD1-NZ 3.8Å; D502-K505 PolarHBondContact OD1-NZ 3.48Å; K505-E508 WeakPolarHBondContact O-CB 3.43Å; K505-E508 PolarHBondContact O-N 2.93Å; K505-I509 WeakPolarHBondContact O-CG1 3.39Å; K505-I509 PolarHBondContact O-N 3.45Å
506	A	91.9	Very high	89.4	Confident	0 Å²	0	38 Å²	38	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-61.6	-50.7	176.3	0	0	0	0	0	111.6	T462 Y481 L484 V485 D502 L503 E508 I509 I510	T462-A506 HydrophobicContact CG2-CB 4.28Å; Y481-A506 HydrophobicContact CD2-CB 3.89Å; Y481-A506 VanDerWaalsContact CD2-O 3.24Å; Y481-A506 WeakPolarHBondContact CD2-O 3.49Å; Y481-A506 HydrophobicContact CE2-CB 3.84Å; Y481-A506 WeakPolarHBondContact CE2-O 3.27Å; L484-A506 HydrophobicContact CB-CB 4.19Å; V485-A506 HydrophobicContact CG2-CB 4.02Å; D502-A506 WeakPolarHBondContact O-CB 3.42Å; D502-A506 PolarHBondContact O-N 2.9Å; L503-A506 PolarHBondContact O-N 3.19Å; A506-E508 VanDerWaalsContact C-N 3.26Å; A506-E508 PolarHBondContact O-N 3.11Å; A506-I509 PolarHBondContact O-N 3.22Å; A506-I510 PolarHBondContact O-N 3.45Å; A506-I510 VanDerWaalsContact O-N 3.13Å
507	N	90.8	Very high	90.1	Very high	1 Å²	1	31.5 Å²	31.5	1%	0.005	15%	0.148	C	C	.	.	H	α-helix	trans	-58.7	-36.9	174.6	173.4	57.9	0	0	0	112.3	L347 V348 F362 L369 L503 Q504 S511	L347-N507 PolarHBondContact N-OD1 3.38Å; V348-N507 HydrophobicContact CG2-CB 4.42Å; F362-N507 HydrophobicContact CE1-CB 3.84Å; F362-N507 WeakPolarHBondContact CE1-ND2 3.29Å; F362-N507 HydrophobicContact CZ-CB 3.98Å; L369-N507 WeakPolarHBondContact CD1-ND2 3.49Å; L503-N507 WeakPolarHBondContact O-CB 3.11Å; L503-N507 PolarHBondContact O-N 3.41Å; Q504-N507 PolarHBondContact O-N 3.2Å; N507-S511 VanDerWaalsContact O-CB 3.26Å; N507-S511 WeakPolarHBondContact O-CB 3.12Å; N507-S511 PolarHBondContact O-N 2.91Å; N507-S511 PolarHBondContact O-OG 3.25Å
508	E	90.1	Very high	90.6	Very high	76 Å²	76	26.7 Å²	26.7	36%	0.355	13%	0.125	S	C	.	.	H	α-helix	trans	-64	-46.8	173.3	178	168.9	-120.6	0	0	112.5	L369 Q504 K505 A506 K512	L369-E508 HydrophobicContact CD2-CB 4.16Å; L369-E508 HydrophobicContact CD2-CG 3.92Å; Q504-E508 VanDerWaalsContact O-CB 3.31Å; Q504-E508 WeakPolarHBondContact O-CB 3.48Å; Q504-E508 PolarHBondContact O-N 3.3Å; K505-E508 WeakPolarHBondContact O-CB 3.43Å; K505-E508 PolarHBondContact O-N 2.93Å; A506-E508 VanDerWaalsContact C-N 3.26Å; A506-E508 PolarHBondContact O-N 3.11Å; E508-K512 HydrophobicContact CG-CD 3.68Å; E508-K512 HydrophobicContact CG-CG 4.17Å; E508-K512 VanDerWaalsContact O-CB 3.26Å; E508-K512 WeakPolarHBondContact O-CB 3.43Å; E508-K512 VanDerWaalsContact O-CG 3.3Å; E508-K512 WeakPolarHBondContact O-CG 3.47Å; E508-K512 PolarHBondContact O-N 3.47Å; E508-K512 WeakPolarHBondContact OE1-CE 3.2Å; E508-K512 IonicContact OE1-NZ 3.61Å; E508-K512 PolarHBondContact OE1-NZ 2.91Å; E508-K512 IonicContact OE2-NZ 3.45Å; E508-K512 PolarHBondContact OE2-NZ 2.95Å
509	I	92.3	Very high	91	Very high	23 Å²	23	25.6 Å²	25.6	12%	0.118	12%	0.116	C	C	.	.	H	α-helix	trans	-60.9	-56	-179.8	-71.2	163.3	0	0	0	111.3	W476 E480 Y481 L484 K505 A506 S511 K512 E513	W476-I509 HydrophobicContact CH2-CG2 4.34Å; W476-I509 HydrophobicContact CZ2-CG2 4.43Å; E480-I509 HydrophobicContact CB-CD1 4.13Å; E480-I509 HydrophobicContact CG-CD1 3.83Å; Y481-I509 HydrophobicContact CD2-CB 4.46Å; Y481-I509 HydrophobicContact CD2-CG2 4.48Å; L484-I509 HydrophobicContact CD1-CD1 3.48Å; L484-I509 VanDerWaalsContact CD1-CD1 3.48Å; K505-I509 WeakPolarHBondContact O-CG1 3.39Å; K505-I509 PolarHBondContact O-N 3.45Å; A506-I509 PolarHBondContact O-N 3.22Å; I509-S511 PolarHBondContact O-N 3.34Å; I509-K512 PolarHBondContact O-N 3.23Å; I509-K512 VanDerWaalsContact O-N 3.11Å; I509-E513 PolarHBondContact O-N 2.72Å
510	I	92.6	Very high	91.3	Very high	1 Å²	1	24.8 Å²	24.8	1%	0.005	11%	0.114	C	C	.	.	H	α-helix	trans	-61.5	-35.3	-175.9	-169	170.8	0	0	0	112	L347 F465 W476 Y481 A506 S514 G515 V516	L347-I510 HydrophobicContact CB-CG2 4.33Å; L347-I510 HydrophobicContact CD2-CD1 4.39Å; L347-I510 HydrophobicContact CD2-CG2 4.36Å; F465-I510 HydrophobicContact CB-CD1 3.57Å; F465-I510 HydrophobicContact CD1-CD1 3.92Å; F465-I510 HydrophobicContact CD2-CD1 3.56Å; F465-I510 HydrophobicContact CE2-CD1 4.25Å; F465-I510 HydrophobicContact CG-CD1 3.37Å; W476-I510 HydrophobicContact CD2-CG1 4.5Å; W476-I510 HydrophobicContact CE3-CD1 3.9Å; W476-I510 HydrophobicContact CE3-CG1 4.11Å; W476-I510 HydrophobicContact CH2-CB 3.68Å; W476-I510 HydrophobicContact CH2-CD1 4.23Å; W476-I510 HydrophobicContact CH2-CG1 3.76Å; W476-I510 HydrophobicContact CZ2-CB 4.29Å; W476-I510 HydrophobicContact CZ2-CG1 4.19Å; W476-I510 HydrophobicContact CZ3-CB 4Å; W476-I510 HydrophobicContact CZ3-CD1 3.67Å; W476-I510 HydrophobicContact CZ3-CG1 3.73Å; Y481-I510 HydrophobicContact CD2-CB 4.12Å; Y481-I510 HydrophobicContact CE2-CB 3.71Å; Y481-I510 HydrophobicContact CE2-CD1 4.41Å; Y481-I510 HydrophobicContact CE2-CG2 3.82Å; A506-I510 PolarHBondContact O-N 3.45Å; A506-I510 VanDerWaalsContact O-N 3.13Å; I510-S514 WeakPolarHBondContact O-CA 3.11Å; I510-S514 PolarHBondContact O-N 2.95Å; I510-S514 VanDerWaalsContact O-N 3.1Å; I510-G515 PolarHBondContact O-N 3.03Å; I510-V516 HydrophobicContact CD1-CG2 4.36Å
511	S	89.3	Confident	91.6	Very high	2 Å²	2	23.9 Å²	23.9	1%	0.014	11%	0.11	C	C	.	.	H	α-helix	trans	-73.1	-39.4	176.7	-56	0	0	0	0	112.2	N507 I509 S514	N507-S511 VanDerWaalsContact O-CB 3.26Å; N507-S511 WeakPolarHBondContact O-CB 3.12Å; N507-S511 PolarHBondContact O-N 2.91Å; N507-S511 PolarHBondContact O-OG 3.25Å; I509-S511 PolarHBondContact O-N 3.34Å; S511-S514 PolarHBondContact O-N 2.72Å
512	K	87.4	Confident	91.6	Very high	96 Å²	96	19.1 Å²	19.1	42%	0.417	9%	0.088	S	C	.	.	H	α-helix	trans	-68	-41	176.4	-82.1	179.7	-179.3	166.5	0	112.5	K321 E508 I509 S514	K321-K512 WeakPolarHBondContact CE-O 3.29Å; K321-K512 PolarHBondContact NZ-O 3.47Å; E508-K512 HydrophobicContact CG-CD 3.68Å; E508-K512 HydrophobicContact CG-CG 4.17Å; E508-K512 VanDerWaalsContact O-CB 3.26Å; E508-K512 WeakPolarHBondContact O-CB 3.43Å; E508-K512 VanDerWaalsContact O-CG 3.3Å; E508-K512 WeakPolarHBondContact O-CG 3.47Å; E508-K512 PolarHBondContact O-N 3.47Å; E508-K512 WeakPolarHBondContact OE1-CE 3.2Å; E508-K512 IonicContact OE1-NZ 3.61Å; E508-K512 PolarHBondContact OE1-NZ 2.91Å; E508-K512 IonicContact OE2-NZ 3.45Å; E508-K512 PolarHBondContact OE2-NZ 2.95Å; I509-K512 PolarHBondContact O-N 3.23Å; I509-K512 VanDerWaalsContact O-N 3.11Å; K512-S514 VanDerWaalsContact C-N 3.26Å
513	E	91	Very high	91.6	Very high	51 Å²	51	18.6 Å²	18.6	24%	0.238	9%	0.086	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.8	-3.5	177.6	-68	-174.5	-177.9	0	0	113.4	E317 R320 N478 I509 G515	E317-E513 HydrophobicContact CG-CB 4.49Å; R320-E513 PolarHBondContact NE-O 3.49Å; R320-E513 PolarHBondContact NH2-O 3.17Å; N478-E513 PolarHBondContact ND2-OE1 2.8Å; N478-E513 PolarHBondContact ND2-OE2 2.78Å; I509-E513 PolarHBondContact O-N 2.72Å; E513-G515 VanDerWaalsContact C-N 3.26Å; E513-G515 PolarHBondContact O-N 2.89Å
514	S	91.1	Very high	91.5	Very high	0 Å²	0	20.1 Å²	20.1	0%	0	9%	0.093	C	C	.	.	T	Hydrogen-bonded Turn	trans	48.3	48.2	-172.8	-60.1	0	0	0	0	111.6	R320 I510 S511 K512 V516	R320-S514 WeakPolarHBondContact CB-O 3.31Å; R320-S514 WeakPolarHBondContact CD-O 3.4Å; R320-S514 PolarHBondContact NE-O 3.05Å; I510-S514 WeakPolarHBondContact O-CA 3.11Å; I510-S514 PolarHBondContact O-N 2.95Å; I510-S514 VanDerWaalsContact O-N 3.1Å; S511-S514 PolarHBondContact O-N 2.72Å; K512-S514 VanDerWaalsContact C-N 3.26Å; S514-V516 CarbonylContact C-O 3.47Å; S514-V516 WeakPolarHBondContact CA-O 3.38Å; S514-V516 PolarHBondContact O-N 3.01Å
515	G	89.2	Confident	91.6	Very high	1 Å²	1	18.9 Å²	18.9	1%	0.01	9%	0.087	C	C	.	.	S	Bend	trans	-57.9	-37.7	174.4	0	0	0	0	0	111.2	I510 E513	I510-G515 PolarHBondContact O-N 3.03Å; E513-G515 VanDerWaalsContact C-N 3.26Å; E513-G515 PolarHBondContact O-N 2.89Å
516	V	93.1	Very high	91.7	Very high	2 Å²	2	15.5 Å²	15.5	1%	0.012	7%	0.073	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	166.5	153.2	-64.7	0	0	0	0	109.5	Y302 L303 E304 L347 F465 I510 S514 P518	Y302-V516 HydrophobicContact CD2-CB 3.89Å; Y302-V516 HydrophobicContact CD2-CG1 3.85Å; Y302-V516 HydrophobicContact CD2-CG2 4.24Å; Y302-V516 HydrophobicContact CE2-CG1 4.03Å; Y302-V516 HydrophobicContact CG-CB 4.24Å; Y302-V516 HydrophobicContact CG-CG2 4.2Å; L303-V516 CarbonylContact O-C 2.94Å; L303-V516 VanDerWaalsContact O-CA 3.29Å; L303-V516 WeakPolarHBondContact O-CA 3.49Å; L303-V516 VanDerWaalsContact O-CB 3.29Å; L303-V516 WeakPolarHBondContact O-CB 3.41Å; E304-V516 HydrophobicContact CB-CG1 4.21Å; E304-V516 HydrophobicContact CG-CG1 4.32Å; L347-V516 HydrophobicContact CD1-CG2 3.98Å; F465-V516 HydrophobicContact CD1-CG1 4.31Å; F465-V516 HydrophobicContact CE1-CG1 3.4Å; F465-V516 HydrophobicContact CE2-CG1 4.47Å; F465-V516 HydrophobicContact CZ-CG1 3.5Å; F465-V516 VanDerWaalsContact CZ-CG1 3.5Å; F465-V516 HydrophobicContact CZ-CG2 4.25Å; I510-V516 HydrophobicContact CD1-CG2 4.36Å; S514-V516 CarbonylContact C-O 3.47Å; S514-V516 WeakPolarHBondContact CA-O 3.38Å; S514-V516 PolarHBondContact O-N 3.01Å; V516-P518 WeakPolarHBondContact O-CD 3.47Å
517	A	93.7	Very high	91.8	Very high	0 Å²	0	15.7 Å²	15.7	0%	0	7%	0.074	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	99.7	170	0	0	0	0	0	111.1	Y302 L303 Y305	Y302-A517 CarbonylContact C-O 3.51Å; Y302-A517 VanDerWaalsContact CA-O 3.23Å; Y302-A517 WeakPolarHBondContact CA-O 3.18Å; Y302-A517 WeakPolarHBondContact CB-O 3.41Å; L303-A517 HydrophobicContact CB-CB 4.26Å; L303-A517 PolarHBondContact N-O 3.09Å; L303-A517 PolarHBondContact O-N 2.82Å; Y305-A517 HydrophobicContact CE2-CB 4.25Å; Y305-A517 VanDerWaalsContact OH-CB 3.26Å; Y305-A517 WeakPolarHBondContact OH-CB 3.17Å
518	P	93.7	Very high	91.9	Very high	1 Å²	1	15.7 Å²	15.7	1%	0.006	7%	0.074	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-55.1	139.2	170.9	-25.3	34.9	0	0	0	111.9	T300 R329 G346 V516	T300-P518 HydrophobicContact CG2-CB 4.09Å; R329-P518 PolarHBondContact NE-O 2.92Å; R329-P518 PolarHBondContact NH2-O 3.21Å; G346-P518 VanDerWaalsContact C-CG 3.44Å; G346-P518 WeakPolarHBondContact O-CB 3.46Å; G346-P518 VanDerWaalsContact O-CG 3.25Å; G346-P518 WeakPolarHBondContact O-CG 3.32Å; V516-P518 WeakPolarHBondContact O-CD 3.47Å
519	L	94	Very high	91.9	Very high	0 Å²	0	12.9 Å²	12.9	0%	0	6%	0.061	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	-58.7	-177	-58.7	172	0	0	0	111	S301 L303 I327 R329 L332 V408 I412 L448	S301-L519 WeakPolarHBondContact O-CB 3.29Å; S301-L519 PolarHBondContact O-N 3.38Å; L303-L519 HydrophobicContact CD2-CD1 4.21Å; L303-L519 HydrophobicContact CG-CD1 4.23Å; L303-L519 HydrophobicContact CG-CD2 4.34Å; I327-L519 HydrophobicContact CD1-CD2 3.73Å; I327-L519 HydrophobicContact CG2-CD2 3.94Å; R329-L519 WeakPolarHBondContact CG-O 3.11Å; L332-L519 HydrophobicContact CD2-CB 3.97Å; L332-L519 HydrophobicContact CD2-CD2 4.45Å; V408-L519 HydrophobicContact CG1-CD1 4Å; I412-L519 HydrophobicContact CD1-CD1 3.87Å; I412-L519 HydrophobicContact CD1-CD2 4.06Å; L448-L519 HydrophobicContact CD1-CD1 3.44Å; L448-L519 VanDerWaalsContact CD1-CD1 3.44Å
520	Y	94.2	Very high	91.5	Very high	10 Å²	10	16.9 Å²	16.9	4%	0.039	8%	0.08	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.3	157.8	-176.3	59.6	-86.9	0	0	0	110.6	S301 L332 V333 L337 V342 V408 L522	S301-Y520 PolarHBondContact N-O 3.36Å; S301-Y520 WeakPolarHBondContact OG-CE2 3.47Å; S301-Y520 PolarHBondContact OG-OH 2.97Å; L332-Y520 HydrophobicContact CD2-CD1 3.89Å; L332-Y520 HydrophobicContact CD2-CE1 4.35Å; L332-Y520 HydrophobicContact CG-CD1 4.28Å; V333-Y520 VanDerWaalsContact CG1-CB 3.49Å; V333-Y520 HydrophobicContact CG1-CG 4.37Å; L337-Y520 HydrophobicContact CD1-CD1 3.71Å; L337-Y520 HydrophobicContact CD1-CD2 3.65Å; L337-Y520 HydrophobicContact CD1-CE1 3.77Å; L337-Y520 HydrophobicContact CD1-CE2 3.67Å; L337-Y520 HydrophobicContact CD1-CG 3.68Å; V342-Y520 CarbonylContact O-C 3.5Å; V342-Y520 VanDerWaalsContact O-CA 3.29Å; V342-Y520 WeakPolarHBondContact O-CA 3.46Å; V342-Y520 WeakPolarHBondContact O-CB 3.31Å; V408-Y520 HydrophobicContact CG1-CE1 4.21Å; V408-Y520 HydrophobicContact CG2-CE1 3.83Å; Y520-L522 HydrophobicContact CE2-CB 4.33Å; Y520-L522 HydrophobicContact CE2-CD1 4.01Å
521	Q	93.9	Very high	90.9	Very high	5 Å²	5	20.3 Å²	20.3	2%	0.023	9%	0.094	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	127.1	162.2	172.2	-177.1	4.9	0	0	108.1	K296 E297 R299 S341 V342 P349 S350	K296-Q521 HydrophobicContact CG-CG 4.4Å; E297-Q521 WeakPolarHBondContact O-CG 3.28Å; E297-Q521 PolarHBondContact O-NE2 3.09Å; R299-Q521 CarbonylContact O-C 3.5Å; R299-Q521 WeakPolarHBondContact O-CA 3.35Å; R299-Q521 WeakPolarHBondContact O-CG 3.41Å; S341-Q521 CarbonylContact C-O 3.55Å; S341-Q521 VanDerWaalsContact CA-O 3.32Å; S341-Q521 WeakPolarHBondContact CA-O 3.33Å; S341-Q521 WeakPolarHBondContact CB-O 3.2Å; V342-Q521 HydrophobicContact CG2-CB 3.79Å; V342-Q521 HydrophobicContact CG2-CG 4.25Å; V342-Q521 PolarHBondContact N-O 3.38Å; V342-Q521 PolarHBondContact O-N 3.46Å; P349-Q521 HydrophobicContact CB-CB 4.46Å; P349-Q521 HydrophobicContact CB-CG 3.93Å; S350-Q521 PolarHBondContact O-NE2 2.9Å; S350-Q521 PolarHBondContact O-OE1 3.43Å; S350-Q521 PolarHBondContact OG-OE1 3.35Å
522	L	90.6	Very high	90.8	Very high	17 Å²	17	20.3 Å²	20.3	9%	0.089	9%	0.094	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.1	143.7	-172.6	-176.5	63.9	0	0	0	112.3	E297 R299 Y520 E524	E297-L522 PolarHBondContact N-O 2.95Å; E297-L522 VanDerWaalsContact N-O 3.12Å; R299-L522 HydrophobicContact CB-CB 4.49Å; R299-L522 VanDerWaalsContact NH1-CD2 3.31Å; R299-L522 PolarHBondContact O-N 3.26Å; Y520-L522 HydrophobicContact CE2-CB 4.33Å; Y520-L522 HydrophobicContact CE2-CD1 4.01Å; L522-E524 HydrophobicContact CD2-CG 4.11Å; L522-E524 HydrophobicContact CG-CG 4.27Å
523	S	90.8	Very high	90.8	Very high	4 Å²	4	21 Å²	21	3%	0.028	10%	0.097	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	115.1	163.9	-156.2	0	0	0	0	109	S294 F295 K296 D339 G340 S341	S294-S523 WeakPolarHBondContact OG-CB 3.3Å; S294-S523 PolarHBondContact OG-OG 3.33Å; F295-S523 CarbonylContact O-C 3.54Å; F295-S523 VanDerWaalsContact O-CA 3.24Å; F295-S523 WeakPolarHBondContact O-CA 3.48Å; F295-S523 PolarHBondContact O-OG 3.4Å; K296-S523 WeakPolarHBondContact CA-OG 3.05Å; K296-S523 PolarHBondContact N-OG 2.82Å; D339-S523 VanDerWaalsContact CB-O 3.32Å; D339-S523 WeakPolarHBondContact CB-O 3.47Å; G340-S523 WeakPolarHBondContact O-CB 3.43Å; S341-S523 PolarHBondContact OG-N 3.26Å
524	E	89.7	Confident	90.6	Very high	32 Å²	32	20.3 Å²	20.3	15%	0.15	10%	0.104	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	131.4	-177.8	-59.1	-163.4	135.9	0	0	110.3	I277 S294 F295 L522 H526	I277-E524 HydrophobicContact CG2-CB 4.41Å; S294-E524 CarbonylContact C-O 3.6Å; S294-E524 VanDerWaalsContact CA-O 3.3Å; S294-E524 WeakPolarHBondContact CA-O 3.23Å; F295-E524 PolarHBondContact N-O 2.9Å; F295-E524 PolarHBondContact O-N 3.41Å; L522-E524 HydrophobicContact CD2-CG 4.11Å; L522-E524 HydrophobicContact CG-CG 4.27Å; E524-H526 WeakPolarHBondContact CB-NE2 3.23Å; E524-H526 IonicContact OE2-NE2 2.64Å
525	A	92.9	Very high	90.6	Very high	0 Å²	0	21.7 Å²	21.7	0%	0	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	103.1	179.5	0	0	0	0	0	111.2	L278 A283 Y292 D339	L278-A525 PolarHBondContact N-O 3.38Å; A283-A525 HydrophobicContact CB-CB 3.77Å; Y292-A525 HydrophobicContact CE2-CB 3.88Å; Y292-A525 VanDerWaalsContact OH-CB 3.27Å; Y292-A525 WeakPolarHBondContact OH-CB 3.3Å; D339-A525 HydrophobicContact CB-CB 3.73Å
526	H	94.3	Very high	90.7	Very high	3 Å²	3	22.2 Å²	22.2	1%	0.014	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	142	-177.9	-68.9	-119.6	0	0	0	112.2	D275 V276 Y292 K293 F295 E524 V528 W544	D275-H526 IonicContact OD1-CE1 3.05Å; D275-H526 IonicContact OD1-CG 2.81Å; D275-H526 IonicContact OD1-ND1 2.9Å; D275-H526 PolarHBondContact OD1-ND1 2.95Å; V276-H526 CarbonylContact O-C 3.52Å; V276-H526 VanDerWaalsContact O-CA 3.24Å; V276-H526 WeakPolarHBondContact O-CA 3.13Å; Y292-H526 CarbonylContact C-O 3.51Å; Y292-H526 WeakPolarHBondContact CA-O 3.32Å; K293-H526 PolarHBondContact N-O 3.28Å; K293-H526 PolarHBondContact O-N 3.39Å; F295-H526 HydrophobicContact CD2-CB 4.18Å; F295-H526 AromaticContact CD2-CD2 3.54Å; F295-H526 AromaticContact CD2-CG 3.84Å; F295-H526 HydrophobicContact CE2-CB 4Å; F295-H526 AromaticContact CE2-CG 3.94Å; E524-H526 WeakPolarHBondContact CB-NE2 3.23Å; E524-H526 IonicContact OE2-NE2 2.64Å; H526-V528 HydrophobicContact CB-CG2 3.73Å; H526-W544 AromaticContact CE1-CH2 3.42Å; H526-W544 VanDerWaalsContact CE1-CH2 3.42Å; H526-W544 WeakPolarHBondContact CE1-CH2 3.34Å; H526-W544 AromaticContact CE1-CZ2 3.38Å; H526-W544 WeakPolarHBondContact CE1-CZ2 3.29Å; H526-W544 AromaticContact NE2-CH2 3.52Å; H526-W544 AromaticContact NE2-CZ2 3.39Å; H526-W544 WeakPolarHBondContact NE2-CZ2 3.16Å
527	L	93.7	Very high	90.6	Very high	4 Å²	4	23.4 Å²	23.4	2%	0.021	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96	118	152.2	-56.7	-173.1	0	0	0	108.4	L265 F268 D275 V276 L278 N286 Y292	L265-L527 HydrophobicContact CD1-CD1 3.5Å; L265-L527 VanDerWaalsContact CD1-CD1 3.5Å; F268-L527 HydrophobicContact CD1-CB 3.83Å; F268-L527 HydrophobicContact CD1-CD1 3.73Å; F268-L527 HydrophobicContact CD1-CG 4.46Å; F268-L527 HydrophobicContact CD2-CB 4.03Å; F268-L527 HydrophobicContact CE1-CB 3.63Å; F268-L527 HydrophobicContact CE1-CD1 4Å; F268-L527 HydrophobicContact CE1-CG 4.45Å; F268-L527 VanDerWaalsContact CE2-C 3.49Å; F268-L527 HydrophobicContact CE2-CB 3.84Å; F268-L527 WeakPolarHBondContact CE2-O 3.45Å; F268-L527 HydrophobicContact CG-CB 4.02Å; F268-L527 HydrophobicContact CG-CD1 4.35Å; F268-L527 HydrophobicContact CZ-CB 3.63Å; D275-L527 WeakPolarHBondContact CA-O 3.25Å; V276-L527 HydrophobicContact CG2-CB 4.03Å; V276-L527 HydrophobicContact CG2-CG 4.47Å; V276-L527 PolarHBondContact N-O 3.07Å; V276-L527 VanDerWaalsContact N-O 3.17Å; V276-L527 PolarHBondContact O-N 3.32Å; L278-L527 HydrophobicContact CD1-CD1 3.92Å; L278-L527 HydrophobicContact CD1-CD2 4.16Å; L278-L527 HydrophobicContact CD1-CG 3.76Å; L278-L527 HydrophobicContact CG-CG 4.37Å; N286-L527 HydrophobicContact CB-CD2 3.99Å; Y292-L527 HydrophobicContact CD2-CD2 3.79Å; Y292-L527 HydrophobicContact CG-CD2 4.34Å
528	V	93.2	Very high	90.5	Very high	2 Å²	2	23.6 Å²	23.6	1%	0.012	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	117.9	-179	-169.1	0	0	0	0	110.5	D275 T291 K293 F295 H526 E530 V532 I535	D275-V528 WeakPolarHBondContact OD2-CG2 3.3Å; T291-V528 WeakPolarHBondContact CB-O 3.45Å; T291-V528 PolarHBondContact O-N 3.32Å; K293-V528 HydrophobicContact CD-CB 4.25Å; K293-V528 HydrophobicContact CD-CG2 3.84Å; K293-V528 HydrophobicContact CG-CG2 4.45Å; K293-V528 VanDerWaalsContact NZ-CG1 3.3Å; F295-V528 HydrophobicContact CE2-CG2 4.31Å; H526-V528 HydrophobicContact CB-CG2 3.73Å; V528-E530 PolarHBondContact O-N 3.49Å; V528-V532 HydrophobicContact CG1-CB 4.46Å; V528-I535 HydrophobicContact CG1-CD1 3.86Å
529	N	88.4	Confident	90.1	Very high	16 Å²	16	25.7 Å²	25.7	9%	0.086	13%	0.133	C	C	.	.			trans	-54	126.9	-176.7	-177.2	-30.7	0	0	0	110.8	F268 D274 K531 V532	F268-N529 HydrophobicContact CE2-CB 3.98Å; F268-N529 HydrophobicContact CZ-CB 4.31Å; D274-N529 HydrophobicContact CB-CB 4.12Å; D274-N529 WeakPolarHBondContact O-CB 3.45Å; D274-N529 PolarHBondContact O-N 3.39Å; D274-N529 VanDerWaalsContact OD1-CG 3.28Å; D274-N529 PolarHBondContact OD1-ND2 3.48Å; N529-K531 PolarHBondContact ND2-NZ 2.92Å; N529-K531 PolarHBondContact O-N 3.04Å; N529-K531 WeakPolarHBondContact OD1-CB 3.43Å; N529-K531 VanDerWaalsContact OD1-CG 3.29Å; N529-K531 WeakPolarHBondContact OD1-CG 3.45Å; N529-K531 PolarHBondContact OD1-N 2.81Å; N529-K531 PolarHBondContact OD1-NZ 3.34Å; N529-V532 HydrophobicContact CB-CG2 4.46Å; N529-V532 PolarHBondContact O-N 2.71Å
530	E	84.3	Confident	89.7	Confident	108 Å²	108	26.5 Å²	26.5	51%	0.505	14%	0.14	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.7	-22.4	-172.7	-63.2	-167.3	157.6	0	0	113.8	S290 T291 V528 V532 K533	S290-E530 PolarHBondContact OG-OE1 2.99Å; T291-E530 HydrophobicContact CG2-CG 4Å; V528-E530 PolarHBondContact O-N 3.49Å; E530-V532 VanDerWaalsContact C-N 3.28Å; E530-V532 PolarHBondContact O-N 3.2Å; E530-K533 WeakPolarHBondContact O-CE 3.38Å; E530-K533 PolarHBondContact O-NZ 3.39Å
531	K	79.6	Confident	89.3	Confident	72 Å²	72	26.7 Å²	26.7	31%	0.313	15%	0.146	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.7	-27.3	175.7	-57.6	-179.3	-137.9	88.7	0	112.8	N529 L552	N529-K531 PolarHBondContact ND2-NZ 2.92Å; N529-K531 PolarHBondContact O-N 3.04Å; N529-K531 WeakPolarHBondContact OD1-CB 3.43Å; N529-K531 VanDerWaalsContact OD1-CG 3.29Å; N529-K531 WeakPolarHBondContact OD1-CG 3.45Å; N529-K531 PolarHBondContact OD1-N 2.81Å; N529-K531 PolarHBondContact OD1-NZ 3.34Å; K531-L552 HydrophobicContact CB-CB 4.38Å; K531-L552 VanDerWaalsContact O-CB 3.26Å; K531-L552 WeakPolarHBondContact O-CB 3.43Å; K531-L552 VanDerWaalsContact O-CG 3.27Å; K531-L552 WeakPolarHBondContact O-CG 3.29Å; K531-L552 PolarHBondContact O-N 2.9Å
532	V	87.6	Confident	88.9	Confident	2 Å²	2	26.8 Å²	26.8	1%	0.012	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	125.4	-178.4	-172.4	0	0	0	0	109.9	F43 D274 V528 N529 E530 I535 T549 H551	F43-V532 HydrophobicContact CD2-CG1 3.98Å; F43-V532 HydrophobicContact CD2-CG2 3.78Å; F43-V532 HydrophobicContact CE2-CB 4.37Å; F43-V532 HydrophobicContact CE2-CG1 3.87Å; F43-V532 HydrophobicContact CE2-CG2 3.96Å; F43-V532 HydrophobicContact CZ-CG1 4.47Å; D274-V532 HydrophobicContact CB-CG2 3.91Å; V528-V532 HydrophobicContact CG1-CB 4.46Å; N529-V532 HydrophobicContact CB-CG2 4.46Å; N529-V532 PolarHBondContact O-N 2.71Å; E530-V532 VanDerWaalsContact C-N 3.28Å; E530-V532 PolarHBondContact O-N 3.2Å; V532-I535 HydrophobicContact CG1-CD1 3.82Å; V532-I535 HydrophobicContact CG1-CG1 3.86Å; V532-T549 HydrophobicContact CG1-CG2 3.59Å; V532-H551 HydrophobicContact CG2-CB 4.38Å
533	K	87.2	Confident	88.7	Confident	112 Å²	112	26.1 Å²	26.1	49%	0.487	14%	0.144	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	145.9	178.7	-59.7	-64.1	178.8	-132.8	0	109.8	E530 R550 L552	E530-K533 WeakPolarHBondContact O-CE 3.38Å; E530-K533 PolarHBondContact O-NZ 3.39Å; K533-R550 PolarHBondContact N-O 2.88Å; K533-R550 PolarHBondContact O-N 3.34Å; K533-L552 HydrophobicContact CG-CD1 4.34Å
534	G	88.1	Confident	88.8	Confident	36 Å²	36	27 Å²	27	37%	0.371	15%	0.146	S	C	.	.			trans	86	13.5	174.4	0	0	0	0	0	116.1	V536 W548 T549	G534-V536 PolarHBondContact O-N 2.8Å; G534-W548 CarbonylContact O-C 3.45Å; G534-T549 PolarHBondContact O-N 2.65Å; G534-T549 PolarHBondContact O-OG1 2.85Å
535	I	90.4	Very high	88.9	Confident	28 Å²	28	25.4 Å²	25.4	14%	0.144	14%	0.139	C	C	.	.			trans	-56.1	133.9	157.9	-56.8	175	0	0	0	107.5	F43 D275 V528 V532 W544 Y546 T549	F43-I535 HydrophobicContact CE1-CD1 4.25Å; F43-I535 HydrophobicContact CE2-CD1 4.18Å; F43-I535 HydrophobicContact CZ-CD1 3.61Å; F43-I535 HydrophobicContact CZ-CG1 4.38Å; D275-I535 VanDerWaalsContact OD2-CD1 3.22Å; D275-I535 WeakPolarHBondContact OD2-CD1 3.33Å; V528-I535 HydrophobicContact CG1-CD1 3.86Å; V532-I535 HydrophobicContact CG1-CD1 3.82Å; V532-I535 HydrophobicContact CG1-CG1 3.86Å; I535-W544 HydrophobicContact CG2-CE3 3.93Å; I535-W544 HydrophobicContact CG2-CZ3 3.94Å; I535-Y546 HydrophobicContact CG2-CD1 4.25Å; I535-Y546 HydrophobicContact CG2-CE1 3.97Å; I535-T549 WeakPolarHBondContact CA-OG1 3.37Å; I535-T549 HydrophobicContact CG1-CG2 3.88Å; I535-T549 PolarHBondContact N-OG1 3.16Å
536	V	91.8	Very high	89	Confident	13 Å²	13	25.7 Å²	25.7	8%	0.079	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	135.1	173.9	178.2	0	0	0	0	108.1	K80 G534 H538 D545 W548	K80-V536 HydrophobicContact CD-CG2 4.17Å; K80-V536 HydrophobicContact CG-CG2 3.94Å; G534-V536 PolarHBondContact O-N 2.8Å; V536-H538 WeakPolarHBondContact CG1-CE1 3.3Å; V536-D545 HydrophobicContact CB-CB 4.27Å; V536-D545 PolarHBondContact N-O 3.42Å; V536-D545 VanDerWaalsContact N-O 3.14Å; V536-D545 PolarHBondContact O-N 3.35Å; V536-W548 HydrophobicContact CB-CE3 4.34Å; V536-W548 HydrophobicContact CG2-CE3 3.68Å; V536-W548 HydrophobicContact CG2-CZ3 4.2Å
537	H	91.8	Very high	88.9	Confident	27 Å²	27	26 Å²	26	13%	0.125	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	124.5	178.1	167.2	-80.4	0	0	0	108.7	F295 K296 S543 W544	F295-H537 HydrophobicContact CD1-CB 3.62Å; F295-H537 AromaticContact CD1-CG 3.66Å; F295-H537 HydrophobicContact CE1-CB 3.89Å; K296-H537 PolarHBondContact O-CE1 3.05Å; H537-S543 CarbonylContact C-O 3.43Å; H537-S543 WeakPolarHBondContact CA-O 3.11Å; H537-W544 HydrophobicContact CB-CE3 4.09Å; H537-W544 HydrophobicContact CB-CH2 4.41Å; H537-W544 HydrophobicContact CB-CZ3 3.82Å; H537-W544 AromaticContact CD2-CH2 3.69Å; H537-W544 AromaticContact CD2-CZ2 3.76Å; H537-W544 AromaticContact CD2-CZ3 3.89Å
538	H	90.7	Very high	88.8	Confident	3 Å²	3	26.9 Å²	26.9	1%	0.014	14%	0.144	C	C	.	.			trans	-102.3	118	177.5	-57.3	-57.1	0	0	0	109.1	L78 D79 N82 V536 A540 S543	L78-H538 HydrophobicContact CD1-CB 4.03Å; D79-H538 PolarHBondContact O-CE1 2.67Å; N82-H538 WeakPolarHBondContact OD1-CA 3.4Å; N82-H538 PolarHBondContact OD1-ND1 3.34Å; V536-H538 WeakPolarHBondContact CG1-CE1 3.3Å; H538-A540 WeakPolarHBondContact CB-O 3.46Å; H538-A540 PolarHBondContact O-N 2.74Å; H538-A540 VanDerWaalsContact O-N 3.17Å; H538-S543 PolarHBondContact N-O 2.86Å; H538-S543 WeakPolarHBondContact O-CA 3.33Å
539	P	85.7	Confident	88.8	Confident	45 Å²	45	26.8 Å²	26.8	29%	0.292	14%	0.144	S	C	.	.	S	Bend	trans	-63.3	-21.4	178.4	-24	35	0	0	0	113.8	A298	A298-P539 WeakPolarHBondContact CA-O 3.26Å; A298-P539 HydrophobicContact CB-CB 4.25Å; A298-P539 WeakPolarHBondContact CB-O 3.35Å; A298-P539 PolarHBondContact N-O 2.72Å
540	A	85.5	Confident	88.6	Confident	17 Å²	17	30.9 Å²	30.9	14%	0.14	16%	0.158	C	C	.	.	S	Bend	trans	-133.3	149.8	177.7	0	0	0	0	0	109.7	A298 A453 H538	A298-A540 HydrophobicContact CB-CB 4.4Å; A453-A540 HydrophobicContact CB-CB 3.85Å; A453-A540 CarbonylContact O-C 3.51Å; A453-A540 WeakPolarHBondContact O-CA 3.5Å; A453-A540 WeakPolarHBondContact O-CB 3.29Å; H538-A540 WeakPolarHBondContact CB-O 3.46Å; H538-A540 PolarHBondContact O-N 2.74Å; H538-A540 VanDerWaalsContact O-N 3.17Å
541	G	85	Confident	88.3	Confident	15 Å²	15	26.7 Å²	26.7	16%	0.155	14%	0.139	C	C	.	.	S	Bend	trans	84.7	-150.1	-168.6	0	0	0	0	0	111.7	A453 D454 S543	A453-G541 PolarHBondContact O-N 3.47Å; D454-G541 VanDerWaalsContact O-CA 3.32Å; D454-G541 WeakPolarHBondContact O-CA 3.38Å; D454-G541 PolarHBondContact O-N 3.36Å; G541-S543 PolarHBondContact O-N 2.85Å
542	A	86.6	Confident	87.7	Confident	6 Å²	6	28.1 Å²	28.1	5%	0.05	15%	0.149	C	C	.	.	S	Bend	trans	-73.6	114	173.6	0	0	0	0	0	110.6	F65 N69 P190 W544	F65-A542 HydrophobicContact CB-CB 4.08Å; F65-A542 WeakPolarHBondContact O-CB 3.4Å; N69-A542 HydrophobicContact CB-CB 3.49Å; N69-A542 VanDerWaalsContact CB-CB 3.49Å; P190-A542 HydrophobicContact CG-CB 4.23Å; A542-W544 PolarHBondContact O-N 2.9Å
543	S	86	Confident	85.7	Confident	3 Å²	3	33.1 Å²	33.1	2%	0.021	17%	0.174	C	C	.	.	S	Bend	trans	-57.9	-25.7	-165	-41.3	0	0	0	0	115.6	E297 H537 H538 G541	E297-S543 WeakPolarHBondContact OE1-CB 3.26Å; E297-S543 PolarHBondContact OE1-OG 3.23Å; H537-S543 CarbonylContact C-O 3.43Å; H537-S543 WeakPolarHBondContact CA-O 3.11Å; H538-S543 PolarHBondContact N-O 2.86Å; H538-S543 WeakPolarHBondContact O-CA 3.33Å; G541-S543 PolarHBondContact O-N 2.85Å
544	W	91.8	Very high	83.6	Confident	22 Å²	22	29 Å²	29	8%	0.083	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	130.2	-169.7	-60.7	105.6	0	0	0	113.9	A66 N69 N70 F295 H526 I535 H537 A542 Y546	A66-W544 HydrophobicContact CB-CB 4.23Å; N69-W544 PolarHBondContact ND2-O 2.7Å; N70-W544 PolarHBondContact ND2-O 2.87Å; F295-W544 HydrophobicContact CB-CH2 4.25Å; F295-W544 HydrophobicContact CD1-CH2 4.2Å; F295-W544 HydrophobicContact CD1-CZ3 4.38Å; F295-W544 AromaticContact CD2-CH2 3.77Å; F295-W544 HydrophobicContact CD2-CH2 3.77Å; F295-W544 HydrophobicContact CD2-CZ3 4.47Å; F295-W544 HydrophobicContact CE1-CH2 4.45Å; F295-W544 HydrophobicContact CE1-CZ3 4.29Å; F295-W544 HydrophobicContact CE2-CH2 4.03Å; F295-W544 HydrophobicContact CE2-CZ3 4.37Å; F295-W544 AromaticContact CG-CH2 3.84Å; F295-W544 HydrophobicContact CG-CH2 3.84Å; F295-W544 HydrophobicContact CG-CZ3 4.45Å; F295-W544 HydrophobicContact CZ-CH2 4.35Å; F295-W544 HydrophobicContact CZ-CZ3 4.27Å; H526-W544 AromaticContact CE1-CH2 3.42Å; H526-W544 VanDerWaalsContact CE1-CH2 3.42Å; H526-W544 WeakPolarHBondContact CE1-CH2 3.34Å; H526-W544 AromaticContact CE1-CZ2 3.38Å; H526-W544 WeakPolarHBondContact CE1-CZ2 3.29Å; H526-W544 AromaticContact NE2-CH2 3.52Å; H526-W544 AromaticContact NE2-CZ2 3.39Å; H526-W544 WeakPolarHBondContact NE2-CZ2 3.16Å; I535-W544 HydrophobicContact CG2-CE3 3.93Å; I535-W544 HydrophobicContact CG2-CZ3 3.94Å; H537-W544 HydrophobicContact CB-CE3 4.09Å; H537-W544 HydrophobicContact CB-CH2 4.41Å; H537-W544 HydrophobicContact CB-CZ3 3.82Å; H537-W544 AromaticContact CD2-CH2 3.69Å; H537-W544 AromaticContact CD2-CZ2 3.76Å; H537-W544 AromaticContact CD2-CZ3 3.89Å; A542-W544 PolarHBondContact O-N 2.9Å; W544-Y546 HydrophobicContact CB-CE1 4.44Å; W544-Y546 HydrophobicContact CB-CE2 4.17Å; W544-Y546 WeakPolarHBondContact CB-OH 3.44Å
545	D	93	Very high	81.6	Confident	0 Å²	0	31.2 Å²	31.2	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	120	171.5	-172.2	-2.7	0	0	0	111.6	R77 V536 K547 W548	R77-D545 IonicContact CZ-OD1 2.94Å; R77-D545 IonicContact CZ-OD2 3.71Å; R77-D545 IonicContact NE-OD1 3.07Å; R77-D545 IonicContact NE-OD2 2.83Å; R77-D545 PolarHBondContact NE-OD2 3.12Å; R77-D545 IonicContact NH2-OD1 2.75Å; R77-D545 PolarHBondContact NH2-OD1 3.22Å; R77-D545 IonicContact NH2-OD2 2.72Å; R77-D545 PolarHBondContact NH2-OD2 3.38Å; R77-D545 VanDerWaalsContact NH2-OD2 3.12Å; V536-D545 HydrophobicContact CB-CB 4.27Å; V536-D545 PolarHBondContact N-O 3.42Å; V536-D545 VanDerWaalsContact N-O 3.14Å; V536-D545 PolarHBondContact O-N 3.35Å; D545-K547 WeakPolarHBondContact OD1-CB 3.44Å; D545-K547 PolarHBondContact OD1-N 3.29Å; D545-W548 WeakPolarHBondContact OD2-CZ3 3.32Å
546	Y	94.3	Very high	79.5	Confident	5 Å²	5	34.5 Å²	34.5	2%	0.02	18%	0.184	C	C	.	.			trans	-101.3	2	179.2	-51.7	-60.5	0	0	0	114	F43 L45 N70 Y236 V253 I535 W544 W548 T549	F43-Y546 HydrophobicContact CD1-CD1 4.31Å; F43-Y546 AromaticContact CE1-CD1 3.85Å; F43-Y546 HydrophobicContact CE1-CD1 3.85Å; F43-Y546 AromaticContact CE1-CE1 3.69Å; F43-Y546 HydrophobicContact CE1-CE1 3.69Å; L45-Y546 HydrophobicContact CD2-CE2 4.15Å; L45-Y546 VanDerWaalsContact CD2-OH 3.24Å; L45-Y546 WeakPolarHBondContact CD2-OH 3.44Å; N70-Y546 WeakPolarHBondContact OD1-CB 3.32Å; N70-Y546 WeakPolarHBondContact OD1-CD2 3.24Å; N70-Y546 PolarHBondContact OD1-N 2.94Å; Y236-Y546 HydrophobicContact CD2-CD2 4.19Å; Y236-Y546 HydrophobicContact CD2-CE2 4.47Å; Y236-Y546 HydrophobicContact CE2-CD2 4.21Å; Y236-Y546 HydrophobicContact CE2-CE2 4.06Å; V253-Y546 HydrophobicContact CG2-CD2 4.17Å; V253-Y546 HydrophobicContact CG2-CG 4.14Å; I535-Y546 HydrophobicContact CG2-CD1 4.25Å; I535-Y546 HydrophobicContact CG2-CE1 3.97Å; W544-Y546 HydrophobicContact CB-CE1 4.44Å; W544-Y546 HydrophobicContact CB-CE2 4.17Å; W544-Y546 WeakPolarHBondContact CB-OH 3.44Å; Y546-W548 PolarHBondContact O-N 3.13Å; Y546-W548 VanDerWaalsContact O-N 3.16Å; Y546-T549 WeakPolarHBondContact CA-OG1 3.33Å; Y546-T549 WeakPolarHBondContact O-CB 3.39Å; Y546-T549 PolarHBondContact O-N 3.05Å; Y546-T549 PolarHBondContact O-OG1 3.01Å
547	K	92.7	Very high	77.5	Confident	9 Å²	9	38.4 Å²	38.4	4%	0.039	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	-49.2	-42.8	179	177.5	173	173.8	171.3	0	112.8	E73 P219 Y242 D244 V248 D545	E73-K547 IonicContact OE1-NZ 3.08Å; P219-K547 HydrophobicContact CB-CB 4.31Å; P219-K547 HydrophobicContact CB-CG 4.24Å; P219-K547 HydrophobicContact CG-CB 4.12Å; P219-K547 HydrophobicContact CG-CG 4.41Å; Y242-K547 VanDerWaalsContact OH-CE 3.28Å; Y242-K547 WeakPolarHBondContact OH-CE 3.3Å; Y242-K547 PolarHBondContact OH-NZ 2.8Å; D244-K547 WeakPolarHBondContact OD2-CE 3.36Å; D244-K547 IonicContact OD2-NZ 2.68Å; D244-K547 PolarHBondContact OD2-NZ 2.93Å; V248-K547 WeakPolarHBondContact CA-O 3.5Å; V248-K547 HydrophobicContact CG2-CG 4.4Å; D545-K547 WeakPolarHBondContact OD1-CB 3.44Å; D545-K547 PolarHBondContact OD1-N 3.29Å
548	W	91.9	Very high	75.4	Confident	23 Å²	23	44.5 Å²	44.5	9%	0.087	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.2	1.2	-178.6	-58.2	-74	0	0	0	114.7	K80 G534 V536 D545 Y546 R550	K80-W548 HydrophobicContact CG-CE3 4.3Å; K80-W548 HydrophobicContact CG-CZ3 4.33Å; G534-W548 CarbonylContact O-C 3.45Å; V536-W548 HydrophobicContact CB-CE3 4.34Å; V536-W548 HydrophobicContact CG2-CE3 3.68Å; V536-W548 HydrophobicContact CG2-CZ3 4.2Å; D545-W548 WeakPolarHBondContact OD2-CZ3 3.32Å; Y546-W548 PolarHBondContact O-N 3.13Å; Y546-W548 VanDerWaalsContact O-N 3.16Å; W548-R550 VanDerWaalsContact O-CG 3.28Å; W548-R550 WeakPolarHBondContact O-CG 3.48Å
549	T	92.2	Very high	73.7	Confident	0 Å²	0	48.5 Å²	48.5	0%	0	25%	0.246	C	C	.	.			trans	-65.7	143	-178.1	-60.1	0	0	0	0	111.5	F43 L250 V532 G534 I535 Y546	F43-T549 HydrophobicContact CD1-CG2 4.49Å; L250-T549 HydrophobicContact CD1-CG2 3.86Å; L250-T549 HydrophobicContact CD2-CG2 4.27Å; L250-T549 HydrophobicContact CG-CG2 4.3Å; V532-T549 HydrophobicContact CG1-CG2 3.59Å; G534-T549 PolarHBondContact O-N 2.65Å; G534-T549 PolarHBondContact O-OG1 2.85Å; I535-T549 WeakPolarHBondContact CA-OG1 3.37Å; I535-T549 HydrophobicContact CG1-CG2 3.88Å; I535-T549 PolarHBondContact N-OG1 3.16Å; Y546-T549 WeakPolarHBondContact CA-OG1 3.33Å; Y546-T549 WeakPolarHBondContact O-CB 3.39Å; Y546-T549 PolarHBondContact O-N 3.05Å; Y546-T549 PolarHBondContact O-OG1 3.01Å
550	R	84.5	Confident	72.6	Confident	102 Å²	102	49.8 Å²	49.8	39%	0.385	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	105.1	-177	-43.9	-171.6	176.3	180	-7.3	108.2	E247 K249 K533 W548 L552	E247-R550 IonicContact OE1-NH2 3.91Å; E247-R550 IonicContact OE2-NH2 2.63Å; E247-R550 PolarHBondContact OE2-NH2 3.46Å; K249-R550 HydrophobicContact CB-CG 4.01Å; K249-R550 VanDerWaalsContact CE-NH2 3.31Å; K249-R550 HydrophobicContact CG-CG 3.81Å; K533-R550 PolarHBondContact N-O 2.88Å; K533-R550 PolarHBondContact O-N 3.34Å; W548-R550 VanDerWaalsContact O-CG 3.28Å; W548-R550 WeakPolarHBondContact O-CG 3.48Å; R550-L552 PolarHBondContact O-N 3.43Å
551	H	78.7	Confident	71.9	Confident	21 Å²	21	53.4 Å²	53.4	10%	0.097	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	110.5	167.2	175.6	-70.7	0	0	0	108.8	L250 D274 V532 M553	L250-H551 HydrophobicContact CD2-CB 3.88Å; D274-H551 IonicContact OD1-CD2 3.7Å; D274-H551 IonicContact OD1-NE2 3.75Å; D274-H551 IonicContact OD2-CD2 2.77Å; D274-H551 PolarHBondContact OD2-CD2 3.34Å; V532-H551 HydrophobicContact CG2-CB 4.38Å; H551-M553 PolarHBondContact O-N 3.26Å; H551-M553 VanDerWaalsContact O-N 3.1Å
552	L	66	Low	71.1	Confident	101 Å²	101	58.9 Å²	58.9	53%	0.529	28%	0.283	S	S	.	.			trans	-66.7	109.1	175.5	-66.1	170.4	0	0	0	109.8	K531 K533 R550 G554	K531-L552 HydrophobicContact CB-CB 4.38Å; K531-L552 VanDerWaalsContact O-CB 3.26Å; K531-L552 WeakPolarHBondContact O-CB 3.43Å; K531-L552 VanDerWaalsContact O-CG 3.27Å; K531-L552 WeakPolarHBondContact O-CG 3.29Å; K531-L552 PolarHBondContact O-N 2.9Å; K533-L552 HydrophobicContact CG-CD1 4.34Å; R550-L552 PolarHBondContact O-N 3.43Å; L552-G554 PolarHBondContact O-N 2.95Å
553	M	46.7	Very low	70.3	Confident	107 Å²	107	62.4 Å²	62.4	53%	0.527	30%	0.295	S	S	.	.			trans	-67.4	74.5	-175.3	-137.2	-172.6	-160.7	0	0	112.4	N40 H551 L557	N40-M553 VanDerWaalsContact O-CE 3.32Å; N40-M553 WeakPolarHBondContact O-CE 3.12Å; H551-M553 PolarHBondContact O-N 3.26Å; H551-M553 VanDerWaalsContact O-N 3.1Å; M553-L557 WeakPolarHBondContact O-CB 3.06Å
554	G	42.7	Very low	69.9	Low	27 Å²	27	63.9 Å²	63.9	28%	0.278	30%	0.304	S	S	.	.			trans	-108.8	1.2	-164.9	0	0	0	0	0	115.8	L552 K558	L552-G554 PolarHBondContact O-N 2.95Å; G554-K558 WeakPolarHBondContact O-CB 3.47Å
555	S	45.5	Very low	69.4	Low	82 Å²	82	68.9 Å²	68.9	57%	0.573	33%	0.327	S	S	*	.	S	Bend	trans	-85.1	-72.2	172.9	54.4	0	0	0	0	110.4	L557 K558 Y559	S555-L557 PolarHBondContact O-N 2.9Å; S555-K558 PolarHBondContact O-N 2.96Å; S555-K558 VanDerWaalsContact O-N 3.13Å; S555-Y559 WeakPolarHBondContact O-CB 3.4Å; S555-Y559 PolarHBondContact O-N 3.1Å
556	Y	46.7	Very low	68.5	Low	96 Å²	96	72.4 Å²	72.4	38%	0.376	34%	0.342	S	S	.	.	H	α-helix	trans	-65.8	-38.4	-174.5	-153.8	-87.8	0	0	0	112.7	K558 Y559 F560 L848	Y556-K558 PolarHBondContact O-N 3.47Å; Y556-Y559 PolarHBondContact O-N 3.38Å; Y556-F560 VanDerWaalsContact O-CB 3.29Å; Y556-F560 WeakPolarHBondContact O-CB 3.42Å; Y556-F560 PolarHBondContact O-N 3.08Å; Y556-L848 HydrophobicContact CE1-CD2 3.6Å; Y556-L848 WeakPolarHBondContact OH-CD2 3.35Å; Y556-L848 PolarHBondContact OH-O 3.28Å
557	L	50.2	Low	67.7	Low	95 Å²	95	73 Å²	73	50%	0.497	35%	0.345	S	S	.	.	H	α-helix	trans	-66.8	-34.9	174.4	-174.9	61.9	0	0	0	112	M553 S555 F560 L561	M553-L557 WeakPolarHBondContact O-CB 3.06Å; S555-L557 PolarHBondContact O-N 2.9Å; L557-F560 HydrophobicContact CD1-CD1 4.31Å; L557-L561 HydrophobicContact CD1-CD1 4.21Å; L557-L561 HydrophobicContact CD1-CG 4.14Å; L557-L561 HydrophobicContact CD2-CD1 4.49Å; L557-L561 HydrophobicContact CG-CD1 3.91Å; L557-L561 HydrophobicContact CG-CG 4.27Å; L557-L561 WeakPolarHBondContact O-CB 3.23Å; L557-L561 WeakPolarHBondContact O-CG 3.28Å; L557-L561 PolarHBondContact O-N 3.49Å
558	K	46.8	Very low	67.3	Low	155 Å²	155	77.7 Å²	77.7	67%	0.674	37%	0.37	S	S	*	.	H	α-helix	trans	-75.3	-32.9	176	-168.4	177	-176.6	178.5	0	111.6	G554 S555 Y556 K562	G554-K558 WeakPolarHBondContact O-CB 3.47Å; S555-K558 PolarHBondContact O-N 2.96Å; S555-K558 VanDerWaalsContact O-N 3.13Å; Y556-K558 PolarHBondContact O-N 3.47Å; K558-K562 WeakPolarHBondContact O-CB 3.43Å; K558-K562 PolarHBondContact O-N 3.37Å
559	Y	54.5	Low	66.9	Low	87 Å²	87	79 Å²	79	34%	0.341	38%	0.379	S	S	.	.	H	α-helix	trans	-63.4	-49.9	169.5	171.3	-107	0	0	0	111.2	S555 Y556 K562 R563	S555-Y559 WeakPolarHBondContact O-CB 3.4Å; S555-Y559 PolarHBondContact O-N 3.1Å; Y556-Y559 PolarHBondContact O-N 3.38Å; Y559-K562 PolarHBondContact O-N 2.8Å; Y559-R563 PolarHBondContact O-N 3.06Å; Y559-R563 PolarHBondContact OH-NE 3.06Å; Y559-R563 PolarHBondContact OH-NH2 3.41Å
560	F	64.2	Low	66.2	Low	73 Å²	73	79.3 Å²	79.3	32%	0.32	38%	0.38	S	S	.	.	H	α-helix	trans	-59.4	-52.7	173.7	176.6	-98.8	0	0	0	111.7	Y556 L557 K562 R563 V564 L844 L848	Y556-F560 VanDerWaalsContact O-CB 3.29Å; Y556-F560 WeakPolarHBondContact O-CB 3.42Å; Y556-F560 PolarHBondContact O-N 3.08Å; L557-F560 HydrophobicContact CD1-CD1 4.31Å; F560-K562 VanDerWaalsContact C-N 3.31Å; F560-K562 PolarHBondContact O-N 3.43Å; F560-R563 CarbonylContact O-C 3.5Å; F560-R563 PolarHBondContact O-N 2.94Å; F560-R563 VanDerWaalsContact O-N 3.14Å; F560-V564 HydrophobicContact CD1-CG2 4.15Å; F560-V564 HydrophobicContact CD2-CG2 4.3Å; F560-V564 HydrophobicContact CE1-CG2 3.83Å; F560-V564 HydrophobicContact CE2-CG2 4Å; F560-V564 HydrophobicContact CG-CG2 4.39Å; F560-V564 HydrophobicContact CZ-CG2 3.75Å; F560-V564 WeakPolarHBondContact O-CB 3.31Å; F560-V564 WeakPolarHBondContact O-CG2 3.41Å; F560-V564 PolarHBondContact O-N 3.46Å; F560-L844 HydrophobicContact CD2-CD1 4.45Å; F560-L844 HydrophobicContact CE2-CD2 4.02Å; F560-L848 HydrophobicContact CD2-CD1 4.22Å; F560-L848 HydrophobicContact CD2-CD2 4.28Å; F560-L848 HydrophobicContact CE2-CD1 4.28Å
561	L	70.3	Confident	66.2	Low	93 Å²	93	75.6 Å²	75.6	49%	0.487	37%	0.368	S	S	.	.	H	α-helix	trans	-62.9	-34.2	178	-73.4	173.4	0	0	0	112.5	L557 V564 F565	L557-L561 HydrophobicContact CD1-CD1 4.21Å; L557-L561 HydrophobicContact CD1-CG 4.14Å; L557-L561 HydrophobicContact CD2-CD1 4.49Å; L557-L561 HydrophobicContact CG-CD1 3.91Å; L557-L561 HydrophobicContact CG-CG 4.27Å; L557-L561 WeakPolarHBondContact O-CB 3.23Å; L557-L561 WeakPolarHBondContact O-CG 3.28Å; L557-L561 PolarHBondContact O-N 3.49Å; L561-V564 PolarHBondContact O-N 3.49Å; L561-F565 WeakPolarHBondContact O-CB 3.45Å; L561-F565 PolarHBondContact O-N 3.41Å
562	K	68.1	Low	66.6	Low	130 Å²	130	80.5 Å²	80.5	57%	0.565	39%	0.386	S	S	*	.	H	α-helix	trans	-65	-45.5	172.3	179.1	178.9	176.5	-173.7	0	110.8	K558 Y559 F560 F566	K558-K562 WeakPolarHBondContact O-CB 3.43Å; K558-K562 PolarHBondContact O-N 3.37Å; Y559-K562 PolarHBondContact O-N 2.8Å; F560-K562 VanDerWaalsContact C-N 3.31Å; F560-K562 PolarHBondContact O-N 3.43Å; K562-F566 HydrophobicContact CD-CE2 4.3Å; K562-F566 HydrophobicContact CG-CD2 3.85Å; K562-F566 HydrophobicContact CG-CE2 3.56Å; K562-F566 HydrophobicContact CG-CZ 4.43Å; K562-F566 VanDerWaalsContact O-CB 3.27Å; K562-F566 WeakPolarHBondContact O-CB 3.44Å; K562-F566 WeakPolarHBondContact O-CD2 3.19Å; K562-F566 VanDerWaalsContact O-CG 3.29Å; K562-F566 WeakPolarHBondContact O-CG 3.39Å; K562-F566 PolarHBondContact O-N 3.1Å
563	R	70.2	Confident	67.4	Low	80 Å²	80	77.9 Å²	77.9	30%	0.302	37%	0.372	S	S	.	.	H	α-helix	trans	-65.6	-37.8	173.8	-74.2	-170.2	178.7	-93.5	13	112.8	Y559 F560 F566 M567 L844 D847	Y559-R563 PolarHBondContact O-N 3.06Å; Y559-R563 PolarHBondContact OH-NE 3.06Å; Y559-R563 PolarHBondContact OH-NH2 3.41Å; F560-R563 CarbonylContact O-C 3.5Å; F560-R563 PolarHBondContact O-N 2.94Å; F560-R563 VanDerWaalsContact O-N 3.14Å; R563-F566 CarbonylContact O-C 3.6Å; R563-F566 PolarHBondContact O-N 2.99Å; R563-M567 VanDerWaalsContact O-CB 3.31Å; R563-M567 WeakPolarHBondContact O-CB 3.29Å; R563-M567 PolarHBondContact O-N 3.42Å; R563-L844 HydrophobicContact CB-CD1 3.87Å; R563-D847 IonicContact CZ-OD1 2.73Å; R563-D847 IonicContact CZ-OD2 2.73Å; R563-D847 VanDerWaalsContact CZ-OD2 3.25Å; R563-D847 IonicContact NE-OD2 3.79Å; R563-D847 IonicContact NH1-OD1 2.59Å; R563-D847 PolarHBondContact NH1-OD1 2.9Å; R563-D847 IonicContact NH1-OD2 2.78Å; R563-D847 PolarHBondContact NH1-OD2 3.45Å; R563-D847 VanDerWaalsContact NH2-CG 3.32Å; R563-D847 IonicContact NH2-OD1 3.11Å; R563-D847 PolarHBondContact NH2-OD1 3.32Å; R563-D847 IonicContact NH2-OD2 3.15Å
564	V	77.4	Confident	69	Low	34 Å²	34	72.8 Å²	72.8	21%	0.206	35%	0.347	C	S	.	.	H	α-helix	trans	-71.3	-42.8	177	170	0	0	0	0	111.7	F560 L561 F566 M567 L568 L844	F560-V564 HydrophobicContact CD1-CG2 4.15Å; F560-V564 HydrophobicContact CD2-CG2 4.3Å; F560-V564 HydrophobicContact CE1-CG2 3.83Å; F560-V564 HydrophobicContact CE2-CG2 4Å; F560-V564 HydrophobicContact CG-CG2 4.39Å; F560-V564 HydrophobicContact CZ-CG2 3.75Å; F560-V564 WeakPolarHBondContact O-CB 3.31Å; F560-V564 WeakPolarHBondContact O-CG2 3.41Å; F560-V564 PolarHBondContact O-N 3.46Å; L561-V564 PolarHBondContact O-N 3.49Å; V564-F566 VanDerWaalsContact C-N 3.32Å; V564-F566 PolarHBondContact O-N 3.44Å; V564-M567 WeakPolarHBondContact O-CB 3.1Å; V564-M567 PolarHBondContact O-N 3.12Å; V564-L568 HydrophobicContact CG1-CD1 4.44Å; V564-L568 WeakPolarHBondContact O-CG 3.48Å; V564-L568 PolarHBondContact O-N 3.33Å; V564-L844 HydrophobicContact CG2-CD2 4.06Å
565	F	80.2	Confident	71	Confident	126 Å²	126	71.5 Å²	71.5	55%	0.553	33%	0.334	S	S	*	.	H	α-helix	trans	-60.2	-43	171.8	175.1	-106.4	0	0	0	111.3	L561 L568 I569	L561-F565 WeakPolarHBondContact O-CB 3.45Å; L561-F565 PolarHBondContact O-N 3.41Å; F565-L568 PolarHBondContact O-N 3.43Å; F565-I569 HydrophobicContact CD1-CD1 3.9Å; F565-I569 HydrophobicContact CE1-CD1 3.42Å; F565-I569 VanDerWaalsContact CE1-CD1 3.42Å; F565-I569 HydrophobicContact CE2-CD1 4.19Å; F565-I569 HydrophobicContact CG-CD1 4.48Å; F565-I569 HydrophobicContact CZ-CD1 3.59Å; F565-I569 WeakPolarHBondContact O-CG1 3.22Å; F565-I569 PolarHBondContact O-N 2.89Å
566	F	73.7	Confident	72.9	Confident	74 Å²	74	68.6 Å²	68.6	33%	0.325	31%	0.312	S	S	.	.	H	α-helix	trans	-68.9	-34.2	173.6	-74.5	-33.4	0	0	0	113.5	K562 R563 V564 I569 T570 R1013	K562-F566 HydrophobicContact CD-CE2 4.3Å; K562-F566 HydrophobicContact CG-CD2 3.85Å; K562-F566 HydrophobicContact CG-CE2 3.56Å; K562-F566 HydrophobicContact CG-CZ 4.43Å; K562-F566 VanDerWaalsContact O-CB 3.27Å; K562-F566 WeakPolarHBondContact O-CB 3.44Å; K562-F566 WeakPolarHBondContact O-CD2 3.19Å; K562-F566 VanDerWaalsContact O-CG 3.29Å; K562-F566 WeakPolarHBondContact O-CG 3.39Å; K562-F566 PolarHBondContact O-N 3.1Å; R563-F566 CarbonylContact O-C 3.6Å; R563-F566 PolarHBondContact O-N 2.99Å; V564-F566 VanDerWaalsContact C-N 3.32Å; V564-F566 PolarHBondContact O-N 3.44Å; F566-I569 HydrophobicContact CD1-CD1 4.22Å; F566-I569 PolarHBondContact O-N 2.62Å; F566-T570 WeakPolarHBondContact O-CB 3.42Å; F566-T570 PolarHBondContact O-N 2.85Å; F566-T570 PolarHBondContact O-OG1 3.43Å; F566-T570 VanDerWaalsContact O-OG1 3.06Å; F566-R1013 PolarHBondContact O-NH2 3.37Å
567	M	78.5	Confident	74.5	Confident	17 Å²	17	66.8 Å²	66.8	8%	0.084	31%	0.309	C	S	.	.	H	α-helix	trans	-59.7	-48.3	169.4	169.7	-169.3	-64.1	0	0	110.6	R563 V564 I569 T570 L571 V840 L844	R563-M567 VanDerWaalsContact O-CB 3.31Å; R563-M567 WeakPolarHBondContact O-CB 3.29Å; R563-M567 PolarHBondContact O-N 3.42Å; V564-M567 WeakPolarHBondContact O-CB 3.1Å; V564-M567 PolarHBondContact O-N 3.12Å; M567-I569 VanDerWaalsContact C-N 3.35Å; M567-I569 PolarHBondContact O-N 2.71Å; M567-T570 PolarHBondContact O-N 2.95Å; M567-L571 HydrophobicContact CG-CD1 3.78Å; M567-L571 HydrophobicContact CG-CG 4.39Å; M567-L571 WeakPolarHBondContact O-CB 3.28Å; M567-L571 VanDerWaalsContact O-CG 3.28Å; M567-L571 WeakPolarHBondContact O-CG 3.35Å; M567-L571 PolarHBondContact O-N 3.14Å; M567-V840 HydrophobicContact CB-CG1 3.71Å; M567-V840 HydrophobicContact CE-CG1 4.02Å; M567-V840 WeakPolarHBondContact CE-O 3.38Å; M567-V840 HydrophobicContact CG-CB 4.13Å; M567-V840 HydrophobicContact CG-CG1 3.59Å; M567-L844 HydrophobicContact CE-CB 3.76Å; M567-L844 HydrophobicContact CE-CD2 3.52Å; M567-L844 HydrophobicContact CE-CG 4.24Å
568	L	83.8	Confident	75.8	Confident	109 Å²	109	62.3 Å²	62.3	57%	0.571	29%	0.285	S	S	*	.	H	α-helix	trans	-61	-41.6	177.4	-69	170.7	0	0	0	111.9	V564 F565 L571 W572	V564-L568 HydrophobicContact CG1-CD1 4.44Å; V564-L568 WeakPolarHBondContact O-CG 3.48Å; V564-L568 PolarHBondContact O-N 3.33Å; F565-L568 PolarHBondContact O-N 3.43Å; L568-L571 PolarHBondContact O-N 2.68Å; L568-W572 VanDerWaalsContact O-CB 3.26Å; L568-W572 WeakPolarHBondContact O-CB 3.43Å; L568-W572 PolarHBondContact O-N 2.99Å
569	I	83.7	Confident	77.6	Confident	51 Å²	51	55.3 Å²	55.3	26%	0.262	26%	0.255	S	S	.	.	H	α-helix	trans	-62.4	-45.4	173	-73.7	169.9	0	0	0	111.4	F565 F566 M567 W572 L573	F565-I569 HydrophobicContact CD1-CD1 3.9Å; F565-I569 HydrophobicContact CE1-CD1 3.42Å; F565-I569 VanDerWaalsContact CE1-CD1 3.42Å; F565-I569 HydrophobicContact CE2-CD1 4.19Å; F565-I569 HydrophobicContact CG-CD1 4.48Å; F565-I569 HydrophobicContact CZ-CD1 3.59Å; F565-I569 WeakPolarHBondContact O-CG1 3.22Å; F565-I569 PolarHBondContact O-N 2.89Å; F566-I569 HydrophobicContact CD1-CD1 4.22Å; F566-I569 PolarHBondContact O-N 2.62Å; M567-I569 VanDerWaalsContact C-N 3.35Å; M567-I569 PolarHBondContact O-N 2.71Å; I569-W572 PolarHBondContact O-N 2.89Å; I569-L573 HydrophobicContact CG2-CD1 3.86Å; I569-L573 HydrophobicContact CG2-CG 4.41Å; I569-L573 WeakPolarHBondContact O-CB 3.29Å; I569-L573 VanDerWaalsContact O-CG 3.3Å; I569-L573 WeakPolarHBondContact O-CG 3.47Å; I569-L573 PolarHBondContact O-N 3.17Å
570	T	78.7	Confident	79	Confident	5 Å²	5	55.2 Å²	55.2	3%	0.031	26%	0.256	C	S	.	.	H	α-helix	trans	-62.5	-45	179.3	-66.3	0	0	0	0	110.8	F566 M567 L573 I574 V840 R1013	F566-T570 WeakPolarHBondContact O-CB 3.42Å; F566-T570 PolarHBondContact O-N 2.85Å; F566-T570 PolarHBondContact O-OG1 3.43Å; F566-T570 VanDerWaalsContact O-OG1 3.06Å; M567-T570 PolarHBondContact O-N 2.95Å; T570-L573 PolarHBondContact O-N 2.83Å; T570-I574 HydrophobicContact CG2-CD1 3.74Å; T570-I574 WeakPolarHBondContact O-CD1 3.33Å; T570-I574 WeakPolarHBondContact O-CG1 3.45Å; T570-I574 PolarHBondContact O-N 2.92Å; T570-V840 HydrophobicContact CG2-CG2 4.07Å; T570-R1013 PolarHBondContact OG1-NH1 3.21Å; T570-R1013 PolarHBondContact OG1-NH2 2.93Å
571	L	84.1	Confident	79.3	Confident	24 Å²	24	54.3 Å²	54.3	13%	0.126	26%	0.255	C	S	.	.	H	α-helix	trans	-66.8	-39.9	177.6	-66.1	170.8	0	0	0	112.5	M567 L568 I574 A575 F837	M567-L571 HydrophobicContact CG-CD1 3.78Å; M567-L571 HydrophobicContact CG-CG 4.39Å; M567-L571 WeakPolarHBondContact O-CB 3.28Å; M567-L571 VanDerWaalsContact O-CG 3.28Å; M567-L571 WeakPolarHBondContact O-CG 3.35Å; M567-L571 PolarHBondContact O-N 3.14Å; L568-L571 PolarHBondContact O-N 2.68Å; L571-I574 PolarHBondContact O-N 3.41Å; L571-A575 WeakPolarHBondContact O-CB 3.38Å; L571-A575 PolarHBondContact O-N 3Å; L571-F837 HydrophobicContact CD1-CD2 3.83Å; L571-F837 HydrophobicContact CD2-CB 4.26Å
572	W	87.1	Confident	79.5	Confident	125 Å²	125	50.5 Å²	50.5	47%	0.473	24%	0.235	S	C	.	.	H	α-helix	trans	-63.4	-42.8	174	171.7	68.6	0	0	0	111.9	L568 I569 A575 T576 Y618	L568-W572 VanDerWaalsContact O-CB 3.26Å; L568-W572 WeakPolarHBondContact O-CB 3.43Å; L568-W572 PolarHBondContact O-N 2.99Å; I569-W572 PolarHBondContact O-N 2.89Å; W572-A575 PolarHBondContact O-N 3.24Å; W572-T576 WeakPolarHBondContact O-CB 3.35Å; W572-T576 PolarHBondContact O-N 2.87Å; W572-T576 PolarHBondContact O-OG1 3.43Å; W572-Y618 PolarHBondContact NE1-OH 3.28Å
573	L	82.8	Confident	79.8	Confident	45 Å²	45	47.6 Å²	47.6	24%	0.236	22%	0.223	C	C	.	.	H	α-helix	trans	-64.4	-42.1	175.6	-74.1	171.9	0	0	0	111.7	I569 T570 T576 I577 I1017	I569-L573 HydrophobicContact CG2-CD1 3.86Å; I569-L573 HydrophobicContact CG2-CG 4.41Å; I569-L573 WeakPolarHBondContact O-CB 3.29Å; I569-L573 VanDerWaalsContact O-CG 3.3Å; I569-L573 WeakPolarHBondContact O-CG 3.47Å; I569-L573 PolarHBondContact O-N 3.17Å; T570-L573 PolarHBondContact O-N 2.83Å; L573-T576 WeakPolarHBondContact O-CB 3.22Å; L573-T576 PolarHBondContact O-N 3.23Å; L573-I577 WeakPolarHBondContact O-CB 3.31Å; L573-I577 VanDerWaalsContact O-CG1 3.25Å; L573-I577 WeakPolarHBondContact O-CG1 3.39Å; L573-I577 PolarHBondContact O-N 3.06Å; L573-I1017 HydrophobicContact CB-CG2 4.25Å; L573-I1017 HydrophobicContact CD1-CD1 3.51Å; L573-I1017 HydrophobicContact CD1-CG1 3.94Å; L573-I1017 HydrophobicContact CD1-CG2 4.27Å
574	I	79.9	Confident	79.7	Confident	0 Å²	0	49.5 Å²	49.5	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-63.8	-42.7	175.5	-66.2	162	0	0	0	110.9	T570 L571 T576 I577 T578 T832 I833 G1020 I1021	T570-I574 HydrophobicContact CG2-CD1 3.74Å; T570-I574 WeakPolarHBondContact O-CD1 3.33Å; T570-I574 WeakPolarHBondContact O-CG1 3.45Å; T570-I574 PolarHBondContact O-N 2.92Å; L571-I574 PolarHBondContact O-N 3.41Å; I574-T576 VanDerWaalsContact C-N 3.31Å; I574-T576 PolarHBondContact O-N 3.48Å; I574-I577 PolarHBondContact O-N 3.44Å; I574-T578 VanDerWaalsContact O-CB 3.26Å; I574-T578 WeakPolarHBondContact O-CB 3.49Å; I574-T578 PolarHBondContact O-N 3.12Å; I574-T578 PolarHBondContact O-OG1 2.78Å; I574-T832 HydrophobicContact CG2-CG2 4.31Å; I574-I833 HydrophobicContact CG2-CD1 4.2Å; I574-G1020 WeakPolarHBondContact CD1-O 3.32Å; I574-I1021 HydrophobicContact CG1-CG1 3.98Å; I574-I1021 HydrophobicContact CG2-CG1 4.38Å
575	A	84.4	Confident	79	Confident	1 Å²	1	48.9 Å²	48.9	1%	0.008	23%	0.234	C	C	.	.	H	α-helix	trans	-59.3	-43	173.8	0	0	0	0	0	111.8	L571 W572 F579 Y621 L622 L625 I833	L571-A575 WeakPolarHBondContact O-CB 3.38Å; L571-A575 PolarHBondContact O-N 3Å; W572-A575 PolarHBondContact O-N 3.24Å; A575-F579 VanDerWaalsContact O-CB 3.22Å; A575-F579 WeakPolarHBondContact O-CB 3.49Å; A575-F579 PolarHBondContact O-N 2.8Å; A575-Y621 HydrophobicContact CB-CE1 3.89Å; A575-Y621 WeakPolarHBondContact O-CE1 3.33Å; A575-L622 HydrophobicContact CB-CD2 4.49Å; A575-L625 HydrophobicContact CB-CD1 3.84Å; A575-I833 HydrophobicContact CB-CD1 3.65Å
576	T	86	Confident	78	Confident	20 Å²	20	47 Å²	47	12%	0.123	24%	0.235	C	C	.	.	H	α-helix	trans	-65.5	-50.3	179.1	-55.5	0	0	0	0	111.7	W572 L573 I574 F579 F580 Y618	W572-T576 WeakPolarHBondContact O-CB 3.35Å; W572-T576 PolarHBondContact O-N 2.87Å; W572-T576 PolarHBondContact O-OG1 3.43Å; L573-T576 WeakPolarHBondContact O-CB 3.22Å; L573-T576 PolarHBondContact O-N 3.23Å; I574-T576 VanDerWaalsContact C-N 3.31Å; I574-T576 PolarHBondContact O-N 3.48Å; T576-F579 PolarHBondContact O-N 2.82Å; T576-F580 HydrophobicContact CG2-CD2 3.78Å; T576-F580 HydrophobicContact CG2-CE2 3.77Å; T576-F580 VanDerWaalsContact O-CD2 3.25Å; T576-F580 WeakPolarHBondContact O-CD2 3.29Å; T576-F580 PolarHBondContact O-N 3.13Å; T576-Y618 HydrophobicContact CG2-CE2 4.02Å; T576-Y618 PolarHBondContact OG1-OH 3.47Å
577	I	79.9	Confident	77.4	Confident	59 Å²	59	46.5 Å²	46.5	30%	0.303	25%	0.25	S	S	.	.	H	α-helix	trans	-61.4	-47.1	177.8	-69.2	164.2	0	0	0	110.2	L573 I574 F579 F580 L581 I1017 I1021	L573-I577 WeakPolarHBondContact O-CB 3.31Å; L573-I577 VanDerWaalsContact O-CG1 3.25Å; L573-I577 WeakPolarHBondContact O-CG1 3.39Å; L573-I577 PolarHBondContact O-N 3.06Å; I574-I577 PolarHBondContact O-N 3.44Å; I577-F579 PolarHBondContact O-N 2.76Å; I577-F580 PolarHBondContact O-N 3.39Å; I577-L581 HydrophobicContact CG2-CD1 3.65Å; I577-L581 HydrophobicContact CG2-CG 4.37Å; I577-L581 WeakPolarHBondContact O-CB 3.44Å; I577-L581 VanDerWaalsContact O-CG 3.26Å; I577-L581 WeakPolarHBondContact O-CG 3.27Å; I577-L581 PolarHBondContact O-N 3.03Å; I577-I1017 HydrophobicContact CD1-CG2 4.44Å; I577-I1021 HydrophobicContact CD1-CD1 4.44Å; I577-I1021 HydrophobicContact CG2-CD1 4.07Å
578	T	77.9	Confident	76.8	Confident	1 Å²	1	47 Å²	47	1%	0.006	25%	0.254	C	S	.	.	H	α-helix	trans	-61.9	-46.6	179.2	-49.8	0	0	0	0	110.7	I574 L581 M582 M829 T832	I574-T578 VanDerWaalsContact O-CB 3.26Å; I574-T578 WeakPolarHBondContact O-CB 3.49Å; I574-T578 PolarHBondContact O-N 3.12Å; I574-T578 PolarHBondContact O-OG1 2.78Å; T578-L581 PolarHBondContact O-N 3.11Å; T578-M582 HydrophobicContact CG2-CE 3.99Å; T578-M582 VanDerWaalsContact O-CG 3.25Å; T578-M582 WeakPolarHBondContact O-CG 3.2Å; T578-M582 PolarHBondContact O-N 3.2Å; T578-M829 HydrophobicContact CG2-CG 4.05Å; T578-T832 HydrophobicContact CG2-CG2 4.06Å
579	F	84.7	Confident	76	Confident	8 Å²	8	42.2 Å²	42.2	4%	0.035	23%	0.229	C	C	.	.	H	α-helix	trans	-59.1	-49.9	177.8	176.6	-87	0	0	0	112.2	A575 T576 I577 L581 M582 Q583 V614 Q617 Y618 Y621 M829	A575-F579 VanDerWaalsContact O-CB 3.22Å; A575-F579 WeakPolarHBondContact O-CB 3.49Å; A575-F579 PolarHBondContact O-N 2.8Å; T576-F579 PolarHBondContact O-N 2.82Å; I577-F579 PolarHBondContact O-N 2.76Å; F579-L581 VanDerWaalsContact C-N 3.34Å; F579-L581 PolarHBondContact O-N 2.89Å; F579-M582 WeakPolarHBondContact O-CB 3.28Å; F579-M582 PolarHBondContact O-N 2.93Å; F579-Q583 HydrophobicContact CD1-CG 4.26Å; F579-Q583 HydrophobicContact CE1-CG 3.72Å; F579-Q583 HydrophobicContact CZ-CG 3.96Å; F579-Q583 WeakPolarHBondContact O-CG 3.17Å; F579-Q583 PolarHBondContact O-N 3.2Å; F579-V614 HydrophobicContact CE1-CG1 3.94Å; F579-V614 HydrophobicContact CZ-CG1 4.4Å; F579-Q617 HydrophobicContact CE2-CB 4.21Å; F579-Q617 HydrophobicContact CZ-CB 3.75Å; F579-Y618 HydrophobicContact CB-CD2 4.4Å; F579-Y618 AromaticContact CD1-CD2 3.69Å; F579-Y618 HydrophobicContact CD1-CD2 3.69Å; F579-Y618 HydrophobicContact CD1-CG 4.23Å; F579-Y618 HydrophobicContact CE1-CD2 4.17Å; F579-Y618 HydrophobicContact CE1-CG 4.28Å; F579-Y618 AromaticContact CG-CD2 3.97Å; F579-Y618 HydrophobicContact CG-CD2 3.97Å; F579-Y618 VanDerWaalsContact CZ-N 3.32Å; F579-Y621 HydrophobicContact CB-CD1 3.92Å; F579-Y621 HydrophobicContact CB-CE1 3.79Å; F579-Y621 AromaticContact CD2-CD1 3.69Å; F579-Y621 HydrophobicContact CD2-CD1 3.69Å; F579-Y621 HydrophobicContact CD2-CD2 4.35Å; F579-Y621 HydrophobicContact CD2-CE1 4.31Å; F579-Y621 AromaticContact CD2-CG 3.7Å; F579-Y621 HydrophobicContact CD2-CG 3.7Å; F579-Y621 HydrophobicContact CE2-CG 4.35Å; F579-Y621 HydrophobicContact CG-CD1 4.02Å; F579-Y621 HydrophobicContact CG-CE1 4.39Å; F579-Y621 HydrophobicContact CG-CG 4.48Å; F579-M829 HydrophobicContact CD2-SD 4.33Å
580	F	82.5	Confident	75.3	Confident	84 Å²	84	40.9 Å²	40.9	37%	0.368	22%	0.221	S	C	.	.	H	α-helix	trans	-70	-29.8	-178.7	-76.3	-64.5	0	0	0	112.9	T576 I577 Q583 L584 V614 Y618	T576-F580 HydrophobicContact CG2-CD2 3.78Å; T576-F580 HydrophobicContact CG2-CE2 3.77Å; T576-F580 VanDerWaalsContact O-CD2 3.25Å; T576-F580 WeakPolarHBondContact O-CD2 3.29Å; T576-F580 PolarHBondContact O-N 3.13Å; I577-F580 PolarHBondContact O-N 3.39Å; F580-Q583 PolarHBondContact O-N 2.97Å; F580-L584 WeakPolarHBondContact O-CG 3.49Å; F580-L584 PolarHBondContact O-N 3.49Å; F580-V614 HydrophobicContact CD1-CG1 4.41Å; F580-V614 HydrophobicContact CE1-CG1 3.99Å; F580-Y618 HydrophobicContact CE2-CD2 4.27Å; F580-Y618 HydrophobicContact CE2-CE2 4.28Å; F580-Y618 HydrophobicContact CE2-CG 4.47Å; F580-Y618 HydrophobicContact CZ-CD1 4.47Å; F580-Y618 HydrophobicContact CZ-CD2 4.48Å; F580-Y618 HydrophobicContact CZ-CG 4.28Å
581	L	71.9	Confident	74.6	Confident	55 Å²	55	43.6 Å²	43.6	29%	0.288	24%	0.238	S	C	.	.	H	α-helix	trans	-67.6	-36.5	170.4	-71.5	171	0	0	0	112.1	I577 T578 F579 Q583 L584 L585 L1029	I577-L581 HydrophobicContact CG2-CD1 3.65Å; I577-L581 HydrophobicContact CG2-CG 4.37Å; I577-L581 WeakPolarHBondContact O-CB 3.44Å; I577-L581 VanDerWaalsContact O-CG 3.26Å; I577-L581 WeakPolarHBondContact O-CG 3.27Å; I577-L581 PolarHBondContact O-N 3.03Å; T578-L581 PolarHBondContact O-N 3.11Å; F579-L581 VanDerWaalsContact C-N 3.34Å; F579-L581 PolarHBondContact O-N 2.89Å; L581-Q583 PolarHBondContact O-N 3.08Å; L581-L584 HydrophobicContact CD2-CD1 4.39Å; L581-L584 PolarHBondContact O-N 2.82Å; L581-L584 VanDerWaalsContact O-N 3.13Å; L581-L585 WeakPolarHBondContact O-CD2 3.27Å; L581-L1029 HydrophobicContact CB-CD1 4.28Å; L581-L1029 HydrophobicContact CB-CD2 4.3Å; L581-L1029 HydrophobicContact CD1-CD1 3.78Å
582	M	74	Confident	73.6	Confident	13 Å²	13	47 Å²	47	6%	0.064	26%	0.256	C	S	.	.	H	α-helix	trans	-63.9	-27.6	172.8	-65.2	-68.9	166	0	0	112.9	T578 F579 L584 L585 Y825 I828 M829 L1029	T578-M582 HydrophobicContact CG2-CE 3.99Å; T578-M582 VanDerWaalsContact O-CG 3.25Å; T578-M582 WeakPolarHBondContact O-CG 3.2Å; T578-M582 PolarHBondContact O-N 3.2Å; F579-M582 WeakPolarHBondContact O-CB 3.28Å; F579-M582 PolarHBondContact O-N 2.93Å; M582-L584 VanDerWaalsContact C-N 3.31Å; M582-L585 WeakPolarHBondContact O-CG 3.19Å; M582-L585 HydrophobicContact SD-CD1 3.73Å; M582-Y825 HydrophobicContact SD-CD1 4.15Å; M582-Y825 HydrophobicContact SD-CG 4.33Å; M582-I828 HydrophobicContact CE-CB 3.91Å; M582-I828 HydrophobicContact CE-CG2 3.43Å; M582-I828 VanDerWaalsContact CE-CG2 3.43Å; M582-M829 HydrophobicContact CB-SD 4.44Å; M582-M829 HydrophobicContact CE-CG 4.06Å; M582-M829 HydrophobicContact CG-CG 3.72Å; M582-M829 HydrophobicContact CG-SD 3.95Å; M582-M829 HydrophobicContact SD-CG 4.42Å; M582-L1029 HydrophobicContact CE-CD2 3.8Å; M582-L1029 HydrophobicContact SD-CD2 4.36Å
583	Q	73.5	Confident	72.5	Confident	68 Å²	68	44.9 Å²	44.9	32%	0.318	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.9	-10.5	176.5	-62.7	-76.7	-25.1	0	0	113.2	F579 F580 L581 V614	F579-Q583 HydrophobicContact CD1-CG 4.26Å; F579-Q583 HydrophobicContact CE1-CG 3.72Å; F579-Q583 HydrophobicContact CZ-CG 3.96Å; F579-Q583 WeakPolarHBondContact O-CG 3.17Å; F579-Q583 PolarHBondContact O-N 3.2Å; F580-Q583 PolarHBondContact O-N 2.97Å; L581-Q583 PolarHBondContact O-N 3.08Å; Q583-V614 HydrophobicContact CB-CG1 4.49Å; Q583-V614 HydrophobicContact CG-CG1 3.9Å
584	L	68.1	Low	71.6	Confident	120 Å²	120	52.1 Å²	52.1	63%	0.628	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.8	0.8	177.3	-68.8	168.4	0	0	0	113	F580 L581 M582	F580-L584 WeakPolarHBondContact O-CG 3.49Å; F580-L584 PolarHBondContact O-N 3.49Å; L581-L584 HydrophobicContact CD2-CD1 4.39Å; L581-L584 PolarHBondContact O-N 2.82Å; L581-L584 VanDerWaalsContact O-N 3.13Å; M582-L584 VanDerWaalsContact C-N 3.31Å
585	L	64	Low	71.3	Confident	22 Å²	22	62 Å²	62	12%	0.115	32%	0.321	C	S	.	.			trans	-74.3	129.9	-177.7	-54.1	-178.3	0	0	0	111.1	L581 M582 Y825 V1032 V1033	L581-L585 WeakPolarHBondContact O-CD2 3.27Å; M582-L585 WeakPolarHBondContact O-CG 3.19Å; M582-L585 HydrophobicContact SD-CD1 3.73Å; L585-Y825 HydrophobicContact CD1-CD1 3.87Å; L585-Y825 HydrophobicContact CD1-CE1 3.5Å; L585-V1032 HydrophobicContact CB-CG1 4.26Å; L585-V1032 HydrophobicContact CD1-CG1 4.24Å; L585-V1032 HydrophobicContact CD2-CB 4.04Å; L585-V1032 HydrophobicContact CD2-CG1 3.78Å; L585-V1032 HydrophobicContact CG-CG1 4.3Å; L585-V1033 HydrophobicContact CD2-CG2 3.87Å
586	P	58	Low	70.8	Confident	87 Å²	87	64.5 Å²	64.5	57%	0.565	34%	0.335	S	S	*	.	S	Bend	trans	-72.6	142.8	173.4	30	-33.8	0	0	0	111.7	V1032	P586-V1032 VanDerWaalsContact CD-O 3.3Å; P586-V1032 WeakPolarHBondContact CD-O 3.23Å; P586-V1032 WeakPolarHBondContact CG-O 3.33Å
587	G	61.3	Low	70.5	Confident	63 Å²	63	65.6 Å²	65.6	65%	0.649	34%	0.343	S	S	*	.	S	Bend	trans	106	-151.5	177.3	0	0	0	0	0	113.5
588	T	66	Low	70.4	Confident	26 Å²	26	68 Å²	68	16%	0.16	36%	0.362	C	S	.	.			trans	-132.9	160.2	173.1	60.7	0	0	0	0	110.9	Y590 Q593	T588-Y590 PolarHBondContact O-N 3.21Å; T588-Y590 VanDerWaalsContact O-N 3.11Å; T588-Q593 HydrophobicContact CG2-CG 4.44Å; T588-Q593 VanDerWaalsContact CG2-OE1 3.24Å; T588-Q593 VanDerWaalsContact OG1-CD 3.23Å; T588-Q593 PolarHBondContact OG1-OE1 2.75Å
589	P	66.7	Low	70.4	Confident	9 Å²	9	75.2 Å²	75.2	6%	0.058	40%	0.396	C	S	.	.	S	Bend	trans	-66.5	-1.9	172	24.7	-34.1	0	0	0	114.9	L610 F634 Q635 Y825	P589-L610 HydrophobicContact CG-CD1 3.82Å; P589-F634 HydrophobicContact CB-CD2 3.27Å; P589-F634 HydrophobicContact CB-CE2 3.59Å; P589-F634 HydrophobicContact CB-CG 4.16Å; P589-F634 HydrophobicContact CG-CD2 4.13Å; P589-F634 HydrophobicContact CG-CE2 4.06Å; P589-Q635 PolarHBondContact O-NE2 3Å; P589-Y825 HydrophobicContact CB-CD2 4.04Å; P589-Y825 HydrophobicContact CB-CE2 3.73Å; P589-Y825 HydrophobicContact CG-CE2 4.19Å
590	Y	71	Confident	70	Confident	24 Å²	24	77.1 Å²	77.1	9%	0.094	41%	0.408	C	S	.	.	S	Bend	trans	-101.5	115.3	-171.4	-52.7	-54.4	0	0	0	111.5	T588 N592 Q593 L596 I601 L604 N605	T588-Y590 PolarHBondContact O-N 3.21Å; T588-Y590 VanDerWaalsContact O-N 3.11Å; Y590-N592 PolarHBondContact O-N 2.93Å; Y590-Q593 PolarHBondContact O-N 3.05Å; Y590-L596 HydrophobicContact CD2-CD1 4.44Å; Y590-L596 HydrophobicContact CG-CD1 4.12Å; Y590-I601 HydrophobicContact CD2-CG2 4.48Å; Y590-I601 HydrophobicContact CE2-CG2 4.34Å; Y590-L604 HydrophobicContact CD1-CD1 4.26Å; Y590-L604 HydrophobicContact CE1-CB 4.01Å; Y590-L604 HydrophobicContact CE1-CD1 4.17Å; Y590-L604 HydrophobicContact CE2-CB 4.05Å; Y590-L604 HydrophobicContact CE2-CD1 4.48Å; Y590-L604 HydrophobicContact CG-CD1 4.48Å; Y590-L604 VanDerWaalsContact OH-C 3.31Å; Y590-L604 WeakPolarHBondContact OH-CB 3.49Å; Y590-N605 WeakPolarHBondContact CE2-OD1 3.41Å; Y590-N605 PolarHBondContact OH-N 3.48Å; Y590-N605 PolarHBondContact OH-OD1 3.36Å
591	T	62.5	Low	69.7	Low	62 Å²	62	74.3 Å²	74.3	38%	0.38	40%	0.397	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.7	132.7	175	44.6	0	0	0	0	109.7	Q635	T591-Q635 PolarHBondContact OG1-OE1 3.3Å
592	N	63.5	Low	69.9	Low	95 Å²	95	74.5 Å²	74.5	51%	0.508	41%	0.406	S	S	.	.	T	Hydrogen-bonded Turn	trans	63.2	42.2	-171.3	-44.2	-97.3	0	0	0	114.3	Y590 E594 R595	Y590-N592 PolarHBondContact O-N 2.93Å; N592-E594 PolarHBondContact O-N 2.59Å; N592-R595 HydrophobicContact CB-CB 4.46Å; N592-R595 HydrophobicContact CB-CG 4.17Å; N592-R595 WeakPolarHBondContact O-CB 3.27Å; N592-R595 PolarHBondContact O-N 3.01Å
593	Q	64.5	Low	70.1	Confident	81 Å²	81	78.6 Å²	78.6	38%	0.379	43%	0.426	S	S	.	.	G	3₁₀ helix	trans	-45.6	-37.3	174.7	-175.7	-174.9	-17.7	0	0	113.7	T588 Y590 R595 L596 I601	T588-Q593 HydrophobicContact CG2-CG 4.44Å; T588-Q593 VanDerWaalsContact CG2-OE1 3.24Å; T588-Q593 VanDerWaalsContact OG1-CD 3.23Å; T588-Q593 PolarHBondContact OG1-OE1 2.75Å; Y590-Q593 PolarHBondContact O-N 3.05Å; Q593-R595 PolarHBondContact O-N 3.42Å; Q593-L596 PolarHBondContact O-N 3.39Å; Q593-I601 HydrophobicContact CG-CD1 3.74Å
594	E	64.5	Low	70.2	Confident	197 Å²	197	77.3 Å²	77.3	92%	0.921	42%	0.421	S	S	*	.	G	3₁₀ helix	trans	-54.5	-20.9	175.8	-60.1	176.2	172.2	0	0	114.6	N592	N592-E594 PolarHBondContact O-N 2.59Å
595	R	72.4	Confident	70.6	Confident	207 Å²	207	73.6 Å²	73.6	78%	0.781	40%	0.402	S	S	*	.	G	3₁₀ helix	trans	-97.6	-2.2	179.1	-56.8	-175.3	-175.8	-173.7	1.3	113.6	N592 Q593	N592-R595 HydrophobicContact CB-CB 4.46Å; N592-R595 HydrophobicContact CB-CG 4.17Å; N592-R595 WeakPolarHBondContact O-CB 3.27Å; N592-R595 PolarHBondContact O-N 3.01Å; Q593-R595 PolarHBondContact O-N 3.42Å
596	L	74.3	Confident	71.3	Confident	54 Å²	54	79.8 Å²	79.8	28%	0.283	43%	0.428	S	S	.	.	S	Bend	trans	-102.5	132.6	-179.6	-59	177.3	0	0	0	109.8	Y590 Q593 T600 I601 L604	Y590-L596 HydrophobicContact CD2-CD1 4.44Å; Y590-L596 HydrophobicContact CG-CD1 4.12Å; Q593-L596 PolarHBondContact O-N 3.39Å; L596-T600 HydrophobicContact CD2-CG2 4.08Å; L596-I601 HydrophobicContact CB-CD1 4.18Å; L596-I601 HydrophobicContact CB-CG1 3.78Å; L596-I601 HydrophobicContact CD1-CG1 4.31Å; L596-L604 HydrophobicContact CD1-CD1 4.17Å
597	S	80	Confident	71.9	Confident	42 Å²	42	82.3 Å²	82.3	29%	0.294	43%	0.432	S	S	.	.			trans	-66.6	153	172.8	77.6	0	0	0	0	110.5	E599 T600 I601	S597-E599 PolarHBondContact O-N 2.95Å; S597-E599 VanDerWaalsContact O-N 3.16Å; S597-E599 PolarHBondContact OG-OE2 2.78Å; S597-T600 WeakPolarHBondContact O-CA 3.33Å; S597-T600 WeakPolarHBondContact O-CB 3.4Å; S597-T600 PolarHBondContact O-N 3.31Å; S597-T600 PolarHBondContact OG-N 2.8Å; S597-T600 VanDerWaalsContact OG-N 3.09Å; S597-T600 PolarHBondContact OG-OG1 2.91Å; S597-I601 PolarHBondContact O-N 3.09Å
598	P	77.4	Confident	72.3	Confident	109 Å²	109	82.5 Å²	82.5	71%	0.708	42%	0.421	S	S	*	.	H	α-helix	trans	-54.1	-34.6	174.2	-27.2	35.9	0	0	0	112.9	I601 A602	P598-I601 PolarHBondContact O-N 2.83Å; P598-A602 WeakPolarHBondContact O-CB 3.27Å; P598-A602 PolarHBondContact O-N 2.97Å
599	E	77.7	Confident	72.6	Confident	153 Å²	153	81.6 Å²	81.6	72%	0.715	42%	0.417	S	S	*	.	H	α-helix	trans	-66.1	-40.9	174.8	-56.2	151.9	159.4	0	0	111.6	S597 A602 M603	S597-E599 PolarHBondContact O-N 2.95Å; S597-E599 VanDerWaalsContact O-N 3.16Å; S597-E599 PolarHBondContact OG-OE2 2.78Å; E599-A602 PolarHBondContact O-N 3.35Å; E599-M603 WeakPolarHBondContact O-CB 3.43Å; E599-M603 PolarHBondContact O-N 2.79Å
600	T	76.8	Confident	73.1	Confident	49 Å²	49	83.7 Å²	83.7	30%	0.301	43%	0.427	S	S	.	.	H	α-helix	trans	-64.4	-43.4	175.5	-52.9	0	0	0	0	110.5	L596 S597 M603 L604	L596-T600 HydrophobicContact CD2-CG2 4.08Å; S597-T600 WeakPolarHBondContact O-CA 3.33Å; S597-T600 WeakPolarHBondContact O-CB 3.4Å; S597-T600 PolarHBondContact O-N 3.31Å; S597-T600 PolarHBondContact OG-N 2.8Å; S597-T600 VanDerWaalsContact OG-N 3.09Å; S597-T600 PolarHBondContact OG-OG1 2.91Å; T600-M603 PolarHBondContact O-N 2.83Å; T600-L604 HydrophobicContact CG2-CD1 4.01Å; T600-L604 HydrophobicContact CG2-CG 4.43Å; T600-L604 WeakPolarHBondContact O-CB 3.29Å; T600-L604 VanDerWaalsContact O-CG 3.22Å; T600-L604 WeakPolarHBondContact O-CG 3.26Å; T600-L604 PolarHBondContact O-N 3.36Å
601	I	76.4	Confident	73.4	Confident	25 Å²	25	86.8 Å²	86.8	13%	0.128	45%	0.445	C	S	.	.	H	α-helix	trans	-63.1	-44.6	175.9	-63.1	168.4	0	0	0	110.4	Y590 Q593 L596 S597 P598 M603 L604 N605	Y590-I601 HydrophobicContact CD2-CG2 4.48Å; Y590-I601 HydrophobicContact CE2-CG2 4.34Å; Q593-I601 HydrophobicContact CG-CD1 3.74Å; L596-I601 HydrophobicContact CB-CD1 4.18Å; L596-I601 HydrophobicContact CB-CG1 3.78Å; L596-I601 HydrophobicContact CD1-CG1 4.31Å; S597-I601 PolarHBondContact O-N 3.09Å; P598-I601 PolarHBondContact O-N 2.83Å; I601-M603 PolarHBondContact O-N 2.8Å; I601-L604 PolarHBondContact O-N 3.15Å; I601-N605 VanDerWaalsContact O-CB 3.32Å; I601-N605 WeakPolarHBondContact O-CB 3.26Å; I601-N605 VanDerWaalsContact O-CG 3.23Å; I601-N605 PolarHBondContact O-N 3.01Å
602	A	76.4	Confident	74.5	Confident	58 Å²	58	88 Å²	88	48%	0.479	45%	0.446	S	S	.	.	H	α-helix	trans	-63.9	-40.2	177	0	0	0	0	0	112.6	P598 E599 K606	P598-A602 WeakPolarHBondContact O-CB 3.27Å; P598-A602 PolarHBondContact O-N 2.97Å; E599-A602 PolarHBondContact O-N 3.35Å; A602-K606 WeakPolarHBondContact O-CB 3.19Å; A602-K606 PolarHBondContact O-N 3.4Å
603	M	76.9	Confident	75.6	Confident	99 Å²	99	87.7 Å²	87.7	49%	0.488	45%	0.449	S	S	.	.	H	α-helix	trans	-63.6	-47	174.5	-178.2	-169.3	69.6	0	0	111.5	E599 T600 I601 K606 Q607	E599-M603 WeakPolarHBondContact O-CB 3.43Å; E599-M603 PolarHBondContact O-N 2.79Å; T600-M603 PolarHBondContact O-N 2.83Å; I601-M603 PolarHBondContact O-N 2.8Å; M603-K606 PolarHBondContact O-N 2.91Å; M603-Q607 WeakPolarHBondContact O-CG 3.27Å; M603-Q607 PolarHBondContact O-N 2.78Å
604	L	75.4	Confident	76.4	Confident	41 Å²	41	86.8 Å²	86.8	22%	0.215	45%	0.448	C	S	.	.	H	α-helix	trans	-63.1	-47.1	178.1	-71.1	168.7	0	0	0	110.8	Y590 L596 T600 I601 K606 Q607 V608	Y590-L604 HydrophobicContact CD1-CD1 4.26Å; Y590-L604 HydrophobicContact CE1-CB 4.01Å; Y590-L604 HydrophobicContact CE1-CD1 4.17Å; Y590-L604 HydrophobicContact CE2-CB 4.05Å; Y590-L604 HydrophobicContact CE2-CD1 4.48Å; Y590-L604 HydrophobicContact CG-CD1 4.48Å; Y590-L604 VanDerWaalsContact OH-C 3.31Å; Y590-L604 WeakPolarHBondContact OH-CB 3.49Å; L596-L604 HydrophobicContact CD1-CD1 4.17Å; T600-L604 HydrophobicContact CG2-CD1 4.01Å; T600-L604 HydrophobicContact CG2-CG 4.43Å; T600-L604 WeakPolarHBondContact O-CB 3.29Å; T600-L604 VanDerWaalsContact O-CG 3.22Å; T600-L604 WeakPolarHBondContact O-CG 3.26Å; T600-L604 PolarHBondContact O-N 3.36Å; I601-L604 PolarHBondContact O-N 3.15Å; L604-K606 VanDerWaalsContact C-N 3.26Å; L604-K606 PolarHBondContact O-N 2.79Å; L604-Q607 WeakPolarHBondContact O-CB 3.41Å; L604-Q607 PolarHBondContact O-N 2.96Å; L604-V608 WeakPolarHBondContact O-CG2 3.07Å; L604-V608 PolarHBondContact O-N 3.45Å
605	N	78.1	Confident	77.4	Confident	43 Å²	43	83 Å²	83	23%	0.23	43%	0.434	C	S	.	.	H	α-helix	trans	-53.7	-44	175.2	-78.3	-12.2	0	0	0	111.4	Y590 I601 V608 G609 L610	Y590-N605 WeakPolarHBondContact CE2-OD1 3.41Å; Y590-N605 PolarHBondContact OH-N 3.48Å; Y590-N605 PolarHBondContact OH-OD1 3.36Å; I601-N605 VanDerWaalsContact O-CB 3.32Å; I601-N605 WeakPolarHBondContact O-CB 3.26Å; I601-N605 VanDerWaalsContact O-CG 3.23Å; I601-N605 PolarHBondContact O-N 3.01Å; N605-V608 PolarHBondContact O-N 2.85Å; N605-G609 CarbonylContact O-C 3.52Å; N605-G609 WeakPolarHBondContact O-CA 3.23Å; N605-G609 PolarHBondContact O-N 3.08Å; N605-L610 HydrophobicContact CB-CB 4.09Å; N605-L610 PolarHBondContact O-N 2.7Å
606	K	78	Confident	78.1	Confident	152 Å²	152	76.3 Å²	76.3	66%	0.661	42%	0.415	S	S	*	.	H	α-helix	trans	-69.2	-31.1	176.9	-175.3	169.7	-174.2	176.2	0	113.7	A602 M603 L604	A602-K606 WeakPolarHBondContact O-CB 3.19Å; A602-K606 PolarHBondContact O-N 3.4Å; M603-K606 PolarHBondContact O-N 2.91Å; L604-K606 VanDerWaalsContact C-N 3.26Å; L604-K606 PolarHBondContact O-N 2.79Å
607	Q	69.5	Low	78.6	Confident	139 Å²	139	75 Å²	75	65%	0.65	41%	0.408	S	S	*	.	H	α-helix	trans	-70.2	-39.1	173.9	-75.6	178.4	-2.3	0	0	112.3	M603 L604	M603-Q607 WeakPolarHBondContact O-CG 3.27Å; M603-Q607 PolarHBondContact O-N 2.78Å; L604-Q607 WeakPolarHBondContact O-CB 3.41Å; L604-Q607 PolarHBondContact O-N 2.96Å
608	V	69.8	Low	79	Confident	67 Å²	67	74.3 Å²	74.3	41%	0.406	40%	0.399	S	S	.	.	H	α-helix	trans	-91	-8.4	178.4	-61.3	0	0	0	0	114.2	L604 N605 L610 F634	L604-V608 WeakPolarHBondContact O-CG2 3.07Å; L604-V608 PolarHBondContact O-N 3.45Å; N605-V608 PolarHBondContact O-N 2.85Å; V608-L610 HydrophobicContact CG2-CB 4.3Å; V608-L610 HydrophobicContact CG2-CD1 3.52Å; V608-L610 HydrophobicContact CG2-CG 3.66Å; V608-F634 HydrophobicContact CB-CE1 3.82Å; V608-F634 HydrophobicContact CB-CZ 4.37Å; V608-F634 HydrophobicContact CG1-CD1 4.05Å; V608-F634 HydrophobicContact CG1-CE1 3.64Å; V608-F634 HydrophobicContact CG2-CE1 4.16Å; V608-F634 HydrophobicContact CG2-CZ 4.36Å
609	G	74	Confident	79.5	Confident	8 Å²	8	71 Å²	71	8%	0.082	38%	0.384	C	S	.	.	T	Hydrogen-bonded Turn	trans	85.2	16.5	176.8	0	0	0	0	0	115.7	N605 D611 K612	N605-G609 CarbonylContact O-C 3.52Å; N605-G609 WeakPolarHBondContact O-CA 3.23Å; N605-G609 PolarHBondContact O-N 3.08Å; G609-D611 WeakPolarHBondContact CA-OD1 3.43Å; G609-D611 PolarHBondContact O-N 2.97Å; G609-K612 WeakPolarHBondContact O-CB 3.42Å; G609-K612 PolarHBondContact O-N 2.81Å
610	L	75.4	Confident	79.8	Confident	52 Å²	52	66.7 Å²	66.7	27%	0.272	37%	0.366	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.3	-10.7	174.7	-68.5	169.9	0	0	0	112.9	P589 N605 V608 K612 Q617	P589-L610 HydrophobicContact CG-CD1 3.82Å; N605-L610 HydrophobicContact CB-CB 4.09Å; N605-L610 PolarHBondContact O-N 2.7Å; V608-L610 HydrophobicContact CG2-CB 4.3Å; V608-L610 HydrophobicContact CG2-CD1 3.52Å; V608-L610 HydrophobicContact CG2-CG 3.66Å; L610-K612 VanDerWaalsContact C-N 3.26Å; L610-Q617 PolarHBondContact O-NE2 3.45Å
611	D	79	Confident	80.2	Confident	89 Å²	89	65.7 Å²	65.7	48%	0.476	36%	0.357	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.6	-12.5	171.4	67.1	-34.9	0	0	0	113.6	G609	G609-D611 WeakPolarHBondContact CA-OD1 3.43Å; G609-D611 PolarHBondContact O-N 2.97Å
612	K	84.8	Confident	80.7	Confident	89 Å²	89	66.5 Å²	66.5	39%	0.387	36%	0.361	S	S	.	.	S	Bend	trans	-83.4	152	-177.8	-61	172.8	-173	172.4	0	111.5	G609 L610 V616 Q617 I620	G609-K612 WeakPolarHBondContact O-CB 3.42Å; G609-K612 PolarHBondContact O-N 2.81Å; L610-K612 VanDerWaalsContact C-N 3.26Å; K612-V616 HydrophobicContact CB-CB 4.34Å; K612-V616 HydrophobicContact CB-CG1 4.27Å; K612-V616 HydrophobicContact CD-CG1 4.21Å; K612-Q617 HydrophobicContact CB-CG 4.11Å; K612-Q617 PolarHBondContact O-NE2 3.34Å; K612-I620 HydrophobicContact CD-CD1 3.82Å
613	P	86	Confident	81.3	Confident	88 Å²	88	66.5 Å²	66.5	57%	0.571	36%	0.357	S	S	*	.			trans	-54.5	142.5	171.9	-24.8	34.1	0	0	0	112.2	I615 V616 Q617	P613-I615 HydrophobicContact CB-CG2 4.48Å; P613-I615 PolarHBondContact O-N 3.33Å; P613-I615 VanDerWaalsContact O-N 3.1Å; P613-V616 HydrophobicContact CB-CG2 4.24Å; P613-V616 HydrophobicContact CG-CG2 4.36Å; P613-V616 WeakPolarHBondContact O-CA 3.34Å; P613-V616 WeakPolarHBondContact O-CB 3.44Å; P613-V616 PolarHBondContact O-N 3.48Å; P613-Q617 PolarHBondContact O-N 3Å
614	V	82.7	Confident	81.6	Confident	61 Å²	61	63.9 Å²	63.9	37%	0.37	35%	0.345	S	S	.	.	H	α-helix	trans	-53.3	-37.6	-174	-179.5	0	0	0	0	112.9	F579 F580 Q583 V616 Q617 Y618	F579-V614 HydrophobicContact CE1-CG1 3.94Å; F579-V614 HydrophobicContact CZ-CG1 4.4Å; F580-V614 HydrophobicContact CD1-CG1 4.41Å; F580-V614 HydrophobicContact CE1-CG1 3.99Å; Q583-V614 HydrophobicContact CB-CG1 4.49Å; Q583-V614 HydrophobicContact CG-CG1 3.9Å; V614-V616 VanDerWaalsContact C-N 3.32Å; V614-V616 PolarHBondContact O-N 3.04Å; V614-Q617 WeakPolarHBondContact O-CB 3.49Å; V614-Q617 PolarHBondContact O-N 3.37Å; V614-Y618 WeakPolarHBondContact O-CB 3.3Å; V614-Y618 PolarHBondContact O-N 3.49Å
615	I	85	Confident	82.1	Confident	119 Å²	119	64.1 Å²	64.1	61%	0.61	35%	0.347	S	S	*	.	H	α-helix	trans	-66.5	-30.8	177.1	-164.9	65.1	0	0	0	113.2	P613 Y618 G619	P613-I615 HydrophobicContact CB-CG2 4.48Å; P613-I615 PolarHBondContact O-N 3.33Å; P613-I615 VanDerWaalsContact O-N 3.1Å; I615-Y618 HydrophobicContact CD1-CD1 4.13Å; I615-G619 PolarHBondContact O-N 3.4Å
616	V	86.6	Confident	82.4	Confident	66 Å²	66	68.1 Å²	68.1	40%	0.4	37%	0.372	S	S	.	.	H	α-helix	trans	-75.7	-40	174.3	-179.8	0	0	0	0	110.1	K612 P613 V614 Y618 G619 I620	K612-V616 HydrophobicContact CB-CB 4.34Å; K612-V616 HydrophobicContact CB-CG1 4.27Å; K612-V616 HydrophobicContact CD-CG1 4.21Å; P613-V616 HydrophobicContact CB-CG2 4.24Å; P613-V616 HydrophobicContact CG-CG2 4.36Å; P613-V616 WeakPolarHBondContact O-CA 3.34Å; P613-V616 WeakPolarHBondContact O-CB 3.44Å; P613-V616 PolarHBondContact O-N 3.48Å; V614-V616 VanDerWaalsContact C-N 3.32Å; V614-V616 PolarHBondContact O-N 3.04Å; V616-Y618 VanDerWaalsContact C-N 3.32Å; V616-Y618 PolarHBondContact O-N 3.42Å; V616-G619 PolarHBondContact O-N 3.43Å; V616-I620 HydrophobicContact CG1-CD1 3.98Å; V616-I620 WeakPolarHBondContact O-CB 3.24Å; V616-I620 VanDerWaalsContact O-CG1 3.27Å; V616-I620 WeakPolarHBondContact O-CG1 3.44Å; V616-I620 PolarHBondContact O-N 2.53Å
617	Q	84.1	Confident	82.7	Confident	25 Å²	25	67.3 Å²	67.3	12%	0.117	37%	0.371	C	S	.	.	H	α-helix	trans	-59.4	-43.1	171.8	-63.1	-174.8	33.1	0	0	111.4	F579 L610 K612 P613 V614 I620 Y621	F579-Q617 HydrophobicContact CE2-CB 4.21Å; F579-Q617 HydrophobicContact CZ-CB 3.75Å; L610-Q617 PolarHBondContact O-NE2 3.45Å; K612-Q617 HydrophobicContact CB-CG 4.11Å; K612-Q617 PolarHBondContact O-NE2 3.34Å; P613-Q617 PolarHBondContact O-N 3Å; V614-Q617 WeakPolarHBondContact O-CB 3.49Å; V614-Q617 PolarHBondContact O-N 3.37Å; Q617-I620 PolarHBondContact O-N 3.49Å; Q617-Y621 WeakPolarHBondContact O-CB 3.28Å; Q617-Y621 PolarHBondContact O-N 2.94Å
618	Y	88.3	Confident	83.2	Confident	28 Å²	28	62.7 Å²	62.7	11%	0.11	36%	0.36	C	S	.	.	H	α-helix	trans	-62.7	-45.8	175.9	175.6	-118.7	0	0	0	112.7	W572 T576 F579 F580 V614 I615 V616 I620 Y621 L622	W572-Y618 PolarHBondContact NE1-OH 3.28Å; T576-Y618 HydrophobicContact CG2-CE2 4.02Å; T576-Y618 PolarHBondContact OG1-OH 3.47Å; F579-Y618 HydrophobicContact CB-CD2 4.4Å; F579-Y618 AromaticContact CD1-CD2 3.69Å; F579-Y618 HydrophobicContact CD1-CD2 3.69Å; F579-Y618 HydrophobicContact CD1-CG 4.23Å; F579-Y618 HydrophobicContact CE1-CD2 4.17Å; F579-Y618 HydrophobicContact CE1-CG 4.28Å; F579-Y618 AromaticContact CG-CD2 3.97Å; F579-Y618 HydrophobicContact CG-CD2 3.97Å; F579-Y618 VanDerWaalsContact CZ-N 3.32Å; F580-Y618 HydrophobicContact CE2-CD2 4.27Å; F580-Y618 HydrophobicContact CE2-CE2 4.28Å; F580-Y618 HydrophobicContact CE2-CG 4.47Å; F580-Y618 HydrophobicContact CZ-CD1 4.47Å; F580-Y618 HydrophobicContact CZ-CD2 4.48Å; F580-Y618 HydrophobicContact CZ-CG 4.28Å; V614-Y618 WeakPolarHBondContact O-CB 3.3Å; V614-Y618 PolarHBondContact O-N 3.49Å; I615-Y618 HydrophobicContact CD1-CD1 4.13Å; V616-Y618 VanDerWaalsContact C-N 3.32Å; V616-Y618 PolarHBondContact O-N 3.42Å; Y618-I620 VanDerWaalsContact C-N 3.35Å; Y618-I620 PolarHBondContact O-N 3.49Å; Y618-Y621 HydrophobicContact CD2-CD1 4.44Å; Y618-Y621 WeakPolarHBondContact O-CB 3.44Å; Y618-Y621 PolarHBondContact O-N 3.48Å; Y618-L622 HydrophobicContact CD2-CG 4.33Å; Y618-L622 HydrophobicContact CE1-CD1 3.86Å; Y618-L622 HydrophobicContact CE2-CD1 3.94Å; Y618-L622 HydrophobicContact CE2-CD2 4.13Å; Y618-L622 HydrophobicContact CE2-CG 3.89Å; Y618-L622 PolarHBondContact O-N 2.95Å
619	G	87.8	Confident	83.9	Confident	39 Å²	39	62.7 Å²	62.7	40%	0.402	36%	0.358	S	S	.	.	H	α-helix	trans	-61.7	-40.5	176	0	0	0	0	0	113	I615 V616 S623	I615-G619 PolarHBondContact O-N 3.4Å; V616-G619 PolarHBondContact O-N 3.43Å; G619-S623 WeakPolarHBondContact O-CB 3.39Å; G619-S623 PolarHBondContact O-N 2.93Å
620	I	84.7	Confident	84.4	Confident	63 Å²	63	65 Å²	65	32%	0.323	37%	0.366	S	S	.	.	H	α-helix	trans	-63.9	-44.9	173	-69.7	166.5	0	0	0	110.6	K612 V616 Q617 Y618 S623 N624	K612-I620 HydrophobicContact CD-CD1 3.82Å; V616-I620 HydrophobicContact CG1-CD1 3.98Å; V616-I620 WeakPolarHBondContact O-CB 3.24Å; V616-I620 VanDerWaalsContact O-CG1 3.27Å; V616-I620 WeakPolarHBondContact O-CG1 3.44Å; V616-I620 PolarHBondContact O-N 2.53Å; Q617-I620 PolarHBondContact O-N 3.49Å; Y618-I620 VanDerWaalsContact C-N 3.35Å; Y618-I620 PolarHBondContact O-N 3.49Å; I620-S623 PolarHBondContact O-N 2.99Å; I620-N624 WeakPolarHBondContact CG2-ND2 3.4Å; I620-N624 VanDerWaalsContact O-CB 3.27Å; I620-N624 WeakPolarHBondContact O-CB 3.4Å; I620-N624 PolarHBondContact O-N 2.85Å; I620-N624 PolarHBondContact O-ND2 3.11Å
621	Y	86.3	Confident	84.7	Confident	28 Å²	28	63.6 Å²	63.6	11%	0.11	36%	0.363	C	S	.	.	H	α-helix	trans	-59.4	-48.2	178	166.7	-106.2	0	0	0	112.3	A575 F579 Q617 Y618 N624 L625 M829	A575-Y621 HydrophobicContact CB-CE1 3.89Å; A575-Y621 WeakPolarHBondContact O-CE1 3.33Å; F579-Y621 HydrophobicContact CB-CD1 3.92Å; F579-Y621 HydrophobicContact CB-CE1 3.79Å; F579-Y621 AromaticContact CD2-CD1 3.69Å; F579-Y621 HydrophobicContact CD2-CD1 3.69Å; F579-Y621 HydrophobicContact CD2-CD2 4.35Å; F579-Y621 HydrophobicContact CD2-CE1 4.31Å; F579-Y621 AromaticContact CD2-CG 3.7Å; F579-Y621 HydrophobicContact CD2-CG 3.7Å; F579-Y621 HydrophobicContact CE2-CG 4.35Å; F579-Y621 HydrophobicContact CG-CD1 4.02Å; F579-Y621 HydrophobicContact CG-CE1 4.39Å; F579-Y621 HydrophobicContact CG-CG 4.48Å; Q617-Y621 WeakPolarHBondContact O-CB 3.28Å; Q617-Y621 PolarHBondContact O-N 2.94Å; Y618-Y621 HydrophobicContact CD2-CD1 4.44Å; Y618-Y621 WeakPolarHBondContact O-CB 3.44Å; Y618-Y621 PolarHBondContact O-N 3.48Å; Y621-N624 PolarHBondContact O-N 3.35Å; Y621-L625 HydrophobicContact CE1-CD1 4.26Å; Y621-L625 HydrophobicContact CE2-CD1 4.34Å; Y621-L625 VanDerWaalsContact O-CB 3.3Å; Y621-L625 WeakPolarHBondContact O-CB 3.11Å; Y621-L625 PolarHBondContact O-N 3.01Å; Y621-M829 HydrophobicContact CD2-SD 4.2Å; Y621-M829 HydrophobicContact CE2-CB 4.24Å; Y621-M829 HydrophobicContact CE2-CE 4.47Å; Y621-M829 HydrophobicContact CE2-SD 3.82Å
622	L	87	Confident	84.8	Confident	43 Å²	43	63.6 Å²	63.6	23%	0.225	36%	0.363	C	S	.	.	H	α-helix	trans	-62.5	-44.5	175.6	-71.4	-175.1	0	0	0	112.4	A575 Y618 N624 L625 V626	A575-L622 HydrophobicContact CB-CD2 4.49Å; Y618-L622 HydrophobicContact CD2-CG 4.33Å; Y618-L622 HydrophobicContact CE1-CD1 3.86Å; Y618-L622 HydrophobicContact CE2-CD1 3.94Å; Y618-L622 HydrophobicContact CE2-CD2 4.13Å; Y618-L622 HydrophobicContact CE2-CG 3.89Å; Y618-L622 PolarHBondContact O-N 2.95Å; L622-N624 VanDerWaalsContact C-N 3.34Å; L622-N624 PolarHBondContact O-N 2.81Å; L622-L625 PolarHBondContact O-N 3.03Å; L622-V626 WeakPolarHBondContact O-CG2 3.46Å; L622-V626 PolarHBondContact O-N 3.49Å
623	S	87.1	Confident	84.7	Confident	57 Å²	57	59.6 Å²	59.6	40%	0.399	35%	0.346	S	S	.	.	H	α-helix	trans	-61.4	-43.3	178.7	-170	0	0	0	0	111.8	G619 I620 Q627	G619-S623 WeakPolarHBondContact O-CB 3.39Å; G619-S623 PolarHBondContact O-N 2.93Å; I620-S623 PolarHBondContact O-N 2.99Å; S623-Q627 VanDerWaalsContact O-CG 3.29Å; S623-Q627 WeakPolarHBondContact O-CG 3.4Å; S623-Q627 PolarHBondContact O-N 2.74Å; S623-Q627 PolarHBondContact OG-NE2 2.84Å
624	N	85	Confident	84.1	Confident	44 Å²	44	57.7 Å²	57.7	24%	0.235	33%	0.329	C	S	.	.	H	α-helix	trans	-64.6	-45	176.2	-74.4	-16.7	0	0	0	111.5	I620 Y621 L622 V626 Q627 G628 N629	I620-N624 WeakPolarHBondContact CG2-ND2 3.4Å; I620-N624 VanDerWaalsContact O-CB 3.27Å; I620-N624 WeakPolarHBondContact O-CB 3.4Å; I620-N624 PolarHBondContact O-N 2.85Å; I620-N624 PolarHBondContact O-ND2 3.11Å; Y621-N624 PolarHBondContact O-N 3.35Å; L622-N624 VanDerWaalsContact C-N 3.34Å; L622-N624 PolarHBondContact O-N 2.81Å; N624-V626 PolarHBondContact O-N 3Å; N624-Q627 CarbonylContact O-C 3.55Å; N624-Q627 WeakPolarHBondContact O-CA 3.48Å; N624-Q627 WeakPolarHBondContact O-CB 3.16Å; N624-Q627 PolarHBondContact O-N 2.71Å; N624-G628 PolarHBondContact O-N 3.27Å; N624-G628 VanDerWaalsContact O-N 3.16Å; N624-N629 CarbonylContact C-O 3.54Å; N624-N629 VanDerWaalsContact C-O 3.23Å; N624-N629 HydrophobicContact CB-CB 4.08Å; N624-N629 WeakPolarHBondContact CB-O 3.38Å; N624-N629 WeakPolarHBondContact O-CA 3.25Å; N624-N629 WeakPolarHBondContact O-CB 3.18Å; N624-N629 PolarHBondContact O-N 3.46Å
625	L	84.9	Confident	83.4	Confident	47 Å²	47	57.3 Å²	57.3	25%	0.246	32%	0.323	C	S	.	.	H	α-helix	trans	-59.2	-44.7	178.4	-171.9	160.5	0	0	0	111.6	A575 Y621 L622 Q627 G628 I833	A575-L625 HydrophobicContact CB-CD1 3.84Å; Y621-L625 HydrophobicContact CE1-CD1 4.26Å; Y621-L625 HydrophobicContact CE2-CD1 4.34Å; Y621-L625 VanDerWaalsContact O-CB 3.3Å; Y621-L625 WeakPolarHBondContact O-CB 3.11Å; Y621-L625 PolarHBondContact O-N 3.01Å; L622-L625 PolarHBondContact O-N 3.03Å; L625-Q627 PolarHBondContact O-N 3.39Å; L625-G628 PolarHBondContact O-N 3.03Å; L625-I833 HydrophobicContact CD1-CD1 4.29Å; L625-I833 HydrophobicContact CD1-CG1 4.08Å; L625-I833 HydrophobicContact CD1-CG2 4.26Å
626	V	83.9	Confident	82.8	Confident	126 Å²	126	55 Å²	55	76%	0.764	31%	0.308	S	S	*	.	H	α-helix	trans	-62.7	-30.2	175	171.4	0	0	0	0	112.2	L622 N624 G628	L622-V626 WeakPolarHBondContact O-CG2 3.46Å; L622-V626 PolarHBondContact O-N 3.49Å; N624-V626 PolarHBondContact O-N 3Å; V626-G628 VanDerWaalsContact C-N 3.31Å
627	Q	84.4	Confident	81.9	Confident	136 Å²	136	61.3 Å²	61.3	64%	0.636	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.2	1.5	175	-66.6	170.3	22.5	0	0	113.7	S623 N624 L625 N629	S623-Q627 VanDerWaalsContact O-CG 3.29Å; S623-Q627 WeakPolarHBondContact O-CG 3.4Å; S623-Q627 PolarHBondContact O-N 2.74Å; S623-Q627 PolarHBondContact OG-NE2 2.84Å; N624-Q627 CarbonylContact O-C 3.55Å; N624-Q627 WeakPolarHBondContact O-CA 3.48Å; N624-Q627 WeakPolarHBondContact O-CB 3.16Å; N624-Q627 PolarHBondContact O-N 2.71Å; L625-Q627 PolarHBondContact O-N 3.39Å; Q627-N629 PolarHBondContact O-N 2.83Å
628	G	79.9	Confident	81.1	Confident	41 Å²	41	67.2 Å²	67.2	42%	0.423	36%	0.363	S	S	.	.	T	Hydrogen-bonded Turn	trans	69.3	12	-173	0	0	0	0	0	114.2	N624 L625 V626	N624-G628 PolarHBondContact O-N 3.27Å; N624-G628 VanDerWaalsContact O-N 3.16Å; L625-G628 PolarHBondContact O-N 3.03Å; V626-G628 VanDerWaalsContact C-N 3.31Å
629	N	84.4	Confident	80.7	Confident	68 Å²	68	70.6 Å²	70.6	36%	0.364	38%	0.38	S	S	.	.			trans	-88.6	112.9	177.1	-179.2	6.4	0	0	0	109.5	N624 Q627 G631	N624-N629 CarbonylContact C-O 3.54Å; N624-N629 VanDerWaalsContact C-O 3.23Å; N624-N629 HydrophobicContact CB-CB 4.08Å; N624-N629 WeakPolarHBondContact CB-O 3.38Å; N624-N629 WeakPolarHBondContact O-CA 3.25Å; N624-N629 WeakPolarHBondContact O-CB 3.18Å; N624-N629 PolarHBondContact O-N 3.46Å; Q627-N629 PolarHBondContact O-N 2.83Å; N629-G631 PolarHBondContact OD1-N 3.32Å
630	F	84.7	Confident	80.6	Confident	57 Å²	57	70.8 Å²	70.8	25%	0.25	38%	0.378	C	S	.	.			trans	-94.7	10.3	178.3	-68	-67.1	0	0	0	113.6	V641 A642 A830 I833	F630-V641 HydrophobicContact CB-CB 3.68Å; F630-V641 HydrophobicContact CB-CG1 3.7Å; F630-A642 HydrophobicContact CD2-CB 4.04Å; F630-A830 HydrophobicContact CB-CB 3.71Å; F630-A830 HydrophobicContact CD1-CB 3.42Å; F630-A830 VanDerWaalsContact CD1-CB 3.42Å; F630-A830 HydrophobicContact CD2-CB 4.43Å; F630-A830 HydrophobicContact CE1-CB 4.13Å; F630-A830 HydrophobicContact CG-CB 3.59Å; F630-I833 HydrophobicContact CE1-CG2 4.43Å
631	G	82.2	Confident	80.6	Confident	21 Å²	21	67.8 Å²	67.8	22%	0.216	36%	0.363	C	S	.	.			trans	77.6	-163.2	-176.6	0	0	0	0	0	113.6	N629 A640 V641	N629-G631 PolarHBondContact OD1-N 3.32Å; G631-A640 WeakPolarHBondContact O-CA 3.13Å; G631-V641 PolarHBondContact O-N 2.97Å
632	I	81.3	Confident	80.6	Confident	89 Å²	89	68.4 Å²	68.4	46%	0.456	37%	0.373	S	S	.	.	B	Isolated β-bridge	trans	-112.6	136.7	-178.3	-62.1	170.8	0	0	0	107.9	Q639 P826	I632-Q639 WeakPolarHBondContact CA-O 3.42Å; I632-P826 WeakPolarHBondContact O-CG 3.26Å
633	S	81.8	Confident	80.4	Confident	6 Å²	6	69.6 Å²	69.6	4%	0.042	39%	0.39	C	S	.	.			trans	-62.7	136.1	174.1	171.7	0	0	0	0	111	Q635 F636 Q639 D824	S633-Q635 PolarHBondContact O-N 3.02Å; S633-Q635 PolarHBondContact OG-N 3.5Å; S633-Q635 VanDerWaalsContact OG-N 3.16Å; S633-F636 WeakPolarHBondContact OG-CD2 3.34Å; S633-F636 PolarHBondContact OG-N 2.95Å; S633-Q639 PolarHBondContact N-O 3.3Å; S633-D824 WeakPolarHBondContact CA-OD1 3.22Å; S633-D824 WeakPolarHBondContact CB-OD2 3.48Å; S633-D824 PolarHBondContact OG-OD1 3.17Å; S633-D824 PolarHBondContact OG-OD2 2.83Å
634	F	73.4	Confident	80.2	Confident	48 Å²	48	67.7 Å²	67.7	21%	0.211	38%	0.375	C	S	.	.	S	Bend	trans	-74.9	-12.4	175.7	-62.1	-23.5	0	0	0	113.1	P589 V608 D824 Y825 P826	P589-F634 HydrophobicContact CB-CD2 3.27Å; P589-F634 HydrophobicContact CB-CE2 3.59Å; P589-F634 HydrophobicContact CB-CG 4.16Å; P589-F634 HydrophobicContact CG-CD2 4.13Å; P589-F634 HydrophobicContact CG-CE2 4.06Å; V608-F634 HydrophobicContact CB-CE1 3.82Å; V608-F634 HydrophobicContact CB-CZ 4.37Å; V608-F634 HydrophobicContact CG1-CD1 4.05Å; V608-F634 HydrophobicContact CG1-CE1 3.64Å; V608-F634 HydrophobicContact CG2-CE1 4.16Å; V608-F634 HydrophobicContact CG2-CZ 4.36Å; F634-D824 PolarHBondContact N-OD1 2.84Å; F634-Y825 HydrophobicContact CE2-CD2 4.02Å; F634-Y825 HydrophobicContact CE2-CG 4.45Å; F634-P826 HydrophobicContact CD1-CG 3.95Å; F634-P826 VanDerWaalsContact CD2-CD 3.47Å; F634-P826 HydrophobicContact CD2-CG 4.01Å; F634-P826 HydrophobicContact CE1-CG 3.61Å; F634-P826 VanDerWaalsContact CE2-CD 3.42Å; F634-P826 HydrophobicContact CE2-CG 3.74Å; F634-P826 HydrophobicContact CG-CG 4.15Å; F634-P826 HydrophobicContact CZ-CG 3.53Å
635	Q	69.3	Low	80.1	Confident	52 Å²	52	66 Å²	66	24%	0.243	37%	0.365	C	S	.	.	S	Bend	trans	-116.6	-38.8	-175	-57.7	-66.4	-38.9	0	0	112.2	P589 T591 S633 K637 T822 D824	P589-Q635 PolarHBondContact O-NE2 3Å; T591-Q635 PolarHBondContact OG1-OE1 3.3Å; S633-Q635 PolarHBondContact O-N 3.02Å; S633-Q635 PolarHBondContact OG-N 3.5Å; S633-Q635 VanDerWaalsContact OG-N 3.16Å; Q635-K637 PolarHBondContact O-N 3.12Å; Q635-T822 VanDerWaalsContact CD-O 3.32Å; Q635-T822 WeakPolarHBondContact CG-O 3.3Å; Q635-T822 PolarHBondContact NE2-O 2.9Å; Q635-T822 VanDerWaalsContact NE2-O 3.07Å; Q635-D824 HydrophobicContact CG-CB 3.95Å
636	F	71.8	Confident	80	Confident	70 Å²	70	67 Å²	67	31%	0.307	38%	0.381	S	S	.	.	S	Bend	trans	-89.8	92	178.1	-64.5	-88.2	0	0	0	110.5	S633 N638 Q639 L644 Q815	S633-F636 WeakPolarHBondContact OG-CD2 3.34Å; S633-F636 PolarHBondContact OG-N 2.95Å; F636-N638 PolarHBondContact O-N 3.02Å; F636-N638 VanDerWaalsContact O-N 3.08Å; F636-Q639 HydrophobicContact CB-CB 4.15Å; F636-Q639 HydrophobicContact CB-CG 4.28Å; F636-Q639 WeakPolarHBondContact O-CB 3.49Å; F636-Q639 PolarHBondContact O-N 3.17Å; F636-L644 HydrophobicContact CB-CD1 4.14Å; F636-L644 HydrophobicContact CD2-CD1 3.76Å; F636-L644 HydrophobicContact CE2-CD1 4.34Å; F636-L644 HydrophobicContact CG-CD1 3.88Å; F636-Q815 VanDerWaalsContact CE2-NE2 3.28Å
637	K	67.8	Low	79.7	Confident	200 Å²	200	64 Å²	64	87%	0.87	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-27.7	105.2	-175.7	-73.8	-172.7	175.6	-177.2	0	114.8	Q635 Q639	Q635-K637 PolarHBondContact O-N 3.12Å; K637-Q639 PolarHBondContact O-N 3.42Å
638	N	66.9	Low	79.6	Confident	149 Å²	149	59.2 Å²	59.2	80%	0.797	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.5	21.8	177	-68.8	6.3	0	0	0	115.7	F636	F636-N638 PolarHBondContact O-N 3.02Å; F636-N638 VanDerWaalsContact O-N 3.08Å
639	Q	80.4	Confident	79.7	Confident	98 Å²	98	59.9 Å²	59.9	46%	0.458	34%	0.344	S	S	.	.			trans	-81.7	123.4	173.1	-65.6	-166.4	-12.4	0	0	110.5	I632 S633 F636 K637 V641	I632-Q639 WeakPolarHBondContact CA-O 3.42Å; S633-Q639 PolarHBondContact N-O 3.3Å; F636-Q639 HydrophobicContact CB-CB 4.15Å; F636-Q639 HydrophobicContact CB-CG 4.28Å; F636-Q639 WeakPolarHBondContact O-CB 3.49Å; F636-Q639 PolarHBondContact O-N 3.17Å; K637-Q639 PolarHBondContact O-N 3.42Å; Q639-V641 PolarHBondContact O-N 3.2Å
640	A	85.1	Confident	79.6	Confident	44 Å²	44	58.5 Å²	58.5	36%	0.364	35%	0.346	S	S	.	.	B	Isolated β-bridge	trans	-64.9	127.8	169.4	0	0	0	0	0	109.6	G631 A642 A643 L644	G631-A640 WeakPolarHBondContact O-CA 3.13Å; A640-A642 PolarHBondContact O-N 3.43Å; A640-A643 PolarHBondContact O-N 3.3Å; A640-L644 PolarHBondContact O-N 3.3Å
641	V	85.3	Confident	79.6	Confident	0 Å²	0	56.3 Å²	56.3	0%	0	34%	0.338	C	S	.	.	H	α-helix	trans	-57.7	-36.3	-175.5	174.8	0	0	0	0	111.3	F630 G631 Q639 A643 L644 L645 P826 T827 A830	F630-V641 HydrophobicContact CB-CB 3.68Å; F630-V641 HydrophobicContact CB-CG1 3.7Å; G631-V641 PolarHBondContact O-N 2.97Å; Q639-V641 PolarHBondContact O-N 3.2Å; V641-A643 VanDerWaalsContact C-N 3.32Å; V641-A643 PolarHBondContact O-N 2.81Å; V641-L644 PolarHBondContact O-N 2.79Å; V641-L645 HydrophobicContact CG1-CD1 4Å; V641-L645 HydrophobicContact CG1-CG 4.21Å; V641-L645 WeakPolarHBondContact O-CG 3.22Å; V641-L645 PolarHBondContact O-N 3.01Å; V641-P826 HydrophobicContact CG2-CB 3.92Å; V641-T827 HydrophobicContact CG1-CG2 4.36Å; V641-A830 HydrophobicContact CG1-CB 3.48Å; V641-A830 VanDerWaalsContact CG1-CB 3.48Å
642	A	85.1	Confident	79.6	Confident	40 Å²	40	55.5 Å²	55.5	33%	0.331	33%	0.329	S	S	.	.	H	α-helix	trans	-56.5	-41.4	175	0	0	0	0	0	113.3	F630 A640 A646	F630-A642 HydrophobicContact CD2-CB 4.04Å; A640-A642 PolarHBondContact O-N 3.43Å; A642-A646 VanDerWaalsContact O-CB 3.29Å; A642-A646 WeakPolarHBondContact O-CB 3.12Å; A642-A646 PolarHBondContact O-N 2.83Å
643	A	82.7	Confident	79.7	Confident	69 Å²	69	53.4 Å²	53.4	57%	0.57	32%	0.318	S	S	*	.	H	α-helix	trans	-73.1	-38.5	178.6	0	0	0	0	0	111.8	A640 V641 L645 A646 G647	A640-A643 PolarHBondContact O-N 3.3Å; V641-A643 VanDerWaalsContact C-N 3.32Å; V641-A643 PolarHBondContact O-N 2.81Å; A643-L645 VanDerWaalsContact C-N 3.33Å; A643-L645 PolarHBondContact O-N 3.18Å; A643-A646 PolarHBondContact O-N 2.9Å; A643-G647 PolarHBondContact O-N 3.46Å
644	L	83.3	Confident	79.8	Confident	16 Å²	16	56.7 Å²	56.7	8%	0.084	33%	0.332	C	S	.	.	H	α-helix	trans	-64	-35.3	175.7	168.7	151.3	0	0	0	112.1	F636 A640 V641 R648 Q815 T827	F636-L644 HydrophobicContact CB-CD1 4.14Å; F636-L644 HydrophobicContact CD2-CD1 3.76Å; F636-L644 HydrophobicContact CE2-CD1 4.34Å; F636-L644 HydrophobicContact CG-CD1 3.88Å; A640-L644 PolarHBondContact O-N 3.3Å; V641-L644 PolarHBondContact O-N 2.79Å; L644-R648 VanDerWaalsContact O-CD 3.32Å; L644-R648 WeakPolarHBondContact O-CD 3.17Å; L644-R648 WeakPolarHBondContact O-CG 3.42Å; L644-Q815 HydrophobicContact CD2-CG 3.71Å; L644-T827 HydrophobicContact CD2-CG2 3.76Å
645	L	84.2	Confident	80.4	Confident	8 Å²	8	54.4 Å²	54.4	4%	0.042	32%	0.322	C	S	.	.	H	α-helix	trans	-79.3	-36.6	173.5	-64.5	-179.2	0	0	0	113.3	V641 A643 G647 R648 I649 A830 V831 L834	V641-L645 HydrophobicContact CG1-CD1 4Å; V641-L645 HydrophobicContact CG1-CG 4.21Å; V641-L645 WeakPolarHBondContact O-CG 3.22Å; V641-L645 PolarHBondContact O-N 3.01Å; A643-L645 VanDerWaalsContact C-N 3.33Å; A643-L645 PolarHBondContact O-N 3.18Å; L645-G647 VanDerWaalsContact C-N 3.26Å; L645-G647 PolarHBondContact O-N 2.94Å; L645-R648 PolarHBondContact O-N 3.35Å; L645-I649 PolarHBondContact O-N 3.45Å; L645-A830 HydrophobicContact CD1-CB 3.73Å; L645-V831 HydrophobicContact CD1-CG2 4.2Å; L645-V831 HydrophobicContact CD2-CG2 3.47Å; L645-V831 VanDerWaalsContact CD2-CG2 3.47Å; L645-V831 HydrophobicContact CG-CG2 4.48Å; L645-L834 HydrophobicContact CD1-CD2 4.47Å
646	A	81.8	Confident	81.1	Confident	70 Å²	70	51.9 Å²	51.9	58%	0.579	31%	0.311	S	S	*	.	H	α-helix	trans	-60.7	-32.6	179.8	0	0	0	0	0	113.3	A642 A643 R648	A642-A646 VanDerWaalsContact O-CB 3.29Å; A642-A646 WeakPolarHBondContact O-CB 3.12Å; A642-A646 PolarHBondContact O-N 2.83Å; A643-A646 PolarHBondContact O-N 2.9Å; A646-R648 VanDerWaalsContact C-N 3.26Å; A646-R648 PolarHBondContact O-N 2.96Å
647	G	78.3	Confident	81.7	Confident	61 Å²	61	51.5 Å²	51.5	63%	0.629	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73	-14	173.1	0	0	0	0	0	114.8	A643 L645	A643-G647 PolarHBondContact O-N 3.46Å; L645-G647 VanDerWaalsContact C-N 3.26Å; L645-G647 PolarHBondContact O-N 2.94Å
648	R	81.7	Confident	82.7	Confident	37 Å²	37	44.1 Å²	44.1	14%	0.14	28%	0.28	C	S	.	.	T	Hydrogen-bonded Turn	trans	-116.9	-20.7	-166.7	-70.4	-176.6	164.3	-84.9	10.9	114.8	L644 L645 A646 G650 P651 P810 G811 I812 E814	L644-R648 VanDerWaalsContact O-CD 3.32Å; L644-R648 WeakPolarHBondContact O-CD 3.17Å; L644-R648 WeakPolarHBondContact O-CG 3.42Å; L645-R648 PolarHBondContact O-N 3.35Å; A646-R648 VanDerWaalsContact C-N 3.26Å; A646-R648 PolarHBondContact O-N 2.96Å; R648-G650 VanDerWaalsContact C-N 3.31Å; R648-G650 PolarHBondContact O-N 3.33Å; R648-P651 WeakPolarHBondContact O-CD 3.41Å; R648-P810 WeakPolarHBondContact CG-O 3.29Å; R648-P810 VanDerWaalsContact NH1-C 3.3Å; R648-G811 WeakPolarHBondContact CD-O 3.3Å; R648-G811 PolarHBondContact NH1-O 3.24Å; R648-G811 CarbonylContact O-C 3.59Å; R648-G811 WeakPolarHBondContact O-CA 3.37Å; R648-I812 HydrophobicContact CB-CG1 4.39Å; R648-I812 PolarHBondContact O-N 3.44Å; R648-E814 IonicContact CZ-OE2 3.21Å; R648-E814 IonicContact NH1-OE2 2.8Å; R648-E814 PolarHBondContact NH1-OE2 2.92Å; R648-E814 IonicContact NH2-OE2 2.76Å; R648-E814 PolarHBondContact NH2-OE2 2.83Å
649	I	81.8	Confident	83.7	Confident	55 Å²	55	37 Å²	37	28%	0.282	24%	0.242	S	C	.	.	H	α-helix	trans	-64.2	-34	177.5	-170.5	168.2	0	0	0	113	L645 L653 I812 L834	L645-I649 PolarHBondContact O-N 3.45Å; I649-L653 WeakPolarHBondContact O-CB 3.48Å; I649-L653 PolarHBondContact O-N 2.94Å; I649-I812 HydrophobicContact CB-CD1 3.91Å; I649-I812 HydrophobicContact CB-CG1 4.48Å; I649-I812 HydrophobicContact CG1-CD1 3.89Å; I649-L834 HydrophobicContact CD1-CD1 4.18Å; I649-L834 HydrophobicContact CD1-CD2 4.27Å
650	G	82.5	Confident	84.1	Confident	38 Å²	38	33.4 Å²	33.4	39%	0.392	23%	0.226	S	C	.	.	H	α-helix	trans	-57.7	-56.7	-178	0	0	0	0	0	114	R648 S652 L653 Q654	R648-G650 VanDerWaalsContact C-N 3.31Å; R648-G650 PolarHBondContact O-N 3.33Å; G650-S652 PolarHBondContact O-N 2.92Å; G650-L653 PolarHBondContact O-N 2.7Å; G650-Q654 WeakPolarHBondContact O-CB 3.4Å; G650-Q654 PolarHBondContact O-N 3.47Å
651	P	84.5	Confident	84.2	Confident	12 Å²	12	35.6 Å²	35.6	8%	0.078	24%	0.235	C	C	.	.	H	α-helix	trans	-55.7	-49.3	177.7	-28.3	35	0	0	0	114	R648 L653 Q654 L655 W721 I809	R648-P651 WeakPolarHBondContact O-CD 3.41Å; P651-L653 PolarHBondContact O-N 2.64Å; P651-Q654 PolarHBondContact O-N 2.96Å; P651-L655 WeakPolarHBondContact O-CG 3.37Å; P651-L655 PolarHBondContact O-N 3.29Å; P651-W721 HydrophobicContact CB-CD2 4.11Å; P651-W721 HydrophobicContact CB-CE3 4.41Å; P651-W721 HydrophobicContact CB-CH2 4.09Å; P651-W721 HydrophobicContact CB-CZ2 3.8Å; P651-W721 HydrophobicContact CB-CZ3 4.39Å; P651-W721 HydrophobicContact CG-CD2 4.34Å; P651-W721 HydrophobicContact CG-CZ2 4.25Å; P651-I809 HydrophobicContact CB-CG2 3.83Å
652	S	83	Confident	84.5	Confident	4 Å²	4	40.1 Å²	40.1	3%	0.028	25%	0.254	C	S	.	.	H	α-helix	trans	-62.8	-43.6	-179.8	-57.5	0	0	0	0	112.4	G650 L655 G656 E804 G811 I812	G650-S652 PolarHBondContact O-N 2.92Å; S652-L655 PolarHBondContact O-N 3.35Å; S652-G656 PolarHBondContact O-N 2.85Å; S652-E804 WeakPolarHBondContact CA-OE1 3.22Å; S652-E804 VanDerWaalsContact CB-OE1 3.22Å; S652-E804 WeakPolarHBondContact CB-OE1 3.4Å; S652-E804 PolarHBondContact OG-OE1 2.82Å; S652-E804 PolarHBondContact OG-OE2 2.76Å; S652-E804 VanDerWaalsContact OG-OE2 3.12Å; S652-G811 WeakPolarHBondContact OG-CA 3.43Å; S652-I812 PolarHBondContact OG-N 2.88Å
653	L	82.3	Confident	84.8	Confident	44 Å²	44	38.2 Å²	38.2	23%	0.23	24%	0.239	C	C	.	.	H	α-helix	trans	-62.5	-43.8	176.7	177	59.5	0	0	0	111.7	I649 G650 P651 L657 M797 M838	I649-L653 WeakPolarHBondContact O-CB 3.48Å; I649-L653 PolarHBondContact O-N 2.94Å; G650-L653 PolarHBondContact O-N 2.7Å; P651-L653 PolarHBondContact O-N 2.64Å; L653-L657 HydrophobicContact CD1-CD1 3.75Å; L653-L657 HydrophobicContact CD1-CG 4.12Å; L653-L657 HydrophobicContact CG-CD1 4.03Å; L653-L657 WeakPolarHBondContact O-CB 3.33Å; L653-L657 WeakPolarHBondContact O-CG 3.46Å; L653-L657 PolarHBondContact O-N 3.15Å; L653-M797 HydrophobicContact CD1-CE 3.51Å; L653-M838 HydrophobicContact CD1-CE 4.34Å
654	Q	85.7	Confident	85.1	Confident	75 Å²	75	35.6 Å²	35.6	35%	0.35	22%	0.215	S	C	.	.	H	α-helix	trans	-63.2	-46.2	178	-179.5	175.9	-19.3	0	0	111.7	G650 P651 Q658 W721	G650-Q654 WeakPolarHBondContact O-CB 3.4Å; G650-Q654 PolarHBondContact O-N 3.47Å; P651-Q654 PolarHBondContact O-N 2.96Å; Q654-Q658 HydrophobicContact CG-CG 4.38Å; Q654-Q658 VanDerWaalsContact NE2-NE2 3.18Å; Q654-Q658 WeakPolarHBondContact O-CB 3.49Å; Q654-Q658 VanDerWaalsContact O-CG 3.28Å; Q654-Q658 WeakPolarHBondContact O-CG 3.43Å; Q654-Q658 PolarHBondContact O-N 3.38Å; Q654-W721 HydrophobicContact CB-CH2 4.45Å; Q654-W721 HydrophobicContact CB-CZ2 4.45Å; Q654-W721 HydrophobicContact CG-CH2 4.46Å
655	L	85.9	Confident	85.5	Confident	0 Å²	0	41.2 Å²	41.2	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-63.8	-45.3	178.8	-72	177.4	0	0	0	112.3	P651 S652 Q658 A659 W721 P730 L734 E804 I809	P651-L655 WeakPolarHBondContact O-CG 3.37Å; P651-L655 PolarHBondContact O-N 3.29Å; S652-L655 PolarHBondContact O-N 3.35Å; L655-Q658 PolarHBondContact O-N 2.89Å; L655-A659 VanDerWaalsContact O-CB 3.26Å; L655-A659 WeakPolarHBondContact O-CB 3.33Å; L655-A659 PolarHBondContact O-N 3.41Å; L655-W721 HydrophobicContact CD1-CH2 4.47Å; L655-W721 HydrophobicContact CD1-CZ3 4.04Å; L655-W721 HydrophobicContact CD2-CH2 4.05Å; L655-W721 HydrophobicContact CD2-CZ3 3.87Å; L655-W721 HydrophobicContact CG-CH2 3.91Å; L655-W721 HydrophobicContact CG-CZ3 3.89Å; L655-P730 HydrophobicContact CD1-CB 4.22Å; L655-P730 HydrophobicContact CD2-CB 3.7Å; L655-L734 HydrophobicContact CB-CD1 4.1Å; L655-E804 HydrophobicContact CD1-CG 4.16Å; L655-I809 HydrophobicContact CD1-CD1 3.67Å; L655-I809 HydrophobicContact CD1-CG2 4.38Å
656	G	83.2	Confident	85.9	Confident	0 Å²	0	42.7 Å²	42.7	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-56.5	-54.7	175.7	0	0	0	0	0	111.4	S652 Q658 A659 I660	S652-G656 PolarHBondContact O-N 2.85Å; G656-Q658 PolarHBondContact O-N 3.32Å; G656-A659 PolarHBondContact O-N 3.33Å; G656-I660 VanDerWaalsContact O-CD1 3.22Å; G656-I660 WeakPolarHBondContact O-CD1 3.29Å; G656-I660 WeakPolarHBondContact O-CG1 3.39Å; G656-I660 PolarHBondContact O-N 2.84Å
657	L	84.1	Confident	86.4	Confident	61 Å²	61	39.4 Å²	39.4	32%	0.319	22%	0.221	S	C	.	.	H	α-helix	trans	-60.5	-44.7	-179.9	-71.6	172	0	0	0	112.9	L653 A659 V661	L653-L657 HydrophobicContact CD1-CD1 3.75Å; L653-L657 HydrophobicContact CD1-CG 4.12Å; L653-L657 HydrophobicContact CG-CD1 4.03Å; L653-L657 WeakPolarHBondContact O-CB 3.33Å; L653-L657 WeakPolarHBondContact O-CG 3.46Å; L653-L657 PolarHBondContact O-N 3.15Å; L657-A659 PolarHBondContact O-N 3.17Å; L657-V661 WeakPolarHBondContact O-CB 3.17Å; L657-V661 WeakPolarHBondContact O-CG2 3.28Å; L657-V661 PolarHBondContact O-N 3.16Å; L657-V661 VanDerWaalsContact O-N 3.09Å
658	Q	88.7	Confident	87	Confident	46 Å²	46	38.1 Å²	38.1	22%	0.215	20%	0.2	C	C	.	.	H	α-helix	trans	-60.3	-44.3	176.4	-75.4	-174.7	-1.2	0	0	111.7	Q654 L655 G656 F662 T727 T731	Q654-Q658 HydrophobicContact CG-CG 4.38Å; Q654-Q658 VanDerWaalsContact NE2-NE2 3.18Å; Q654-Q658 WeakPolarHBondContact O-CB 3.49Å; Q654-Q658 VanDerWaalsContact O-CG 3.28Å; Q654-Q658 WeakPolarHBondContact O-CG 3.43Å; Q654-Q658 PolarHBondContact O-N 3.38Å; L655-Q658 PolarHBondContact O-N 2.89Å; G656-Q658 PolarHBondContact O-N 3.32Å; Q658-F662 VanDerWaalsContact O-CB 3.29Å; Q658-F662 WeakPolarHBondContact O-CB 3.32Å; Q658-F662 PolarHBondContact O-N 3.42Å; Q658-T727 PolarHBondContact NE2-OG1 3.02Å; Q658-T727 PolarHBondContact OE1-OG1 3.18Å; Q658-T731 HydrophobicContact CB-CG2 3.68Å; Q658-T731 WeakPolarHBondContact CB-OG1 3.46Å; Q658-T731 PolarHBondContact OE1-OG1 2.84Å
659	A	88.5	Confident	87.5	Confident	0 Å²	0	40 Å²	40	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-67.8	-41.5	-178.5	0	0	0	0	0	113	L655 G656 L657 G663 L734 A735 P738	L655-A659 VanDerWaalsContact O-CB 3.26Å; L655-A659 WeakPolarHBondContact O-CB 3.33Å; L655-A659 PolarHBondContact O-N 3.41Å; G656-A659 PolarHBondContact O-N 3.33Å; L657-A659 PolarHBondContact O-N 3.17Å; A659-G663 WeakPolarHBondContact O-CA 3.18Å; A659-G663 PolarHBondContact O-N 3.35Å; A659-L734 HydrophobicContact CB-CB 3.52Å; A659-A735 HydrophobicContact CB-CB 4.36Å; A659-P738 WeakPolarHBondContact O-CG 3.34Å
660	I	87.9	Confident	87.9	Confident	21 Å²	21	39.7 Å²	39.7	11%	0.108	21%	0.21	C	C	.	.	H	α-helix	trans	-61.4	-54.8	176.2	-61.5	152	0	0	0	110	G656 T664 A793 L796	G656-I660 VanDerWaalsContact O-CD1 3.22Å; G656-I660 WeakPolarHBondContact O-CD1 3.29Å; G656-I660 WeakPolarHBondContact O-CG1 3.39Å; G656-I660 PolarHBondContact O-N 2.84Å; I660-T664 WeakPolarHBondContact O-CB 3.32Å; I660-T664 PolarHBondContact O-N 3Å; I660-T664 PolarHBondContact O-OG1 2.94Å; I660-A793 HydrophobicContact CD1-CB 3.39Å; I660-A793 HydrophobicContact CG1-CB 4.18Å; I660-L796 HydrophobicContact CG1-CD1 3.53Å
661	V	88.4	Confident	88.2	Confident	91 Å²	91	37.9 Å²	37.9	55%	0.552	19%	0.192	S	C	*	.	H	α-helix	trans	-64.7	-48.4	-173	172.9	0	0	0	0	111	L657 F665	L657-V661 WeakPolarHBondContact O-CB 3.17Å; L657-V661 WeakPolarHBondContact O-CG2 3.28Å; L657-V661 PolarHBondContact O-N 3.16Å; L657-V661 VanDerWaalsContact O-N 3.09Å; V661-F665 WeakPolarHBondContact O-CB 3.27Å; V661-F665 PolarHBondContact O-N 3.47Å; V661-F665 VanDerWaalsContact O-N 3.12Å
662	F	91.6	Very high	88.4	Confident	95 Å²	95	37.5 Å²	37.5	42%	0.417	19%	0.189	S	C	.	.	H	α-helix	trans	-65.4	-48.8	178.8	178.4	-103.5	0	0	0	112	Q658 V666 L732 A735	Q658-F662 VanDerWaalsContact O-CB 3.29Å; Q658-F662 WeakPolarHBondContact O-CB 3.32Å; Q658-F662 PolarHBondContact O-N 3.42Å; F662-V666 HydrophobicContact CD2-CG2 4.26Å; F662-V666 HydrophobicContact CE1-CG2 4.5Å; F662-V666 HydrophobicContact CE2-CG2 3.91Å; F662-V666 HydrophobicContact CZ-CG2 4.04Å; F662-V666 WeakPolarHBondContact O-CG2 3.45Å; F662-V666 PolarHBondContact O-N 3.11Å; F662-V666 VanDerWaalsContact O-N 3.14Å; F662-L732 HydrophobicContact CE1-CD2 3.81Å; F662-L732 HydrophobicContact CZ-CD2 4.32Å; F662-A735 HydrophobicContact CD1-CB 3.82Å
663	G	89.9	Confident	88.6	Confident	0 Å²	0	40.2 Å²	40.2	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-62.2	-50.9	-178.2	0	0	0	0	0	112	A659 F665 V666 G667 L739	A659-G663 WeakPolarHBondContact O-CA 3.18Å; A659-G663 PolarHBondContact O-N 3.35Å; G663-F665 PolarHBondContact O-N 2.88Å; G663-V666 PolarHBondContact O-N 3.17Å; G663-G667 PolarHBondContact O-N 3.35Å; G663-L739 VanDerWaalsContact O-CA 3.23Å; G663-L739 WeakPolarHBondContact O-CA 3.43Å
664	T	90.3	Very high	88.8	Confident	13 Å²	13	38.1 Å²	38.1	8%	0.08	19%	0.192	C	C	.	.	H	α-helix	trans	-62.1	-44.4	-179	-55.8	0	0	0	0	112	I660 G667 I668 L785 L789	I660-T664 WeakPolarHBondContact O-CB 3.32Å; I660-T664 PolarHBondContact O-N 3Å; I660-T664 PolarHBondContact O-OG1 2.94Å; T664-G667 PolarHBondContact O-N 3.23Å; T664-I668 HydrophobicContact CG2-CD1 3.82Å; T664-I668 HydrophobicContact CG2-CG1 4.37Å; T664-I668 WeakPolarHBondContact O-CD1 3Å; T664-I668 VanDerWaalsContact O-CG1 3.29Å; T664-I668 WeakPolarHBondContact O-CG1 3.45Å; T664-I668 PolarHBondContact O-N 3.49Å; T664-L785 HydrophobicContact CG2-CD2 4.23Å; T664-L789 HydrophobicContact CG2-CD1 3.99Å; T664-L789 HydrophobicContact CG2-CD2 3.68Å; T664-L789 HydrophobicContact CG2-CG 4.47Å; T664-L789 WeakPolarHBondContact OG1-CD2 3.46Å
665	F	91.5	Very high	88.7	Confident	135 Å²	135	34.6 Å²	34.6	59%	0.592	18%	0.175	S	C	*	.	H	α-helix	trans	-61.9	-49.3	179.4	177.4	-100.2	0	0	0	112.4	V661 G663 G667 I668 I669	V661-F665 WeakPolarHBondContact O-CB 3.27Å; V661-F665 PolarHBondContact O-N 3.47Å; V661-F665 VanDerWaalsContact O-N 3.12Å; G663-F665 PolarHBondContact O-N 2.88Å; F665-G667 VanDerWaalsContact C-N 3.27Å; F665-G667 PolarHBondContact O-N 3.5Å; F665-I668 PolarHBondContact O-N 3.25Å; F665-I669 HydrophobicContact CD1-CD1 4.13Å; F665-I669 HydrophobicContact CE1-CD1 3.63Å; F665-I669 HydrophobicContact CE2-CD1 4.34Å; F665-I669 HydrophobicContact CZ-CD1 3.76Å; F665-I669 PolarHBondContact O-N 3.02Å
666	V	92.8	Very high	88.6	Confident	39 Å²	39	35.9 Å²	35.9	24%	0.236	18%	0.182	C	C	.	.	H	α-helix	trans	-64.2	-36.8	175.7	176.3	0	0	0	0	110.6	F662 G663 I669 L670 L739	F662-V666 HydrophobicContact CD2-CG2 4.26Å; F662-V666 HydrophobicContact CE1-CG2 4.5Å; F662-V666 HydrophobicContact CE2-CG2 3.91Å; F662-V666 HydrophobicContact CZ-CG2 4.04Å; F662-V666 WeakPolarHBondContact O-CG2 3.45Å; F662-V666 PolarHBondContact O-N 3.11Å; F662-V666 VanDerWaalsContact O-N 3.14Å; G663-V666 PolarHBondContact O-N 3.17Å; V666-I669 PolarHBondContact O-N 2.88Å; V666-L670 HydrophobicContact CG1-CD1 3.9Å; V666-L670 HydrophobicContact CG1-CG 4.37Å; V666-L670 WeakPolarHBondContact O-CG 3.03Å; V666-L670 PolarHBondContact O-N 2.99Å; V666-L739 HydrophobicContact CB-CD1 4.11Å; V666-L739 HydrophobicContact CB-CG 4.41Å; V666-L739 HydrophobicContact CG1-CD1 3.67Å; V666-L739 HydrophobicContact CG1-CG 4.13Å
667	G	91.3	Very high	88.5	Confident	0 Å²	0	40.8 Å²	40.8	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-59.7	-53.5	176.5	0	0	0	0	0	112.7	G663 T664 F665 I669 L670 G671 A743	G663-G667 PolarHBondContact O-N 3.35Å; T664-G667 PolarHBondContact O-N 3.23Å; F665-G667 VanDerWaalsContact C-N 3.27Å; F665-G667 PolarHBondContact O-N 3.5Å; G667-I669 VanDerWaalsContact C-N 3.26Å; G667-I669 PolarHBondContact O-N 3.35Å; G667-L670 PolarHBondContact O-N 3.35Å; G667-L670 VanDerWaalsContact O-N 3.08Å; G667-G671 PolarHBondContact O-N 2.78Å; G667-A743 WeakPolarHBondContact O-CA 3.36Å; G667-A743 WeakPolarHBondContact O-CB 3.35Å
668	I	91.5	Very high	88	Confident	34 Å²	34	41.1 Å²	41.1	17%	0.174	20%	0.203	C	C	.	.	H	α-helix	trans	-53.1	-44	178.7	-68.6	158.6	0	0	0	111.4	T664 F665 T672 I746 L778 L782 L785	T664-I668 HydrophobicContact CG2-CD1 3.82Å; T664-I668 HydrophobicContact CG2-CG1 4.37Å; T664-I668 WeakPolarHBondContact O-CD1 3Å; T664-I668 VanDerWaalsContact O-CG1 3.29Å; T664-I668 WeakPolarHBondContact O-CG1 3.45Å; T664-I668 PolarHBondContact O-N 3.49Å; F665-I668 PolarHBondContact O-N 3.25Å; I668-T672 WeakPolarHBondContact O-CB 3.31Å; I668-T672 PolarHBondContact O-N 3.44Å; I668-T672 PolarHBondContact O-OG1 3Å; I668-I746 HydrophobicContact CG1-CG1 4.07Å; I668-L778 HydrophobicContact CG2-CD1 3.84Å; I668-L782 HydrophobicContact CD1-CD2 3.78Å; I668-L782 HydrophobicContact CG1-CD2 4.08Å; I668-L782 HydrophobicContact CG2-CD2 4.39Å; I668-L785 HydrophobicContact CD1-CD2 4.03Å; I668-L785 HydrophobicContact CG1-CD2 3.83Å
669	I	91.2	Very high	87.3	Confident	77 Å²	77	45.7 Å²	45.7	40%	0.395	23%	0.229	S	C	.	.	H	α-helix	trans	-63.2	-48.7	177.9	-65.3	169	0	0	0	110.9	F665 V666 G667 G671 T672 I673	F665-I669 HydrophobicContact CD1-CD1 4.13Å; F665-I669 HydrophobicContact CE1-CD1 3.63Å; F665-I669 HydrophobicContact CE2-CD1 4.34Å; F665-I669 HydrophobicContact CZ-CD1 3.76Å; F665-I669 PolarHBondContact O-N 3.02Å; V666-I669 PolarHBondContact O-N 2.88Å; G667-I669 VanDerWaalsContact C-N 3.26Å; G667-I669 PolarHBondContact O-N 3.35Å; I669-G671 PolarHBondContact O-N 3.17Å; I669-T672 PolarHBondContact O-N 2.98Å; I669-I673 HydrophobicContact CG2-CD1 3.79Å; I669-I673 WeakPolarHBondContact O-CG1 3.33Å; I669-I673 PolarHBondContact O-N 2.92Å; I669-I673 VanDerWaalsContact O-N 3.08Å
670	L	90.5	Very high	86.7	Confident	48 Å²	48	47.3 Å²	47.3	25%	0.251	24%	0.24	S	C	.	.	H	α-helix	trans	-63.8	-38.7	179.7	-75.4	175.5	0	0	0	112.8	V666 G667 S674 S686 V689 L739 A743	V666-L670 HydrophobicContact CG1-CD1 3.9Å; V666-L670 HydrophobicContact CG1-CG 4.37Å; V666-L670 WeakPolarHBondContact O-CG 3.03Å; V666-L670 PolarHBondContact O-N 2.99Å; G667-L670 PolarHBondContact O-N 3.35Å; G667-L670 VanDerWaalsContact O-N 3.08Å; L670-S674 WeakPolarHBondContact O-CB 3.38Å; L670-S674 PolarHBondContact O-N 2.9Å; L670-S674 VanDerWaalsContact O-N 3.17Å; L670-S686 VanDerWaalsContact C-OG 3.3Å; L670-S686 PolarHBondContact O-OG 3.36Å; L670-V689 HydrophobicContact CD1-CG1 4.41Å; L670-L739 HydrophobicContact CD1-CD2 3.83Å; L670-L739 HydrophobicContact CD1-CG 4.4Å; L670-A743 HydrophobicContact CB-CB 4.01Å
671	G	89.2	Confident	86.3	Confident	0 Å²	0	56.3 Å²	56.3	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-67.2	-45.9	176.3	0	0	0	0	0	112.6	G667 I669 S674 A675 A743	G667-G671 PolarHBondContact O-N 2.78Å; I669-G671 PolarHBondContact O-N 3.17Å; G671-S674 WeakPolarHBondContact O-CB 3.39Å; G671-S674 PolarHBondContact O-N 2.87Å; G671-A675 WeakPolarHBondContact O-CB 3.19Å; G671-A675 PolarHBondContact O-N 3.04Å; G671-A743 WeakPolarHBondContact CA-O 3.4Å
672	T	89.1	Confident	85.9	Confident	5 Å²	5	52.6 Å²	52.6	3%	0.031	25%	0.252	C	S	.	.	H	α-helix	trans	-61.6	-48.7	179	-53.2	0	0	0	0	111.3	I668 I669 S674 A675 M676 M750	I668-T672 WeakPolarHBondContact O-CB 3.31Å; I668-T672 PolarHBondContact O-N 3.44Å; I668-T672 PolarHBondContact O-OG1 3Å; I669-T672 PolarHBondContact O-N 2.98Å; T672-S674 VanDerWaalsContact C-N 3.28Å; T672-S674 PolarHBondContact O-N 2.84Å; T672-A675 PolarHBondContact O-N 2.84Å; T672-M676 HydrophobicContact CG2-SD 4.29Å; T672-M676 WeakPolarHBondContact O-CB 3.46Å; T672-M676 VanDerWaalsContact O-CG 3.29Å; T672-M676 WeakPolarHBondContact O-CG 3.47Å; T672-M676 PolarHBondContact O-N 3.08Å; T672-M750 HydrophobicContact CG2-CE 4.2Å
673	I	87.6	Confident	85.4	Confident	61 Å²	61	48.3 Å²	48.3	31%	0.313	23%	0.233	S	C	.	.	H	α-helix	trans	-62.6	-36.9	179.2	-67.9	169.9	0	0	0	111.5	I669 K677 A682	I669-I673 HydrophobicContact CG2-CD1 3.79Å; I669-I673 WeakPolarHBondContact O-CG1 3.33Å; I669-I673 PolarHBondContact O-N 2.92Å; I669-I673 VanDerWaalsContact O-N 3.08Å; I673-K677 PolarHBondContact O-N 3Å; I673-A682 HydrophobicContact CG2-CB 4.3Å
674	S	85.4	Confident	84.9	Confident	0 Å²	0	52.6 Å²	52.6	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-66.2	-50.9	177	161.5	0	0	0	0	112	L670 G671 T672 M676 K677 Q678 D683 R747	L670-S674 WeakPolarHBondContact O-CB 3.38Å; L670-S674 PolarHBondContact O-N 2.9Å; L670-S674 VanDerWaalsContact O-N 3.17Å; G671-S674 WeakPolarHBondContact O-CB 3.39Å; G671-S674 PolarHBondContact O-N 2.87Å; T672-S674 VanDerWaalsContact C-N 3.28Å; T672-S674 PolarHBondContact O-N 2.84Å; S674-M676 VanDerWaalsContact C-N 3.31Å; S674-M676 PolarHBondContact O-N 2.99Å; S674-K677 CarbonylContact O-C 3.56Å; S674-K677 PolarHBondContact O-N 2.99Å; S674-Q678 PolarHBondContact O-N 2.77Å; S674-D683 PolarHBondContact OG-OD1 3.09Å; S674-R747 WeakPolarHBondContact OG-CD 3.24Å; S674-R747 VanDerWaalsContact OG-CG 3.25Å; S674-R747 WeakPolarHBondContact OG-CG 3.09Å; S674-R747 PolarHBondContact OG-NE 3.44Å
675	A	84.2	Confident	84.3	Confident	0 Å²	0	53.9 Å²	53.9	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-63.3	-33.1	177.6	0	0	0	0	0	113.9	G671 T672 Q678 M750 V751 L754	G671-A675 WeakPolarHBondContact O-CB 3.19Å; G671-A675 PolarHBondContact O-N 3.04Å; T672-A675 PolarHBondContact O-N 2.84Å; A675-Q678 WeakPolarHBondContact O-CG 3.45Å; A675-Q678 PolarHBondContact O-NE2 3.49Å; A675-M750 HydrophobicContact CB-CB 3.31Å; A675-M750 HydrophobicContact CB-CG 4.31Å; A675-V751 HydrophobicContact CB-CG2 3.78Å; A675-L754 HydrophobicContact CB-CD1 4.44Å
676	M	82.8	Confident	83.9	Confident	27 Å²	27	47.9 Å²	47.9	13%	0.133	25%	0.246	C	C	.	.	H	α-helix	trans	-74.9	-22.6	176.2	-74	-170	71.3	0	0	114.3	T672 S674 L754 R769 W770 A773	T672-M676 HydrophobicContact CG2-SD 4.29Å; T672-M676 WeakPolarHBondContact O-CB 3.46Å; T672-M676 VanDerWaalsContact O-CG 3.29Å; T672-M676 WeakPolarHBondContact O-CG 3.47Å; T672-M676 PolarHBondContact O-N 3.08Å; S674-M676 VanDerWaalsContact C-N 3.31Å; S674-M676 PolarHBondContact O-N 2.99Å; M676-L754 HydrophobicContact CG-CD1 4.48Å; M676-R769 HydrophobicContact CE-CB 4.4Å; M676-R769 WeakPolarHBondContact CE-O 3.29Å; M676-W770 HydrophobicContact CE-CB 4.42Å; M676-W770 HydrophobicContact CE-CD2 3.46Å; M676-W770 VanDerWaalsContact CE-CD2 3.46Å; M676-W770 HydrophobicContact CE-CE3 3.48Å; M676-W770 VanDerWaalsContact CE-CE3 3.48Å; M676-W770 HydrophobicContact CE-CG 3.88Å; M676-W770 HydrophobicContact CE-CH2 4.39Å; M676-W770 HydrophobicContact CE-CZ2 4.37Å; M676-W770 HydrophobicContact CE-CZ3 3.96Å; M676-W770 HydrophobicContact SD-CD2 4.1Å; M676-W770 HydrophobicContact SD-CE3 3.47Å; M676-W770 HydrophobicContact SD-CH2 4.05Å; M676-W770 HydrophobicContact SD-CZ3 3.44Å; M676-W770 WeakPolarHBondContact SD-CZ3 3.49Å; M676-A773 HydrophobicContact CE-CB 3.68Å; M676-A773 HydrophobicContact CG-CB 3.8Å; M676-A773 HydrophobicContact SD-CB 3.38Å; M676-A773 WeakPolarHBondContact SD-CB 3.27Å
677	K	81.3	Confident	83.3	Confident	103 Å²	103	47.9 Å²	47.9	45%	0.448	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-127.6	47.3	-176.7	-61.3	-172.4	175.7	-178.3	0	111.5	I673 S674 S680 A682 D683	I673-K677 PolarHBondContact O-N 3Å; S674-K677 CarbonylContact O-C 3.56Å; S674-K677 PolarHBondContact O-N 2.99Å; K677-S680 VanDerWaalsContact CB-OG 3.29Å; K677-S680 WeakPolarHBondContact CB-OG 3.23Å; K677-S680 WeakPolarHBondContact O-CB 3.17Å; K677-S680 PolarHBondContact O-N 2.71Å; K677-S680 PolarHBondContact O-OG 3.23Å; K677-A682 HydrophobicContact CD-CB 4.49Å; K677-D683 VanDerWaalsContact O-CB 3.24Å; K677-D683 WeakPolarHBondContact O-CB 3.29Å
678	Q	74.8	Confident	82.9	Confident	69 Å²	69	52.5 Å²	52.5	32%	0.322	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-48.6	139.5	-179.6	-48	-178.6	26.6	0	0	111.6	S674 A675 S680 D683 V751	S674-Q678 PolarHBondContact O-N 2.77Å; A675-Q678 WeakPolarHBondContact O-CG 3.45Å; A675-Q678 PolarHBondContact O-NE2 3.49Å; Q678-S680 PolarHBondContact O-N 3.17Å; Q678-S680 VanDerWaalsContact O-N 3.1Å; Q678-D683 WeakPolarHBondContact CA-OD2 3.35Å; Q678-V751 HydrophobicContact CG-CG2 4.21Å
679	N	72.4	Confident	82.6	Confident	142 Å²	142	53.8 Å²	53.8	76%	0.759	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.5	6.7	-177.9	-48.4	-78	0	0	0	115.5	D683	N679-D683 PolarHBondContact N-OD2 3.18Å
680	S	76.7	Confident	82.3	Confident	33 Å²	33	50.6 Å²	50.6	23%	0.231	27%	0.265	C	S	.	.	S	Bend	trans	-84.2	171.6	172.5	77.7	0	0	0	0	112.7	K677 Q678 A682 D683 T684	K677-S680 VanDerWaalsContact CB-OG 3.29Å; K677-S680 WeakPolarHBondContact CB-OG 3.23Å; K677-S680 WeakPolarHBondContact O-CB 3.17Å; K677-S680 PolarHBondContact O-N 2.71Å; K677-S680 PolarHBondContact O-OG 3.23Å; Q678-S680 PolarHBondContact O-N 3.17Å; Q678-S680 VanDerWaalsContact O-N 3.1Å; S680-A682 PolarHBondContact O-N 3.46Å; S680-A682 PolarHBondContact OG-N 2.96Å; S680-D683 PolarHBondContact O-N 3Å; S680-D683 PolarHBondContact OG-N 3.33Å; S680-T684 PolarHBondContact O-N 3.36Å; S680-T684 PolarHBondContact O-OG1 2.93Å
681	W	79.3	Confident	81.9	Confident	210 Å²	210	49.2 Å²	49.2	80%	0.795	26%	0.258	S	S	*	.	H	α-helix	trans	-59.1	-30.8	171.6	74.7	-98.8	0	0	0	112.9	A685	W681-A685 VanDerWaalsContact O-CB 3.27Å; W681-A685 WeakPolarHBondContact O-CB 3.3Å; W681-A685 PolarHBondContact O-N 3.24Å
682	A	79.5	Confident	81.6	Confident	13 Å²	13	52.2 Å²	52.2	11%	0.107	27%	0.274	C	S	.	.	H	α-helix	trans	-75.2	-38.5	-179.3	0	0	0	0	0	111.8	I673 K677 S680 A685 S686	I673-A682 HydrophobicContact CG2-CB 4.3Å; K677-A682 HydrophobicContact CD-CB 4.49Å; S680-A682 PolarHBondContact O-N 3.46Å; S680-A682 PolarHBondContact OG-N 2.96Å; A682-A685 PolarHBondContact O-N 2.73Å; A682-S686 VanDerWaalsContact O-CB 3.29Å; A682-S686 WeakPolarHBondContact O-CB 3.38Å; A682-S686 PolarHBondContact O-N 3.38Å
683	D	81.8	Confident	81.3	Confident	6 Å²	6	52.1 Å²	52.1	3%	0.032	27%	0.274	C	S	.	.	H	α-helix	trans	-63.6	-45.7	170.8	177.3	30.9	0	0	0	111	S674 K677 Q678 N679 S680 A685 S686 T687 R747	S674-D683 PolarHBondContact OG-OD1 3.09Å; K677-D683 VanDerWaalsContact O-CB 3.24Å; K677-D683 WeakPolarHBondContact O-CB 3.29Å; Q678-D683 WeakPolarHBondContact CA-OD2 3.35Å; N679-D683 PolarHBondContact N-OD2 3.18Å; S680-D683 PolarHBondContact O-N 3Å; S680-D683 PolarHBondContact OG-N 3.33Å; D683-A685 PolarHBondContact O-N 2.86Å; D683-S686 PolarHBondContact O-N 3.01Å; D683-T687 WeakPolarHBondContact O-CB 3.21Å; D683-T687 PolarHBondContact O-N 2.79Å; D683-T687 PolarHBondContact O-OG1 2.83Å; D683-T687 PolarHBondContact OD1-OG1 2.56Å; D683-R747 VanDerWaalsContact CG-NH2 3.32Å; D683-R747 IonicContact OD1-CZ 2.67Å; D683-R747 VanDerWaalsContact OD1-CZ 3.31Å; D683-R747 IonicContact OD1-NE 2.72Å; D683-R747 PolarHBondContact OD1-NE 3.39Å; D683-R747 IonicContact OD1-NH2 3.72Å; D683-R747 PolarHBondContact OD1-NH2 2.95Å; D683-R747 IonicContact OD2-CZ 2.71Å; D683-R747 IonicContact OD2-NH2 2.78Å; D683-R747 PolarHBondContact OD2-NH2 3.31Å
684	T	78.7	Confident	81	Confident	89 Å²	89	53.1 Å²	53.1	55%	0.546	27%	0.273	S	S	.	.	H	α-helix	trans	-59.7	-44.6	175.8	-53.6	0	0	0	0	112	S680 L688	S680-T684 PolarHBondContact O-N 3.36Å; S680-T684 PolarHBondContact O-OG1 2.93Å; T684-L688 VanDerWaalsContact O-CB 3.29Å; T684-L688 WeakPolarHBondContact O-CB 3.45Å; T684-L688 PolarHBondContact O-N 3.08Å
685	A	79.2	Confident	80.9	Confident	41 Å²	41	53.1 Å²	53.1	34%	0.339	27%	0.273	S	S	.	.	H	α-helix	trans	-68.8	-44.3	179.9	0	0	0	0	0	112.7	W681 A682 D683 L688 V689	W681-A685 VanDerWaalsContact O-CB 3.27Å; W681-A685 WeakPolarHBondContact O-CB 3.3Å; W681-A685 PolarHBondContact O-N 3.24Å; A682-A685 PolarHBondContact O-N 2.73Å; D683-A685 PolarHBondContact O-N 2.86Å; A685-L688 PolarHBondContact O-N 2.84Å; A685-V689 WeakPolarHBondContact O-CG2 3.32Å; A685-V689 PolarHBondContact O-N 2.95Å
686	S	82.8	Confident	80.9	Confident	8 Å²	8	54.7 Å²	54.7	6%	0.056	28%	0.281	C	S	.	.	H	α-helix	trans	-60.1	-47.7	175.2	179	0	0	0	0	111.4	L670 A682 D683 L688 V689 A690	L670-S686 VanDerWaalsContact C-OG 3.3Å; L670-S686 PolarHBondContact O-OG 3.36Å; A682-S686 VanDerWaalsContact O-CB 3.29Å; A682-S686 WeakPolarHBondContact O-CB 3.38Å; A682-S686 PolarHBondContact O-N 3.38Å; D683-S686 PolarHBondContact O-N 3.01Å; S686-L688 PolarHBondContact O-N 3.03Å; S686-V689 PolarHBondContact O-N 2.78Å; S686-A690 PolarHBondContact O-N 3.29Å
687	T	80.6	Confident	81	Confident	40 Å²	40	53.5 Å²	53.5	25%	0.245	28%	0.276	C	S	.	.	H	α-helix	trans	-61.2	-42.3	176.9	-59.4	0	0	0	0	111.6	D683 A690 I691 R747	D683-T687 WeakPolarHBondContact O-CB 3.21Å; D683-T687 PolarHBondContact O-N 2.79Å; D683-T687 PolarHBondContact O-OG1 2.83Å; D683-T687 PolarHBondContact OD1-OG1 2.56Å; T687-A690 PolarHBondContact O-N 3.11Å; T687-I691 HydrophobicContact CG2-CD1 3.73Å; T687-I691 HydrophobicContact CG2-CG1 4.44Å; T687-I691 WeakPolarHBondContact O-CD1 3.47Å; T687-I691 VanDerWaalsContact O-CG1 3.25Å; T687-I691 WeakPolarHBondContact O-CG1 3.43Å; T687-I691 PolarHBondContact O-N 3.26Å; T687-R747 PolarHBondContact OG1-NE 2.86Å
688	L	82.1	Confident	81.2	Confident	97 Å²	97	50.1 Å²	50.1	51%	0.508	26%	0.263	S	S	.	.	H	α-helix	trans	-62	-44.2	175.6	-179.3	64.8	0	0	0	112.3	T684 A685 S686 A690 I691 L692	T684-L688 VanDerWaalsContact O-CB 3.29Å; T684-L688 WeakPolarHBondContact O-CB 3.45Å; T684-L688 PolarHBondContact O-N 3.08Å; A685-L688 PolarHBondContact O-N 2.84Å; S686-L688 PolarHBondContact O-N 3.03Å; L688-A690 VanDerWaalsContact C-N 3.35Å; L688-A690 PolarHBondContact O-N 3.26Å; L688-I691 PolarHBondContact O-N 3Å; L688-L692 HydrophobicContact CD1-CD1 4.19Å; L688-L692 HydrophobicContact CD1-CG 4.32Å; L688-L692 HydrophobicContact CG-CD1 4.06Å; L688-L692 WeakPolarHBondContact O-CB 3.2Å; L688-L692 VanDerWaalsContact O-CG 3.29Å; L688-L692 WeakPolarHBondContact O-CG 3.46Å; L688-L692 PolarHBondContact O-N 2.87Å
689	V	85.8	Confident	81.5	Confident	60 Å²	60	47 Å²	47	36%	0.364	25%	0.248	S	C	.	.	H	α-helix	trans	-62.1	-42.5	176.7	169.8	0	0	0	0	111	L670 A685 S686 L692 G693 L739	L670-V689 HydrophobicContact CD1-CG1 4.41Å; A685-V689 WeakPolarHBondContact O-CG2 3.32Å; A685-V689 PolarHBondContact O-N 2.95Å; S686-V689 PolarHBondContact O-N 2.78Å; V689-L692 PolarHBondContact O-N 3.38Å; V689-G693 PolarHBondContact O-N 2.82Å; V689-L739 HydrophobicContact CG1-CD2 3.91Å
690	A	84.4	Confident	82.1	Confident	10 Å²	10	40.3 Å²	40.3	8%	0.083	21%	0.212	C	C	.	.	H	α-helix	trans	-65.1	-44.6	176	0	0	0	0	0	112.4	S686 T687 L688 L692 G693 R694 A740	S686-A690 PolarHBondContact O-N 3.29Å; T687-A690 PolarHBondContact O-N 3.11Å; L688-A690 VanDerWaalsContact C-N 3.35Å; L688-A690 PolarHBondContact O-N 3.26Å; A690-L692 VanDerWaalsContact C-N 3.35Å; A690-L692 PolarHBondContact O-N 2.96Å; A690-G693 PolarHBondContact O-N 3.41Å; A690-R694 WeakPolarHBondContact O-CB 3.14Å; A690-R694 PolarHBondContact O-N 3.26Å; A690-A740 HydrophobicContact CB-CB 4.24Å; A690-A740 WeakPolarHBondContact O-CB 3.45Å
691	I	82.8	Confident	82.5	Confident	19 Å²	19	41.2 Å²	41.2	10%	0.097	21%	0.212	C	C	.	.	H	α-helix	trans	-59.5	-46.3	176.3	-69.2	158.9	0	0	0	110.6	T687 L688 R694 S695 I1158 L1162	T687-I691 HydrophobicContact CG2-CD1 3.73Å; T687-I691 HydrophobicContact CG2-CG1 4.44Å; T687-I691 WeakPolarHBondContact O-CD1 3.47Å; T687-I691 VanDerWaalsContact O-CG1 3.25Å; T687-I691 WeakPolarHBondContact O-CG1 3.43Å; T687-I691 PolarHBondContact O-N 3.26Å; L688-I691 PolarHBondContact O-N 3Å; I691-R694 PolarHBondContact O-N 3.02Å; I691-S695 WeakPolarHBondContact O-CB 3.34Å; I691-S695 PolarHBondContact O-N 2.86Å; I691-S695 PolarHBondContact O-OG 3.18Å; I691-I1158 HydrophobicContact CG2-CG1 4.44Å; I691-I1158 HydrophobicContact CG2-CG2 4.29Å; I691-L1162 HydrophobicContact CD1-CD2 3.62Å; I691-L1162 HydrophobicContact CD1-CG 4.44Å; I691-L1162 HydrophobicContact CG2-CG 4.44Å
692	L	82.9	Confident	82.9	Confident	64 Å²	64	31.2 Å²	31.2	34%	0.335	17%	0.174	S	C	.	.	H	α-helix	trans	-64.5	-44.9	178.5	-69	171.6	0	0	0	111.7	L688 V689 A690 R694 S695 I696 I1158	L688-L692 HydrophobicContact CD1-CD1 4.19Å; L688-L692 HydrophobicContact CD1-CG 4.32Å; L688-L692 HydrophobicContact CG-CD1 4.06Å; L688-L692 WeakPolarHBondContact O-CB 3.2Å; L688-L692 VanDerWaalsContact O-CG 3.29Å; L688-L692 WeakPolarHBondContact O-CG 3.46Å; L688-L692 PolarHBondContact O-N 2.87Å; V689-L692 PolarHBondContact O-N 3.38Å; A690-L692 VanDerWaalsContact C-N 3.35Å; A690-L692 PolarHBondContact O-N 2.96Å; L692-R694 VanDerWaalsContact C-N 3.29Å; L692-R694 PolarHBondContact O-N 3.32Å; L692-S695 PolarHBondContact O-N 3.05Å; L692-I696 HydrophobicContact CB-CD1 4.31Å; L692-I696 HydrophobicContact CD2-CD1 4.31Å; L692-I696 WeakPolarHBondContact O-CG1 3.21Å; L692-I696 PolarHBondContact O-N 3.02Å; L692-I1158 HydrophobicContact CD2-CD1 3.87Å
693	G	83.3	Confident	83.2	Confident	3 Å²	3	30.8 Å²	30.8	3%	0.031	17%	0.17	C	C	.	.	H	α-helix	trans	-64.6	-27.2	179.4	0	0	0	0	0	114.9	V689 A690	V689-G693 PolarHBondContact O-N 2.82Å; A690-G693 PolarHBondContact O-N 3.41Å
694	R	81.3	Confident	83.4	Confident	82 Å²	82	31.8 Å²	31.8	31%	0.309	18%	0.176	S	C	.	.	H	α-helix	trans	-90.6	-23.2	174.8	-178.5	174	168.4	114.2	-6.6	113.8	A690 I691 L692 A740 D741 F1102 N1161	A690-R694 WeakPolarHBondContact O-CB 3.14Å; A690-R694 PolarHBondContact O-N 3.26Å; I691-R694 PolarHBondContact O-N 3.02Å; L692-R694 VanDerWaalsContact C-N 3.29Å; L692-R694 PolarHBondContact O-N 3.32Å; R694-A740 HydrophobicContact CB-CB 3.97Å; R694-D741 IonicContact CZ-OD1 3.68Å; R694-D741 IonicContact NH1-OD1 3.73Å; R694-D741 PolarHBondContact NH1-OD1 2.93Å; R694-F1102 VanDerWaalsContact NH2-CD1 3.27Å; R694-N1161 PolarHBondContact NE-OD1 2.83Å
695	S	81.5	Confident	83.9	Confident	0 Å²	0	28.1 Å²	28.1	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-103.5	-24.1	-171.9	-51.7	0	0	0	0	114.6	I691 L692 M1157 I1158 N1161	I691-S695 WeakPolarHBondContact O-CB 3.34Å; I691-S695 PolarHBondContact O-N 2.86Å; I691-S695 PolarHBondContact O-OG 3.18Å; L692-S695 PolarHBondContact O-N 3.05Å; S695-M1157 VanDerWaalsContact O-CB 3.27Å; S695-M1157 WeakPolarHBondContact O-CB 3.08Å; S695-I1158 VanDerWaalsContact CB-CG1 3.41Å; S695-N1161 PolarHBondContact OG-ND2 3.34Å
696	I	85.7	Confident	84.2	Confident	33 Å²	33	26.7 Å²	26.7	17%	0.169	14%	0.139	C	C	.	.	S	Bend	trans	-82.6	122.6	170.7	-59.4	170.3	0	0	0	107.3	L692 N698 V700 F701	L692-I696 HydrophobicContact CB-CD1 4.31Å; L692-I696 HydrophobicContact CD2-CD1 4.31Å; L692-I696 WeakPolarHBondContact O-CG1 3.21Å; L692-I696 PolarHBondContact O-N 3.02Å; I696-N698 PolarHBondContact O-N 3.1Å; I696-V700 HydrophobicContact CG2-CB 4.22Å; I696-V700 HydrophobicContact CG2-CG1 4.07Å; I696-F701 HydrophobicContact CG2-CB 4.05Å; I696-F701 HydrophobicContact CG2-CD2 4.29Å
697	P	84.9	Confident	84.2	Confident	2 Å²	2	29.9 Å²	29.9	1%	0.013	15%	0.15	C	C	.	.			trans	-58.2	133.2	177.3	-23.8	32.9	0	0	0	111.7	F699 V700 F701 F1109 I1153 M1157	P697-F699 HydrophobicContact CB-CD1 3.69Å; P697-F699 HydrophobicContact CB-CE1 3.46Å; P697-F699 VanDerWaalsContact CB-CE1 3.46Å; P697-F699 HydrophobicContact CB-CG 4.37Å; P697-F699 HydrophobicContact CB-CZ 3.98Å; P697-F699 HydrophobicContact CG-CE1 4.32Å; P697-F699 HydrophobicContact CG-CZ 4.49Å; P697-F699 PolarHBondContact O-N 2.81Å; P697-V700 HydrophobicContact CB-CB 4.3Å; P697-V700 HydrophobicContact CB-CG2 4Å; P697-V700 HydrophobicContact CG-CG2 4.03Å; P697-V700 WeakPolarHBondContact O-CA 3.25Å; P697-V700 WeakPolarHBondContact O-CB 3.45Å; P697-V700 PolarHBondContact O-N 2.79Å; P697-F701 PolarHBondContact O-N 3.08Å; P697-F1109 HydrophobicContact CB-CD2 3.94Å; P697-F1109 HydrophobicContact CB-CE2 3.95Å; P697-F1109 HydrophobicContact CG-CD2 4.44Å; P697-I1153 HydrophobicContact CG-CD1 4.26Å; P697-I1153 HydrophobicContact CG-CG2 4.09Å; P697-M1157 HydrophobicContact CG-CE 4.49Å; P697-M1157 HydrophobicContact CG-SD 3.88Å
698	N	83.9	Confident	84.4	Confident	32 Å²	32	31.3 Å²	31.3	17%	0.171	16%	0.156	C	C	.	.	H	α-helix	trans	-51.5	-33.4	-178.9	-63.9	4.4	0	0	0	113.1	I696 F701 A702	I696-N698 PolarHBondContact O-N 3.1Å; N698-F701 PolarHBondContact O-N 2.84Å; N698-A702 VanDerWaalsContact O-CB 3.29Å; N698-A702 WeakPolarHBondContact O-CB 3.32Å; N698-A702 PolarHBondContact O-N 3.41Å
699	F	81.6	Confident	84.7	Confident	2 Å²	2	30.2 Å²	30.2	1%	0.009	15%	0.147	C	C	.	.	H	α-helix	trans	-73.8	-32.5	177.5	70.8	-96.1	0	0	0	113.5	P697 V703 V802 I806 F1109 A1112 F1113 F1116 L1132	P697-F699 HydrophobicContact CB-CD1 3.69Å; P697-F699 HydrophobicContact CB-CE1 3.46Å; P697-F699 VanDerWaalsContact CB-CE1 3.46Å; P697-F699 HydrophobicContact CB-CG 4.37Å; P697-F699 HydrophobicContact CB-CZ 3.98Å; P697-F699 HydrophobicContact CG-CE1 4.32Å; P697-F699 HydrophobicContact CG-CZ 4.49Å; P697-F699 PolarHBondContact O-N 2.81Å; F699-V703 WeakPolarHBondContact O-CG2 3.15Å; F699-V703 PolarHBondContact O-N 3.33Å; F699-V802 HydrophobicContact CB-CB 4.07Å; F699-V802 HydrophobicContact CB-CG1 3.65Å; F699-V802 HydrophobicContact CG-CG1 4.31Å; F699-I806 HydrophobicContact CB-CD1 3.73Å; F699-F1109 AromaticContact CD1-CE2 4Å; F699-F1109 HydrophobicContact CD1-CE2 4Å; F699-F1109 HydrophobicContact CE1-CD2 4.26Å; F699-F1109 AromaticContact CE1-CE2 3.94Å; F699-F1109 HydrophobicContact CE1-CE2 3.94Å; F699-A1112 HydrophobicContact CZ-CB 4.45Å; F699-F1113 HydrophobicContact CE1-CB 3.98Å; F699-F1116 HydrophobicContact CB-CE1 4.47Å; F699-F1116 HydrophobicContact CD2-CB 4.38Å; F699-F1116 AromaticContact CD2-CD1 3.71Å; F699-F1116 HydrophobicContact CD2-CD1 3.71Å; F699-F1116 HydrophobicContact CD2-CD2 4.01Å; F699-F1116 AromaticContact CD2-CE1 3.96Å; F699-F1116 HydrophobicContact CD2-CE1 3.96Å; F699-F1116 HydrophobicContact CD2-CE2 4.21Å; F699-F1116 AromaticContact CD2-CG 3.74Å; F699-F1116 HydrophobicContact CD2-CG 3.74Å; F699-F1116 HydrophobicContact CD2-CZ 4.2Å; F699-F1116 HydrophobicContact CE2-CB 3.85Å; F699-F1116 HydrophobicContact CE2-CD1 4.06Å; F699-F1116 AromaticContact CE2-CD2 3.86Å; F699-F1116 HydrophobicContact CE2-CD2 3.86Å; F699-F1116 HydrophobicContact CE2-CE2 4.45Å; F699-F1116 AromaticContact CE2-CG 3.63Å; F699-F1116 HydrophobicContact CE2-CG 3.63Å; F699-F1116 HydrophobicContact CG-CD1 4.29Å; F699-F1116 HydrophobicContact CZ-CB 4.26Å; F699-F1116 HydrophobicContact CZ-CG 4.47Å; F699-L1132 HydrophobicContact CE2-CB 4.39Å; F699-L1132 HydrophobicContact CE2-CD1 3.75Å; F699-L1132 HydrophobicContact CZ-CD1 4.02Å
700	V	84.7	Confident	84.5	Confident	3 Å²	3	27.8 Å²	27.8	2%	0.018	13%	0.133	C	C	.	.	H	α-helix	trans	-66.5	-48.9	168.9	172.6	0	0	0	0	109.4	I696 P697 A702 V703 L704 L1132 A1150	I696-V700 HydrophobicContact CG2-CB 4.22Å; I696-V700 HydrophobicContact CG2-CG1 4.07Å; P697-V700 HydrophobicContact CB-CB 4.3Å; P697-V700 HydrophobicContact CB-CG2 4Å; P697-V700 HydrophobicContact CG-CG2 4.03Å; P697-V700 WeakPolarHBondContact O-CA 3.25Å; P697-V700 WeakPolarHBondContact O-CB 3.45Å; P697-V700 PolarHBondContact O-N 2.79Å; V700-A702 VanDerWaalsContact C-N 3.31Å; V700-A702 PolarHBondContact O-N 3.13Å; V700-V703 PolarHBondContact O-N 2.83Å; V700-L704 HydrophobicContact CG1-CD1 4.19Å; V700-L704 HydrophobicContact CG1-CG 4.44Å; V700-L704 WeakPolarHBondContact O-CG 3.44Å; V700-L704 PolarHBondContact O-N 3.45Å; V700-L1132 HydrophobicContact CG2-CD1 4.12Å; V700-L1132 HydrophobicContact CG2-CD2 3.98Å; V700-A1150 HydrophobicContact CG1-CB 3.69Å
701	F	86.1	Confident	84.3	Confident	52 Å²	52	29.8 Å²	29.8	23%	0.228	14%	0.141	C	C	.	.	H	α-helix	trans	-61.4	-38.5	179.9	-163.2	-99.4	0	0	0	112.2	I696 P697 N698 V703 L704 L705 M736	I696-F701 HydrophobicContact CG2-CB 4.05Å; I696-F701 HydrophobicContact CG2-CD2 4.29Å; P697-F701 PolarHBondContact O-N 3.08Å; N698-F701 PolarHBondContact O-N 2.84Å; F701-V703 PolarHBondContact O-N 3.15Å; F701-L704 PolarHBondContact O-N 2.95Å; F701-L705 HydrophobicContact CD1-CD1 3.78Å; F701-L705 HydrophobicContact CD1-CG 3.97Å; F701-L705 HydrophobicContact CE1-CD1 3.69Å; F701-L705 HydrophobicContact CE1-CD2 4.12Å; F701-L705 HydrophobicContact CE1-CG 3.89Å; F701-L705 HydrophobicContact CZ-CD2 4.46Å; F701-L705 WeakPolarHBondContact O-CB 3.33Å; F701-L705 WeakPolarHBondContact O-CG 3.48Å; F701-L705 PolarHBondContact O-N 2.95Å; F701-M736 HydrophobicContact CD1-CG 3.9Å; F701-M736 HydrophobicContact CE1-CG 3.52Å; F701-M736 HydrophobicContact CE1-SD 4.05Å; F701-M736 HydrophobicContact CE2-CG 4.49Å; F701-M736 HydrophobicContact CG-CG 4.49Å; F701-M736 HydrophobicContact CZ-CG 3.86Å; F701-M736 HydrophobicContact CZ-SD 3.93Å
702	A	87.8	Confident	84.2	Confident	0 Å²	0	36 Å²	36	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-55.7	-49	172.7	0	0	0	0	0	113.1	N698 V700 L705 Q706 A733 I806 F807	N698-A702 VanDerWaalsContact O-CB 3.29Å; N698-A702 WeakPolarHBondContact O-CB 3.32Å; N698-A702 PolarHBondContact O-N 3.41Å; V700-A702 VanDerWaalsContact C-N 3.31Å; V700-A702 PolarHBondContact O-N 3.13Å; A702-L705 PolarHBondContact O-N 3.37Å; A702-Q706 PolarHBondContact O-N 3.06Å; A702-A733 HydrophobicContact CB-CB 3.97Å; A702-I806 HydrophobicContact CB-CD1 4.2Å; A702-I806 HydrophobicContact CB-CG2 4.11Å; A702-F807 HydrophobicContact CB-CE2 3.75Å
703	V	86.1	Confident	84.3	Confident	3 Å²	3	37.6 Å²	37.6	2%	0.018	18%	0.176	C	C	.	.	H	α-helix	trans	-68.3	-35.6	178.9	-179.8	0	0	0	0	111.4	F699 V700 F701 Q706 Y707 I806 Y1136 F1139 L1146	F699-V703 WeakPolarHBondContact O-CG2 3.15Å; F699-V703 PolarHBondContact O-N 3.33Å; V700-V703 PolarHBondContact O-N 2.83Å; F701-V703 PolarHBondContact O-N 3.15Å; V703-Q706 PolarHBondContact O-N 2.95Å; V703-Y707 PolarHBondContact O-N 3.36Å; V703-I806 HydrophobicContact CG2-CD1 4.16Å; V703-I806 HydrophobicContact CG2-CG1 4.48Å; V703-I806 HydrophobicContact CG2-CG2 4Å; V703-Y1136 HydrophobicContact CB-CD2 4.43Å; V703-Y1136 HydrophobicContact CG1-CD2 3.88Å; V703-Y1136 HydrophobicContact CG1-CE2 4.29Å; V703-Y1136 HydrophobicContact CG2-CD2 3.58Å; V703-Y1136 HydrophobicContact CG2-CE2 3.69Å; V703-F1139 HydrophobicContact CG1-CD1 3.89Å; V703-F1139 HydrophobicContact CG1-CE1 3.77Å; V703-F1139 HydrophobicContact CG1-CZ 4.41Å; V703-L1146 HydrophobicContact CB-CD2 4.23Å; V703-L1146 HydrophobicContact CG1-CD2 3.45Å; V703-L1146 VanDerWaalsContact CG1-CD2 3.45Å
704	L	85.6	Confident	84.3	Confident	28 Å²	28	45 Å²	45	15%	0.147	21%	0.21	C	C	.	.	H	α-helix	trans	-67.2	-36.9	174	-64.7	-174.7	0	0	0	112.5	V700 F701 Y707 I708 W1147	V700-L704 HydrophobicContact CG1-CD1 4.19Å; V700-L704 HydrophobicContact CG1-CG 4.44Å; V700-L704 WeakPolarHBondContact O-CG 3.44Å; V700-L704 PolarHBondContact O-N 3.45Å; F701-L704 PolarHBondContact O-N 2.95Å; L704-Y707 WeakPolarHBondContact O-CB 3.39Å; L704-Y707 PolarHBondContact O-N 3.13Å; L704-I708 WeakPolarHBondContact O-CB 3.36Å; L704-I708 WeakPolarHBondContact O-CG1 3.15Å; L704-I708 PolarHBondContact O-N 3.02Å; L704-W1147 HydrophobicContact CD1-CH2 4.35Å; L704-W1147 HydrophobicContact CD1-CZ3 4.04Å; L704-W1147 HydrophobicContact CD2-CD2 4.43Å; L704-W1147 HydrophobicContact CD2-CE3 4.1Å; L704-W1147 HydrophobicContact CD2-CH2 3.42Å; L704-W1147 VanDerWaalsContact CD2-CH2 3.42Å; L704-W1147 HydrophobicContact CD2-CZ2 3.76Å; L704-W1147 HydrophobicContact CD2-CZ3 3.59Å; L704-W1147 HydrophobicContact CG-CH2 4.46Å; L704-W1147 HydrophobicContact CG-CZ3 4.48Å
705	L	88	Confident	84.6	Confident	12 Å²	12	46.1 Å²	46.1	6%	0.063	23%	0.225	C	C	.	.	H	α-helix	trans	-64.6	-44.8	172.4	-76.4	-177.6	0	0	0	111.8	F701 A702 Y707 I708 F709 L729 L732 A733	F701-L705 HydrophobicContact CD1-CD1 3.78Å; F701-L705 HydrophobicContact CD1-CG 3.97Å; F701-L705 HydrophobicContact CE1-CD1 3.69Å; F701-L705 HydrophobicContact CE1-CD2 4.12Å; F701-L705 HydrophobicContact CE1-CG 3.89Å; F701-L705 HydrophobicContact CZ-CD2 4.46Å; F701-L705 WeakPolarHBondContact O-CB 3.33Å; F701-L705 WeakPolarHBondContact O-CG 3.48Å; F701-L705 PolarHBondContact O-N 2.95Å; A702-L705 PolarHBondContact O-N 3.37Å; L705-Y707 VanDerWaalsContact C-N 3.33Å; L705-Y707 PolarHBondContact O-N 3.26Å; L705-I708 PolarHBondContact O-N 3.36Å; L705-F709 HydrophobicContact CD2-CD2 3.71Å; L705-F709 HydrophobicContact CD2-CE2 3.61Å; L705-F709 PolarHBondContact O-N 3.31Å; L705-L729 HydrophobicContact CB-CD2 4.27Å; L705-L729 WeakPolarHBondContact CD1-O 3.47Å; L705-L729 HydrophobicContact CD2-CD2 4.5Å; L705-L732 HydrophobicContact CD1-CB 3.89Å; L705-A733 HydrophobicContact CD1-CB 4.09Å
706	Q	85.7	Confident	85	Confident	11 Å²	11	47.9 Å²	47.9	5%	0.051	24%	0.235	C	C	.	.	I	π-helix	trans	-58.2	-44.7	172.5	-74.9	-179.9	-31.8	0	0	111.4	A702 V703 A710 M711 I718 I806 F807	A702-Q706 PolarHBondContact O-N 3.06Å; V703-Q706 PolarHBondContact O-N 2.95Å; Q706-A710 WeakPolarHBondContact O-CA 3.37Å; Q706-A710 WeakPolarHBondContact O-CB 3.36Å; Q706-A710 PolarHBondContact O-N 2.83Å; Q706-M711 PolarHBondContact O-N 3.44Å; Q706-I718 HydrophobicContact CG-CG2 4.44Å; Q706-I718 PolarHBondContact NE2-O 3Å; Q706-I806 PolarHBondContact NE2-O 2.84Å; Q706-I806 VanDerWaalsContact OE1-CG2 3.27Å; Q706-F807 HydrophobicContact CG-CD1 4.08Å; Q706-F807 HydrophobicContact CG-CE1 3.46Å; Q706-F807 VanDerWaalsContact CG-CE1 3.46Å; Q706-F807 HydrophobicContact CG-CE2 4.47Å; Q706-F807 HydrophobicContact CG-CZ 3.7Å
707	Y	83.5	Confident	85	Confident	75 Å²	75	48 Å²	48	29%	0.294	24%	0.237	S	C	.	.	I	π-helix	trans	-57.1	-58.7	176.2	-170.7	-110.1	0	0	0	111.7	V703 L704 L705 M711 K712 F1139 W1147	V703-Y707 PolarHBondContact O-N 3.36Å; L704-Y707 WeakPolarHBondContact O-CB 3.39Å; L704-Y707 PolarHBondContact O-N 3.13Å; L705-Y707 VanDerWaalsContact C-N 3.33Å; L705-Y707 PolarHBondContact O-N 3.26Å; Y707-M711 HydrophobicContact CD2-CE 3.93Å; Y707-M711 PolarHBondContact O-N 3.12Å; Y707-K712 HydrophobicContact CE1-CG 4.47Å; Y707-K712 WeakPolarHBondContact O-CB 3.43Å; Y707-K712 PolarHBondContact O-N 3.41Å; Y707-F1139 HydrophobicContact CD1-CZ 4.47Å; Y707-F1139 HydrophobicContact CD2-CD1 4.42Å; Y707-F1139 AromaticContact CD2-CE1 3.44Å; Y707-F1139 HydrophobicContact CD2-CE1 3.44Å; Y707-F1139 VanDerWaalsContact CD2-CE1 3.44Å; Y707-F1139 HydrophobicContact CD2-CE2 4.44Å; Y707-F1139 AromaticContact CD2-CZ 3.43Å; Y707-F1139 HydrophobicContact CD2-CZ 3.43Å; Y707-F1139 VanDerWaalsContact CD2-CZ 3.43Å; Y707-F1139 HydrophobicContact CE2-CE1 4.36Å; Y707-F1139 HydrophobicContact CE2-CZ 4.13Å; Y707-F1139 AromaticContact CG-CE1 3.84Å; Y707-F1139 HydrophobicContact CG-CE1 3.84Å; Y707-F1139 AromaticContact CG-CZ 3.65Å; Y707-F1139 HydrophobicContact CG-CZ 3.65Å; Y707-W1147 HydrophobicContact CD1-CZ2 4.26Å; Y707-W1147 HydrophobicContact CE1-CZ2 4.37Å
708	I	84.8	Confident	84.6	Confident	70 Å²	70	51.6 Å²	51.6	36%	0.359	26%	0.255	S	S	.	.	I	π-helix	trans	-70.1	-58	-169.6	-65.4	167.9	0	0	0	110.3	L704 L705 L713	L704-I708 WeakPolarHBondContact O-CB 3.36Å; L704-I708 WeakPolarHBondContact O-CG1 3.15Å; L704-I708 PolarHBondContact O-N 3.02Å; L705-I708 PolarHBondContact O-N 3.36Å; I708-L713 HydrophobicContact CG2-CD1 3.95Å; I708-L713 VanDerWaalsContact O-CB 3.28Å; I708-L713 WeakPolarHBondContact O-CB 3.25Å; I708-L713 VanDerWaalsContact O-CG 3.25Å; I708-L713 WeakPolarHBondContact O-CG 3.47Å; I708-L713 PolarHBondContact O-N 3.05Å
709	F	87.7	Confident	84.2	Confident	74 Å²	74	51.4 Å²	51.4	33%	0.325	26%	0.259	S	S	.	.	I	π-helix	trans	-83.5	-33.9	-168.6	-69.3	-81.3	0	0	0	113.6	L705 L713 Q714 V715 L716 L729	L705-F709 HydrophobicContact CD2-CD2 3.71Å; L705-F709 HydrophobicContact CD2-CE2 3.61Å; L705-F709 PolarHBondContact O-N 3.31Å; F709-L713 HydrophobicContact CD1-CD1 4.19Å; F709-L713 HydrophobicContact CE1-CD1 4.39Å; F709-Q714 PolarHBondContact O-N 3.23Å; F709-Q714 VanDerWaalsContact O-N 3.09Å; F709-V715 PolarHBondContact O-N 2.77Å; F709-L716 HydrophobicContact CB-CB 4.43Å; F709-L716 HydrophobicContact CB-CD1 4.37Å; F709-L716 PolarHBondContact O-N 2.8Å; F709-L729 HydrophobicContact CB-CD1 4.11Å; F709-L729 HydrophobicContact CB-CD2 3.91Å; F709-L729 HydrophobicContact CD2-CD2 4.13Å; F709-L729 HydrophobicContact CG-CD2 4.12Å
710	A	82.3	Confident	84.1	Confident	8 Å²	8	56.7 Å²	56.7	7%	0.066	28%	0.281	C	S	.	.	I	π-helix	trans	-101.5	-31	-170.8	0	0	0	0	0	114.2	Q706 L716 I718 L729	Q706-A710 WeakPolarHBondContact O-CA 3.37Å; Q706-A710 WeakPolarHBondContact O-CB 3.36Å; Q706-A710 PolarHBondContact O-N 2.83Å; A710-L716 WeakPolarHBondContact CA-O 3.46Å; A710-L716 WeakPolarHBondContact CB-O 3.24Å; A710-I718 HydrophobicContact CB-CB 4.18Å; A710-I718 HydrophobicContact CB-CG1 3.51Å; A710-L729 HydrophobicContact CB-CD1 4.05Å
711	M	80	Confident	83.9	Confident	53 Å²	53	59.8 Å²	59.8	26%	0.261	29%	0.293	S	S	.	.	I	π-helix	trans	-102.3	-43.6	178.2	-59.8	-166.5	-65.2	0	0	113.5	Q706 Y707 Q714 I718 F1139 L1140	Q706-M711 PolarHBondContact O-N 3.44Å; Y707-M711 HydrophobicContact CD2-CE 3.93Å; Y707-M711 PolarHBondContact O-N 3.12Å; M711-Q714 WeakPolarHBondContact O-CG 3.37Å; M711-Q714 PolarHBondContact O-NE2 3.18Å; M711-I718 HydrophobicContact CG-CD1 3.91Å; M711-I718 HydrophobicContact CG-CG1 4.23Å; M711-F1139 HydrophobicContact CE-CD1 4.27Å; M711-F1139 HydrophobicContact CE-CE1 4.15Å; M711-L1140 HydrophobicContact CE-CD2 4.07Å; M711-L1140 HydrophobicContact SD-CD2 3.58Å; M711-L1140 VanDerWaalsContact SD-CD2 3.58Å
712	K	79.8	Confident	83.8	Confident	150 Å²	150	63 Å²	63	65%	0.652	31%	0.309	S	S	*	.	I	π-helix	trans	-91.6	-32.6	-172	-149.3	-82.1	-175.8	-176.5	0	113.3	Y707	Y707-K712 HydrophobicContact CE1-CG 4.47Å; Y707-K712 WeakPolarHBondContact O-CB 3.43Å; Y707-K712 PolarHBondContact O-N 3.41Å
713	L	86.3	Confident	83.6	Confident	97 Å²	97	64.9 Å²	64.9	51%	0.508	33%	0.328	S	S	.	.	S	Bend	trans	-103.4	-23.9	172.9	-64	174.1	0	0	0	113.5	I708 F709 V715	I708-L713 HydrophobicContact CG2-CD1 3.95Å; I708-L713 VanDerWaalsContact O-CB 3.28Å; I708-L713 WeakPolarHBondContact O-CB 3.25Å; I708-L713 VanDerWaalsContact O-CG 3.25Å; I708-L713 WeakPolarHBondContact O-CG 3.47Å; I708-L713 PolarHBondContact O-N 3.05Å; F709-L713 HydrophobicContact CD1-CD1 4.19Å; F709-L713 HydrophobicContact CE1-CD1 4.39Å; L713-V715 HydrophobicContact CB-CG2 3.99Å; L713-V715 PolarHBondContact O-N 2.88Å
714	Q	83.7	Confident	83.6	Confident	159 Å²	159	71.4 Å²	71.4	74%	0.743	36%	0.356	S	S	*	.			trans	57.3	28.8	179.4	-54.8	-177.4	-5.5	0	0	114.7	F709 M711	F709-Q714 PolarHBondContact O-N 3.23Å; F709-Q714 VanDerWaalsContact O-N 3.09Å; M711-Q714 WeakPolarHBondContact O-CG 3.37Å; M711-Q714 PolarHBondContact O-NE2 3.18Å
715	V	87.6	Confident	83.7	Confident	105 Å²	105	72.3 Å²	72.3	64%	0.636	37%	0.367	S	S	*	.			trans	-88.4	-25.8	-177.8	177	0	0	0	0	112.4	F709 L713	F709-V715 PolarHBondContact O-N 2.77Å; L713-V715 HydrophobicContact CB-CG2 3.99Å; L713-V715 PolarHBondContact O-N 2.88Å
716	L	89.3	Confident	83.7	Confident	37 Å²	37	74.4 Å²	74.4	19%	0.194	38%	0.375	C	S	.	.	S	Bend	trans	-132.7	153.2	-176.9	-71.7	171.5	0	0	0	110.9	F709 A710 I728 L729	F709-L716 HydrophobicContact CB-CB 4.43Å; F709-L716 HydrophobicContact CB-CD1 4.37Å; F709-L716 PolarHBondContact O-N 2.8Å; A710-L716 WeakPolarHBondContact CA-O 3.46Å; A710-L716 WeakPolarHBondContact CB-O 3.24Å; L716-I728 HydrophobicContact CD1-CG2 3.94Å; L716-I728 HydrophobicContact CD2-CD1 3.97Å; L716-L729 HydrophobicContact CB-CD1 3.94Å; L716-L729 HydrophobicContact CB-CD2 4.43Å; L716-L729 HydrophobicContact CB-CG 4.06Å; L716-L729 HydrophobicContact CD1-CD2 3.52Å; L716-L729 HydrophobicContact CD1-CG 3.9Å
717	P	85.9	Confident	83.8	Confident	34 Å²	34	74 Å²	74	22%	0.221	37%	0.373	C	S	.	.			trans	-71.6	150.9	-178.5	29.6	-36.3	0	0	0	113.1	A725 Y726	P717-A725 HydrophobicContact CG-CB 4.32Å; P717-Y726 HydrophobicContact CB-CD1 3.58Å; P717-Y726 HydrophobicContact CB-CE1 3.41Å; P717-Y726 VanDerWaalsContact CB-CE1 3.41Å; P717-Y726 HydrophobicContact CB-CE2 4.48Å; P717-Y726 HydrophobicContact CB-CG 4.19Å; P717-Y726 HydrophobicContact CG-CD1 3.63Å; P717-Y726 HydrophobicContact CG-CD2 4.11Å; P717-Y726 HydrophobicContact CG-CE1 3.92Å; P717-Y726 HydrophobicContact CG-CE2 4.39Å; P717-Y726 HydrophobicContact CG-CG 3.74Å
718	I	77	Confident	84.1	Confident	78 Å²	78	73.1 Å²	73.1	40%	0.4	37%	0.373	S	S	.	.			trans	-78.2	-43	-174.8	-57.2	167.9	0	0	0	112.8	Q706 A710 M711 F807	Q706-I718 HydrophobicContact CG-CG2 4.44Å; Q706-I718 PolarHBondContact NE2-O 3Å; A710-I718 HydrophobicContact CB-CB 4.18Å; A710-I718 HydrophobicContact CB-CG1 3.51Å; M711-I718 HydrophobicContact CG-CD1 3.91Å; M711-I718 HydrophobicContact CG-CG1 4.23Å; I718-F807 WeakPolarHBondContact O-CD1 3.38Å
719	A	75.2	Confident	84.4	Confident	29 Å²	29	69.9 Å²	69.9	24%	0.24	36%	0.356	C	S	.	.	S	Bend	trans	-163.6	174.5	-165.3	0	0	0	0	0	111.8	Y726 F807 A808	A719-Y726 WeakPolarHBondContact O-CD1 3.23Å; A719-Y726 WeakPolarHBondContact O-CE1 3.38Å; A719-F807 CarbonylContact C-O 3.54Å; A719-F807 WeakPolarHBondContact CA-O 3.34Å; A719-F807 VanDerWaalsContact CB-O 3.26Å; A719-F807 WeakPolarHBondContact CB-O 3.18Å; A719-A808 HydrophobicContact CB-CB 4.29Å
720	K	78.8	Confident	84.5	Confident	112 Å²	112	66.4 Å²	66.4	49%	0.487	34%	0.341	S	S	.	.			trans	77	-175.3	-171	-45.5	178.6	-178	173.3	0	114.4	E722 Y726 F807	K720-E722 HydrophobicContact CB-CG 4.42Å; K720-E722 HydrophobicContact CD-CG 4.2Å; K720-E722 WeakPolarHBondContact CD-OE1 3.19Å; K720-E722 WeakPolarHBondContact CE-OE1 3.41Å; K720-E722 IonicContact NZ-OE1 2.66Å; K720-E722 PolarHBondContact NZ-OE1 3.12Å; K720-E722 IonicContact NZ-OE2 3.53Å; K720-Y726 HydrophobicContact CB-CD1 4.48Å; K720-Y726 HydrophobicContact CB-CE1 4.34Å; K720-F807 PolarHBondContact N-O 2.67Å
721	W	81.6	Confident	84.9	Confident	68 Å²	68	66.7 Å²	66.7	26%	0.258	34%	0.342	S	S	.	.			trans	-139.1	68.5	-174.7	-167.6	-96.4	0	0	0	111.6	P651 Q654 L655 T727 I809 P810	P651-W721 HydrophobicContact CB-CD2 4.11Å; P651-W721 HydrophobicContact CB-CE3 4.41Å; P651-W721 HydrophobicContact CB-CH2 4.09Å; P651-W721 HydrophobicContact CB-CZ2 3.8Å; P651-W721 HydrophobicContact CB-CZ3 4.39Å; P651-W721 HydrophobicContact CG-CD2 4.34Å; P651-W721 HydrophobicContact CG-CZ2 4.25Å; Q654-W721 HydrophobicContact CB-CH2 4.45Å; Q654-W721 HydrophobicContact CB-CZ2 4.45Å; Q654-W721 HydrophobicContact CG-CH2 4.46Å; L655-W721 HydrophobicContact CD1-CH2 4.47Å; L655-W721 HydrophobicContact CD1-CZ3 4.04Å; L655-W721 HydrophobicContact CD2-CH2 4.05Å; L655-W721 HydrophobicContact CD2-CZ3 3.87Å; L655-W721 HydrophobicContact CG-CH2 3.91Å; L655-W721 HydrophobicContact CG-CZ3 3.89Å; W721-T727 HydrophobicContact CE3-CG2 4.24Å; W721-T727 HydrophobicContact CH2-CG2 3.45Å; W721-T727 VanDerWaalsContact CH2-CG2 3.45Å; W721-T727 HydrophobicContact CZ2-CG2 4.05Å; W721-T727 HydrophobicContact CZ3-CG2 3.56Å; W721-I809 HydrophobicContact CD2-CG2 4.08Å; W721-I809 HydrophobicContact CE3-CB 4.48Å; W721-I809 HydrophobicContact CE3-CD1 4.19Å; W721-I809 HydrophobicContact CE3-CG1 4.28Å; W721-I809 HydrophobicContact CE3-CG2 3.5Å; W721-I809 HydrophobicContact CZ3-CD1 4.21Å; W721-I809 HydrophobicContact CZ3-CG2 3.94Å; W721-P810 HydrophobicContact CB-CG 4.08Å
722	E	83.3	Confident	85.4	Confident	121 Å²	121	67 Å²	67	57%	0.565	34%	0.344	S	S	*	.	S	Bend	trans	-110.3	1.9	-175.2	-61.3	176.4	170.1	0	0	113.7	K720 Y726	K720-E722 HydrophobicContact CB-CG 4.42Å; K720-E722 HydrophobicContact CD-CG 4.2Å; K720-E722 WeakPolarHBondContact CD-OE1 3.19Å; K720-E722 WeakPolarHBondContact CE-OE1 3.41Å; K720-E722 IonicContact NZ-OE1 2.66Å; K720-E722 PolarHBondContact NZ-OE1 3.12Å; K720-E722 IonicContact NZ-OE2 3.53Å; E722-Y726 HydrophobicContact CB-CD2 4.18Å; E722-Y726 HydrophobicContact CB-CE2 3.62Å; E722-Y726 PolarHBondContact OE2-OH 3.08Å; E722-Y726 VanDerWaalsContact OE2-OH 3.08Å
723	G	83.7	Confident	85.8	Confident	38 Å²	38	59.8 Å²	59.8	39%	0.392	31%	0.313	S	S	.	.	S	Bend	trans	166.8	176.9	177.5	0	0	0	0	0	114.1	A725 Y726	G723-A725 VanDerWaalsContact C-N 3.3Å; G723-A725 PolarHBondContact O-N 2.77Å; G723-Y726 WeakPolarHBondContact O-CB 3.25Å; G723-Y726 WeakPolarHBondContact O-CD2 3.39Å; G723-Y726 PolarHBondContact O-N 2.87Å
724	F	86.4	Confident	85.8	Confident	141 Å²	141	55.2 Å²	55.2	62%	0.618	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.3	-35.2	-174.3	-175.9	-93.9	0	0	0	114.1	Y726 T727 I728	F724-Y726 PolarHBondContact O-N 3.47Å; F724-Y726 VanDerWaalsContact O-N 3.13Å; F724-T727 PolarHBondContact O-N 2.88Å; F724-T727 PolarHBondContact O-OG1 3.5Å; F724-I728 HydrophobicContact CD1-CD1 4.49Å; F724-I728 HydrophobicContact CD1-CG1 4.47Å; F724-I728 HydrophobicContact CE1-CD1 4.39Å; F724-I728 HydrophobicContact CE1-CG1 4.23Å
725	A	86.4	Confident	86.1	Confident	46 Å²	46	47.7 Å²	47.7	38%	0.38	25%	0.254	S	S	.	.	H	α-helix	trans	-58.3	-27.9	177	0	0	0	0	0	113.3	P717 G723 T727	P717-A725 HydrophobicContact CG-CB 4.32Å; G723-A725 VanDerWaalsContact C-N 3.3Å; G723-A725 PolarHBondContact O-N 2.77Å; A725-T727 VanDerWaalsContact C-N 3.3Å; A725-T727 PolarHBondContact O-N 3.14Å
726	Y	87.9	Confident	86.2	Confident	57 Å²	57	44.2 Å²	44.2	22%	0.224	23%	0.231	C	C	.	.	H	α-helix	trans	-73.6	-18	176.1	-64.8	-96.9	0	0	0	113.2	P717 A719 K720 E722 G723 F724 P730	P717-Y726 HydrophobicContact CB-CD1 3.58Å; P717-Y726 HydrophobicContact CB-CE1 3.41Å; P717-Y726 VanDerWaalsContact CB-CE1 3.41Å; P717-Y726 HydrophobicContact CB-CE2 4.48Å; P717-Y726 HydrophobicContact CB-CG 4.19Å; P717-Y726 HydrophobicContact CG-CD1 3.63Å; P717-Y726 HydrophobicContact CG-CD2 4.11Å; P717-Y726 HydrophobicContact CG-CE1 3.92Å; P717-Y726 HydrophobicContact CG-CE2 4.39Å; P717-Y726 HydrophobicContact CG-CG 3.74Å; A719-Y726 WeakPolarHBondContact O-CD1 3.23Å; A719-Y726 WeakPolarHBondContact O-CE1 3.38Å; K720-Y726 HydrophobicContact CB-CD1 4.48Å; K720-Y726 HydrophobicContact CB-CE1 4.34Å; E722-Y726 HydrophobicContact CB-CD2 4.18Å; E722-Y726 HydrophobicContact CB-CE2 3.62Å; E722-Y726 PolarHBondContact OE2-OH 3.08Å; E722-Y726 VanDerWaalsContact OE2-OH 3.08Å; G723-Y726 WeakPolarHBondContact O-CB 3.25Å; G723-Y726 WeakPolarHBondContact O-CD2 3.39Å; G723-Y726 PolarHBondContact O-N 2.87Å; F724-Y726 PolarHBondContact O-N 3.47Å; F724-Y726 VanDerWaalsContact O-N 3.13Å; Y726-P730 WeakPolarHBondContact O-CD 3.31Å; Y726-P730 VanDerWaalsContact O-CG 3.31Å; Y726-P730 WeakPolarHBondContact O-CG 3.33Å
727	T	88.8	Confident	85.9	Confident	2 Å²	2	43.8 Å²	43.8	1%	0.012	23%	0.231	C	C	.	.	H	α-helix	trans	-88.1	-15.8	178.7	87.8	0	0	0	0	112.6	Q658 W721 F724 A725 P730 T731	Q658-T727 PolarHBondContact NE2-OG1 3.02Å; Q658-T727 PolarHBondContact OE1-OG1 3.18Å; W721-T727 HydrophobicContact CE3-CG2 4.24Å; W721-T727 HydrophobicContact CH2-CG2 3.45Å; W721-T727 VanDerWaalsContact CH2-CG2 3.45Å; W721-T727 HydrophobicContact CZ2-CG2 4.05Å; W721-T727 HydrophobicContact CZ3-CG2 3.56Å; F724-T727 PolarHBondContact O-N 2.88Å; F724-T727 PolarHBondContact O-OG1 3.5Å; A725-T727 VanDerWaalsContact C-N 3.3Å; A725-T727 PolarHBondContact O-N 3.14Å; T727-P730 WeakPolarHBondContact O-CD 3.24Å; T727-T731 WeakPolarHBondContact O-CB 3.5Å; T727-T731 PolarHBondContact O-N 2.86Å; T727-T731 PolarHBondContact O-OG1 3.14Å; T727-T731 VanDerWaalsContact O-OG1 3.05Å
728	I	90.7	Very high	86	Confident	56 Å²	56	42.2 Å²	42.2	29%	0.287	22%	0.221	S	C	.	.	H	α-helix	trans	-62.4	-56.6	-174.1	-61.6	176.3	0	0	0	112.1	L716 F724 T731 L732	L716-I728 HydrophobicContact CD1-CG2 3.94Å; L716-I728 HydrophobicContact CD2-CD1 3.97Å; F724-I728 HydrophobicContact CD1-CD1 4.49Å; F724-I728 HydrophobicContact CD1-CG1 4.47Å; F724-I728 HydrophobicContact CE1-CD1 4.39Å; F724-I728 HydrophobicContact CE1-CG1 4.23Å; I728-T731 PolarHBondContact O-N 3.03Å; I728-L732 HydrophobicContact CG2-CD1 3.99Å; I728-L732 WeakPolarHBondContact O-CB 3.16Å; I728-L732 VanDerWaalsContact O-CG 3.32Å; I728-L732 WeakPolarHBondContact O-CG 3.43Å; I728-L732 PolarHBondContact O-N 3.4Å
729	L	90.3	Very high	86.7	Confident	3 Å²	3	39.1 Å²	39.1	2%	0.016	21%	0.205	C	C	.	.	H	α-helix	trans	-66.1	-42	-178.9	-62.9	-176.8	0	0	0	113.3	L705 F709 A710 L716 L732 A733 F807	L705-L729 HydrophobicContact CB-CD2 4.27Å; L705-L729 WeakPolarHBondContact CD1-O 3.47Å; L705-L729 HydrophobicContact CD2-CD2 4.5Å; F709-L729 HydrophobicContact CB-CD1 4.11Å; F709-L729 HydrophobicContact CB-CD2 3.91Å; F709-L729 HydrophobicContact CD2-CD2 4.13Å; F709-L729 HydrophobicContact CG-CD2 4.12Å; A710-L729 HydrophobicContact CB-CD1 4.05Å; L716-L729 HydrophobicContact CB-CD1 3.94Å; L716-L729 HydrophobicContact CB-CD2 4.43Å; L716-L729 HydrophobicContact CB-CG 4.06Å; L716-L729 HydrophobicContact CD1-CD2 3.52Å; L716-L729 HydrophobicContact CD1-CG 3.9Å; L729-L732 HydrophobicContact CD2-CD1 4.47Å; L729-L732 PolarHBondContact O-N 3.42Å; L729-A733 WeakPolarHBondContact O-CB 3.25Å; L729-A733 PolarHBondContact O-N 2.99Å; L729-F807 HydrophobicContact CB-CE1 3.49Å; L729-F807 VanDerWaalsContact CB-CE1 3.49Å; L729-F807 HydrophobicContact CB-CZ 3.59Å; L729-F807 HydrophobicContact CD1-CE1 4.22Å
730	P	89.8	Confident	87.2	Confident	1 Å²	1	37.8 Å²	37.8	1%	0.006	19%	0.194	C	C	.	.	H	α-helix	trans	-58.5	-45.1	170.7	-27.3	34.9	0	0	0	113.9	L655 Y726 T727 A733 L734 V803 F807 I809	L655-P730 HydrophobicContact CD1-CB 4.22Å; L655-P730 HydrophobicContact CD2-CB 3.7Å; Y726-P730 WeakPolarHBondContact O-CD 3.31Å; Y726-P730 VanDerWaalsContact O-CG 3.31Å; Y726-P730 WeakPolarHBondContact O-CG 3.33Å; T727-P730 WeakPolarHBondContact O-CD 3.24Å; P730-A733 PolarHBondContact O-N 3.49Å; P730-L734 PolarHBondContact O-N 3.41Å; P730-V803 HydrophobicContact CB-CG1 3.82Å; P730-F807 HydrophobicContact CB-CD2 4.33Å; P730-F807 HydrophobicContact CG-CB 4.12Å; P730-F807 HydrophobicContact CG-CD1 3.79Å; P730-F807 HydrophobicContact CG-CD2 3.91Å; P730-F807 HydrophobicContact CG-CE1 4.15Å; P730-F807 HydrophobicContact CG-CE2 4.21Å; P730-F807 HydrophobicContact CG-CG 3.69Å; P730-F807 HydrophobicContact CG-CZ 4.35Å; P730-I809 HydrophobicContact CB-CD1 3.9Å; P730-I809 HydrophobicContact CG-CD1 3.6Å
731	T	90.3	Very high	87.5	Confident	13 Å²	13	33.5 Å²	33.5	8%	0.08	18%	0.177	C	C	.	.	H	α-helix	trans	-64.7	-42.5	178.5	-74.6	0	0	0	0	111	Q658 T727 I728 A733 L734 A735	Q658-T731 HydrophobicContact CB-CG2 3.68Å; Q658-T731 WeakPolarHBondContact CB-OG1 3.46Å; Q658-T731 PolarHBondContact OE1-OG1 2.84Å; T727-T731 WeakPolarHBondContact O-CB 3.5Å; T727-T731 PolarHBondContact O-N 2.86Å; T727-T731 PolarHBondContact O-OG1 3.14Å; T727-T731 VanDerWaalsContact O-OG1 3.05Å; I728-T731 PolarHBondContact O-N 3.03Å; T731-A733 VanDerWaalsContact C-N 3.33Å; T731-A733 PolarHBondContact O-N 3.46Å; T731-L734 PolarHBondContact O-N 3.49Å; T731-A735 WeakPolarHBondContact O-CB 3.46Å; T731-A735 PolarHBondContact O-N 2.88Å
732	L	90.3	Very high	87.8	Confident	59 Å²	59	30.3 Å²	30.3	31%	0.309	17%	0.165	S	C	.	.	H	α-helix	trans	-62.3	-38.8	173.3	-72.2	172.5	0	0	0	112	F662 L705 I728 L729 A735	F662-L732 HydrophobicContact CE1-CD2 3.81Å; F662-L732 HydrophobicContact CZ-CD2 4.32Å; L705-L732 HydrophobicContact CD1-CB 3.89Å; I728-L732 HydrophobicContact CG2-CD1 3.99Å; I728-L732 WeakPolarHBondContact O-CB 3.16Å; I728-L732 VanDerWaalsContact O-CG 3.32Å; I728-L732 WeakPolarHBondContact O-CG 3.43Å; I728-L732 PolarHBondContact O-N 3.4Å; L729-L732 HydrophobicContact CD2-CD1 4.47Å; L729-L732 PolarHBondContact O-N 3.42Å; L732-A735 PolarHBondContact O-N 3.14Å
733	A	87.9	Confident	88.1	Confident	0 Å²	0	24.6 Å²	24.6	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-65.9	-36.4	177.1	0	0	0	0	0	113.4	A702 L705 L729 P730 T731 V803	A702-A733 HydrophobicContact CB-CB 3.97Å; L705-A733 HydrophobicContact CD1-CB 4.09Å; L729-A733 WeakPolarHBondContact O-CB 3.25Å; L729-A733 PolarHBondContact O-N 2.99Å; P730-A733 PolarHBondContact O-N 3.49Å; T731-A733 VanDerWaalsContact C-N 3.33Å; T731-A733 PolarHBondContact O-N 3.46Å; A733-V803 HydrophobicContact CB-CG1 4.27Å; A733-V803 HydrophobicContact CB-CG2 4.4Å
734	L	87.5	Confident	88.1	Confident	0 Å²	0	24.8 Å²	24.8	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-81	-31.9	176.6	-70.1	169.7	0	0	0	112.6	L655 A659 P730 T731 M736 P738 L796 V803	L655-L734 HydrophobicContact CB-CD1 4.1Å; A659-L734 HydrophobicContact CB-CB 3.52Å; P730-L734 PolarHBondContact O-N 3.41Å; T731-L734 PolarHBondContact O-N 3.49Å; L734-M736 VanDerWaalsContact C-N 3.26Å; L734-M736 PolarHBondContact O-N 2.66Å; L734-P738 VanDerWaalsContact O-CD 3.24Å; L734-P738 WeakPolarHBondContact O-CD 3.31Å; L734-L796 HydrophobicContact CB-CD2 4.19Å; L734-L796 VanDerWaalsContact O-CD2 3.25Å; L734-L796 WeakPolarHBondContact O-CD2 3.29Å; L734-V803 HydrophobicContact CD1-CB 4.48Å; L734-V803 HydrophobicContact CD1-CG1 4.45Å; L734-V803 HydrophobicContact CD2-CB 4.28Å; L734-V803 HydrophobicContact CD2-CG2 3.7Å; L734-V803 HydrophobicContact CG-CB 4.27Å; L734-V803 HydrophobicContact CG-CG1 4.3Å; L734-V803 HydrophobicContact CG-CG2 3.98Å
735	A	90.3	Very high	88	Confident	1 Å²	1	20.2 Å²	20.2	1%	0.008	11%	0.107	C	C	.	.	H	α-helix	trans	-70.1	-16.1	-175	0	0	0	0	0	114.6	A659 F662 T731 L732 S737 P738 L739	A659-A735 HydrophobicContact CB-CB 4.36Å; F662-A735 HydrophobicContact CD1-CB 3.82Å; T731-A735 WeakPolarHBondContact O-CB 3.46Å; T731-A735 PolarHBondContact O-N 2.88Å; L732-A735 PolarHBondContact O-N 3.14Å; A735-S737 VanDerWaalsContact C-N 3.34Å; A735-S737 PolarHBondContact O-N 2.94Å; A735-P738 WeakPolarHBondContact O-CD 3.32Å; A735-P738 WeakPolarHBondContact O-CG 3.42Å; A735-L739 WeakPolarHBondContact O-CB 3.32Å; A735-L739 PolarHBondContact O-N 3.36Å
736	M	88.4	Confident	88.1	Confident	33 Å²	33	18 Å²	18	16%	0.163	9%	0.089	C	C	.	.	H	α-helix	trans	-63	-35.1	-177.6	-70	-51.8	-54.6	0	0	113.7	F701 L734 A740	F701-M736 HydrophobicContact CD1-CG 3.9Å; F701-M736 HydrophobicContact CE1-CG 3.52Å; F701-M736 HydrophobicContact CE1-SD 4.05Å; F701-M736 HydrophobicContact CE2-CG 4.49Å; F701-M736 HydrophobicContact CG-CG 4.49Å; F701-M736 HydrophobicContact CZ-CG 3.86Å; F701-M736 HydrophobicContact CZ-SD 3.93Å; L734-M736 VanDerWaalsContact C-N 3.26Å; L734-M736 PolarHBondContact O-N 2.66Å; M736-A740 WeakPolarHBondContact O-CB 3.47Å; M736-A740 PolarHBondContact O-N 3.4Å
737	S	83.7	Confident	88	Confident	28 Å²	28	17.9 Å²	17.9	20%	0.196	9%	0.088	C	C	.	.	H	α-helix	trans	-68.7	-58.3	173.2	162.4	0	0	0	0	112.8	A735 L739 A740 D741	A735-S737 VanDerWaalsContact C-N 3.34Å; A735-S737 PolarHBondContact O-N 2.94Å; S737-L739 PolarHBondContact O-N 3.25Å; S737-L739 VanDerWaalsContact O-N 3.13Å; S737-A740 PolarHBondContact O-N 3.42Å; S737-D741 WeakPolarHBondContact O-CB 3.23Å; S737-D741 PolarHBondContact O-N 2.91Å; S737-D741 VanDerWaalsContact O-OD2 3.05Å; S737-D741 PolarHBondContact OG-OD2 2.91Å
738	P	87.5	Confident	87.6	Confident	0 Å²	0	18.5 Å²	18.5	0%	0	9%	0.092	C	C	.	.	H	α-helix	trans	-56	-33.9	177.4	15.1	-26.7	0	0	0	112.7	A659 L734 A735 S742 L792 L796	A659-P738 WeakPolarHBondContact O-CG 3.34Å; L734-P738 VanDerWaalsContact O-CD 3.24Å; L734-P738 WeakPolarHBondContact O-CD 3.31Å; A735-P738 WeakPolarHBondContact O-CD 3.32Å; A735-P738 WeakPolarHBondContact O-CG 3.42Å; P738-S742 WeakPolarHBondContact O-CB 3.31Å; P738-S742 PolarHBondContact O-N 2.95Å; P738-S742 PolarHBondContact O-OG 2.59Å; P738-L792 HydrophobicContact CB-CD2 3.67Å; P738-L796 HydrophobicContact CB-CD1 4.12Å; P738-L796 HydrophobicContact CG-CD1 3.69Å; P738-L796 HydrophobicContact CG-CD2 4.27Å
739	L	91.5	Very high	87.2	Confident	13 Å²	13	17.8 Å²	17.8	7%	0.068	9%	0.087	C	C	.	.	H	α-helix	trans	-64.6	-54.8	172.4	-171.7	162.5	0	0	0	111.8	G663 V666 L670 V689 A735 S737 A743	G663-L739 VanDerWaalsContact O-CA 3.23Å; G663-L739 WeakPolarHBondContact O-CA 3.43Å; V666-L739 HydrophobicContact CB-CD1 4.11Å; V666-L739 HydrophobicContact CB-CG 4.41Å; V666-L739 HydrophobicContact CG1-CD1 3.67Å; V666-L739 HydrophobicContact CG1-CG 4.13Å; L670-L739 HydrophobicContact CD1-CD2 3.83Å; L670-L739 HydrophobicContact CD1-CG 4.4Å; V689-L739 HydrophobicContact CG1-CD2 3.91Å; A735-L739 WeakPolarHBondContact O-CB 3.32Å; A735-L739 PolarHBondContact O-N 3.36Å; S737-L739 PolarHBondContact O-N 3.25Å; S737-L739 VanDerWaalsContact O-N 3.13Å; L739-A743 WeakPolarHBondContact O-CB 3.35Å; L739-A743 PolarHBondContact O-N 3.38Å
740	A	87.2	Confident	86.9	Confident	1 Å²	1	17.6 Å²	17.6	1%	0.008	9%	0.086	C	C	.	.	H	α-helix	trans	-61.9	-47.3	-178.4	0	0	0	0	0	112.6	A690 R694 M736 S737 R744	A690-A740 HydrophobicContact CB-CB 4.24Å; A690-A740 WeakPolarHBondContact O-CB 3.45Å; R694-A740 HydrophobicContact CB-CB 3.97Å; M736-A740 WeakPolarHBondContact O-CB 3.47Å; M736-A740 PolarHBondContact O-N 3.4Å; S737-A740 PolarHBondContact O-N 3.42Å; A740-R744 WeakPolarHBondContact O-CB 3.33Å; A740-R744 PolarHBondContact O-N 3.12Å
741	D	84.4	Confident	86.4	Confident	23 Å²	23	18 Å²	18	12%	0.123	9%	0.088	C	C	.	.	H	α-helix	trans	-69.1	-44.6	-177.6	-64	-50.3	0	0	0	110.6	R694 S737 F745 L792	R694-D741 IonicContact CZ-OD1 3.68Å; R694-D741 IonicContact NH1-OD1 3.73Å; R694-D741 PolarHBondContact NH1-OD1 2.93Å; S737-D741 WeakPolarHBondContact O-CB 3.23Å; S737-D741 PolarHBondContact O-N 2.91Å; S737-D741 VanDerWaalsContact O-OD2 3.05Å; S737-D741 PolarHBondContact OG-OD2 2.91Å; D741-F745 WeakPolarHBondContact O-CB 3.3Å; D741-F745 PolarHBondContact O-N 3.21Å; D741-L792 HydrophobicContact CB-CD1 4.48Å
742	S	87.1	Confident	85.7	Confident	0 Å²	0	23.6 Å²	23.6	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-69.1	-40.3	177	-52.9	0	0	0	0	112.9	P738 F745 I746	P738-S742 WeakPolarHBondContact O-CB 3.31Å; P738-S742 PolarHBondContact O-N 2.95Å; P738-S742 PolarHBondContact O-OG 2.59Å; S742-F745 PolarHBondContact O-N 3.02Å; S742-I746 WeakPolarHBondContact O-CB 3.29Å; S742-I746 WeakPolarHBondContact O-CG1 3.42Å; S742-I746 PolarHBondContact O-N 2.91Å
743	A	89.7	Confident	85.1	Confident	2 Å²	2	21.6 Å²	21.6	2%	0.017	10%	0.104	C	C	.	.	H	α-helix	trans	-61.4	-46	176.3	0	0	0	0	0	111.6	G667 L670 G671 L739 R747	G667-A743 WeakPolarHBondContact O-CA 3.36Å; G667-A743 WeakPolarHBondContact O-CB 3.35Å; L670-A743 HydrophobicContact CB-CB 4.01Å; G671-A743 WeakPolarHBondContact CA-O 3.4Å; L739-A743 WeakPolarHBondContact O-CB 3.35Å; L739-A743 PolarHBondContact O-N 3.38Å; A743-R747 VanDerWaalsContact O-CB 3.22Å; A743-R747 WeakPolarHBondContact O-CB 3.22Å; A743-R747 PolarHBondContact O-N 2.82Å
744	R	83.3	Confident	84.8	Confident	42 Å²	42	23.2 Å²	23.2	16%	0.158	11%	0.113	C	C	.	.	H	α-helix	trans	-69.2	-40	179.8	-179.1	-177.1	170.4	155.3	6.4	112.4	A740 T748 D1165	A740-R744 WeakPolarHBondContact O-CB 3.33Å; A740-R744 PolarHBondContact O-N 3.12Å; R744-T748 PolarHBondContact O-N 3.31Å; R744-T748 VanDerWaalsContact O-N 3.11Å; R744-T748 PolarHBondContact O-OG1 2.83Å; R744-D1165 VanDerWaalsContact CZ-CG 3.46Å; R744-D1165 IonicContact CZ-OD1 2.74Å; R744-D1165 IonicContact CZ-OD2 2.7Å; R744-D1165 IonicContact NH1-OD1 3.35Å; R744-D1165 PolarHBondContact NH1-OD1 3Å; R744-D1165 IonicContact NH1-OD2 3.25Å; R744-D1165 PolarHBondContact NH1-OD2 3.22Å; R744-D1165 IonicContact NH2-OD1 2.78Å; R744-D1165 PolarHBondContact NH2-OD1 3.36Å; R744-D1165 IonicContact NH2-OD2 2.83Å; R744-D1165 PolarHBondContact NH2-OD2 2.91Å
745	F	85.1	Confident	84.3	Confident	44 Å²	44	28 Å²	28	19%	0.193	14%	0.135	C	C	.	.	H	α-helix	trans	-62.9	-58	177.8	-169.4	-88.4	0	0	0	109.8	D741 S742 R747 T748 E749 P784 L785 L788	D741-F745 WeakPolarHBondContact O-CB 3.3Å; D741-F745 PolarHBondContact O-N 3.21Å; S742-F745 PolarHBondContact O-N 3.02Å; F745-R747 VanDerWaalsContact C-N 3.27Å; F745-R747 PolarHBondContact O-N 2.94Å; F745-T748 WeakPolarHBondContact O-CA 3.41Å; F745-T748 PolarHBondContact O-N 3.45Å; F745-E749 HydrophobicContact CD1-CG 3.74Å; F745-E749 HydrophobicContact CE1-CG 3.42Å; F745-E749 VanDerWaalsContact CE1-CG 3.42Å; F745-E749 HydrophobicContact CG-CG 4.46Å; F745-E749 HydrophobicContact CZ-CG 3.91Å; F745-E749 WeakPolarHBondContact O-CG 3.39Å; F745-E749 PolarHBondContact O-N 3.5Å; F745-P784 HydrophobicContact CE1-CB 3.81Å; F745-P784 HydrophobicContact CZ-CB 3.63Å; F745-L785 HydrophobicContact CB-CD1 4.18Å; F745-L785 HydrophobicContact CD1-CB 3.91Å; F745-L785 HydrophobicContact CD1-CD1 3.71Å; F745-L785 HydrophobicContact CD1-CG 4.41Å; F745-L785 HydrophobicContact CE1-CB 3.93Å; F745-L785 HydrophobicContact CE1-CD1 4.42Å; F745-L785 HydrophobicContact CG-CD1 4.09Å; F745-L788 HydrophobicContact CD2-CD1 3.74Å; F745-L788 HydrophobicContact CE2-CD1 4.06Å; F745-L788 HydrophobicContact CG-CD1 4.38Å
746	I	87.6	Confident	83.8	Confident	0 Å²	0	29.4 Å²	29.4	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-58	-37.6	176.7	-67.6	-67.2	0	0	0	111.9	I668 S742 T748 M750 L778 S781 L782 L785	I668-I746 HydrophobicContact CG1-CG1 4.07Å; S742-I746 WeakPolarHBondContact O-CB 3.29Å; S742-I746 WeakPolarHBondContact O-CG1 3.42Å; S742-I746 PolarHBondContact O-N 2.91Å; I746-T748 VanDerWaalsContact C-N 3.27Å; I746-T748 PolarHBondContact O-N 3.16Å; I746-M750 HydrophobicContact CG2-CG 3.8Å; I746-M750 WeakPolarHBondContact O-CB 3.38Å; I746-M750 WeakPolarHBondContact O-CG 3.49Å; I746-M750 PolarHBondContact O-N 3.43Å; I746-L778 HydrophobicContact CG2-CD1 4.43Å; I746-S781 WeakPolarHBondContact CD1-O 3.24Å; I746-L782 HydrophobicContact CD1-CD2 4.02Å; I746-L782 HydrophobicContact CD1-CG 4.35Å; I746-L785 HydrophobicContact CD1-CB 4.27Å; I746-L785 HydrophobicContact CD1-CD2 3.96Å; I746-L785 HydrophobicContact CG1-CD2 3.94Å
747	R	87.3	Confident	83.2	Confident	55 Å²	55	30.6 Å²	30.6	21%	0.208	15%	0.152	C	C	.	.	H	α-helix	trans	-54.5	-44.7	171.5	177.8	-173	-168.7	-96.9	0.5	111.7	S674 D683 T687 A743 F745 V751	S674-R747 WeakPolarHBondContact OG-CD 3.24Å; S674-R747 VanDerWaalsContact OG-CG 3.25Å; S674-R747 WeakPolarHBondContact OG-CG 3.09Å; S674-R747 PolarHBondContact OG-NE 3.44Å; D683-R747 VanDerWaalsContact CG-NH2 3.32Å; D683-R747 IonicContact OD1-CZ 2.67Å; D683-R747 VanDerWaalsContact OD1-CZ 3.31Å; D683-R747 IonicContact OD1-NE 2.72Å; D683-R747 PolarHBondContact OD1-NE 3.39Å; D683-R747 IonicContact OD1-NH2 3.72Å; D683-R747 PolarHBondContact OD1-NH2 2.95Å; D683-R747 IonicContact OD2-CZ 2.71Å; D683-R747 IonicContact OD2-NH2 2.78Å; D683-R747 PolarHBondContact OD2-NH2 3.31Å; T687-R747 PolarHBondContact OG1-NE 2.86Å; A743-R747 VanDerWaalsContact O-CB 3.22Å; A743-R747 WeakPolarHBondContact O-CB 3.22Å; A743-R747 PolarHBondContact O-N 2.82Å; F745-R747 VanDerWaalsContact C-N 3.27Å; F745-R747 PolarHBondContact O-N 2.94Å; R747-V751 WeakPolarHBondContact O-CB 3.3Å; R747-V751 WeakPolarHBondContact O-CG2 3.38Å; R747-V751 PolarHBondContact O-N 2.88Å; R747-V751 VanDerWaalsContact O-N 3.12Å
748	T	80.3	Confident	83.1	Confident	15 Å²	15	30.4 Å²	30.4	9%	0.092	15%	0.147	C	C	.	.	H	α-helix	trans	-73.9	-53.4	-174.9	-49.8	0	0	0	0	111.3	R744 F745 I746 M750 V751 E752 R1168	R744-T748 PolarHBondContact O-N 3.31Å; R744-T748 VanDerWaalsContact O-N 3.11Å; R744-T748 PolarHBondContact O-OG1 2.83Å; F745-T748 WeakPolarHBondContact O-CA 3.41Å; F745-T748 PolarHBondContact O-N 3.45Å; I746-T748 VanDerWaalsContact C-N 3.27Å; I746-T748 PolarHBondContact O-N 3.16Å; T748-M750 VanDerWaalsContact C-N 3.28Å; T748-M750 PolarHBondContact O-N 2.86Å; T748-V751 PolarHBondContact O-N 2.85Å; T748-E752 PolarHBondContact O-N 2.89Å; T748-R1168 VanDerWaalsContact CG2-NH2 3.32Å
749	E	81.9	Confident	83	Confident	40 Å²	40	30.9 Å²	30.9	19%	0.187	15%	0.149	C	C	.	.	H	α-helix	trans	-60.8	-38	180	-47.6	-54.4	104.4	0	0	111.5	F745 E752 V753 S781	F745-E749 HydrophobicContact CD1-CG 3.74Å; F745-E749 HydrophobicContact CE1-CG 3.42Å; F745-E749 VanDerWaalsContact CE1-CG 3.42Å; F745-E749 HydrophobicContact CG-CG 4.46Å; F745-E749 HydrophobicContact CZ-CG 3.91Å; F745-E749 WeakPolarHBondContact O-CG 3.39Å; F745-E749 PolarHBondContact O-N 3.5Å; E749-E752 PolarHBondContact O-N 3.47Å; E749-V753 WeakPolarHBondContact O-CB 3.43Å; E749-V753 VanDerWaalsContact O-CG2 3.29Å; E749-V753 WeakPolarHBondContact O-CG2 3.37Å; E749-V753 PolarHBondContact O-N 2.87Å; E749-S781 VanDerWaalsContact CB-CB 3.48Å
750	M	84.3	Confident	82.5	Confident	0 Å²	0	34.5 Å²	34.5	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-66.6	-34.8	173.5	-77	-73.1	-54.8	0	0	113.1	T672 A675 I746 T748 E752 L754 A773 L778 S781	T672-M750 HydrophobicContact CG2-CE 4.2Å; A675-M750 HydrophobicContact CB-CB 3.31Å; A675-M750 HydrophobicContact CB-CG 4.31Å; I746-M750 HydrophobicContact CG2-CG 3.8Å; I746-M750 WeakPolarHBondContact O-CB 3.38Å; I746-M750 WeakPolarHBondContact O-CG 3.49Å; I746-M750 PolarHBondContact O-N 3.43Å; T748-M750 VanDerWaalsContact C-N 3.28Å; T748-M750 PolarHBondContact O-N 2.86Å; M750-E752 VanDerWaalsContact C-N 3.34Å; M750-L754 HydrophobicContact CE-CD1 4.11Å; M750-L754 HydrophobicContact CE-CG 4.34Å; M750-L754 WeakPolarHBondContact O-CB 3.38Å; M750-L754 WeakPolarHBondContact O-CD1 3.42Å; M750-L754 WeakPolarHBondContact O-CG 3.22Å; M750-L754 PolarHBondContact O-N 3.27Å; M750-A773 HydrophobicContact CE-CB 3.93Å; M750-L778 HydrophobicContact SD-CB 4.31Å; M750-L778 PolarHBondContact SD-N 2.59Å; M750-L778 VanDerWaalsContact SD-N 3.41Å; M750-S781 WeakPolarHBondContact CG-OG 3.47Å; M750-S781 PolarHBondContact SD-OG 2.79Å
751	V	80	Confident	82.3	Confident	8 Å²	8	35.7 Å²	35.7	5%	0.048	17%	0.172	C	C	.	.	H	α-helix	trans	-68.5	-37.4	176.2	165.3	0	0	0	0	110.4	A675 Q678 R747 T748 H755 K1174	A675-V751 HydrophobicContact CB-CG2 3.78Å; Q678-V751 HydrophobicContact CG-CG2 4.21Å; R747-V751 WeakPolarHBondContact O-CB 3.3Å; R747-V751 WeakPolarHBondContact O-CG2 3.38Å; R747-V751 PolarHBondContact O-N 2.88Å; R747-V751 VanDerWaalsContact O-N 3.12Å; T748-V751 PolarHBondContact O-N 2.85Å; V751-H755 PolarHBondContact O-ND1 3.45Å; V751-K1174 HydrophobicContact CG1-CD 4.46Å
752	E	73.8	Confident	82.4	Confident	131 Å²	131	34.7 Å²	34.7	61%	0.612	17%	0.167	S	C	*	.	H	α-helix	trans	-67.1	-52.8	176.2	-164.1	166	149.1	0	0	111	T748 E749 M750 L754 H755 S756	T748-E752 PolarHBondContact O-N 2.89Å; E749-E752 PolarHBondContact O-N 3.47Å; M750-E752 VanDerWaalsContact C-N 3.34Å; E752-L754 VanDerWaalsContact C-N 3.26Å; E752-L754 PolarHBondContact O-N 2.65Å; E752-H755 PolarHBondContact O-N 2.67Å; E752-S756 PolarHBondContact O-N 2.89Å
753	V	79.2	Confident	82.4	Confident	18 Å²	18	38.3 Å²	38.3	11%	0.109	18%	0.181	C	C	.	.	H	α-helix	trans	-60.4	-31.4	176.4	172.4	0	0	0	0	112.8	E749 H755 S756 Y758 V759 N780	E749-V753 WeakPolarHBondContact O-CB 3.43Å; E749-V753 VanDerWaalsContact O-CG2 3.29Å; E749-V753 WeakPolarHBondContact O-CG2 3.37Å; E749-V753 PolarHBondContact O-N 2.87Å; V753-H755 PolarHBondContact O-N 3.45Å; V753-S756 PolarHBondContact O-N 2.98Å; V753-S756 PolarHBondContact O-OG 3.37Å; V753-Y758 HydrophobicContact CG1-CE2 3.88Å; V753-Y758 WeakPolarHBondContact CG1-OH 3.25Å; V753-V759 HydrophobicContact CG1-CG2 4.38Å; V753-V759 WeakPolarHBondContact O-CG2 3.43Å; V753-N780 HydrophobicContact CG1-CB 4.33Å; V753-N780 HydrophobicContact CG2-CB 3.95Å
754	L	81.4	Confident	82.1	Confident	34 Å²	34	38.9 Å²	38.9	18%	0.178	19%	0.185	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.1	-1.6	177.2	-77.4	170.4	0	0	0	114.5	A675 M676 M750 E752 V759 I772	A675-L754 HydrophobicContact CB-CD1 4.44Å; M676-L754 HydrophobicContact CG-CD1 4.48Å; M750-L754 HydrophobicContact CE-CD1 4.11Å; M750-L754 HydrophobicContact CE-CG 4.34Å; M750-L754 WeakPolarHBondContact O-CB 3.38Å; M750-L754 WeakPolarHBondContact O-CD1 3.42Å; M750-L754 WeakPolarHBondContact O-CG 3.22Å; M750-L754 PolarHBondContact O-N 3.27Å; E752-L754 VanDerWaalsContact C-N 3.26Å; E752-L754 PolarHBondContact O-N 2.65Å; L754-V759 HydrophobicContact CD2-CG1 4.39Å; L754-I772 HydrophobicContact CD2-CG2 4.3Å
755	H	77.6	Confident	82.2	Confident	100 Å²	100	38 Å²	38	46%	0.463	18%	0.182	S	C	.	.	T	Hydrogen-bonded Turn	trans	-122.8	7.1	173.5	-60	93.2	0	0	0	113.8	V751 E752 V753	V751-H755 PolarHBondContact O-ND1 3.45Å; E752-H755 PolarHBondContact O-N 2.67Å; V753-H755 PolarHBondContact O-N 3.45Å
756	S	78.5	Confident	82.2	Confident	30 Å²	30	35.9 Å²	35.9	21%	0.21	17%	0.173	C	C	.	.	S	Bend	trans	-81.3	149.3	172.9	55.2	0	0	0	0	111.6	E752 V753 Y758 V759 E760	E752-S756 PolarHBondContact O-N 2.89Å; V753-S756 PolarHBondContact O-N 2.98Å; V753-S756 PolarHBondContact O-OG 3.37Å; S756-Y758 VanDerWaalsContact C-N 3.26Å; S756-Y758 PolarHBondContact O-N 3.17Å; S756-Y758 VanDerWaalsContact O-N 3.09Å; S756-Y758 WeakPolarHBondContact OG-CE1 3.5Å; S756-V759 WeakPolarHBondContact O-CA 3.23Å; S756-V759 WeakPolarHBondContact O-CB 3.31Å; S756-V759 PolarHBondContact O-N 2.74Å; S756-E760 PolarHBondContact O-N 2.96Å
757	D	75.1	Confident	82.2	Confident	59 Å²	59	36 Å²	36	32%	0.316	17%	0.174	S	C	.	.	H	α-helix	trans	-58.9	-31.3	-168.7	-46.1	-27.9	0	0	0	113.5	V759 E760 L761 T1218	D757-V759 PolarHBondContact O-N 2.92Å; D757-E760 CarbonylContact O-C 3.39Å; D757-E760 WeakPolarHBondContact O-CA 3.22Å; D757-E760 WeakPolarHBondContact O-CB 3.48Å; D757-E760 PolarHBondContact O-N 2.85Å; D757-L761 PolarHBondContact O-N 2.79Å; D757-T1218 WeakPolarHBondContact OD2-CB 3.09Å; D757-T1218 PolarHBondContact OD2-OG1 3.19Å
758	Y	83	Confident	82.1	Confident	24 Å²	24	34.8 Å²	34.8	9%	0.094	17%	0.174	C	C	.	.	H	α-helix	trans	-63.3	-22.7	172.1	63.9	-100.6	0	0	0	114.9	V753 S756 A762 H776 T1218 S1219 D1221	V753-Y758 HydrophobicContact CG1-CE2 3.88Å; V753-Y758 WeakPolarHBondContact CG1-OH 3.25Å; S756-Y758 VanDerWaalsContact C-N 3.26Å; S756-Y758 PolarHBondContact O-N 3.17Å; S756-Y758 VanDerWaalsContact O-N 3.09Å; S756-Y758 WeakPolarHBondContact OG-CE1 3.5Å; Y758-A762 VanDerWaalsContact O-CB 3.23Å; Y758-A762 WeakPolarHBondContact O-CB 3.3Å; Y758-A762 PolarHBondContact O-N 2.94Å; Y758-H776 HydrophobicContact CD2-CB 4.1Å; Y758-H776 HydrophobicContact CE2-CB 4.05Å; Y758-T1218 WeakPolarHBondContact CD1-O 3.45Å; Y758-T1218 PolarHBondContact N-O 2.83Å; Y758-S1219 VanDerWaalsContact CA-O 3.25Å; Y758-S1219 WeakPolarHBondContact CA-O 3.15Å; Y758-S1219 WeakPolarHBondContact CB-O 3.07Å; Y758-D1221 HydrophobicContact CD2-CB 3.97Å; Y758-D1221 HydrophobicContact CE2-CB 4.49Å; Y758-D1221 HydrophobicContact CG-CB 4.26Å
759	V	84.1	Confident	82.1	Confident	9 Å²	9	41 Å²	41	6%	0.055	20%	0.195	C	C	.	.	H	α-helix	trans	-79.5	-33.9	169.4	159.9	0	0	0	0	111.6	V753 L754 S756 D757 A762 R763 I772 H776	V753-V759 HydrophobicContact CG1-CG2 4.38Å; V753-V759 WeakPolarHBondContact O-CG2 3.43Å; L754-V759 HydrophobicContact CD2-CG1 4.39Å; S756-V759 WeakPolarHBondContact O-CA 3.23Å; S756-V759 WeakPolarHBondContact O-CB 3.31Å; S756-V759 PolarHBondContact O-N 2.74Å; D757-V759 PolarHBondContact O-N 2.92Å; V759-A762 PolarHBondContact O-N 2.91Å; V759-R763 WeakPolarHBondContact O-CB 3.14Å; V759-R763 PolarHBondContact O-N 3.24Å; V759-I772 HydrophobicContact CB-CG2 4.23Å; V759-I772 HydrophobicContact CG1-CG2 3.72Å; V759-I772 HydrophobicContact CG2-CG2 3.79Å; V759-H776 HydrophobicContact CG2-CB 4.27Å
760	E	81.7	Confident	82.2	Confident	89 Å²	89	45 Å²	45	42%	0.416	21%	0.209	S	C	.	.	H	α-helix	trans	-64.8	-46.1	170.7	-60.6	-104.8	113.8	0	0	110.2	S756 D757 A762 R763 A764 F1213	S756-E760 PolarHBondContact O-N 2.96Å; D757-E760 CarbonylContact O-C 3.39Å; D757-E760 WeakPolarHBondContact O-CA 3.22Å; D757-E760 WeakPolarHBondContact O-CB 3.48Å; D757-E760 PolarHBondContact O-N 2.85Å; E760-A762 PolarHBondContact O-N 2.95Å; E760-R763 CarbonylContact O-C 3.59Å; E760-R763 WeakPolarHBondContact O-CA 3.43Å; E760-R763 WeakPolarHBondContact O-CB 3.05Å; E760-R763 PolarHBondContact O-N 3.23Å; E760-R763 VanDerWaalsContact O-N 3.08Å; E760-A764 WeakPolarHBondContact O-CB 3.2Å; E760-A764 PolarHBondContact O-N 2.7Å; E760-F1213 HydrophobicContact CB-CE1 3.54Å; E760-F1213 HydrophobicContact CB-CZ 3.69Å
761	L	84.2	Confident	82.2	Confident	27 Å²	27	47.3 Å²	47.3	14%	0.141	22%	0.22	C	C	.	.	H	α-helix	trans	-60.6	-43.4	172.6	-176.1	69	0	0	0	111.5	D757 R763 A764 K765 F1213 S1219 L1220	D757-L761 PolarHBondContact O-N 2.79Å; L761-R763 PolarHBondContact O-N 2.97Å; L761-A764 CarbonylContact O-C 3.59Å; L761-A764 WeakPolarHBondContact O-CA 3.48Å; L761-A764 WeakPolarHBondContact O-CB 3.23Å; L761-A764 PolarHBondContact O-N 2.85Å; L761-A764 VanDerWaalsContact O-N 3.12Å; L761-K765 WeakPolarHBondContact O-CG 3.39Å; L761-K765 PolarHBondContact O-N 3.01Å; L761-F1213 HydrophobicContact CB-CD2 4.38Å; L761-F1213 HydrophobicContact CB-CE2 3.94Å; L761-F1213 HydrophobicContact CB-CZ 4.47Å; L761-F1213 HydrophobicContact CD1-CD2 3.97Å; L761-F1213 HydrophobicContact CD1-CE2 3.75Å; L761-F1213 HydrophobicContact CG-CE2 4.47Å; L761-S1219 WeakPolarHBondContact CD2-O 3.16Å; L761-L1220 HydrophobicContact CD2-CD2 4.04Å
762	A	86.5	Confident	82.4	Confident	1 Å²	1	47.2 Å²	47.2	1%	0.008	22%	0.219	C	C	.	.	H	α-helix	trans	-60	-33.3	174.7	0	0	0	0	0	112.7	Y758 V759 E760 L767 I772 H776	Y758-A762 VanDerWaalsContact O-CB 3.23Å; Y758-A762 WeakPolarHBondContact O-CB 3.3Å; Y758-A762 PolarHBondContact O-N 2.94Å; V759-A762 PolarHBondContact O-N 2.91Å; E760-A762 PolarHBondContact O-N 2.95Å; A762-L767 HydrophobicContact CB-CD1 4.2Å; A762-L767 VanDerWaalsContact O-CB 3.32Å; A762-L767 WeakPolarHBondContact O-CB 3.16Å; A762-L767 WeakPolarHBondContact O-CG 3.43Å; A762-L767 PolarHBondContact O-N 2.71Å; A762-I772 HydrophobicContact CB-CD1 4.31Å; A762-I772 HydrophobicContact CB-CG1 4.03Å; A762-H776 VanDerWaalsContact CB-CD2 3.46Å; A762-H776 WeakPolarHBondContact CB-CD2 3.48Å
763	R	85.4	Confident	82.8	Confident	77 Å²	77	41 Å²	41	29%	0.291	19%	0.19	S	C	.	.	H	α-helix	trans	-76.3	-34.6	174	-161.7	177.1	-174.3	-163	-3.6	112.1	V759 E760 L761 K765 G766 I772 E1198 R1205	V759-R763 WeakPolarHBondContact O-CB 3.14Å; V759-R763 PolarHBondContact O-N 3.24Å; E760-R763 CarbonylContact O-C 3.59Å; E760-R763 WeakPolarHBondContact O-CA 3.43Å; E760-R763 WeakPolarHBondContact O-CB 3.05Å; E760-R763 PolarHBondContact O-N 3.23Å; E760-R763 VanDerWaalsContact O-N 3.08Å; L761-R763 PolarHBondContact O-N 2.97Å; R763-K765 VanDerWaalsContact C-N 3.33Å; R763-G766 WeakPolarHBondContact O-CA 3.44Å; R763-G766 PolarHBondContact O-N 3.34Å; R763-I772 HydrophobicContact CB-CD1 3.99Å; R763-I772 HydrophobicContact CG-CD1 4.4Å; R763-E1198 IonicContact CZ-OE1 3.56Å; R763-E1198 IonicContact NE-OE1 3.81Å; R763-E1198 PolarHBondContact NE-OE1 3.18Å; R763-E1198 IonicContact NH2-OE1 3.96Å; R763-E1198 PolarHBondContact NH2-OE1 2.73Å; R763-E1198 IonicContact NH2-OE2 2.74Å; R763-R1205 WeakPolarHBondContact O-CD 3.22Å
764	A	83.5	Confident	83	Confident	14 Å²	14	45.8 Å²	45.8	12%	0.116	21%	0.209	C	C	.	.	H	α-helix	trans	-68.6	-27.3	170.9	0	0	0	0	0	112.8	E760 L761 G766 R1205 G1206 M1211 F1213	E760-A764 WeakPolarHBondContact O-CB 3.2Å; E760-A764 PolarHBondContact O-N 2.7Å; L761-A764 CarbonylContact O-C 3.59Å; L761-A764 WeakPolarHBondContact O-CA 3.48Å; L761-A764 WeakPolarHBondContact O-CB 3.23Å; L761-A764 PolarHBondContact O-N 2.85Å; L761-A764 VanDerWaalsContact O-N 3.12Å; A764-G766 PolarHBondContact O-N 2.85Å; A764-R1205 CarbonylContact O-C 3.57Å; A764-R1205 WeakPolarHBondContact O-CB 3.38Å; A764-G1206 WeakPolarHBondContact O-CA 3.35Å; A764-G1206 PolarHBondContact O-N 3.31Å; A764-M1211 HydrophobicContact CB-CB 4.04Å; A764-F1213 HydrophobicContact CB-CE2 4.3Å; A764-F1213 HydrophobicContact CB-CZ 4.49Å
765	K	86.6	Confident	83	Confident	22 Å²	22	48.2 Å²	48.2	10%	0.096	22%	0.216	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.6	-3.7	165.7	-66.9	173.7	-167.1	173.8	0	113.3	L761 R763 R1205 Q1229 E1232 H1237	L761-K765 WeakPolarHBondContact O-CG 3.39Å; L761-K765 PolarHBondContact O-N 3.01Å; R763-K765 VanDerWaalsContact C-N 3.33Å; K765-R1205 CarbonylContact C-O 3.38Å; K765-Q1229 PolarHBondContact NZ-O 3.19Å; K765-E1232 HydrophobicContact CD-CB 4.49Å; K765-E1232 HydrophobicContact CD-CG 4.5Å; K765-E1232 IonicContact NZ-OE2 3.72Å; K765-H1237 PolarHBondContact O-NE2 3.49Å
766	G	83.9	Confident	83.3	Confident	0 Å²	0	43.5 Å²	43.5	0%	0	19%	0.194	C	C	.	.	T	Hydrogen-bonded Turn	trans	79.2	19.8	178.9	0	0	0	0	0	115	R763 A764 Q1202 R1205 K1236	R763-G766 WeakPolarHBondContact O-CA 3.44Å; R763-G766 PolarHBondContact O-N 3.34Å; A764-G766 PolarHBondContact O-N 2.85Å; G766-Q1202 WeakPolarHBondContact O-CG 3.19Å; G766-R1205 WeakPolarHBondContact CA-O 3.32Å; G766-R1205 PolarHBondContact N-O 3.11Å; G766-K1236 WeakPolarHBondContact O-CE 3.29Å
767	L	88.2	Confident	83.5	Confident	4 Å²	4	42.1 Å²	42.1	2%	0.021	19%	0.185	C	C	.	.			trans	-69.5	149.6	172	-62.4	-176	0	0	0	112	A762 E771 I772 E1232 K1236	A762-L767 HydrophobicContact CB-CD1 4.2Å; A762-L767 VanDerWaalsContact O-CB 3.32Å; A762-L767 WeakPolarHBondContact O-CB 3.16Å; A762-L767 WeakPolarHBondContact O-CG 3.43Å; A762-L767 PolarHBondContact O-N 2.71Å; L767-E771 HydrophobicContact CB-CB 4.26Å; L767-E771 HydrophobicContact CD2-CB 4.46Å; L767-I772 HydrophobicContact CB-CD1 4.11Å; L767-I772 HydrophobicContact CB-CG1 3.62Å; L767-I772 HydrophobicContact CD1-CG1 4.28Å; L767-E1232 HydrophobicContact CD1-CG 4.06Å; L767-E1232 HydrophobicContact CD2-CG 4.26Å; L767-K1236 HydrophobicContact CD2-CB 4.34Å; L767-K1236 HydrophobicContact CD2-CD 3.92Å; L767-K1236 HydrophobicContact CD2-CG 4.07Å
768	S	86	Confident	83.9	Confident	28 Å²	28	40.5 Å²	40.5	20%	0.196	18%	0.176	C	C	.	.			trans	-79.5	154.4	171.2	72.2	0	0	0	0	111.3	W770 E771 I772	S768-W770 PolarHBondContact O-N 3.12Å; S768-E771 WeakPolarHBondContact CB-OE2 3.35Å; S768-E771 PolarHBondContact N-OE2 2.74Å; S768-E771 PolarHBondContact O-N 3.44Å; S768-E771 PolarHBondContact OG-OE2 2.95Å; S768-I772 WeakPolarHBondContact O-CG1 3.24Å; S768-I772 PolarHBondContact O-N 2.78Å
769	R	79.8	Confident	83.7	Confident	145 Å²	145	44.7 Å²	44.7	55%	0.547	19%	0.192	S	C	.	.	H	α-helix	trans	-52.9	-28.4	179.5	-66.5	-171.5	-179.5	-154.9	-2.7	114.3	M676 A773 E1198	M676-R769 HydrophobicContact CE-CB 4.4Å; M676-R769 WeakPolarHBondContact CE-O 3.29Å; R769-A773 WeakPolarHBondContact O-CB 3.42Å; R769-A773 PolarHBondContact O-N 3.03Å; R769-E1198 IonicContact NE-OE1 2.74Å
770	W	83.5	Confident	83.4	Confident	126 Å²	126	44.6 Å²	44.6	48%	0.477	19%	0.191	S	C	.	.	H	α-helix	trans	-77	-38.6	175.1	-76	108.7	0	0	0	113.4	M676 S768 F774	M676-W770 HydrophobicContact CE-CB 4.42Å; M676-W770 HydrophobicContact CE-CD2 3.46Å; M676-W770 VanDerWaalsContact CE-CD2 3.46Å; M676-W770 HydrophobicContact CE-CE3 3.48Å; M676-W770 VanDerWaalsContact CE-CE3 3.48Å; M676-W770 HydrophobicContact CE-CG 3.88Å; M676-W770 HydrophobicContact CE-CH2 4.39Å; M676-W770 HydrophobicContact CE-CZ2 4.37Å; M676-W770 HydrophobicContact CE-CZ3 3.96Å; M676-W770 HydrophobicContact SD-CD2 4.1Å; M676-W770 HydrophobicContact SD-CE3 3.47Å; M676-W770 HydrophobicContact SD-CH2 4.05Å; M676-W770 HydrophobicContact SD-CZ3 3.44Å; M676-W770 WeakPolarHBondContact SD-CZ3 3.49Å; S768-W770 PolarHBondContact O-N 3.12Å; W770-F774 HydrophobicContact CE3-CD2 4.1Å; W770-F774 AromaticContact CE3-CE2 3.59Å; W770-F774 HydrophobicContact CE3-CE2 3.59Å; W770-F774 AromaticContact CZ3-CE2 3.85Å; W770-F774 HydrophobicContact CZ3-CE2 3.85Å; W770-F774 HydrophobicContact CZ3-CZ 4.42Å; W770-F774 WeakPolarHBondContact O-CD2 3.48Å; W770-F774 PolarHBondContact O-N 2.92Å; W770-F774 VanDerWaalsContact O-N 3.15Å
771	E	83.7	Confident	83.3	Confident	48 Å²	48	40.4 Å²	40.4	22%	0.224	17%	0.171	C	C	.	.	H	α-helix	trans	-63.9	-45.8	173.5	-70.3	158.9	112.2	0	0	110.3	L767 S768 F774 R775 K1236	L767-E771 HydrophobicContact CB-CB 4.26Å; L767-E771 HydrophobicContact CD2-CB 4.46Å; S768-E771 WeakPolarHBondContact CB-OE2 3.35Å; S768-E771 PolarHBondContact N-OE2 2.74Å; S768-E771 PolarHBondContact O-N 3.44Å; S768-E771 PolarHBondContact OG-OE2 2.95Å; E771-F774 PolarHBondContact O-N 3.08Å; E771-R775 WeakPolarHBondContact O-CB 3.37Å; E771-R775 WeakPolarHBondContact O-CG 3.49Å; E771-R775 PolarHBondContact O-N 2.92Å; E771-K1236 IonicContact OE1-NZ 2.75Å; E771-K1236 PolarHBondContact OE1-NZ 2.88Å; E771-K1236 IonicContact OE2-NZ 3.28Å; E771-K1236 PolarHBondContact OE2-NZ 3.27Å
772	I	85.1	Confident	83.1	Confident	5 Å²	5	41.9 Å²	41.9	3%	0.026	18%	0.179	C	C	.	.	H	α-helix	trans	-58.6	-52.5	176.8	-64	175.1	0	0	0	110.9	L754 V759 A762 R763 L767 S768 F774 R775 H776 G777	L754-I772 HydrophobicContact CD2-CG2 4.3Å; V759-I772 HydrophobicContact CB-CG2 4.23Å; V759-I772 HydrophobicContact CG1-CG2 3.72Å; V759-I772 HydrophobicContact CG2-CG2 3.79Å; A762-I772 HydrophobicContact CB-CD1 4.31Å; A762-I772 HydrophobicContact CB-CG1 4.03Å; R763-I772 HydrophobicContact CB-CD1 3.99Å; R763-I772 HydrophobicContact CG-CD1 4.4Å; L767-I772 HydrophobicContact CB-CD1 4.11Å; L767-I772 HydrophobicContact CB-CG1 3.62Å; L767-I772 HydrophobicContact CD1-CG1 4.28Å; S768-I772 WeakPolarHBondContact O-CG1 3.24Å; S768-I772 PolarHBondContact O-N 2.78Å; I772-F774 VanDerWaalsContact C-N 3.3Å; I772-F774 PolarHBondContact O-N 3.49Å; I772-R775 PolarHBondContact O-N 2.77Å; I772-H776 PolarHBondContact O-N 3.31Å; I772-G777 PolarHBondContact O-N 3.24Å
773	A	82.7	Confident	82.4	Confident	0 Å²	0	42.6 Å²	42.6	0%	0	18%	0.183	C	C	.	.	I	π-helix	trans	-63.8	-31.1	-176.7	0	0	0	0	0	113.5	M676 M750 R769 G777 L778	M676-A773 HydrophobicContact CE-CB 3.68Å; M676-A773 HydrophobicContact CG-CB 3.8Å; M676-A773 HydrophobicContact SD-CB 3.38Å; M676-A773 WeakPolarHBondContact SD-CB 3.27Å; M750-A773 HydrophobicContact CE-CB 3.93Å; R769-A773 WeakPolarHBondContact O-CB 3.42Å; R769-A773 PolarHBondContact O-N 3.03Å; A773-G777 CarbonylContact O-C 3.38Å; A773-G777 WeakPolarHBondContact O-CA 3.21Å; A773-L778 WeakPolarHBondContact O-CB 3.49Å; A773-L778 PolarHBondContact O-N 3.12Å
774	F	83.4	Confident	81.6	Confident	119 Å²	119	41.2 Å²	41.2	52%	0.522	18%	0.184	S	C	.	.	I	π-helix	trans	-89.6	-29.5	177.2	-82.2	-64.5	0	0	0	114.6	W770 E771 I772 L778	W770-F774 HydrophobicContact CE3-CD2 4.1Å; W770-F774 AromaticContact CE3-CE2 3.59Å; W770-F774 HydrophobicContact CE3-CE2 3.59Å; W770-F774 AromaticContact CZ3-CE2 3.85Å; W770-F774 HydrophobicContact CZ3-CE2 3.85Å; W770-F774 HydrophobicContact CZ3-CZ 4.42Å; W770-F774 WeakPolarHBondContact O-CD2 3.48Å; W770-F774 PolarHBondContact O-N 2.92Å; W770-F774 VanDerWaalsContact O-N 3.15Å; E771-F774 PolarHBondContact O-N 3.08Å; I772-F774 VanDerWaalsContact C-N 3.3Å; I772-F774 PolarHBondContact O-N 3.49Å; F774-L778 HydrophobicContact CD1-CD2 3.75Å; F774-L778 HydrophobicContact CE1-CD2 3.8Å
775	R	81.6	Confident	81.4	Confident	85 Å²	85	40.7 Å²	40.7	32%	0.321	18%	0.179	S	C	.	.	I	π-helix	trans	-83.2	-56.7	178.6	-67.9	-175.2	-172.5	178.3	8.7	112.2	E771 I772 E1232	E771-R775 WeakPolarHBondContact O-CB 3.37Å; E771-R775 WeakPolarHBondContact O-CG 3.49Å; E771-R775 PolarHBondContact O-N 2.92Å; I772-R775 PolarHBondContact O-N 2.77Å; R775-E1232 WeakPolarHBondContact CD-OE1 3.32Å; R775-E1232 IonicContact CZ-OE1 3.58Å; R775-E1232 IonicContact NE-OE1 2.69Å; R775-E1232 IonicContact NH1-OE1 3.61Å; R775-E1232 PolarHBondContact NH1-OE1 2.92Å
776	H	84	Confident	80.5	Confident	2 Å²	2	42 Å²	42	1%	0.009	19%	0.186	C	C	.	.	I	π-helix	trans	-94.5	-43	-174.5	-48.4	-59.6	0	0	0	111.6	Y758 V759 A762 I772 N780 D1221 M1224 E1232	Y758-H776 HydrophobicContact CD2-CB 4.1Å; Y758-H776 HydrophobicContact CE2-CB 4.05Å; V759-H776 HydrophobicContact CG2-CB 4.27Å; A762-H776 VanDerWaalsContact CB-CD2 3.46Å; A762-H776 WeakPolarHBondContact CB-CD2 3.48Å; I772-H776 PolarHBondContact O-N 3.31Å; H776-N780 WeakPolarHBondContact O-CB 3.46Å; H776-N780 PolarHBondContact O-ND2 2.97Å; H776-D1221 WeakPolarHBondContact CA-OD2 3.27Å; H776-D1221 IonicContact CE1-OD2 3.69Å; H776-D1221 IonicContact CG-OD2 3.25Å; H776-D1221 IonicContact ND1-OD2 2.74Å; H776-D1221 PolarHBondContact ND1-OD2 2.99Å; H776-M1224 VanDerWaalsContact CE1-SD 3.51Å; H776-M1224 PolarHBondContact ND1-SD 3.03Å; H776-E1232 IonicContact CE1-OE1 3.27Å; H776-E1232 IonicContact CE1-OE2 2.91Å; H776-E1232 PolarHBondContact CE1-OE2 3.34Å; H776-E1232 VanDerWaalsContact CE1-OE2 3.3Å; H776-E1232 IonicContact NE2-OE1 2.59Å; H776-E1232 IonicContact NE2-OE2 3.75Å; H776-E1232 PolarHBondContact NE2-OE2 2.87Å
777	G	81.7	Confident	79.7	Confident	0 Å²	0	45.5 Å²	45.5	0%	0	21%	0.207	C	C	.	.	I	π-helix	trans	-63.1	-68.5	-175.9	0	0	0	0	0	114.4	I772 A773 R779 N780 S781	I772-G777 PolarHBondContact O-N 3.24Å; A773-G777 CarbonylContact O-C 3.38Å; A773-G777 WeakPolarHBondContact O-CA 3.21Å; G777-R779 VanDerWaalsContact C-N 3.31Å; G777-R779 PolarHBondContact O-N 3.11Å; G777-N780 PolarHBondContact O-N 3.44Å; G777-S781 PolarHBondContact O-N 3.38Å; G777-S781 VanDerWaalsContact O-N 3.11Å; G777-S781 PolarHBondContact O-OG 2.75Å
778	L	83.3	Confident	78.8	Confident	26 Å²	26	48 Å²	48	14%	0.136	22%	0.22	C	C	.	.	H	α-helix	trans	-66.7	-33.3	-166.5	-176	57.9	0	0	0	112.6	I668 I746 M750 A773 F774 S781 L782	I668-L778 HydrophobicContact CG2-CD1 3.84Å; I746-L778 HydrophobicContact CG2-CD1 4.43Å; M750-L778 HydrophobicContact SD-CB 4.31Å; M750-L778 PolarHBondContact SD-N 2.59Å; M750-L778 VanDerWaalsContact SD-N 3.41Å; A773-L778 WeakPolarHBondContact O-CB 3.49Å; A773-L778 PolarHBondContact O-N 3.12Å; F774-L778 HydrophobicContact CD1-CD2 3.75Å; F774-L778 HydrophobicContact CE1-CD2 3.8Å; L778-S781 WeakPolarHBondContact CA-OG 3.38Å; L778-S781 PolarHBondContact O-OG 3.37Å; L778-L782 HydrophobicContact CD1-CD1 4.05Å; L778-L782 HydrophobicContact CD1-CG 3.99Å; L778-L782 HydrophobicContact CG-CD1 3.85Å; L778-L782 HydrophobicContact CG-CG 4.28Å; L778-L782 WeakPolarHBondContact O-CB 3.46Å; L778-L782 WeakPolarHBondContact O-CD1 3.29Å; L778-L782 WeakPolarHBondContact O-CG 3.3Å; L778-L782 PolarHBondContact O-N 2.9Å
779	R	79.2	Confident	78.1	Confident	112 Å²	112	48 Å²	48	42%	0.423	22%	0.218	S	C	.	.	H	α-helix	trans	-70.8	-42.9	179.8	-170.5	172.9	174.8	-143.8	-10.9	112.3	G777 T1223	G777-R779 VanDerWaalsContact C-N 3.31Å; G777-R779 PolarHBondContact O-N 3.11Å; R779-T1223 PolarHBondContact NH1-O 2.69Å
780	N	76.8	Confident	77.5	Confident	7 Å²	7	41.2 Å²	41.2	4%	0.037	19%	0.193	C	C	.	.	H	α-helix	trans	-64.2	-43.2	175.5	-82	-73.5	0	0	0	111.5	V753 H776 G777 L782 I783 P784 R856 D1221 T1223	V753-N780 HydrophobicContact CG1-CB 4.33Å; V753-N780 HydrophobicContact CG2-CB 3.95Å; H776-N780 WeakPolarHBondContact O-CB 3.46Å; H776-N780 PolarHBondContact O-ND2 2.97Å; G777-N780 PolarHBondContact O-N 3.44Å; N780-L782 PolarHBondContact O-N 2.81Å; N780-I783 PolarHBondContact O-N 2.98Å; N780-P784 VanDerWaalsContact O-CD 3.22Å; N780-P784 WeakPolarHBondContact O-CD 3.41Å; N780-R856 PolarHBondContact OD1-NH2 2.93Å; N780-D1221 PolarHBondContact ND2-OD1 3.1Å; N780-T1223 WeakPolarHBondContact OD1-CG2 3.36Å
781	S	81	Confident	76.6	Confident	1 Å²	1	38.5 Å²	38.5	1%	0.007	19%	0.192	C	C	.	.	H	α-helix	trans	-73.8	-21	-179.9	50.9	0	0	0	0	115.5	I746 E749 M750 G777 L778	I746-S781 WeakPolarHBondContact CD1-O 3.24Å; E749-S781 VanDerWaalsContact CB-CB 3.48Å; M750-S781 WeakPolarHBondContact CG-OG 3.47Å; M750-S781 PolarHBondContact SD-OG 2.79Å; G777-S781 PolarHBondContact O-N 3.38Å; G777-S781 VanDerWaalsContact O-N 3.11Å; G777-S781 PolarHBondContact O-OG 2.75Å; L778-S781 WeakPolarHBondContact CA-OG 3.38Å; L778-S781 PolarHBondContact O-OG 3.37Å
782	L	79.9	Confident	76.1	Confident	58 Å²	58	37.2 Å²	37.2	30%	0.304	19%	0.186	S	C	.	.	H	α-helix	trans	-75.5	-26.3	174.9	-80.9	169.9	0	0	0	113.6	I668 I746 L778 N780 L785 M786	I668-L782 HydrophobicContact CD1-CD2 3.78Å; I668-L782 HydrophobicContact CG1-CD2 4.08Å; I668-L782 HydrophobicContact CG2-CD2 4.39Å; I746-L782 HydrophobicContact CD1-CD2 4.02Å; I746-L782 HydrophobicContact CD1-CG 4.35Å; L778-L782 HydrophobicContact CD1-CD1 4.05Å; L778-L782 HydrophobicContact CD1-CG 3.99Å; L778-L782 HydrophobicContact CG-CD1 3.85Å; L778-L782 HydrophobicContact CG-CG 4.28Å; L778-L782 WeakPolarHBondContact O-CB 3.46Å; L778-L782 WeakPolarHBondContact O-CD1 3.29Å; L778-L782 WeakPolarHBondContact O-CG 3.3Å; L778-L782 PolarHBondContact O-N 2.9Å; N780-L782 PolarHBondContact O-N 2.81Å; L782-L785 HydrophobicContact CD2-CD2 4Å; L782-L785 PolarHBondContact O-N 2.64Å; L782-M786 PolarHBondContact O-N 2.77Å
783	I	71.7	Confident	75.4	Confident	16 Å²	16	37.6 Å²	37.6	8%	0.082	19%	0.19	C	C	.	.	H	α-helix	trans	-61.8	-50.8	-177.6	-67	165.4	0	0	0	110.9	N780 L785 M786 Y850 V853 D854 T1223	N780-I783 PolarHBondContact O-N 2.98Å; I783-L785 VanDerWaalsContact C-N 3.3Å; I783-L785 PolarHBondContact O-N 3.46Å; I783-M786 PolarHBondContact O-N 2.97Å; I783-Y850 HydrophobicContact CG2-CE2 3.96Å; I783-V853 HydrophobicContact CG1-CG1 4.28Å; I783-D854 HydrophobicContact CG2-CB 4.03Å; I783-T1223 HydrophobicContact CD1-CG2 3.89Å
784	P	67.4	Low	74.5	Confident	48 Å²	48	37.9 Å²	37.9	31%	0.312	19%	0.192	S	C	.	.	H	α-helix	trans	-66.7	-26.1	175.5	-23.2	36.4	0	0	0	114.2	F745 N780 M786 T787	F745-P784 HydrophobicContact CE1-CB 3.81Å; F745-P784 HydrophobicContact CZ-CB 3.63Å; N780-P784 VanDerWaalsContact O-CD 3.22Å; N780-P784 WeakPolarHBondContact O-CD 3.41Å; P784-M786 PolarHBondContact O-N 2.77Å; P784-T787 PolarHBondContact O-N 3.21Å
785	L	79.8	Confident	73.7	Confident	2 Å²	2	35 Å²	35	1%	0.01	19%	0.191	C	C	.	.	H	α-helix	trans	-65.1	-38.4	179.3	-178.6	68.2	0	0	0	111.6	T664 I668 F745 I746 L782 I783 T787 L788 L789	T664-L785 HydrophobicContact CG2-CD2 4.23Å; I668-L785 HydrophobicContact CD1-CD2 4.03Å; I668-L785 HydrophobicContact CG1-CD2 3.83Å; F745-L785 HydrophobicContact CB-CD1 4.18Å; F745-L785 HydrophobicContact CD1-CB 3.91Å; F745-L785 HydrophobicContact CD1-CD1 3.71Å; F745-L785 HydrophobicContact CD1-CG 4.41Å; F745-L785 HydrophobicContact CE1-CB 3.93Å; F745-L785 HydrophobicContact CE1-CD1 4.42Å; F745-L785 HydrophobicContact CG-CD1 4.09Å; I746-L785 HydrophobicContact CD1-CB 4.27Å; I746-L785 HydrophobicContact CD1-CD2 3.96Å; I746-L785 HydrophobicContact CG1-CD2 3.94Å; L782-L785 HydrophobicContact CD2-CD2 4Å; L782-L785 PolarHBondContact O-N 2.64Å; I783-L785 VanDerWaalsContact C-N 3.3Å; I783-L785 PolarHBondContact O-N 3.46Å; L785-T787 PolarHBondContact O-N 2.89Å; L785-L788 WeakPolarHBondContact O-CA 3.39Å; L785-L788 WeakPolarHBondContact O-CB 3.12Å; L785-L788 PolarHBondContact O-N 3.27Å; L785-L789 HydrophobicContact CG-CD1 4.41Å; L785-L789 HydrophobicContact CG-CG 4.26Å; L785-L789 WeakPolarHBondContact O-CG 3.48Å; L785-L789 PolarHBondContact O-N 3.37Å; L785-L789 VanDerWaalsContact O-N 3.12Å
786	M	69	Low	73.2	Confident	51 Å²	51	31.3 Å²	31.3	25%	0.251	18%	0.177	S	C	.	.	H	α-helix	trans	-55.1	-39.4	-179.9	-69.1	-121.1	66.2	0	0	112.4	L17 L782 I783 P784 L788 L789	L17-M786 HydrophobicContact CD2-CE 4.29Å; L782-M786 PolarHBondContact O-N 2.77Å; I783-M786 PolarHBondContact O-N 2.97Å; P784-M786 PolarHBondContact O-N 2.77Å; M786-L788 VanDerWaalsContact C-N 3.28Å; M786-L788 PolarHBondContact O-N 3.11Å; M786-L789 HydrophobicContact CE-CD1 4.47Å; M786-L789 PolarHBondContact O-N 3.32Å
787	T	65.9	Low	72.5	Confident	73 Å²	73	31.8 Å²	31.8	45%	0.448	18%	0.179	S	C	.	.	H	α-helix	trans	-63.7	-31.1	176.9	-52.8	0	0	0	0	112.7	P784 L785 P791	P784-T787 PolarHBondContact O-N 3.21Å; L785-T787 PolarHBondContact O-N 2.89Å; T787-P791 VanDerWaalsContact O-CD 3.29Å; T787-P791 WeakPolarHBondContact O-CD 3.36Å
788	L	69.4	Low	71.5	Confident	56 Å²	56	33.2 Å²	33.2	29%	0.293	19%	0.188	S	C	.	.	H	α-helix	trans	-78.4	-34.5	177.1	-171.8	148.6	0	0	0	112.2	F745 L785 M786 G790 L792	F745-L788 HydrophobicContact CD2-CD1 3.74Å; F745-L788 HydrophobicContact CE2-CD1 4.06Å; F745-L788 HydrophobicContact CG-CD1 4.38Å; L785-L788 WeakPolarHBondContact O-CA 3.39Å; L785-L788 WeakPolarHBondContact O-CB 3.12Å; L785-L788 PolarHBondContact O-N 3.27Å; M786-L788 VanDerWaalsContact C-N 3.28Å; M786-L788 PolarHBondContact O-N 3.11Å; L788-G790 VanDerWaalsContact C-N 3.34Å; L788-G790 PolarHBondContact O-N 2.92Å; L788-L792 HydrophobicContact CD2-CB 4.38Å; L788-L792 HydrophobicContact CD2-CD1 4.15Å; L788-L792 VanDerWaalsContact O-CB 3.26Å; L788-L792 WeakPolarHBondContact O-CB 3.34Å; L788-L792 PolarHBondContact O-N 2.57Å
789	L	71.9	Confident	70.4	Confident	27 Å²	27	33 Å²	33	14%	0.141	19%	0.193	C	C	.	.	H	α-helix	trans	-64.3	-32	-176.6	-65.4	177.7	0	0	0	114	T664 L785 M786 L792 A793	T664-L789 HydrophobicContact CG2-CD1 3.99Å; T664-L789 HydrophobicContact CG2-CD2 3.68Å; T664-L789 HydrophobicContact CG2-CG 4.47Å; T664-L789 WeakPolarHBondContact OG1-CD2 3.46Å; L785-L789 HydrophobicContact CG-CD1 4.41Å; L785-L789 HydrophobicContact CG-CG 4.26Å; L785-L789 WeakPolarHBondContact O-CG 3.48Å; L785-L789 PolarHBondContact O-N 3.37Å; L785-L789 VanDerWaalsContact O-N 3.12Å; M786-L789 HydrophobicContact CE-CD1 4.47Å; M786-L789 PolarHBondContact O-N 3.32Å; L789-L792 HydrophobicContact CD2-CD2 4.46Å; L789-L792 PolarHBondContact O-N 3.35Å; L789-A793 WeakPolarHBondContact O-CB 3.42Å; L789-A793 PolarHBondContact O-N 3.41Å
790	G	66.4	Low	70	Confident	3 Å²	3	27.7 Å²	27.7	3%	0.031	17%	0.173	C	C	.	.	H	α-helix	trans	-60.9	-62.7	179.5	0	0	0	0	0	113.5	L788 L792 A793 V842	L788-G790 VanDerWaalsContact C-N 3.34Å; L788-G790 PolarHBondContact O-N 2.92Å; G790-L792 PolarHBondContact O-N 3.44Å; G790-A793 PolarHBondContact O-N 3.39Å; G790-V842 VanDerWaalsContact O-CG1 3.32Å; G790-V842 WeakPolarHBondContact O-CG1 3.4Å
791	P	65.5	Low	69.7	Low	69 Å²	69	27.5 Å²	27.5	45%	0.448	17%	0.171	S	C	.	.	H	α-helix	trans	-57.5	-37.7	174.2	-25.7	35.4	0	0	0	112.8	T787 A793 V794 A795	T787-P791 VanDerWaalsContact O-CD 3.29Å; T787-P791 WeakPolarHBondContact O-CD 3.36Å; P791-A793 PolarHBondContact O-N 3.45Å; P791-V794 PolarHBondContact O-N 3.29Å; P791-A795 WeakPolarHBondContact O-CB 3.45Å; P791-A795 PolarHBondContact O-N 2.98Å
792	L	71.9	Confident	69.1	Low	21 Å²	21	27.7 Å²	27.7	11%	0.11	17%	0.172	C	C	.	.	H	α-helix	trans	-64.2	-39.7	179.4	-166.6	101.5	0	0	0	112.5	P738 D741 L788 L789 G790 V794 A795 L796	P738-L792 HydrophobicContact CB-CD2 3.67Å; D741-L792 HydrophobicContact CB-CD1 4.48Å; L788-L792 HydrophobicContact CD2-CB 4.38Å; L788-L792 HydrophobicContact CD2-CD1 4.15Å; L788-L792 VanDerWaalsContact O-CB 3.26Å; L788-L792 WeakPolarHBondContact O-CB 3.34Å; L788-L792 PolarHBondContact O-N 2.57Å; L789-L792 HydrophobicContact CD2-CD2 4.46Å; L789-L792 PolarHBondContact O-N 3.35Å; G790-L792 PolarHBondContact O-N 3.44Å; L792-V794 VanDerWaalsContact C-N 3.28Å; L792-V794 PolarHBondContact O-N 3.49Å; L792-A795 PolarHBondContact O-N 3.32Å; L792-L796 HydrophobicContact CD2-CD1 3.86Å; L792-L796 HydrophobicContact CG-CD1 4.08Å; L792-L796 WeakPolarHBondContact O-CB 3.4Å; L792-L796 WeakPolarHBondContact O-CD1 3.38Å; L792-L796 WeakPolarHBondContact O-CG 3.44Å; L792-L796 PolarHBondContact O-N 2.94Å
793	A	70.2	Confident	69.2	Low	13 Å²	13	24.9 Å²	24.9	11%	0.107	16%	0.158	C	C	.	.	H	α-helix	trans	-58.7	-41	177.6	0	0	0	0	0	112.4	I660 L789 G790 P791 L796 M797 V842	I660-A793 HydrophobicContact CD1-CB 3.39Å; I660-A793 HydrophobicContact CG1-CB 4.18Å; L789-A793 WeakPolarHBondContact O-CB 3.42Å; L789-A793 PolarHBondContact O-N 3.41Å; G790-A793 PolarHBondContact O-N 3.39Å; P791-A793 PolarHBondContact O-N 3.45Å; A793-L796 PolarHBondContact O-N 3.42Å; A793-M797 WeakPolarHBondContact O-CG 3.43Å; A793-M797 PolarHBondContact O-N 3.2Å; A793-M797 VanDerWaalsContact O-N 3.16Å; A793-V842 HydrophobicContact CB-CG1 4.48Å
794	V	64.4	Low	69.8	Low	6 Å²	6	24.1 Å²	24.1	4%	0.036	15%	0.154	C	C	.	.	H	α-helix	trans	-78.2	-36.6	179.5	-170.9	0	0	0	0	110.9	P791 L792 L796 M797 T798 L839 V842	P791-V794 PolarHBondContact O-N 3.29Å; L792-V794 VanDerWaalsContact C-N 3.28Å; L792-V794 PolarHBondContact O-N 3.49Å; V794-L796 PolarHBondContact O-N 2.89Å; V794-M797 PolarHBondContact O-N 2.89Å; V794-T798 PolarHBondContact O-N 3.44Å; V794-T798 PolarHBondContact O-OG1 3.3Å; V794-L839 HydrophobicContact CB-CD1 3.94Å; V794-L839 HydrophobicContact CG1-CB 3.87Å; V794-L839 HydrophobicContact CG1-CD1 3.84Å; V794-L839 HydrophobicContact CG1-CG 4.36Å; V794-L839 HydrophobicContact CG2-CD1 3.99Å; V794-V842 HydrophobicContact CG2-CB 3.8Å; V794-V842 HydrophobicContact CG2-CG1 3.96Å; V794-V842 HydrophobicContact CG2-CG2 4.06Å
795	A	66.4	Low	70.4	Confident	60 Å²	60	24.7 Å²	24.7	50%	0.496	16%	0.155	S	C	.	.	H	α-helix	trans	-59.6	-35.9	170.4	0	0	0	0	0	111.6	P791 L792 T798 G799	P791-A795 WeakPolarHBondContact O-CB 3.45Å; P791-A795 PolarHBondContact O-N 2.98Å; L792-A795 PolarHBondContact O-N 3.32Å; A795-T798 CarbonylContact O-C 3.58Å; A795-T798 PolarHBondContact O-N 3.06Å; A795-G799 PolarHBondContact O-N 3.36Å
796	L	72.6	Confident	70.4	Confident	6 Å²	6	25 Å²	25	3%	0.031	16%	0.156	C	C	.	.	H	α-helix	trans	-70	-39.6	174.5	-80.7	157.3	0	0	0	113	I660 L734 P738 L792 A793 V794 T798 G799 S800	I660-L796 HydrophobicContact CG1-CD1 3.53Å; L734-L796 HydrophobicContact CB-CD2 4.19Å; L734-L796 VanDerWaalsContact O-CD2 3.25Å; L734-L796 WeakPolarHBondContact O-CD2 3.29Å; P738-L796 HydrophobicContact CB-CD1 4.12Å; P738-L796 HydrophobicContact CG-CD1 3.69Å; P738-L796 HydrophobicContact CG-CD2 4.27Å; L792-L796 HydrophobicContact CD2-CD1 3.86Å; L792-L796 HydrophobicContact CG-CD1 4.08Å; L792-L796 WeakPolarHBondContact O-CB 3.4Å; L792-L796 WeakPolarHBondContact O-CD1 3.38Å; L792-L796 WeakPolarHBondContact O-CG 3.44Å; L792-L796 PolarHBondContact O-N 2.94Å; A793-L796 PolarHBondContact O-N 3.42Å; V794-L796 PolarHBondContact O-N 2.89Å; L796-T798 PolarHBondContact O-N 3.12Å; L796-G799 CarbonylContact O-C 3.41Å; L796-G799 PolarHBondContact O-N 3.34Å; L796-S800 PolarHBondContact O-N 2.95Å
797	M	67.5	Low	71.3	Confident	13 Å²	13	22.7 Å²	22.7	6%	0.064	14%	0.144	C	C	.	.	H	α-helix	trans	-66.9	-21.6	171	-66.9	175.1	175.1	0	0	113.5	L653 A793 V794 S800 Y835 M838	L653-M797 HydrophobicContact CD1-CE 3.51Å; A793-M797 WeakPolarHBondContact O-CG 3.43Å; A793-M797 PolarHBondContact O-N 3.2Å; A793-M797 VanDerWaalsContact O-N 3.16Å; V794-M797 PolarHBondContact O-N 2.89Å; M797-S800 PolarHBondContact O-OG 3.47Å; M797-S800 VanDerWaalsContact O-OG 3.11Å; M797-Y835 HydrophobicContact CB-CE1 4.18Å; M797-Y835 VanDerWaalsContact O-CE1 3.24Å; M797-Y835 WeakPolarHBondContact O-CE1 3.49Å; M797-Y835 PolarHBondContact O-OH 3.03Å; M797-M838 HydrophobicContact CE-CE 3.92Å; M797-M838 HydrophobicContact SD-CE 3.47Å; M797-M838 WeakPolarHBondContact SD-CE 3.43Å
798	T	61.1	Low	72.1	Confident	29 Å²	29	21.7 Å²	21.7	18%	0.178	14%	0.144	C	C	.	.	H	α-helix	trans	-91.9	-23.6	173	-43.9	0	0	0	0	111.4	V794 A795 L796 L801 P1022	V794-T798 PolarHBondContact O-N 3.44Å; V794-T798 PolarHBondContact O-OG1 3.3Å; A795-T798 CarbonylContact O-C 3.58Å; A795-T798 PolarHBondContact O-N 3.06Å; L796-T798 PolarHBondContact O-N 3.12Å; T798-L801 HydrophobicContact CG2-CD1 4.3Å; T798-L801 WeakPolarHBondContact O-CD1 3.33Å; T798-L801 WeakPolarHBondContact O-CG 3.49Å; T798-P1022 HydrophobicContact CG2-CB 4.33Å
799	G	61.6	Low	72.8	Confident	23 Å²	23	19 Å²	19	24%	0.237	13%	0.13	C	C	.	.	H	α-helix	trans	-80.3	-22.7	171.9	0	0	0	0	0	112.9	A795 L796 L801	A795-G799 PolarHBondContact O-N 3.36Å; L796-G799 CarbonylContact O-C 3.41Å; L796-G799 PolarHBondContact O-N 3.34Å; G799-L801 PolarHBondContact O-N 3.12Å
800	S	69.9	Low	73.3	Confident	0 Å²	0	20.2 Å²	20.2	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-62.8	-22.3	177.6	75.8	0	0	0	0	112.9	L796 M797 V802 V803 E804	L796-S800 PolarHBondContact O-N 2.95Å; M797-S800 PolarHBondContact O-OG 3.47Å; M797-S800 VanDerWaalsContact O-OG 3.11Å; S800-V802 PolarHBondContact O-N 3.15Å; S800-V802 VanDerWaalsContact O-N 3.14Å; S800-V803 PolarHBondContact O-N 2.74Å; S800-V803 VanDerWaalsContact O-N 3.11Å; S800-E804 VanDerWaalsContact CB-OE1 3.27Å; S800-E804 WeakPolarHBondContact CB-OE1 3.25Å; S800-E804 VanDerWaalsContact O-CB 3.31Å; S800-E804 WeakPolarHBondContact O-CB 3.39Å; S800-E804 VanDerWaalsContact O-CG 3.27Å; S800-E804 WeakPolarHBondContact O-CG 3.41Å; S800-E804 PolarHBondContact O-N 3.41Å; S800-E804 PolarHBondContact OG-OE1 2.76Å
801	L	70.1	Confident	74.2	Confident	2 Å²	2	20.1 Å²	20.1	1%	0.01	14%	0.138	C	C	.	.	H	α-helix	trans	-50.1	-43.3	179.9	-46.6	161.3	0	0	0	113.3	T798 G799 N805 F816 Y835 L1024	T798-L801 HydrophobicContact CG2-CD1 4.3Å; T798-L801 WeakPolarHBondContact O-CD1 3.33Å; T798-L801 WeakPolarHBondContact O-CG 3.49Å; G799-L801 PolarHBondContact O-N 3.12Å; L801-N805 WeakPolarHBondContact O-CB 3.07Å; L801-N805 PolarHBondContact O-N 3.27Å; L801-F816 HydrophobicContact CD2-CB 4.41Å; L801-F816 HydrophobicContact CD2-CD1 4.49Å; L801-Y835 HydrophobicContact CD2-CE2 4.16Å; L801-Y835 VanDerWaalsContact CD2-OH 3.26Å; L801-Y835 WeakPolarHBondContact CD2-OH 3.39Å; L801-L1024 HydrophobicContact CD1-CD1 4.24Å; L801-L1024 HydrophobicContact CD1-CD2 3.42Å; L801-L1024 VanDerWaalsContact CD1-CD2 3.42Å; L801-L1024 HydrophobicContact CD1-CG 4.37Å
802	V	69.6	Low	75	Confident	5 Å²	5	17 Å²	17	3%	0.03	12%	0.117	C	C	.	.	H	α-helix	trans	-75.5	-42	-177.5	-139.1	0	0	0	0	111.2	F699 S800 N805 I806 F1113 F1116 I1117	F699-V802 HydrophobicContact CB-CB 4.07Å; F699-V802 HydrophobicContact CB-CG1 3.65Å; F699-V802 HydrophobicContact CG-CG1 4.31Å; S800-V802 PolarHBondContact O-N 3.15Å; S800-V802 VanDerWaalsContact O-N 3.14Å; V802-N805 PolarHBondContact O-N 3.31Å; V802-I806 HydrophobicContact CG1-CD1 4.22Å; V802-I806 WeakPolarHBondContact O-CB 3.47Å; V802-I806 WeakPolarHBondContact O-CD1 3.29Å; V802-I806 VanDerWaalsContact O-CG1 3.28Å; V802-I806 WeakPolarHBondContact O-CG1 3.39Å; V802-I806 PolarHBondContact O-N 2.94Å; V802-F1113 HydrophobicContact CB-CD2 4.47Å; V802-F1113 HydrophobicContact CB-CE2 4.04Å; V802-F1113 HydrophobicContact CG1-CD2 3.86Å; V802-F1113 HydrophobicContact CG1-CE2 3.7Å; V802-F1113 HydrophobicContact CG2-CD2 3.76Å; V802-F1113 HydrophobicContact CG2-CE1 4.29Å; V802-F1113 HydrophobicContact CG2-CE2 3.26Å; V802-F1113 HydrophobicContact CG2-CZ 3.57Å; V802-F1116 HydrophobicContact CG1-CD1 4.1Å; V802-F1116 HydrophobicContact CG1-CE1 4.13Å; V802-I1117 HydrophobicContact CG1-CG2 3.99Å
803	V	81	Confident	75.2	Confident	0 Å²	0	16 Å²	16	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-68.1	-42.6	-179.3	-179.6	0	0	0	0	109.8	P730 A733 L734 S800 N805 I806 F807	P730-V803 HydrophobicContact CB-CG1 3.82Å; A733-V803 HydrophobicContact CB-CG1 4.27Å; A733-V803 HydrophobicContact CB-CG2 4.4Å; L734-V803 HydrophobicContact CD1-CB 4.48Å; L734-V803 HydrophobicContact CD1-CG1 4.45Å; L734-V803 HydrophobicContact CD2-CB 4.28Å; L734-V803 HydrophobicContact CD2-CG2 3.7Å; L734-V803 HydrophobicContact CG-CB 4.27Å; L734-V803 HydrophobicContact CG-CG1 4.3Å; L734-V803 HydrophobicContact CG-CG2 3.98Å; S800-V803 PolarHBondContact O-N 2.74Å; S800-V803 VanDerWaalsContact O-N 3.11Å; V803-N805 VanDerWaalsContact C-N 3.33Å; V803-N805 PolarHBondContact O-N 3.36Å; V803-I806 PolarHBondContact O-N 2.96Å; V803-F807 HydrophobicContact CG1-CD2 3.63Å; V803-F807 HydrophobicContact CG1-CE2 3.88Å; V803-F807 WeakPolarHBondContact O-CB 3.46Å; V803-F807 WeakPolarHBondContact O-CD2 3.18Å; V803-F807 PolarHBondContact O-N 3.04Å
804	E	84.7	Confident	75.7	Confident	0 Å²	0	16.4 Å²	16.4	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-59.5	-41.4	172.9	-71.8	171.9	-150.9	0	0	111.9	S652 L655 S800 A808 I809 G811 I812 G813	S652-E804 WeakPolarHBondContact CA-OE1 3.22Å; S652-E804 VanDerWaalsContact CB-OE1 3.22Å; S652-E804 WeakPolarHBondContact CB-OE1 3.4Å; S652-E804 PolarHBondContact OG-OE1 2.82Å; S652-E804 PolarHBondContact OG-OE2 2.76Å; S652-E804 VanDerWaalsContact OG-OE2 3.12Å; L655-E804 HydrophobicContact CD1-CG 4.16Å; S800-E804 VanDerWaalsContact CB-OE1 3.27Å; S800-E804 WeakPolarHBondContact CB-OE1 3.25Å; S800-E804 VanDerWaalsContact O-CB 3.31Å; S800-E804 WeakPolarHBondContact O-CB 3.39Å; S800-E804 VanDerWaalsContact O-CG 3.27Å; S800-E804 WeakPolarHBondContact O-CG 3.41Å; S800-E804 PolarHBondContact O-N 3.41Å; S800-E804 PolarHBondContact OG-OE1 2.76Å; E804-A808 CarbonylContact O-C 3.46Å; E804-A808 WeakPolarHBondContact O-CA 3.31Å; E804-A808 PolarHBondContact O-N 2.81Å; E804-I809 HydrophobicContact CB-CB 4.12Å; E804-I809 HydrophobicContact CG-CB 4.14Å; E804-I809 HydrophobicContact CG-CG2 4.28Å; E804-I809 PolarHBondContact O-N 3.15Å; E804-G811 VanDerWaalsContact OE2-C 3.29Å; E804-G811 WeakPolarHBondContact OE2-CA 3.27Å; E804-I812 PolarHBondContact OE2-N 3.17Å; E804-G813 WeakPolarHBondContact OE2-CA 3.38Å; E804-G813 PolarHBondContact OE2-N 3.22Å
805	N	79.2	Confident	76.5	Confident	60 Å²	60	16.2 Å²	16.2	32%	0.321	11%	0.11	S	C	.	.	H	α-helix	trans	-67.2	-45.4	176.1	-163.7	28.5	0	0	0	111.9	L801 V802 V803 F807 A808	L801-N805 WeakPolarHBondContact O-CB 3.07Å; L801-N805 PolarHBondContact O-N 3.27Å; V802-N805 PolarHBondContact O-N 3.31Å; V803-N805 VanDerWaalsContact C-N 3.33Å; V803-N805 PolarHBondContact O-N 3.36Å; N805-F807 PolarHBondContact O-N 2.91Å; N805-A808 PolarHBondContact O-N 3.49Å
806	I	81.1	Confident	77.1	Confident	7 Å²	7	13.4 Å²	13.4	4%	0.036	9%	0.087	C	C	.	.	H	α-helix	trans	-64.6	-38.3	180	-73.8	164.2	0	0	0	112.5	F699 A702 V703 Q706 V802 V803 F1116	F699-I806 HydrophobicContact CB-CD1 3.73Å; A702-I806 HydrophobicContact CB-CD1 4.2Å; A702-I806 HydrophobicContact CB-CG2 4.11Å; V703-I806 HydrophobicContact CG2-CD1 4.16Å; V703-I806 HydrophobicContact CG2-CG1 4.48Å; V703-I806 HydrophobicContact CG2-CG2 4Å; Q706-I806 PolarHBondContact NE2-O 2.84Å; Q706-I806 VanDerWaalsContact OE1-CG2 3.27Å; V802-I806 HydrophobicContact CG1-CD1 4.22Å; V802-I806 WeakPolarHBondContact O-CB 3.47Å; V802-I806 WeakPolarHBondContact O-CD1 3.29Å; V802-I806 VanDerWaalsContact O-CG1 3.28Å; V802-I806 WeakPolarHBondContact O-CG1 3.39Å; V802-I806 PolarHBondContact O-N 2.94Å; V803-I806 PolarHBondContact O-N 2.96Å; I806-F1116 HydrophobicContact CD1-CE1 3.88Å; I806-F1116 HydrophobicContact CD1-CZ 4.13Å; I806-F1116 HydrophobicContact CG1-CE1 4.21Å; I806-F1116 HydrophobicContact CG1-CZ 4.38Å
807	F	86.5	Confident	77.2	Confident	3 Å²	3	13.8 Å²	13.8	1%	0.013	9%	0.089	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.7	7	177.5	-73.9	-89.8	0	0	0	113.2	A702 Q706 I718 A719 K720 L729 P730 V803 N805 I809	A702-F807 HydrophobicContact CB-CE2 3.75Å; Q706-F807 HydrophobicContact CG-CD1 4.08Å; Q706-F807 HydrophobicContact CG-CE1 3.46Å; Q706-F807 VanDerWaalsContact CG-CE1 3.46Å; Q706-F807 HydrophobicContact CG-CE2 4.47Å; Q706-F807 HydrophobicContact CG-CZ 3.7Å; I718-F807 WeakPolarHBondContact O-CD1 3.38Å; A719-F807 CarbonylContact C-O 3.54Å; A719-F807 WeakPolarHBondContact CA-O 3.34Å; A719-F807 VanDerWaalsContact CB-O 3.26Å; A719-F807 WeakPolarHBondContact CB-O 3.18Å; K720-F807 PolarHBondContact N-O 2.67Å; L729-F807 HydrophobicContact CB-CE1 3.49Å; L729-F807 VanDerWaalsContact CB-CE1 3.49Å; L729-F807 HydrophobicContact CB-CZ 3.59Å; L729-F807 HydrophobicContact CD1-CE1 4.22Å; P730-F807 HydrophobicContact CB-CD2 4.33Å; P730-F807 HydrophobicContact CG-CB 4.12Å; P730-F807 HydrophobicContact CG-CD1 3.79Å; P730-F807 HydrophobicContact CG-CD2 3.91Å; P730-F807 HydrophobicContact CG-CE1 4.15Å; P730-F807 HydrophobicContact CG-CE2 4.21Å; P730-F807 HydrophobicContact CG-CG 3.69Å; P730-F807 HydrophobicContact CG-CZ 4.35Å; V803-F807 HydrophobicContact CG1-CD2 3.63Å; V803-F807 HydrophobicContact CG1-CE2 3.88Å; V803-F807 WeakPolarHBondContact O-CB 3.46Å; V803-F807 WeakPolarHBondContact O-CD2 3.18Å; V803-F807 PolarHBondContact O-N 3.04Å; N805-F807 PolarHBondContact O-N 2.91Å; F807-I809 VanDerWaalsContact C-N 3.28Å; F807-I809 HydrophobicContact CB-CD1 3.73Å; F807-I809 HydrophobicContact CB-CG1 3.71Å; F807-I809 PolarHBondContact O-N 3.31Å
808	A	82.5	Confident	77.6	Confident	52 Å²	52	17.4 Å²	17.4	43%	0.43	11%	0.105	S	C	.	.	T	Hydrogen-bonded Turn	trans	46.6	47.6	-176.6	0	0	0	0	0	113.8	A719 E804 N805	A719-A808 HydrophobicContact CB-CB 4.29Å; E804-A808 CarbonylContact O-C 3.46Å; E804-A808 WeakPolarHBondContact O-CA 3.31Å; E804-A808 PolarHBondContact O-N 2.81Å; N805-A808 PolarHBondContact O-N 3.49Å
809	I	85.3	Confident	78.5	Confident	0 Å²	0	16 Å²	16	0%	0	10%	0.097	C	C	.	.			trans	-88.2	131.4	-179.6	-57.5	179	0	0	0	108.5	P651 L655 W721 P730 E804 F807 G811 E814	P651-I809 HydrophobicContact CB-CG2 3.83Å; L655-I809 HydrophobicContact CD1-CD1 3.67Å; L655-I809 HydrophobicContact CD1-CG2 4.38Å; W721-I809 HydrophobicContact CD2-CG2 4.08Å; W721-I809 HydrophobicContact CE3-CB 4.48Å; W721-I809 HydrophobicContact CE3-CD1 4.19Å; W721-I809 HydrophobicContact CE3-CG1 4.28Å; W721-I809 HydrophobicContact CE3-CG2 3.5Å; W721-I809 HydrophobicContact CZ3-CD1 4.21Å; W721-I809 HydrophobicContact CZ3-CG2 3.94Å; P730-I809 HydrophobicContact CB-CD1 3.9Å; P730-I809 HydrophobicContact CG-CD1 3.6Å; E804-I809 HydrophobicContact CB-CB 4.12Å; E804-I809 HydrophobicContact CG-CB 4.14Å; E804-I809 HydrophobicContact CG-CG2 4.28Å; E804-I809 PolarHBondContact O-N 3.15Å; F807-I809 VanDerWaalsContact C-N 3.28Å; F807-I809 HydrophobicContact CB-CD1 3.73Å; F807-I809 HydrophobicContact CB-CG1 3.71Å; F807-I809 PolarHBondContact O-N 3.31Å; I809-G811 PolarHBondContact O-N 3.42Å; I809-E814 WeakPolarHBondContact O-CB 3.33Å
810	P	83	Confident	79	Confident	53 Å²	53	15.3 Å²	15.3	34%	0.344	9%	0.087	S	C	.	.			trans	-79.3	54.8	-179.3	35.1	-36.4	0	0	0	111.4	R648 W721	R648-P810 WeakPolarHBondContact CG-O 3.29Å; R648-P810 VanDerWaalsContact NH1-C 3.3Å; W721-P810 HydrophobicContact CB-CG 4.08Å
811	G	85.1	Confident	79	Confident	0 Å²	0	20.8 Å²	20.8	0%	0	11%	0.114	C	C	.	.	S	Bend	trans	-91	-173.4	176.4	0	0	0	0	0	113.2	R648 S652 E804 I809 G813	R648-G811 WeakPolarHBondContact CD-O 3.3Å; R648-G811 PolarHBondContact NH1-O 3.24Å; R648-G811 CarbonylContact O-C 3.59Å; R648-G811 WeakPolarHBondContact O-CA 3.37Å; S652-G811 WeakPolarHBondContact OG-CA 3.43Å; E804-G811 VanDerWaalsContact OE2-C 3.29Å; E804-G811 WeakPolarHBondContact OE2-CA 3.27Å; I809-G811 PolarHBondContact O-N 3.42Å; G811-G813 PolarHBondContact O-N 3.21Å
812	I	80.7	Confident	79.1	Confident	4 Å²	4	22.7 Å²	22.7	2%	0.021	13%	0.126	C	C	.	.	H	α-helix	trans	-64.2	-33.4	174.4	-69.9	166.5	0	0	0	110.3	R648 I649 S652 E804 Q815 F816 V831 L834 Y835	R648-I812 HydrophobicContact CB-CG1 4.39Å; R648-I812 PolarHBondContact O-N 3.44Å; I649-I812 HydrophobicContact CB-CD1 3.91Å; I649-I812 HydrophobicContact CB-CG1 4.48Å; I649-I812 HydrophobicContact CG1-CD1 3.89Å; S652-I812 PolarHBondContact OG-N 2.88Å; E804-I812 PolarHBondContact OE2-N 3.17Å; I812-Q815 WeakPolarHBondContact O-CB 3.45Å; I812-Q815 PolarHBondContact O-N 2.93Å; I812-F816 PolarHBondContact O-N 3.13Å; I812-V831 HydrophobicContact CG2-CG1 3.63Å; I812-V831 HydrophobicContact CG2-CG2 4.18Å; I812-L834 HydrophobicContact CD1-CD2 3.62Å; I812-L834 HydrophobicContact CG1-CD2 4.49Å; I812-Y835 HydrophobicContact CG2-CE2 3.69Å
813	G	76.8	Confident	79.4	Confident	0 Å²	0	24.8 Å²	24.8	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-75	-44	-169.9	0	0	0	0	0	114.9	E804 G811 Q815 F816 V817	E804-G813 WeakPolarHBondContact OE2-CA 3.38Å; E804-G813 PolarHBondContact OE2-N 3.22Å; G811-G813 PolarHBondContact O-N 3.21Å; G813-Q815 PolarHBondContact O-N 3.37Å; G813-F816 PolarHBondContact O-N 3.39Å; G813-V817 WeakPolarHBondContact O-CG2 3.38Å; G813-V817 PolarHBondContact O-N 2.82Å; G813-V817 VanDerWaalsContact O-N 3.14Å
814	E	80	Confident	79.3	Confident	22 Å²	22	24.8 Å²	24.8	10%	0.103	14%	0.137	C	C	.	.	H	α-helix	trans	-56.1	-40.1	169.2	-171.7	-129.1	-153.5	0	0	111.1	R648 I809 K818	R648-E814 IonicContact CZ-OE2 3.21Å; R648-E814 IonicContact NH1-OE2 2.8Å; R648-E814 PolarHBondContact NH1-OE2 2.92Å; R648-E814 IonicContact NH2-OE2 2.76Å; R648-E814 PolarHBondContact NH2-OE2 2.83Å; I809-E814 WeakPolarHBondContact O-CB 3.33Å; E814-K818 HydrophobicContact CG-CD 4.21Å; E814-K818 WeakPolarHBondContact O-CB 3.36Å; E814-K818 VanDerWaalsContact O-CG 3.25Å; E814-K818 WeakPolarHBondContact O-CG 3.43Å; E814-K818 PolarHBondContact O-N 3.48Å; E814-K818 VanDerWaalsContact O-N 3.12Å; E814-K818 WeakPolarHBondContact OE1-CE 3.41Å; E814-K818 IonicContact OE1-NZ 2.63Å; E814-K818 PolarHBondContact OE1-NZ 2.84Å; E814-K818 IonicContact OE2-NZ 3.7Å
815	Q	81.8	Confident	79.1	Confident	1 Å²	1	25.9 Å²	25.9	1%	0.005	14%	0.141	C	C	.	.	H	α-helix	trans	-69.3	-40.1	177.5	-174.1	60.1	50.1	0	0	112.9	F636 L644 I812 G813 K818 S819 T827	F636-Q815 VanDerWaalsContact CE2-NE2 3.28Å; L644-Q815 HydrophobicContact CD2-CG 3.71Å; I812-Q815 WeakPolarHBondContact O-CB 3.45Å; I812-Q815 PolarHBondContact O-N 2.93Å; G813-Q815 PolarHBondContact O-N 3.37Å; Q815-K818 PolarHBondContact O-N 2.93Å; Q815-S819 PolarHBondContact NE2-OG 3.01Å; Q815-S819 VanDerWaalsContact NE2-OG 3.11Å; Q815-S819 WeakPolarHBondContact O-CB 3Å; Q815-S819 PolarHBondContact O-N 3.26Å; Q815-S819 PolarHBondContact O-OG 3.26Å; Q815-T827 HydrophobicContact CG-CG2 4.13Å
816	F	79.6	Confident	79.3	Confident	2 Å²	2	23.6 Å²	23.6	1%	0.009	13%	0.13	C	C	.	.	H	α-helix	trans	-62.9	-51.6	-179.4	-163.9	-130.8	0	0	0	110.3	L801 I812 G813 K818 S819 I820 I828 V831 L1024 V1025 I1028	L801-F816 HydrophobicContact CD2-CB 4.41Å; L801-F816 HydrophobicContact CD2-CD1 4.49Å; I812-F816 PolarHBondContact O-N 3.13Å; G813-F816 PolarHBondContact O-N 3.39Å; F816-K818 VanDerWaalsContact C-N 3.32Å; F816-K818 PolarHBondContact O-N 3.3Å; F816-S819 WeakPolarHBondContact O-CB 3.44Å; F816-S819 PolarHBondContact O-N 2.92Å; F816-I820 HydrophobicContact CD1-CD1 3.74Å; F816-I820 HydrophobicContact CD2-CD1 4.39Å; F816-I820 HydrophobicContact CE1-CD1 3.83Å; F816-I820 HydrophobicContact CE2-CD1 4.49Å; F816-I820 HydrophobicContact CG-CD1 4.03Å; F816-I820 HydrophobicContact CZ-CD1 4.2Å; F816-I820 VanDerWaalsContact O-CD1 3.25Å; F816-I820 WeakPolarHBondContact O-CD1 3.29Å; F816-I820 VanDerWaalsContact O-CG1 3.23Å; F816-I820 WeakPolarHBondContact O-CG1 3.49Å; F816-I820 PolarHBondContact O-N 3.46Å; F816-I828 HydrophobicContact CE2-CB 4.22Å; F816-I828 HydrophobicContact CE2-CG2 3.62Å; F816-I828 HydrophobicContact CZ-CG2 4Å; F816-V831 HydrophobicContact CB-CG1 4.03Å; F816-V831 HydrophobicContact CD1-CG1 4.35Å; F816-V831 HydrophobicContact CD2-CB 3.45Å; F816-V831 VanDerWaalsContact CD2-CB 3.45Å; F816-V831 HydrophobicContact CD2-CG1 3.28Å; F816-V831 HydrophobicContact CD2-CG2 4Å; F816-V831 HydrophobicContact CE2-CB 3.73Å; F816-V831 HydrophobicContact CE2-CG1 3.71Å; F816-V831 HydrophobicContact CG-CB 4.3Å; F816-V831 HydrophobicContact CG-CG1 3.65Å; F816-V831 HydrophobicContact CZ-CG1 4.43Å; F816-L1024 HydrophobicContact CD1-CD2 4.02Å; F816-L1024 HydrophobicContact CE1-CD2 3.89Å; F816-V1025 HydrophobicContact CE1-CG2 4.02Å; F816-V1025 HydrophobicContact CZ-CG2 3.87Å; F816-I1028 HydrophobicContact CD1-CD1 4.33Å; F816-I1028 HydrophobicContact CE1-CD1 3.63Å; F816-I1028 HydrophobicContact CZ-CD1 4.27Å
817	V	73.5	Confident	79.4	Confident	13 Å²	13	23.3 Å²	23.3	8%	0.079	13%	0.128	C	C	.	.	H	α-helix	trans	-55.9	-45.2	176.1	178.8	0	0	0	0	111.2	G813 S819 I820 M821	G813-V817 WeakPolarHBondContact O-CG2 3.38Å; G813-V817 PolarHBondContact O-N 2.82Å; G813-V817 VanDerWaalsContact O-N 3.14Å; V817-S819 PolarHBondContact O-N 2.85Å; V817-I820 PolarHBondContact O-N 3.25Å; V817-M821 VanDerWaalsContact O-CG 3.31Å; V817-M821 WeakPolarHBondContact O-CG 3.24Å; V817-M821 PolarHBondContact O-N 3.08Å
818	K	77.2	Confident	79	Confident	90 Å²	90	23.6 Å²	23.6	39%	0.391	13%	0.13	S	C	.	.	H	α-helix	trans	-63.1	-38.6	176	-76	174.5	175.3	-177.1	0	113.4	E814 Q815 F816 T822	E814-K818 HydrophobicContact CG-CD 4.21Å; E814-K818 WeakPolarHBondContact O-CB 3.36Å; E814-K818 VanDerWaalsContact O-CG 3.25Å; E814-K818 WeakPolarHBondContact O-CG 3.43Å; E814-K818 PolarHBondContact O-N 3.48Å; E814-K818 VanDerWaalsContact O-N 3.12Å; E814-K818 WeakPolarHBondContact OE1-CE 3.41Å; E814-K818 IonicContact OE1-NZ 2.63Å; E814-K818 PolarHBondContact OE1-NZ 2.84Å; E814-K818 IonicContact OE2-NZ 3.7Å; Q815-K818 PolarHBondContact O-N 2.93Å; F816-K818 VanDerWaalsContact C-N 3.32Å; F816-K818 PolarHBondContact O-N 3.3Å; K818-T822 WeakPolarHBondContact O-CG2 3.28Å; K818-T822 PolarHBondContact O-N 2.9Å; K818-T822 PolarHBondContact O-OG1 2.82Å
819	S	78.7	Confident	79	Confident	0 Å²	0	22.4 Å²	22.4	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-68.5	-37.5	-179.9	-53.9	0	0	0	0	111.5	Q815 F816 V817 T822 N823 D824 T827	Q815-S819 PolarHBondContact NE2-OG 3.01Å; Q815-S819 VanDerWaalsContact NE2-OG 3.11Å; Q815-S819 WeakPolarHBondContact O-CB 3Å; Q815-S819 PolarHBondContact O-N 3.26Å; Q815-S819 PolarHBondContact O-OG 3.26Å; F816-S819 WeakPolarHBondContact O-CB 3.44Å; F816-S819 PolarHBondContact O-N 2.92Å; V817-S819 PolarHBondContact O-N 2.85Å; S819-T822 CarbonylContact O-C 3.55Å; S819-T822 PolarHBondContact O-N 2.79Å; S819-T822 PolarHBondContact O-OG1 2.75Å; S819-N823 PolarHBondContact O-N 3.34Å; S819-N823 VanDerWaalsContact O-N 3.09Å; S819-D824 PolarHBondContact O-N 3.11Å; S819-T827 WeakPolarHBondContact OG-CG2 3.34Å
820	I	72.6	Confident	79	Confident	8 Å²	8	22.5 Å²	22.5	4%	0.041	12%	0.116	C	C	.	.	H	α-helix	trans	-66.3	-51.2	175.3	-62.4	153.7	0	0	0	110.6	F816 V817 T822 N823 I828 I1028 L1119	F816-I820 HydrophobicContact CD1-CD1 3.74Å; F816-I820 HydrophobicContact CD2-CD1 4.39Å; F816-I820 HydrophobicContact CE1-CD1 3.83Å; F816-I820 HydrophobicContact CE2-CD1 4.49Å; F816-I820 HydrophobicContact CG-CD1 4.03Å; F816-I820 HydrophobicContact CZ-CD1 4.2Å; F816-I820 VanDerWaalsContact O-CD1 3.25Å; F816-I820 WeakPolarHBondContact O-CD1 3.29Å; F816-I820 VanDerWaalsContact O-CG1 3.23Å; F816-I820 WeakPolarHBondContact O-CG1 3.49Å; F816-I820 PolarHBondContact O-N 3.46Å; V817-I820 PolarHBondContact O-N 3.25Å; I820-T822 PolarHBondContact O-N 2.71Å; I820-N823 PolarHBondContact O-N 3.07Å; I820-I828 HydrophobicContact CG1-CD1 4.2Å; I820-I828 HydrophobicContact CG1-CG1 4.21Å; I820-I1028 HydrophobicContact CB-CG2 4.45Å; I820-I1028 HydrophobicContact CD1-CD1 3.28Å; I820-I1028 HydrophobicContact CD1-CG1 3.99Å; I820-I1028 HydrophobicContact CD1-CG2 4.13Å; I820-I1028 HydrophobicContact CG1-CD1 4.28Å; I820-I1028 HydrophobicContact CG1-CG2 4Å; I820-I1028 HydrophobicContact CG2-CG2 3.58Å; I820-L1119 HydrophobicContact CG2-CD1 4.11Å; I820-L1119 HydrophobicContact CG2-CD2 3.94Å
821	M	69.9	Low	78.9	Confident	114 Å²	114	20 Å²	20	56%	0.562	10%	0.1	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.7	-5.3	177.5	-68.9	-62	-59.7	0	0	114.2	V817 L1119	V817-M821 VanDerWaalsContact O-CG 3.31Å; V817-M821 WeakPolarHBondContact O-CG 3.24Å; V817-M821 PolarHBondContact O-N 3.08Å; M821-L1119 HydrophobicContact CG-CD2 4.46Å; M821-L1119 HydrophobicContact SD-CD2 3.46Å; M821-L1119 WeakPolarHBondContact SD-CD2 3.48Å; M821-L1119 HydrophobicContact SD-CG 4.34Å
822	T	73.5	Confident	78.6	Confident	42 Å²	42	20 Å²	20	26%	0.258	10%	0.1	S	C	.	.	T	Hydrogen-bonded Turn	trans	-131.6	12.7	-178.7	57.9	0	0	0	0	114	Q635 K818 S819 I820 D824	Q635-T822 VanDerWaalsContact CD-O 3.32Å; Q635-T822 WeakPolarHBondContact CG-O 3.3Å; Q635-T822 PolarHBondContact NE2-O 2.9Å; Q635-T822 VanDerWaalsContact NE2-O 3.07Å; K818-T822 WeakPolarHBondContact O-CG2 3.28Å; K818-T822 PolarHBondContact O-N 2.9Å; K818-T822 PolarHBondContact O-OG1 2.82Å; S819-T822 CarbonylContact O-C 3.55Å; S819-T822 PolarHBondContact O-N 2.79Å; S819-T822 PolarHBondContact O-OG1 2.75Å; I820-T822 PolarHBondContact O-N 2.71Å; T822-D824 VanDerWaalsContact C-N 3.27Å; T822-D824 PolarHBondContact O-N 3.09Å
823	N	74	Confident	78.8	Confident	50 Å²	50	20.4 Å²	20.4	27%	0.267	10%	0.102	S	C	.	.	T	Hydrogen-bonded Turn	trans	53	35.4	179.3	-71.7	-10.4	0	0	0	115	S819 I820 Y825	S819-N823 PolarHBondContact O-N 3.34Å; S819-N823 VanDerWaalsContact O-N 3.09Å; I820-N823 PolarHBondContact O-N 3.07Å; N823-Y825 VanDerWaalsContact C-N 3.27Å; N823-Y825 HydrophobicContact CB-CD1 4.41Å; N823-Y825 HydrophobicContact CB-CE1 3.68Å; N823-Y825 VanDerWaalsContact O-CD1 3.29Å; N823-Y825 WeakPolarHBondContact O-CD1 3.43Å; N823-Y825 WeakPolarHBondContact O-CE1 3.02Å; N823-Y825 PolarHBondContact O-N 3.02Å
824	D	80.8	Confident	78.9	Confident	0 Å²	0	22 Å²	22	0%	0	11%	0.111	C	C	.	.			trans	-81	67.8	179.1	-171.5	20.7	0	0	0	111.9	S633 F634 Q635 S819 T822 P826 T827 I828	S633-D824 WeakPolarHBondContact CA-OD1 3.22Å; S633-D824 WeakPolarHBondContact CB-OD2 3.48Å; S633-D824 PolarHBondContact OG-OD1 3.17Å; S633-D824 PolarHBondContact OG-OD2 2.83Å; F634-D824 PolarHBondContact N-OD1 2.84Å; Q635-D824 HydrophobicContact CG-CB 3.95Å; S819-D824 PolarHBondContact O-N 3.11Å; T822-D824 VanDerWaalsContact C-N 3.27Å; T822-D824 PolarHBondContact O-N 3.09Å; D824-P826 VanDerWaalsContact C-N 3.34Å; D824-P826 VanDerWaalsContact O-N 3.16Å; D824-T827 PolarHBondContact O-N 3.12Å; D824-T827 VanDerWaalsContact OD2-CB 3.26Å; D824-T827 WeakPolarHBondContact OD2-CB 3.4Å; D824-T827 PolarHBondContact OD2-OG1 2.72Å; D824-I828 WeakPolarHBondContact O-CG1 3.14Å; D824-I828 PolarHBondContact O-N 3.07Å
825	Y	78.9	Confident	78.8	Confident	22 Å²	22	21.4 Å²	21.4	9%	0.086	11%	0.108	C	C	.	.	H	α-helix	trans	-48.8	-41.2	-171.9	-46.3	-34.9	0	0	0	115	M582 L585 P589 F634 N823 T827 I828 M829	M582-Y825 HydrophobicContact SD-CD1 4.15Å; M582-Y825 HydrophobicContact SD-CG 4.33Å; L585-Y825 HydrophobicContact CD1-CD1 3.87Å; L585-Y825 HydrophobicContact CD1-CE1 3.5Å; P589-Y825 HydrophobicContact CB-CD2 4.04Å; P589-Y825 HydrophobicContact CB-CE2 3.73Å; P589-Y825 HydrophobicContact CG-CE2 4.19Å; F634-Y825 HydrophobicContact CE2-CD2 4.02Å; F634-Y825 HydrophobicContact CE2-CG 4.45Å; N823-Y825 VanDerWaalsContact C-N 3.27Å; N823-Y825 HydrophobicContact CB-CD1 4.41Å; N823-Y825 HydrophobicContact CB-CE1 3.68Å; N823-Y825 VanDerWaalsContact O-CD1 3.29Å; N823-Y825 WeakPolarHBondContact O-CD1 3.43Å; N823-Y825 WeakPolarHBondContact O-CE1 3.02Å; N823-Y825 PolarHBondContact O-N 3.02Å; Y825-T827 PolarHBondContact O-N 2.85Å; Y825-I828 HydrophobicContact CD1-CD1 4.45Å; Y825-I828 PolarHBondContact O-N 3.32Å; Y825-M829 WeakPolarHBondContact O-CB 3.44Å; Y825-M829 WeakPolarHBondContact O-CG 3.41Å; Y825-M829 PolarHBondContact O-N 2.78Å
826	P	83.3	Confident	78.5	Confident	13 Å²	13	21.3 Å²	21.3	8%	0.084	11%	0.107	C	C	.	.	H	α-helix	trans	-58.7	-44	176.7	-26.1	37.6	0	0	0	112.7	I632 F634 V641 D824 A830	I632-P826 WeakPolarHBondContact O-CG 3.26Å; F634-P826 HydrophobicContact CD1-CG 3.95Å; F634-P826 VanDerWaalsContact CD2-CD 3.47Å; F634-P826 HydrophobicContact CD2-CG 4.01Å; F634-P826 HydrophobicContact CE1-CG 3.61Å; F634-P826 VanDerWaalsContact CE2-CD 3.42Å; F634-P826 HydrophobicContact CE2-CG 3.74Å; F634-P826 HydrophobicContact CG-CG 4.15Å; F634-P826 HydrophobicContact CZ-CG 3.53Å; V641-P826 HydrophobicContact CG2-CB 3.92Å; D824-P826 VanDerWaalsContact C-N 3.34Å; D824-P826 VanDerWaalsContact O-N 3.16Å; P826-A830 VanDerWaalsContact O-CB 3.27Å; P826-A830 WeakPolarHBondContact O-CB 3.49Å; P826-A830 PolarHBondContact O-N 2.76Å
827	T	83.6	Confident	78.6	Confident	0 Å²	0	26 Å²	26	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-69.4	-38.1	176.7	-53.8	0	0	0	0	111.6	V641 L644 Q815 S819 D824 Y825 A830 V831	V641-T827 HydrophobicContact CG1-CG2 4.36Å; L644-T827 HydrophobicContact CD2-CG2 3.76Å; Q815-T827 HydrophobicContact CG-CG2 4.13Å; S819-T827 WeakPolarHBondContact OG-CG2 3.34Å; D824-T827 PolarHBondContact O-N 3.12Å; D824-T827 VanDerWaalsContact OD2-CB 3.26Å; D824-T827 WeakPolarHBondContact OD2-CB 3.4Å; D824-T827 PolarHBondContact OD2-OG1 2.72Å; Y825-T827 PolarHBondContact O-N 2.85Å; T827-A830 PolarHBondContact O-N 3.2Å; T827-V831 HydrophobicContact CG2-CG2 4.32Å; T827-V831 VanDerWaalsContact O-CG2 3.32Å; T827-V831 WeakPolarHBondContact O-CG2 3.31Å; T827-V831 PolarHBondContact O-N 3.39Å
828	I	79.1	Confident	78.6	Confident	10 Å²	10	27 Å²	27	5%	0.051	13%	0.132	C	C	.	.	H	α-helix	trans	-64.6	-46	177.8	-55.6	168.2	0	0	0	110.9	M582 F816 I820 D824 Y825 T832	M582-I828 HydrophobicContact CE-CB 3.91Å; M582-I828 HydrophobicContact CE-CG2 3.43Å; M582-I828 VanDerWaalsContact CE-CG2 3.43Å; F816-I828 HydrophobicContact CE2-CB 4.22Å; F816-I828 HydrophobicContact CE2-CG2 3.62Å; F816-I828 HydrophobicContact CZ-CG2 4Å; I820-I828 HydrophobicContact CG1-CD1 4.2Å; I820-I828 HydrophobicContact CG1-CG1 4.21Å; D824-I828 WeakPolarHBondContact O-CG1 3.14Å; D824-I828 PolarHBondContact O-N 3.07Å; Y825-I828 HydrophobicContact CD1-CD1 4.45Å; Y825-I828 PolarHBondContact O-N 3.32Å; I828-T832 WeakPolarHBondContact O-CB 3.47Å; I828-T832 PolarHBondContact O-N 2.93Å; I828-T832 PolarHBondContact O-OG1 3.22Å
829	M	82.4	Confident	78.4	Confident	26 Å²	26	23.7 Å²	23.7	13%	0.128	12%	0.119	C	C	.	.	H	α-helix	trans	-61.6	-43.5	175.9	-72.1	-172.7	-72.3	0	0	112.1	T578 F579 M582 Y621 Y825 T832 I833	T578-M829 HydrophobicContact CG2-CG 4.05Å; F579-M829 HydrophobicContact CD2-SD 4.33Å; M582-M829 HydrophobicContact CB-SD 4.44Å; M582-M829 HydrophobicContact CE-CG 4.06Å; M582-M829 HydrophobicContact CG-CG 3.72Å; M582-M829 HydrophobicContact CG-SD 3.95Å; M582-M829 HydrophobicContact SD-CG 4.42Å; Y621-M829 HydrophobicContact CD2-SD 4.2Å; Y621-M829 HydrophobicContact CE2-CB 4.24Å; Y621-M829 HydrophobicContact CE2-CE 4.47Å; Y621-M829 HydrophobicContact CE2-SD 3.82Å; Y825-M829 WeakPolarHBondContact O-CB 3.44Å; Y825-M829 WeakPolarHBondContact O-CG 3.41Å; Y825-M829 PolarHBondContact O-N 2.78Å; M829-T832 PolarHBondContact O-N 3.09Å; M829-I833 WeakPolarHBondContact O-CG1 3.17Å; M829-I833 PolarHBondContact O-N 3.34Å
830	A	85.6	Confident	78.3	Confident	2 Å²	2	24.8 Å²	24.8	2%	0.017	13%	0.125	C	C	.	.	H	α-helix	trans	-64.9	-44.1	-179.4	0	0	0	0	0	112.8	F630 V641 L645 P826 T827 I833 L834	F630-A830 HydrophobicContact CB-CB 3.71Å; F630-A830 HydrophobicContact CD1-CB 3.42Å; F630-A830 VanDerWaalsContact CD1-CB 3.42Å; F630-A830 HydrophobicContact CD2-CB 4.43Å; F630-A830 HydrophobicContact CE1-CB 4.13Å; F630-A830 HydrophobicContact CG-CB 3.59Å; V641-A830 HydrophobicContact CG1-CB 3.48Å; V641-A830 VanDerWaalsContact CG1-CB 3.48Å; L645-A830 HydrophobicContact CD1-CB 3.73Å; P826-A830 VanDerWaalsContact O-CB 3.27Å; P826-A830 WeakPolarHBondContact O-CB 3.49Å; P826-A830 PolarHBondContact O-N 2.76Å; T827-A830 PolarHBondContact O-N 3.2Å; A830-I833 PolarHBondContact O-N 3.33Å; A830-L834 WeakPolarHBondContact O-CB 3.36Å; A830-L834 PolarHBondContact O-N 2.89Å
831	V	81	Confident	78.5	Confident	0 Å²	0	29 Å²	29	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-65.9	-40.2	176.7	172.8	0	0	0	0	111.4	L645 I812 F816 T827 I833 L834 Y835	L645-V831 HydrophobicContact CD1-CG2 4.2Å; L645-V831 HydrophobicContact CD2-CG2 3.47Å; L645-V831 VanDerWaalsContact CD2-CG2 3.47Å; L645-V831 HydrophobicContact CG-CG2 4.48Å; I812-V831 HydrophobicContact CG2-CG1 3.63Å; I812-V831 HydrophobicContact CG2-CG2 4.18Å; F816-V831 HydrophobicContact CB-CG1 4.03Å; F816-V831 HydrophobicContact CD1-CG1 4.35Å; F816-V831 HydrophobicContact CD2-CB 3.45Å; F816-V831 VanDerWaalsContact CD2-CB 3.45Å; F816-V831 HydrophobicContact CD2-CG1 3.28Å; F816-V831 HydrophobicContact CD2-CG2 4Å; F816-V831 HydrophobicContact CE2-CB 3.73Å; F816-V831 HydrophobicContact CE2-CG1 3.71Å; F816-V831 HydrophobicContact CG-CB 4.3Å; F816-V831 HydrophobicContact CG-CG1 3.65Å; F816-V831 HydrophobicContact CZ-CG1 4.43Å; T827-V831 HydrophobicContact CG2-CG2 4.32Å; T827-V831 VanDerWaalsContact O-CG2 3.32Å; T827-V831 WeakPolarHBondContact O-CG2 3.31Å; T827-V831 PolarHBondContact O-N 3.39Å; V831-I833 VanDerWaalsContact C-N 3.35Å; V831-I833 PolarHBondContact O-N 3.03Å; V831-L834 PolarHBondContact O-N 3.23Å; V831-Y835 HydrophobicContact CG1-CD2 3.51Å; V831-Y835 HydrophobicContact CG1-CE2 3.46Å; V831-Y835 VanDerWaalsContact CG1-CE2 3.46Å; V831-Y835 WeakPolarHBondContact O-CD2 3.46Å; V831-Y835 PolarHBondContact O-N 3.34Å
832	T	78.1	Confident	78.6	Confident	0 Å²	0	25 Å²	25	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-57	-48.7	174.5	-60.6	0	0	0	0	111.1	I574 T578 I828 M829 Y835 S836 V1025	I574-T832 HydrophobicContact CG2-CG2 4.31Å; T578-T832 HydrophobicContact CG2-CG2 4.06Å; I828-T832 WeakPolarHBondContact O-CB 3.47Å; I828-T832 PolarHBondContact O-N 2.93Å; I828-T832 PolarHBondContact O-OG1 3.22Å; M829-T832 PolarHBondContact O-N 3.09Å; T832-Y835 PolarHBondContact O-N 3Å; T832-S836 WeakPolarHBondContact O-CB 3.35Å; T832-S836 PolarHBondContact O-N 3.39Å; T832-S836 PolarHBondContact O-OG 2.82Å; T832-V1025 HydrophobicContact CG2-CG1 3.79Å; T832-V1025 HydrophobicContact CG2-CG2 4.31Å; T832-V1025 WeakPolarHBondContact OG1-CG1 3.46Å
833	I	84.1	Confident	78.4	Confident	14 Å²	14	26 Å²	26	7%	0.072	13%	0.129	C	C	.	.	H	α-helix	trans	-66.9	-37.6	178.9	-70.1	-66	0	0	0	112.4	I574 A575 L625 F630 M829 A830 V831 S836 F837	I574-I833 HydrophobicContact CG2-CD1 4.2Å; A575-I833 HydrophobicContact CB-CD1 3.65Å; L625-I833 HydrophobicContact CD1-CD1 4.29Å; L625-I833 HydrophobicContact CD1-CG1 4.08Å; L625-I833 HydrophobicContact CD1-CG2 4.26Å; F630-I833 HydrophobicContact CE1-CG2 4.43Å; M829-I833 WeakPolarHBondContact O-CG1 3.17Å; M829-I833 PolarHBondContact O-N 3.34Å; A830-I833 PolarHBondContact O-N 3.33Å; V831-I833 VanDerWaalsContact C-N 3.35Å; V831-I833 PolarHBondContact O-N 3.03Å; I833-S836 PolarHBondContact O-N 3.02Å; I833-F837 VanDerWaalsContact O-CB 3.28Å; I833-F837 WeakPolarHBondContact O-CB 3.42Å; I833-F837 PolarHBondContact O-N 3.25Å
834	L	80.2	Confident	78.4	Confident	34 Å²	34	24.2 Å²	24.2	18%	0.178	12%	0.119	C	C	.	.	H	α-helix	trans	-62.2	-47	175.6	-177.5	59.5	0	0	0	111.5	L645 I649 I812 A830 V831 F837 M838	L645-L834 HydrophobicContact CD1-CD2 4.47Å; I649-L834 HydrophobicContact CD1-CD1 4.18Å; I649-L834 HydrophobicContact CD1-CD2 4.27Å; I812-L834 HydrophobicContact CD1-CD2 3.62Å; I812-L834 HydrophobicContact CG1-CD2 4.49Å; A830-L834 WeakPolarHBondContact O-CB 3.36Å; A830-L834 PolarHBondContact O-N 2.89Å; V831-L834 PolarHBondContact O-N 3.23Å; L834-F837 PolarHBondContact O-N 3.26Å; L834-M838 HydrophobicContact CD1-SD 4.34Å; L834-M838 HydrophobicContact CG-SD 4.35Å; L834-M838 VanDerWaalsContact O-CG 3.3Å; L834-M838 WeakPolarHBondContact O-CG 3.39Å; L834-M838 PolarHBondContact O-N 2.88Å
835	Y	76.4	Confident	77.9	Confident	8 Å²	8	26.6 Å²	26.6	3%	0.031	13%	0.133	C	C	.	.	H	α-helix	trans	-62.9	-44.3	175.6	-84.3	-61	0	0	0	112.5	M797 L801 I812 V831 T832 M838 L839	M797-Y835 HydrophobicContact CB-CE1 4.18Å; M797-Y835 VanDerWaalsContact O-CE1 3.24Å; M797-Y835 WeakPolarHBondContact O-CE1 3.49Å; M797-Y835 PolarHBondContact O-OH 3.03Å; L801-Y835 HydrophobicContact CD2-CE2 4.16Å; L801-Y835 VanDerWaalsContact CD2-OH 3.26Å; L801-Y835 WeakPolarHBondContact CD2-OH 3.39Å; I812-Y835 HydrophobicContact CG2-CE2 3.69Å; V831-Y835 HydrophobicContact CG1-CD2 3.51Å; V831-Y835 HydrophobicContact CG1-CE2 3.46Å; V831-Y835 VanDerWaalsContact CG1-CE2 3.46Å; V831-Y835 WeakPolarHBondContact O-CD2 3.46Å; V831-Y835 PolarHBondContact O-N 3.34Å; T832-Y835 PolarHBondContact O-N 3Å; Y835-M838 PolarHBondContact O-N 2.81Å; Y835-L839 WeakPolarHBondContact O-CB 3.38Å; Y835-L839 PolarHBondContact O-N 3.04Å
836	S	76.9	Confident	77.2	Confident	0 Å²	0	26.6 Å²	26.6	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-66.6	-36.2	178.3	-65.4	0	0	0	0	112.7	T832 I833 L839 V840 G1020	T832-S836 WeakPolarHBondContact O-CB 3.35Å; T832-S836 PolarHBondContact O-N 3.39Å; T832-S836 PolarHBondContact O-OG 2.82Å; I833-S836 PolarHBondContact O-N 3.02Å; S836-L839 PolarHBondContact O-N 3.16Å; S836-V840 WeakPolarHBondContact O-CG2 3.27Å; S836-V840 PolarHBondContact O-N 3.36Å; S836-G1020 PolarHBondContact OG-O 3.48Å
837	F	80.9	Confident	76.2	Confident	101 Å²	101	27.8 Å²	27.8	44%	0.443	14%	0.141	S	C	.	.	H	α-helix	trans	-62.4	-49.3	172	177.7	-94.6	0	0	0	111.2	L571 I833 L834 L839 V840 F841	L571-F837 HydrophobicContact CD1-CD2 3.83Å; L571-F837 HydrophobicContact CD2-CB 4.26Å; I833-F837 VanDerWaalsContact O-CB 3.28Å; I833-F837 WeakPolarHBondContact O-CB 3.42Å; I833-F837 PolarHBondContact O-N 3.25Å; L834-F837 PolarHBondContact O-N 3.26Å; F837-L839 VanDerWaalsContact C-N 3.29Å; F837-L839 PolarHBondContact O-N 2.84Å; F837-V840 PolarHBondContact O-N 2.78Å; F837-F841 WeakPolarHBondContact O-CB 3.41Å; F837-F841 PolarHBondContact O-N 2.86Å
838	M	74.4	Confident	75.3	Confident	33 Å²	33	29.3 Å²	29.3	16%	0.163	15%	0.149	C	C	.	.	H	α-helix	trans	-61.6	-38	177	-68	179.1	79.1	0	0	111.8	L653 M797 L834 Y835 V842	L653-M838 HydrophobicContact CD1-CE 4.34Å; M797-M838 HydrophobicContact CE-CE 3.92Å; M797-M838 HydrophobicContact SD-CE 3.47Å; M797-M838 WeakPolarHBondContact SD-CE 3.43Å; L834-M838 HydrophobicContact CD1-SD 4.34Å; L834-M838 HydrophobicContact CG-SD 4.35Å; L834-M838 VanDerWaalsContact O-CG 3.3Å; L834-M838 WeakPolarHBondContact O-CG 3.39Å; L834-M838 PolarHBondContact O-N 2.88Å; Y835-M838 PolarHBondContact O-N 2.81Å; M838-V842 WeakPolarHBondContact O-CB 3.42Å; M838-V842 VanDerWaalsContact O-CG2 3.27Å; M838-V842 WeakPolarHBondContact O-CG2 3.41Å; M838-V842 PolarHBondContact O-N 3.38Å
839	L	72.5	Confident	74.5	Confident	21 Å²	21	31.2 Å²	31.2	11%	0.11	16%	0.159	C	C	.	.	H	α-helix	trans	-59.8	-57.3	175.9	-179.5	52.6	0	0	0	112.3	V794 Y835 S836 F837 F841 V842 I843 S1019	V794-L839 HydrophobicContact CB-CD1 3.94Å; V794-L839 HydrophobicContact CG1-CB 3.87Å; V794-L839 HydrophobicContact CG1-CD1 3.84Å; V794-L839 HydrophobicContact CG1-CG 4.36Å; V794-L839 HydrophobicContact CG2-CD1 3.99Å; Y835-L839 WeakPolarHBondContact O-CB 3.38Å; Y835-L839 PolarHBondContact O-N 3.04Å; S836-L839 PolarHBondContact O-N 3.16Å; F837-L839 VanDerWaalsContact C-N 3.29Å; F837-L839 PolarHBondContact O-N 2.84Å; L839-F841 VanDerWaalsContact C-N 3.3Å; L839-F841 PolarHBondContact O-N 3.34Å; L839-V842 PolarHBondContact O-N 3.35Å; L839-I843 HydrophobicContact CD1-CD1 3.72Å; L839-I843 HydrophobicContact CD1-CG1 4.3Å; L839-I843 HydrophobicContact CG-CD1 4.01Å; L839-I843 VanDerWaalsContact O-CG1 3.32Å; L839-I843 WeakPolarHBondContact O-CG1 3.34Å; L839-I843 PolarHBondContact O-N 2.99Å; L839-S1019 WeakPolarHBondContact CD2-O 3.37Å
840	V	75.3	Confident	73.4	Confident	22 Å²	22	33.6 Å²	33.6	13%	0.133	17%	0.167	C	C	.	.	H	α-helix	trans	-71.6	-28.6	-175.4	-170	0	0	0	0	111.1	M567 T570 S836 F837 L844	M567-V840 HydrophobicContact CB-CG1 3.71Å; M567-V840 HydrophobicContact CE-CG1 4.02Å; M567-V840 WeakPolarHBondContact CE-O 3.38Å; M567-V840 HydrophobicContact CG-CB 4.13Å; M567-V840 HydrophobicContact CG-CG1 3.59Å; T570-V840 HydrophobicContact CG2-CG2 4.07Å; S836-V840 WeakPolarHBondContact O-CG2 3.27Å; S836-V840 PolarHBondContact O-N 3.36Å; F837-V840 PolarHBondContact O-N 2.78Å; V840-L844 WeakPolarHBondContact O-CB 3.44Å; V840-L844 PolarHBondContact O-N 3.46Å
841	F	78.6	Confident	71.8	Confident	96 Å²	96	35.2 Å²	35.2	42%	0.421	18%	0.184	S	C	.	.	H	α-helix	trans	-67	-46.1	171.5	-178.6	-96.3	0	0	0	112.7	F837 L839 I843 L844 V845	F837-F841 WeakPolarHBondContact O-CB 3.41Å; F837-F841 PolarHBondContact O-N 2.86Å; L839-F841 VanDerWaalsContact C-N 3.3Å; L839-F841 PolarHBondContact O-N 3.34Å; F841-I843 VanDerWaalsContact C-N 3.34Å; F841-I843 PolarHBondContact O-N 2.96Å; F841-L844 WeakPolarHBondContact O-CB 3.47Å; F841-L844 PolarHBondContact O-N 3.38Å; F841-V845 HydrophobicContact CD1-CG2 4.25Å; F841-V845 HydrophobicContact CE1-CG2 3.8Å; F841-V845 HydrophobicContact CZ-CG2 3.97Å; F841-V845 WeakPolarHBondContact O-CG2 3.23Å; F841-V845 PolarHBondContact O-N 2.97Å
842	V	71.6	Confident	70.6	Confident	32 Å²	32	41.4 Å²	41.4	19%	0.194	22%	0.217	C	C	.	.	H	α-helix	trans	-66.2	-37.6	177.4	170.1	0	0	0	0	111.3	G790 A793 V794 M838 L839 V845 V846	G790-V842 VanDerWaalsContact O-CG1 3.32Å; G790-V842 WeakPolarHBondContact O-CG1 3.4Å; A793-V842 HydrophobicContact CB-CG1 4.48Å; V794-V842 HydrophobicContact CG2-CB 3.8Å; V794-V842 HydrophobicContact CG2-CG1 3.96Å; V794-V842 HydrophobicContact CG2-CG2 4.06Å; M838-V842 WeakPolarHBondContact O-CB 3.42Å; M838-V842 VanDerWaalsContact O-CG2 3.27Å; M838-V842 WeakPolarHBondContact O-CG2 3.41Å; M838-V842 PolarHBondContact O-N 3.38Å; L839-V842 PolarHBondContact O-N 3.35Å; V842-V845 PolarHBondContact O-N 3.28Å; V842-V846 PolarHBondContact O-N 3.2Å
843	I	69.6	Low	69.5	Low	63 Å²	63	44.6 Å²	44.6	32%	0.323	24%	0.236	S	C	.	.	H	α-helix	trans	-58.7	-49	170.9	-71.4	167.5	0	0	0	110.3	L839 F841 V845 V846 D847	L839-I843 HydrophobicContact CD1-CD1 3.72Å; L839-I843 HydrophobicContact CD1-CG1 4.3Å; L839-I843 HydrophobicContact CG-CD1 4.01Å; L839-I843 VanDerWaalsContact O-CG1 3.32Å; L839-I843 WeakPolarHBondContact O-CG1 3.34Å; L839-I843 PolarHBondContact O-N 2.99Å; F841-I843 VanDerWaalsContact C-N 3.34Å; F841-I843 PolarHBondContact O-N 2.96Å; I843-V845 VanDerWaalsContact C-N 3.32Å; I843-V845 PolarHBondContact O-N 3.5Å; I843-V846 PolarHBondContact O-N 3.34Å; I843-V846 VanDerWaalsContact O-N 3.14Å; I843-D847 WeakPolarHBondContact CG2-OD2 3.23Å; I843-D847 WeakPolarHBondContact O-CB 3.41Å; I843-D847 VanDerWaalsContact O-CG 3.27Å; I843-D847 PolarHBondContact O-N 3.36Å
844	L	72.4	Confident	68.2	Low	12 Å²	12	44.6 Å²	44.6	6%	0.063	24%	0.236	C	C	.	.	H	α-helix	trans	-58.1	-41.6	175.8	177.2	65.2	0	0	0	112.3	F560 R563 V564 M567 V840 F841 V846 D847 L848	F560-L844 HydrophobicContact CD2-CD1 4.45Å; F560-L844 HydrophobicContact CE2-CD2 4.02Å; R563-L844 HydrophobicContact CB-CD1 3.87Å; V564-L844 HydrophobicContact CG2-CD2 4.06Å; M567-L844 HydrophobicContact CE-CB 3.76Å; M567-L844 HydrophobicContact CE-CD2 3.52Å; M567-L844 HydrophobicContact CE-CG 4.24Å; V840-L844 WeakPolarHBondContact O-CB 3.44Å; V840-L844 PolarHBondContact O-N 3.46Å; F841-L844 WeakPolarHBondContact O-CB 3.47Å; F841-L844 PolarHBondContact O-N 3.38Å; L844-V846 VanDerWaalsContact C-N 3.34Å; L844-V846 PolarHBondContact O-N 2.99Å; L844-D847 PolarHBondContact O-N 3.05Å; L844-L848 HydrophobicContact CD1-CD1 3.99Å; L844-L848 HydrophobicContact CD1-CG 4.09Å; L844-L848 HydrophobicContact CG-CD1 3.87Å; L844-L848 HydrophobicContact CG-CG 4.39Å; L844-L848 WeakPolarHBondContact O-CB 3.41Å; L844-L848 WeakPolarHBondContact O-CD1 3.2Å; L844-L848 WeakPolarHBondContact O-CG 3.12Å; L844-L848 PolarHBondContact O-N 3.33Å
845	V	71	Confident	66.7	Low	49 Å²	49	45.3 Å²	45.3	30%	0.297	24%	0.243	S	C	.	.	H	α-helix	trans	-62.5	-41.1	177.2	170.7	0	0	0	0	111.3	F841 V842 I843 L848 L849	F841-V845 HydrophobicContact CD1-CG2 4.25Å; F841-V845 HydrophobicContact CE1-CG2 3.8Å; F841-V845 HydrophobicContact CZ-CG2 3.97Å; F841-V845 WeakPolarHBondContact O-CG2 3.23Å; F841-V845 PolarHBondContact O-N 2.97Å; V842-V845 PolarHBondContact O-N 3.28Å; I843-V845 VanDerWaalsContact C-N 3.32Å; I843-V845 PolarHBondContact O-N 3.5Å; V845-L848 PolarHBondContact O-N 3.27Å; V845-L849 HydrophobicContact CG1-CD1 3.87Å; V845-L849 HydrophobicContact CG1-CG 4.42Å; V845-L849 WeakPolarHBondContact O-CB 3.08Å; V845-L849 VanDerWaalsContact O-CG 3.29Å; V845-L849 WeakPolarHBondContact O-CG 3.27Å; V845-L849 PolarHBondContact O-N 2.95Å
846	V	64.3	Low	65.7	Low	23 Å²	23	49.2 Å²	49.2	14%	0.139	26%	0.257	C	S	.	.	H	α-helix	trans	-71.4	-38.4	176.1	172.5	0	0	0	0	112.3	V842 I843 L844 L848 L849 Y850	V842-V846 PolarHBondContact O-N 3.2Å; I843-V846 PolarHBondContact O-N 3.34Å; I843-V846 VanDerWaalsContact O-N 3.14Å; L844-V846 VanDerWaalsContact C-N 3.34Å; L844-V846 PolarHBondContact O-N 2.99Å; V846-L848 PolarHBondContact O-N 2.77Å; V846-L849 PolarHBondContact O-N 3.43Å; V846-Y850 VanDerWaalsContact O-CB 3.31Å; V846-Y850 WeakPolarHBondContact O-CB 3.29Å; V846-Y850 PolarHBondContact O-N 3.24Å
847	D	63.1	Low	64	Low	37 Å²	37	53.6 Å²	53.6	20%	0.198	28%	0.28	C	S	.	.	H	α-helix	trans	-59.1	-32.7	173	-73.1	-56.6	0	0	0	113	R563 I843 L844	R563-D847 IonicContact CZ-OD1 2.73Å; R563-D847 IonicContact CZ-OD2 2.73Å; R563-D847 VanDerWaalsContact CZ-OD2 3.25Å; R563-D847 IonicContact NE-OD2 3.79Å; R563-D847 IonicContact NH1-OD1 2.59Å; R563-D847 PolarHBondContact NH1-OD1 2.9Å; R563-D847 IonicContact NH1-OD2 2.78Å; R563-D847 PolarHBondContact NH1-OD2 3.45Å; R563-D847 VanDerWaalsContact NH2-CG 3.32Å; R563-D847 IonicContact NH2-OD1 3.11Å; R563-D847 PolarHBondContact NH2-OD1 3.32Å; R563-D847 IonicContact NH2-OD2 3.15Å; I843-D847 WeakPolarHBondContact CG2-OD2 3.23Å; I843-D847 WeakPolarHBondContact O-CB 3.41Å; I843-D847 VanDerWaalsContact O-CG 3.27Å; I843-D847 PolarHBondContact O-N 3.36Å; L844-D847 PolarHBondContact O-N 3.05Å
848	L	63.9	Low	62.1	Low	32 Å²	32	55.3 Å²	55.3	17%	0.168	29%	0.289	C	S	.	.	H	α-helix	trans	-81.1	-44.6	178.1	-69.1	169.1	0	0	0	111.4	Y556 F560 L844 V845 V846 G851 L852	Y556-L848 HydrophobicContact CE1-CD2 3.6Å; Y556-L848 WeakPolarHBondContact OH-CD2 3.35Å; Y556-L848 PolarHBondContact OH-O 3.28Å; F560-L848 HydrophobicContact CD2-CD1 4.22Å; F560-L848 HydrophobicContact CD2-CD2 4.28Å; F560-L848 HydrophobicContact CE2-CD1 4.28Å; L844-L848 HydrophobicContact CD1-CD1 3.99Å; L844-L848 HydrophobicContact CD1-CG 4.09Å; L844-L848 HydrophobicContact CG-CD1 3.87Å; L844-L848 HydrophobicContact CG-CG 4.39Å; L844-L848 WeakPolarHBondContact O-CB 3.41Å; L844-L848 WeakPolarHBondContact O-CD1 3.2Å; L844-L848 WeakPolarHBondContact O-CG 3.12Å; L844-L848 PolarHBondContact O-N 3.33Å; V845-L848 PolarHBondContact O-N 3.27Å; V846-L848 PolarHBondContact O-N 2.77Å; L848-G851 PolarHBondContact O-N 2.94Å; L848-L852 WeakPolarHBondContact O-CG 3.29Å; L848-L852 PolarHBondContact O-N 3.11Å
849	L	63.1	Low	60.1	Low	50 Å²	50	62.4 Å²	62.4	26%	0.262	32%	0.322	S	S	.	.	H	α-helix	trans	-64.3	-40.5	177.1	-74.4	171.1	0	0	0	112.3	L17 V845 V846 G851 L852 V853	L17-L849 HydrophobicContact CD1-CD1 4Å; V845-L849 HydrophobicContact CG1-CD1 3.87Å; V845-L849 HydrophobicContact CG1-CG 4.42Å; V845-L849 WeakPolarHBondContact O-CB 3.08Å; V845-L849 VanDerWaalsContact O-CG 3.29Å; V845-L849 WeakPolarHBondContact O-CG 3.27Å; V845-L849 PolarHBondContact O-N 2.95Å; V846-L849 PolarHBondContact O-N 3.43Å; L849-G851 VanDerWaalsContact C-N 3.32Å; L849-G851 PolarHBondContact O-N 2.9Å; L849-L852 PolarHBondContact O-N 3.09Å; L849-V853 WeakPolarHBondContact O-CB 3.36Å; L849-V853 VanDerWaalsContact O-CG2 3.3Å; L849-V853 WeakPolarHBondContact O-CG2 3.39Å; L849-V853 PolarHBondContact O-N 2.89Å; L849-V853 VanDerWaalsContact O-N 3.12Å
850	Y	58.5	Low	58	Low	77 Å²	77	69.6 Å²	69.6	30%	0.302	35%	0.347	S	S	.	.	H	α-helix	trans	-60	-44.6	178.3	-174.7	-117.7	0	0	0	111.1	I783 V846 L852 V853 D854 I857	I783-Y850 HydrophobicContact CG2-CE2 3.96Å; V846-Y850 VanDerWaalsContact O-CB 3.31Å; V846-Y850 WeakPolarHBondContact O-CB 3.29Å; V846-Y850 PolarHBondContact O-N 3.24Å; Y850-L852 PolarHBondContact O-N 3.29Å; Y850-L852 VanDerWaalsContact O-N 3.1Å; Y850-V853 PolarHBondContact O-N 2.93Å; Y850-V853 VanDerWaalsContact O-N 3.17Å; Y850-D854 HydrophobicContact CD2-CB 4.18Å; Y850-D854 HydrophobicContact CE2-CB 3.63Å; Y850-D854 WeakPolarHBondContact CE2-OD2 3.45Å; Y850-D854 VanDerWaalsContact CZ-OD2 3.28Å; Y850-D854 PolarHBondContact O-N 2.9Å; Y850-D854 VanDerWaalsContact O-N 3.11Å; Y850-D854 PolarHBondContact OH-OD2 3.04Å; Y850-I857 HydrophobicContact CD1-CD1 3.86Å; Y850-I857 HydrophobicContact CE1-CD1 3.73Å; Y850-I857 HydrophobicContact CE1-CG1 4.19Å
851	G	52.7	Low	55.7	Low	36 Å²	36	78 Å²	78	37%	0.371	39%	0.385	S	S	.	.	H	α-helix	trans	-69.7	4.3	172.7	0	0	0	0	0	116.3	L848 L849	L848-G851 PolarHBondContact O-N 2.94Å; L849-G851 VanDerWaalsContact C-N 3.32Å; L849-G851 PolarHBondContact O-N 2.9Å
852	L	54.8	Low	53.3	Low	130 Å²	130	77.6 Å²	77.6	68%	0.681	39%	0.385	S	S	*	.	H	α-helix	trans	-116.6	-12	172.1	-69.3	169.6	0	0	0	112.8	L848 L849 Y850	L848-L852 WeakPolarHBondContact O-CG 3.29Å; L848-L852 PolarHBondContact O-N 3.11Å; L849-L852 PolarHBondContact O-N 3.09Å; Y850-L852 PolarHBondContact O-N 3.29Å; Y850-L852 VanDerWaalsContact O-N 3.1Å
853	V	56	Low	51.1	Low	66 Å²	66	84.1 Å²	84.1	40%	0.4	42%	0.417	S	S	.	.	H	α-helix	trans	-112.7	-33.5	-171	170.6	0	0	0	0	112.4	I783 L849 Y850	I783-V853 HydrophobicContact CG1-CG1 4.28Å; L849-V853 WeakPolarHBondContact O-CB 3.36Å; L849-V853 VanDerWaalsContact O-CG2 3.3Å; L849-V853 WeakPolarHBondContact O-CG2 3.39Å; L849-V853 PolarHBondContact O-N 2.89Å; L849-V853 VanDerWaalsContact O-N 3.12Å; Y850-V853 PolarHBondContact O-N 2.93Å; Y850-V853 VanDerWaalsContact O-N 3.17Å
854	D	55.1	Low	49.1	Very low	15 Å²	15	83 Å²	83	8%	0.08	42%	0.417	C	S	.	.			trans	-105.2	111.3	-177.7	-165	-7.3	0	0	0	111.2	I783 Y850 R856 I857	I783-D854 HydrophobicContact CG2-CB 4.03Å; Y850-D854 HydrophobicContact CD2-CB 4.18Å; Y850-D854 HydrophobicContact CE2-CB 3.63Å; Y850-D854 WeakPolarHBondContact CE2-OD2 3.45Å; Y850-D854 VanDerWaalsContact CZ-OD2 3.28Å; Y850-D854 PolarHBondContact O-N 2.9Å; Y850-D854 VanDerWaalsContact O-N 3.11Å; Y850-D854 PolarHBondContact OH-OD2 3.04Å; D854-R856 PolarHBondContact O-N 3.16Å; D854-R856 VanDerWaalsContact OD1-CB 3.31Å; D854-R856 WeakPolarHBondContact OD1-CB 3.18Å; D854-R856 VanDerWaalsContact OD1-CG 3.23Å; D854-R856 WeakPolarHBondContact OD1-CG 3.07Å; D854-R856 PolarHBondContact OD1-N 3.41Å; D854-R856 VanDerWaalsContact OD1-N 3.08Å; D854-I857 HydrophobicContact CB-CD1 4.21Å; D854-I857 HydrophobicContact CB-CG1 4.43Å; D854-I857 WeakPolarHBondContact O-CD1 3.41Å
855	P	49	Very low	47.1	Very low	49 Å²	49	87.3 Å²	87.3	32%	0.318	45%	0.454	S	S	.	.	S	Bend	trans	-72.2	-16.2	176.5	30.1	-34.6	0	0	0	113	I857	P855-I857 PolarHBondContact O-N 2.94Å
856	R	55.9	Low	45.4	Very low	90 Å²	90	87 Å²	87	34%	0.34	45%	0.453	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.9	26.7	-176	-48.5	176.6	-161.5	-171.8	8.7	114.2	N780 D854	N780-R856 PolarHBondContact OD1-NH2 2.93Å; D854-R856 PolarHBondContact O-N 3.16Å; D854-R856 VanDerWaalsContact OD1-CB 3.31Å; D854-R856 WeakPolarHBondContact OD1-CB 3.18Å; D854-R856 VanDerWaalsContact OD1-CG 3.23Å; D854-R856 WeakPolarHBondContact OD1-CG 3.07Å; D854-R856 PolarHBondContact OD1-N 3.41Å; D854-R856 VanDerWaalsContact OD1-N 3.08Å
857	I	42.4	Very low	44.1	Very low	92 Å²	92	87.2 Å²	87.2	47%	0.472	46%	0.456	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.9	-13.5	-176.2	-67.9	175	0	0	0	111.4	Y850 D854 P855	Y850-I857 HydrophobicContact CD1-CD1 3.86Å; Y850-I857 HydrophobicContact CE1-CD1 3.73Å; Y850-I857 HydrophobicContact CE1-CG1 4.19Å; D854-I857 HydrophobicContact CB-CD1 4.21Å; D854-I857 HydrophobicContact CB-CG1 4.43Å; D854-I857 WeakPolarHBondContact O-CD1 3.41Å; P855-I857 PolarHBondContact O-N 2.94Å
858	Q	39.1	Very low	43.1	Very low	137 Å²	137	89.1 Å²	89.1	64%	0.64	47%	0.466	S	S	*	.	S	Bend	trans	-85.2	120.6	155.1	-71.5	171.8	-89	0	0	108.1	E272	E272-Q858 PolarHBondContact OE1-NE2 3.43Å
859	E	33.9	Very low	42.4	Very low	181 Å²	181	89.4 Å²	89.4	85%	0.846	47%	0.467	S	S	*	.			trans	66.6	153.6	176.7	-50.2	-150.4	127.4	0	0	118.7
860	R	27.7	Very low	42	Very low	172 Å²	172	88.1 Å²	88.1	65%	0.649	46%	0.46	S	S	*	.			trans	-162.3	72.6	-176	-135.1	-178.2	-170.9	-69.5	-16.1	114	E862	R860-E862 IonicContact CZ-OE1 2.71Å; R860-E862 IonicContact CZ-OE2 3.76Å; R860-E862 IonicContact NH1-OE1 2.62Å; R860-E862 PolarHBondContact NH1-OE1 3.07Å; R860-E862 IonicContact NH1-OE2 4Å; R860-E862 PolarHBondContact NH1-OE2 3.18Å; R860-E862 IonicContact NH2-OE1 3.46Å; R860-E862 PolarHBondContact NH2-OE1 3.11Å
861	E	26.8	Very low	41.9	Very low	199 Å²	199	91 Å²	91	93%	0.93	48%	0.479	S	S	*	.			trans	-103	109.2	158.3	-61.8	-149.6	141	0	0	109.5
862	E	29	Very low	42	Very low	87 Å²	87	96.6 Å²	96.6	41%	0.407	50%	0.496	S	S	.	.			trans	-105.7	100.8	175.5	-82.3	177.1	173.8	0	0	109.6	R860 A864 K1063	R860-E862 IonicContact CZ-OE1 2.71Å; R860-E862 IonicContact CZ-OE2 3.76Å; R860-E862 IonicContact NH1-OE1 2.62Å; R860-E862 PolarHBondContact NH1-OE1 3.07Å; R860-E862 IonicContact NH1-OE2 4Å; R860-E862 PolarHBondContact NH1-OE2 3.18Å; R860-E862 IonicContact NH2-OE1 3.46Å; R860-E862 PolarHBondContact NH2-OE1 3.11Å; E862-A864 PolarHBondContact O-N 3.12Å; E862-K1063 IonicContact OE2-NZ 2.85Å; E862-K1063 PolarHBondContact OE2-NZ 3.34Å
863	I	25.3	Very low	42	Very low	169 Å²	169	91.6 Å²	91.6	87%	0.867	47%	0.47	S	S	*	.			trans	-54.7	131	166.3	-57.5	174.7	0	0	0	108.3
864	A	27	Very low	42.5	Very low	41 Å²	41	88.7 Å²	88.7	34%	0.339	45%	0.453	S	S	.	.			trans	-140.4	106	-173.1	0	0	0	0	0	111.4	E862 P866	E862-A864 PolarHBondContact O-N 3.12Å; A864-P866 WeakPolarHBondContact O-CD 3.2Å
865	A	29.8	Very low	43.2	Very low	101 Å²	101	93.9 Å²	93.9	84%	0.835	47%	0.471	S	S	*	.			trans	-59.3	122.2	-176.8	0	0	0	0	0	113
866	P	35.9	Very low	43.9	Very low	43 Å²	43	98.8 Å²	98.8	28%	0.279	48%	0.483	S	S	.	.			trans	-74.5	163.5	179.4	-14.4	26.1	0	0	0	115.4	A864 Y1491 P1496	A864-P866 WeakPolarHBondContact O-CD 3.2Å; P866-Y1491 HydrophobicContact CB-CE1 4.1Å; P866-Y1491 HydrophobicContact CG-CD1 4.38Å; P866-Y1491 HydrophobicContact CG-CE1 3.95Å; P866-Y1491 PolarHBondContact O-OH 3.5Å; P866-P1496 HydrophobicContact CB-CG 4Å
867	S	38	Very low	44.5	Very low	27 Å²	27	97.2 Å²	97.2	19%	0.189	48%	0.478	C	S	.	.			trans	-109.5	159.1	-163.1	47.8	0	0	0	0	116.9
868	L	41.1	Very low	46.2	Very low	78 Å²	78	93 Å²	93	41%	0.408	46%	0.456	S	S	.	.			trans	-65.8	177.8	-173	-65	162	0	0	0	116.1	F870 P1173	L868-F870 VanDerWaalsContact C-N 3.32Å; L868-F870 WeakPolarHBondContact O-CA 3.32Å; L868-F870 WeakPolarHBondContact O-CB 3.46Å; L868-F870 PolarHBondContact O-N 3.31Å; L868-P1173 HydrophobicContact CD1-CB 4.49Å
869	N	49.7	Very low	47.9	Very low	37 Å²	37	93 Å²	93	20%	0.198	45%	0.454	C	S	.	.	S	Bend	trans	-54.9	83.4	176.4	-162.9	-21.5	0	0	0	112.7	D873 Y1541 H1543 E1544	N869-D873 PolarHBondContact O-N 2.7Å; N869-Y1541 WeakPolarHBondContact ND2-CD2 3.42Å; N869-Y1541 WeakPolarHBondContact ND2-CE2 3.01Å; N869-Y1541 WeakPolarHBondContact OD1-CE2 3.36Å; N869-H1543 WeakPolarHBondContact CB-NE2 3.49Å; N869-H1543 PolarHBondContact N-CE1 2.65Å; N869-H1543 PolarHBondContact N-NE2 3.21Å; N869-E1544 PolarHBondContact ND2-OE1 3.23Å
870	F	55.4	Low	49.8	Very low	24 Å²	24	91.7 Å²	91.7	11%	0.105	45%	0.445	C	S	.	.	H	α-helix	trans	-70.2	-60.6	-142.2	-164	-108.5	0	0	0	113.9	L868 Q872 D873 S874 F1171	L868-F870 VanDerWaalsContact C-N 3.32Å; L868-F870 WeakPolarHBondContact O-CA 3.32Å; L868-F870 WeakPolarHBondContact O-CB 3.46Å; L868-F870 PolarHBondContact O-N 3.31Å; F870-Q872 VanDerWaalsContact C-N 3.29Å; F870-Q872 PolarHBondContact O-N 2.9Å; F870-D873 PolarHBondContact O-N 2.96Å; F870-S874 WeakPolarHBondContact O-CB 3.5Å; F870-S874 PolarHBondContact O-N 2.74Å; F870-S874 PolarHBondContact O-OG 3.04Å; F870-F1171 HydrophobicContact CD1-CD1 4.04Å; F870-F1171 HydrophobicContact CD1-CE1 4.26Å; F870-F1171 HydrophobicContact CE1-CB 4.23Å; F870-F1171 AromaticContact CE1-CD1 3.15Å; F870-F1171 HydrophobicContact CE1-CD1 3.15Å; F870-F1171 AromaticContact CE1-CE1 3.61Å; F870-F1171 HydrophobicContact CE1-CE1 3.61Å; F870-F1171 AromaticContact CE1-CG 3.82Å; F870-F1171 HydrophobicContact CE1-CG 3.82Å; F870-F1171 HydrophobicContact CE2-CB 4.36Å; F870-F1171 HydrophobicContact CE2-CD1 4.41Å; F870-F1171 VanDerWaalsContact CE2-O 3.32Å; F870-F1171 WeakPolarHBondContact CE2-O 3.33Å; F870-F1171 HydrophobicContact CZ-CB 3.56Å; F870-F1171 AromaticContact CZ-CD1 3.4Å; F870-F1171 HydrophobicContact CZ-CD1 3.4Å; F870-F1171 VanDerWaalsContact CZ-CD1 3.4Å; F870-F1171 HydrophobicContact CZ-CE1 4.31Å; F870-F1171 AromaticContact CZ-CG 3.69Å; F870-F1171 HydrophobicContact CZ-CG 3.69Å
871	L	55.9	Low	52.2	Low	136 Å²	136	85.8 Å²	85.8	71%	0.712	43%	0.427	S	S	*	.	H	α-helix	trans	-62.8	-32.7	-169.5	-105.1	164.3	0	0	0	113.6	W875	L871-W875 VanDerWaalsContact O-CB 3.23Å; L871-W875 WeakPolarHBondContact O-CB 3.32Å; L871-W875 PolarHBondContact O-N 3.14Å; L871-W875 VanDerWaalsContact O-N 3.1Å
872	Q	55.1	Low	54.7	Low	154 Å²	154	84.1 Å²	84.1	72%	0.72	42%	0.416	S	S	*	.	H	α-helix	trans	-78.3	-45.4	178.7	-66.3	-168.1	1.8	0	0	112.1	F870 W875 R876	F870-Q872 VanDerWaalsContact C-N 3.29Å; F870-Q872 PolarHBondContact O-N 2.9Å; Q872-W875 PolarHBondContact O-N 3.08Å; Q872-R876 WeakPolarHBondContact O-CB 3.39Å; Q872-R876 PolarHBondContact O-N 3.24Å
873	D	54.3	Low	57.1	Low	25 Å²	25	82 Å²	82	13%	0.134	41%	0.413	C	S	.	.	H	α-helix	trans	-72.3	-37.4	178.1	-167.3	33.2	0	0	0	112	N869 F870 W875 R876 R877	N869-D873 PolarHBondContact O-N 2.7Å; F870-D873 PolarHBondContact O-N 2.96Å; D873-W875 VanDerWaalsContact C-N 3.32Å; D873-W875 PolarHBondContact O-N 3.15Å; D873-R876 CarbonylContact O-C 3.53Å; D873-R876 WeakPolarHBondContact O-CA 3.47Å; D873-R876 WeakPolarHBondContact O-CB 3.24Å; D873-R876 PolarHBondContact O-N 2.8Å; D873-R876 IonicContact OD1-CZ 3Å; D873-R876 IonicContact OD1-NE 2.82Å; D873-R876 PolarHBondContact OD1-NE 3.3Å; D873-R876 IonicContact OD1-NH2 3.17Å; D873-R876 PolarHBondContact OD1-NH2 3.39Å; D873-R876 IonicContact OD2-NH2 3.7Å; D873-R877 WeakPolarHBondContact O-CB 3.47Å; D873-R877 WeakPolarHBondContact O-CG 3Å; D873-R877 PolarHBondContact O-N 2.74Å; D873-R877 IonicContact OD1-NE 2.65Å; D873-R877 IonicContact OD2-CZ 3.84Å; D873-R877 IonicContact OD2-NE 2.59Å; D873-R877 PolarHBondContact OD2-NE 2.94Å; D873-R877 IonicContact OD2-NH2 3.53Å; D873-R877 PolarHBondContact OD2-NH2 3.02Å
874	S	65.2	Low	59.9	Low	6 Å²	6	73.9 Å²	73.9	4%	0.042	37%	0.372	C	S	.	.	H	α-helix	trans	-60.1	-39.7	169.4	-63.1	0	0	0	0	111.9	F870 R876 R877 L878 A1170 F1171	F870-S874 WeakPolarHBondContact O-CB 3.5Å; F870-S874 PolarHBondContact O-N 2.74Å; F870-S874 PolarHBondContact O-OG 3.04Å; S874-R876 VanDerWaalsContact C-N 3.34Å; S874-R876 PolarHBondContact O-N 2.81Å; S874-R877 PolarHBondContact O-N 3.39Å; S874-L878 VanDerWaalsContact O-CB 3.31Å; S874-L878 WeakPolarHBondContact O-CB 3.29Å; S874-L878 PolarHBondContact O-N 3.22Å; S874-A1170 WeakPolarHBondContact CA-O 3.35Å; S874-A1170 VanDerWaalsContact CB-O 3.22Å; S874-A1170 WeakPolarHBondContact CB-O 3.17Å; S874-A1170 WeakPolarHBondContact O-CB 3.44Å; S874-A1170 PolarHBondContact OG-O 2.96Å; S874-F1171 WeakPolarHBondContact OG-CD1 3.49Å
875	W	70.2	Confident	62.7	Low	124 Å²	124	74 Å²	74	47%	0.47	37%	0.368	S	S	.	.	H	α-helix	trans	-66.1	-35.7	172	-169.2	-123.1	0	0	0	112.5	L871 Q872 D873 L878 K879 M888	L871-W875 VanDerWaalsContact O-CB 3.23Å; L871-W875 WeakPolarHBondContact O-CB 3.32Å; L871-W875 PolarHBondContact O-N 3.14Å; L871-W875 VanDerWaalsContact O-N 3.1Å; Q872-W875 PolarHBondContact O-N 3.08Å; D873-W875 VanDerWaalsContact C-N 3.32Å; D873-W875 PolarHBondContact O-N 3.15Å; W875-L878 HydrophobicContact CE3-CD2 3.69Å; W875-L878 HydrophobicContact CZ3-CD2 3.58Å; W875-K879 WeakPolarHBondContact O-CB 3.21Å; W875-K879 VanDerWaalsContact O-CG 3.32Å; W875-K879 WeakPolarHBondContact O-CG 3.31Å; W875-K879 PolarHBondContact O-N 3.05Å; W875-M888 HydrophobicContact CH2-CE 3.83Å; W875-M888 HydrophobicContact CH2-SD 3.79Å; W875-M888 HydrophobicContact CZ3-CE 4.46Å; W875-M888 HydrophobicContact CZ3-SD 4.03Å
876	R	64.4	Low	65.5	Low	151 Å²	151	74 Å²	74	57%	0.57	35%	0.353	S	S	*	.	H	α-helix	trans	-64.4	-38.1	172.3	-171.5	175.8	69.5	155.3	-1.1	112.1	Q872 D873 S874 K880	Q872-R876 WeakPolarHBondContact O-CB 3.39Å; Q872-R876 PolarHBondContact O-N 3.24Å; D873-R876 CarbonylContact O-C 3.53Å; D873-R876 WeakPolarHBondContact O-CA 3.47Å; D873-R876 WeakPolarHBondContact O-CB 3.24Å; D873-R876 PolarHBondContact O-N 2.8Å; D873-R876 IonicContact OD1-CZ 3Å; D873-R876 IonicContact OD1-NE 2.82Å; D873-R876 PolarHBondContact OD1-NE 3.3Å; D873-R876 IonicContact OD1-NH2 3.17Å; D873-R876 PolarHBondContact OD1-NH2 3.39Å; D873-R876 IonicContact OD2-NH2 3.7Å; S874-R876 VanDerWaalsContact C-N 3.34Å; S874-R876 PolarHBondContact O-N 2.81Å; R876-K880 PolarHBondContact O-N 3.39Å
877	R	69.2	Low	67.9	Low	58 Å²	58	72 Å²	72	22%	0.219	34%	0.341	C	S	.	.	H	α-helix	trans	-74.1	-44	176.7	-67.5	162.7	-173.7	-152	4.9	112.3	D873 S874 K879 K880 N881 A1170 D1172	D873-R877 WeakPolarHBondContact O-CB 3.47Å; D873-R877 WeakPolarHBondContact O-CG 3Å; D873-R877 PolarHBondContact O-N 2.74Å; D873-R877 IonicContact OD1-NE 2.65Å; D873-R877 IonicContact OD2-CZ 3.84Å; D873-R877 IonicContact OD2-NE 2.59Å; D873-R877 PolarHBondContact OD2-NE 2.94Å; D873-R877 IonicContact OD2-NH2 3.53Å; D873-R877 PolarHBondContact OD2-NH2 3.02Å; S874-R877 PolarHBondContact O-N 3.39Å; R877-K879 VanDerWaalsContact C-N 3.26Å; R877-K879 PolarHBondContact O-N 2.93Å; R877-K880 WeakPolarHBondContact O-CA 3.38Å; R877-K880 WeakPolarHBondContact O-CB 3.46Å; R877-K880 PolarHBondContact O-N 3Å; R877-N881 PolarHBondContact O-N 3.03Å; R877-A1170 HydrophobicContact CB-CB 4.15Å; R877-A1170 WeakPolarHBondContact CD-O 3.49Å; R877-D1172 PolarHBondContact NH1-O 2.8Å
878	L	77.5	Confident	70.3	Confident	4 Å²	4	72.7 Å²	72.7	2%	0.021	34%	0.341	C	S	.	.	H	α-helix	trans	-57.4	-42.9	173.2	-170.7	71.6	0	0	0	110.1	S874 W875 K880 N881 A884 V885 G1166 L1167 A1170	S874-L878 VanDerWaalsContact O-CB 3.31Å; S874-L878 WeakPolarHBondContact O-CB 3.29Å; S874-L878 PolarHBondContact O-N 3.22Å; W875-L878 HydrophobicContact CE3-CD2 3.69Å; W875-L878 HydrophobicContact CZ3-CD2 3.58Å; L878-K880 VanDerWaalsContact C-N 3.28Å; L878-K880 PolarHBondContact O-N 2.81Å; L878-N881 CarbonylContact O-C 3.49Å; L878-N881 WeakPolarHBondContact O-CA 3.45Å; L878-N881 PolarHBondContact O-N 3.01Å; L878-A884 HydrophobicContact CD1-CB 3.74Å; L878-V885 VanDerWaalsContact O-CG2 3.27Å; L878-V885 WeakPolarHBondContact O-CG2 3.4Å; L878-G1166 VanDerWaalsContact CD1-C 3.4Å; L878-G1166 WeakPolarHBondContact CD1-O 3.4Å; L878-L1167 HydrophobicContact CD1-CD2 4.28Å; L878-L1167 HydrophobicContact CD1-CG 4.29Å; L878-L1167 HydrophobicContact CD2-CD2 4.04Å; L878-A1170 HydrophobicContact CB-CB 3.95Å; L878-A1170 HydrophobicContact CD1-CB 4.4Å
879	K	75	Confident	72.7	Confident	135 Å²	135	72.6 Å²	72.6	59%	0.587	34%	0.344	S	S	*	.	H	α-helix	trans	-60.4	-29	171.9	-80.3	178.2	173.7	-177.2	0	114.5	W875 R877	W875-K879 WeakPolarHBondContact O-CB 3.21Å; W875-K879 VanDerWaalsContact O-CG 3.32Å; W875-K879 WeakPolarHBondContact O-CG 3.31Å; W875-K879 PolarHBondContact O-N 3.05Å; R877-K879 VanDerWaalsContact C-N 3.26Å; R877-K879 PolarHBondContact O-N 2.93Å
880	K	73.3	Confident	74.6	Confident	155 Å²	155	73.9 Å²	73.9	67%	0.674	35%	0.35	S	S	*	.	H	α-helix	trans	-74.3	-32.5	171.7	-69.5	176.7	180	-177.3	0	111.6	R876 R877 L878 K882	R876-K880 PolarHBondContact O-N 3.39Å; R877-K880 WeakPolarHBondContact O-CA 3.38Å; R877-K880 WeakPolarHBondContact O-CB 3.46Å; R877-K880 PolarHBondContact O-N 3Å; L878-K880 VanDerWaalsContact C-N 3.28Å; L878-K880 PolarHBondContact O-N 2.81Å; K880-K882 PolarHBondContact O-N 2.97Å
881	N	78.7	Confident	76.2	Confident	48 Å²	48	73.2 Å²	73.2	26%	0.257	35%	0.348	S	S	.	.			trans	-76	86.4	173.8	-171.1	-27.1	0	0	0	111.3	R877 L878 A883 A884 V885	R877-N881 PolarHBondContact O-N 3.03Å; L878-N881 CarbonylContact O-C 3.49Å; L878-N881 WeakPolarHBondContact O-CA 3.45Å; L878-N881 PolarHBondContact O-N 3.01Å; N881-A883 PolarHBondContact O-N 2.92Å; N881-A883 PolarHBondContact OD1-N 2.95Å; N881-A884 HydrophobicContact CB-CB 4.08Å; N881-A884 PolarHBondContact O-N 3.35Å; N881-A884 VanDerWaalsContact O-N 3.11Å; N881-A884 PolarHBondContact OD1-N 2.89Å; N881-A884 VanDerWaalsContact OD1-N 3.12Å; N881-V885 PolarHBondContact O-N 3.37Å
882	K	79.4	Confident	77.9	Confident	164 Å²	164	71.8 Å²	71.8	71%	0.713	34%	0.339	S	S	*	.	H	α-helix	trans	-51.5	-39.5	179.7	-64.8	-179.7	-179.5	177.4	0	113.4	K880 V885 I886	K880-K882 PolarHBondContact O-N 2.97Å; K882-V885 PolarHBondContact O-N 2.74Å; K882-I886 WeakPolarHBondContact O-CB 2.9Å; K882-I886 WeakPolarHBondContact O-CD1 3.36Å; K882-I886 WeakPolarHBondContact O-CG1 3.25Å; K882-I886 PolarHBondContact O-N 2.93Å
883	A	79	Confident	79.4	Confident	41 Å²	41	67.7 Å²	67.7	34%	0.339	33%	0.325	S	S	.	.	H	α-helix	trans	-67	-39.1	-178.4	0	0	0	0	0	112	N881 S887 L1162	N881-A883 PolarHBondContact O-N 2.92Å; N881-A883 PolarHBondContact OD1-N 2.95Å; A883-S887 VanDerWaalsContact O-CB 3.3Å; A883-S887 WeakPolarHBondContact O-CB 3.35Å; A883-S887 PolarHBondContact O-N 3.18Å; A883-S887 PolarHBondContact O-OG 2.81Å; A883-L1162 HydrophobicContact CB-CD2 4.2Å
884	A	84	Confident	81	Confident	0 Å²	0	67.7 Å²	67.7	0%	0	33%	0.325	C	S	.	.	H	α-helix	trans	-69.9	-40.4	175.6	0	0	0	0	0	112.4	L878 N881 S887 M888	L878-A884 HydrophobicContact CD1-CB 3.74Å; N881-A884 HydrophobicContact CB-CB 4.08Å; N881-A884 PolarHBondContact O-N 3.35Å; N881-A884 VanDerWaalsContact O-N 3.11Å; N881-A884 PolarHBondContact OD1-N 2.89Å; N881-A884 VanDerWaalsContact OD1-N 3.12Å; A884-S887 PolarHBondContact O-N 3.48Å; A884-M888 WeakPolarHBondContact O-CB 3.41Å; A884-M888 PolarHBondContact O-N 3.38Å
885	V	86.4	Confident	82	Confident	43 Å²	43	69.3 Å²	69.3	26%	0.261	33%	0.334	S	S	.	.	H	α-helix	trans	-62.6	-46.5	174.3	178.9	0	0	0	0	111.3	L878 N881 K882 S887 M888 V889	L878-V885 VanDerWaalsContact O-CG2 3.27Å; L878-V885 WeakPolarHBondContact O-CG2 3.4Å; N881-V885 PolarHBondContact O-N 3.37Å; K882-V885 PolarHBondContact O-N 2.74Å; V885-S887 VanDerWaalsContact C-N 3.31Å; V885-S887 PolarHBondContact O-N 2.99Å; V885-M888 PolarHBondContact O-N 2.91Å; V885-V889 WeakPolarHBondContact O-CG2 3.2Å; V885-V889 PolarHBondContact O-N 2.98Å
886	I	87.9	Confident	82.7	Confident	100 Å²	100	65.2 Å²	65.2	51%	0.513	33%	0.327	S	S	.	.	H	α-helix	trans	-59.7	-44.9	176.2	-70.5	164.4	0	0	0	110	K882 M888 V889 L890	K882-I886 WeakPolarHBondContact O-CB 2.9Å; K882-I886 WeakPolarHBondContact O-CD1 3.36Å; K882-I886 WeakPolarHBondContact O-CG1 3.25Å; K882-I886 PolarHBondContact O-N 2.93Å; I886-M888 PolarHBondContact O-N 2.98Å; I886-V889 PolarHBondContact O-N 2.75Å; I886-L890 HydrophobicContact CG2-CD1 3.83Å; I886-L890 HydrophobicContact CG2-CG 4.35Å; I886-L890 WeakPolarHBondContact O-CB 3.36Å; I886-L890 VanDerWaalsContact O-CG 3.29Å; I886-L890 WeakPolarHBondContact O-CG 3.23Å; I886-L890 PolarHBondContact O-N 2.85Å
887	S	86.7	Confident	83.5	Confident	3 Å²	3	61.2 Å²	61.2	2%	0.021	32%	0.316	C	S	.	.	H	α-helix	trans	-64.5	-39.7	178.3	-60.8	0	0	0	0	112.9	A883 A884 V885 L890 L891 C1159 L1162	A883-S887 VanDerWaalsContact O-CB 3.3Å; A883-S887 WeakPolarHBondContact O-CB 3.35Å; A883-S887 PolarHBondContact O-N 3.18Å; A883-S887 PolarHBondContact O-OG 2.81Å; A884-S887 PolarHBondContact O-N 3.48Å; V885-S887 VanDerWaalsContact C-N 3.31Å; V885-S887 PolarHBondContact O-N 2.99Å; S887-L890 PolarHBondContact O-N 2.92Å; S887-L891 WeakPolarHBondContact O-CB 3.33Å; S887-L891 VanDerWaalsContact O-CG 3.3Å; S887-L891 WeakPolarHBondContact O-CG 3.1Å; S887-L891 PolarHBondContact O-N 3.01Å; S887-C1159 WeakPolarHBondContact CB-O 3.12Å; S887-L1162 WeakPolarHBondContact OG-CB 3.43Å; S887-L1162 WeakPolarHBondContact OG-CD1 3.41Å
888	M	88.5	Confident	84.1	Confident	41 Å²	41	58.7 Å²	58.7	20%	0.202	31%	0.308	C	S	.	.	H	α-helix	trans	-62.4	-45.9	173.7	-175.2	-178.7	66.5	0	0	111.5	W875 A884 V885 I886 L891 I892 L1163	W875-M888 HydrophobicContact CH2-CE 3.83Å; W875-M888 HydrophobicContact CH2-SD 3.79Å; W875-M888 HydrophobicContact CZ3-CE 4.46Å; W875-M888 HydrophobicContact CZ3-SD 4.03Å; A884-M888 WeakPolarHBondContact O-CB 3.41Å; A884-M888 PolarHBondContact O-N 3.38Å; V885-M888 PolarHBondContact O-N 2.91Å; I886-M888 PolarHBondContact O-N 2.98Å; M888-L891 PolarHBondContact O-N 2.87Å; M888-I892 HydrophobicContact CG-CD1 3.94Å; M888-I892 WeakPolarHBondContact O-CB 3.42Å; M888-I892 WeakPolarHBondContact O-CD1 3.46Å; M888-I892 VanDerWaalsContact O-CG1 3.24Å; M888-I892 WeakPolarHBondContact O-CG1 3.19Å; M888-I892 PolarHBondContact O-N 3.1Å; M888-L1163 HydrophobicContact CB-CD1 4.06Å; M888-L1163 HydrophobicContact CB-CD2 4.48Å; M888-L1163 HydrophobicContact CG-CD1 4.5Å
889	V	90.2	Very high	84.2	Confident	76 Å²	76	63.1 Å²	63.1	46%	0.461	33%	0.33	S	S	.	.	H	α-helix	trans	-64	-43.5	176.8	171.9	0	0	0	0	110.9	V885 I886 I892 V893	V885-V889 WeakPolarHBondContact O-CG2 3.2Å; V885-V889 PolarHBondContact O-N 2.98Å; I886-V889 PolarHBondContact O-N 2.75Å; V889-I892 PolarHBondContact O-N 3.23Å; V889-V893 WeakPolarHBondContact O-CB 3.38Å; V889-V893 VanDerWaalsContact O-CG2 3.31Å; V889-V893 WeakPolarHBondContact O-CG2 3.46Å; V889-V893 PolarHBondContact O-N 2.62Å
890	L	90.1	Very high	84.4	Confident	64 Å²	64	61.6 Å²	61.6	34%	0.335	33%	0.328	S	S	.	.	H	α-helix	trans	-61.6	-43.6	175.5	-73.4	171.6	0	0	0	111.9	I886 S887 V893 I894	I886-L890 HydrophobicContact CG2-CD1 3.83Å; I886-L890 HydrophobicContact CG2-CG 4.35Å; I886-L890 WeakPolarHBondContact O-CB 3.36Å; I886-L890 VanDerWaalsContact O-CG 3.29Å; I886-L890 WeakPolarHBondContact O-CG 3.23Å; I886-L890 PolarHBondContact O-N 2.85Å; S887-L890 PolarHBondContact O-N 2.92Å; L890-V893 PolarHBondContact O-N 2.96Å; L890-I894 WeakPolarHBondContact O-CB 3.11Å; L890-I894 WeakPolarHBondContact O-CD1 3.45Å; L890-I894 WeakPolarHBondContact O-CG1 3.45Å; L890-I894 PolarHBondContact O-N 3.04Å
891	L	90.3	Very high	84.5	Confident	10 Å²	10	54.7 Å²	54.7	5%	0.052	30%	0.299	C	S	.	.	H	α-helix	trans	-65	-42.3	175.8	-74	171.2	0	0	0	112.3	S887 M888 V893 I894 V895 C1159 F1160 L1163	S887-L891 WeakPolarHBondContact O-CB 3.33Å; S887-L891 VanDerWaalsContact O-CG 3.3Å; S887-L891 WeakPolarHBondContact O-CG 3.1Å; S887-L891 PolarHBondContact O-N 3.01Å; M888-L891 PolarHBondContact O-N 2.87Å; L891-V893 VanDerWaalsContact C-N 3.3Å; L891-V893 PolarHBondContact O-N 3.37Å; L891-I894 PolarHBondContact O-N 3.23Å; L891-V895 WeakPolarHBondContact O-CB 3.16Å; L891-V895 VanDerWaalsContact O-CG2 3.27Å; L891-V895 WeakPolarHBondContact O-CG2 3.42Å; L891-V895 PolarHBondContact O-N 2.86Å; L891-C1159 HydrophobicContact CD1-CB 4.07Å; L891-C1159 HydrophobicContact CD2-CB 3.93Å; L891-C1159 HydrophobicContact CG-CB 3.7Å; L891-F1160 HydrophobicContact CD1-CD1 3.7Å; L891-F1160 HydrophobicContact CD1-CD2 4.42Å; L891-F1160 HydrophobicContact CD1-CE1 3.84Å; L891-F1160 HydrophobicContact CD1-CG 3.99Å; L891-F1160 HydrophobicContact CD1-CZ 4.26Å; L891-F1160 HydrophobicContact CD2-CD1 4.38Å; L891-F1160 HydrophobicContact CD2-CD2 3.7Å; L891-F1160 HydrophobicContact CD2-CE1 4.21Å; L891-F1160 HydrophobicContact CD2-CE2 3.51Å; L891-F1160 HydrophobicContact CD2-CG 4.13Å; L891-F1160 HydrophobicContact CD2-CZ 3.77Å; L891-L1163 HydrophobicContact CD1-CB 4.35Å; L891-L1163 HydrophobicContact CD1-CD2 3.79Å
892	I	89.7	Confident	84.2	Confident	105 Å²	105	57.2 Å²	57.2	54%	0.538	31%	0.311	S	S	.	.	H	α-helix	trans	-59.5	-43.3	174.2	-70.9	164.9	0	0	0	110.3	M888 V889 A896	M888-I892 HydrophobicContact CG-CD1 3.94Å; M888-I892 WeakPolarHBondContact O-CB 3.42Å; M888-I892 WeakPolarHBondContact O-CD1 3.46Å; M888-I892 VanDerWaalsContact O-CG1 3.24Å; M888-I892 WeakPolarHBondContact O-CG1 3.19Å; M888-I892 PolarHBondContact O-N 3.1Å; V889-I892 PolarHBondContact O-N 3.23Å; I892-A896 WeakPolarHBondContact O-CB 3.49Å; I892-A896 PolarHBondContact O-N 3.17Å
893	V	88.3	Confident	83.9	Confident	69 Å²	69	57.6 Å²	57.6	42%	0.418	31%	0.313	S	S	.	.	H	α-helix	trans	-65.8	-44.5	176.3	168.4	0	0	0	0	111.8	V889 L890 L891 A896 I897	V889-V893 WeakPolarHBondContact O-CB 3.38Å; V889-V893 VanDerWaalsContact O-CG2 3.31Å; V889-V893 WeakPolarHBondContact O-CG2 3.46Å; V889-V893 PolarHBondContact O-N 2.62Å; L890-V893 PolarHBondContact O-N 2.96Å; L891-V893 VanDerWaalsContact C-N 3.3Å; L891-V893 PolarHBondContact O-N 3.37Å; V893-A896 PolarHBondContact O-N 3.27Å; V893-I897 HydrophobicContact CG1-CD1 3.7Å; V893-I897 HydrophobicContact CG1-CG1 4.42Å; V893-I897 WeakPolarHBondContact O-CB 3.36Å; V893-I897 VanDerWaalsContact O-CG1 3.23Å; V893-I897 WeakPolarHBondContact O-CG1 3.08Å; V893-I897 PolarHBondContact O-N 2.94Å
894	I	87.3	Confident	83.5	Confident	25 Å²	25	60.6 Å²	60.6	13%	0.128	33%	0.327	C	S	.	.	H	α-helix	trans	-65	-41.9	178.8	-69.8	162.2	0	0	0	111.2	L890 L891 S898 T975 L979 I1156	L890-I894 WeakPolarHBondContact O-CB 3.11Å; L890-I894 WeakPolarHBondContact O-CD1 3.45Å; L890-I894 WeakPolarHBondContact O-CG1 3.45Å; L890-I894 PolarHBondContact O-N 3.04Å; L891-I894 PolarHBondContact O-N 3.23Å; I894-S898 VanDerWaalsContact O-CB 3.3Å; I894-S898 WeakPolarHBondContact O-CB 3.45Å; I894-S898 PolarHBondContact O-N 2.96Å; I894-S898 PolarHBondContact O-OG 3.13Å; I894-T975 HydrophobicContact CG2-CG2 3.9Å; I894-L979 HydrophobicContact CG2-CD1 4.12Å; I894-I1156 HydrophobicContact CD1-CG1 4.14Å; I894-I1156 HydrophobicContact CG2-CD1 4.29Å; I894-I1156 HydrophobicContact CG2-CG1 4.19Å
895	V	85.7	Confident	82.9	Confident	39 Å²	39	62.7 Å²	62.7	24%	0.236	34%	0.341	C	S	.	.	H	α-helix	trans	-66.8	-44	175	171	0	0	0	0	110.6	L891 I897 S898 I899 L979 F983	L891-V895 WeakPolarHBondContact O-CB 3.16Å; L891-V895 VanDerWaalsContact O-CG2 3.27Å; L891-V895 WeakPolarHBondContact O-CG2 3.42Å; L891-V895 PolarHBondContact O-N 2.86Å; V895-I897 PolarHBondContact O-N 2.92Å; V895-S898 WeakPolarHBondContact O-CB 3.48Å; V895-S898 PolarHBondContact O-N 3.4Å; V895-S898 VanDerWaalsContact O-N 3.17Å; V895-I899 HydrophobicContact CG1-CD1 3.86Å; V895-I899 WeakPolarHBondContact O-CG1 3.21Å; V895-I899 PolarHBondContact O-N 3.46Å; V895-L979 HydrophobicContact CG2-CD1 4.25Å; V895-F983 HydrophobicContact CG2-CE2 4.2Å; V895-F983 HydrophobicContact CG2-CZ 4.25Å
896	A	84.5	Confident	82.2	Confident	39 Å²	39	64 Å²	64	32%	0.322	35%	0.351	S	S	.	.	H	α-helix	trans	-61	-44.5	175.7	0	0	0	0	0	112	I892 V893 S898 I899 L900	I892-A896 WeakPolarHBondContact O-CB 3.49Å; I892-A896 PolarHBondContact O-N 3.17Å; V893-A896 PolarHBondContact O-N 3.27Å; A896-S898 VanDerWaalsContact C-N 3.34Å; A896-S898 PolarHBondContact O-N 3.11Å; A896-I899 PolarHBondContact O-N 3.03Å; A896-L900 VanDerWaalsContact O-CB 3.31Å; A896-L900 WeakPolarHBondContact O-CB 3.02Å; A896-L900 VanDerWaalsContact O-CG 3.22Å; A896-L900 WeakPolarHBondContact O-CG 3.21Å; A896-L900 PolarHBondContact O-N 3.32Å
897	I	82.7	Confident	81.7	Confident	66 Å²	66	62.3 Å²	62.3	34%	0.338	34%	0.341	S	S	.	.	H	α-helix	trans	-60.3	-44.7	172.7	-70.7	165.9	0	0	0	110.4	V893 V895 I899 L900 T901 F972	V893-I897 HydrophobicContact CG1-CD1 3.7Å; V893-I897 HydrophobicContact CG1-CG1 4.42Å; V893-I897 WeakPolarHBondContact O-CB 3.36Å; V893-I897 VanDerWaalsContact O-CG1 3.23Å; V893-I897 WeakPolarHBondContact O-CG1 3.08Å; V893-I897 PolarHBondContact O-N 2.94Å; V895-I897 PolarHBondContact O-N 2.92Å; I897-I899 PolarHBondContact O-N 2.95Å; I897-L900 PolarHBondContact O-N 3.07Å; I897-T901 HydrophobicContact CG2-CG2 4Å; I897-T901 VanDerWaalsContact O-CB 3.31Å; I897-T901 WeakPolarHBondContact O-CB 3.45Å; I897-T901 WeakPolarHBondContact O-CG2 3.44Å; I897-T901 PolarHBondContact O-N 2.69Å; I897-T901 PolarHBondContact O-OG1 3.41Å; I897-F972 HydrophobicContact CG2-CD1 3.8Å; I897-F972 HydrophobicContact CG2-CE1 3.58Å; I897-F972 HydrophobicContact CG2-CZ 4.26Å
898	S	80.1	Confident	81.3	Confident	6 Å²	6	66.7 Å²	66.7	4%	0.042	36%	0.364	C	S	.	.	H	α-helix	trans	-62.9	-26.7	178.7	-60.4	0	0	0	0	113.3	I894 V895 A896 T901 R976	I894-S898 VanDerWaalsContact O-CB 3.3Å; I894-S898 WeakPolarHBondContact O-CB 3.45Å; I894-S898 PolarHBondContact O-N 2.96Å; I894-S898 PolarHBondContact O-OG 3.13Å; V895-S898 WeakPolarHBondContact O-CB 3.48Å; V895-S898 PolarHBondContact O-N 3.4Å; V895-S898 VanDerWaalsContact O-N 3.17Å; A896-S898 VanDerWaalsContact C-N 3.34Å; A896-S898 PolarHBondContact O-N 3.11Å; S898-T901 PolarHBondContact O-OG1 3.14Å; S898-R976 WeakPolarHBondContact O-CD 3.45Å; S898-R976 VanDerWaalsContact O-CG 3.26Å; S898-R976 WeakPolarHBondContact O-CG 3.42Å
899	I	80.5	Confident	80.9	Confident	97 Å²	97	65.6 Å²	65.6	50%	0.497	36%	0.36	S	S	.	.	H	α-helix	trans	-84.7	-49.3	173.7	-66	165.2	0	0	0	110.7	V895 A896 I897 T901 I902	V895-I899 HydrophobicContact CG1-CD1 3.86Å; V895-I899 WeakPolarHBondContact O-CG1 3.21Å; V895-I899 PolarHBondContact O-N 3.46Å; A896-I899 PolarHBondContact O-N 3.03Å; I897-I899 PolarHBondContact O-N 2.95Å; I899-T901 VanDerWaalsContact C-N 3.25Å; I899-T901 PolarHBondContact O-N 2.86Å; I899-I902 VanDerWaalsContact O-CB 3.27Å; I899-I902 WeakPolarHBondContact O-CB 3.16Å; I899-I902 WeakPolarHBondContact O-CD1 3.49Å; I899-I902 VanDerWaalsContact O-CG1 3.24Å; I899-I902 WeakPolarHBondContact O-CG1 3.43Å; I899-I902 PolarHBondContact O-N 2.92Å; I899-I902 VanDerWaalsContact O-N 3.07Å
900	L	79.4	Confident	80.5	Confident	102 Å²	102	64.2 Å²	64.2	53%	0.534	35%	0.354	S	S	.	.	H	α-helix	trans	-62.1	-29.9	-178.3	-72.1	167.6	0	0	0	113.1	A896 I897 I902 F903 V904	A896-L900 VanDerWaalsContact O-CB 3.31Å; A896-L900 WeakPolarHBondContact O-CB 3.02Å; A896-L900 VanDerWaalsContact O-CG 3.22Å; A896-L900 WeakPolarHBondContact O-CG 3.21Å; A896-L900 PolarHBondContact O-N 3.32Å; I897-L900 PolarHBondContact O-N 3.07Å; L900-I902 PolarHBondContact O-N 2.85Å; L900-I902 VanDerWaalsContact O-N 3.16Å; L900-F903 PolarHBondContact O-N 2.86Å; L900-V904 PolarHBondContact O-N 2.96Å
901	T	75.2	Confident	80.1	Confident	10 Å²	10	68.3 Å²	68.3	6%	0.061	37%	0.369	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.4	-0.6	176.3	51.6	0	0	0	0	114.1	I897 S898 I899 F903 F972	I897-T901 HydrophobicContact CG2-CG2 4Å; I897-T901 VanDerWaalsContact O-CB 3.31Å; I897-T901 WeakPolarHBondContact O-CB 3.45Å; I897-T901 WeakPolarHBondContact O-CG2 3.44Å; I897-T901 PolarHBondContact O-N 2.69Å; I897-T901 PolarHBondContact O-OG1 3.41Å; S898-T901 PolarHBondContact O-OG1 3.14Å; I899-T901 VanDerWaalsContact C-N 3.25Å; I899-T901 PolarHBondContact O-N 2.86Å; T901-F903 VanDerWaalsContact C-N 3.25Å; T901-F972 HydrophobicContact CG2-CB 3.76Å; T901-F972 HydrophobicContact CG2-CD1 4.04Å; T901-F972 HydrophobicContact CG2-CD2 3.41Å; T901-F972 VanDerWaalsContact CG2-CD2 3.41Å; T901-F972 HydrophobicContact CG2-CE1 4.44Å; T901-F972 HydrophobicContact CG2-CE2 3.85Å; T901-F972 HydrophobicContact CG2-CG 3.5Å; T901-F972 VanDerWaalsContact CG2-CG 3.5Å; T901-F972 HydrophobicContact CG2-CZ 4.34Å
902	I	71.9	Confident	79.7	Confident	102 Å²	102	72.9 Å²	72.9	52%	0.523	39%	0.39	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-34.8	158.8	-64.7	169.1	0	0	0	110.6	I899 L900	I899-I902 VanDerWaalsContact O-CB 3.27Å; I899-I902 WeakPolarHBondContact O-CB 3.16Å; I899-I902 WeakPolarHBondContact O-CD1 3.49Å; I899-I902 VanDerWaalsContact O-CG1 3.24Å; I899-I902 WeakPolarHBondContact O-CG1 3.43Å; I899-I902 PolarHBondContact O-N 2.92Å; I899-I902 VanDerWaalsContact O-N 3.07Å; L900-I902 PolarHBondContact O-N 2.85Å; L900-I902 VanDerWaalsContact O-N 3.16Å
903	F	73.8	Confident	79.4	Confident	172 Å²	172	70 Å²	70	75%	0.754	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.9	-27.1	-176.6	-53	-79.9	0	0	0	113.4	L900 T901	L900-F903 PolarHBondContact O-N 2.86Å; T901-F903 VanDerWaalsContact C-N 3.25Å
904	V	69.6	Low	79.1	Confident	103 Å²	103	71.7 Å²	71.7	62%	0.624	39%	0.386	S	S	*	.			trans	-122.9	48.3	-170.3	-158.9	0	0	0	0	112	L900	L900-V904 PolarHBondContact O-N 2.96Å
905	S	72.8	Confident	78.8	Confident	44 Å²	44	76.3 Å²	76.3	31%	0.308	41%	0.411	S	S	.	.			trans	-84.4	122.2	169.7	-157.9	0	0	0	0	109.3	H907	S905-H907 PolarHBondContact O-N 2.91Å; S905-H907 PolarHBondContact OG-O 2.81Å; S905-H907 VanDerWaalsContact OG-O 3.11Å
906	P	71.6	Confident	78.9	Confident	72 Å²	72	76 Å²	76	47%	0.468	41%	0.406	S	S	.	.	S	Bend	trans	-58.1	-34.8	-176.5	-27.6	35.1	0	0	0	114.3	L968 S969	P906-L968 HydrophobicContact CG-CD2 4.19Å; P906-S969 WeakPolarHBondContact CD-OG 3.06Å
907	H	76.1	Confident	79.1	Confident	64 Å²	64	77.5 Å²	77.5	30%	0.296	41%	0.408	S	S	.	.	S	Bend	trans	-139.7	170.5	178.2	-58.2	98.7	0	0	0	110.1	S905 P909 Y956 D966 S969	S905-H907 PolarHBondContact O-N 2.91Å; S905-H907 PolarHBondContact OG-O 2.81Å; S905-H907 VanDerWaalsContact OG-O 3.11Å; H907-P909 WeakPolarHBondContact O-CD 3.06Å; H907-Y956 AromaticContact CE1-CD1 3.69Å; H907-Y956 AromaticContact CE1-CE1 3.3Å; H907-Y956 WeakPolarHBondContact CE1-CE1 3.47Å; H907-Y956 AromaticContact ND1-CD1 3.96Å; H907-Y956 AromaticContact ND1-CE1 3.62Å; H907-Y956 AromaticContact NE2-CE1 3.55Å; H907-D966 HydrophobicContact CB-CB 3.84Å; H907-D966 IonicContact CE1-OD2 2.88Å; H907-D966 IonicContact CG-OD2 3.82Å; H907-D966 IonicContact ND1-OD2 2.64Å; H907-D966 PolarHBondContact ND1-OD2 3.36Å; H907-S969 PolarHBondContact N-OG 3.4Å; H907-S969 WeakPolarHBondContact O-CB 3.23Å; H907-S969 PolarHBondContact O-OG 3.3Å
908	N	78.7	Confident	79.2	Confident	95 Å²	95	76.9 Å²	76.9	51%	0.508	41%	0.405	S	S	.	.			trans	-77.1	117.2	171.1	177.9	-29.4	0	0	0	109.7	S910 K911	N908-S910 PolarHBondContact O-N 3.48Å; N908-S910 VanDerWaalsContact O-N 3.12Å; N908-S910 PolarHBondContact OD1-N 3.06Å; N908-K911 HydrophobicContact CB-CB 3.76Å; N908-K911 PolarHBondContact O-N 2.96Å; N908-K911 VanDerWaalsContact O-N 3.15Å; N908-K911 PolarHBondContact OD1-N 3.43Å
909	P	81.5	Confident	79.6	Confident	18 Å²	18	76.7 Å²	76.7	12%	0.117	40%	0.404	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.9	-11.8	-174.6	27.9	-37.1	0	0	0	115.3	H907 R970 M973	H907-P909 WeakPolarHBondContact O-CD 3.06Å; P909-R970 HydrophobicContact CB-CB 4.46Å; P909-R970 HydrophobicContact CB-CG 3.82Å; P909-R970 WeakPolarHBondContact O-CD 3.33Å; P909-R970 WeakPolarHBondContact O-CG 3.07Å; P909-R970 PolarHBondContact O-NH1 2.93Å; P909-R970 VanDerWaalsContact O-NH1 3.09Å; P909-M973 HydrophobicContact CB-CB 4.18Å; P909-M973 HydrophobicContact CB-SD 3.95Å; P909-M973 HydrophobicContact CG-CB 4.06Å; P909-M973 HydrophobicContact CG-CG 4.36Å; P909-M973 HydrophobicContact CG-SD 3.42Å; P909-M973 WeakPolarHBondContact CG-SD 3.45Å
910	S	80.9	Confident	79.9	Confident	46 Å²	46	72.3 Å²	72.3	32%	0.322	38%	0.382	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106.8	-13	176.5	-60.3	0	0	0	0	113.2	N908 Q912	N908-S910 PolarHBondContact O-N 3.48Å; N908-S910 VanDerWaalsContact O-N 3.12Å; N908-S910 PolarHBondContact OD1-N 3.06Å; S910-Q912 PolarHBondContact O-N 3.04Å
911	K	80.6	Confident	80.4	Confident	151 Å²	151	68 Å²	68	66%	0.657	36%	0.36	S	S	*	.			trans	-75.4	115.4	179	-174.3	-178	177.8	-172.1	0	109.5	N908	N908-K911 HydrophobicContact CB-CB 3.76Å; N908-K911 PolarHBondContact O-N 2.96Å; N908-K911 VanDerWaalsContact O-N 3.15Å; N908-K911 PolarHBondContact OD1-N 3.43Å
912	Q	83.3	Confident	80.9	Confident	105 Å²	105	69.7 Å²	69.7	49%	0.491	37%	0.365	S	S	.	.			trans	-72.7	150.4	172.6	-56.4	178.6	11.3	0	0	110.2	S910 L963 R965	S910-Q912 PolarHBondContact O-N 3.04Å; Q912-L963 CarbonylContact C-O 3.56Å; Q912-L963 WeakPolarHBondContact CA-O 3.36Å; Q912-L963 HydrophobicContact CB-CB 4.44Å; Q912-L963 HydrophobicContact CG-CB 4.09Å; Q912-L963 HydrophobicContact CG-CD1 4.44Å; Q912-R965 HydrophobicContact CG-CG 4.37Å
913	N	83	Confident	81.5	Confident	45 Å²	45	66.9 Å²	66.9	24%	0.241	35%	0.353	C	S	.	.			trans	-144	92	175.1	-169.8	1.5	0	0	0	110.2	D915 F916 L963 G964	N913-D915 PolarHBondContact O-N 3.46Å; N913-F916 WeakPolarHBondContact ND2-CD2 3.46Å; N913-F916 WeakPolarHBondContact ND2-CE2 3.17Å; N913-F916 PolarHBondContact O-N 3.4Å; N913-F916 VanDerWaalsContact O-N 3.1Å; N913-L963 PolarHBondContact N-O 2.94Å; N913-G964 WeakPolarHBondContact O-CA 3.43Å
914	V	81.7	Confident	81.7	Confident	105 Å²	105	62.9 Å²	62.9	64%	0.636	34%	0.344	S	S	*	.	G	3₁₀ helix	trans	-62.4	-28.6	-167.9	-172.5	0	0	0	0	112.6	F916 I917	V914-F916 VanDerWaalsContact C-N 3.32Å; V914-F916 PolarHBondContact O-N 2.92Å; V914-I917 WeakPolarHBondContact O-CG2 3.34Å
915	D	82.1	Confident	82.1	Confident	122 Å²	122	62.1 Å²	62.1	65%	0.652	36%	0.357	S	S	*	.	G	3₁₀ helix	trans	-71.1	-29.5	-179.6	-50.2	-46.5	0	0	0	112.1	N913	N913-D915 PolarHBondContact O-N 3.46Å
916	F	87.1	Confident	82.4	Confident	31 Å²	31	63.6 Å²	63.6	14%	0.136	36%	0.361	C	S	.	.	G	3₁₀ helix	trans	-108.3	36.1	-173.9	-61.7	-12.7	0	0	0	112.5	N913 V914 L919 A948 V950 Y956 T960 G964	N913-F916 WeakPolarHBondContact ND2-CD2 3.46Å; N913-F916 WeakPolarHBondContact ND2-CE2 3.17Å; N913-F916 PolarHBondContact O-N 3.4Å; N913-F916 VanDerWaalsContact O-N 3.1Å; V914-F916 VanDerWaalsContact C-N 3.32Å; V914-F916 PolarHBondContact O-N 2.92Å; F916-L919 HydrophobicContact CB-CD1 3.78Å; F916-L919 HydrophobicContact CG-CD1 4.28Å; F916-A948 WeakPolarHBondContact CE1-O 3.2Å; F916-V950 HydrophobicContact CD1-CG2 3.85Å; F916-V950 HydrophobicContact CE1-CB 4.41Å; F916-V950 HydrophobicContact CE1-CG2 3.91Å; F916-V950 HydrophobicContact CE2-CG1 4.45Å; F916-V950 HydrophobicContact CG-CG2 4.35Å; F916-V950 HydrophobicContact CZ-CG1 4.41Å; F916-V950 HydrophobicContact CZ-CG2 4.44Å; F916-Y956 HydrophobicContact CB-CE2 4.44Å; F916-Y956 AromaticContact CD2-CE2 3.93Å; F916-Y956 HydrophobicContact CD2-CE2 3.93Å; F916-Y956 WeakPolarHBondContact CD2-OH 3.11Å; F916-T960 WeakPolarHBondContact O-CB 3.29Å; F916-T960 PolarHBondContact O-OG1 2.97Å; F916-G964 WeakPolarHBondContact O-CA 3.28Å
917	I	87.6	Confident	82.7	Confident	71 Å²	71	66.9 Å²	66.9	36%	0.364	38%	0.375	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70	144.2	177.5	54	170.6	0	0	0	113.2	V914 L919	V914-I917 WeakPolarHBondContact O-CG2 3.34Å; I917-L919 PolarHBondContact O-N 2.97Å; I917-L919 VanDerWaalsContact O-N 3.15Å
918	N	86.6	Confident	82.8	Confident	53 Å²	53	68.4 Å²	68.4	28%	0.283	38%	0.384	S	S	.	.	T	Hydrogen-bonded Turn	trans	57.9	25.7	169	-46.1	-57.3	0	0	0	115.6	T960 D961 G962 L1142	N918-T960 PolarHBondContact N-OG1 3.14Å; N918-D961 PolarHBondContact N-O 3.05Å; N918-D961 VanDerWaalsContact N-O 3.07Å; N918-G962 VanDerWaalsContact OD1-CA 3.29Å; N918-G962 WeakPolarHBondContact OD1-CA 3.33Å; N918-L1142 HydrophobicContact CB-CD1 4.06Å; N918-L1142 HydrophobicContact CB-CD2 4.01Å; N918-L1142 WeakPolarHBondContact OD1-CD1 3.5Å
919	L	88.4	Confident	82.5	Confident	2 Å²	2	68.7 Å²	68.7	1%	0.01	39%	0.386	C	S	.	.	P	Polyproline II helix	trans	-68.4	130.3	178.2	-65.1	176.9	0	0	0	109.8	F916 I917 K944 Y945 A948 V950 Y956 G959 T960 Y1144	F916-L919 HydrophobicContact CB-CD1 3.78Å; F916-L919 HydrophobicContact CG-CD1 4.28Å; I917-L919 PolarHBondContact O-N 2.97Å; I917-L919 VanDerWaalsContact O-N 3.15Å; L919-K944 HydrophobicContact CD2-CB 4.05Å; L919-K944 WeakPolarHBondContact CD2-O 3.33Å; L919-Y945 HydrophobicContact CB-CE2 4.14Å; L919-Y945 HydrophobicContact CD1-CE1 4.25Å; L919-A948 HydrophobicContact CD2-CB 4.13Å; L919-V950 HydrophobicContact CD1-CG2 3.75Å; L919-V950 HydrophobicContact CD2-CG2 4.3Å; L919-Y956 HydrophobicContact CD1-CD2 3.64Å; L919-Y956 HydrophobicContact CD1-CE2 3.83Å; L919-G959 CarbonylContact O-C 3.6Å; L919-G959 WeakPolarHBondContact O-CA 3.49Å; L919-T960 HydrophobicContact CB-CG2 4.3Å; L919-T960 WeakPolarHBondContact CB-OG1 3.34Å; L919-T960 HydrophobicContact CD1-CG2 4.28Å; L919-T960 PolarHBondContact N-OG1 3.35Å; L919-T960 PolarHBondContact O-N 3.27Å; L919-Y1144 PolarHBondContact O-OH 2.92Å; L919-Y1144 VanDerWaalsContact O-OH 3.05Å
920	P	87	Confident	82.1	Confident	6 Å²	6	69.3 Å²	69.3	4%	0.039	40%	0.395	C	S	.	.	P	Polyproline II helix	trans	-69	165.6	174.8	31.4	-35.4	0	0	0	111.1	R922 G933 T935 K944 Y945	P920-R922 PolarHBondContact O-N 2.98Å; P920-G933 VanDerWaalsContact CG-O 3.31Å; P920-G933 WeakPolarHBondContact CG-O 3.29Å; P920-T935 HydrophobicContact CG-CG2 4.4Å; P920-K944 HydrophobicContact CG-CB 3.95Å; P920-K944 HydrophobicContact CG-CG 4.26Å; P920-Y945 HydrophobicContact CG-CE2 4.46Å; P920-Y945 VanDerWaalsContact O-CE2 3.28Å; P920-Y945 WeakPolarHBondContact O-CE2 3.45Å; P920-Y945 PolarHBondContact O-OH 2.97Å
921	P	89.7	Confident	82.1	Confident	10 Å²	10	70.3 Å²	70.3	7%	0.065	40%	0.397	C	S	.	.	P	Polyproline II helix	trans	-52.2	132.2	170.2	-26.4	34.9	0	0	0	112.9	L931 G933 Y1144	P921-L931 HydrophobicContact CB-CD2 3.97Å; P921-L931 CarbonylContact O-C 3.57Å; P921-L931 WeakPolarHBondContact O-CA 3.39Å; P921-G933 PolarHBondContact O-N 3.13Å; P921-Y1144 HydrophobicContact CG-CD2 4.46Å; P921-Y1144 HydrophobicContact CG-CG 4.47Å
922	R	85.4	Confident	82.2	Confident	46 Å²	46	63.9 Å²	63.9	17%	0.174	37%	0.369	C	S	.	.	B	Isolated β-bridge	trans	-128.6	105.7	170.9	-171.6	177.3	-174.4	-150.8	9.1	109.4	P920 L931 Y945 D952 N955 Y956	P920-R922 PolarHBondContact O-N 2.98Å; R922-L931 CarbonylContact C-O 3.53Å; R922-L931 WeakPolarHBondContact CA-O 3.37Å; R922-Y945 HydrophobicContact CB-CD2 4.25Å; R922-Y945 HydrophobicContact CB-CE1 3.93Å; R922-Y945 HydrophobicContact CB-CE2 3.58Å; R922-Y945 WeakPolarHBondContact CB-OH 3.3Å; R922-Y945 VanDerWaalsContact CD-CD1 3.46Å; R922-Y945 HydrophobicContact CG-CE1 4.44Å; R922-Y945 HydrophobicContact CG-CE2 4.32Å; R922-D952 IonicContact NH2-OD1 3.06Å; R922-N955 WeakPolarHBondContact CD-OD1 3.44Å; R922-N955 WeakPolarHBondContact CG-OD1 3.42Å; R922-N955 PolarHBondContact NE-OD1 3.06Å; R922-N955 PolarHBondContact NH1-OD1 3.17Å; R922-Y956 PolarHBondContact N-O 2.91Å; R922-Y956 VanDerWaalsContact N-O 3.11Å
923	V	83.8	Confident	82.2	Confident	44 Å²	44	58.9 Å²	58.9	27%	0.267	35%	0.346	S	S	.	.			trans	-99.9	118.8	174.9	-174.7	0	0	0	0	108.4	G925 L926 L931	V923-G925 PolarHBondContact O-N 2.98Å; V923-L926 HydrophobicContact CB-CB 4.05Å; V923-L926 HydrophobicContact CB-CD1 4.15Å; V923-L926 HydrophobicContact CG1-CB 4.26Å; V923-L926 HydrophobicContact CG1-CD1 3.77Å; V923-L926 PolarHBondContact O-N 2.6Å; V923-L926 VanDerWaalsContact O-N 3.14Å; V923-L931 PolarHBondContact N-O 3.47Å
924	P	77.4	Confident	82.2	Confident	87 Å²	87	60.2 Å²	60.2	57%	0.565	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.1	131.7	-178.6	-29.7	36.7	0	0	0	113.3	L926 N955	P924-L926 VanDerWaalsContact C-N 3.27Å; P924-L926 PolarHBondContact O-N 3.46Å; P924-N955 HydrophobicContact CG-CB 4.36Å
925	G	79.1	Confident	82.1	Confident	87 Å²	87	57.7 Å²	57.7	90%	0.897	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.5	-9.6	-179.9	0	0	0	0	0	116.1	V923 N927	V923-G925 PolarHBondContact O-N 2.98Å; G925-N927 PolarHBondContact O-N 2.91Å
926	L	79.5	Confident	81.9	Confident	75 Å²	75	57.7 Å²	57.7	39%	0.393	33%	0.332	S	S	.	.			trans	-95.9	98.3	-174	-113.5	165.1	0	0	0	112	V923 P924 I928 N932	V923-L926 HydrophobicContact CB-CB 4.05Å; V923-L926 HydrophobicContact CB-CD1 4.15Å; V923-L926 HydrophobicContact CG1-CB 4.26Å; V923-L926 HydrophobicContact CG1-CD1 3.77Å; V923-L926 PolarHBondContact O-N 2.6Å; V923-L926 VanDerWaalsContact O-N 3.14Å; P924-L926 VanDerWaalsContact C-N 3.27Å; P924-L926 PolarHBondContact O-N 3.46Å; L926-I928 HydrophobicContact CD2-CD1 3.62Å; L926-I928 HydrophobicContact CD2-CG1 3.83Å; L926-I928 PolarHBondContact O-N 3.28Å; L926-N932 WeakPolarHBondContact O-CB 3.5Å
927	N	76.8	Confident	81	Confident	142 Å²	142	58.6 Å²	58.6	76%	0.759	34%	0.34	S	S	*	.			trans	-81.7	37.1	-175	-111.8	-24	0	0	0	114.6	G925	G925-N927 PolarHBondContact O-N 2.91Å
928	I	78.3	Confident	80.3	Confident	95 Å²	95	60.9 Å²	60.9	49%	0.487	37%	0.37	S	S	.	.			trans	-95.5	127.7	176.4	-60.6	179.6	0	0	0	109.1	L926 G930 L931 N932	L926-I928 HydrophobicContact CD2-CD1 3.62Å; L926-I928 HydrophobicContact CD2-CG1 3.83Å; L926-I928 PolarHBondContact O-N 3.28Å; I928-G930 PolarHBondContact O-N 2.79Å; I928-L931 HydrophobicContact CB-CB 4.33Å; I928-L931 HydrophobicContact CB-CD1 4.4Å; I928-L931 HydrophobicContact CG2-CD1 4.39Å; I928-L931 CarbonylContact O-C 3.45Å; I928-L931 WeakPolarHBondContact O-CA 3.18Å; I928-L931 PolarHBondContact O-N 2.68Å; I928-N932 WeakPolarHBondContact O-CB 3.41Å; I928-N932 PolarHBondContact O-N 2.85Å; I928-N932 PolarHBondContact O-OD1 3.12Å
929	N	72.9	Confident	79.7	Confident	102 Å²	102	61.1 Å²	61.1	55%	0.545	38%	0.384	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.7	129.8	178.2	-70.6	-14.8	0	0	0	111.3	L931 N932 L941	N929-L931 VanDerWaalsContact C-N 3.33Å; N929-N932 WeakPolarHBondContact CA-OD1 3.19Å; N929-N932 PolarHBondContact OD1-ND2 2.86Å; N929-L941 HydrophobicContact CB-CD1 4.27Å
930	G	72.2	Confident	79.1	Confident	30 Å²	30	68 Å²	68	31%	0.309	42%	0.416	S	S	.	.	T	Hydrogen-bonded Turn	trans	87.2	-9.6	-171.2	0	0	0	0	0	115.3	I928 N932 K934	I928-G930 PolarHBondContact O-N 2.79Å; G930-N932 PolarHBondContact N-OD1 2.93Å; G930-K934 PolarHBondContact N-O 3.22Å; G930-K934 VanDerWaalsContact N-O 3.07Å
931	L	81.8	Confident	78.7	Confident	68 Å²	68	71.4 Å²	71.4	36%	0.356	43%	0.434	S	S	.	.	T	Hydrogen-bonded Turn	trans	-119.9	-6.9	169.1	-62.9	178.8	0	0	0	113.1	P921 R922 V923 I928 N929	P921-L931 HydrophobicContact CB-CD2 3.97Å; P921-L931 CarbonylContact O-C 3.57Å; P921-L931 WeakPolarHBondContact O-CA 3.39Å; R922-L931 CarbonylContact C-O 3.53Å; R922-L931 WeakPolarHBondContact CA-O 3.37Å; V923-L931 PolarHBondContact N-O 3.47Å; I928-L931 HydrophobicContact CB-CB 4.33Å; I928-L931 HydrophobicContact CB-CD1 4.4Å; I928-L931 HydrophobicContact CG2-CD1 4.39Å; I928-L931 CarbonylContact O-C 3.45Å; I928-L931 WeakPolarHBondContact O-CA 3.18Å; I928-L931 PolarHBondContact O-N 2.68Å; N929-L931 VanDerWaalsContact C-N 3.33Å
932	N	82.3	Confident	78.3	Confident	16 Å²	16	72.6 Å²	72.6	9%	0.086	44%	0.441	C	S	.	.	B	Isolated β-bridge	trans	-99	13.4	-178.2	61.3	-3.1	0	0	0	113.4	L926 I928 N929 G930 K934	L926-N932 WeakPolarHBondContact O-CB 3.5Å; I928-N932 WeakPolarHBondContact O-CB 3.41Å; I928-N932 PolarHBondContact O-N 2.85Å; I928-N932 PolarHBondContact O-OD1 3.12Å; N929-N932 WeakPolarHBondContact CA-OD1 3.19Å; N929-N932 PolarHBondContact OD1-ND2 2.86Å; G930-N932 PolarHBondContact N-OD1 2.93Å; N932-K934 PolarHBondContact O-N 3.22Å; N932-K934 VanDerWaalsContact OD1-CB 3.29Å; N932-K934 WeakPolarHBondContact OD1-CB 3.3Å; N932-K934 PolarHBondContact OD1-N 2.86Å; N932-K934 PolarHBondContact OD1-O 3.18Å
933	G	83.7	Confident	78.3	Confident	0 Å²	0	72.3 Å²	72.3	0%	0	44%	0.443	C	S	.	.	S	Bend	trans	77.3	-2.8	-171.6	0	0	0	0	0	115	P920 P921 K944	P920-G933 VanDerWaalsContact CG-O 3.31Å; P920-G933 WeakPolarHBondContact CG-O 3.29Å; P921-G933 PolarHBondContact O-N 3.13Å; G933-K944 PolarHBondContact O-N 3.25Å
934	K	83.1	Confident	78.3	Confident	72 Å²	72	72.6 Å²	72.6	31%	0.313	44%	0.44	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	140.1	179.9	-45.5	-167.1	176.6	-171.7	0	111.6	G930 N932 L941 V942 D943	G930-K934 PolarHBondContact N-O 3.22Å; G930-K934 VanDerWaalsContact N-O 3.07Å; N932-K934 PolarHBondContact O-N 3.22Å; N932-K934 VanDerWaalsContact OD1-CB 3.29Å; N932-K934 WeakPolarHBondContact OD1-CB 3.3Å; N932-K934 PolarHBondContact OD1-N 2.86Å; N932-K934 PolarHBondContact OD1-O 3.18Å; K934-L941 HydrophobicContact CB-CD1 4.25Å; K934-L941 HydrophobicContact CB-CG 4.11Å; K934-L941 HydrophobicContact CD-CD2 4.48Å; K934-V942 VanDerWaalsContact CA-O 3.29Å; K934-V942 WeakPolarHBondContact CA-O 3.37Å; K934-D943 HydrophobicContact CD-CB 4.29Å; K934-D943 WeakPolarHBondContact CE-OD2 3.07Å; K934-D943 HydrophobicContact CG-CB 4.02Å
935	T	80.1	Confident	78.8	Confident	52 Å²	52	68.6 Å²	68.6	32%	0.319	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	160.5	179.8	-166.5	0	0	0	0	111.3	P920 V937 V942 K944	P920-T935 HydrophobicContact CG-CG2 4.4Å; T935-V937 HydrophobicContact CG2-CG2 3.88Å; T935-V937 PolarHBondContact O-N 2.69Å; T935-V942 PolarHBondContact N-O 3.39Å; T935-V942 PolarHBondContact O-N 3.16Å; T935-K944 HydrophobicContact CG2-CG 3.73Å
936	M	77	Confident	78.9	Confident	122 Å²	122	68 Å²	68	60%	0.601	40%	0.4	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77.8	118.1	176.9	-64.8	-66.1	-75.5	0	0	109.8	G939 E940 L941	M936-G939 WeakPolarHBondContact CE-O 3.39Å; M936-E940 CarbonylContact C-O 3.55Å; M936-E940 WeakPolarHBondContact CA-O 3.41Å; M936-L941 HydrophobicContact SD-CB 4.1Å; M936-L941 HydrophobicContact SD-CD1 3.95Å
937	V	68.7	Low	79.2	Confident	51 Å²	51	69.8 Å²	69.8	31%	0.309	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	120.7	176.2	-174.8	0	0	0	0	107.9	T935 G939 E940 V942	T935-V937 HydrophobicContact CG2-CG2 3.88Å; T935-V937 PolarHBondContact O-N 2.69Å; V937-G939 PolarHBondContact O-N 3.01Å; V937-E940 PolarHBondContact N-O 3.41Å; V937-E940 PolarHBondContact O-N 2.95Å; V937-V942 HydrophobicContact CB-CB 4.25Å; V937-V942 HydrophobicContact CB-CG2 3.92Å; V937-V942 HydrophobicContact CG2-CB 3.96Å; V937-V942 HydrophobicContact CG2-CG2 4.21Å
938	A	72.8	Confident	79.5	Confident	119 Å²	119	64.4 Å²	64.4	98%	0.983	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.2	14.7	-178.3	0	0	0	0	0	116.2
939	G	74.1	Confident	79.8	Confident	57 Å²	57	67 Å²	67	59%	0.588	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	109.9	-13.3	-177.3	0	0	0	0	0	114.7	M936 V937	M936-G939 WeakPolarHBondContact CE-O 3.39Å; V937-G939 PolarHBondContact O-N 3.01Å
940	E	76.2	Confident	80.3	Confident	148 Å²	148	62.6 Å²	62.6	69%	0.692	37%	0.374	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-103.6	151	178.2	-63.4	-166.7	156.7	0	0	112.5	M936 V937 V942	M936-E940 CarbonylContact C-O 3.55Å; M936-E940 WeakPolarHBondContact CA-O 3.41Å; V937-E940 PolarHBondContact N-O 3.41Å; V937-E940 PolarHBondContact O-N 2.95Å; E940-V942 HydrophobicContact CB-CG2 4.4Å; E940-V942 PolarHBondContact O-N 3Å
941	L	77.9	Confident	80.8	Confident	76 Å²	76	64.1 Å²	64.1	40%	0.398	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	86.8	179.5	-173	78.4	0	0	0	110.6	N929 K934 M936	N929-L941 HydrophobicContact CB-CD1 4.27Å; K934-L941 HydrophobicContact CB-CD1 4.25Å; K934-L941 HydrophobicContact CB-CG 4.11Å; K934-L941 HydrophobicContact CD-CD2 4.48Å; M936-L941 HydrophobicContact SD-CB 4.1Å; M936-L941 HydrophobicContact SD-CD1 3.95Å
942	V	81.3	Confident	80.5	Confident	36 Å²	36	67.4 Å²	67.4	22%	0.218	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	134.6	-175.2	179.9	0	0	0	0	111.1	K934 T935 V937 E940 K944	K934-V942 VanDerWaalsContact CA-O 3.29Å; K934-V942 WeakPolarHBondContact CA-O 3.37Å; T935-V942 PolarHBondContact N-O 3.39Å; T935-V942 PolarHBondContact O-N 3.16Å; V937-V942 HydrophobicContact CB-CB 4.25Å; V937-V942 HydrophobicContact CB-CG2 3.92Å; V937-V942 HydrophobicContact CG2-CB 3.96Å; V937-V942 HydrophobicContact CG2-CG2 4.21Å; E940-V942 HydrophobicContact CB-CG2 4.4Å; E940-V942 PolarHBondContact O-N 3Å; V942-K944 PolarHBondContact O-N 2.98Å
943	D	85.2	Confident	80.3	Confident	39 Å²	39	73.3 Å²	73.3	21%	0.209	43%	0.428	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	113.7	167.7	-166.4	-49.7	0	0	0	110	K934 Y945 A946 Q947	K934-D943 HydrophobicContact CD-CB 4.29Å; K934-D943 WeakPolarHBondContact CE-OD2 3.07Å; K934-D943 HydrophobicContact CG-CB 4.02Å; D943-Y945 PolarHBondContact OD1-N 2.94Å; D943-A946 HydrophobicContact CB-CB 4.12Å; D943-A946 PolarHBondContact OD1-N 3.22Å; D943-A946 VanDerWaalsContact OD1-N 3.11Å; D943-Q947 WeakPolarHBondContact O-CB 3.41Å; D943-Q947 PolarHBondContact O-N 3.07Å
944	K	83.5	Confident	80.3	Confident	51 Å²	51	75 Å²	75	22%	0.222	44%	0.437	C	S	.	.	H	α-helix	trans	-79.5	-20.4	-175.1	-86.6	-74	179.7	-168.4	0	113.7	L919 P920 G933 T935 V942 A948	L919-K944 HydrophobicContact CD2-CB 4.05Å; L919-K944 WeakPolarHBondContact CD2-O 3.33Å; P920-K944 HydrophobicContact CG-CB 3.95Å; P920-K944 HydrophobicContact CG-CG 4.26Å; G933-K944 PolarHBondContact O-N 3.25Å; T935-K944 HydrophobicContact CG2-CG 3.73Å; V942-K944 PolarHBondContact O-N 2.98Å; K944-A948 WeakPolarHBondContact O-CB 3.24Å; K944-A948 PolarHBondContact O-N 2.66Å
945	Y	87.5	Confident	80.4	Confident	3 Å²	3	73.3 Å²	73.3	1%	0.012	43%	0.432	C	S	.	.	H	α-helix	trans	-80	-42.5	179.3	-74.4	-110.8	0	0	0	109.7	L919 P920 R922 D943 Q947 A948 D949 V950 Y956	L919-Y945 HydrophobicContact CB-CE2 4.14Å; L919-Y945 HydrophobicContact CD1-CE1 4.25Å; P920-Y945 HydrophobicContact CG-CE2 4.46Å; P920-Y945 VanDerWaalsContact O-CE2 3.28Å; P920-Y945 WeakPolarHBondContact O-CE2 3.45Å; P920-Y945 PolarHBondContact O-OH 2.97Å; R922-Y945 HydrophobicContact CB-CD2 4.25Å; R922-Y945 HydrophobicContact CB-CE1 3.93Å; R922-Y945 HydrophobicContact CB-CE2 3.58Å; R922-Y945 WeakPolarHBondContact CB-OH 3.3Å; R922-Y945 VanDerWaalsContact CD-CD1 3.46Å; R922-Y945 HydrophobicContact CG-CE1 4.44Å; R922-Y945 HydrophobicContact CG-CE2 4.32Å; D943-Y945 PolarHBondContact OD1-N 2.94Å; Y945-Q947 VanDerWaalsContact C-N 3.31Å; Y945-Q947 PolarHBondContact O-N 3.11Å; Y945-A948 PolarHBondContact O-N 2.78Å; Y945-D949 PolarHBondContact O-N 2.76Å; Y945-V950 HydrophobicContact CD1-CB 3.84Å; Y945-V950 HydrophobicContact CD1-CG1 3.72Å; Y945-V950 HydrophobicContact CD1-CG2 4.03Å; Y945-V950 HydrophobicContact CE1-CG1 4.23Å; Y945-V950 HydrophobicContact CG-CB 4.4Å; Y945-V950 HydrophobicContact CG-CG2 4.37Å; Y945-V950 PolarHBondContact O-N 2.84Å; Y945-V950 VanDerWaalsContact O-N 3.12Å; Y945-Y956 HydrophobicContact CE1-CD2 4.13Å; Y945-Y956 WeakPolarHBondContact OH-CB 3.39Å; Y945-Y956 PolarHBondContact OH-N 3.41Å; Y945-Y956 PolarHBondContact OH-O 2.97Å
946	A	82.7	Confident	80.8	Confident	73 Å²	73	71.4 Å²	71.4	60%	0.603	42%	0.419	S	S	*	.	H	α-helix	trans	-64.5	-32.8	170.3	0	0	0	0	0	112.8	D943 A948	D943-A946 HydrophobicContact CB-CB 4.12Å; D943-A946 PolarHBondContact OD1-N 3.22Å; D943-A946 VanDerWaalsContact OD1-N 3.11Å; A946-A948 VanDerWaalsContact C-N 3.31Å; A946-A948 PolarHBondContact O-N 2.6Å
947	Q	84.4	Confident	81.2	Confident	114 Å²	114	69.1 Å²	69.1	53%	0.533	41%	0.409	S	S	.	.	H	α-helix	trans	-70.9	-22.7	176.5	-179	167.1	56.8	0	0	114	D943 Y945	D943-Q947 WeakPolarHBondContact O-CB 3.41Å; D943-Q947 PolarHBondContact O-N 3.07Å; Y945-Q947 VanDerWaalsContact C-N 3.31Å; Y945-Q947 PolarHBondContact O-N 3.11Å
948	A	84.7	Confident	82.2	Confident	28 Å²	28	68.8 Å²	68.8	23%	0.231	41%	0.405	C	S	.	.	T	Hydrogen-bonded Turn	trans	-114.5	19.3	-173.8	0	0	0	0	0	113.2	F916 L919 K944 Y945 A946 V950	F916-A948 WeakPolarHBondContact CE1-O 3.2Å; L919-A948 HydrophobicContact CD2-CB 4.13Å; K944-A948 WeakPolarHBondContact O-CB 3.24Å; K944-A948 PolarHBondContact O-N 2.66Å; Y945-A948 PolarHBondContact O-N 2.78Å; A946-A948 VanDerWaalsContact C-N 3.31Å; A946-A948 PolarHBondContact O-N 2.6Å; A948-V950 HydrophobicContact CB-CG2 4Å; A948-V950 PolarHBondContact O-N 3.28Å
949	D	83.7	Confident	83	Confident	149 Å²	149	63.1 Å²	63.1	80%	0.797	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	45.5	38.5	-177.6	-73.6	-40.6	0	0	0	113.7	Y945 P951	Y945-D949 PolarHBondContact O-N 2.76Å; D949-P951 WeakPolarHBondContact O-CD 3.3Å
950	V	83.5	Confident	83.8	Confident	11 Å²	11	60.4 Å²	60.4	7%	0.067	33%	0.33	C	S	.	.			trans	-71.1	122.2	-179.6	-172.9	0	0	0	0	109	F916 L919 Y945 A948 D952 V954	F916-V950 HydrophobicContact CD1-CG2 3.85Å; F916-V950 HydrophobicContact CE1-CB 4.41Å; F916-V950 HydrophobicContact CE1-CG2 3.91Å; F916-V950 HydrophobicContact CE2-CG1 4.45Å; F916-V950 HydrophobicContact CG-CG2 4.35Å; F916-V950 HydrophobicContact CZ-CG1 4.41Å; F916-V950 HydrophobicContact CZ-CG2 4.44Å; L919-V950 HydrophobicContact CD1-CG2 3.75Å; L919-V950 HydrophobicContact CD2-CG2 4.3Å; Y945-V950 HydrophobicContact CD1-CB 3.84Å; Y945-V950 HydrophobicContact CD1-CG1 3.72Å; Y945-V950 HydrophobicContact CD1-CG2 4.03Å; Y945-V950 HydrophobicContact CE1-CG1 4.23Å; Y945-V950 HydrophobicContact CG-CB 4.4Å; Y945-V950 HydrophobicContact CG-CG2 4.37Å; Y945-V950 PolarHBondContact O-N 2.84Å; Y945-V950 VanDerWaalsContact O-N 3.12Å; A948-V950 HydrophobicContact CB-CG2 4Å; A948-V950 PolarHBondContact O-N 3.28Å; V950-D952 PolarHBondContact O-N 2.66Å; V950-V954 HydrophobicContact CG1-CB 3.97Å; V950-V954 HydrophobicContact CG1-CG1 4Å
951	P	81.8	Confident	84.5	Confident	62 Å²	62	53.6 Å²	53.6	40%	0.403	30%	0.299	S	S	.	.			trans	-55.8	138.2	179.5	-27.2	35.8	0	0	0	112	D949 N953 V954	D949-P951 WeakPolarHBondContact O-CD 3.3Å; P951-N953 WeakPolarHBondContact CB-OD1 3.48Å; P951-N953 PolarHBondContact O-N 3.2Å; P951-V954 HydrophobicContact CB-CG2 4.22Å; P951-V954 WeakPolarHBondContact O-CB 3.37Å; P951-V954 PolarHBondContact O-N 3.37Å
952	D	76.5	Confident	84.8	Confident	136 Å²	136	51.8 Å²	51.8	73%	0.727	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.3	-25.4	-172	-82.1	-52.2	0	0	0	115.1	R922 V950 V954 N955	R922-D952 IonicContact NH2-OD1 3.06Å; V950-D952 PolarHBondContact O-N 2.66Å; D952-V954 VanDerWaalsContact C-N 3.33Å; D952-N955 PolarHBondContact O-ND2 2.68Å
953	N	78.7	Confident	85	Confident	141 Å²	141	53.5 Å²	53.5	75%	0.754	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.5	-14	174.7	64.8	-27.9	0	0	0	113.8	P951	P951-N953 WeakPolarHBondContact CB-OD1 3.48Å; P951-N953 PolarHBondContact O-N 3.2Å
954	V	82.9	Confident	85	Confident	34 Å²	34	51.8 Å²	51.8	21%	0.206	30%	0.298	C	S	.	.			trans	-96.1	117.5	179.7	179.8	0	0	0	0	110.2	V950 P951 D952 Y956	V950-V954 HydrophobicContact CG1-CB 3.97Å; V950-V954 HydrophobicContact CG1-CG1 4Å; P951-V954 HydrophobicContact CB-CG2 4.22Å; P951-V954 WeakPolarHBondContact O-CB 3.37Å; P951-V954 PolarHBondContact O-N 3.37Å; D952-V954 VanDerWaalsContact C-N 3.33Å; V954-Y956 HydrophobicContact CG1-CD2 4.44Å; V954-Y956 HydrophobicContact CG1-CE2 3.72Å
955	N	85.6	Confident	85.3	Confident	38 Å²	38	49.7 Å²	49.7	20%	0.203	29%	0.288	C	S	.	.			trans	-133.5	116.2	-178.7	-70	-91.1	0	0	0	109.7	R922 P924 D952 L957	R922-N955 WeakPolarHBondContact CD-OD1 3.44Å; R922-N955 WeakPolarHBondContact CG-OD1 3.42Å; R922-N955 PolarHBondContact NE-OD1 3.06Å; R922-N955 PolarHBondContact NH1-OD1 3.17Å; P924-N955 HydrophobicContact CG-CB 4.36Å; D952-N955 PolarHBondContact O-ND2 2.68Å; N955-L957 PolarHBondContact O-N 3.2Å
956	Y	87.8	Confident	85.4	Confident	12 Å²	12	49.8 Å²	49.8	5%	0.047	29%	0.289	C	S	.	.			trans	-86.4	94.5	174.2	-60.3	-77.3	0	0	0	108.7	H907 F916 L919 R922 Y945 V954 L958 G959 T960 D966	H907-Y956 AromaticContact CE1-CD1 3.69Å; H907-Y956 AromaticContact CE1-CE1 3.3Å; H907-Y956 WeakPolarHBondContact CE1-CE1 3.47Å; H907-Y956 AromaticContact ND1-CD1 3.96Å; H907-Y956 AromaticContact ND1-CE1 3.62Å; H907-Y956 AromaticContact NE2-CE1 3.55Å; F916-Y956 HydrophobicContact CB-CE2 4.44Å; F916-Y956 AromaticContact CD2-CE2 3.93Å; F916-Y956 HydrophobicContact CD2-CE2 3.93Å; F916-Y956 WeakPolarHBondContact CD2-OH 3.11Å; L919-Y956 HydrophobicContact CD1-CD2 3.64Å; L919-Y956 HydrophobicContact CD1-CE2 3.83Å; R922-Y956 PolarHBondContact N-O 2.91Å; R922-Y956 VanDerWaalsContact N-O 3.11Å; Y945-Y956 HydrophobicContact CE1-CD2 4.13Å; Y945-Y956 WeakPolarHBondContact OH-CB 3.39Å; Y945-Y956 PolarHBondContact OH-N 3.41Å; Y945-Y956 PolarHBondContact OH-O 2.97Å; V954-Y956 HydrophobicContact CG1-CD2 4.44Å; V954-Y956 HydrophobicContact CG1-CE2 3.72Å; Y956-L958 PolarHBondContact O-N 3.36Å; Y956-G959 PolarHBondContact O-N 3.38Å; Y956-T960 HydrophobicContact CD1-CG2 3.66Å; Y956-T960 HydrophobicContact CD2-CG2 3.57Å; Y956-T960 HydrophobicContact CE1-CG2 3.98Å; Y956-T960 HydrophobicContact CE2-CG2 3.88Å; Y956-T960 HydrophobicContact CG-CG2 3.46Å; Y956-T960 VanDerWaalsContact CG-CG2 3.46Å; Y956-D966 HydrophobicContact CD1-CB 3.82Å; Y956-D966 HydrophobicContact CE1-CB 3.97Å
957	L	86.7	Confident	85.7	Confident	73 Å²	73	46.6 Å²	46.6	38%	0.382	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55	-29.4	-173.9	-65.4	176.2	0	0	0	113.5	N955 L968	N955-L957 PolarHBondContact O-N 3.2Å; L957-L968 HydrophobicContact CB-CD2 4.19Å; L957-L968 HydrophobicContact CD1-CD2 3.91Å
958	L	89.1	Confident	86	Confident	44 Å²	44	42.3 Å²	42.3	23%	0.23	24%	0.243	C	C	.	.	T	Hydrogen-bonded Turn	trans	-116.1	11.8	176.7	-66.3	-170.8	0	0	0	113.4	Y956 V967 L968 L971 I1148	Y956-L958 PolarHBondContact O-N 3.36Å; L958-V967 HydrophobicContact CB-CB 4Å; L958-V967 HydrophobicContact CB-CG1 3.94Å; L958-V967 WeakPolarHBondContact O-CB 3.41Å; L958-L968 HydrophobicContact CB-CB 4.21Å; L958-L968 HydrophobicContact CD1-CB 4.1Å; L958-L968 HydrophobicContact CD1-CD1 3.64Å; L958-L968 HydrophobicContact CD1-CG 4.47Å; L958-L968 HydrophobicContact CG-CB 4.16Å; L958-L968 HydrophobicContact CG-CD1 4.19Å; L958-L971 HydrophobicContact CD1-CD2 3.9Å; L958-I1148 HydrophobicContact CB-CD1 4.02Å; L958-I1148 HydrophobicContact CD1-CD1 4.47Å; L958-I1148 HydrophobicContact CD1-CG2 3.9Å; L958-I1148 HydrophobicContact CD2-CD1 4.07Å; L958-I1148 HydrophobicContact CG-CD1 4.4Å
959	G	90	Very high	86.2	Confident	0 Å²	0	41 Å²	41	0%	0	23%	0.231	C	C	.	.			trans	78.6	-173.2	-175.9	0	0	0	0	0	114.4	L919 Y956 V967	L919-G959 CarbonylContact O-C 3.6Å; L919-G959 WeakPolarHBondContact O-CA 3.49Å; Y956-G959 PolarHBondContact O-N 3.38Å; G959-V967 WeakPolarHBondContact O-CB 3.28Å; G959-V967 VanDerWaalsContact O-CG2 3.29Å; G959-V967 WeakPolarHBondContact O-CG2 3.4Å; G959-V967 PolarHBondContact O-N 3.5Å; G959-V967 VanDerWaalsContact O-N 3.09Å
960	T	90.9	Very high	86.5	Confident	0 Å²	0	33.9 Å²	33.9	0%	0	19%	0.194	C	C	.	.	B	Isolated β-bridge	trans	-122.7	154.8	174.6	62.5	0	0	0	0	111.2	F916 N918 L919 Y956 R965 Y1144	F916-T960 WeakPolarHBondContact O-CB 3.29Å; F916-T960 PolarHBondContact O-OG1 2.97Å; N918-T960 PolarHBondContact N-OG1 3.14Å; L919-T960 HydrophobicContact CB-CG2 4.3Å; L919-T960 WeakPolarHBondContact CB-OG1 3.34Å; L919-T960 HydrophobicContact CD1-CG2 4.28Å; L919-T960 PolarHBondContact N-OG1 3.35Å; L919-T960 PolarHBondContact O-N 3.27Å; Y956-T960 HydrophobicContact CD1-CG2 3.66Å; Y956-T960 HydrophobicContact CD2-CG2 3.57Å; Y956-T960 HydrophobicContact CE1-CG2 3.98Å; Y956-T960 HydrophobicContact CE2-CG2 3.88Å; Y956-T960 HydrophobicContact CG-CG2 3.46Å; Y956-T960 VanDerWaalsContact CG-CG2 3.46Å; T960-R965 VanDerWaalsContact CA-O 3.32Å; T960-R965 WeakPolarHBondContact CA-O 3.49Å; T960-Y1144 PolarHBondContact O-OH 3.36Å
961	D	89.5	Confident	86.9	Confident	5 Å²	5	34 Å²	34	3%	0.027	19%	0.194	C	C	.	.			trans	-86.8	-173.9	175.9	66.1	31.3	0	0	0	113.7	N918 L963 G964 R965 R970 L1145	N918-D961 PolarHBondContact N-O 3.05Å; N918-D961 VanDerWaalsContact N-O 3.07Å; D961-L963 PolarHBondContact O-N 3.42Å; D961-L963 PolarHBondContact OD1-N 3.22Å; D961-G964 PolarHBondContact O-N 2.93Å; D961-G964 PolarHBondContact OD1-N 3.42Å; D961-R965 VanDerWaalsContact CG-NE 3.33Å; D961-R965 PolarHBondContact N-O 3.39Å; D961-R965 VanDerWaalsContact N-O 3.09Å; D961-R965 WeakPolarHBondContact OD1-CB 3.45Å; D961-R965 IonicContact OD1-CZ 3.13Å; D961-R965 PolarHBondContact OD1-N 2.8Å; D961-R965 IonicContact OD1-NE 2.77Å; D961-R965 PolarHBondContact OD1-NE 3.17Å; D961-R965 VanDerWaalsContact OD1-NE 3.13Å; D961-R965 IonicContact OD1-NH2 2.69Å; D961-R965 IonicContact OD2-CZ 3.96Å; D961-R965 IonicContact OD2-NE 3.31Å; D961-R965 PolarHBondContact OD2-NE 3.15Å; D961-R965 IonicContact OD2-NH2 2.85Å; D961-R965 PolarHBondContact OD2-NH2 2.96Å; D961-R970 WeakPolarHBondContact OD2-CD 3.36Å; D961-R970 IonicContact OD2-NE 3.13Å; D961-R970 PolarHBondContact OD2-NE 3.2Å; D961-L1145 HydrophobicContact CB-CD1 4.08Å; D961-L1145 HydrophobicContact CB-CD2 4.08Å
962	G	83.9	Confident	87.3	Confident	39 Å²	39	33.3 Å²	33.3	40%	0.402	19%	0.185	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65	-3.9	-179.9	0	0	0	0	0	115.9	N918	N918-G962 VanDerWaalsContact OD1-CA 3.29Å; N918-G962 WeakPolarHBondContact OD1-CA 3.33Å
963	L	85.8	Confident	87.8	Confident	71 Å²	71	28.5 Å²	28.5	37%	0.372	16%	0.158	S	C	.	.	T	Hydrogen-bonded Turn	trans	-116.7	14.6	170.4	-60.9	175.2	0	0	0	111.8	Q912 N913 D961 R965	Q912-L963 CarbonylContact C-O 3.56Å; Q912-L963 WeakPolarHBondContact CA-O 3.36Å; Q912-L963 HydrophobicContact CB-CB 4.44Å; Q912-L963 HydrophobicContact CG-CB 4.09Å; Q912-L963 HydrophobicContact CG-CD1 4.44Å; N913-L963 PolarHBondContact N-O 2.94Å; D961-L963 PolarHBondContact O-N 3.42Å; D961-L963 PolarHBondContact OD1-N 3.22Å; L963-R965 HydrophobicContact CB-CG 4.08Å; L963-R965 PolarHBondContact O-N 3.11Å
964	G	85.9	Confident	88.3	Confident	3 Å²	3	21.8 Å²	21.8	3%	0.031	12%	0.122	C	C	.	.			trans	66.4	19.1	178.6	0	0	0	0	0	114.1	N913 F916 D961	N913-G964 WeakPolarHBondContact O-CA 3.43Å; F916-G964 WeakPolarHBondContact O-CA 3.28Å; D961-G964 PolarHBondContact O-N 2.93Å; D961-G964 PolarHBondContact OD1-N 3.42Å
965	R	89.2	Confident	88.7	Confident	8 Å²	8	20.6 Å²	20.6	3%	0.03	12%	0.115	C	C	.	.			trans	-80.3	137.3	178.3	-50.6	169.9	-63.4	-170.7	6.6	108.4	Q912 T960 D961 L963 V967 R970 D1134	Q912-R965 HydrophobicContact CG-CG 4.37Å; T960-R965 VanDerWaalsContact CA-O 3.32Å; T960-R965 WeakPolarHBondContact CA-O 3.49Å; D961-R965 VanDerWaalsContact CG-NE 3.33Å; D961-R965 PolarHBondContact N-O 3.39Å; D961-R965 VanDerWaalsContact N-O 3.09Å; D961-R965 WeakPolarHBondContact OD1-CB 3.45Å; D961-R965 IonicContact OD1-CZ 3.13Å; D961-R965 PolarHBondContact OD1-N 2.8Å; D961-R965 IonicContact OD1-NE 2.77Å; D961-R965 PolarHBondContact OD1-NE 3.17Å; D961-R965 VanDerWaalsContact OD1-NE 3.13Å; D961-R965 IonicContact OD1-NH2 2.69Å; D961-R965 IonicContact OD2-CZ 3.96Å; D961-R965 IonicContact OD2-NE 3.31Å; D961-R965 PolarHBondContact OD2-NE 3.15Å; D961-R965 IonicContact OD2-NH2 2.85Å; D961-R965 PolarHBondContact OD2-NH2 2.96Å; L963-R965 HydrophobicContact CB-CG 4.08Å; L963-R965 PolarHBondContact O-N 3.11Å; R965-V967 PolarHBondContact O-N 3.24Å; R965-R970 HydrophobicContact CB-CG 4.43Å; R965-D1134 IonicContact CZ-OD2 2.73Å; R965-D1134 IonicContact NH2-OD2 3.84Å; R965-D1134 PolarHBondContact NH2-OD2 3.3Å
966	D	90	Very high	88.9	Confident	5 Å²	5	22.4 Å²	22.4	3%	0.027	12%	0.119	C	C	.	.	B	Isolated β-bridge	trans	-63	119.6	178.5	172.9	21.1	0	0	0	111.6	H907 Y956 L968 S969 R970	H907-D966 HydrophobicContact CB-CB 3.84Å; H907-D966 IonicContact CE1-OD2 2.88Å; H907-D966 IonicContact CG-OD2 3.82Å; H907-D966 IonicContact ND1-OD2 2.64Å; H907-D966 PolarHBondContact ND1-OD2 3.36Å; Y956-D966 HydrophobicContact CD1-CB 3.82Å; Y956-D966 HydrophobicContact CE1-CB 3.97Å; D966-L968 VanDerWaalsContact C-N 3.29Å; D966-L968 PolarHBondContact O-N 2.94Å; D966-L968 WeakPolarHBondContact OD1-CB 3.33Å; D966-L968 PolarHBondContact OD1-N 3.08Å; D966-S969 PolarHBondContact O-N 2.56Å; D966-S969 VanDerWaalsContact OD2-CB 3.29Å; D966-S969 WeakPolarHBondContact OD2-CB 3.22Å; D966-S969 PolarHBondContact OD2-N 2.82Å; D966-S969 PolarHBondContact OD2-OG 2.82Å; D966-R970 WeakPolarHBondContact O-CB 3.48Å; D966-R970 WeakPolarHBondContact O-CG 3.28Å; D966-R970 PolarHBondContact O-N 3.34Å
967	V	90	Very high	89	Confident	6 Å²	6	22.6 Å²	22.6	4%	0.036	12%	0.121	C	C	.	.	H	α-helix	trans	-64.3	-33.8	-179.4	176.1	0	0	0	0	111.3	L958 G959 R965 L971 Y1144 L1145 I1148	L958-V967 HydrophobicContact CB-CB 4Å; L958-V967 HydrophobicContact CB-CG1 3.94Å; L958-V967 WeakPolarHBondContact O-CB 3.41Å; G959-V967 WeakPolarHBondContact O-CB 3.28Å; G959-V967 VanDerWaalsContact O-CG2 3.29Å; G959-V967 WeakPolarHBondContact O-CG2 3.4Å; G959-V967 PolarHBondContact O-N 3.5Å; G959-V967 VanDerWaalsContact O-N 3.09Å; R965-V967 PolarHBondContact O-N 3.24Å; V967-L971 VanDerWaalsContact O-CB 3.23Å; V967-L971 WeakPolarHBondContact O-CB 3.18Å; V967-L971 PolarHBondContact O-N 3.46Å; V967-Y1144 HydrophobicContact CG2-CE2 4.44Å; V967-L1145 HydrophobicContact CG1-CD2 4.4Å; V967-L1145 HydrophobicContact CG2-CD2 3.34Å; V967-I1148 HydrophobicContact CG1-CD1 4.21Å; V967-I1148 HydrophobicContact CG1-CG2 4.3Å
968	L	90	Very high	89.2	Confident	23 Å²	23	19.1 Å²	19.1	12%	0.12	10%	0.103	C	C	.	.	H	α-helix	trans	-69.3	-49.6	179.6	-179.6	61.1	0	0	0	111.4	P906 L957 L958 D966 R970 L971 F972	P906-L968 HydrophobicContact CG-CD2 4.19Å; L957-L968 HydrophobicContact CB-CD2 4.19Å; L957-L968 HydrophobicContact CD1-CD2 3.91Å; L958-L968 HydrophobicContact CB-CB 4.21Å; L958-L968 HydrophobicContact CD1-CB 4.1Å; L958-L968 HydrophobicContact CD1-CD1 3.64Å; L958-L968 HydrophobicContact CD1-CG 4.47Å; L958-L968 HydrophobicContact CG-CB 4.16Å; L958-L968 HydrophobicContact CG-CD1 4.19Å; D966-L968 VanDerWaalsContact C-N 3.29Å; D966-L968 PolarHBondContact O-N 2.94Å; D966-L968 WeakPolarHBondContact OD1-CB 3.33Å; D966-L968 PolarHBondContact OD1-N 3.08Å; L968-R970 VanDerWaalsContact C-N 3.3Å; L968-R970 PolarHBondContact O-N 3.27Å; L968-L971 PolarHBondContact O-N 3.49Å; L968-F972 HydrophobicContact CD1-CD1 4.47Å; L968-F972 HydrophobicContact CD1-CD2 4.3Å; L968-F972 HydrophobicContact CD1-CE1 3.89Å; L968-F972 HydrophobicContact CD1-CE2 3.72Å; L968-F972 HydrophobicContact CD1-CZ 3.49Å; L968-F972 VanDerWaalsContact CD1-CZ 3.49Å; L968-F972 HydrophobicContact CD2-CE2 4.2Å; L968-F972 HydrophobicContact CD2-CZ 4.45Å; L968-F972 HydrophobicContact CG-CD2 4.18Å; L968-F972 HydrophobicContact CG-CE2 3.68Å; L968-F972 HydrophobicContact CG-CZ 3.99Å; L968-F972 WeakPolarHBondContact O-CD2 3.39Å; L968-F972 WeakPolarHBondContact O-CG 3.23Å; L968-F972 PolarHBondContact O-N 2.91Å
969	S	88.7	Confident	89.3	Confident	0 Å²	0	17.3 Å²	17.3	0%	0	9%	0.093	C	C	.	.	H	α-helix	trans	-59.4	-40.6	175	-61.9	0	0	0	0	111.9	P906 H907 D966 M973	P906-S969 WeakPolarHBondContact CD-OG 3.06Å; H907-S969 PolarHBondContact N-OG 3.4Å; H907-S969 WeakPolarHBondContact O-CB 3.23Å; H907-S969 PolarHBondContact O-OG 3.3Å; D966-S969 PolarHBondContact O-N 2.56Å; D966-S969 VanDerWaalsContact OD2-CB 3.29Å; D966-S969 WeakPolarHBondContact OD2-CB 3.22Å; D966-S969 PolarHBondContact OD2-N 2.82Å; D966-S969 PolarHBondContact OD2-OG 2.82Å; S969-M973 PolarHBondContact O-N 3.05Å; S969-M973 VanDerWaalsContact O-N 3.12Å
970	R	90.5	Very high	89.3	Confident	0 Å²	0	21.4 Å²	21.4	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-66	-41.1	175	-75.4	-179.6	66.9	71	-2.7	112.6	P909 D961 R965 D966 L968 F972 M973 G974 P1124 A1126 L1131 D1134	P909-R970 HydrophobicContact CB-CB 4.46Å; P909-R970 HydrophobicContact CB-CG 3.82Å; P909-R970 WeakPolarHBondContact O-CD 3.33Å; P909-R970 WeakPolarHBondContact O-CG 3.07Å; P909-R970 PolarHBondContact O-NH1 2.93Å; P909-R970 VanDerWaalsContact O-NH1 3.09Å; D961-R970 WeakPolarHBondContact OD2-CD 3.36Å; D961-R970 IonicContact OD2-NE 3.13Å; D961-R970 PolarHBondContact OD2-NE 3.2Å; R965-R970 HydrophobicContact CB-CG 4.43Å; D966-R970 WeakPolarHBondContact O-CB 3.48Å; D966-R970 WeakPolarHBondContact O-CG 3.28Å; D966-R970 PolarHBondContact O-N 3.34Å; L968-R970 VanDerWaalsContact C-N 3.3Å; L968-R970 PolarHBondContact O-N 3.27Å; R970-F972 PolarHBondContact O-N 2.85Å; R970-M973 PolarHBondContact O-N 3.2Å; R970-G974 PolarHBondContact O-N 3.28Å; R970-P1124 PolarHBondContact NH1-O 2.79Å; R970-A1126 HydrophobicContact CB-CB 4.26Å; R970-A1126 HydrophobicContact CG-CB 4.41Å; R970-L1131 HydrophobicContact CB-CD1 4.46Å; R970-L1131 HydrophobicContact CB-CD2 3.97Å; R970-D1134 IonicContact NH2-OD2 3.72Å; R970-D1134 PolarHBondContact NH2-OD2 3.44Å
971	L	91.2	Very high	89.2	Confident	15 Å²	15	21.4 Å²	21.4	8%	0.079	11%	0.114	C	C	.	.	H	α-helix	trans	-62.3	-42.6	177.9	-173.4	69.8	0	0	0	111.9	L958 V967 L968 G974 T975 L1128 L1131 I1148 P1149 T1152	L958-L971 HydrophobicContact CD1-CD2 3.9Å; V967-L971 VanDerWaalsContact O-CB 3.23Å; V967-L971 WeakPolarHBondContact O-CB 3.18Å; V967-L971 PolarHBondContact O-N 3.46Å; L968-L971 PolarHBondContact O-N 3.49Å; L971-G974 PolarHBondContact O-N 3.04Å; L971-T975 WeakPolarHBondContact O-CB 3.04Å; L971-T975 PolarHBondContact O-N 3.16Å; L971-T975 PolarHBondContact O-OG1 3.43Å; L971-L1128 HydrophobicContact CD1-CD2 3.99Å; L971-L1131 HydrophobicContact CD1-CD1 4.27Å; L971-I1148 HydrophobicContact CD1-CG2 4.12Å; L971-I1148 HydrophobicContact CD2-CG2 3.66Å; L971-I1148 HydrophobicContact CG-CG2 4.42Å; L971-P1149 HydrophobicContact CD1-CB 4.27Å; L971-T1152 HydrophobicContact CD1-CG2 4.06Å; L971-T1152 HydrophobicContact CG-CG2 4.43Å
972	F	90.3	Very high	89.2	Confident	47 Å²	47	21.1 Å²	21.1	21%	0.206	11%	0.113	C	C	.	.	H	α-helix	trans	-63.3	-48.2	175.1	-68.7	-31.8	0	0	0	112.2	I897 T901 L968 R970 G974 T975 R976	I897-F972 HydrophobicContact CG2-CD1 3.8Å; I897-F972 HydrophobicContact CG2-CE1 3.58Å; I897-F972 HydrophobicContact CG2-CZ 4.26Å; T901-F972 HydrophobicContact CG2-CB 3.76Å; T901-F972 HydrophobicContact CG2-CD1 4.04Å; T901-F972 HydrophobicContact CG2-CD2 3.41Å; T901-F972 VanDerWaalsContact CG2-CD2 3.41Å; T901-F972 HydrophobicContact CG2-CE1 4.44Å; T901-F972 HydrophobicContact CG2-CE2 3.85Å; T901-F972 HydrophobicContact CG2-CG 3.5Å; T901-F972 VanDerWaalsContact CG2-CG 3.5Å; T901-F972 HydrophobicContact CG2-CZ 4.34Å; L968-F972 HydrophobicContact CD1-CD1 4.47Å; L968-F972 HydrophobicContact CD1-CD2 4.3Å; L968-F972 HydrophobicContact CD1-CE1 3.89Å; L968-F972 HydrophobicContact CD1-CE2 3.72Å; L968-F972 HydrophobicContact CD1-CZ 3.49Å; L968-F972 VanDerWaalsContact CD1-CZ 3.49Å; L968-F972 HydrophobicContact CD2-CE2 4.2Å; L968-F972 HydrophobicContact CD2-CZ 4.45Å; L968-F972 HydrophobicContact CG-CD2 4.18Å; L968-F972 HydrophobicContact CG-CE2 3.68Å; L968-F972 HydrophobicContact CG-CZ 3.99Å; L968-F972 WeakPolarHBondContact O-CD2 3.39Å; L968-F972 WeakPolarHBondContact O-CG 3.23Å; L968-F972 PolarHBondContact O-N 2.91Å; R970-F972 PolarHBondContact O-N 2.85Å; F972-G974 VanDerWaalsContact C-N 3.29Å; F972-G974 PolarHBondContact O-N 2.78Å; F972-T975 PolarHBondContact O-N 3.03Å; F972-R976 WeakPolarHBondContact O-CB 3.06Å; F972-R976 PolarHBondContact O-N 2.8Å
973	M	87.9	Confident	89.6	Confident	34 Å²	34	23.6 Å²	23.6	17%	0.167	11%	0.113	C	C	.	.	H	α-helix	trans	-59.5	-41.8	175.5	179.5	173.9	177.2	0	0	111.7	P909 S969 R970 R976 I977 A1126	P909-M973 HydrophobicContact CB-CB 4.18Å; P909-M973 HydrophobicContact CB-SD 3.95Å; P909-M973 HydrophobicContact CG-CB 4.06Å; P909-M973 HydrophobicContact CG-CG 4.36Å; P909-M973 HydrophobicContact CG-SD 3.42Å; P909-M973 WeakPolarHBondContact CG-SD 3.45Å; S969-M973 PolarHBondContact O-N 3.05Å; S969-M973 VanDerWaalsContact O-N 3.12Å; R970-M973 PolarHBondContact O-N 3.2Å; M973-R976 PolarHBondContact O-N 3.44Å; M973-I977 HydrophobicContact CE-CD1 3.68Å; M973-I977 HydrophobicContact CG-CD1 3.97Å; M973-I977 WeakPolarHBondContact O-CG1 3.44Å; M973-I977 PolarHBondContact O-N 2.82Å; M973-A1126 HydrophobicContact CB-CB 4.2Å; M973-A1126 HydrophobicContact CG-CB 4.1Å; M973-A1126 HydrophobicContact SD-CB 4.15Å
974	G	89.7	Confident	89.8	Confident	0 Å²	0	23 Å²	23	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-66.7	-46.3	-179.7	0	0	0	0	0	113.2	R970 L971 F972 R976 I977 S978 A1126	R970-G974 PolarHBondContact O-N 3.28Å; L971-G974 PolarHBondContact O-N 3.04Å; F972-G974 VanDerWaalsContact C-N 3.29Å; F972-G974 PolarHBondContact O-N 2.78Å; G974-R976 VanDerWaalsContact C-N 3.31Å; G974-R976 PolarHBondContact O-N 3.12Å; G974-I977 PolarHBondContact O-N 2.86Å; G974-S978 PolarHBondContact O-N 3.04Å; G974-S978 PolarHBondContact O-OG 3.44Å; G974-S978 VanDerWaalsContact O-OG 3.12Å; G974-A1126 VanDerWaalsContact CA-O 3.28Å; G974-A1126 WeakPolarHBondContact CA-O 3.44Å
975	T	91.1	Very high	89.9	Confident	9 Å²	9	22.9 Å²	22.9	6%	0.055	11%	0.109	C	C	.	.	H	α-helix	trans	-58.1	-44.6	175.4	-55.1	0	0	0	0	111.1	I894 L971 F972 I977 L979 I1156	I894-T975 HydrophobicContact CG2-CG2 3.9Å; L971-T975 WeakPolarHBondContact O-CB 3.04Å; L971-T975 PolarHBondContact O-N 3.16Å; L971-T975 PolarHBondContact O-OG1 3.43Å; F972-T975 PolarHBondContact O-N 3.03Å; T975-I977 PolarHBondContact O-N 3.26Å; T975-L979 HydrophobicContact CG2-CD1 3.92Å; T975-L979 WeakPolarHBondContact O-CB 3.05Å; T975-L979 VanDerWaalsContact O-CG 3.28Å; T975-L979 WeakPolarHBondContact O-CG 3.45Å; T975-L979 PolarHBondContact O-N 3.14Å; T975-I1156 HydrophobicContact CG2-CD1 3.68Å
976	R	89.8	Confident	89.8	Confident	77 Å²	77	22.7 Å²	22.7	29%	0.291	11%	0.109	S	C	.	.	H	α-helix	trans	-59.9	-43.4	176.2	-174.8	-177.4	74.1	-155.7	2.7	112.7	S898 F972 M973 G974 L980	S898-R976 WeakPolarHBondContact O-CD 3.45Å; S898-R976 VanDerWaalsContact O-CG 3.26Å; S898-R976 WeakPolarHBondContact O-CG 3.42Å; F972-R976 WeakPolarHBondContact O-CB 3.06Å; F972-R976 PolarHBondContact O-N 2.8Å; M973-R976 PolarHBondContact O-N 3.44Å; G974-R976 VanDerWaalsContact C-N 3.31Å; G974-R976 PolarHBondContact O-N 3.12Å; R976-L980 VanDerWaalsContact O-CB 3.27Å; R976-L980 WeakPolarHBondContact O-CB 3.49Å; R976-L980 PolarHBondContact O-N 3.2Å
977	I	89.3	Confident	89.9	Confident	15 Å²	15	27.5 Å²	27.5	8%	0.077	13%	0.134	C	C	.	.	H	α-helix	trans	-72.6	-43.8	-177.7	-73.1	173.2	0	0	0	111.6	M973 G974 T975 L979 L980 I981 I1038 L1121	M973-I977 HydrophobicContact CE-CD1 3.68Å; M973-I977 HydrophobicContact CG-CD1 3.97Å; M973-I977 WeakPolarHBondContact O-CG1 3.44Å; M973-I977 PolarHBondContact O-N 2.82Å; G974-I977 PolarHBondContact O-N 2.86Å; T975-I977 PolarHBondContact O-N 3.26Å; I977-L979 VanDerWaalsContact C-N 3.33Å; I977-L979 PolarHBondContact O-N 3.2Å; I977-L980 PolarHBondContact O-N 2.96Å; I977-I981 HydrophobicContact CG2-CD1 3.94Å; I977-I981 PolarHBondContact O-N 2.75Å; I977-I1038 HydrophobicContact CG2-CD1 4.32Å; I977-L1121 HydrophobicContact CG2-CD1 3.49Å; I977-L1121 VanDerWaalsContact CG2-CD1 3.49Å
978	S	90.6	Very high	89.8	Confident	1 Å²	1	30.8 Å²	30.8	1%	0.007	15%	0.148	C	C	.	.	H	α-helix	trans	-61.1	-40.7	175.7	-54.9	0	0	0	0	111.8	G974 A982 E1111 L1128	G974-S978 PolarHBondContact O-N 3.04Å; G974-S978 PolarHBondContact O-OG 3.44Å; G974-S978 VanDerWaalsContact O-OG 3.12Å; S978-A982 WeakPolarHBondContact O-CB 3.25Å; S978-A982 PolarHBondContact O-N 2.8Å; S978-A982 VanDerWaalsContact O-N 3.16Å; S978-E1111 WeakPolarHBondContact CB-OE2 3.26Å; S978-E1111 PolarHBondContact OG-OE2 2.87Å; S978-L1128 PolarHBondContact OG-N 2.84Å
979	L	91.1	Very high	89.6	Confident	6 Å²	6	29.8 Å²	29.8	3%	0.031	14%	0.142	C	C	.	.	H	α-helix	trans	-67.4	-42.8	174.4	-73	170.8	0	0	0	112.8	I894 V895 T975 I977 I981 A982 F983 I1108 I1156 F1160	I894-L979 HydrophobicContact CG2-CD1 4.12Å; V895-L979 HydrophobicContact CG2-CD1 4.25Å; T975-L979 HydrophobicContact CG2-CD1 3.92Å; T975-L979 WeakPolarHBondContact O-CB 3.05Å; T975-L979 VanDerWaalsContact O-CG 3.28Å; T975-L979 WeakPolarHBondContact O-CG 3.45Å; T975-L979 PolarHBondContact O-N 3.14Å; I977-L979 VanDerWaalsContact C-N 3.33Å; I977-L979 PolarHBondContact O-N 3.2Å; L979-I981 PolarHBondContact O-N 3.21Å; L979-A982 PolarHBondContact O-N 2.82Å; L979-F983 HydrophobicContact CB-CD2 4.38Å; L979-F983 HydrophobicContact CB-CE2 4.25Å; L979-F983 HydrophobicContact CD2-CE2 4.3Å; L979-F983 WeakPolarHBondContact O-CD2 2.92Å; L979-F983 PolarHBondContact O-N 3.33Å; L979-I1108 HydrophobicContact CD2-CD1 4.02Å; L979-I1156 HydrophobicContact CD2-CG2 4.31Å; L979-F1160 HydrophobicContact CD2-CE2 3.88Å; L979-F1160 HydrophobicContact CD2-CZ 4.24Å
980	L	90	Very high	89.7	Confident	85 Å²	85	32.2 Å²	32.2	45%	0.445	16%	0.155	S	C	.	.	H	α-helix	trans	-58.6	-48.1	178.5	179.1	66.9	0	0	0	111.5	R976 I977 A982 F983 I984	R976-L980 VanDerWaalsContact O-CB 3.27Å; R976-L980 WeakPolarHBondContact O-CB 3.49Å; R976-L980 PolarHBondContact O-N 3.2Å; I977-L980 PolarHBondContact O-N 2.96Å; L980-A982 VanDerWaalsContact C-N 3.32Å; L980-A982 PolarHBondContact O-N 3.41Å; L980-F983 PolarHBondContact O-N 3.03Å; L980-I984 HydrophobicContact CD1-CD1 3.98Å; L980-I984 HydrophobicContact CG-CD1 3.97Å; L980-I984 WeakPolarHBondContact O-CD1 3.45Å; L980-I984 VanDerWaalsContact O-CG1 3.27Å; L980-I984 WeakPolarHBondContact O-CG1 3.49Å; L980-I984 PolarHBondContact O-N 2.69Å; L980-I984 VanDerWaalsContact O-N 3.11Å
981	I	89.5	Confident	89.8	Confident	0 Å²	0	35.9 Å²	35.9	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-59.6	-44.5	176.5	-72.8	165.6	0	0	0	110.4	I977 L979 I984 A985 I1038 I1041 V1042 M1045 E1111 L1121	I977-I981 HydrophobicContact CG2-CD1 3.94Å; I977-I981 PolarHBondContact O-N 2.75Å; L979-I981 PolarHBondContact O-N 3.21Å; I981-I984 PolarHBondContact O-N 3.48Å; I981-A985 WeakPolarHBondContact O-CB 3.22Å; I981-A985 PolarHBondContact O-N 3.01Å; I981-I1038 HydrophobicContact CD1-CG1 4.37Å; I981-I1038 HydrophobicContact CD1-CG2 4.36Å; I981-I1038 HydrophobicContact CG1-CG2 3.94Å; I981-I1041 HydrophobicContact CG2-CG2 3.89Å; I981-V1042 HydrophobicContact CG1-CG2 4.34Å; I981-V1042 HydrophobicContact CG2-CG2 4.33Å; I981-M1045 HydrophobicContact CG2-CE 3.95Å; I981-M1045 HydrophobicContact CG2-SD 3.78Å; I981-E1111 HydrophobicContact CD1-CG 3.67Å; I981-E1111 HydrophobicContact CG2-CB 4.34Å; I981-E1111 HydrophobicContact CG2-CG 4.46Å; I981-L1121 HydrophobicContact CD1-CD1 4.21Å
982	A	89.6	Confident	89.9	Confident	0 Å²	0	38 Å²	38	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-67.9	-39.1	-178.2	0	0	0	0	0	114	S978 L979 L980 A985 A986 I1104 A1107 I1108	S978-A982 WeakPolarHBondContact O-CB 3.25Å; S978-A982 PolarHBondContact O-N 2.8Å; S978-A982 VanDerWaalsContact O-N 3.16Å; L979-A982 PolarHBondContact O-N 2.82Å; L980-A982 VanDerWaalsContact C-N 3.32Å; L980-A982 PolarHBondContact O-N 3.41Å; A982-A985 PolarHBondContact O-N 3.4Å; A982-A986 WeakPolarHBondContact O-CB 3.39Å; A982-A986 PolarHBondContact O-N 2.97Å; A982-I1104 HydrophobicContact CB-CG2 3.96Å; A982-A1107 HydrophobicContact CB-CB 3.87Å; A982-I1108 HydrophobicContact CB-CD1 4.32Å; A982-I1108 HydrophobicContact CB-CG1 3.55Å
983	F	91.3	Very high	89.9	Confident	91 Å²	91	35.8 Å²	35.8	40%	0.399	18%	0.178	S	C	.	.	H	α-helix	trans	-68.4	-36.3	174.5	-75	-60	0	0	0	112.6	V895 L979 L980 A986 L987 I1104 F1160	V895-F983 HydrophobicContact CG2-CE2 4.2Å; V895-F983 HydrophobicContact CG2-CZ 4.25Å; L979-F983 HydrophobicContact CB-CD2 4.38Å; L979-F983 HydrophobicContact CB-CE2 4.25Å; L979-F983 HydrophobicContact CD2-CE2 4.3Å; L979-F983 WeakPolarHBondContact O-CD2 2.92Å; L979-F983 PolarHBondContact O-N 3.33Å; L980-F983 PolarHBondContact O-N 3.03Å; F983-A986 PolarHBondContact O-N 2.95Å; F983-L987 PolarHBondContact O-N 2.9Å; F983-I1104 HydrophobicContact CD1-CD1 4.09Å; F983-I1104 HydrophobicContact CE1-CD1 3.9Å; F983-F1160 HydrophobicContact CZ-CZ 4.29Å
984	I	90.7	Very high	90.2	Very high	57 Å²	57	34.9 Å²	34.9	29%	0.292	18%	0.175	S	C	.	.	H	α-helix	trans	-67.6	-42.4	174.3	-64.7	166.2	0	0	0	110.5	L980 I981 A986 L987 F988 V1042	L980-I984 HydrophobicContact CD1-CD1 3.98Å; L980-I984 HydrophobicContact CG-CD1 3.97Å; L980-I984 WeakPolarHBondContact O-CD1 3.45Å; L980-I984 VanDerWaalsContact O-CG1 3.27Å; L980-I984 WeakPolarHBondContact O-CG1 3.49Å; L980-I984 PolarHBondContact O-N 2.69Å; L980-I984 VanDerWaalsContact O-N 3.11Å; I981-I984 PolarHBondContact O-N 3.48Å; I984-A986 PolarHBondContact O-N 3.28Å; I984-L987 WeakPolarHBondContact O-CB 3.31Å; I984-L987 PolarHBondContact O-N 2.79Å; I984-F988 HydrophobicContact CG2-CD2 4.05Å; I984-F988 HydrophobicContact CG2-CE2 3.73Å; I984-F988 VanDerWaalsContact O-CD2 3.3Å; I984-F988 WeakPolarHBondContact O-CD2 3.47Å; I984-F988 PolarHBondContact O-N 3.19Å; I984-V1042 HydrophobicContact CB-CG2 4.41Å; I984-V1042 HydrophobicContact CG2-CG1 3.57Å; I984-V1042 HydrophobicContact CG2-CG2 4.13Å
985	A	86.9	Confident	90.4	Very high	2 Å²	2	37 Å²	37	2%	0.017	19%	0.192	C	C	.	.	H	α-helix	trans	-61.6	-42.1	175.1	0	0	0	0	0	112.2	I981 A982 L987 F988 D989 M1045 A1107	I981-A985 WeakPolarHBondContact O-CB 3.22Å; I981-A985 PolarHBondContact O-N 3.01Å; A982-A985 PolarHBondContact O-N 3.4Å; A985-L987 VanDerWaalsContact C-N 3.32Å; A985-L987 PolarHBondContact O-N 3.13Å; A985-F988 PolarHBondContact O-N 3.33Å; A985-D989 WeakPolarHBondContact O-CB 3.34Å; A985-D989 PolarHBondContact O-N 3.17Å; A985-M1045 HydrophobicContact CB-CB 4.03Å; A985-M1045 HydrophobicContact CB-CG 4.48Å; A985-M1045 HydrophobicContact CB-SD 3.71Å; A985-A1107 HydrophobicContact CB-CB 3.88Å
986	A	88.3	Confident	90.5	Very high	4 Å²	4	38.5 Å²	38.5	3%	0.033	20%	0.197	C	C	.	.	H	α-helix	trans	-64.5	-33	175.1	0	0	0	0	0	112.8	A982 F983 I984 D989 I990 M1100 I1104	A982-A986 WeakPolarHBondContact O-CB 3.39Å; A982-A986 PolarHBondContact O-N 2.97Å; F983-A986 PolarHBondContact O-N 2.95Å; I984-A986 PolarHBondContact O-N 3.28Å; A986-D989 WeakPolarHBondContact O-CB 3.48Å; A986-D989 PolarHBondContact O-N 3.23Å; A986-I990 WeakPolarHBondContact O-CD1 3.24Å; A986-I990 VanDerWaalsContact O-CG1 3.23Å; A986-I990 WeakPolarHBondContact O-CG1 3.38Å; A986-I990 PolarHBondContact O-N 3.47Å; A986-M1100 HydrophobicContact CB-CG 4.49Å; A986-I1104 HydrophobicContact CB-CD1 4.38Å; A986-I1104 HydrophobicContact CB-CG1 3.73Å
987	L	90.9	Very high	90.6	Very high	105 Å²	105	34.8 Å²	34.8	55%	0.55	18%	0.183	S	C	.	.	H	α-helix	trans	-66	-40.5	174.1	-176.9	62.4	0	0	0	111.9	F983 I984 A985 T991	F983-L987 PolarHBondContact O-N 2.9Å; I984-L987 WeakPolarHBondContact O-CB 3.31Å; I984-L987 PolarHBondContact O-N 2.79Å; A985-L987 VanDerWaalsContact C-N 3.32Å; A985-L987 PolarHBondContact O-N 3.13Å; L987-T991 HydrophobicContact CD1-CG2 4.08Å; L987-T991 WeakPolarHBondContact O-CB 3.26Å; L987-T991 WeakPolarHBondContact O-CG2 3.44Å; L987-T991 PolarHBondContact O-N 3.39Å; L987-T991 PolarHBondContact O-OG1 3.06Å
988	F	89	Confident	90.7	Very high	76 Å²	76	34.3 Å²	34.3	33%	0.333	18%	0.181	S	C	.	.	H	α-helix	trans	-67.8	-40.3	173.1	-74.5	-64.1	0	0	0	112.5	I984 A985 I990 T991 I992 V1042 A1046	I984-F988 HydrophobicContact CG2-CD2 4.05Å; I984-F988 HydrophobicContact CG2-CE2 3.73Å; I984-F988 VanDerWaalsContact O-CD2 3.3Å; I984-F988 WeakPolarHBondContact O-CD2 3.47Å; I984-F988 PolarHBondContact O-N 3.19Å; A985-F988 PolarHBondContact O-N 3.33Å; F988-I990 PolarHBondContact O-N 3.47Å; F988-T991 PolarHBondContact O-N 3.06Å; F988-I992 HydrophobicContact CB-CD1 4.42Å; F988-I992 HydrophobicContact CD1-CD1 4.04Å; F988-I992 WeakPolarHBondContact O-CB 3.19Å; F988-I992 WeakPolarHBondContact O-CG1 3.3Å; F988-I992 PolarHBondContact O-N 3.03Å; F988-V1042 HydrophobicContact CD2-CG1 4.37Å; F988-V1042 HydrophobicContact CE2-CG1 3.82Å; F988-A1046 HydrophobicContact CB-CB 4.27Å; F988-A1046 HydrophobicContact CD1-CB 4.31Å; F988-A1046 HydrophobicContact CD2-CB 3.93Å; F988-A1046 HydrophobicContact CE2-CB 4.32Å; F988-A1046 HydrophobicContact CG-CB 3.92Å
989	D	86.5	Confident	90.8	Very high	1 Å²	1	37 Å²	37	1%	0.005	19%	0.194	C	C	.	.	H	α-helix	trans	-54.8	-50.4	174.1	177.2	38.1	0	0	0	111.7	A985 A986 G993 W1050 M1053 S1103	A985-D989 WeakPolarHBondContact O-CB 3.34Å; A985-D989 PolarHBondContact O-N 3.17Å; A986-D989 WeakPolarHBondContact O-CB 3.48Å; A986-D989 PolarHBondContact O-N 3.23Å; D989-G993 WeakPolarHBondContact O-CA 3.44Å; D989-G993 PolarHBondContact O-N 3.35Å; D989-W1050 WeakPolarHBondContact OD1-CA 3.32Å; D989-M1053 WeakPolarHBondContact OD1-CB 3.48Å; D989-S1103 WeakPolarHBondContact OD2-CB 3.33Å; D989-S1103 PolarHBondContact OD2-OG 2.82Å
990	I	90.4	Very high	90.7	Very high	51 Å²	51	36.7 Å²	36.7	26%	0.262	19%	0.193	S	C	.	.	H	α-helix	trans	-65.9	-54.3	176.7	-60.7	157.6	0	0	0	111.2	A986 F988 V994 M1053 M1100	A986-I990 WeakPolarHBondContact O-CD1 3.24Å; A986-I990 VanDerWaalsContact O-CG1 3.23Å; A986-I990 WeakPolarHBondContact O-CG1 3.38Å; A986-I990 PolarHBondContact O-N 3.47Å; F988-I990 PolarHBondContact O-N 3.47Å; I990-V994 HydrophobicContact CG2-CG2 4.17Å; I990-V994 WeakPolarHBondContact O-CB 3.49Å; I990-V994 WeakPolarHBondContact O-CG2 3.46Å; I990-V994 PolarHBondContact O-N 3.32Å; I990-M1053 HydrophobicContact CG1-CE 4.34Å; I990-M1100 HydrophobicContact CD1-CB 4.37Å; I990-M1100 HydrophobicContact CD1-CG 3.93Å; I990-M1100 HydrophobicContact CD1-SD 3.54Å; I990-M1100 VanDerWaalsContact CD1-SD 3.54Å; I990-M1100 HydrophobicContact CG1-CB 4.41Å; I990-M1100 HydrophobicContact CG1-CG 4.45Å
991	T	91.1	Very high	90.4	Very high	77 Å²	77	32.7 Å²	32.7	47%	0.472	17%	0.172	S	C	.	.	H	α-helix	trans	-68.3	-42.2	-168.8	50.6	0	0	0	0	113.1	L987 F988 A995	L987-T991 HydrophobicContact CD1-CG2 4.08Å; L987-T991 WeakPolarHBondContact O-CB 3.26Å; L987-T991 WeakPolarHBondContact O-CG2 3.44Å; L987-T991 PolarHBondContact O-N 3.39Å; L987-T991 PolarHBondContact O-OG1 3.06Å; F988-T991 PolarHBondContact O-N 3.06Å; T991-A995 VanDerWaalsContact O-CB 3.32Å; T991-A995 WeakPolarHBondContact O-CB 3.42Å
992	I	93.4	Very high	90.1	Very high	60 Å²	60	33.5 Å²	33.5	31%	0.308	18%	0.176	S	C	.	.	H	α-helix	trans	-82	-46.9	177.8	-52.6	176.4	0	0	0	109.9	F988 A995 Y996 W1050	F988-I992 HydrophobicContact CB-CD1 4.42Å; F988-I992 HydrophobicContact CD1-CD1 4.04Å; F988-I992 WeakPolarHBondContact O-CB 3.19Å; F988-I992 WeakPolarHBondContact O-CG1 3.3Å; F988-I992 PolarHBondContact O-N 3.03Å; I992-A995 PolarHBondContact O-N 3.04Å; I992-Y996 VanDerWaalsContact O-CB 3.27Å; I992-Y996 WeakPolarHBondContact O-CB 3.34Å; I992-Y996 PolarHBondContact O-N 3.28Å; I992-W1050 HydrophobicContact CB-CB 4.11Å; I992-W1050 HydrophobicContact CB-CD2 4.16Å; I992-W1050 HydrophobicContact CB-CE3 4.46Å; I992-W1050 HydrophobicContact CB-CG 4Å; I992-W1050 HydrophobicContact CG2-CB 4.45Å; I992-W1050 HydrophobicContact CG2-CD2 3.51Å; I992-W1050 HydrophobicContact CG2-CE3 3.68Å; I992-W1050 HydrophobicContact CG2-CG 3.86Å; I992-W1050 HydrophobicContact CG2-CH2 4.41Å; I992-W1050 HydrophobicContact CG2-CZ2 4.29Å; I992-W1050 HydrophobicContact CG2-CZ3 4.13Å
993	G	91.9	Very high	89.8	Confident	0 Å²	0	38.1 Å²	38.1	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-64.6	-47.9	-174	0	0	0	0	0	113.4	D989 G997 A1054	D989-G993 WeakPolarHBondContact O-CA 3.44Å; D989-G993 PolarHBondContact O-N 3.35Å; G993-G997 PolarHBondContact O-N 3.04Å; G993-A1054 VanDerWaalsContact O-CA 3.28Å; G993-A1054 WeakPolarHBondContact O-CA 3.49Å
994	V	92.8	Very high	89.1	Confident	16 Å²	16	34.4 Å²	34.4	10%	0.097	19%	0.188	C	C	.	.	H	α-helix	trans	-65.5	-45.3	179.2	179.7	0	0	0	0	110.6	I990 Y996 G997 L998 M1053 V1057 I1096	I990-V994 HydrophobicContact CG2-CG2 4.17Å; I990-V994 WeakPolarHBondContact O-CB 3.49Å; I990-V994 WeakPolarHBondContact O-CG2 3.46Å; I990-V994 PolarHBondContact O-N 3.32Å; V994-Y996 PolarHBondContact O-N 3.19Å; V994-G997 PolarHBondContact O-N 2.75Å; V994-L998 HydrophobicContact CG1-CD1 3.69Å; V994-L998 HydrophobicContact CG1-CG 4.27Å; V994-L998 WeakPolarHBondContact O-CB 3.37Å; V994-L998 WeakPolarHBondContact O-CD1 3.32Å; V994-L998 WeakPolarHBondContact O-CG 3.22Å; V994-L998 PolarHBondContact O-N 2.95Å; V994-M1053 HydrophobicContact CG2-CG 3.96Å; V994-M1053 HydrophobicContact CG2-SD 4.03Å; V994-V1057 HydrophobicContact CG1-CG1 4.39Å; V994-V1057 HydrophobicContact CG2-CG2 4.18Å; V994-I1096 HydrophobicContact CG1-CD1 3.9Å; V994-I1096 HydrophobicContact CG2-CD1 3.81Å; V994-I1096 HydrophobicContact CG2-CG1 4.08Å; V994-I1096 HydrophobicContact CG2-CG2 3.9Å
995	A	93.4	Very high	88.3	Confident	44 Å²	44	34.2 Å²	34.2	36%	0.364	20%	0.2	S	C	.	.	H	α-helix	trans	-60.8	-47.3	178.6	0	0	0	0	0	112.2	T991 I992 I999	T991-A995 VanDerWaalsContact O-CB 3.32Å; T991-A995 WeakPolarHBondContact O-CB 3.42Å; I992-A995 PolarHBondContact O-N 3.04Å; A995-I999 WeakPolarHBondContact O-CD1 3.33Å; A995-I999 VanDerWaalsContact O-CG1 3.25Å; A995-I999 WeakPolarHBondContact O-CG1 3.41Å; A995-I999 PolarHBondContact O-N 2.92Å; A995-I999 VanDerWaalsContact O-N 3.14Å
996	Y	94.3	Very high	87.7	Confident	40 Å²	40	43.5 Å²	43.5	16%	0.157	24%	0.24	C	C	.	.	H	α-helix	trans	-64.8	-45.8	179.9	-165.1	-79.2	0	0	0	111.9	I992 V994 L998 I999 S1000 M1011 F1014 L1015 W1050 A1054	I992-Y996 VanDerWaalsContact O-CB 3.27Å; I992-Y996 WeakPolarHBondContact O-CB 3.34Å; I992-Y996 PolarHBondContact O-N 3.28Å; V994-Y996 PolarHBondContact O-N 3.19Å; Y996-L998 PolarHBondContact O-N 2.81Å; Y996-I999 PolarHBondContact O-N 3.32Å; Y996-S1000 WeakPolarHBondContact O-CB 3.5Å; Y996-S1000 PolarHBondContact O-N 2.68Å; Y996-M1011 HydrophobicContact CD1-CE 3.54Å; Y996-M1011 HydrophobicContact CD2-CE 3.93Å; Y996-M1011 HydrophobicContact CE1-CB 3.84Å; Y996-M1011 HydrophobicContact CE1-CE 3.46Å; Y996-M1011 VanDerWaalsContact CE1-CE 3.46Å; Y996-M1011 HydrophobicContact CE1-CG 4.37Å; Y996-M1011 HydrophobicContact CE2-CE 3.86Å; Y996-M1011 HydrophobicContact CG-CE 3.78Å; Y996-M1011 VanDerWaalsContact O-CE 3.29Å; Y996-M1011 WeakPolarHBondContact O-CE 3.36Å; Y996-M1011 VanDerWaalsContact OH-CA 3.26Å; Y996-M1011 WeakPolarHBondContact OH-CA 3.35Å; Y996-M1011 WeakPolarHBondContact OH-CB 3.31Å; Y996-M1011 PolarHBondContact OH-O 3.28Å; Y996-F1014 HydrophobicContact CE2-CD1 4.2Å; Y996-F1014 WeakPolarHBondContact OH-CD1 3.38Å; Y996-L1015 HydrophobicContact CD1-CD1 4.08Å; Y996-L1015 HydrophobicContact CD1-CD2 4.18Å; Y996-L1015 HydrophobicContact CD1-CG 4.35Å; Y996-L1015 HydrophobicContact CE1-CD1 3.71Å; Y996-L1015 HydrophobicContact CE1-CD2 3.68Å; Y996-L1015 HydrophobicContact CE1-CG 3.61Å; Y996-W1050 AromaticContact CD1-CZ3 3.99Å; Y996-W1050 HydrophobicContact CD1-CZ3 3.99Å; Y996-W1050 AromaticContact CD2-CH2 3.82Å; Y996-W1050 HydrophobicContact CD2-CH2 3.82Å; Y996-W1050 AromaticContact CD2-CZ3 3.71Å; Y996-W1050 HydrophobicContact CD2-CZ3 3.71Å; Y996-W1050 HydrophobicContact CE1-CZ3 4.48Å; Y996-W1050 AromaticContact CE2-CH2 3.98Å; Y996-W1050 HydrophobicContact CE2-CH2 3.98Å; Y996-W1050 HydrophobicContact CE2-CZ3 4.24Å; Y996-W1050 HydrophobicContact CG-CH2 4.15Å; Y996-W1050 AromaticContact CG-CZ3 3.57Å; Y996-W1050 HydrophobicContact CG-CZ3 3.57Å; Y996-A1054 HydrophobicContact CD1-CB 3.98Å; Y996-A1054 HydrophobicContact CG-CB 4.42Å
997	G	91.4	Very high	87.4	Confident	0 Å²	0	46.6 Å²	46.6	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-61.8	-43	179.7	0	0	0	0	0	113.1	G993 V994 S1000 G1001 A1054 R1058	G993-G997 PolarHBondContact O-N 3.04Å; V994-G997 PolarHBondContact O-N 2.75Å; G997-S1000 PolarHBondContact O-N 3.27Å; G997-G1001 PolarHBondContact O-N 3.37Å; G997-A1054 VanDerWaalsContact CA-O 3.25Å; G997-A1054 WeakPolarHBondContact CA-O 3.17Å; G997-R1058 WeakPolarHBondContact O-CA 3.22Å
998	L	91.8	Very high	87.1	Confident	4 Å²	4	42 Å²	42	2%	0.021	23%	0.234	C	C	.	.	H	α-helix	trans	-62.7	-45.6	176.4	-71.9	165.7	0	0	0	111.9	V994 Y996 S1000 G1001 M1002 V1057 A1084 I1088 I1089 I1092	V994-L998 HydrophobicContact CG1-CD1 3.69Å; V994-L998 HydrophobicContact CG1-CG 4.27Å; V994-L998 WeakPolarHBondContact O-CB 3.37Å; V994-L998 WeakPolarHBondContact O-CD1 3.32Å; V994-L998 WeakPolarHBondContact O-CG 3.22Å; V994-L998 PolarHBondContact O-N 2.95Å; Y996-L998 PolarHBondContact O-N 2.81Å; L998-S1000 VanDerWaalsContact C-N 3.34Å; L998-S1000 PolarHBondContact O-N 3.05Å; L998-G1001 PolarHBondContact O-N 3.21Å; L998-M1002 VanDerWaalsContact O-CB 3.23Å; L998-M1002 WeakPolarHBondContact O-CB 3.32Å; L998-M1002 VanDerWaalsContact O-CG 3.24Å; L998-M1002 WeakPolarHBondContact O-CG 3.38Å; L998-M1002 PolarHBondContact O-N 2.59Å; L998-V1057 HydrophobicContact CD2-CG1 4.2Å; L998-V1057 HydrophobicContact CG-CG1 3.85Å; L998-A1084 HydrophobicContact CD2-CB 4.41Å; L998-I1088 HydrophobicContact CD2-CB 4.49Å; L998-I1088 HydrophobicContact CD2-CG2 3.99Å; L998-I1089 HydrophobicContact CD1-CD1 3.48Å; L998-I1089 VanDerWaalsContact CD1-CD1 3.48Å; L998-I1089 HydrophobicContact CD1-CG1 3.62Å; L998-I1089 HydrophobicContact CD2-CG1 3.9Å; L998-I1089 HydrophobicContact CG-CG1 4.39Å; L998-I1092 HydrophobicContact CD2-CD1 4.35Å
999	I	92.6	Very high	86.4	Confident	58 Å²	58	43.8 Å²	43.8	30%	0.297	25%	0.247	S	C	.	.	H	α-helix	trans	-61.5	-45.6	178.4	-67.6	165.4	0	0	0	110.3	A995 Y996 L1003 M1011 W1081	A995-I999 WeakPolarHBondContact O-CD1 3.33Å; A995-I999 VanDerWaalsContact O-CG1 3.25Å; A995-I999 WeakPolarHBondContact O-CG1 3.41Å; A995-I999 PolarHBondContact O-N 2.92Å; A995-I999 VanDerWaalsContact O-N 3.14Å; Y996-I999 PolarHBondContact O-N 3.32Å; I999-L1003 HydrophobicContact CG2-CD1 3.79Å; I999-L1003 WeakPolarHBondContact O-CB 3.4Å; I999-L1003 WeakPolarHBondContact O-CG 3.32Å; I999-L1003 PolarHBondContact O-N 3.17Å; I999-M1011 HydrophobicContact CB-CE 4.06Å; I999-M1011 HydrophobicContact CG2-CE 3.9Å; I999-M1011 HydrophobicContact CG2-SD 3.84Å; I999-W1081 HydrophobicContact CD1-CH2 3.95Å; I999-W1081 HydrophobicContact CD1-CZ2 4.33Å; I999-W1081 HydrophobicContact CG1-CH2 3.49Å; I999-W1081 VanDerWaalsContact CG1-CH2 3.49Å; I999-W1081 HydrophobicContact CG1-CZ2 3.9Å
1000	S	88.5	Confident	86.1	Confident	0 Å²	0	46.8 Å²	46.8	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-56.2	-53.6	177.5	-142.6	0	0	0	0	110.7	Y996 G997 L998 G1004 D1008 M1011 Q1012	Y996-S1000 WeakPolarHBondContact O-CB 3.5Å; Y996-S1000 PolarHBondContact O-N 2.68Å; G997-S1000 PolarHBondContact O-N 3.27Å; L998-S1000 VanDerWaalsContact C-N 3.34Å; L998-S1000 PolarHBondContact O-N 3.05Å; S1000-G1004 PolarHBondContact O-N 2.72Å; S1000-D1008 VanDerWaalsContact CB-OD1 3.27Å; S1000-D1008 WeakPolarHBondContact CB-OD1 3.27Å; S1000-D1008 WeakPolarHBondContact O-CB 3.35Å; S1000-D1008 PolarHBondContact OG-OD1 3.4Å; S1000-M1011 WeakPolarHBondContact OG-CB 3.09Å; S1000-Q1012 PolarHBondContact OG-NE2 3.26Å
1001	G	84.8	Confident	86	Confident	1 Å²	1	45.6 Å²	45.6	1%	0.01	27%	0.266	C	S	.	.	H	α-helix	trans	-70.7	-38.7	-177.6	0	0	0	0	0	115.1	G997 L998 L1003	G997-G1001 PolarHBondContact O-N 3.37Å; L998-G1001 PolarHBondContact O-N 3.21Å; G1001-L1003 PolarHBondContact O-N 3.15Å
1002	M	83.3	Confident	85.4	Confident	16 Å²	16	43 Å²	43	8%	0.079	25%	0.248	C	C	.	.	H	α-helix	trans	-75.1	-22.1	-178.1	-71.1	-60.3	-59.9	0	0	113.8	L998 T1061 K1080 I1083 A1084 I1088	L998-M1002 VanDerWaalsContact O-CB 3.23Å; L998-M1002 WeakPolarHBondContact O-CB 3.32Å; L998-M1002 VanDerWaalsContact O-CG 3.24Å; L998-M1002 WeakPolarHBondContact O-CG 3.38Å; L998-M1002 PolarHBondContact O-N 2.59Å; M1002-T1061 HydrophobicContact CG-CG2 3.81Å; M1002-T1061 HydrophobicContact SD-CG2 3.85Å; M1002-K1080 HydrophobicContact CE-CB 3.84Å; M1002-K1080 HydrophobicContact CE-CD 4.34Å; M1002-K1080 HydrophobicContact CE-CG 4.03Å; M1002-K1080 WeakPolarHBondContact CE-O 3.07Å; M1002-K1080 PolarHBondContact O-NZ 3.21Å; M1002-I1083 HydrophobicContact CE-CG2 4.24Å; M1002-A1084 HydrophobicContact CG-CB 4.28Å; M1002-I1088 HydrophobicContact SD-CG1 4.1Å
1003	L	82	Confident	84.8	Confident	97 Å²	97	42.2 Å²	42.2	51%	0.508	24%	0.241	S	C	.	.	H	α-helix	trans	-95.8	-41.3	177	-63.8	-178.9	0	0	0	112.5	I999 G1001 V1007	I999-L1003 HydrophobicContact CG2-CD1 3.79Å; I999-L1003 WeakPolarHBondContact O-CB 3.4Å; I999-L1003 WeakPolarHBondContact O-CG 3.32Å; I999-L1003 PolarHBondContact O-N 3.17Å; G1001-L1003 PolarHBondContact O-N 3.15Å; L1003-V1007 HydrophobicContact CB-CB 4.3Å; L1003-V1007 HydrophobicContact CB-CG1 4.36Å; L1003-V1007 HydrophobicContact CD1-CG1 3.89Å
1004	G	76.5	Confident	84.4	Confident	13 Å²	13	47 Å²	47	13%	0.134	26%	0.262	C	S	.	.			trans	64.8	-164.5	178.1	0	0	0	0	0	114.3	S1000 K1006 V1007 D1008	S1000-G1004 PolarHBondContact O-N 2.72Å; G1004-K1006 PolarHBondContact O-N 3.44Å; G1004-V1007 PolarHBondContact O-N 2.92Å; G1004-D1008 WeakPolarHBondContact O-CB 3.29Å; G1004-D1008 PolarHBondContact O-N 2.88Å
1005	G	75.3	Confident	83.9	Confident	53 Å²	53	46.2 Å²	46.2	55%	0.546	26%	0.258	S	S	.	.	H	α-helix	trans	53.8	-133.5	167.7	0	0	0	0	0	114.8	V1007 N1009	G1005-V1007 VanDerWaalsContact C-N 3.31Å; G1005-V1007 PolarHBondContact O-N 2.88Å; G1005-N1009 PolarHBondContact O-N 3.46Å; G1005-N1009 VanDerWaalsContact O-N 3.11Å; G1005-N1009 PolarHBondContact O-ND2 3.49Å
1006	K	74.4	Confident	83	Confident	197 Å²	197	48.2 Å²	48.2	86%	0.857	26%	0.26	S	S	*	.	H	α-helix	trans	-65	-31.7	-176.5	-66.7	-179.4	-179.1	175.5	0	113.2	G1004 A1010	G1004-K1006 PolarHBondContact O-N 3.44Å; K1006-A1010 PolarHBondContact O-N 2.76Å
1007	V	81.4	Confident	82	Confident	70 Å²	70	47.5 Å²	47.5	42%	0.424	26%	0.258	S	S	.	.	H	α-helix	trans	-72.6	-48.1	179.4	-179.1	0	0	0	0	110.3	L1003 G1004 G1005 N1009 A1010 M1011	L1003-V1007 HydrophobicContact CB-CB 4.3Å; L1003-V1007 HydrophobicContact CB-CG1 4.36Å; L1003-V1007 HydrophobicContact CD1-CG1 3.89Å; G1004-V1007 PolarHBondContact O-N 2.92Å; G1005-V1007 VanDerWaalsContact C-N 3.31Å; G1005-V1007 PolarHBondContact O-N 2.88Å; V1007-N1009 VanDerWaalsContact C-N 3.34Å; V1007-N1009 PolarHBondContact O-N 3.42Å; V1007-A1010 PolarHBondContact O-N 3.04Å; V1007-A1010 VanDerWaalsContact O-N 3.16Å; V1007-M1011 HydrophobicContact CG1-CG 4.39Å; V1007-M1011 HydrophobicContact CG1-SD 3.88Å; V1007-M1011 WeakPolarHBondContact O-CB 3.39Å; V1007-M1011 WeakPolarHBondContact O-CG 3.07Å; V1007-M1011 PolarHBondContact O-N 2.9Å
1008	D	83.4	Confident	81.2	Confident	9 Å²	9	49 Å²	49	5%	0.048	27%	0.266	C	S	.	.	H	α-helix	trans	-59	-43.8	177.2	-175.1	51.7	0	0	0	112.2	S1000 G1004 A1010 M1011 Q1012 R1058	S1000-D1008 VanDerWaalsContact CB-OD1 3.27Å; S1000-D1008 WeakPolarHBondContact CB-OD1 3.27Å; S1000-D1008 WeakPolarHBondContact O-CB 3.35Å; S1000-D1008 PolarHBondContact OG-OD1 3.4Å; G1004-D1008 WeakPolarHBondContact O-CB 3.29Å; G1004-D1008 PolarHBondContact O-N 2.88Å; D1008-A1010 PolarHBondContact O-N 3.24Å; D1008-M1011 PolarHBondContact O-N 3.17Å; D1008-Q1012 WeakPolarHBondContact O-CG 3.21Å; D1008-Q1012 PolarHBondContact O-N 3.33Å; D1008-R1058 VanDerWaalsContact CG-NE 3.25Å; D1008-R1058 VanDerWaalsContact OD1-CD 3.26Å; D1008-R1058 WeakPolarHBondContact OD1-CD 3.48Å; D1008-R1058 IonicContact OD1-CZ 2.76Å; D1008-R1058 IonicContact OD1-NE 3.95Å; D1008-R1058 PolarHBondContact OD1-NE 3.28Å; D1008-R1058 IonicContact OD1-NH2 2.75Å; D1008-R1058 IonicContact OD2-CZ 3.33Å; D1008-R1058 VanDerWaalsContact OD2-CZ 3.27Å; D1008-R1058 IonicContact OD2-NE 2.63Å; D1008-R1058 PolarHBondContact OD2-NE 3.39Å; D1008-R1058 IonicContact OD2-NH2 3.94Å; D1008-R1058 PolarHBondContact OD2-NH2 3.25Å
1009	N	74.7	Confident	80.3	Confident	112 Å²	112	50.6 Å²	50.6	60%	0.599	28%	0.278	S	S	*	.	H	α-helix	trans	-59.2	-43.2	174.7	-80.2	-64.3	0	0	0	112.7	G1005 V1007 R1013	G1005-N1009 PolarHBondContact O-N 3.46Å; G1005-N1009 VanDerWaalsContact O-N 3.11Å; G1005-N1009 PolarHBondContact O-ND2 3.49Å; V1007-N1009 VanDerWaalsContact C-N 3.34Å; V1007-N1009 PolarHBondContact O-N 3.42Å; N1009-R1013 WeakPolarHBondContact O-CB 3.25Å; N1009-R1013 PolarHBondContact O-N 3.31Å
1010	A	80.9	Confident	79.1	Confident	65 Å²	65	48 Å²	48	54%	0.537	27%	0.265	S	S	.	.	H	α-helix	trans	-66.5	-38.5	176	0	0	0	0	0	112.1	K1006 V1007 D1008 R1013 F1014	K1006-A1010 PolarHBondContact O-N 2.76Å; V1007-A1010 PolarHBondContact O-N 3.04Å; V1007-A1010 VanDerWaalsContact O-N 3.16Å; D1008-A1010 PolarHBondContact O-N 3.24Å; A1010-R1013 WeakPolarHBondContact O-CB 3.39Å; A1010-R1013 PolarHBondContact O-N 3.49Å; A1010-F1014 PolarHBondContact O-N 3.26Å; A1010-F1014 VanDerWaalsContact O-N 3.14Å
1011	M	87.2	Confident	78.3	Confident	26 Å²	26	48.5 Å²	48.5	13%	0.128	27%	0.268	C	S	.	.	H	α-helix	trans	-68.9	-40.9	177.9	-74.6	-179.7	68.5	0	0	112.6	Y996 I999 S1000 V1007 D1008 F1014 L1015	Y996-M1011 HydrophobicContact CD1-CE 3.54Å; Y996-M1011 HydrophobicContact CD2-CE 3.93Å; Y996-M1011 HydrophobicContact CE1-CB 3.84Å; Y996-M1011 HydrophobicContact CE1-CE 3.46Å; Y996-M1011 VanDerWaalsContact CE1-CE 3.46Å; Y996-M1011 HydrophobicContact CE1-CG 4.37Å; Y996-M1011 HydrophobicContact CE2-CE 3.86Å; Y996-M1011 HydrophobicContact CG-CE 3.78Å; Y996-M1011 VanDerWaalsContact O-CE 3.29Å; Y996-M1011 WeakPolarHBondContact O-CE 3.36Å; Y996-M1011 VanDerWaalsContact OH-CA 3.26Å; Y996-M1011 WeakPolarHBondContact OH-CA 3.35Å; Y996-M1011 WeakPolarHBondContact OH-CB 3.31Å; Y996-M1011 PolarHBondContact OH-O 3.28Å; I999-M1011 HydrophobicContact CB-CE 4.06Å; I999-M1011 HydrophobicContact CG2-CE 3.9Å; I999-M1011 HydrophobicContact CG2-SD 3.84Å; S1000-M1011 WeakPolarHBondContact OG-CB 3.09Å; V1007-M1011 HydrophobicContact CG1-CG 4.39Å; V1007-M1011 HydrophobicContact CG1-SD 3.88Å; V1007-M1011 WeakPolarHBondContact O-CB 3.39Å; V1007-M1011 WeakPolarHBondContact O-CG 3.07Å; V1007-M1011 PolarHBondContact O-N 2.9Å; D1008-M1011 PolarHBondContact O-N 3.17Å; M1011-F1014 PolarHBondContact O-N 3.48Å; M1011-L1015 WeakPolarHBondContact O-CG 3.46Å; M1011-L1015 PolarHBondContact O-N 2.72Å
1012	Q	79.6	Confident	77.5	Confident	22 Å²	22	49 Å²	49	10%	0.103	27%	0.271	C	S	.	.	H	α-helix	trans	-63.8	-41.8	172.3	-68.3	-49.7	-91.4	0	0	111.4	S1000 D1008 F1014 L1015 E1016 R1058	S1000-Q1012 PolarHBondContact OG-NE2 3.26Å; D1008-Q1012 WeakPolarHBondContact O-CG 3.21Å; D1008-Q1012 PolarHBondContact O-N 3.33Å; Q1012-F1014 VanDerWaalsContact C-N 3.27Å; Q1012-F1014 PolarHBondContact O-N 3.05Å; Q1012-L1015 CarbonylContact O-C 3.57Å; Q1012-L1015 WeakPolarHBondContact O-CA 3.49Å; Q1012-L1015 PolarHBondContact O-N 3.05Å; Q1012-E1016 WeakPolarHBondContact O-CG 3.39Å; Q1012-E1016 PolarHBondContact O-N 3.46Å; Q1012-R1058 VanDerWaalsContact CD-NE 3.33Å; Q1012-R1058 VanDerWaalsContact CG-CZ 3.46Å; Q1012-R1058 VanDerWaalsContact OE1-NH1 3.07Å
1013	R	79.9	Confident	76.9	Confident	43 Å²	43	51 Å²	51	16%	0.162	28%	0.282	C	S	.	.	H	α-helix	trans	-56.9	-40.2	176.5	-160.6	73.3	-175.5	114.4	17.7	112.4	F566 T570 N1009 A1010 E1016 I1017	F566-R1013 PolarHBondContact O-NH2 3.37Å; T570-R1013 PolarHBondContact OG1-NH1 3.21Å; T570-R1013 PolarHBondContact OG1-NH2 2.93Å; N1009-R1013 WeakPolarHBondContact O-CB 3.25Å; N1009-R1013 PolarHBondContact O-N 3.31Å; A1010-R1013 WeakPolarHBondContact O-CB 3.39Å; A1010-R1013 PolarHBondContact O-N 3.49Å; R1013-E1016 WeakPolarHBondContact CD-OE2 3.48Å; R1013-E1016 IonicContact CZ-OE2 3.81Å; R1013-E1016 IonicContact NE-OE2 3.71Å; R1013-E1016 IonicContact NH1-OE2 3.98Å; R1013-E1016 PolarHBondContact NH1-OE2 3.13Å; R1013-E1016 WeakPolarHBondContact O-CB 3.34Å; R1013-E1016 PolarHBondContact O-N 3.03Å; R1013-I1017 HydrophobicContact CG-CD1 4.27Å; R1013-I1017 VanDerWaalsContact O-CD1 3.27Å; R1013-I1017 WeakPolarHBondContact O-CD1 3.5Å; R1013-I1017 VanDerWaalsContact O-CG1 3.23Å; R1013-I1017 WeakPolarHBondContact O-CG1 3.26Å; R1013-I1017 PolarHBondContact O-N 2.86Å
1014	F	83.8	Confident	76.2	Confident	100 Å²	100	46.8 Å²	46.8	44%	0.439	26%	0.26	S	S	.	.	H	α-helix	trans	-64.6	-42.3	173.6	-179.3	-102.7	0	0	0	112.6	Y996 A1010 M1011 Q1012 E1016 I1017 L1018 W1050	Y996-F1014 HydrophobicContact CE2-CD1 4.2Å; Y996-F1014 WeakPolarHBondContact OH-CD1 3.38Å; A1010-F1014 PolarHBondContact O-N 3.26Å; A1010-F1014 VanDerWaalsContact O-N 3.14Å; M1011-F1014 PolarHBondContact O-N 3.48Å; Q1012-F1014 VanDerWaalsContact C-N 3.27Å; Q1012-F1014 PolarHBondContact O-N 3.05Å; F1014-E1016 VanDerWaalsContact C-N 3.32Å; F1014-E1016 PolarHBondContact O-N 2.8Å; F1014-I1017 PolarHBondContact O-N 2.67Å; F1014-L1018 HydrophobicContact CD1-CD1 4Å; F1014-L1018 HydrophobicContact CE1-CD1 3.41Å; F1014-L1018 VanDerWaalsContact CE1-CD1 3.41Å; F1014-L1018 HydrophobicContact CE1-CG 4.2Å; F1014-L1018 HydrophobicContact CE2-CD1 4.46Å; F1014-L1018 HydrophobicContact CE2-CG 4.49Å; F1014-L1018 HydrophobicContact CZ-CD1 3.69Å; F1014-L1018 HydrophobicContact CZ-CG 4.17Å; F1014-L1018 PolarHBondContact O-N 3.19Å; F1014-W1050 HydrophobicContact CE1-CH2 4.28Å; F1014-W1050 HydrophobicContact CE1-CZ2 4.42Å
1015	L	82.2	Confident	75.7	Confident	0 Å²	0	46.3 Å²	46.3	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-67.4	-28.7	174.6	-61.6	-172.3	0	0	0	113.5	Y996 M1011 Q1012 S1019 W1050 I1051 A1054 R1055	Y996-L1015 HydrophobicContact CD1-CD1 4.08Å; Y996-L1015 HydrophobicContact CD1-CD2 4.18Å; Y996-L1015 HydrophobicContact CD1-CG 4.35Å; Y996-L1015 HydrophobicContact CE1-CD1 3.71Å; Y996-L1015 HydrophobicContact CE1-CD2 3.68Å; Y996-L1015 HydrophobicContact CE1-CG 3.61Å; M1011-L1015 WeakPolarHBondContact O-CG 3.46Å; M1011-L1015 PolarHBondContact O-N 2.72Å; Q1012-L1015 CarbonylContact O-C 3.57Å; Q1012-L1015 WeakPolarHBondContact O-CA 3.49Å; Q1012-L1015 PolarHBondContact O-N 3.05Å; L1015-S1019 WeakPolarHBondContact O-CB 3.5Å; L1015-S1019 PolarHBondContact O-N 3.09Å; L1015-S1019 VanDerWaalsContact O-N 3.14Å; L1015-W1050 HydrophobicContact CD2-CE3 4.47Å; L1015-W1050 HydrophobicContact CD2-CH2 3.42Å; L1015-W1050 VanDerWaalsContact CD2-CH2 3.42Å; L1015-W1050 HydrophobicContact CD2-CZ2 4.35Å; L1015-W1050 HydrophobicContact CD2-CZ3 3.49Å; L1015-W1050 VanDerWaalsContact CD2-CZ3 3.49Å; L1015-I1051 HydrophobicContact CB-CG2 4.2Å; L1015-I1051 HydrophobicContact CD2-CG1 4.33Å; L1015-I1051 HydrophobicContact CD2-CG2 4.31Å; L1015-A1054 HydrophobicContact CD1-CB 3.86Å; L1015-R1055 HydrophobicContact CD1-CG 3.97Å; L1015-R1055 PolarHBondContact O-NH2 2.91Å
1016	E	74.1	Confident	75.5	Confident	87 Å²	87	44.4 Å²	44.4	41%	0.407	23%	0.232	S	C	.	.	H	α-helix	trans	-69	-44.5	171.3	-71.3	164.1	-156	0	0	111	Q1012 R1013 F1014 S1019 G1020	Q1012-E1016 WeakPolarHBondContact O-CG 3.39Å; Q1012-E1016 PolarHBondContact O-N 3.46Å; R1013-E1016 WeakPolarHBondContact CD-OE2 3.48Å; R1013-E1016 IonicContact CZ-OE2 3.81Å; R1013-E1016 IonicContact NE-OE2 3.71Å; R1013-E1016 IonicContact NH1-OE2 3.98Å; R1013-E1016 PolarHBondContact NH1-OE2 3.13Å; R1013-E1016 WeakPolarHBondContact O-CB 3.34Å; R1013-E1016 PolarHBondContact O-N 3.03Å; F1014-E1016 VanDerWaalsContact C-N 3.32Å; F1014-E1016 PolarHBondContact O-N 2.8Å; E1016-S1019 PolarHBondContact O-N 3.37Å; E1016-G1020 PolarHBondContact O-N 3.17Å
1017	I	74.1	Confident	75.2	Confident	25 Å²	25	35.3 Å²	35.3	13%	0.128	19%	0.193	C	C	.	.	H	α-helix	trans	-64	-49.2	179.7	-67.3	155.9	0	0	0	110.9	L573 I577 R1013 F1014 G1020	L573-I1017 HydrophobicContact CB-CG2 4.25Å; L573-I1017 HydrophobicContact CD1-CD1 3.51Å; L573-I1017 HydrophobicContact CD1-CG1 3.94Å; L573-I1017 HydrophobicContact CD1-CG2 4.27Å; I577-I1017 HydrophobicContact CD1-CG2 4.44Å; R1013-I1017 HydrophobicContact CG-CD1 4.27Å; R1013-I1017 VanDerWaalsContact O-CD1 3.27Å; R1013-I1017 WeakPolarHBondContact O-CD1 3.5Å; R1013-I1017 VanDerWaalsContact O-CG1 3.23Å; R1013-I1017 WeakPolarHBondContact O-CG1 3.26Å; R1013-I1017 PolarHBondContact O-N 2.86Å; F1014-I1017 PolarHBondContact O-N 2.67Å; I1017-G1020 PolarHBondContact O-N 3.45Å
1018	L	75.4	Confident	74.4	Confident	30 Å²	30	32.4 Å²	32.4	16%	0.157	18%	0.175	C	C	.	.	H	α-helix	trans	-61.8	-45.7	176.7	-72.6	-178.8	0	0	0	112	F1014 G1020 I1021 W1050 I1051	F1014-L1018 HydrophobicContact CD1-CD1 4Å; F1014-L1018 HydrophobicContact CE1-CD1 3.41Å; F1014-L1018 VanDerWaalsContact CE1-CD1 3.41Å; F1014-L1018 HydrophobicContact CE1-CG 4.2Å; F1014-L1018 HydrophobicContact CE2-CD1 4.46Å; F1014-L1018 HydrophobicContact CE2-CG 4.49Å; F1014-L1018 HydrophobicContact CZ-CD1 3.69Å; F1014-L1018 HydrophobicContact CZ-CG 4.17Å; F1014-L1018 PolarHBondContact O-N 3.19Å; L1018-G1020 PolarHBondContact O-N 3.41Å; L1018-I1021 PolarHBondContact O-N 2.98Å; L1018-W1050 HydrophobicContact CD1-CZ2 3.93Å; L1018-I1051 HydrophobicContact CB-CD1 3.65Å; L1018-I1051 HydrophobicContact CD1-CD1 4.31Å
1019	S	72.5	Confident	73.6	Confident	38 Å²	38	32.5 Å²	32.5	27%	0.266	18%	0.175	S	C	.	.	H	α-helix	trans	-67.9	-13.9	177.9	179.9	0	0	0	0	114	L839 L1015 E1016 I1021 R1055	L839-S1019 WeakPolarHBondContact CD2-O 3.37Å; L1015-S1019 WeakPolarHBondContact O-CB 3.5Å; L1015-S1019 PolarHBondContact O-N 3.09Å; L1015-S1019 VanDerWaalsContact O-N 3.14Å; E1016-S1019 PolarHBondContact O-N 3.37Å; S1019-I1021 VanDerWaalsContact C-N 3.34Å; S1019-R1055 PolarHBondContact OG-NH2 2.98Å
1020	G	67	Low	73.5	Confident	3 Å²	3	28.6 Å²	28.6	3%	0.031	15%	0.154	C	C	.	.	H	α-helix	trans	-78.3	-19.2	174.6	0	0	0	0	0	113.4	I574 S836 E1016 I1017 L1018	I574-G1020 WeakPolarHBondContact CD1-O 3.32Å; S836-G1020 PolarHBondContact OG-O 3.48Å; E1016-G1020 PolarHBondContact O-N 3.17Å; I1017-G1020 PolarHBondContact O-N 3.45Å; L1018-G1020 PolarHBondContact O-N 3.41Å
1021	I	71.3	Confident	72.7	Confident	11 Å²	11	26.1 Å²	26.1	6%	0.056	13%	0.131	C	C	.	.	S	Bend	trans	-84.8	121.5	170.1	-46.9	172.2	0	0	0	107.4	I574 I577 L1018 S1019 N1023 V1025 V1026	I574-I1021 HydrophobicContact CG1-CG1 3.98Å; I574-I1021 HydrophobicContact CG2-CG1 4.38Å; I577-I1021 HydrophobicContact CD1-CD1 4.44Å; I577-I1021 HydrophobicContact CG2-CD1 4.07Å; L1018-I1021 PolarHBondContact O-N 2.98Å; S1019-I1021 VanDerWaalsContact C-N 3.34Å; I1021-N1023 PolarHBondContact O-N 3.32Å; I1021-V1025 HydrophobicContact CG2-CB 4.17Å; I1021-V1025 HydrophobicContact CG2-CG1 4.22Å; I1021-V1026 HydrophobicContact CB-CG2 3.95Å; I1021-V1026 HydrophobicContact CG2-CG2 3.52Å
1022	P	68.6	Low	71.5	Confident	13 Å²	13	26.8 Å²	26.8	8%	0.084	14%	0.137	C	C	.	.			trans	-62	133.8	179.5	-18.7	29.4	0	0	0	110.8	T798 L1024 V1025 V1026	T798-P1022 HydrophobicContact CG2-CB 4.33Å; P1022-L1024 PolarHBondContact O-N 3.31Å; P1022-V1025 HydrophobicContact CB-CG2 3.99Å; P1022-V1025 HydrophobicContact CG-CG2 3.96Å; P1022-V1025 WeakPolarHBondContact O-CA 3.48Å; P1022-V1025 WeakPolarHBondContact O-CB 3.35Å; P1022-V1025 PolarHBondContact O-N 3.38Å; P1022-V1026 PolarHBondContact O-N 3.01Å
1023	N	70.4	Confident	70.9	Confident	57 Å²	57	28 Å²	28	31%	0.305	15%	0.146	S	C	.	.	H	α-helix	trans	-50.4	-38.1	-174.9	-65.4	14.8	0	0	0	113.3	I1021 V1025 V1026 M1027 T1048 F1110	I1021-N1023 PolarHBondContact O-N 3.32Å; N1023-V1025 PolarHBondContact O-N 2.98Å; N1023-V1026 PolarHBondContact O-N 3.3Å; N1023-M1027 WeakPolarHBondContact O-CB 3.23Å; N1023-M1027 PolarHBondContact O-N 3.45Å; N1023-T1048 HydrophobicContact CB-CG2 4.5Å; N1023-F1110 HydrophobicContact CB-CZ 4.44Å
1024	L	66.7	Low	70.6	Confident	8 Å²	8	30.1 Å²	30.1	4%	0.042	16%	0.156	C	C	.	.	H	α-helix	trans	-60.9	-41.9	176.1	-170.4	109.3	0	0	0	112.2	L801 F816 P1022 M1027 I1028 F1113	L801-L1024 HydrophobicContact CD1-CD1 4.24Å; L801-L1024 HydrophobicContact CD1-CD2 3.42Å; L801-L1024 VanDerWaalsContact CD1-CD2 3.42Å; L801-L1024 HydrophobicContact CD1-CG 4.37Å; F816-L1024 HydrophobicContact CD1-CD2 4.02Å; F816-L1024 HydrophobicContact CE1-CD2 3.89Å; P1022-L1024 PolarHBondContact O-N 3.31Å; L1024-M1027 CarbonylContact O-C 3.33Å; L1024-M1027 PolarHBondContact O-N 3.36Å; L1024-I1028 HydrophobicContact CD2-CD1 3.39Å; L1024-I1028 HydrophobicContact CD2-CG1 4.46Å; L1024-I1028 HydrophobicContact CG-CD1 3.69Å; L1024-I1028 HydrophobicContact CG-CG1 4.31Å; L1024-I1028 WeakPolarHBondContact O-CB 3.27Å; L1024-I1028 VanDerWaalsContact O-CD1 3.25Å; L1024-I1028 WeakPolarHBondContact O-CD1 3.42Å; L1024-I1028 WeakPolarHBondContact O-CG1 3.09Å; L1024-I1028 PolarHBondContact O-N 3.34Å; L1024-F1113 HydrophobicContact CD1-CD1 4.34Å; L1024-F1113 HydrophobicContact CD1-CE1 3.29Å; L1024-F1113 HydrophobicContact CD1-CZ 3.48Å; L1024-F1113 VanDerWaalsContact CD1-CZ 3.48Å
1025	V	66.4	Low	70.1	Confident	3 Å²	3	33.6 Å²	33.6	2%	0.018	17%	0.174	C	C	.	.	H	α-helix	trans	-62.5	-48.1	178.6	-179.9	0	0	0	0	110.7	F816 T832 I1021 P1022 N1023 M1027 I1028 L1029	F816-V1025 HydrophobicContact CE1-CG2 4.02Å; F816-V1025 HydrophobicContact CZ-CG2 3.87Å; T832-V1025 HydrophobicContact CG2-CG1 3.79Å; T832-V1025 HydrophobicContact CG2-CG2 4.31Å; T832-V1025 WeakPolarHBondContact OG1-CG1 3.46Å; I1021-V1025 HydrophobicContact CG2-CB 4.17Å; I1021-V1025 HydrophobicContact CG2-CG1 4.22Å; P1022-V1025 HydrophobicContact CB-CG2 3.99Å; P1022-V1025 HydrophobicContact CG-CG2 3.96Å; P1022-V1025 WeakPolarHBondContact O-CA 3.48Å; P1022-V1025 WeakPolarHBondContact O-CB 3.35Å; P1022-V1025 PolarHBondContact O-N 3.38Å; N1023-V1025 PolarHBondContact O-N 2.98Å; V1025-M1027 PolarHBondContact O-N 3.21Å; V1025-I1028 PolarHBondContact O-N 3.32Å; V1025-L1029 HydrophobicContact CG1-CD1 3.86Å; V1025-L1029 HydrophobicContact CG1-CG 4.46Å; V1025-L1029 WeakPolarHBondContact O-CB 3.18Å; V1025-L1029 VanDerWaalsContact O-CG 3.26Å; V1025-L1029 WeakPolarHBondContact O-CG 3.36Å; V1025-L1029 PolarHBondContact O-N 3.21Å
1026	V	71.5	Confident	69.7	Low	14 Å²	14	37 Å²	37	9%	0.085	20%	0.196	C	C	.	.	H	α-helix	trans	-54.7	-47.2	173.9	-179.3	0	0	0	0	109.9	I1021 P1022 N1023 L1029 M1030 I1047 T1048	I1021-V1026 HydrophobicContact CB-CG2 3.95Å; I1021-V1026 HydrophobicContact CG2-CG2 3.52Å; P1022-V1026 PolarHBondContact O-N 3.01Å; N1023-V1026 PolarHBondContact O-N 3.3Å; V1026-L1029 PolarHBondContact O-N 2.81Å; V1026-M1030 VanDerWaalsContact O-CG 3.3Å; V1026-M1030 WeakPolarHBondContact O-CG 3.25Å; V1026-M1030 PolarHBondContact O-N 2.77Å; V1026-I1047 HydrophobicContact CG1-CB 3.99Å; V1026-I1047 HydrophobicContact CG1-CD1 3.92Å; V1026-I1047 HydrophobicContact CG1-CG2 3.81Å; V1026-T1048 HydrophobicContact CB-CG2 4.13Å; V1026-T1048 HydrophobicContact CG1-CG2 4.19Å; V1026-T1048 HydrophobicContact CG2-CG2 3.88Å
1027	M	68.9	Low	70	Confident	6 Å²	6	33.6 Å²	33.6	3%	0.03	19%	0.185	C	C	.	.	H	α-helix	trans	-68.3	-38.6	-175.5	-170.9	160.9	60.4	0	0	113.4	N1023 L1024 V1025 M1030 L1031 A1044 F1110 L1114	N1023-M1027 WeakPolarHBondContact O-CB 3.23Å; N1023-M1027 PolarHBondContact O-N 3.45Å; L1024-M1027 CarbonylContact O-C 3.33Å; L1024-M1027 PolarHBondContact O-N 3.36Å; V1025-M1027 PolarHBondContact O-N 3.21Å; M1027-M1030 PolarHBondContact O-N 2.84Å; M1027-L1031 HydrophobicContact CG-CD1 4.3Å; M1027-L1031 VanDerWaalsContact O-CD1 3.3Å; M1027-L1031 WeakPolarHBondContact O-CD1 3.3Å; M1027-L1031 VanDerWaalsContact O-CG 3.22Å; M1027-L1031 WeakPolarHBondContact O-CG 3.16Å; M1027-L1031 PolarHBondContact O-N 3.47Å; M1027-L1031 VanDerWaalsContact O-N 3.09Å; M1027-A1044 HydrophobicContact CB-CB 3.78Å; M1027-A1044 HydrophobicContact CG-CB 3.6Å; M1027-A1044 HydrophobicContact SD-CB 4.41Å; M1027-F1110 HydrophobicContact CE-CB 4.17Å; M1027-F1110 HydrophobicContact CE-CD1 3.75Å; M1027-F1110 HydrophobicContact CE-CG 4.23Å; M1027-F1110 HydrophobicContact SD-CB 4.43Å; M1027-L1114 HydrophobicContact CE-CD1 3.93Å; M1027-L1114 HydrophobicContact CE-CD2 3.93Å; M1027-L1114 HydrophobicContact CE-CG 3.71Å; M1027-L1114 HydrophobicContact CG-CD1 3.7Å; M1027-L1114 HydrophobicContact CG-CD2 4.23Å; M1027-L1114 HydrophobicContact CG-CG 4.31Å; M1027-L1114 HydrophobicContact SD-CD1 3.47Å; M1027-L1114 WeakPolarHBondContact SD-CD1 3.37Å; M1027-L1114 HydrophobicContact SD-CD2 4.44Å; M1027-L1114 HydrophobicContact SD-CG 3.98Å
1028	I	64	Low	70.6	Confident	8 Å²	8	35.4 Å²	35.4	4%	0.041	19%	0.194	C	C	.	.	H	α-helix	trans	-61.9	-47.8	170.1	-69.8	152.9	0	0	0	110.8	F816 I820 L1024 V1025 M1030 L1031 V1032 L1119	F816-I1028 HydrophobicContact CD1-CD1 4.33Å; F816-I1028 HydrophobicContact CE1-CD1 3.63Å; F816-I1028 HydrophobicContact CZ-CD1 4.27Å; I820-I1028 HydrophobicContact CB-CG2 4.45Å; I820-I1028 HydrophobicContact CD1-CD1 3.28Å; I820-I1028 HydrophobicContact CD1-CG1 3.99Å; I820-I1028 HydrophobicContact CD1-CG2 4.13Å; I820-I1028 HydrophobicContact CG1-CD1 4.28Å; I820-I1028 HydrophobicContact CG1-CG2 4Å; I820-I1028 HydrophobicContact CG2-CG2 3.58Å; L1024-I1028 HydrophobicContact CD2-CD1 3.39Å; L1024-I1028 HydrophobicContact CD2-CG1 4.46Å; L1024-I1028 HydrophobicContact CG-CD1 3.69Å; L1024-I1028 HydrophobicContact CG-CG1 4.31Å; L1024-I1028 WeakPolarHBondContact O-CB 3.27Å; L1024-I1028 VanDerWaalsContact O-CD1 3.25Å; L1024-I1028 WeakPolarHBondContact O-CD1 3.42Å; L1024-I1028 WeakPolarHBondContact O-CG1 3.09Å; L1024-I1028 PolarHBondContact O-N 3.34Å; V1025-I1028 PolarHBondContact O-N 3.32Å; I1028-M1030 VanDerWaalsContact C-N 3.25Å; I1028-M1030 PolarHBondContact O-N 3.4Å; I1028-L1031 CarbonylContact O-C 3.54Å; I1028-L1031 WeakPolarHBondContact O-CA 3.36Å; I1028-L1031 WeakPolarHBondContact O-CB 3.45Å; I1028-L1031 PolarHBondContact O-N 3.11Å; I1028-V1032 HydrophobicContact CG2-CG2 4.46Å; I1028-V1032 WeakPolarHBondContact O-CG2 3.45Å; I1028-V1032 PolarHBondContact O-N 3.32Å; I1028-L1119 HydrophobicContact CG1-CD1 4.2Å
1029	L	66.5	Low	71.1	Confident	11 Å²	11	40.6 Å²	40.6	6%	0.058	22%	0.215	C	C	.	.	H	α-helix	trans	-60	-39.5	-179.2	-70.6	167	0	0	0	110.8	L581 M582 V1025 V1026 L1031 V1032 V1033	L581-L1029 HydrophobicContact CB-CD1 4.28Å; L581-L1029 HydrophobicContact CB-CD2 4.3Å; L581-L1029 HydrophobicContact CD1-CD1 3.78Å; M582-L1029 HydrophobicContact CE-CD2 3.8Å; M582-L1029 HydrophobicContact SD-CD2 4.36Å; V1025-L1029 HydrophobicContact CG1-CD1 3.86Å; V1025-L1029 HydrophobicContact CG1-CG 4.46Å; V1025-L1029 WeakPolarHBondContact O-CB 3.18Å; V1025-L1029 VanDerWaalsContact O-CG 3.26Å; V1025-L1029 WeakPolarHBondContact O-CG 3.36Å; V1025-L1029 PolarHBondContact O-N 3.21Å; V1026-L1029 PolarHBondContact O-N 2.81Å; L1029-L1031 VanDerWaalsContact C-N 3.33Å; L1029-L1031 PolarHBondContact O-N 3.14Å; L1029-V1032 PolarHBondContact O-N 3.38Å; L1029-V1033 WeakPolarHBondContact O-CB 3.28Å; L1029-V1033 VanDerWaalsContact O-CG2 3.29Å; L1029-V1033 WeakPolarHBondContact O-CG2 3.2Å; L1029-V1033 PolarHBondContact O-N 3.19Å
1030	M	72	Confident	71.5	Confident	31 Å²	31	38.8 Å²	38.8	15%	0.153	20%	0.202	C	C	.	.	H	α-helix	trans	-66.7	-29.2	173.1	-64.5	-63.7	-76.1	0	0	113.7	V1026 M1027 I1028 V1032 F1034 A1043 A1044 I1047	V1026-M1030 VanDerWaalsContact O-CG 3.3Å; V1026-M1030 WeakPolarHBondContact O-CG 3.25Å; V1026-M1030 PolarHBondContact O-N 2.77Å; M1027-M1030 PolarHBondContact O-N 2.84Å; I1028-M1030 VanDerWaalsContact C-N 3.25Å; I1028-M1030 PolarHBondContact O-N 3.4Å; M1030-V1032 VanDerWaalsContact C-N 3.35Å; M1030-F1034 HydrophobicContact CE-CD2 3.88Å; M1030-F1034 HydrophobicContact CE-CE2 3.52Å; M1030-F1034 WeakPolarHBondContact O-CB 3.24Å; M1030-F1034 PolarHBondContact O-N 2.95Å; M1030-F1034 HydrophobicContact SD-CD2 4.29Å; M1030-F1034 HydrophobicContact SD-CE2 3.99Å; M1030-A1043 HydrophobicContact CE-CB 3.4Å; M1030-A1044 HydrophobicContact CB-CB 3.99Å; M1030-A1044 HydrophobicContact CG-CB 4.04Å; M1030-I1047 HydrophobicContact CE-CD1 3.99Å; M1030-I1047 HydrophobicContact CG-CD1 4.08Å; M1030-I1047 HydrophobicContact SD-CD1 3.77Å
1031	L	64.8	Low	72.3	Confident	13 Å²	13	38.6 Å²	38.6	7%	0.068	20%	0.201	C	C	.	.	H	α-helix	trans	-81.7	-8.5	175.6	-70	160.4	0	0	0	114.2	M1027 I1028 L1029 F1034 P1036 I1041 L1114 L1119	M1027-L1031 HydrophobicContact CG-CD1 4.3Å; M1027-L1031 VanDerWaalsContact O-CD1 3.3Å; M1027-L1031 WeakPolarHBondContact O-CD1 3.3Å; M1027-L1031 VanDerWaalsContact O-CG 3.22Å; M1027-L1031 WeakPolarHBondContact O-CG 3.16Å; M1027-L1031 PolarHBondContact O-N 3.47Å; M1027-L1031 VanDerWaalsContact O-N 3.09Å; I1028-L1031 CarbonylContact O-C 3.54Å; I1028-L1031 WeakPolarHBondContact O-CA 3.36Å; I1028-L1031 WeakPolarHBondContact O-CB 3.45Å; I1028-L1031 PolarHBondContact O-N 3.11Å; L1029-L1031 VanDerWaalsContact C-N 3.33Å; L1029-L1031 PolarHBondContact O-N 3.14Å; L1031-F1034 CarbonylContact C-O 3.23Å; L1031-P1036 HydrophobicContact CD2-CB 4.41Å; L1031-I1041 HydrophobicContact CD2-CG1 4.18Å; L1031-L1114 HydrophobicContact CD1-CD1 3.82Å; L1031-L1114 HydrophobicContact CD1-CD2 3.6Å; L1031-L1114 HydrophobicContact CD1-CG 4.33Å; L1031-L1119 HydrophobicContact CD1-CB 4.46Å; L1031-L1119 WeakPolarHBondContact CD1-O 3.38Å; L1031-L1119 WeakPolarHBondContact CD2-O 3.12Å
1032	V	62	Low	73	Confident	39 Å²	39	38.9 Å²	38.9	24%	0.236	20%	0.203	C	C	.	.	H	α-helix	trans	-105.4	-30.9	171.7	-173.7	0	0	0	0	111.3	L585 P586 I1028 L1029 M1030	L585-V1032 HydrophobicContact CB-CG1 4.26Å; L585-V1032 HydrophobicContact CD1-CG1 4.24Å; L585-V1032 HydrophobicContact CD2-CB 4.04Å; L585-V1032 HydrophobicContact CD2-CG1 3.78Å; L585-V1032 HydrophobicContact CG-CG1 4.3Å; P586-V1032 VanDerWaalsContact CD-O 3.3Å; P586-V1032 WeakPolarHBondContact CD-O 3.23Å; P586-V1032 WeakPolarHBondContact CG-O 3.33Å; I1028-V1032 HydrophobicContact CG2-CG2 4.46Å; I1028-V1032 WeakPolarHBondContact O-CG2 3.45Å; I1028-V1032 PolarHBondContact O-N 3.32Å; L1029-V1032 PolarHBondContact O-N 3.38Å; M1030-V1032 VanDerWaalsContact C-N 3.35Å
1033	V	66.8	Low	73.7	Confident	49 Å²	49	39.1 Å²	39.1	30%	0.297	21%	0.206	S	C	.	.	H	α-helix	trans	-75.6	-33	173.1	172.3	0	0	0	0	112.2	L585 L1029	L585-V1033 HydrophobicContact CD2-CG2 3.87Å; L1029-V1033 WeakPolarHBondContact O-CB 3.28Å; L1029-V1033 VanDerWaalsContact O-CG2 3.29Å; L1029-V1033 WeakPolarHBondContact O-CG2 3.2Å; L1029-V1033 PolarHBondContact O-N 3.19Å
1034	F	74.3	Confident	74.2	Confident	86 Å²	86	36.5 Å²	36.5	38%	0.377	19%	0.192	S	C	.	.	S	Bend	trans	-122.5	153.2	176.2	-59	-85.2	0	0	0	110.4	M1030 L1031 F1039	M1030-F1034 HydrophobicContact CE-CD2 3.88Å; M1030-F1034 HydrophobicContact CE-CE2 3.52Å; M1030-F1034 WeakPolarHBondContact O-CB 3.24Å; M1030-F1034 PolarHBondContact O-N 2.95Å; M1030-F1034 HydrophobicContact SD-CD2 4.29Å; M1030-F1034 HydrophobicContact SD-CE2 3.99Å; L1031-F1034 CarbonylContact C-O 3.23Å; F1034-F1039 HydrophobicContact CD1-CD1 4.32Å; F1034-F1039 AromaticContact CD1-CE1 3.82Å; F1034-F1039 HydrophobicContact CD1-CE1 3.82Å; F1034-F1039 AromaticContact CE1-CE1 3.91Å; F1034-F1039 HydrophobicContact CE1-CE1 3.91Å; F1034-F1039 HydrophobicContact CG-CD1 4.5Å; F1034-F1039 HydrophobicContact CG-CE1 4.24Å; F1034-F1039 HydrophobicContact CZ-CE1 4.41Å
1035	E	73.5	Confident	75	Confident	174 Å²	174	36.2 Å²	36.2	81%	0.813	19%	0.191	S	C	*	.			trans	-56.2	139.8	178.7	-64.2	-174.9	163	0	0	112.2	G1037 S1040	E1035-G1037 PolarHBondContact O-N 2.91Å; E1035-G1037 VanDerWaalsContact O-N 3.13Å; E1035-S1040 WeakPolarHBondContact O-CB 3.46Å; E1035-S1040 PolarHBondContact O-OG 3.33Å
1036	P	72.6	Confident	75.8	Confident	70 Å²	70	37 Å²	37	46%	0.455	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.1	115	176	-26.8	35.6	0	0	0	112.3	L1031	L1031-P1036 HydrophobicContact CD2-CB 4.41Å
1037	G	81.7	Confident	76.3	Confident	17 Å²	17	39.2 Å²	39.2	18%	0.175	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	-179.8	-178.3	-169	0	0	0	0	0	114	E1035 F1039 S1040 I1041	E1035-G1037 PolarHBondContact O-N 2.91Å; E1035-G1037 VanDerWaalsContact O-N 3.13Å; G1037-F1039 VanDerWaalsContact C-N 3.28Å; G1037-F1039 PolarHBondContact O-N 2.93Å; G1037-S1040 PolarHBondContact N-OG 2.83Å; G1037-S1040 PolarHBondContact O-N 2.96Å; G1037-S1040 PolarHBondContact O-OG 3.14Å; G1037-S1040 VanDerWaalsContact O-OG 3.07Å; G1037-I1041 VanDerWaalsContact O-CG1 3.32Å; G1037-I1041 WeakPolarHBondContact O-CG1 3.47Å; G1037-I1041 PolarHBondContact O-N 2.95Å
1038	I	85.4	Confident	76.9	Confident	63 Å²	63	39.3 Å²	39.3	32%	0.323	21%	0.209	S	C	.	.	H	α-helix	trans	-60.1	-40.5	-179.8	-61	-179.9	0	0	0	110.9	I977 I981 V1042 L1121	I977-I1038 HydrophobicContact CG2-CD1 4.32Å; I981-I1038 HydrophobicContact CD1-CG1 4.37Å; I981-I1038 HydrophobicContact CD1-CG2 4.36Å; I981-I1038 HydrophobicContact CG1-CG2 3.94Å; I1038-V1042 HydrophobicContact CG2-CG2 4.36Å; I1038-V1042 WeakPolarHBondContact O-CB 3.21Å; I1038-V1042 VanDerWaalsContact O-CG2 3.28Å; I1038-V1042 WeakPolarHBondContact O-CG2 3.16Å; I1038-V1042 PolarHBondContact O-N 3.44Å; I1038-L1121 HydrophobicContact CG1-CD2 4.05Å
1039	F	85.3	Confident	77.9	Confident	138 Å²	138	39.8 Å²	39.8	61%	0.605	21%	0.212	S	C	*	.	H	α-helix	trans	-65.1	-47.2	-178.6	178.8	-96.7	0	0	0	112.9	F1034 G1037 V1042 A1043	F1034-F1039 HydrophobicContact CD1-CD1 4.32Å; F1034-F1039 AromaticContact CD1-CE1 3.82Å; F1034-F1039 HydrophobicContact CD1-CE1 3.82Å; F1034-F1039 AromaticContact CE1-CE1 3.91Å; F1034-F1039 HydrophobicContact CE1-CE1 3.91Å; F1034-F1039 HydrophobicContact CG-CD1 4.5Å; F1034-F1039 HydrophobicContact CG-CE1 4.24Å; F1034-F1039 HydrophobicContact CZ-CE1 4.41Å; G1037-F1039 VanDerWaalsContact C-N 3.28Å; G1037-F1039 PolarHBondContact O-N 2.93Å; F1039-V1042 PolarHBondContact O-N 2.89Å; F1039-A1043 HydrophobicContact CE1-CB 4.45Å; F1039-A1043 VanDerWaalsContact O-CB 3.23Å; F1039-A1043 WeakPolarHBondContact O-CB 3.44Å; F1039-A1043 PolarHBondContact O-N 2.86Å
1040	S	81.4	Confident	79.1	Confident	0 Å²	0	40.1 Å²	40.1	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-66.1	-39.1	-178.8	40.1	0	0	0	0	112.2	E1035 G1037 A1044	E1035-S1040 WeakPolarHBondContact O-CB 3.46Å; E1035-S1040 PolarHBondContact O-OG 3.33Å; G1037-S1040 PolarHBondContact N-OG 2.83Å; G1037-S1040 PolarHBondContact O-N 2.96Å; G1037-S1040 PolarHBondContact O-OG 3.14Å; G1037-S1040 VanDerWaalsContact O-OG 3.07Å; S1040-A1044 WeakPolarHBondContact O-CB 3.23Å; S1040-A1044 PolarHBondContact O-N 3.22Å
1041	I	84.7	Confident	79.9	Confident	0 Å²	0	39 Å²	39	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-64	-47.7	172.9	-62.1	173.3	0	0	0	111.1	I981 L1031 G1037 A1044 M1045 E1111 L1114 L1121	I981-I1041 HydrophobicContact CG2-CG2 3.89Å; L1031-I1041 HydrophobicContact CD2-CG1 4.18Å; G1037-I1041 VanDerWaalsContact O-CG1 3.32Å; G1037-I1041 WeakPolarHBondContact O-CG1 3.47Å; G1037-I1041 PolarHBondContact O-N 2.95Å; I1041-A1044 PolarHBondContact O-N 2.96Å; I1041-M1045 HydrophobicContact CG2-CE 3.64Å; I1041-M1045 HydrophobicContact CG2-SD 4.27Å; I1041-M1045 WeakPolarHBondContact O-CG 3.39Å; I1041-M1045 PolarHBondContact O-N 2.84Å; I1041-E1111 HydrophobicContact CD1-CG 4.5Å; I1041-L1114 HydrophobicContact CD1-CD1 4.23Å; I1041-L1114 HydrophobicContact CG1-CD1 3.85Å; I1041-L1114 HydrophobicContact CG2-CD1 4.33Å; I1041-L1121 HydrophobicContact CD1-CD2 4.47Å; I1041-L1121 HydrophobicContact CD1-CG 3.96Å
1042	V	85.6	Confident	80.9	Confident	16 Å²	16	41 Å²	41	10%	0.097	22%	0.221	C	C	.	.	H	α-helix	trans	-63.4	-43.9	178.3	163.6	0	0	0	0	111.7	I981 I984 F988 I1038 F1039 A1044 M1045 A1046	I981-V1042 HydrophobicContact CG1-CG2 4.34Å; I981-V1042 HydrophobicContact CG2-CG2 4.33Å; I984-V1042 HydrophobicContact CB-CG2 4.41Å; I984-V1042 HydrophobicContact CG2-CG1 3.57Å; I984-V1042 HydrophobicContact CG2-CG2 4.13Å; F988-V1042 HydrophobicContact CD2-CG1 4.37Å; F988-V1042 HydrophobicContact CE2-CG1 3.82Å; I1038-V1042 HydrophobicContact CG2-CG2 4.36Å; I1038-V1042 WeakPolarHBondContact O-CB 3.21Å; I1038-V1042 VanDerWaalsContact O-CG2 3.28Å; I1038-V1042 WeakPolarHBondContact O-CG2 3.16Å; I1038-V1042 PolarHBondContact O-N 3.44Å; F1039-V1042 PolarHBondContact O-N 2.89Å; V1042-A1044 VanDerWaalsContact C-N 3.33Å; V1042-A1044 PolarHBondContact O-N 2.73Å; V1042-M1045 PolarHBondContact O-N 3.37Å; V1042-A1046 WeakPolarHBondContact O-CB 3.13Å; V1042-A1046 PolarHBondContact O-N 3.1Å
1043	A	82.5	Confident	82.3	Confident	19 Å²	19	39.2 Å²	39.2	16%	0.157	21%	0.21	C	C	.	.	H	α-helix	trans	-66.2	-35.4	-179.6	0	0	0	0	0	112	M1030 F1039 A1046 I1047	M1030-A1043 HydrophobicContact CE-CB 3.4Å; F1039-A1043 HydrophobicContact CE1-CB 4.45Å; F1039-A1043 VanDerWaalsContact O-CB 3.23Å; F1039-A1043 WeakPolarHBondContact O-CB 3.44Å; F1039-A1043 PolarHBondContact O-N 2.86Å; A1043-A1046 PolarHBondContact O-N 2.7Å; A1043-I1047 WeakPolarHBondContact O-CG1 3.43Å; A1043-I1047 PolarHBondContact O-N 2.97Å
1044	A	80.8	Confident	83.4	Confident	1 Å²	1	36.9 Å²	36.9	1%	0.008	20%	0.196	C	C	.	.	H	α-helix	trans	-61.8	-50.2	169.4	0	0	0	0	0	112.6	M1027 M1030 S1040 I1041 V1042 A1046 I1047	M1027-A1044 HydrophobicContact CB-CB 3.78Å; M1027-A1044 HydrophobicContact CG-CB 3.6Å; M1027-A1044 HydrophobicContact SD-CB 4.41Å; M1030-A1044 HydrophobicContact CB-CB 3.99Å; M1030-A1044 HydrophobicContact CG-CB 4.04Å; S1040-A1044 WeakPolarHBondContact O-CB 3.23Å; S1040-A1044 PolarHBondContact O-N 3.22Å; I1041-A1044 PolarHBondContact O-N 2.96Å; V1042-A1044 VanDerWaalsContact C-N 3.33Å; V1042-A1044 PolarHBondContact O-N 2.73Å; A1044-A1046 VanDerWaalsContact C-N 3.25Å; A1044-A1046 PolarHBondContact O-N 3.14Å; A1044-I1047 PolarHBondContact O-N 3.06Å
1045	M	83.6	Confident	84	Confident	2 Å²	2	37.2 Å²	37.2	1%	0.01	20%	0.195	C	C	.	.	H	α-helix	trans	-59.7	-37.1	178.4	-70.5	-179.7	-178.8	0	0	111.9	I981 A985 I1041 V1042 I1047 T1048 N1049 A1107 F1110 E1111	I981-M1045 HydrophobicContact CG2-CE 3.95Å; I981-M1045 HydrophobicContact CG2-SD 3.78Å; A985-M1045 HydrophobicContact CB-CB 4.03Å; A985-M1045 HydrophobicContact CB-CG 4.48Å; A985-M1045 HydrophobicContact CB-SD 3.71Å; I1041-M1045 HydrophobicContact CG2-CE 3.64Å; I1041-M1045 HydrophobicContact CG2-SD 4.27Å; I1041-M1045 WeakPolarHBondContact O-CG 3.39Å; I1041-M1045 PolarHBondContact O-N 2.84Å; V1042-M1045 PolarHBondContact O-N 3.37Å; M1045-I1047 PolarHBondContact O-N 2.89Å; M1045-T1048 PolarHBondContact O-N 2.97Å; M1045-N1049 WeakPolarHBondContact CB-ND2 3.48Å; M1045-N1049 WeakPolarHBondContact CG-ND2 3.07Å; M1045-N1049 VanDerWaalsContact O-CB 3.22Å; M1045-N1049 WeakPolarHBondContact O-CB 3.21Å; M1045-N1049 PolarHBondContact O-N 3.14Å; M1045-A1107 HydrophobicContact CE-CB 4.21Å; M1045-A1107 VanDerWaalsContact CE-O 3.3Å; M1045-A1107 WeakPolarHBondContact CE-O 3.36Å; M1045-A1107 HydrophobicContact SD-CB 3.86Å; M1045-F1110 HydrophobicContact CE-CB 3.89Å; M1045-E1111 HydrophobicContact CE-CB 4.35Å
1046	A	83.3	Confident	84.6	Confident	21 Å²	21	31.5 Å²	31.5	17%	0.174	17%	0.169	C	C	.	.	H	α-helix	trans	-66.7	-15.9	176.8	0	0	0	0	0	114.3	F988 V1042 A1043 A1044 W1050	F988-A1046 HydrophobicContact CB-CB 4.27Å; F988-A1046 HydrophobicContact CD1-CB 4.31Å; F988-A1046 HydrophobicContact CD2-CB 3.93Å; F988-A1046 HydrophobicContact CE2-CB 4.32Å; F988-A1046 HydrophobicContact CG-CB 3.92Å; V1042-A1046 WeakPolarHBondContact O-CB 3.13Å; V1042-A1046 PolarHBondContact O-N 3.1Å; A1043-A1046 PolarHBondContact O-N 2.7Å; A1044-A1046 VanDerWaalsContact C-N 3.25Å; A1044-A1046 PolarHBondContact O-N 3.14Å; A1046-W1050 PolarHBondContact O-NE1 3.14Å
1047	I	83.8	Confident	85.4	Confident	59 Å²	59	28.2 Å²	28.2	30%	0.303	15%	0.148	S	C	.	.	H	α-helix	trans	-84.1	-40.3	174.8	-65.8	164.4	0	0	0	111.3	V1026 M1030 A1043 A1044 M1045 W1050	V1026-I1047 HydrophobicContact CG1-CB 3.99Å; V1026-I1047 HydrophobicContact CG1-CD1 3.92Å; V1026-I1047 HydrophobicContact CG1-CG2 3.81Å; M1030-I1047 HydrophobicContact CE-CD1 3.99Å; M1030-I1047 HydrophobicContact CG-CD1 4.08Å; M1030-I1047 HydrophobicContact SD-CD1 3.77Å; A1043-I1047 WeakPolarHBondContact O-CG1 3.43Å; A1043-I1047 PolarHBondContact O-N 2.97Å; A1044-I1047 PolarHBondContact O-N 3.06Å; M1045-I1047 PolarHBondContact O-N 2.89Å; I1047-W1050 PolarHBondContact O-NE1 3.43Å
1048	T	81.4	Confident	85.8	Confident	8 Å²	8	30.2 Å²	30.2	5%	0.049	15%	0.15	C	C	.	.	H	α-helix	trans	-108.6	-32.4	-169.2	53.3	0	0	0	0	115.5	N1023 V1026 M1045 W1050 I1051	N1023-T1048 HydrophobicContact CB-CG2 4.5Å; V1026-T1048 HydrophobicContact CB-CG2 4.13Å; V1026-T1048 HydrophobicContact CG1-CG2 4.19Å; V1026-T1048 HydrophobicContact CG2-CG2 3.88Å; M1045-T1048 PolarHBondContact O-N 2.97Å; T1048-W1050 VanDerWaalsContact C-N 3.32Å; T1048-W1050 PolarHBondContact O-N 3.03Å; T1048-I1051 WeakPolarHBondContact O-CG1 3.35Å; T1048-I1051 PolarHBondContact O-N 3.47Å
1049	N	84.9	Confident	85.5	Confident	19 Å²	19	29.6 Å²	29.6	10%	0.102	15%	0.154	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.4	-16.6	-162.3	-66.5	7.6	0	0	0	114.1	M1045 P1052	M1045-N1049 WeakPolarHBondContact CB-ND2 3.48Å; M1045-N1049 WeakPolarHBondContact CG-ND2 3.07Å; M1045-N1049 VanDerWaalsContact O-CB 3.22Å; M1045-N1049 WeakPolarHBondContact O-CB 3.21Å; M1045-N1049 PolarHBondContact O-N 3.14Å; N1049-P1052 WeakPolarHBondContact O-CD 3.49Å
1050	W	90.8	Very high	85.5	Confident	17 Å²	17	26.3 Å²	26.3	6%	0.064	14%	0.141	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.1	-12.4	177.3	65	-89.7	0	0	0	114.1	D989 I992 Y996 F1014 L1015 L1018 A1046 I1047 T1048 M1053 A1054	D989-W1050 WeakPolarHBondContact OD1-CA 3.32Å; I992-W1050 HydrophobicContact CB-CB 4.11Å; I992-W1050 HydrophobicContact CB-CD2 4.16Å; I992-W1050 HydrophobicContact CB-CE3 4.46Å; I992-W1050 HydrophobicContact CB-CG 4Å; I992-W1050 HydrophobicContact CG2-CB 4.45Å; I992-W1050 HydrophobicContact CG2-CD2 3.51Å; I992-W1050 HydrophobicContact CG2-CE3 3.68Å; I992-W1050 HydrophobicContact CG2-CG 3.86Å; I992-W1050 HydrophobicContact CG2-CH2 4.41Å; I992-W1050 HydrophobicContact CG2-CZ2 4.29Å; I992-W1050 HydrophobicContact CG2-CZ3 4.13Å; Y996-W1050 AromaticContact CD1-CZ3 3.99Å; Y996-W1050 HydrophobicContact CD1-CZ3 3.99Å; Y996-W1050 AromaticContact CD2-CH2 3.82Å; Y996-W1050 HydrophobicContact CD2-CH2 3.82Å; Y996-W1050 AromaticContact CD2-CZ3 3.71Å; Y996-W1050 HydrophobicContact CD2-CZ3 3.71Å; Y996-W1050 HydrophobicContact CE1-CZ3 4.48Å; Y996-W1050 AromaticContact CE2-CH2 3.98Å; Y996-W1050 HydrophobicContact CE2-CH2 3.98Å; Y996-W1050 HydrophobicContact CE2-CZ3 4.24Å; Y996-W1050 HydrophobicContact CG-CH2 4.15Å; Y996-W1050 AromaticContact CG-CZ3 3.57Å; Y996-W1050 HydrophobicContact CG-CZ3 3.57Å; F1014-W1050 HydrophobicContact CE1-CH2 4.28Å; F1014-W1050 HydrophobicContact CE1-CZ2 4.42Å; L1015-W1050 HydrophobicContact CD2-CE3 4.47Å; L1015-W1050 HydrophobicContact CD2-CH2 3.42Å; L1015-W1050 VanDerWaalsContact CD2-CH2 3.42Å; L1015-W1050 HydrophobicContact CD2-CZ2 4.35Å; L1015-W1050 HydrophobicContact CD2-CZ3 3.49Å; L1015-W1050 VanDerWaalsContact CD2-CZ3 3.49Å; L1018-W1050 HydrophobicContact CD1-CZ2 3.93Å; A1046-W1050 PolarHBondContact O-NE1 3.14Å; I1047-W1050 PolarHBondContact O-NE1 3.43Å; T1048-W1050 VanDerWaalsContact C-N 3.32Å; T1048-W1050 PolarHBondContact O-N 3.03Å; W1050-M1053 PolarHBondContact O-N 3.39Å; W1050-A1054 HydrophobicContact CE3-CB 3.86Å; W1050-A1054 HydrophobicContact CZ3-CB 3.89Å; W1050-A1054 PolarHBondContact O-N 3.17Å
1051	I	88.6	Confident	85.7	Confident	7 Å²	7	26.3 Å²	26.3	4%	0.036	14%	0.141	C	C	.	.	H	α-helix	trans	-62.9	-42.4	-176.2	-60.1	172.1	0	0	0	112.5	L1015 L1018 T1048 A1054 R1055	L1015-I1051 HydrophobicContact CB-CG2 4.2Å; L1015-I1051 HydrophobicContact CD2-CG1 4.33Å; L1015-I1051 HydrophobicContact CD2-CG2 4.31Å; L1018-I1051 HydrophobicContact CB-CD1 3.65Å; L1018-I1051 HydrophobicContact CD1-CD1 4.31Å; T1048-I1051 WeakPolarHBondContact O-CG1 3.35Å; T1048-I1051 PolarHBondContact O-N 3.47Å; I1051-A1054 PolarHBondContact O-N 3.24Å; I1051-R1055 WeakPolarHBondContact O-CG 3.44Å; I1051-R1055 PolarHBondContact O-N 2.86Å; I1051-R1055 VanDerWaalsContact O-N 3.09Å
1052	P	86.2	Confident	85.5	Confident	57 Å²	57	28.5 Å²	28.5	37%	0.37	15%	0.153	S	C	.	.	H	α-helix	trans	-61.6	-45.3	175.1	-23	35.6	0	0	0	112.6	N1049 A1054 R1055 I1056	N1049-P1052 WeakPolarHBondContact O-CD 3.49Å; P1052-A1054 PolarHBondContact O-N 2.88Å; P1052-R1055 PolarHBondContact O-N 3.02Å; P1052-I1056 WeakPolarHBondContact O-CB 3.33Å; P1052-I1056 VanDerWaalsContact O-CG1 3.29Å; P1052-I1056 WeakPolarHBondContact O-CG1 3.41Å; P1052-I1056 PolarHBondContact O-N 3.26Å
1053	M	90.8	Very high	85	Confident	1 Å²	1	31.4 Å²	31.4	1%	0.005	16%	0.164	C	C	.	.	H	α-helix	trans	-59.5	-45.1	175.9	-178	75.3	77	0	0	111.2	D989 I990 V994 W1050 R1055 I1056 V1057 I1096 Q1099	D989-M1053 WeakPolarHBondContact OD1-CB 3.48Å; I990-M1053 HydrophobicContact CG1-CE 4.34Å; V994-M1053 HydrophobicContact CG2-CG 3.96Å; V994-M1053 HydrophobicContact CG2-SD 4.03Å; W1050-M1053 PolarHBondContact O-N 3.39Å; M1053-R1055 PolarHBondContact O-N 3.46Å; M1053-I1056 PolarHBondContact O-N 3.5Å; M1053-V1057 HydrophobicContact CG-CG2 4.08Å; M1053-V1057 VanDerWaalsContact O-CB 3.27Å; M1053-V1057 WeakPolarHBondContact O-CB 3.48Å; M1053-V1057 VanDerWaalsContact O-CG2 3.27Å; M1053-V1057 WeakPolarHBondContact O-CG2 3.46Å; M1053-V1057 PolarHBondContact O-N 3.33Å; M1053-V1057 HydrophobicContact SD-CG2 3.89Å; M1053-I1096 HydrophobicContact CE-CG2 4.04Å; M1053-I1096 HydrophobicContact SD-CB 4.31Å; M1053-I1096 HydrophobicContact SD-CG1 4.19Å; M1053-I1096 HydrophobicContact SD-CG2 4.06Å; M1053-Q1099 HydrophobicContact CB-CG 4.26Å; M1053-Q1099 HydrophobicContact CE-CB 3.85Å; M1053-Q1099 HydrophobicContact CE-CG 3.7Å; M1053-Q1099 HydrophobicContact SD-CB 4.07Å; M1053-Q1099 HydrophobicContact SD-CG 3.91Å
1054	A	90.6	Very high	84.9	Confident	0 Å²	0	31.7 Å²	31.7	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-59.3	-41.9	176.7	0	0	0	0	0	113.4	G993 Y996 G997 L1015 W1050 I1051 P1052 R1058	G993-A1054 VanDerWaalsContact O-CA 3.28Å; G993-A1054 WeakPolarHBondContact O-CA 3.49Å; Y996-A1054 HydrophobicContact CD1-CB 3.98Å; Y996-A1054 HydrophobicContact CG-CB 4.42Å; G997-A1054 VanDerWaalsContact CA-O 3.25Å; G997-A1054 WeakPolarHBondContact CA-O 3.17Å; L1015-A1054 HydrophobicContact CD1-CB 3.86Å; W1050-A1054 HydrophobicContact CE3-CB 3.86Å; W1050-A1054 HydrophobicContact CZ3-CB 3.89Å; W1050-A1054 PolarHBondContact O-N 3.17Å; I1051-A1054 PolarHBondContact O-N 3.24Å; P1052-A1054 PolarHBondContact O-N 2.88Å; A1054-R1058 VanDerWaalsContact O-CB 3.26Å; A1054-R1058 WeakPolarHBondContact O-CB 3.32Å; A1054-R1058 PolarHBondContact O-N 3.09Å
1055	R	87.1	Confident	85	Confident	93 Å²	93	34.2 Å²	34.2	35%	0.351	17%	0.173	S	C	.	.	H	α-helix	trans	-67.3	-44.5	176.7	-69.8	-178.4	-174.5	162.9	6.3	112.1	L1015 S1019 I1051 P1052 M1053 R1058 A1059	L1015-R1055 HydrophobicContact CD1-CG 3.97Å; L1015-R1055 PolarHBondContact O-NH2 2.91Å; S1019-R1055 PolarHBondContact OG-NH2 2.98Å; I1051-R1055 WeakPolarHBondContact O-CG 3.44Å; I1051-R1055 PolarHBondContact O-N 2.86Å; I1051-R1055 VanDerWaalsContact O-N 3.09Å; P1052-R1055 PolarHBondContact O-N 3.02Å; M1053-R1055 PolarHBondContact O-N 3.46Å; R1055-R1058 PolarHBondContact O-N 3.4Å; R1055-A1059 PolarHBondContact O-N 2.89Å
1056	I	85.2	Confident	84.6	Confident	53 Å²	53	38.5 Å²	38.5	27%	0.272	20%	0.196	S	C	.	.	H	α-helix	trans	-67.3	-47	-179	-67.8	166.7	0	0	0	110.9	P1052 M1053 R1058 A1059 Q1060 V1095 Q1099	P1052-I1056 WeakPolarHBondContact O-CB 3.33Å; P1052-I1056 VanDerWaalsContact O-CG1 3.29Å; P1052-I1056 WeakPolarHBondContact O-CG1 3.41Å; P1052-I1056 PolarHBondContact O-N 3.26Å; M1053-I1056 PolarHBondContact O-N 3.5Å; I1056-R1058 VanDerWaalsContact C-N 3.34Å; I1056-R1058 PolarHBondContact O-N 2.84Å; I1056-A1059 PolarHBondContact O-N 3.21Å; I1056-Q1060 WeakPolarHBondContact O-CG 3.43Å; I1056-Q1060 PolarHBondContact O-N 2.89Å; I1056-V1095 HydrophobicContact CG2-CG1 3.34Å; I1056-Q1099 HydrophobicContact CD1-CG 4.16Å
1057	V	89.5	Confident	84.5	Confident	2 Å²	2	39.8 Å²	39.8	1%	0.012	20%	0.199	C	C	.	.	H	α-helix	trans	-63.3	-39.7	177.7	170.4	0	0	0	0	111.1	V994 L998 M1053 T1061 I1092 I1096	V994-V1057 HydrophobicContact CG1-CG1 4.39Å; V994-V1057 HydrophobicContact CG2-CG2 4.18Å; L998-V1057 HydrophobicContact CD2-CG1 4.2Å; L998-V1057 HydrophobicContact CG-CG1 3.85Å; M1053-V1057 HydrophobicContact CG-CG2 4.08Å; M1053-V1057 VanDerWaalsContact O-CB 3.27Å; M1053-V1057 WeakPolarHBondContact O-CB 3.48Å; M1053-V1057 VanDerWaalsContact O-CG2 3.27Å; M1053-V1057 WeakPolarHBondContact O-CG2 3.46Å; M1053-V1057 PolarHBondContact O-N 3.33Å; M1053-V1057 HydrophobicContact SD-CG2 3.89Å; V1057-T1061 VanDerWaalsContact O-CB 3.25Å; V1057-T1061 WeakPolarHBondContact O-CB 3.14Å; V1057-T1061 PolarHBondContact O-N 3.27Å; V1057-T1061 PolarHBondContact O-OG1 3.44Å; V1057-I1092 HydrophobicContact CB-CD1 4.43Å; V1057-I1092 HydrophobicContact CG1-CD1 3.77Å; V1057-I1092 HydrophobicContact CG2-CD1 4.33Å; V1057-I1096 HydrophobicContact CG2-CD1 4.33Å; V1057-I1096 HydrophobicContact CG2-CG1 3.93Å
1058	R	90.4	Very high	84.5	Confident	59 Å²	59	38.2 Å²	38.2	22%	0.223	19%	0.19	C	C	.	.	H	α-helix	trans	-57.1	-53	170.4	169.7	-173	172.9	-105.7	-7.8	111.5	G997 D1008 Q1012 A1054 R1055 I1056 Q1060 T1061 L1062	G997-R1058 WeakPolarHBondContact O-CA 3.22Å; D1008-R1058 VanDerWaalsContact CG-NE 3.25Å; D1008-R1058 VanDerWaalsContact OD1-CD 3.26Å; D1008-R1058 WeakPolarHBondContact OD1-CD 3.48Å; D1008-R1058 IonicContact OD1-CZ 2.76Å; D1008-R1058 IonicContact OD1-NE 3.95Å; D1008-R1058 PolarHBondContact OD1-NE 3.28Å; D1008-R1058 IonicContact OD1-NH2 2.75Å; D1008-R1058 IonicContact OD2-CZ 3.33Å; D1008-R1058 VanDerWaalsContact OD2-CZ 3.27Å; D1008-R1058 IonicContact OD2-NE 2.63Å; D1008-R1058 PolarHBondContact OD2-NE 3.39Å; D1008-R1058 IonicContact OD2-NH2 3.94Å; D1008-R1058 PolarHBondContact OD2-NH2 3.25Å; Q1012-R1058 VanDerWaalsContact CD-NE 3.33Å; Q1012-R1058 VanDerWaalsContact CG-CZ 3.46Å; Q1012-R1058 VanDerWaalsContact OE1-NH1 3.07Å; A1054-R1058 VanDerWaalsContact O-CB 3.26Å; A1054-R1058 WeakPolarHBondContact O-CB 3.32Å; A1054-R1058 PolarHBondContact O-N 3.09Å; R1055-R1058 PolarHBondContact O-N 3.4Å; I1056-R1058 VanDerWaalsContact C-N 3.34Å; I1056-R1058 PolarHBondContact O-N 2.84Å; R1058-Q1060 VanDerWaalsContact C-N 3.33Å; R1058-Q1060 PolarHBondContact O-N 2.64Å; R1058-T1061 WeakPolarHBondContact O-CB 3.49Å; R1058-T1061 PolarHBondContact O-N 3.23Å; R1058-T1061 VanDerWaalsContact O-N 3.14Å; R1058-L1062 HydrophobicContact CG-CD1 3.86Å; R1058-L1062 HydrophobicContact CG-CG 4.31Å; R1058-L1062 WeakPolarHBondContact O-CG 3.43Å; R1058-L1062 PolarHBondContact O-N 3.45Å
1059	A	79.7	Confident	84.7	Confident	49 Å²	49	38.2 Å²	38.2	41%	0.405	19%	0.189	S	C	.	.	H	α-helix	trans	-59.6	-44.7	-175.3	0	0	0	0	0	111.7	R1055 I1056 L1062 K1063	R1055-A1059 PolarHBondContact O-N 2.89Å; I1056-A1059 PolarHBondContact O-N 3.21Å; A1059-L1062 PolarHBondContact O-N 2.9Å; A1059-K1063 PolarHBondContact O-N 2.69Å
1060	Q	84.1	Confident	84.8	Confident	69 Å²	69	37.3 Å²	37.3	32%	0.322	18%	0.184	S	C	.	.	H	α-helix	trans	-68.3	-37	175.7	-62.3	-63.6	-39	0	0	112.2	I1056 R1058 L1062 K1063 L1064 I1092 V1095	I1056-Q1060 WeakPolarHBondContact O-CG 3.43Å; I1056-Q1060 PolarHBondContact O-N 2.89Å; R1058-Q1060 VanDerWaalsContact C-N 3.33Å; R1058-Q1060 PolarHBondContact O-N 2.64Å; Q1060-L1062 VanDerWaalsContact C-N 3.33Å; Q1060-L1062 PolarHBondContact O-N 2.66Å; Q1060-K1063 PolarHBondContact O-N 3.24Å; Q1060-L1064 WeakPolarHBondContact O-CG 3.27Å; Q1060-L1064 PolarHBondContact O-N 3.3Å; Q1060-I1092 HydrophobicContact CB-CB 4.27Å; Q1060-I1092 HydrophobicContact CB-CG2 3.59Å; Q1060-V1095 HydrophobicContact CG-CG1 4.4Å; Q1060-V1095 HydrophobicContact CG-CG2 4.41Å
1061	T	86.8	Confident	84.6	Confident	0 Å²	0	37.9 Å²	37.9	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-62.2	-40.8	173.2	-58.8	0	0	0	0	111.6	M1002 V1057 R1058 L1064 K1065 I1088	M1002-T1061 HydrophobicContact CG-CG2 3.81Å; M1002-T1061 HydrophobicContact SD-CG2 3.85Å; V1057-T1061 VanDerWaalsContact O-CB 3.25Å; V1057-T1061 WeakPolarHBondContact O-CB 3.14Å; V1057-T1061 PolarHBondContact O-N 3.27Å; V1057-T1061 PolarHBondContact O-OG1 3.44Å; R1058-T1061 WeakPolarHBondContact O-CB 3.49Å; R1058-T1061 PolarHBondContact O-N 3.23Å; R1058-T1061 VanDerWaalsContact O-N 3.14Å; T1061-L1064 PolarHBondContact O-N 2.88Å; T1061-K1065 WeakPolarHBondContact O-CB 3.42Å; T1061-K1065 WeakPolarHBondContact O-CG 3.43Å; T1061-K1065 PolarHBondContact O-N 2.92Å; T1061-I1088 HydrophobicContact CG2-CG2 4.21Å
1062	L	79.5	Confident	84.4	Confident	47 Å²	47	37.7 Å²	37.7	25%	0.246	19%	0.188	C	C	.	.	H	α-helix	trans	-66.7	-34.9	176.3	-72.2	173.4	0	0	0	112.5	R1058 A1059 Q1060 K1065	R1058-L1062 HydrophobicContact CG-CD1 3.86Å; R1058-L1062 HydrophobicContact CG-CG 4.31Å; R1058-L1062 WeakPolarHBondContact O-CG 3.43Å; R1058-L1062 PolarHBondContact O-N 3.45Å; A1059-L1062 PolarHBondContact O-N 2.9Å; Q1060-L1062 VanDerWaalsContact C-N 3.33Å; Q1060-L1062 PolarHBondContact O-N 2.66Å; L1062-K1065 HydrophobicContact CD2-CD 4.18Å; L1062-K1065 WeakPolarHBondContact O-CG 3Å
1063	K	75.1	Confident	84.4	Confident	77 Å²	77	35 Å²	35	34%	0.335	17%	0.17	S	C	.	.	H	α-helix	trans	-71.8	-33.9	173.7	-173.3	160.8	-172.6	158.2	0	112.8	E862 A1059 Q1060	E862-K1063 IonicContact OE2-NZ 2.85Å; E862-K1063 PolarHBondContact OE2-NZ 3.34Å; A1059-K1063 PolarHBondContact O-N 2.69Å; Q1060-K1063 PolarHBondContact O-N 3.24Å
1064	L	81.8	Confident	84.2	Confident	24 Å²	24	36.9 Å²	36.9	13%	0.126	18%	0.18	C	C	.	.	H	α-helix	trans	-90.9	-21.9	-175.6	-62.1	-169.7	0	0	0	115.1	Q1060 T1061 D1066 Q1067 V1070 I1088 N1091 I1092	Q1060-L1064 WeakPolarHBondContact O-CG 3.27Å; Q1060-L1064 PolarHBondContact O-N 3.3Å; T1061-L1064 PolarHBondContact O-N 2.88Å; L1064-D1066 VanDerWaalsContact C-N 3.26Å; L1064-D1066 PolarHBondContact O-N 3.07Å; L1064-Q1067 HydrophobicContact CD2-CG 4.12Å; L1064-Q1067 WeakPolarHBondContact O-CB 3.41Å; L1064-Q1067 WeakPolarHBondContact O-CG 3.23Å; L1064-Q1067 PolarHBondContact O-N 2.81Å; L1064-V1070 VanDerWaalsContact O-CG2 3.26Å; L1064-V1070 WeakPolarHBondContact O-CG2 3.28Å; L1064-I1088 HydrophobicContact CB-CD1 3.79Å; L1064-N1091 HydrophobicContact CD1-CB 3.69Å; L1064-I1092 HydrophobicContact CD1-CG2 3.54Å; L1064-I1092 HydrophobicContact CG-CG2 4.46Å
1065	K	81.8	Confident	84	Confident	55 Å²	55	36.9 Å²	36.9	24%	0.239	18%	0.18	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63	-24.7	-173.1	60	163.7	-177.2	69	0	115.4	T1061 L1062 V1070	T1061-K1065 WeakPolarHBondContact O-CB 3.42Å; T1061-K1065 WeakPolarHBondContact O-CG 3.43Å; T1061-K1065 PolarHBondContact O-N 2.92Å; L1062-K1065 HydrophobicContact CD2-CD 4.18Å; L1062-K1065 WeakPolarHBondContact O-CG 3Å; K1065-V1070 VanDerWaalsContact O-CG1 3.24Å; K1065-V1070 WeakPolarHBondContact O-CG1 3.45Å
1066	D	75.5	Confident	83.9	Confident	91 Å²	91	32.4 Å²	32.4	49%	0.487	16%	0.163	S	C	.	.	T	Hydrogen-bonded Turn	trans	-105.8	1.5	-177	-44.4	-50.2	0	0	0	112.7	L1064 L1071	L1064-D1066 VanDerWaalsContact C-N 3.26Å; L1064-D1066 PolarHBondContact O-N 3.07Å; D1066-L1071 WeakPolarHBondContact O-CD1 3.34Å
1067	Q	82.4	Confident	83.7	Confident	48 Å²	48	30 Å²	30	22%	0.224	15%	0.151	C	C	.	.	S	Bend	trans	-64	145.9	176.3	-65.1	-79.6	-73.2	0	0	110.7	L1064 Y1069 V1070 L1071	L1064-Q1067 HydrophobicContact CD2-CG 4.12Å; L1064-Q1067 WeakPolarHBondContact O-CB 3.41Å; L1064-Q1067 WeakPolarHBondContact O-CG 3.23Å; L1064-Q1067 PolarHBondContact O-N 2.81Å; Q1067-Y1069 VanDerWaalsContact C-N 3.3Å; Q1067-Y1069 HydrophobicContact CB-CD1 3.88Å; Q1067-Y1069 HydrophobicContact CB-CE1 3.55Å; Q1067-Y1069 HydrophobicContact CG-CE1 4.03Å; Q1067-Y1069 PolarHBondContact O-N 2.71Å; Q1067-V1070 WeakPolarHBondContact O-CA 3.39Å; Q1067-V1070 WeakPolarHBondContact O-CB 3.41Å; Q1067-V1070 PolarHBondContact O-N 3.04Å; Q1067-L1071 PolarHBondContact O-N 3.35Å
1068	E	81.8	Confident	83.4	Confident	26 Å²	26	30.9 Å²	30.9	12%	0.121	16%	0.155	C	C	.	.	H	α-helix	trans	-60	-35.4	-172	-60.3	-153.3	136.2	0	0	113.5	V1070 L1071 A1072 R1447 F1487 A1492	E1068-V1070 PolarHBondContact O-N 3.27Å; E1068-L1071 PolarHBondContact O-N 3.43Å; E1068-A1072 WeakPolarHBondContact O-CB 3.43Å; E1068-A1072 PolarHBondContact O-N 3.06Å; E1068-R1447 IonicContact OE1-CZ 2.78Å; E1068-R1447 IonicContact OE1-NH1 2.73Å; E1068-R1447 IonicContact OE1-NH2 3.09Å; E1068-R1447 PolarHBondContact OE1-NH2 2.69Å; E1068-F1487 HydrophobicContact CB-CD1 4.01Å; E1068-F1487 HydrophobicContact CB-CE1 4.41Å; E1068-F1487 HydrophobicContact CG-CD1 4.15Å; E1068-F1487 WeakPolarHBondContact OE2-CB 3.23Å; E1068-A1492 HydrophobicContact CB-CB 4.31Å; E1068-A1492 HydrophobicContact CG-CB 4.43Å
1069	Y	87.2	Confident	83	Confident	9 Å²	9	29.7 Å²	29.7	4%	0.035	16%	0.156	C	C	.	.	H	α-helix	trans	-65.6	-19.8	174.3	69.3	-95.4	0	0	0	113.9	Q1067 G1073 H1087 A1492 S1493 N1495	Q1067-Y1069 VanDerWaalsContact C-N 3.3Å; Q1067-Y1069 HydrophobicContact CB-CD1 3.88Å; Q1067-Y1069 HydrophobicContact CB-CE1 3.55Å; Q1067-Y1069 HydrophobicContact CG-CE1 4.03Å; Q1067-Y1069 PolarHBondContact O-N 2.71Å; Y1069-G1073 PolarHBondContact O-N 2.77Å; Y1069-H1087 HydrophobicContact CD2-CB 4.22Å; Y1069-H1087 AromaticContact CD2-ND1 3.81Å; Y1069-H1087 HydrophobicContact CE2-CB 4.05Å; Y1069-A1492 WeakPolarHBondContact CB-O 3.02Å; Y1069-A1492 WeakPolarHBondContact CD1-O 3.49Å; Y1069-A1492 PolarHBondContact N-O 2.77Å; Y1069-S1493 WeakPolarHBondContact CA-O 3.37Å; Y1069-N1495 HydrophobicContact CD2-CB 3.85Å; Y1069-N1495 HydrophobicContact CG-CB 4.17Å
1070	V	86.9	Confident	83.1	Confident	0 Å²	0	32.6 Å²	32.6	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-87	-41.1	172.5	177.9	0	0	0	0	110.7	L1064 K1065 Q1067 E1068 A1072 G1073 M1074 I1083 H1087 I1088	L1064-V1070 VanDerWaalsContact O-CG2 3.26Å; L1064-V1070 WeakPolarHBondContact O-CG2 3.28Å; K1065-V1070 VanDerWaalsContact O-CG1 3.24Å; K1065-V1070 WeakPolarHBondContact O-CG1 3.45Å; Q1067-V1070 WeakPolarHBondContact O-CA 3.39Å; Q1067-V1070 WeakPolarHBondContact O-CB 3.41Å; Q1067-V1070 PolarHBondContact O-N 3.04Å; E1068-V1070 PolarHBondContact O-N 3.27Å; V1070-A1072 VanDerWaalsContact C-N 3.3Å; V1070-A1072 PolarHBondContact O-N 3.26Å; V1070-G1073 PolarHBondContact O-N 2.99Å; V1070-G1073 VanDerWaalsContact O-N 3.15Å; V1070-M1074 HydrophobicContact CG1-CE 3.88Å; V1070-M1074 WeakPolarHBondContact O-CG 3.5Å; V1070-M1074 PolarHBondContact O-N 2.96Å; V1070-I1083 HydrophobicContact CG1-CG2 3.62Å; V1070-H1087 HydrophobicContact CG2-CB 4.07Å; V1070-I1088 HydrophobicContact CG2-CD1 3.88Å
1071	L	85.2	Confident	83.2	Confident	29 Å²	29	36.3 Å²	36.3	15%	0.152	17%	0.17	C	C	.	.	H	α-helix	trans	-60	-41.7	172.3	-59.3	-178.6	0	0	0	110.9	D1066 Q1067 E1068 G1073 M1074 T1075 L1452 F1487	D1066-L1071 WeakPolarHBondContact O-CD1 3.34Å; Q1067-L1071 PolarHBondContact O-N 3.35Å; E1068-L1071 PolarHBondContact O-N 3.43Å; L1071-G1073 PolarHBondContact O-N 3.06Å; L1071-M1074 CarbonylContact O-C 3.53Å; L1071-M1074 WeakPolarHBondContact O-CA 3.1Å; L1071-M1074 VanDerWaalsContact O-CB 3.31Å; L1071-M1074 WeakPolarHBondContact O-CB 3.09Å; L1071-M1074 PolarHBondContact O-N 3Å; L1071-T1075 WeakPolarHBondContact O-CG2 3.48Å; L1071-T1075 PolarHBondContact O-N 2.68Å; L1071-L1452 HydrophobicContact CB-CD1 4.19Å; L1071-L1452 HydrophobicContact CB-CD2 4.24Å; L1071-L1452 HydrophobicContact CD2-CD2 4.34Å; L1071-F1487 HydrophobicContact CB-CE1 3.99Å; L1071-F1487 HydrophobicContact CB-CZ 4.12Å
1072	A	85.8	Confident	83.1	Confident	3 Å²	3	41.3 Å²	41.3	3%	0.025	19%	0.192	C	C	.	.	H	α-helix	trans	-57.5	-43.7	170.4	0	0	0	0	0	113.3	E1068 V1070 M1074 T1075 L1076 F1487 R1557	E1068-A1072 WeakPolarHBondContact O-CB 3.43Å; E1068-A1072 PolarHBondContact O-N 3.06Å; V1070-A1072 VanDerWaalsContact C-N 3.3Å; V1070-A1072 PolarHBondContact O-N 3.26Å; A1072-M1074 PolarHBondContact O-N 2.99Å; A1072-T1075 PolarHBondContact O-N 3.49Å; A1072-T1075 PolarHBondContact O-OG1 3.15Å; A1072-L1076 WeakPolarHBondContact O-CG 3.35Å; A1072-L1076 PolarHBondContact O-N 3.29Å; A1072-L1076 VanDerWaalsContact O-N 3.16Å; A1072-F1487 HydrophobicContact CB-CE2 3.99Å; A1072-F1487 HydrophobicContact CB-CZ 4.3Å; A1072-R1557 VanDerWaalsContact CB-CZ 3.42Å
1073	G	85.7	Confident	83.4	Confident	0 Å²	0	39.1 Å²	39.1	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-59	-38.9	170.9	0	0	0	0	0	111.7	Y1069 V1070 L1071 L1076 E1078	Y1069-G1073 PolarHBondContact O-N 2.77Å; V1070-G1073 PolarHBondContact O-N 2.99Å; V1070-G1073 VanDerWaalsContact O-N 3.15Å; L1071-G1073 PolarHBondContact O-N 3.06Å; G1073-L1076 PolarHBondContact O-N 3.31Å; G1073-E1078 WeakPolarHBondContact O-CB 3.43Å; G1073-E1078 PolarHBondContact O-N 3.21Å
1074	M	85.4	Confident	84	Confident	40 Å²	40	35.5 Å²	35.5	20%	0.197	17%	0.165	C	C	.	.	H	α-helix	trans	-68.5	-37.8	173.9	-61.4	-161.5	-143.9	0	0	113.1	V1070 L1071 A1072 L1076 G1077 I1083 L1452 R1480	V1070-M1074 HydrophobicContact CG1-CE 3.88Å; V1070-M1074 WeakPolarHBondContact O-CG 3.5Å; V1070-M1074 PolarHBondContact O-N 2.96Å; L1071-M1074 CarbonylContact O-C 3.53Å; L1071-M1074 WeakPolarHBondContact O-CA 3.1Å; L1071-M1074 VanDerWaalsContact O-CB 3.31Å; L1071-M1074 WeakPolarHBondContact O-CB 3.09Å; L1071-M1074 PolarHBondContact O-N 3Å; A1072-M1074 PolarHBondContact O-N 2.99Å; M1074-L1076 PolarHBondContact O-N 3.38Å; M1074-G1077 PolarHBondContact O-N 2.81Å; M1074-I1083 HydrophobicContact CB-CD1 4.49Å; M1074-I1083 HydrophobicContact CG-CD1 3.46Å; M1074-I1083 VanDerWaalsContact CG-CD1 3.46Å; M1074-L1452 HydrophobicContact CB-CD2 3.99Å; M1074-R1480 WeakPolarHBondContact O-CD 3.15Å; M1074-R1480 PolarHBondContact O-NH1 2.88Å
1075	T	86.4	Confident	84.4	Confident	0 Å²	0	40.6 Å²	40.6	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-65.1	-26.8	176.3	66.5	0	0	0	0	112	L1071 A1072 G1077 I1450 L1452 R1480 Q1484 M1485 F1487	L1071-T1075 WeakPolarHBondContact O-CG2 3.48Å; L1071-T1075 PolarHBondContact O-N 2.68Å; A1072-T1075 PolarHBondContact O-N 3.49Å; A1072-T1075 PolarHBondContact O-OG1 3.15Å; T1075-G1077 PolarHBondContact O-N 3.41Å; T1075-I1450 HydrophobicContact CG2-CD1 3.73Å; T1075-I1450 HydrophobicContact CG2-CG1 4.23Å; T1075-I1450 HydrophobicContact CG2-CG2 4.39Å; T1075-L1452 HydrophobicContact CG2-CD1 3.76Å; T1075-L1452 HydrophobicContact CG2-CD2 4.1Å; T1075-L1452 HydrophobicContact CG2-CG 4.07Å; T1075-R1480 VanDerWaalsContact O-CB 3.28Å; T1075-R1480 WeakPolarHBondContact O-CB 3.48Å; T1075-R1480 WeakPolarHBondContact O-CD 3.47Å; T1075-Q1484 PolarHBondContact O-NE2 3.46Å; T1075-Q1484 PolarHBondContact OG1-OE1 3.14Å; T1075-M1485 HydrophobicContact CG2-CB 4.39Å; T1075-F1487 HydrophobicContact CG2-CE2 4.41Å; T1075-F1487 HydrophobicContact CG2-CZ 4.09Å
1076	L	85.8	Confident	84.5	Confident	0 Å²	0	40.7 Å²	40.7	0%	0	19%	0.187	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.9	-5.7	173.1	-63.5	170.4	0	0	0	113.5	A1072 G1073 M1074 E1506 V1510 R1557 V1561	A1072-L1076 WeakPolarHBondContact O-CG 3.35Å; A1072-L1076 PolarHBondContact O-N 3.29Å; A1072-L1076 VanDerWaalsContact O-N 3.16Å; G1073-L1076 PolarHBondContact O-N 3.31Å; M1074-L1076 PolarHBondContact O-N 3.38Å; L1076-E1506 HydrophobicContact CD1-CB 3.86Å; L1076-E1506 HydrophobicContact CD1-CG 3.66Å; L1076-V1510 WeakPolarHBondContact O-CG1 3.19Å; L1076-R1557 HydrophobicContact CD1-CG 4.18Å; L1076-V1561 HydrophobicContact CD2-CG1 3.69Å
1077	G	80.3	Confident	85.1	Confident	3 Å²	3	36.5 Å²	36.5	3%	0.031	16%	0.164	C	C	.	.	T	Hydrogen-bonded Turn	trans	90.1	18	177.1	0	0	0	0	0	115	M1074 T1075 K1473 T1477	M1074-G1077 PolarHBondContact O-N 2.81Å; T1075-G1077 PolarHBondContact O-N 3.41Å; G1077-K1473 WeakPolarHBondContact O-CE 3.32Å; G1077-T1477 PolarHBondContact O-OG1 2.93Å
1078	E	85	Confident	85.4	Confident	20 Å²	20	34.2 Å²	34.2	9%	0.093	15%	0.153	C	C	.	.			trans	-63	156.9	179	-98.9	-58.1	175.8	0	0	113.9	G1073 K1082 I1083 V1510	G1073-E1078 WeakPolarHBondContact O-CB 3.43Å; G1073-E1078 PolarHBondContact O-N 3.21Å; E1078-K1082 VanDerWaalsContact CD-CD 3.41Å; E1078-K1082 WeakPolarHBondContact OE1-CD 3.34Å; E1078-K1082 IonicContact OE1-NZ 3.44Å; E1078-K1082 PolarHBondContact OE1-NZ 3.22Å; E1078-K1082 VanDerWaalsContact OE2-CB 3.31Å; E1078-K1082 WeakPolarHBondContact OE2-CB 3.32Å; E1078-K1082 WeakPolarHBondContact OE2-CD 3.44Å; E1078-K1082 IonicContact OE2-NZ 2.96Å; E1078-I1083 HydrophobicContact CB-CD1 3.95Å; E1078-I1083 HydrophobicContact CB-CG1 3.73Å; E1078-V1510 HydrophobicContact CG-CG2 3.55Å; E1078-V1510 WeakPolarHBondContact OE1-CG2 3Å
1079	S	82.1	Confident	85.7	Confident	33 Å²	33	34.7 Å²	34.7	23%	0.231	16%	0.156	C	C	.	.			trans	-80.5	140.8	170.1	62.6	0	0	0	0	111.6	W1081 K1082 I1083	S1079-W1081 PolarHBondContact O-N 3.24Å; S1079-K1082 PolarHBondContact O-N 3.02Å; S1079-K1082 WeakPolarHBondContact OG-CB 3.21Å; S1079-K1082 WeakPolarHBondContact OG-CG 3.41Å; S1079-K1082 PolarHBondContact OG-N 3.47Å; S1079-I1083 WeakPolarHBondContact O-CG1 3.27Å; S1079-I1083 PolarHBondContact O-N 2.83Å
1080	K	81.3	Confident	85.5	Confident	110 Å²	110	36.2 Å²	36.2	48%	0.478	17%	0.168	S	C	.	.	H	α-helix	trans	-46.9	-38.4	173.3	-76.2	-165.6	168.4	-162.9	0	113.2	M1002 I1083 A1084	M1002-K1080 HydrophobicContact CE-CB 3.84Å; M1002-K1080 HydrophobicContact CE-CD 4.34Å; M1002-K1080 HydrophobicContact CE-CG 4.03Å; M1002-K1080 WeakPolarHBondContact CE-O 3.07Å; M1002-K1080 PolarHBondContact O-NZ 3.21Å; K1080-I1083 PolarHBondContact O-N 3.18Å; K1080-A1084 WeakPolarHBondContact O-CB 3.4Å; K1080-A1084 PolarHBondContact O-N 2.84Å
1081	W	85.2	Confident	85.3	Confident	147 Å²	147	37.1 Å²	37.1	56%	0.557	17%	0.172	S	C	*	.	H	α-helix	trans	-67.3	-48.1	177.4	-83.7	116.6	0	0	0	113.7	I999 S1079 I1083 A1084 F1085	I999-W1081 HydrophobicContact CD1-CH2 3.95Å; I999-W1081 HydrophobicContact CD1-CZ2 4.33Å; I999-W1081 HydrophobicContact CG1-CH2 3.49Å; I999-W1081 VanDerWaalsContact CG1-CH2 3.49Å; I999-W1081 HydrophobicContact CG1-CZ2 3.9Å; S1079-W1081 PolarHBondContact O-N 3.24Å; W1081-I1083 VanDerWaalsContact C-N 3.31Å; W1081-I1083 PolarHBondContact O-N 3.22Å; W1081-A1084 WeakPolarHBondContact O-CB 3.29Å; W1081-A1084 PolarHBondContact O-N 2.94Å; W1081-F1085 HydrophobicContact CE3-CD2 4.49Å; W1081-F1085 HydrophobicContact CE3-CE2 4.03Å; W1081-F1085 HydrophobicContact CZ3-CE2 4.33Å; W1081-F1085 WeakPolarHBondContact O-CD2 3.31Å; W1081-F1085 PolarHBondContact O-N 2.68Å
1082	K	85	Confident	85.3	Confident	106 Å²	106	35.8 Å²	35.8	46%	0.461	17%	0.166	S	C	.	.	H	α-helix	trans	-65.6	-35.2	174.6	-77.8	179	155.3	-163.1	0	111.9	E1078 S1079 A1084 F1085 K1086	E1078-K1082 VanDerWaalsContact CD-CD 3.41Å; E1078-K1082 WeakPolarHBondContact OE1-CD 3.34Å; E1078-K1082 IonicContact OE1-NZ 3.44Å; E1078-K1082 PolarHBondContact OE1-NZ 3.22Å; E1078-K1082 VanDerWaalsContact OE2-CB 3.31Å; E1078-K1082 WeakPolarHBondContact OE2-CB 3.32Å; E1078-K1082 WeakPolarHBondContact OE2-CD 3.44Å; E1078-K1082 IonicContact OE2-NZ 2.96Å; S1079-K1082 PolarHBondContact O-N 3.02Å; S1079-K1082 WeakPolarHBondContact OG-CB 3.21Å; S1079-K1082 WeakPolarHBondContact OG-CG 3.41Å; S1079-K1082 PolarHBondContact OG-N 3.47Å; K1082-A1084 VanDerWaalsContact C-N 3.31Å; K1082-A1084 PolarHBondContact O-N 3.22Å; K1082-F1085 CarbonylContact O-C 3.6Å; K1082-F1085 PolarHBondContact O-N 3.08Å; K1082-F1085 VanDerWaalsContact O-N 3.16Å; K1082-K1086 WeakPolarHBondContact O-CB 3.17Å; K1082-K1086 PolarHBondContact O-N 3.1Å
1083	I	86.6	Confident	85.1	Confident	1 Å²	1	37.4 Å²	37.4	1%	0.005	18%	0.176	C	C	.	.	H	α-helix	trans	-57.7	-45.4	171.2	-70.6	173.8	0	0	0	110.8	M1002 V1070 M1074 E1078 S1079 K1080 W1081 F1085 K1086 H1087 I1088	M1002-I1083 HydrophobicContact CE-CG2 4.24Å; V1070-I1083 HydrophobicContact CG1-CG2 3.62Å; M1074-I1083 HydrophobicContact CB-CD1 4.49Å; M1074-I1083 HydrophobicContact CG-CD1 3.46Å; M1074-I1083 VanDerWaalsContact CG-CD1 3.46Å; E1078-I1083 HydrophobicContact CB-CD1 3.95Å; E1078-I1083 HydrophobicContact CB-CG1 3.73Å; S1079-I1083 WeakPolarHBondContact O-CG1 3.27Å; S1079-I1083 PolarHBondContact O-N 2.83Å; K1080-I1083 PolarHBondContact O-N 3.18Å; W1081-I1083 VanDerWaalsContact C-N 3.31Å; W1081-I1083 PolarHBondContact O-N 3.22Å; I1083-F1085 VanDerWaalsContact C-N 3.35Å; I1083-F1085 PolarHBondContact O-N 3.2Å; I1083-K1086 PolarHBondContact O-N 2.75Å; I1083-H1087 HydrophobicContact CG2-CB 4.48Å; I1083-H1087 WeakPolarHBondContact O-CA 3.34Å; I1083-H1087 WeakPolarHBondContact O-CB 3.19Å; I1083-H1087 PolarHBondContact O-N 2.76Å; I1083-I1088 HydrophobicContact CG2-CG1 4.39Å; I1083-I1088 PolarHBondContact O-N 3.33Å; I1083-I1088 VanDerWaalsContact O-N 3.12Å
1084	A	87.6	Confident	84.7	Confident	0 Å²	0	38 Å²	38	0%	0	18%	0.181	C	C	.	.	I	π-helix	trans	-57.9	-46	174.7	0	0	0	0	0	111.6	L998 M1002 K1080 W1081 K1082 I1088 I1089	L998-A1084 HydrophobicContact CD2-CB 4.41Å; M1002-A1084 HydrophobicContact CG-CB 4.28Å; K1080-A1084 WeakPolarHBondContact O-CB 3.4Å; K1080-A1084 PolarHBondContact O-N 2.84Å; W1081-A1084 WeakPolarHBondContact O-CB 3.29Å; W1081-A1084 PolarHBondContact O-N 2.94Å; K1082-A1084 VanDerWaalsContact C-N 3.31Å; K1082-A1084 PolarHBondContact O-N 3.22Å; A1084-I1088 PolarHBondContact O-N 3.32Å; A1084-I1089 WeakPolarHBondContact O-CB 3.4Å; A1084-I1089 VanDerWaalsContact O-CG1 3.27Å; A1084-I1089 WeakPolarHBondContact O-CG1 3.45Å; A1084-I1089 PolarHBondContact O-N 2.97Å
1085	F	88.7	Confident	84.6	Confident	132 Å²	132	38.1 Å²	38.1	58%	0.579	18%	0.184	S	C	*	.	I	π-helix	trans	-76.1	-27.3	-179.7	-80.9	-79.3	0	0	0	115.7	W1081 K1082 I1083 I1089 P1090	W1081-F1085 HydrophobicContact CE3-CD2 4.49Å; W1081-F1085 HydrophobicContact CE3-CE2 4.03Å; W1081-F1085 HydrophobicContact CZ3-CE2 4.33Å; W1081-F1085 WeakPolarHBondContact O-CD2 3.31Å; W1081-F1085 PolarHBondContact O-N 2.68Å; K1082-F1085 CarbonylContact O-C 3.6Å; K1082-F1085 PolarHBondContact O-N 3.08Å; K1082-F1085 VanDerWaalsContact O-N 3.16Å; I1083-F1085 VanDerWaalsContact C-N 3.35Å; I1083-F1085 PolarHBondContact O-N 3.2Å; F1085-I1089 HydrophobicContact CD1-CD1 3.53Å; F1085-I1089 HydrophobicContact CE1-CD1 3.64Å; F1085-I1089 HydrophobicContact CG-CD1 4.05Å; F1085-I1089 HydrophobicContact CZ-CD1 4.25Å; F1085-P1090 WeakPolarHBondContact O-CD 3.48Å; F1085-P1090 WeakPolarHBondContact O-CG 3.39Å
1086	K	85.3	Confident	84.6	Confident	56 Å²	56	39 Å²	39	24%	0.243	19%	0.188	C	C	.	.	I	π-helix	trans	-102.9	-31.8	-173	-170.5	176.4	172.3	-167.1	0	114	K1082 I1083 P1090 N1495 M1498 E1506	K1082-K1086 WeakPolarHBondContact O-CB 3.17Å; K1082-K1086 PolarHBondContact O-N 3.1Å; I1083-K1086 PolarHBondContact O-N 2.75Å; K1086-P1090 WeakPolarHBondContact O-CG 3.33Å; K1086-N1495 PolarHBondContact O-ND2 2.76Å; K1086-M1498 HydrophobicContact CG-SD 4.11Å; K1086-E1506 VanDerWaalsContact CD-OE1 3.27Å; K1086-E1506 WeakPolarHBondContact CD-OE1 3.48Å; K1086-E1506 WeakPolarHBondContact CE-OE1 3.46Å; K1086-E1506 IonicContact NZ-OE1 3.62Å; K1086-E1506 PolarHBondContact NZ-OE1 3.31Å; K1086-E1506 IonicContact NZ-OE2 2.74Å
1087	H	88.2	Confident	84.5	Confident	3 Å²	3	41.6 Å²	41.6	1%	0.014	20%	0.202	C	C	.	.	I	π-helix	trans	-111.2	-48.8	-179.9	-60.7	-91.4	0	0	0	112.5	Y1069 V1070 I1083 N1091 N1495 E1506	Y1069-H1087 HydrophobicContact CD2-CB 4.22Å; Y1069-H1087 AromaticContact CD2-ND1 3.81Å; Y1069-H1087 HydrophobicContact CE2-CB 4.05Å; V1070-H1087 HydrophobicContact CG2-CB 4.07Å; I1083-H1087 HydrophobicContact CG2-CB 4.48Å; I1083-H1087 WeakPolarHBondContact O-CA 3.34Å; I1083-H1087 WeakPolarHBondContact O-CB 3.19Å; I1083-H1087 PolarHBondContact O-N 2.76Å; H1087-N1091 WeakPolarHBondContact O-CB 3.49Å; H1087-N1091 PolarHBondContact O-ND2 2.8Å; H1087-N1495 PolarHBondContact ND1-ND2 3.04Å; H1087-E1506 IonicContact CE1-OE1 3.82Å; H1087-E1506 IonicContact CE1-OE2 3.24Å; H1087-E1506 PolarHBondContact CE1-OE2 2.76Å; H1087-E1506 VanDerWaalsContact CE1-OE2 3.24Å; H1087-E1506 IonicContact NE2-OE1 2.96Å; H1087-E1506 PolarHBondContact NE2-OE1 2.91Å; H1087-E1506 IonicContact NE2-OE2 3.58Å; H1087-E1506 PolarHBondContact NE2-OE2 3.07Å
1088	I	87.8	Confident	84.6	Confident	0 Å²	0	42.8 Å²	42.8	0%	0	21%	0.207	C	C	.	.	I	π-helix	trans	-75.7	-63.1	-173.2	-48.8	-62.1	0	0	0	111.9	L998 M1002 T1061 L1064 V1070 I1083 A1084 N1091 I1092	L998-I1088 HydrophobicContact CD2-CB 4.49Å; L998-I1088 HydrophobicContact CD2-CG2 3.99Å; M1002-I1088 HydrophobicContact SD-CG1 4.1Å; T1061-I1088 HydrophobicContact CG2-CG2 4.21Å; L1064-I1088 HydrophobicContact CB-CD1 3.79Å; V1070-I1088 HydrophobicContact CG2-CD1 3.88Å; I1083-I1088 HydrophobicContact CG2-CG1 4.39Å; I1083-I1088 PolarHBondContact O-N 3.33Å; I1083-I1088 VanDerWaalsContact O-N 3.12Å; A1084-I1088 PolarHBondContact O-N 3.32Å; I1088-N1091 PolarHBondContact O-N 2.93Å; I1088-I1092 HydrophobicContact CG2-CD1 4.26Å; I1088-I1092 HydrophobicContact CG2-CG2 4.29Å; I1088-I1092 PolarHBondContact O-N 3.36Å
1089	I	88.6	Confident	84.6	Confident	36 Å²	36	43.4 Å²	43.4	19%	0.185	21%	0.21	C	C	.	.	H	α-helix	trans	-52.4	-46.3	-177.5	-68.3	173.9	0	0	0	112	L998 A1084 F1085 N1091 I1092 S1093	L998-I1089 HydrophobicContact CD1-CD1 3.48Å; L998-I1089 VanDerWaalsContact CD1-CD1 3.48Å; L998-I1089 HydrophobicContact CD1-CG1 3.62Å; L998-I1089 HydrophobicContact CD2-CG1 3.9Å; L998-I1089 HydrophobicContact CG-CG1 4.39Å; A1084-I1089 WeakPolarHBondContact O-CB 3.4Å; A1084-I1089 VanDerWaalsContact O-CG1 3.27Å; A1084-I1089 WeakPolarHBondContact O-CG1 3.45Å; A1084-I1089 PolarHBondContact O-N 2.97Å; F1085-I1089 HydrophobicContact CD1-CD1 3.53Å; F1085-I1089 HydrophobicContact CE1-CD1 3.64Å; F1085-I1089 HydrophobicContact CG-CD1 4.05Å; F1085-I1089 HydrophobicContact CZ-CD1 4.25Å; I1089-N1091 VanDerWaalsContact C-N 3.3Å; I1089-N1091 PolarHBondContact O-N 3.21Å; I1089-I1092 PolarHBondContact O-N 3.47Å; I1089-S1093 WeakPolarHBondContact O-CB 3.48Å; I1089-S1093 PolarHBondContact O-N 3.39Å
1090	P	83.7	Confident	84.8	Confident	42 Å²	42	44 Å²	44	27%	0.273	21%	0.21	S	C	.	.	H	α-helix	trans	-63	-34.9	179.8	-27	39.7	0	0	0	113	F1085 K1086 S1093 R1497	F1085-P1090 WeakPolarHBondContact O-CD 3.48Å; F1085-P1090 WeakPolarHBondContact O-CG 3.39Å; K1086-P1090 WeakPolarHBondContact O-CG 3.33Å; P1090-S1093 PolarHBondContact O-OG 3.36Å; P1090-R1497 WeakPolarHBondContact O-CD 3.37Å; P1090-R1497 PolarHBondContact O-NH1 3.43Å
1091	N	81.2	Confident	85.1	Confident	18 Å²	18	39.9 Å²	39.9	10%	0.096	19%	0.192	C	C	.	.	H	α-helix	trans	-76.6	-36.9	177.7	-78.8	-62.9	0	0	0	113.4	L1064 H1087 I1088 I1089 S1093 N1495 R1497	L1064-N1091 HydrophobicContact CD1-CB 3.69Å; H1087-N1091 WeakPolarHBondContact O-CB 3.49Å; H1087-N1091 PolarHBondContact O-ND2 2.8Å; I1088-N1091 PolarHBondContact O-N 2.93Å; I1089-N1091 VanDerWaalsContact C-N 3.3Å; I1089-N1091 PolarHBondContact O-N 3.21Å; N1091-S1093 VanDerWaalsContact C-N 3.34Å; N1091-S1093 PolarHBondContact O-N 3.33Å; N1091-N1495 PolarHBondContact ND2-OD1 2.96Å; N1091-R1497 WeakPolarHBondContact OD1-CD 3.43Å; N1091-R1497 WeakPolarHBondContact OD1-CG 3.35Å; N1091-R1497 PolarHBondContact OD1-NE 2.92Å
1092	I	85.4	Confident	85	Confident	2 Å²	2	34.3 Å²	34.3	1%	0.01	17%	0.172	C	C	.	.	H	α-helix	trans	-85.2	-1.9	177	71.5	173.5	0	0	0	114.2	L998 V1057 Q1060 L1064 I1088 I1089 S1094 V1095 I1096	L998-I1092 HydrophobicContact CD2-CD1 4.35Å; V1057-I1092 HydrophobicContact CB-CD1 4.43Å; V1057-I1092 HydrophobicContact CG1-CD1 3.77Å; V1057-I1092 HydrophobicContact CG2-CD1 4.33Å; Q1060-I1092 HydrophobicContact CB-CB 4.27Å; Q1060-I1092 HydrophobicContact CB-CG2 3.59Å; L1064-I1092 HydrophobicContact CD1-CG2 3.54Å; L1064-I1092 HydrophobicContact CG-CG2 4.46Å; I1088-I1092 HydrophobicContact CG2-CD1 4.26Å; I1088-I1092 HydrophobicContact CG2-CG2 4.29Å; I1088-I1092 PolarHBondContact O-N 3.36Å; I1089-I1092 PolarHBondContact O-N 3.47Å; I1092-S1094 VanDerWaalsContact C-N 3.28Å; I1092-S1094 PolarHBondContact O-N 2.86Å; I1092-V1095 WeakPolarHBondContact O-CB 3.34Å; I1092-V1095 PolarHBondContact O-N 2.9Å; I1092-I1096 HydrophobicContact CD1-CD1 3.97Å; I1092-I1096 HydrophobicContact CG1-CD1 3.84Å; I1092-I1096 HydrophobicContact CG1-CG1 4.37Å; I1092-I1096 PolarHBondContact O-N 2.72Å; I1092-I1096 VanDerWaalsContact O-N 3.14Å
1093	S	82.6	Confident	85	Confident	36 Å²	36	29.7 Å²	29.7	25%	0.252	15%	0.153	S	C	.	.	H	α-helix	trans	-57.8	-33.2	-172.7	58.1	0	0	0	0	114.5	I1089 P1090 N1091 I1096 I1097 R1497	I1089-S1093 WeakPolarHBondContact O-CB 3.48Å; I1089-S1093 PolarHBondContact O-N 3.39Å; P1090-S1093 PolarHBondContact O-OG 3.36Å; N1091-S1093 VanDerWaalsContact C-N 3.34Å; N1091-S1093 PolarHBondContact O-N 3.33Å; S1093-I1096 PolarHBondContact O-N 2.73Å; S1093-I1097 WeakPolarHBondContact O-CD1 3.32Å; S1093-I1097 VanDerWaalsContact O-CG1 3.23Å; S1093-I1097 WeakPolarHBondContact O-CG1 3.17Å; S1093-I1097 PolarHBondContact O-N 3.2Å; S1093-R1497 PolarHBondContact OG-NH1 3.22Å; S1093-R1497 VanDerWaalsContact OG-NH1 3.14Å
1094	S	77.5	Confident	85.2	Confident	13 Å²	13	29.8 Å²	29.8	9%	0.091	15%	0.153	C	C	.	.	H	α-helix	trans	-60.2	-44.5	172.2	30.7	0	0	0	0	112	I1092 I1097 I1098	I1092-S1094 VanDerWaalsContact C-N 3.28Å; I1092-S1094 PolarHBondContact O-N 2.86Å; S1094-I1097 PolarHBondContact O-N 3.09Å; S1094-I1098 WeakPolarHBondContact O-CD1 3.35Å; S1094-I1098 VanDerWaalsContact O-CG1 3.23Å; S1094-I1098 WeakPolarHBondContact O-CG1 3.23Å; S1094-I1098 PolarHBondContact O-N 2.96Å
1095	V	82.3	Confident	85.2	Confident	42 Å²	42	30 Å²	30	26%	0.255	16%	0.155	S	C	.	.	H	α-helix	trans	-65.6	-41.2	-179.8	-169.3	0	0	0	0	110.4	I1056 Q1060 I1092 I1098 Q1099	I1056-V1095 HydrophobicContact CG2-CG1 3.34Å; Q1060-V1095 HydrophobicContact CG-CG1 4.4Å; Q1060-V1095 HydrophobicContact CG-CG2 4.41Å; I1092-V1095 WeakPolarHBondContact O-CB 3.34Å; I1092-V1095 PolarHBondContact O-N 2.9Å; V1095-I1098 PolarHBondContact O-N 2.73Å; V1095-Q1099 WeakPolarHBondContact O-CB 3.18Å; V1095-Q1099 PolarHBondContact O-N 2.78Å
1096	I	86.2	Confident	85	Confident	20 Å²	20	26.9 Å²	26.9	10%	0.103	15%	0.147	C	C	.	.	H	α-helix	trans	-61.5	-44.7	173.5	-62.7	171.1	0	0	0	110.8	V994 M1053 V1057 I1092 S1093 Q1099 M1100	V994-I1096 HydrophobicContact CG1-CD1 3.9Å; V994-I1096 HydrophobicContact CG2-CD1 3.81Å; V994-I1096 HydrophobicContact CG2-CG1 4.08Å; V994-I1096 HydrophobicContact CG2-CG2 3.9Å; M1053-I1096 HydrophobicContact CE-CG2 4.04Å; M1053-I1096 HydrophobicContact SD-CB 4.31Å; M1053-I1096 HydrophobicContact SD-CG1 4.19Å; M1053-I1096 HydrophobicContact SD-CG2 4.06Å; V1057-I1096 HydrophobicContact CG2-CD1 4.33Å; V1057-I1096 HydrophobicContact CG2-CG1 3.93Å; I1092-I1096 HydrophobicContact CD1-CD1 3.97Å; I1092-I1096 HydrophobicContact CG1-CD1 3.84Å; I1092-I1096 HydrophobicContact CG1-CG1 4.37Å; I1092-I1096 PolarHBondContact O-N 2.72Å; I1092-I1096 VanDerWaalsContact O-N 3.14Å; S1093-I1096 PolarHBondContact O-N 2.73Å; I1096-Q1099 PolarHBondContact O-N 2.75Å; I1096-M1100 WeakPolarHBondContact O-CB 3.2Å; I1096-M1100 PolarHBondContact O-N 3.11Å
1097	I	84.1	Confident	85.1	Confident	54 Å²	54	24.2 Å²	24.2	28%	0.277	14%	0.135	S	C	.	.	H	α-helix	trans	-64.6	-43.3	179.2	-69.5	162.5	0	0	0	111.6	S1093 S1094 M1100 M1101 L1167 F1171	S1093-I1097 WeakPolarHBondContact O-CD1 3.32Å; S1093-I1097 VanDerWaalsContact O-CG1 3.23Å; S1093-I1097 WeakPolarHBondContact O-CG1 3.17Å; S1093-I1097 PolarHBondContact O-N 3.2Å; S1094-I1097 PolarHBondContact O-N 3.09Å; I1097-M1100 HydrophobicContact CB-CE 4.39Å; I1097-M1100 HydrophobicContact CG1-CE 4.34Å; I1097-M1100 HydrophobicContact CG2-CE 4.17Å; I1097-M1100 PolarHBondContact O-N 2.59Å; I1097-M1101 VanDerWaalsContact O-CG 3.31Å; I1097-M1101 WeakPolarHBondContact O-CG 3.27Å; I1097-M1101 PolarHBondContact O-N 2.99Å; I1097-L1167 HydrophobicContact CG2-CD1 4.12Å; I1097-F1171 HydrophobicContact CB-CE2 4.07Å; I1097-F1171 HydrophobicContact CD1-CE2 4.35Å; I1097-F1171 HydrophobicContact CD1-CZ 4.08Å; I1097-F1171 HydrophobicContact CG2-CE2 3.84Å; I1097-F1171 HydrophobicContact CG2-CZ 4.3Å
1098	I	81.6	Confident	85.1	Confident	28 Å²	28	24.1 Å²	24.1	14%	0.144	14%	0.135	C	C	.	.	H	α-helix	trans	-63.1	-46.3	176.9	-66.7	159.7	0	0	0	110.3	S1094 V1095 M1101 F1102 R1168 F1171	S1094-I1098 WeakPolarHBondContact O-CD1 3.35Å; S1094-I1098 VanDerWaalsContact O-CG1 3.23Å; S1094-I1098 WeakPolarHBondContact O-CG1 3.23Å; S1094-I1098 PolarHBondContact O-N 2.96Å; V1095-I1098 PolarHBondContact O-N 2.73Å; I1098-M1101 PolarHBondContact O-N 2.75Å; I1098-M1101 VanDerWaalsContact O-N 3.17Å; I1098-F1102 HydrophobicContact CG2-CD2 4.05Å; I1098-F1102 HydrophobicContact CG2-CE2 3.55Å; I1098-F1102 HydrophobicContact CG2-CZ 4.37Å; I1098-F1102 WeakPolarHBondContact O-CD2 3.46Å; I1098-F1102 PolarHBondContact O-N 3.07Å; I1098-R1168 HydrophobicContact CD1-CB 4Å; I1098-R1168 HydrophobicContact CD1-CG 4.18Å; I1098-R1168 HydrophobicContact CG1-CB 4.35Å; I1098-F1171 HydrophobicContact CD1-CD2 4.04Å; I1098-F1171 HydrophobicContact CG1-CD2 4.08Å
1099	Q	86.1	Confident	85.1	Confident	33 Å²	33	26.3 Å²	26.3	15%	0.154	14%	0.144	C	C	.	.	H	α-helix	trans	-64.6	-41.6	179.6	-178.7	55.2	35.5	0	0	112.1	M1053 I1056 V1095 I1096 M1101 F1102 S1103	M1053-Q1099 HydrophobicContact CB-CG 4.26Å; M1053-Q1099 HydrophobicContact CE-CB 3.85Å; M1053-Q1099 HydrophobicContact CE-CG 3.7Å; M1053-Q1099 HydrophobicContact SD-CB 4.07Å; M1053-Q1099 HydrophobicContact SD-CG 3.91Å; I1056-Q1099 HydrophobicContact CD1-CG 4.16Å; V1095-Q1099 WeakPolarHBondContact O-CB 3.18Å; V1095-Q1099 PolarHBondContact O-N 2.78Å; I1096-Q1099 PolarHBondContact O-N 2.75Å; Q1099-M1101 VanDerWaalsContact C-N 3.31Å; Q1099-M1101 PolarHBondContact O-N 2.9Å; Q1099-F1102 PolarHBondContact O-N 2.89Å; Q1099-F1102 VanDerWaalsContact O-N 3.12Å; Q1099-S1103 PolarHBondContact O-N 3.17Å
1100	M	86.6	Confident	84.8	Confident	46 Å²	46	26.4 Å²	26.4	23%	0.227	14%	0.144	C	C	.	.	H	α-helix	trans	-56.5	-43.4	170.9	170.9	-172.5	55.7	0	0	111.8	A986 I990 I1096 I1097 F1102 S1103 I1104	A986-M1100 HydrophobicContact CB-CG 4.49Å; I990-M1100 HydrophobicContact CD1-CB 4.37Å; I990-M1100 HydrophobicContact CD1-CG 3.93Å; I990-M1100 HydrophobicContact CD1-SD 3.54Å; I990-M1100 VanDerWaalsContact CD1-SD 3.54Å; I990-M1100 HydrophobicContact CG1-CB 4.41Å; I990-M1100 HydrophobicContact CG1-CG 4.45Å; I1096-M1100 WeakPolarHBondContact O-CB 3.2Å; I1096-M1100 PolarHBondContact O-N 3.11Å; I1097-M1100 HydrophobicContact CB-CE 4.39Å; I1097-M1100 HydrophobicContact CG1-CE 4.34Å; I1097-M1100 HydrophobicContact CG2-CE 4.17Å; I1097-M1100 PolarHBondContact O-N 2.59Å; M1100-F1102 PolarHBondContact O-N 2.63Å; M1100-S1103 PolarHBondContact O-N 2.84Å; M1100-S1103 PolarHBondContact O-OG 2.74Å; M1100-I1104 PolarHBondContact O-N 2.85Å
1101	M	86.7	Confident	85	Confident	23 Å²	23	24.4 Å²	24.4	11%	0.113	13%	0.131	C	C	.	.	H	α-helix	trans	-68.6	-19.1	179.3	-70.8	-71.1	106.4	0	0	113.4	I1097 I1098 Q1099 I1104 P1105 F1160 L1163 A1164 L1167	I1097-M1101 VanDerWaalsContact O-CG 3.31Å; I1097-M1101 WeakPolarHBondContact O-CG 3.27Å; I1097-M1101 PolarHBondContact O-N 2.99Å; I1098-M1101 PolarHBondContact O-N 2.75Å; I1098-M1101 VanDerWaalsContact O-N 3.17Å; Q1099-M1101 VanDerWaalsContact C-N 3.31Å; Q1099-M1101 PolarHBondContact O-N 2.9Å; M1101-I1104 HydrophobicContact CE-CD1 3.62Å; M1101-P1105 WeakPolarHBondContact O-CD 3.47Å; M1101-P1105 WeakPolarHBondContact O-CG 3.5Å; M1101-F1160 HydrophobicContact SD-CD1 4.35Å; M1101-L1163 HydrophobicContact SD-CD2 4.1Å; M1101-L1163 HydrophobicContact SD-CG 4.36Å; M1101-A1164 HydrophobicContact CB-CB 3.65Å; M1101-L1167 HydrophobicContact CG-CD1 3.87Å; M1101-L1167 HydrophobicContact SD-CD1 4.42Å
1102	F	84	Confident	85.4	Confident	29 Å²	29	23.6 Å²	23.6	13%	0.127	13%	0.126	C	C	.	.	H	α-helix	trans	-89.4	-27.1	168.6	-66.2	-47.6	0	0	0	114.1	R694 I1098 Q1099 M1100 P1105 T1106 A1164	R694-F1102 VanDerWaalsContact NH2-CD1 3.27Å; I1098-F1102 HydrophobicContact CG2-CD2 4.05Å; I1098-F1102 HydrophobicContact CG2-CE2 3.55Å; I1098-F1102 HydrophobicContact CG2-CZ 4.37Å; I1098-F1102 WeakPolarHBondContact O-CD2 3.46Å; I1098-F1102 PolarHBondContact O-N 3.07Å; Q1099-F1102 PolarHBondContact O-N 2.89Å; Q1099-F1102 VanDerWaalsContact O-N 3.12Å; M1100-F1102 PolarHBondContact O-N 2.63Å; F1102-P1105 WeakPolarHBondContact O-CD 3.33Å; F1102-P1105 WeakPolarHBondContact O-CG 3.3Å; F1102-T1106 WeakPolarHBondContact O-CB 3.35Å; F1102-T1106 PolarHBondContact O-N 3.22Å; F1102-T1106 PolarHBondContact O-OG1 3.42Å; F1102-A1164 HydrophobicContact CD1-CB 3.87Å; F1102-A1164 HydrophobicContact CE1-CB 3.46Å; F1102-A1164 VanDerWaalsContact CE1-CB 3.46Å; F1102-A1164 HydrophobicContact CZ-CB 3.83Å
1103	S	85.3	Confident	85.3	Confident	10 Å²	10	23.9 Å²	23.9	7%	0.07	13%	0.127	C	C	.	.	H	α-helix	trans	-68.6	-34.3	178.1	68.2	0	0	0	0	112.6	D989 Q1099 M1100 T1106 A1107	D989-S1103 WeakPolarHBondContact OD2-CB 3.33Å; D989-S1103 PolarHBondContact OD2-OG 2.82Å; Q1099-S1103 PolarHBondContact O-N 3.17Å; M1100-S1103 PolarHBondContact O-N 2.84Å; M1100-S1103 PolarHBondContact O-OG 2.74Å; S1103-T1106 PolarHBondContact O-N 3.26Å; S1103-A1107 WeakPolarHBondContact O-CB 3.18Å; S1103-A1107 PolarHBondContact O-N 3.4Å
1104	I	90.1	Very high	85.2	Confident	2 Å²	2	22.1 Å²	22.1	1%	0.01	12%	0.115	C	C	.	.	H	α-helix	trans	-59.6	-59.8	176.7	-63.9	168.5	0	0	0	113.1	A982 F983 A986 M1100 M1101 T1106 A1107 I1108 F1160	A982-I1104 HydrophobicContact CB-CG2 3.96Å; F983-I1104 HydrophobicContact CD1-CD1 4.09Å; F983-I1104 HydrophobicContact CE1-CD1 3.9Å; A986-I1104 HydrophobicContact CB-CD1 4.38Å; A986-I1104 HydrophobicContact CB-CG1 3.73Å; M1100-I1104 PolarHBondContact O-N 2.85Å; M1101-I1104 HydrophobicContact CE-CD1 3.62Å; I1104-T1106 PolarHBondContact O-N 3.37Å; I1104-A1107 PolarHBondContact O-N 3.15Å; I1104-A1107 VanDerWaalsContact O-N 3.09Å; I1104-I1108 HydrophobicContact CG2-CD1 4.07Å; I1104-I1108 WeakPolarHBondContact O-CG1 3.42Å; I1104-I1108 PolarHBondContact O-N 3.39Å; I1104-F1160 HydrophobicContact CB-CD1 4.47Å; I1104-F1160 HydrophobicContact CB-CE1 4.4Å; I1104-F1160 HydrophobicContact CD1-CE1 4.05Å; I1104-F1160 HydrophobicContact CG2-CD1 4.09Å; I1104-F1160 HydrophobicContact CG2-CD2 4.03Å; I1104-F1160 HydrophobicContact CG2-CE1 3.76Å; I1104-F1160 HydrophobicContact CG2-CE2 3.67Å; I1104-F1160 HydrophobicContact CG2-CG 4.24Å; I1104-F1160 HydrophobicContact CG2-CZ 3.54Å
1105	P	86.9	Confident	85.6	Confident	6 Å²	6	21.7 Å²	21.7	4%	0.039	11%	0.112	C	C	.	.	H	α-helix	trans	-63.2	-28.3	178.9	24.4	-33.8	0	0	0	112.7	M1101 F1102 F1109 M1157 F1160	M1101-P1105 WeakPolarHBondContact O-CD 3.47Å; M1101-P1105 WeakPolarHBondContact O-CG 3.5Å; F1102-P1105 WeakPolarHBondContact O-CD 3.33Å; F1102-P1105 WeakPolarHBondContact O-CG 3.3Å; P1105-F1109 WeakPolarHBondContact O-CB 3.34Å; P1105-F1109 PolarHBondContact O-N 3.43Å; P1105-M1157 HydrophobicContact CB-CG 4.21Å; P1105-F1160 HydrophobicContact CB-CB 4.2Å; P1105-F1160 HydrophobicContact CG-CB 4.03Å
1106	T	84.4	Confident	85.9	Confident	65 Å²	65	20.1 Å²	20.1	40%	0.399	10%	0.102	S	C	.	.	H	α-helix	trans	-65.8	-42.4	172.5	-58.5	0	0	0	0	111.7	F1102 S1103 I1104 F1109 F1110	F1102-T1106 WeakPolarHBondContact O-CB 3.35Å; F1102-T1106 PolarHBondContact O-N 3.22Å; F1102-T1106 PolarHBondContact O-OG1 3.42Å; S1103-T1106 PolarHBondContact O-N 3.26Å; I1104-T1106 PolarHBondContact O-N 3.37Å; T1106-F1109 PolarHBondContact O-N 3.26Å; T1106-F1110 HydrophobicContact CG2-CD2 3.8Å; T1106-F1110 HydrophobicContact CG2-CE2 3.64Å; T1106-F1110 VanDerWaalsContact O-CD2 3.25Å; T1106-F1110 WeakPolarHBondContact O-CD2 3.3Å; T1106-F1110 PolarHBondContact O-N 3.01Å
1107	A	87.4	Confident	85.5	Confident	0 Å²	0	20.2 Å²	20.2	0%	0	10%	0.102	C	C	.	.	H	α-helix	trans	-68.2	-40.3	175.3	0	0	0	0	0	112.5	A982 A985 M1045 S1103 I1104 F1109 F1110 E1111	A982-A1107 HydrophobicContact CB-CB 3.87Å; A985-A1107 HydrophobicContact CB-CB 3.88Å; M1045-A1107 HydrophobicContact CE-CB 4.21Å; M1045-A1107 VanDerWaalsContact CE-O 3.3Å; M1045-A1107 WeakPolarHBondContact CE-O 3.36Å; M1045-A1107 HydrophobicContact SD-CB 3.86Å; S1103-A1107 WeakPolarHBondContact O-CB 3.18Å; S1103-A1107 PolarHBondContact O-N 3.4Å; I1104-A1107 PolarHBondContact O-N 3.15Å; I1104-A1107 VanDerWaalsContact O-N 3.09Å; A1107-F1109 VanDerWaalsContact C-N 3.33Å; A1107-F1109 PolarHBondContact O-N 3.43Å; A1107-F1110 PolarHBondContact O-N 3.32Å; A1107-E1111 PolarHBondContact O-N 2.76Å
1108	I	89.7	Confident	85.2	Confident	1 Å²	1	19.2 Å²	19.2	1%	0.005	11%	0.105	C	C	.	.	H	α-helix	trans	-58.4	-46	172	-64.2	172.8	0	0	0	110.3	L979 A982 I1104 A1112 I1153 I1156 F1160	L979-I1108 HydrophobicContact CD2-CD1 4.02Å; A982-I1108 HydrophobicContact CB-CD1 4.32Å; A982-I1108 HydrophobicContact CB-CG1 3.55Å; I1104-I1108 HydrophobicContact CG2-CD1 4.07Å; I1104-I1108 WeakPolarHBondContact O-CG1 3.42Å; I1104-I1108 PolarHBondContact O-N 3.39Å; I1108-A1112 VanDerWaalsContact O-CB 3.25Å; I1108-A1112 WeakPolarHBondContact O-CB 3.32Å; I1108-A1112 PolarHBondContact O-N 2.88Å; I1108-I1153 HydrophobicContact CG2-CD1 4.09Å; I1108-I1153 HydrophobicContact CG2-CG1 3.96Å; I1108-I1156 HydrophobicContact CD1-CG2 3.7Å; I1108-F1160 HydrophobicContact CD1-CD2 4.16Å; I1108-F1160 HydrophobicContact CD1-CE2 3.97Å
1109	F	85.9	Confident	84.9	Confident	46 Å²	46	19 Å²	19	20%	0.202	10%	0.104	C	C	.	.	H	α-helix	trans	-59.7	-48.5	176.9	171.9	-93.1	0	0	0	112	P697 F699 P1105 T1106 A1107 A1112 F1113 M1157	P697-F1109 HydrophobicContact CB-CD2 3.94Å; P697-F1109 HydrophobicContact CB-CE2 3.95Å; P697-F1109 HydrophobicContact CG-CD2 4.44Å; F699-F1109 AromaticContact CD1-CE2 4Å; F699-F1109 HydrophobicContact CD1-CE2 4Å; F699-F1109 HydrophobicContact CE1-CD2 4.26Å; F699-F1109 AromaticContact CE1-CE2 3.94Å; F699-F1109 HydrophobicContact CE1-CE2 3.94Å; P1105-F1109 WeakPolarHBondContact O-CB 3.34Å; P1105-F1109 PolarHBondContact O-N 3.43Å; T1106-F1109 PolarHBondContact O-N 3.26Å; A1107-F1109 VanDerWaalsContact C-N 3.33Å; A1107-F1109 PolarHBondContact O-N 3.43Å; F1109-A1112 PolarHBondContact O-N 3.11Å; F1109-F1113 HydrophobicContact CE1-CD1 4.19Å; F1109-F1113 WeakPolarHBondContact O-CB 3.27Å; F1109-F1113 PolarHBondContact O-N 3.48Å; F1109-M1157 HydrophobicContact CB-CE 4.16Å; F1109-M1157 HydrophobicContact CD2-CE 4.47Å
1110	F	83.5	Confident	84.7	Confident	39 Å²	39	17.4 Å²	17.4	17%	0.171	10%	0.097	C	C	.	.	H	α-helix	trans	-67.1	-39.1	-178.5	-82.3	-59.4	0	0	0	113.4	N1023 M1027 M1045 T1106 A1107 F1113 L1114	N1023-F1110 HydrophobicContact CB-CZ 4.44Å; M1027-F1110 HydrophobicContact CE-CB 4.17Å; M1027-F1110 HydrophobicContact CE-CD1 3.75Å; M1027-F1110 HydrophobicContact CE-CG 4.23Å; M1027-F1110 HydrophobicContact SD-CB 4.43Å; M1045-F1110 HydrophobicContact CE-CB 3.89Å; T1106-F1110 HydrophobicContact CG2-CD2 3.8Å; T1106-F1110 HydrophobicContact CG2-CE2 3.64Å; T1106-F1110 VanDerWaalsContact O-CD2 3.25Å; T1106-F1110 WeakPolarHBondContact O-CD2 3.3Å; T1106-F1110 PolarHBondContact O-N 3.01Å; A1107-F1110 PolarHBondContact O-N 3.32Å; F1110-F1113 HydrophobicContact CD1-CD1 4.26Å; F1110-L1114 WeakPolarHBondContact O-CB 3.41Å; F1110-L1114 WeakPolarHBondContact O-CG 3.21Å; F1110-L1114 PolarHBondContact O-N 3.23Å
1111	E	87.9	Confident	84.7	Confident	0 Å²	0	15.9 Å²	15.9	0%	0	9%	0.089	C	C	.	.	H	α-helix	trans	-60.5	-55.3	171.2	-177.5	-75.3	115.9	0	0	110.5	S978 I981 I1041 M1045 A1107 F1113 L1114 S1115 S1127	S978-E1111 WeakPolarHBondContact CB-OE2 3.26Å; S978-E1111 PolarHBondContact OG-OE2 2.87Å; I981-E1111 HydrophobicContact CD1-CG 3.67Å; I981-E1111 HydrophobicContact CG2-CB 4.34Å; I981-E1111 HydrophobicContact CG2-CG 4.46Å; I1041-E1111 HydrophobicContact CD1-CG 4.5Å; M1045-E1111 HydrophobicContact CE-CB 4.35Å; A1107-E1111 PolarHBondContact O-N 2.76Å; E1111-F1113 VanDerWaalsContact C-N 3.26Å; E1111-F1113 PolarHBondContact O-N 2.59Å; E1111-L1114 PolarHBondContact O-N 3.1Å; E1111-S1115 WeakPolarHBondContact O-CB 3.3Å; E1111-S1115 PolarHBondContact O-N 2.93Å; E1111-S1115 PolarHBondContact O-OG 2.93Å; E1111-S1115 VanDerWaalsContact OE1-CB 3.28Å; E1111-S1115 WeakPolarHBondContact OE1-CB 3.45Å; E1111-S1115 PolarHBondContact OE1-OG 2.91Å; E1111-S1127 WeakPolarHBondContact OE1-CB 3.38Å; E1111-S1127 PolarHBondContact OE1-OG 3.31Å
1112	A	88.6	Confident	84.5	Confident	0 Å²	0	18 Å²	18	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-63.5	-34.6	-175.3	0	0	0	0	0	111.9	F699 I1108 F1109 F1116 G1129 I1153	F699-A1112 HydrophobicContact CZ-CB 4.45Å; I1108-A1112 VanDerWaalsContact O-CB 3.25Å; I1108-A1112 WeakPolarHBondContact O-CB 3.32Å; I1108-A1112 PolarHBondContact O-N 2.88Å; F1109-A1112 PolarHBondContact O-N 3.11Å; A1112-F1116 WeakPolarHBondContact O-CA 3.05Å; A1112-F1116 WeakPolarHBondContact O-CB 3.47Å; A1112-F1116 PolarHBondContact O-N 2.79Å; A1112-G1129 WeakPolarHBondContact O-CA 3.38Å; A1112-I1153 HydrophobicContact CB-CD1 3.29Å
1113	F	83.8	Confident	84.2	Confident	8 Å²	8	20 Å²	20	4%	0.035	12%	0.12	C	C	.	.	H	α-helix	trans	-65.6	-51	173.5	166.1	-148	0	0	0	111.9	F699 V802 L1024 F1109 F1110 E1111 S1115 F1116 I1117	F699-F1113 HydrophobicContact CE1-CB 3.98Å; V802-F1113 HydrophobicContact CB-CD2 4.47Å; V802-F1113 HydrophobicContact CB-CE2 4.04Å; V802-F1113 HydrophobicContact CG1-CD2 3.86Å; V802-F1113 HydrophobicContact CG1-CE2 3.7Å; V802-F1113 HydrophobicContact CG2-CD2 3.76Å; V802-F1113 HydrophobicContact CG2-CE1 4.29Å; V802-F1113 HydrophobicContact CG2-CE2 3.26Å; V802-F1113 HydrophobicContact CG2-CZ 3.57Å; L1024-F1113 HydrophobicContact CD1-CD1 4.34Å; L1024-F1113 HydrophobicContact CD1-CE1 3.29Å; L1024-F1113 HydrophobicContact CD1-CZ 3.48Å; L1024-F1113 VanDerWaalsContact CD1-CZ 3.48Å; F1109-F1113 HydrophobicContact CE1-CD1 4.19Å; F1109-F1113 WeakPolarHBondContact O-CB 3.27Å; F1109-F1113 PolarHBondContact O-N 3.48Å; F1110-F1113 HydrophobicContact CD1-CD1 4.26Å; E1111-F1113 VanDerWaalsContact C-N 3.26Å; E1111-F1113 PolarHBondContact O-N 2.59Å; F1113-S1115 PolarHBondContact O-N 2.94Å; F1113-F1116 WeakPolarHBondContact O-CB 2.99Å; F1113-F1116 PolarHBondContact O-N 3.29Å; F1113-F1116 VanDerWaalsContact O-N 3.13Å; F1113-I1117 HydrophobicContact CD2-CD1 4.44Å; F1113-I1117 HydrophobicContact CD2-CG2 4.01Å; F1113-I1117 HydrophobicContact CE2-CD1 3.79Å; F1113-I1117 HydrophobicContact CE2-CG1 4.33Å; F1113-I1117 HydrophobicContact CE2-CG2 3.71Å; F1113-I1117 HydrophobicContact CZ-CD1 4.22Å; F1113-I1117 WeakPolarHBondContact O-CG1 3.38Å; F1113-I1117 PolarHBondContact O-N 3.41Å
1114	L	80.4	Confident	83.9	Confident	0 Å²	0	23.1 Å²	23.1	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-55	-50.4	176.1	-84.1	179.1	0	0	0	112.2	M1027 L1031 I1041 F1110 E1111 F1116 I1117 G1118 L1119 G1120	M1027-L1114 HydrophobicContact CE-CD1 3.93Å; M1027-L1114 HydrophobicContact CE-CD2 3.93Å; M1027-L1114 HydrophobicContact CE-CG 3.71Å; M1027-L1114 HydrophobicContact CG-CD1 3.7Å; M1027-L1114 HydrophobicContact CG-CD2 4.23Å; M1027-L1114 HydrophobicContact CG-CG 4.31Å; M1027-L1114 HydrophobicContact SD-CD1 3.47Å; M1027-L1114 WeakPolarHBondContact SD-CD1 3.37Å; M1027-L1114 HydrophobicContact SD-CD2 4.44Å; M1027-L1114 HydrophobicContact SD-CG 3.98Å; L1031-L1114 HydrophobicContact CD1-CD1 3.82Å; L1031-L1114 HydrophobicContact CD1-CD2 3.6Å; L1031-L1114 HydrophobicContact CD1-CG 4.33Å; I1041-L1114 HydrophobicContact CD1-CD1 4.23Å; I1041-L1114 HydrophobicContact CG1-CD1 3.85Å; I1041-L1114 HydrophobicContact CG2-CD1 4.33Å; F1110-L1114 WeakPolarHBondContact O-CB 3.41Å; F1110-L1114 WeakPolarHBondContact O-CG 3.21Å; F1110-L1114 PolarHBondContact O-N 3.23Å; E1111-L1114 PolarHBondContact O-N 3.1Å; L1114-F1116 PolarHBondContact O-N 2.91Å; L1114-I1117 VanDerWaalsContact O-CG1 3.28Å; L1114-I1117 WeakPolarHBondContact O-CG1 3.37Å; L1114-I1117 PolarHBondContact O-N 2.94Å; L1114-G1118 PolarHBondContact O-N 2.77Å; L1114-L1119 HydrophobicContact CD2-CB 4.09Å; L1114-L1119 PolarHBondContact O-N 3.49Å; L1114-G1120 PolarHBondContact O-N 2.65Å
1115	S	87	Confident	83.6	Confident	3 Å²	3	24.3 Å²	24.3	2%	0.021	15%	0.15	C	C	.	.	H	α-helix	trans	-70.4	-24.9	-179.2	-54.6	0	0	0	0	111.3	E1111 F1113 L1121 S1127	E1111-S1115 WeakPolarHBondContact O-CB 3.3Å; E1111-S1115 PolarHBondContact O-N 2.93Å; E1111-S1115 PolarHBondContact O-OG 2.93Å; E1111-S1115 VanDerWaalsContact OE1-CB 3.28Å; E1111-S1115 WeakPolarHBondContact OE1-CB 3.45Å; E1111-S1115 PolarHBondContact OE1-OG 2.91Å; F1113-S1115 PolarHBondContact O-N 2.94Å; S1115-L1121 PolarHBondContact OG-N 3.4Å; S1115-S1127 VanDerWaalsContact CB-OG 3.31Å; S1115-S1127 WeakPolarHBondContact CB-OG 3.41Å; S1115-S1127 PolarHBondContact OG-OG 3.18Å
1116	F	87.2	Confident	83.6	Confident	9 Å²	9	24 Å²	24	4%	0.039	15%	0.148	C	C	.	.	H	α-helix	trans	-70.4	-37.9	170.5	176.2	-97	0	0	0	113.1	F699 V802 I806 A1112 F1113 L1114 G1118 G1129 L1132 N1133 Y1136	F699-F1116 HydrophobicContact CB-CE1 4.47Å; F699-F1116 HydrophobicContact CD2-CB 4.38Å; F699-F1116 AromaticContact CD2-CD1 3.71Å; F699-F1116 HydrophobicContact CD2-CD1 3.71Å; F699-F1116 HydrophobicContact CD2-CD2 4.01Å; F699-F1116 AromaticContact CD2-CE1 3.96Å; F699-F1116 HydrophobicContact CD2-CE1 3.96Å; F699-F1116 HydrophobicContact CD2-CE2 4.21Å; F699-F1116 AromaticContact CD2-CG 3.74Å; F699-F1116 HydrophobicContact CD2-CG 3.74Å; F699-F1116 HydrophobicContact CD2-CZ 4.2Å; F699-F1116 HydrophobicContact CE2-CB 3.85Å; F699-F1116 HydrophobicContact CE2-CD1 4.06Å; F699-F1116 AromaticContact CE2-CD2 3.86Å; F699-F1116 HydrophobicContact CE2-CD2 3.86Å; F699-F1116 HydrophobicContact CE2-CE2 4.45Å; F699-F1116 AromaticContact CE2-CG 3.63Å; F699-F1116 HydrophobicContact CE2-CG 3.63Å; F699-F1116 HydrophobicContact CG-CD1 4.29Å; F699-F1116 HydrophobicContact CZ-CB 4.26Å; F699-F1116 HydrophobicContact CZ-CG 4.47Å; V802-F1116 HydrophobicContact CG1-CD1 4.1Å; V802-F1116 HydrophobicContact CG1-CE1 4.13Å; I806-F1116 HydrophobicContact CD1-CE1 3.88Å; I806-F1116 HydrophobicContact CD1-CZ 4.13Å; I806-F1116 HydrophobicContact CG1-CE1 4.21Å; I806-F1116 HydrophobicContact CG1-CZ 4.38Å; A1112-F1116 WeakPolarHBondContact O-CA 3.05Å; A1112-F1116 WeakPolarHBondContact O-CB 3.47Å; A1112-F1116 PolarHBondContact O-N 2.79Å; F1113-F1116 WeakPolarHBondContact O-CB 2.99Å; F1113-F1116 PolarHBondContact O-N 3.29Å; F1113-F1116 VanDerWaalsContact O-N 3.13Å; L1114-F1116 PolarHBondContact O-N 2.91Å; F1116-G1118 VanDerWaalsContact C-N 3.33Å; F1116-G1129 WeakPolarHBondContact CA-O 3.35Å; F1116-L1132 HydrophobicContact CD2-CB 3.62Å; F1116-L1132 HydrophobicContact CE2-CB 4.23Å; F1116-L1132 WeakPolarHBondContact CE2-O 3.13Å; F1116-N1133 HydrophobicContact CD2-CB 4.36Å; F1116-N1133 PolarHBondContact O-ND2 2.8Å; F1116-Y1136 HydrophobicContact CE2-CD1 4.39Å; F1116-Y1136 HydrophobicContact CE2-CG 4.19Å; F1116-Y1136 HydrophobicContact CZ-CD1 4.07Å; F1116-Y1136 HydrophobicContact CZ-CG 4.08Å
1117	I	79.1	Confident	84	Confident	23 Å²	23	21 Å²	21	12%	0.118	13%	0.129	C	C	.	.	H	α-helix	trans	-84.9	-5.4	175.4	63.2	176.2	0	0	0	113.7	V802 F1113 L1114 L1119	V802-I1117 HydrophobicContact CG1-CG2 3.99Å; F1113-I1117 HydrophobicContact CD2-CD1 4.44Å; F1113-I1117 HydrophobicContact CD2-CG2 4.01Å; F1113-I1117 HydrophobicContact CE2-CD1 3.79Å; F1113-I1117 HydrophobicContact CE2-CG1 4.33Å; F1113-I1117 HydrophobicContact CE2-CG2 3.71Å; F1113-I1117 HydrophobicContact CZ-CD1 4.22Å; F1113-I1117 WeakPolarHBondContact O-CG1 3.38Å; F1113-I1117 PolarHBondContact O-N 3.41Å; L1114-I1117 VanDerWaalsContact O-CG1 3.28Å; L1114-I1117 WeakPolarHBondContact O-CG1 3.37Å; L1114-I1117 PolarHBondContact O-N 2.94Å; I1117-L1119 HydrophobicContact CD1-CB 4.37Å; I1117-L1119 HydrophobicContact CD1-CD1 3.73Å; I1117-L1119 HydrophobicContact CD1-CG 4.17Å; I1117-L1119 HydrophobicContact CG1-CB 4.2Å; I1117-L1119 HydrophobicContact CG1-CD1 4.34Å; I1117-L1119 HydrophobicContact CG1-CG 4.22Å
1118	G	76.9	Confident	84.2	Confident	32 Å²	32	21 Å²	21	33%	0.33	13%	0.129	S	C	.	.	T	Hydrogen-bonded Turn	trans	83.6	13.1	178.9	0	0	0	0	0	115.1	L1114 F1116	L1114-G1118 PolarHBondContact O-N 2.77Å; F1116-G1118 VanDerWaalsContact C-N 3.33Å
1119	L	76.2	Confident	84.2	Confident	24 Å²	24	21 Å²	21	13%	0.126	13%	0.129	C	C	.	.	S	Bend	trans	-94.4	-21.3	173.5	-70.6	-179.9	0	0	0	113.2	I820 M821 I1028 L1031 L1114 I1117	I820-L1119 HydrophobicContact CG2-CD1 4.11Å; I820-L1119 HydrophobicContact CG2-CD2 3.94Å; M821-L1119 HydrophobicContact CG-CD2 4.46Å; M821-L1119 HydrophobicContact SD-CD2 3.46Å; M821-L1119 WeakPolarHBondContact SD-CD2 3.48Å; M821-L1119 HydrophobicContact SD-CG 4.34Å; I1028-L1119 HydrophobicContact CG1-CD1 4.2Å; L1031-L1119 HydrophobicContact CD1-CB 4.46Å; L1031-L1119 WeakPolarHBondContact CD1-O 3.38Å; L1031-L1119 WeakPolarHBondContact CD2-O 3.12Å; L1114-L1119 HydrophobicContact CD2-CB 4.09Å; L1114-L1119 PolarHBondContact O-N 3.49Å; I1117-L1119 HydrophobicContact CD1-CB 4.37Å; I1117-L1119 HydrophobicContact CD1-CD1 3.73Å; I1117-L1119 HydrophobicContact CD1-CG 4.17Å; I1117-L1119 HydrophobicContact CG1-CB 4.2Å; I1117-L1119 HydrophobicContact CG1-CD1 4.34Å; I1117-L1119 HydrophobicContact CG1-CG 4.22Å
1120	G	81.2	Confident	84.4	Confident	0 Å²	0	19 Å²	19	0%	0	12%	0.121	C	C	.	.	S	Bend	trans	-85	-125.8	-178.9	0	0	0	0	0	113.3	L1114	L1114-G1120 PolarHBondContact O-N 2.65Å
1121	L	86.1	Confident	84.8	Confident	13 Å²	13	17.8 Å²	17.8	7%	0.068	12%	0.116	C	C	.	.	S	Bend	trans	-69.7	131	172.2	-64.9	167.3	0	0	0	109.3	I977 I981 I1038 I1041 S1115 T1130	I977-L1121 HydrophobicContact CG2-CD1 3.49Å; I977-L1121 VanDerWaalsContact CG2-CD1 3.49Å; I981-L1121 HydrophobicContact CD1-CD1 4.21Å; I1038-L1121 HydrophobicContact CG1-CD2 4.05Å; I1041-L1121 HydrophobicContact CD1-CD2 4.47Å; I1041-L1121 HydrophobicContact CD1-CG 3.96Å; S1115-L1121 PolarHBondContact OG-N 3.4Å; L1121-T1130 HydrophobicContact CB-CG2 4.25Å; L1121-T1130 WeakPolarHBondContact O-CG2 3.26Å
1122	T	82.7	Confident	84.9	Confident	69 Å²	69	17.9 Å²	17.9	42%	0.423	12%	0.117	S	C	.	.	P	Polyproline II helix	trans	-102.8	152.9	178.8	57.3	0	0	0	0	111.6	A1125	T1122-A1125 VanDerWaalsContact O-CB 3.32Å; T1122-A1125 WeakPolarHBondContact O-CB 3.42Å; T1122-A1125 PolarHBondContact O-N 2.99Å
1123	P	77.6	Confident	85	Confident	70 Å²	70	19 Å²	19	46%	0.455	12%	0.123	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.1	144.5	167.9	-26.3	35.7	0	0	0	111.6
1124	P	79.8	Confident	85.2	Confident	75 Å²	75	20 Å²	20	49%	0.487	13%	0.129	S	C	.	.	T	Hydrogen-bonded Turn	cis	-80.4	-8.2	12.6	32.6	-37.3	0	0	0	115.6	R970	R970-P1124 PolarHBondContact NH1-O 2.79Å
1125	A	83.1	Confident	85.5	Confident	28 Å²	28	20 Å²	20	23%	0.231	13%	0.129	C	C	.	.	S	Bend	trans	-53.9	149.8	-178.4	0	0	0	0	0	111.7	T1122 T1130	T1122-A1125 VanDerWaalsContact O-CB 3.32Å; T1122-A1125 WeakPolarHBondContact O-CB 3.42Å; T1122-A1125 PolarHBondContact O-N 2.99Å; A1125-T1130 PolarHBondContact O-OG1 3.21Å
1126	A	88	Confident	85.5	Confident	0 Å²	0	23.6 Å²	23.6	0%	0	14%	0.142	C	C	.	.			trans	-112.4	118.4	176.3	0	0	0	0	0	109.1	R970 M973 G974	R970-A1126 HydrophobicContact CB-CB 4.26Å; R970-A1126 HydrophobicContact CG-CB 4.41Å; M973-A1126 HydrophobicContact CB-CB 4.2Å; M973-A1126 HydrophobicContact CG-CB 4.1Å; M973-A1126 HydrophobicContact SD-CB 4.15Å; G974-A1126 VanDerWaalsContact CA-O 3.28Å; G974-A1126 WeakPolarHBondContact CA-O 3.44Å
1127	S	91.6	Very high	85.4	Confident	0 Å²	0	29.6 Å²	29.6	0%	0	17%	0.168	C	C	.	.			trans	-125	167	161.6	92.6	0	0	0	0	109.2	E1111 S1115 G1129 T1130 L1131	E1111-S1127 WeakPolarHBondContact OE1-CB 3.38Å; E1111-S1127 PolarHBondContact OE1-OG 3.31Å; S1115-S1127 VanDerWaalsContact CB-OG 3.31Å; S1115-S1127 WeakPolarHBondContact CB-OG 3.41Å; S1115-S1127 PolarHBondContact OG-OG 3.18Å; S1127-G1129 PolarHBondContact O-N 3.17Å; S1127-G1129 PolarHBondContact OG-N 2.89Å; S1127-G1129 VanDerWaalsContact OG-N 3.13Å; S1127-T1130 PolarHBondContact N-OG1 2.85Å; S1127-T1130 PolarHBondContact O-N 3Å; S1127-T1130 PolarHBondContact O-OG1 2.94Å; S1127-T1130 PolarHBondContact OG-N 3.16Å; S1127-L1131 WeakPolarHBondContact O-CG 3.29Å; S1127-L1131 PolarHBondContact O-N 2.75Å; S1127-L1131 VanDerWaalsContact O-N 3.12Å
1128	L	91.9	Very high	85.7	Confident	1 Å²	1	29.2 Å²	29.2	1%	0.005	17%	0.167	C	C	.	.	H	α-helix	trans	-59.2	-35.3	173.6	-68.5	174.1	0	0	0	111.3	L971 S978 L1131 L1132 T1152 I1153 I1156	L971-L1128 HydrophobicContact CD1-CD2 3.99Å; S978-L1128 PolarHBondContact OG-N 2.84Å; L1128-L1131 PolarHBondContact O-N 3.21Å; L1128-L1132 WeakPolarHBondContact O-CD1 3.12Å; L1128-L1132 VanDerWaalsContact O-CG 3.26Å; L1128-L1132 WeakPolarHBondContact O-CG 3.29Å; L1128-L1132 PolarHBondContact O-N 2.79Å; L1128-T1152 HydrophobicContact CD2-CG2 4.05Å; L1128-I1153 HydrophobicContact CB-CD1 4.34Å; L1128-I1153 HydrophobicContact CD1-CB 4.09Å; L1128-I1153 HydrophobicContact CD1-CG1 4.12Å; L1128-I1156 HydrophobicContact CD1-CD1 4.05Å
1129	G	89.9	Confident	86	Confident	0 Å²	0	28.1 Å²	28.1	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-67	-43.5	174.7	0	0	0	0	0	114.4	A1112 F1116 S1127 L1131 L1132 N1133	A1112-G1129 WeakPolarHBondContact O-CA 3.38Å; F1116-G1129 WeakPolarHBondContact CA-O 3.35Å; S1127-G1129 PolarHBondContact O-N 3.17Å; S1127-G1129 PolarHBondContact OG-N 2.89Å; S1127-G1129 VanDerWaalsContact OG-N 3.13Å; G1129-L1131 VanDerWaalsContact C-N 3.25Å; G1129-L1131 PolarHBondContact O-N 3.46Å; G1129-L1132 PolarHBondContact O-N 3.08Å; G1129-N1133 PolarHBondContact O-N 2.75Å
1130	T	90.6	Very high	86	Confident	4 Å²	4	33.9 Å²	33.9	3%	0.025	18%	0.183	C	C	.	.	H	α-helix	trans	-63.1	-35.8	176.4	63.2	0	0	0	0	111.7	L1121 A1125 S1127 N1133 D1134	L1121-T1130 HydrophobicContact CB-CG2 4.25Å; L1121-T1130 WeakPolarHBondContact O-CG2 3.26Å; A1125-T1130 PolarHBondContact O-OG1 3.21Å; S1127-T1130 PolarHBondContact N-OG1 2.85Å; S1127-T1130 PolarHBondContact O-N 3Å; S1127-T1130 PolarHBondContact O-OG1 2.94Å; S1127-T1130 PolarHBondContact OG-N 3.16Å; T1130-N1133 PolarHBondContact O-N 2.72Å; T1130-D1134 WeakPolarHBondContact O-CB 3.23Å; T1130-D1134 PolarHBondContact O-N 2.83Å
1131	L	91.7	Very high	85.9	Confident	15 Å²	15	41.1 Å²	41.1	8%	0.079	21%	0.212	C	C	.	.	H	α-helix	trans	-71.5	-35.5	178.3	-67.1	171.4	0	0	0	111.8	R970 L971 S1127 L1128 G1129 N1133 G1135 P1149	R970-L1131 HydrophobicContact CB-CD1 4.46Å; R970-L1131 HydrophobicContact CB-CD2 3.97Å; L971-L1131 HydrophobicContact CD1-CD1 4.27Å; S1127-L1131 WeakPolarHBondContact O-CG 3.29Å; S1127-L1131 PolarHBondContact O-N 2.75Å; S1127-L1131 VanDerWaalsContact O-N 3.12Å; L1128-L1131 PolarHBondContact O-N 3.21Å; G1129-L1131 VanDerWaalsContact C-N 3.25Å; G1129-L1131 PolarHBondContact O-N 3.46Å; L1131-N1133 VanDerWaalsContact C-N 3.32Å; L1131-G1135 WeakPolarHBondContact O-CA 3.49Å; L1131-G1135 PolarHBondContact O-N 3.32Å; L1131-P1149 HydrophobicContact CB-CB 3.77Å; L1131-P1149 HydrophobicContact CB-CG 3.89Å
1132	L	90.7	Very high	85.8	Confident	1 Å²	1	41.2 Å²	41.2	1%	0.005	21%	0.212	C	C	.	.	H	α-helix	trans	-65.1	-34.9	169.4	-70.6	163.3	0	0	0	111.9	F699 V700 F1116 L1128 G1129 Y1136 L1146 P1149 A1150 I1153	F699-L1132 HydrophobicContact CE2-CB 4.39Å; F699-L1132 HydrophobicContact CE2-CD1 3.75Å; F699-L1132 HydrophobicContact CZ-CD1 4.02Å; V700-L1132 HydrophobicContact CG2-CD1 4.12Å; V700-L1132 HydrophobicContact CG2-CD2 3.98Å; F1116-L1132 HydrophobicContact CD2-CB 3.62Å; F1116-L1132 HydrophobicContact CE2-CB 4.23Å; F1116-L1132 WeakPolarHBondContact CE2-O 3.13Å; L1128-L1132 WeakPolarHBondContact O-CD1 3.12Å; L1128-L1132 VanDerWaalsContact O-CG 3.26Å; L1128-L1132 WeakPolarHBondContact O-CG 3.29Å; L1128-L1132 PolarHBondContact O-N 2.79Å; G1129-L1132 PolarHBondContact O-N 3.08Å; L1132-Y1136 WeakPolarHBondContact O-CB 3.27Å; L1132-Y1136 PolarHBondContact O-N 3.07Å; L1132-L1146 HydrophobicContact CD2-CD1 3.84Å; L1132-P1149 HydrophobicContact CD2-CB 4.24Å; L1132-P1149 HydrophobicContact CD2-CG 4.09Å; L1132-P1149 HydrophobicContact CG-CB 4.14Å; L1132-P1149 HydrophobicContact CG-CG 4.29Å; L1132-A1150 HydrophobicContact CD2-CB 3.88Å; L1132-I1153 HydrophobicContact CD1-CD1 4.38Å; L1132-I1153 HydrophobicContact CD1-CG2 4.15Å
1133	N	89.4	Confident	85.8	Confident	24 Å²	24	40 Å²	40	13%	0.128	21%	0.206	C	C	.	.	H	α-helix	trans	-70.5	-50.8	176.1	-175.3	-99.1	0	0	0	112.6	F1116 G1129 T1130 L1131 G1135 Y1136 K1137	F1116-N1133 HydrophobicContact CD2-CB 4.36Å; F1116-N1133 PolarHBondContact O-ND2 2.8Å; G1129-N1133 PolarHBondContact O-N 2.75Å; T1130-N1133 PolarHBondContact O-N 2.72Å; L1131-N1133 VanDerWaalsContact C-N 3.32Å; N1133-G1135 VanDerWaalsContact C-N 3.29Å; N1133-G1135 PolarHBondContact O-N 2.88Å; N1133-Y1136 PolarHBondContact O-N 3.26Å; N1133-K1137 WeakPolarHBondContact O-CG 3.22Å; N1133-K1137 PolarHBondContact O-N 3.49Å; N1133-K1137 VanDerWaalsContact O-N 3.09Å; N1133-K1137 WeakPolarHBondContact OD1-CE 3.44Å; N1133-K1137 PolarHBondContact OD1-NZ 2.78Å
1134	D	87.7	Confident	86.1	Confident	30 Å²	30	38.3 Å²	38.3	16%	0.16	19%	0.19	C	C	.	.	H	α-helix	trans	-53.9	-50.9	173.2	-77.9	-13.6	0	0	0	108.7	R965 R970 T1130 Y1136 K1137 T1138	R965-D1134 IonicContact CZ-OD2 2.73Å; R965-D1134 IonicContact NH2-OD2 3.84Å; R965-D1134 PolarHBondContact NH2-OD2 3.3Å; R970-D1134 IonicContact NH2-OD2 3.72Å; R970-D1134 PolarHBondContact NH2-OD2 3.44Å; T1130-D1134 WeakPolarHBondContact O-CB 3.23Å; T1130-D1134 PolarHBondContact O-N 2.83Å; D1134-Y1136 PolarHBondContact O-N 3.01Å; D1134-K1137 PolarHBondContact O-N 3.04Å; D1134-T1138 WeakPolarHBondContact O-CG2 2.95Å; D1134-T1138 PolarHBondContact O-N 3.14Å; D1134-T1138 VanDerWaalsContact O-N 3.1Å; D1134-T1138 PolarHBondContact O-OG1 2.75Å; D1134-T1138 VanDerWaalsContact O-OG1 3.09Å
1135	G	87.7	Confident	86.6	Confident	0 Å²	0	35.3 Å²	35.3	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-60.5	-41.6	179.2	0	0	0	0	0	114.9	L1131 N1133 T1138 F1139	L1131-G1135 WeakPolarHBondContact O-CA 3.49Å; L1131-G1135 PolarHBondContact O-N 3.32Å; N1133-G1135 VanDerWaalsContact C-N 3.29Å; N1133-G1135 PolarHBondContact O-N 2.88Å; G1135-T1138 PolarHBondContact O-N 2.92Å; G1135-T1138 PolarHBondContact O-OG1 2.76Å; G1135-F1139 VanDerWaalsContact O-CA 3.22Å; G1135-F1139 WeakPolarHBondContact O-CA 3.35Å; G1135-F1139 VanDerWaalsContact O-CB 3.26Å; G1135-F1139 WeakPolarHBondContact O-CB 3.42Å; G1135-F1139 PolarHBondContact O-N 3.26Å
1136	Y	86.9	Confident	86.8	Confident	78 Å²	78	34.1 Å²	34.1	31%	0.306	16%	0.16	S	C	.	.	H	α-helix	trans	-64.7	-45	176.7	171.3	-115.4	0	0	0	111.6	V703 F1116 L1132 N1133 D1134 T1138 F1139	V703-Y1136 HydrophobicContact CB-CD2 4.43Å; V703-Y1136 HydrophobicContact CG1-CD2 3.88Å; V703-Y1136 HydrophobicContact CG1-CE2 4.29Å; V703-Y1136 HydrophobicContact CG2-CD2 3.58Å; V703-Y1136 HydrophobicContact CG2-CE2 3.69Å; F1116-Y1136 HydrophobicContact CE2-CD1 4.39Å; F1116-Y1136 HydrophobicContact CE2-CG 4.19Å; F1116-Y1136 HydrophobicContact CZ-CD1 4.07Å; F1116-Y1136 HydrophobicContact CZ-CG 4.08Å; L1132-Y1136 WeakPolarHBondContact O-CB 3.27Å; L1132-Y1136 PolarHBondContact O-N 3.07Å; N1133-Y1136 PolarHBondContact O-N 3.26Å; D1134-Y1136 PolarHBondContact O-N 3.01Å; Y1136-T1138 VanDerWaalsContact C-N 3.28Å; Y1136-T1138 PolarHBondContact O-N 3.47Å; Y1136-F1139 VanDerWaalsContact O-CB 3.3Å; Y1136-F1139 WeakPolarHBondContact O-CB 3.31Å; Y1136-F1139 PolarHBondContact O-N 2.79Å
1137	K	84.9	Confident	86.8	Confident	135 Å²	135	38.6 Å²	38.6	59%	0.587	18%	0.177	S	C	*	.	H	α-helix	trans	-60.3	-36.9	175.9	-72.3	165.3	171.9	167.6	0	112.4	N1133 D1134	N1133-K1137 WeakPolarHBondContact O-CG 3.22Å; N1133-K1137 PolarHBondContact O-N 3.49Å; N1133-K1137 VanDerWaalsContact O-N 3.09Å; N1133-K1137 WeakPolarHBondContact OD1-CE 3.44Å; N1133-K1137 PolarHBondContact OD1-NZ 2.78Å; D1134-K1137 PolarHBondContact O-N 3.04Å
1138	T	85.7	Confident	86.7	Confident	15 Å²	15	39.9 Å²	39.9	9%	0.092	18%	0.184	C	C	.	.	H	α-helix	trans	-92	-2.8	-179.4	59.8	0	0	0	0	114.5	D1134 G1135 Y1136 L1140 Y1141 L1142 L1145	D1134-T1138 WeakPolarHBondContact O-CG2 2.95Å; D1134-T1138 PolarHBondContact O-N 3.14Å; D1134-T1138 VanDerWaalsContact O-N 3.1Å; D1134-T1138 PolarHBondContact O-OG1 2.75Å; D1134-T1138 VanDerWaalsContact O-OG1 3.09Å; G1135-T1138 PolarHBondContact O-N 2.92Å; G1135-T1138 PolarHBondContact O-OG1 2.76Å; Y1136-T1138 VanDerWaalsContact C-N 3.28Å; Y1136-T1138 PolarHBondContact O-N 3.47Å; T1138-L1140 VanDerWaalsContact C-N 3.27Å; T1138-L1140 PolarHBondContact O-N 3.28Å; T1138-Y1141 HydrophobicContact CG2-CE2 4.22Å; T1138-Y1141 WeakPolarHBondContact O-CD1 3.06Å; T1138-Y1141 PolarHBondContact O-N 3Å; T1138-L1142 HydrophobicContact CG2-CD1 4.25Å; T1138-L1142 PolarHBondContact O-N 3.45Å; T1138-L1145 HydrophobicContact CG2-CD1 4.17Å; T1138-L1145 WeakPolarHBondContact OG1-CD1 3.22Å
1139	F	81.6	Confident	86.7	Confident	9 Å²	9	40 Å²	40	4%	0.039	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.5	-33.7	-157.2	-176.1	-132.5	0	0	0	114.9	V703 Y707 M711 G1135 Y1136 Y1141 P1143 L1146 W1147	V703-F1139 HydrophobicContact CG1-CD1 3.89Å; V703-F1139 HydrophobicContact CG1-CE1 3.77Å; V703-F1139 HydrophobicContact CG1-CZ 4.41Å; Y707-F1139 HydrophobicContact CD1-CZ 4.47Å; Y707-F1139 HydrophobicContact CD2-CD1 4.42Å; Y707-F1139 AromaticContact CD2-CE1 3.44Å; Y707-F1139 HydrophobicContact CD2-CE1 3.44Å; Y707-F1139 VanDerWaalsContact CD2-CE1 3.44Å; Y707-F1139 HydrophobicContact CD2-CE2 4.44Å; Y707-F1139 AromaticContact CD2-CZ 3.43Å; Y707-F1139 HydrophobicContact CD2-CZ 3.43Å; Y707-F1139 VanDerWaalsContact CD2-CZ 3.43Å; Y707-F1139 HydrophobicContact CE2-CE1 4.36Å; Y707-F1139 HydrophobicContact CE2-CZ 4.13Å; Y707-F1139 AromaticContact CG-CE1 3.84Å; Y707-F1139 HydrophobicContact CG-CE1 3.84Å; Y707-F1139 AromaticContact CG-CZ 3.65Å; Y707-F1139 HydrophobicContact CG-CZ 3.65Å; M711-F1139 HydrophobicContact CE-CD1 4.27Å; M711-F1139 HydrophobicContact CE-CE1 4.15Å; G1135-F1139 VanDerWaalsContact O-CA 3.22Å; G1135-F1139 WeakPolarHBondContact O-CA 3.35Å; G1135-F1139 VanDerWaalsContact O-CB 3.26Å; G1135-F1139 WeakPolarHBondContact O-CB 3.42Å; G1135-F1139 PolarHBondContact O-N 3.26Å; Y1136-F1139 VanDerWaalsContact O-CB 3.3Å; Y1136-F1139 WeakPolarHBondContact O-CB 3.31Å; Y1136-F1139 PolarHBondContact O-N 2.79Å; F1139-Y1141 VanDerWaalsContact C-N 3.26Å; F1139-Y1141 PolarHBondContact O-N 3.21Å; F1139-P1143 HydrophobicContact CD2-CB 4.15Å; F1139-P1143 HydrophobicContact CE2-CB 4.1Å; F1139-P1143 WeakPolarHBondContact O-CA 3.46Å; F1139-L1146 HydrophobicContact CD1-CD2 4.28Å; F1139-L1146 HydrophobicContact CD2-CB 3.57Å; F1139-L1146 HydrophobicContact CD2-CD2 3.55Å; F1139-L1146 HydrophobicContact CD2-CG 4.2Å; F1139-L1146 HydrophobicContact CE1-CD2 4.18Å; F1139-L1146 HydrophobicContact CE2-CB 3.95Å; F1139-L1146 HydrophobicContact CE2-CD2 3.47Å; F1139-L1146 VanDerWaalsContact CE2-CD2 3.47Å; F1139-L1146 HydrophobicContact CE2-CG 4.33Å; F1139-L1146 HydrophobicContact CG-CB 4.42Å; F1139-L1146 HydrophobicContact CG-CD2 3.98Å; F1139-L1146 HydrophobicContact CZ-CD2 3.81Å; F1139-W1147 AromaticContact CE2-NE1 3.92Å
1140	L	76.3	Confident	86.7	Confident	144 Å²	144	40.1 Å²	40.1	75%	0.754	19%	0.185	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.4	-27.2	179	-69.9	171.9	0	0	0	114	M711 T1138	M711-L1140 HydrophobicContact CE-CD2 4.07Å; M711-L1140 HydrophobicContact SD-CD2 3.58Å; M711-L1140 VanDerWaalsContact SD-CD2 3.58Å; T1138-L1140 VanDerWaalsContact C-N 3.27Å; T1138-L1140 PolarHBondContact O-N 3.28Å
1141	Y	80.2	Confident	86.6	Confident	153 Å²	153	44.1 Å²	44.1	60%	0.6	21%	0.209	S	C	*	.	T	Hydrogen-bonded Turn	trans	-124.1	-22.2	-174	53.1	-79.9	0	0	0	113.7	T1138 F1139	T1138-Y1141 HydrophobicContact CG2-CE2 4.22Å; T1138-Y1141 WeakPolarHBondContact O-CD1 3.06Å; T1138-Y1141 PolarHBondContact O-N 3Å; F1139-Y1141 VanDerWaalsContact C-N 3.26Å; F1139-Y1141 PolarHBondContact O-N 3.21Å
1142	L	84.2	Confident	86.6	Confident	14 Å²	14	44.8 Å²	44.8	7%	0.073	21%	0.214	C	C	.	.			trans	-130.1	65.8	175.2	-52.9	169.7	0	0	0	110.1	N918 T1138 Y1144 L1145	N918-L1142 HydrophobicContact CB-CD1 4.06Å; N918-L1142 HydrophobicContact CB-CD2 4.01Å; N918-L1142 WeakPolarHBondContact OD1-CD1 3.5Å; T1138-L1142 HydrophobicContact CG2-CD1 4.25Å; T1138-L1142 PolarHBondContact O-N 3.45Å; L1142-Y1144 HydrophobicContact CB-CD1 4.36Å; L1142-Y1144 HydrophobicContact CB-CE1 3.83Å; L1142-Y1144 HydrophobicContact CD2-CE1 3.75Å; L1142-Y1144 HydrophobicContact CG-CE1 4.35Å; L1142-Y1144 PolarHBondContact O-N 3.09Å; L1142-Y1144 VanDerWaalsContact O-N 3.13Å; L1142-L1145 HydrophobicContact CB-CD1 3.72Å; L1142-L1145 HydrophobicContact CB-CG 4Å; L1142-L1145 HydrophobicContact CD1-CD1 3.67Å; L1142-L1145 HydrophobicContact CG-CD1 4.33Å; L1142-L1145 WeakPolarHBondContact O-CB 3.34Å; L1142-L1145 PolarHBondContact O-N 2.87Å; L1142-L1145 VanDerWaalsContact O-N 3.09Å
1143	P	82.2	Confident	86.6	Confident	45 Å²	45	44.7 Å²	44.7	29%	0.292	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-27.9	-172.8	23.5	-34.4	0	0	0	113.2	F1139 L1145 L1146 W1147	F1139-P1143 HydrophobicContact CD2-CB 4.15Å; F1139-P1143 HydrophobicContact CE2-CB 4.1Å; F1139-P1143 WeakPolarHBondContact O-CA 3.46Å; P1143-L1145 PolarHBondContact O-N 3.41Å; P1143-L1146 PolarHBondContact O-N 3.12Å; P1143-L1146 VanDerWaalsContact O-N 3.1Å; P1143-W1147 PolarHBondContact O-N 2.87Å
1144	Y	84.6	Confident	86.7	Confident	34 Å²	34	44.1 Å²	44.1	13%	0.133	21%	0.212	C	C	.	.	H	α-helix	trans	-58.6	-32.7	177.3	63.6	-88.8	0	0	0	112.8	L919 P921 T960 V967 L1142 L1146 W1147 I1148	L919-Y1144 PolarHBondContact O-OH 2.92Å; L919-Y1144 VanDerWaalsContact O-OH 3.05Å; P921-Y1144 HydrophobicContact CG-CD2 4.46Å; P921-Y1144 HydrophobicContact CG-CG 4.47Å; T960-Y1144 PolarHBondContact O-OH 3.36Å; V967-Y1144 HydrophobicContact CG2-CE2 4.44Å; L1142-Y1144 HydrophobicContact CB-CD1 4.36Å; L1142-Y1144 HydrophobicContact CB-CE1 3.83Å; L1142-Y1144 HydrophobicContact CD2-CE1 3.75Å; L1142-Y1144 HydrophobicContact CG-CE1 4.35Å; L1142-Y1144 PolarHBondContact O-N 3.09Å; L1142-Y1144 VanDerWaalsContact O-N 3.13Å; Y1144-L1146 PolarHBondContact O-N 3.46Å; Y1144-W1147 PolarHBondContact O-N 3.42Å; Y1144-I1148 HydrophobicContact CD2-CD1 4.25Å; Y1144-I1148 WeakPolarHBondContact O-CB 3.49Å; Y1144-I1148 WeakPolarHBondContact O-CD1 3.4Å; Y1144-I1148 VanDerWaalsContact O-CG1 3.24Å; Y1144-I1148 WeakPolarHBondContact O-CG1 3.38Å; Y1144-I1148 PolarHBondContact O-N 2.87Å
1145	L	89	Confident	86.8	Confident	12 Å²	12	46.1 Å²	46.1	6%	0.063	22%	0.222	C	C	.	.	H	α-helix	trans	-64.9	-24.6	178.1	-64.2	-179.8	0	0	0	113	D961 V967 T1138 L1142 P1143 P1149	D961-L1145 HydrophobicContact CB-CD1 4.08Å; D961-L1145 HydrophobicContact CB-CD2 4.08Å; V967-L1145 HydrophobicContact CG1-CD2 4.4Å; V967-L1145 HydrophobicContact CG2-CD2 3.34Å; T1138-L1145 HydrophobicContact CG2-CD1 4.17Å; T1138-L1145 WeakPolarHBondContact OG1-CD1 3.22Å; L1142-L1145 HydrophobicContact CB-CD1 3.72Å; L1142-L1145 HydrophobicContact CB-CG 4Å; L1142-L1145 HydrophobicContact CD1-CD1 3.67Å; L1142-L1145 HydrophobicContact CG-CD1 4.33Å; L1142-L1145 WeakPolarHBondContact O-CB 3.34Å; L1142-L1145 PolarHBondContact O-N 2.87Å; L1142-L1145 VanDerWaalsContact O-N 3.09Å; P1143-L1145 PolarHBondContact O-N 3.41Å; L1145-P1149 WeakPolarHBondContact O-CD 3.21Å; L1145-P1149 WeakPolarHBondContact O-CG 3.45Å
1146	L	88.9	Confident	87	Confident	3 Å²	3	46.3 Å²	46.3	2%	0.016	22%	0.223	C	C	.	.	H	α-helix	trans	-89.6	-49	169.6	-171.9	76.2	0	0	0	111.8	V703 L1132 F1139 P1143 Y1144 I1148 P1149 A1150	V703-L1146 HydrophobicContact CB-CD2 4.23Å; V703-L1146 HydrophobicContact CG1-CD2 3.45Å; V703-L1146 VanDerWaalsContact CG1-CD2 3.45Å; L1132-L1146 HydrophobicContact CD2-CD1 3.84Å; F1139-L1146 HydrophobicContact CD1-CD2 4.28Å; F1139-L1146 HydrophobicContact CD2-CB 3.57Å; F1139-L1146 HydrophobicContact CD2-CD2 3.55Å; F1139-L1146 HydrophobicContact CD2-CG 4.2Å; F1139-L1146 HydrophobicContact CE1-CD2 4.18Å; F1139-L1146 HydrophobicContact CE2-CB 3.95Å; F1139-L1146 HydrophobicContact CE2-CD2 3.47Å; F1139-L1146 VanDerWaalsContact CE2-CD2 3.47Å; F1139-L1146 HydrophobicContact CE2-CG 4.33Å; F1139-L1146 HydrophobicContact CG-CB 4.42Å; F1139-L1146 HydrophobicContact CG-CD2 3.98Å; F1139-L1146 HydrophobicContact CZ-CD2 3.81Å; P1143-L1146 PolarHBondContact O-N 3.12Å; P1143-L1146 VanDerWaalsContact O-N 3.1Å; Y1144-L1146 PolarHBondContact O-N 3.46Å; L1146-I1148 VanDerWaalsContact C-N 3.3Å; L1146-I1148 PolarHBondContact O-N 3.32Å; L1146-P1149 VanDerWaalsContact O-CD 3.27Å; L1146-P1149 WeakPolarHBondContact O-CD 3.42Å; L1146-P1149 WeakPolarHBondContact O-CG 3.4Å; L1146-A1150 WeakPolarHBondContact O-CB 3.16Å; L1146-A1150 PolarHBondContact O-N 3.01Å
1147	W	87.5	Confident	87.2	Confident	93 Å²	93	43 Å²	43	35%	0.352	21%	0.211	S	C	.	.	H	α-helix	trans	-58.6	-39.8	-173.2	-77.2	111.1	0	0	0	112.8	L704 Y707 F1139 P1143 Y1144 A1150 V1151	L704-W1147 HydrophobicContact CD1-CH2 4.35Å; L704-W1147 HydrophobicContact CD1-CZ3 4.04Å; L704-W1147 HydrophobicContact CD2-CD2 4.43Å; L704-W1147 HydrophobicContact CD2-CE3 4.1Å; L704-W1147 HydrophobicContact CD2-CH2 3.42Å; L704-W1147 VanDerWaalsContact CD2-CH2 3.42Å; L704-W1147 HydrophobicContact CD2-CZ2 3.76Å; L704-W1147 HydrophobicContact CD2-CZ3 3.59Å; L704-W1147 HydrophobicContact CG-CH2 4.46Å; L704-W1147 HydrophobicContact CG-CZ3 4.48Å; Y707-W1147 HydrophobicContact CD1-CZ2 4.26Å; Y707-W1147 HydrophobicContact CE1-CZ2 4.37Å; F1139-W1147 AromaticContact CE2-NE1 3.92Å; P1143-W1147 PolarHBondContact O-N 2.87Å; Y1144-W1147 PolarHBondContact O-N 3.42Å; W1147-A1150 PolarHBondContact O-N 2.78Å; W1147-V1151 WeakPolarHBondContact O-CB 3.42Å; W1147-V1151 VanDerWaalsContact O-CG2 3.27Å; W1147-V1151 WeakPolarHBondContact O-CG2 3.47Å; W1147-V1151 PolarHBondContact O-N 2.81Å
1148	I	89.4	Confident	87.4	Confident	28 Å²	28	38.2 Å²	38.2	14%	0.144	19%	0.191	C	C	.	.	H	α-helix	trans	-63.3	-57	-177.5	-70.1	168	0	0	0	112.4	L958 V967 L971 Y1144 L1146 A1150 T1152	L958-I1148 HydrophobicContact CB-CD1 4.02Å; L958-I1148 HydrophobicContact CD1-CD1 4.47Å; L958-I1148 HydrophobicContact CD1-CG2 3.9Å; L958-I1148 HydrophobicContact CD2-CD1 4.07Å; L958-I1148 HydrophobicContact CG-CD1 4.4Å; V967-I1148 HydrophobicContact CG1-CD1 4.21Å; V967-I1148 HydrophobicContact CG1-CG2 4.3Å; L971-I1148 HydrophobicContact CD1-CG2 4.12Å; L971-I1148 HydrophobicContact CD2-CG2 3.66Å; L971-I1148 HydrophobicContact CG-CG2 4.42Å; Y1144-I1148 HydrophobicContact CD2-CD1 4.25Å; Y1144-I1148 WeakPolarHBondContact O-CB 3.49Å; Y1144-I1148 WeakPolarHBondContact O-CD1 3.4Å; Y1144-I1148 VanDerWaalsContact O-CG1 3.24Å; Y1144-I1148 WeakPolarHBondContact O-CG1 3.38Å; Y1144-I1148 PolarHBondContact O-N 2.87Å; L1146-I1148 VanDerWaalsContact C-N 3.3Å; L1146-I1148 PolarHBondContact O-N 3.32Å; I1148-A1150 VanDerWaalsContact C-N 3.33Å; I1148-A1150 PolarHBondContact O-N 3.12Å; I1148-T1152 WeakPolarHBondContact O-CB 3.49Å; I1148-T1152 PolarHBondContact O-N 2.74Å; I1148-T1152 PolarHBondContact O-OG1 2.98Å
1149	P	91	Very high	87.7	Confident	2 Å²	2	37.6 Å²	37.6	1%	0.013	19%	0.187	C	C	.	.	H	α-helix	trans	-68.4	-30.2	175.5	27.9	-36.2	0	0	0	112.7	L971 L1131 L1132 L1145 L1146 T1152 I1153	L971-P1149 HydrophobicContact CD1-CB 4.27Å; L1131-P1149 HydrophobicContact CB-CB 3.77Å; L1131-P1149 HydrophobicContact CB-CG 3.89Å; L1132-P1149 HydrophobicContact CD2-CB 4.24Å; L1132-P1149 HydrophobicContact CD2-CG 4.09Å; L1132-P1149 HydrophobicContact CG-CB 4.14Å; L1132-P1149 HydrophobicContact CG-CG 4.29Å; L1145-P1149 WeakPolarHBondContact O-CD 3.21Å; L1145-P1149 WeakPolarHBondContact O-CG 3.45Å; L1146-P1149 VanDerWaalsContact O-CD 3.27Å; L1146-P1149 WeakPolarHBondContact O-CD 3.42Å; L1146-P1149 WeakPolarHBondContact O-CG 3.4Å; P1149-T1152 PolarHBondContact O-N 3.29Å; P1149-I1153 WeakPolarHBondContact O-CG2 3.38Å; P1149-I1153 PolarHBondContact O-N 3.48Å
1150	A	89.9	Confident	88.1	Confident	4 Å²	4	37.5 Å²	37.5	3%	0.033	19%	0.187	C	C	.	.	H	α-helix	trans	-64.1	-45.2	175.9	0	0	0	0	0	112.9	V700 L1132 L1146 W1147 I1148 T1152 I1153 S1154	V700-A1150 HydrophobicContact CG1-CB 3.69Å; L1132-A1150 HydrophobicContact CD2-CB 3.88Å; L1146-A1150 WeakPolarHBondContact O-CB 3.16Å; L1146-A1150 PolarHBondContact O-N 3.01Å; W1147-A1150 PolarHBondContact O-N 2.78Å; I1148-A1150 VanDerWaalsContact C-N 3.33Å; I1148-A1150 PolarHBondContact O-N 3.12Å; A1150-T1152 VanDerWaalsContact C-N 3.34Å; A1150-I1153 WeakPolarHBondContact O-CG2 3.34Å; A1150-S1154 VanDerWaalsContact O-CB 3.25Å; A1150-S1154 WeakPolarHBondContact O-CB 3.38Å; A1150-S1154 PolarHBondContact O-N 3.31Å; A1150-S1154 VanDerWaalsContact O-N 3.16Å; A1150-S1154 PolarHBondContact O-OG 2.96Å
1151	V	90.2	Very high	88.4	Confident	87 Å²	87	31 Å²	31	53%	0.527	15%	0.152	S	C	.	.	H	α-helix	trans	-66.2	-39.5	173.5	170.8	0	0	0	0	110.3	W1147 L1155	W1147-V1151 WeakPolarHBondContact O-CB 3.42Å; W1147-V1151 VanDerWaalsContact O-CG2 3.27Å; W1147-V1151 WeakPolarHBondContact O-CG2 3.47Å; W1147-V1151 PolarHBondContact O-N 2.81Å; V1151-L1155 WeakPolarHBondContact O-CB 3.39Å; V1151-L1155 PolarHBondContact O-N 3.1Å
1152	T	90.7	Very high	88.7	Confident	29 Å²	29	25.4 Å²	25.4	18%	0.178	13%	0.133	C	C	.	.	H	α-helix	trans	-66.2	-50	-177.9	-57.5	0	0	0	0	112.1	L971 L1128 I1148 P1149 A1150 S1154 L1155 I1156	L971-T1152 HydrophobicContact CD1-CG2 4.06Å; L971-T1152 HydrophobicContact CG-CG2 4.43Å; L1128-T1152 HydrophobicContact CD2-CG2 4.05Å; I1148-T1152 WeakPolarHBondContact O-CB 3.49Å; I1148-T1152 PolarHBondContact O-N 2.74Å; I1148-T1152 PolarHBondContact O-OG1 2.98Å; P1149-T1152 PolarHBondContact O-N 3.29Å; A1150-T1152 VanDerWaalsContact C-N 3.34Å; T1152-S1154 PolarHBondContact O-N 2.59Å; T1152-L1155 PolarHBondContact O-N 2.8Å; T1152-I1156 HydrophobicContact CG2-CD1 3.95Å; T1152-I1156 WeakPolarHBondContact O-CD1 3.22Å; T1152-I1156 VanDerWaalsContact O-CG1 3.26Å; T1152-I1156 WeakPolarHBondContact O-CG1 3.49Å; T1152-I1156 PolarHBondContact O-N 3.01Å; T1152-I1156 VanDerWaalsContact O-N 3.07Å
1153	I	91.7	Very high	88.8	Confident	0 Å²	0	25.6 Å²	25.6	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-63.8	-42.2	177.5	-163.7	171.9	0	0	0	111.4	P697 I1108 A1112 L1128 L1132 P1149 A1150 L1155 I1156 M1157	P697-I1153 HydrophobicContact CG-CD1 4.26Å; P697-I1153 HydrophobicContact CG-CG2 4.09Å; I1108-I1153 HydrophobicContact CG2-CD1 4.09Å; I1108-I1153 HydrophobicContact CG2-CG1 3.96Å; A1112-I1153 HydrophobicContact CB-CD1 3.29Å; L1128-I1153 HydrophobicContact CB-CD1 4.34Å; L1128-I1153 HydrophobicContact CD1-CB 4.09Å; L1128-I1153 HydrophobicContact CD1-CG1 4.12Å; L1132-I1153 HydrophobicContact CD1-CD1 4.38Å; L1132-I1153 HydrophobicContact CD1-CG2 4.15Å; P1149-I1153 WeakPolarHBondContact O-CG2 3.38Å; P1149-I1153 PolarHBondContact O-N 3.48Å; A1150-I1153 WeakPolarHBondContact O-CG2 3.34Å; I1153-L1155 PolarHBondContact O-N 3.34Å; I1153-I1156 PolarHBondContact O-N 3.07Å; I1153-M1157 HydrophobicContact CD1-SD 4.45Å; I1153-M1157 HydrophobicContact CG1-SD 4.01Å; I1153-M1157 WeakPolarHBondContact O-CB 3.42Å; I1153-M1157 WeakPolarHBondContact O-CG 3.25Å; I1153-M1157 PolarHBondContact O-N 3.23Å
1154	S	89.9	Confident	88.9	Confident	12 Å²	12	23.4 Å²	23.4	8%	0.084	12%	0.12	C	C	.	.	H	α-helix	trans	-65.1	-41.4	179.4	-54.7	0	0	0	0	111.1	A1150 T1152 M1157 I1158	A1150-S1154 VanDerWaalsContact O-CB 3.25Å; A1150-S1154 WeakPolarHBondContact O-CB 3.38Å; A1150-S1154 PolarHBondContact O-N 3.31Å; A1150-S1154 VanDerWaalsContact O-N 3.16Å; A1150-S1154 PolarHBondContact O-OG 2.96Å; T1152-S1154 PolarHBondContact O-N 2.59Å; S1154-M1157 PolarHBondContact O-N 3.39Å; S1154-I1158 VanDerWaalsContact O-CB 3.29Å; S1154-I1158 WeakPolarHBondContact O-CB 3.5Å; S1154-I1158 WeakPolarHBondContact O-CD1 3.48Å; S1154-I1158 WeakPolarHBondContact O-CG1 3.25Å; S1154-I1158 PolarHBondContact O-N 3.39Å
1155	L	91.1	Very high	88.5	Confident	72 Å²	72	22.8 Å²	22.8	38%	0.377	12%	0.119	S	C	.	.	H	α-helix	trans	-61.9	-44.2	176.1	179	62.5	0	0	0	111.6	V1151 T1152 I1153 I1158 C1159	V1151-L1155 WeakPolarHBondContact O-CB 3.39Å; V1151-L1155 PolarHBondContact O-N 3.1Å; T1152-L1155 PolarHBondContact O-N 2.8Å; I1153-L1155 PolarHBondContact O-N 3.34Å; L1155-I1158 PolarHBondContact O-N 3.08Å; L1155-C1159 WeakPolarHBondContact O-CB 3.39Å; L1155-C1159 PolarHBondContact O-N 3.03Å; L1155-C1159 PolarHBondContact O-SG 3.43Å
1156	I	92	Very high	88	Confident	3 Å²	3	22.2 Å²	22.2	2%	0.015	12%	0.116	C	C	.	.	H	α-helix	trans	-62.2	-46.9	177.5	-67.3	162.7	0	0	0	110.6	I894 T975 L979 I1108 L1128 T1152 I1153 C1159 F1160	I894-I1156 HydrophobicContact CD1-CG1 4.14Å; I894-I1156 HydrophobicContact CG2-CD1 4.29Å; I894-I1156 HydrophobicContact CG2-CG1 4.19Å; T975-I1156 HydrophobicContact CG2-CD1 3.68Å; L979-I1156 HydrophobicContact CD2-CG2 4.31Å; I1108-I1156 HydrophobicContact CD1-CG2 3.7Å; L1128-I1156 HydrophobicContact CD1-CD1 4.05Å; T1152-I1156 HydrophobicContact CG2-CD1 3.95Å; T1152-I1156 WeakPolarHBondContact O-CD1 3.22Å; T1152-I1156 VanDerWaalsContact O-CG1 3.26Å; T1152-I1156 WeakPolarHBondContact O-CG1 3.49Å; T1152-I1156 PolarHBondContact O-N 3.01Å; T1152-I1156 VanDerWaalsContact O-N 3.07Å; I1153-I1156 PolarHBondContact O-N 3.07Å; I1156-C1159 PolarHBondContact O-N 2.86Å; I1156-F1160 HydrophobicContact CG2-CD2 3.75Å; I1156-F1160 HydrophobicContact CG2-CE2 3.75Å; I1156-F1160 WeakPolarHBondContact O-CD2 3.39Å; I1156-F1160 PolarHBondContact O-N 3.36Å
1157	M	89.6	Confident	87.5	Confident	10 Å²	10	23.3 Å²	23.3	5%	0.049	12%	0.121	C	C	.	.	H	α-helix	trans	-66	-39	177.8	-70.8	176.4	65.9	0	0	112.4	S695 P697 P1105 F1109 I1153 S1154 F1160 N1161	S695-M1157 VanDerWaalsContact O-CB 3.27Å; S695-M1157 WeakPolarHBondContact O-CB 3.08Å; P697-M1157 HydrophobicContact CG-CE 4.49Å; P697-M1157 HydrophobicContact CG-SD 3.88Å; P1105-M1157 HydrophobicContact CB-CG 4.21Å; F1109-M1157 HydrophobicContact CB-CE 4.16Å; F1109-M1157 HydrophobicContact CD2-CE 4.47Å; I1153-M1157 HydrophobicContact CD1-SD 4.45Å; I1153-M1157 HydrophobicContact CG1-SD 4.01Å; I1153-M1157 WeakPolarHBondContact O-CB 3.42Å; I1153-M1157 WeakPolarHBondContact O-CG 3.25Å; I1153-M1157 PolarHBondContact O-N 3.23Å; S1154-M1157 PolarHBondContact O-N 3.39Å; M1157-F1160 PolarHBondContact O-N 3.07Å; M1157-N1161 WeakPolarHBondContact O-CB 3.4Å; M1157-N1161 PolarHBondContact O-N 3.4Å; M1157-N1161 PolarHBondContact O-ND2 3Å
1158	I	89.6	Confident	86.9	Confident	34 Å²	34	22.9 Å²	22.9	17%	0.174	12%	0.12	C	C	.	.	H	α-helix	trans	-59.5	-47.9	173.1	-74.3	164.7	0	0	0	109.8	I691 L692 S695 S1154 L1155 N1161 L1162	I691-I1158 HydrophobicContact CG2-CG1 4.44Å; I691-I1158 HydrophobicContact CG2-CG2 4.29Å; L692-I1158 HydrophobicContact CD2-CD1 3.87Å; S695-I1158 VanDerWaalsContact CB-CG1 3.41Å; S1154-I1158 VanDerWaalsContact O-CB 3.29Å; S1154-I1158 WeakPolarHBondContact O-CB 3.5Å; S1154-I1158 WeakPolarHBondContact O-CD1 3.48Å; S1154-I1158 WeakPolarHBondContact O-CG1 3.25Å; S1154-I1158 PolarHBondContact O-N 3.39Å; L1155-I1158 PolarHBondContact O-N 3.08Å; I1158-N1161 PolarHBondContact O-N 3.36Å; I1158-L1162 HydrophobicContact CG2-CD1 3.69Å; I1158-L1162 HydrophobicContact CG2-CG 4.35Å; I1158-L1162 VanDerWaalsContact O-CB 3.28Å; I1158-L1162 WeakPolarHBondContact O-CB 3.32Å; I1158-L1162 WeakPolarHBondContact O-CG 3.46Å; I1158-L1162 PolarHBondContact O-N 3.02Å
1159	C	91.1	Very high	85.8	Confident	2 Å²	2	24.7 Å²	24.7	1%	0.014	13%	0.13	C	C	.	.	H	α-helix	trans	-68.9	-37.1	-178.6	-66.5	0	0	0	0	112.8	S887 L891 L1155 I1156 L1163	S887-C1159 WeakPolarHBondContact CB-O 3.12Å; L891-C1159 HydrophobicContact CD1-CB 4.07Å; L891-C1159 HydrophobicContact CD2-CB 3.93Å; L891-C1159 HydrophobicContact CG-CB 3.7Å; L1155-C1159 WeakPolarHBondContact O-CB 3.39Å; L1155-C1159 PolarHBondContact O-N 3.03Å; L1155-C1159 PolarHBondContact O-SG 3.43Å; I1156-C1159 PolarHBondContact O-N 2.86Å; C1159-L1163 VanDerWaalsContact O-CB 3.24Å; C1159-L1163 WeakPolarHBondContact O-CB 3.36Å; C1159-L1163 PolarHBondContact O-N 3.05Å
1160	F	90.3	Very high	84.8	Confident	7 Å²	7	24.7 Å²	24.7	3%	0.031	13%	0.13	C	C	.	.	H	α-helix	trans	-66.7	-44.2	173.5	-85	-64.8	0	0	0	112.2	L891 L979 F983 M1101 I1104 P1105 I1108 I1156 M1157 L1163 A1164	L891-F1160 HydrophobicContact CD1-CD1 3.7Å; L891-F1160 HydrophobicContact CD1-CD2 4.42Å; L891-F1160 HydrophobicContact CD1-CE1 3.84Å; L891-F1160 HydrophobicContact CD1-CG 3.99Å; L891-F1160 HydrophobicContact CD1-CZ 4.26Å; L891-F1160 HydrophobicContact CD2-CD1 4.38Å; L891-F1160 HydrophobicContact CD2-CD2 3.7Å; L891-F1160 HydrophobicContact CD2-CE1 4.21Å; L891-F1160 HydrophobicContact CD2-CE2 3.51Å; L891-F1160 HydrophobicContact CD2-CG 4.13Å; L891-F1160 HydrophobicContact CD2-CZ 3.77Å; L979-F1160 HydrophobicContact CD2-CE2 3.88Å; L979-F1160 HydrophobicContact CD2-CZ 4.24Å; F983-F1160 HydrophobicContact CZ-CZ 4.29Å; M1101-F1160 HydrophobicContact SD-CD1 4.35Å; I1104-F1160 HydrophobicContact CB-CD1 4.47Å; I1104-F1160 HydrophobicContact CB-CE1 4.4Å; I1104-F1160 HydrophobicContact CD1-CE1 4.05Å; I1104-F1160 HydrophobicContact CG2-CD1 4.09Å; I1104-F1160 HydrophobicContact CG2-CD2 4.03Å; I1104-F1160 HydrophobicContact CG2-CE1 3.76Å; I1104-F1160 HydrophobicContact CG2-CE2 3.67Å; I1104-F1160 HydrophobicContact CG2-CG 4.24Å; I1104-F1160 HydrophobicContact CG2-CZ 3.54Å; P1105-F1160 HydrophobicContact CB-CB 4.2Å; P1105-F1160 HydrophobicContact CG-CB 4.03Å; I1108-F1160 HydrophobicContact CD1-CD2 4.16Å; I1108-F1160 HydrophobicContact CD1-CE2 3.97Å; I1156-F1160 HydrophobicContact CG2-CD2 3.75Å; I1156-F1160 HydrophobicContact CG2-CE2 3.75Å; I1156-F1160 WeakPolarHBondContact O-CD2 3.39Å; I1156-F1160 PolarHBondContact O-N 3.36Å; M1157-F1160 PolarHBondContact O-N 3.07Å; F1160-L1163 PolarHBondContact O-N 2.83Å; F1160-A1164 WeakPolarHBondContact O-CB 3.2Å; F1160-A1164 PolarHBondContact O-N 3.23Å
1161	N	84	Confident	83.7	Confident	6 Å²	6	25.7 Å²	25.7	3%	0.032	13%	0.134	C	C	.	.	H	α-helix	trans	-62.3	-49	174.6	-78.6	-47.5	0	0	0	111.1	R694 S695 M1157 I1158 L1163 A1164 D1165	R694-N1161 PolarHBondContact NE-OD1 2.83Å; S695-N1161 PolarHBondContact OG-ND2 3.34Å; M1157-N1161 WeakPolarHBondContact O-CB 3.4Å; M1157-N1161 PolarHBondContact O-N 3.4Å; M1157-N1161 PolarHBondContact O-ND2 3Å; I1158-N1161 PolarHBondContact O-N 3.36Å; N1161-L1163 VanDerWaalsContact C-N 3.27Å; N1161-L1163 PolarHBondContact O-N 3.43Å; N1161-A1164 WeakPolarHBondContact O-CB 3.44Å; N1161-A1164 PolarHBondContact O-N 2.88Å; N1161-A1164 VanDerWaalsContact O-N 3.16Å; N1161-D1165 WeakPolarHBondContact O-CB 3.04Å; N1161-D1165 PolarHBondContact O-N 3.37Å
1162	L	85.3	Confident	82.3	Confident	36 Å²	36	23.9 Å²	23.9	19%	0.188	12%	0.121	C	C	.	.	H	α-helix	trans	-59.8	-33.6	176.8	-81.8	173.5	0	0	0	113.6	I691 A883 S887 I1158 G1166	I691-L1162 HydrophobicContact CD1-CD2 3.62Å; I691-L1162 HydrophobicContact CD1-CG 4.44Å; I691-L1162 HydrophobicContact CG2-CG 4.44Å; A883-L1162 HydrophobicContact CB-CD2 4.2Å; S887-L1162 WeakPolarHBondContact OG-CB 3.43Å; S887-L1162 WeakPolarHBondContact OG-CD1 3.41Å; I1158-L1162 HydrophobicContact CG2-CD1 3.69Å; I1158-L1162 HydrophobicContact CG2-CG 4.35Å; I1158-L1162 VanDerWaalsContact O-CB 3.28Å; I1158-L1162 WeakPolarHBondContact O-CB 3.32Å; I1158-L1162 WeakPolarHBondContact O-CG 3.46Å; I1158-L1162 PolarHBondContact O-N 3.02Å; L1162-G1166 PolarHBondContact O-N 2.57Å
1163	L	87.6	Confident	80.4	Confident	18 Å²	18	25.1 Å²	25.1	9%	0.094	13%	0.129	C	C	.	.	H	α-helix	trans	-73	-42.8	174.6	-178.2	55.8	0	0	0	111.7	M888 L891 M1101 C1159 F1160 N1161 D1165 G1166 L1167	M888-L1163 HydrophobicContact CB-CD1 4.06Å; M888-L1163 HydrophobicContact CB-CD2 4.48Å; M888-L1163 HydrophobicContact CG-CD1 4.5Å; L891-L1163 HydrophobicContact CD1-CB 4.35Å; L891-L1163 HydrophobicContact CD1-CD2 3.79Å; M1101-L1163 HydrophobicContact SD-CD2 4.1Å; M1101-L1163 HydrophobicContact SD-CG 4.36Å; C1159-L1163 VanDerWaalsContact O-CB 3.24Å; C1159-L1163 WeakPolarHBondContact O-CB 3.36Å; C1159-L1163 PolarHBondContact O-N 3.05Å; F1160-L1163 PolarHBondContact O-N 2.83Å; N1161-L1163 VanDerWaalsContact C-N 3.27Å; N1161-L1163 PolarHBondContact O-N 3.43Å; L1163-D1165 VanDerWaalsContact C-N 3.25Å; L1163-D1165 PolarHBondContact O-N 2.94Å; L1163-G1166 PolarHBondContact O-N 3.03Å; L1163-L1167 HydrophobicContact CD1-CD1 4.04Å; L1163-L1167 HydrophobicContact CD1-CG 4.17Å; L1163-L1167 HydrophobicContact CG-CD1 3.95Å; L1163-L1167 VanDerWaalsContact O-CB 3.31Å; L1163-L1167 WeakPolarHBondContact O-CB 3.49Å; L1163-L1167 WeakPolarHBondContact O-CD1 3.22Å; L1163-L1167 VanDerWaalsContact O-CG 3.23Å; L1163-L1167 WeakPolarHBondContact O-CG 3.36Å; L1163-L1167 PolarHBondContact O-N 3.24Å
1164	A	82.7	Confident	78.4	Confident	0 Å²	0	29.2 Å²	29.2	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-57.9	-40.7	172.8	0	0	0	0	0	111.6	M1101 F1102 F1160 N1161 L1167 R1168	M1101-A1164 HydrophobicContact CB-CB 3.65Å; F1102-A1164 HydrophobicContact CD1-CB 3.87Å; F1102-A1164 HydrophobicContact CE1-CB 3.46Å; F1102-A1164 VanDerWaalsContact CE1-CB 3.46Å; F1102-A1164 HydrophobicContact CZ-CB 3.83Å; F1160-A1164 WeakPolarHBondContact O-CB 3.2Å; F1160-A1164 PolarHBondContact O-N 3.23Å; N1161-A1164 WeakPolarHBondContact O-CB 3.44Å; N1161-A1164 PolarHBondContact O-N 2.88Å; N1161-A1164 VanDerWaalsContact O-N 3.16Å; A1164-L1167 PolarHBondContact O-N 3.11Å; A1164-R1168 PolarHBondContact O-N 3Å
1165	D	76.4	Confident	76.1	Confident	21 Å²	21	35.4 Å²	35.4	11%	0.112	18%	0.177	C	C	.	.	H	α-helix	trans	-69.7	-47.7	-179	-67	14.3	0	0	0	111.1	R744 N1161 L1163 L1167 R1168 D1169	R744-D1165 VanDerWaalsContact CZ-CG 3.46Å; R744-D1165 IonicContact CZ-OD1 2.74Å; R744-D1165 IonicContact CZ-OD2 2.7Å; R744-D1165 IonicContact NH1-OD1 3.35Å; R744-D1165 PolarHBondContact NH1-OD1 3Å; R744-D1165 IonicContact NH1-OD2 3.25Å; R744-D1165 PolarHBondContact NH1-OD2 3.22Å; R744-D1165 IonicContact NH2-OD1 2.78Å; R744-D1165 PolarHBondContact NH2-OD1 3.36Å; R744-D1165 IonicContact NH2-OD2 2.83Å; R744-D1165 PolarHBondContact NH2-OD2 2.91Å; N1161-D1165 WeakPolarHBondContact O-CB 3.04Å; N1161-D1165 PolarHBondContact O-N 3.37Å; L1163-D1165 VanDerWaalsContact C-N 3.25Å; L1163-D1165 PolarHBondContact O-N 2.94Å; D1165-L1167 VanDerWaalsContact C-N 3.29Å; D1165-L1167 PolarHBondContact O-N 2.97Å; D1165-R1168 PolarHBondContact O-N 3.36Å; D1165-R1168 VanDerWaalsContact O-N 3.16Å; D1165-D1169 PolarHBondContact O-N 2.81Å
1166	G	78.2	Confident	73.7	Confident	0 Å²	0	39.8 Å²	39.8	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-64.1	-32.6	174.4	0	0	0	0	0	113.8	L878 L1162 L1163 A1170	L878-G1166 VanDerWaalsContact CD1-C 3.4Å; L878-G1166 WeakPolarHBondContact CD1-O 3.4Å; L1162-G1166 PolarHBondContact O-N 2.57Å; L1163-G1166 PolarHBondContact O-N 3.03Å; G1166-A1170 WeakPolarHBondContact O-CB 3.2Å; G1166-A1170 PolarHBondContact O-N 2.93Å
1167	L	79.6	Confident	71.2	Confident	25 Å²	25	46.7 Å²	46.7	13%	0.131	23%	0.23	C	C	.	.	H	α-helix	trans	-69.3	-41.4	171.3	-74.6	165.7	0	0	0	111.1	L878 I1097 M1101 L1163 A1164 D1165 A1170 F1171	L878-L1167 HydrophobicContact CD1-CD2 4.28Å; L878-L1167 HydrophobicContact CD1-CG 4.29Å; L878-L1167 HydrophobicContact CD2-CD2 4.04Å; I1097-L1167 HydrophobicContact CG2-CD1 4.12Å; M1101-L1167 HydrophobicContact CG-CD1 3.87Å; M1101-L1167 HydrophobicContact SD-CD1 4.42Å; L1163-L1167 HydrophobicContact CD1-CD1 4.04Å; L1163-L1167 HydrophobicContact CD1-CG 4.17Å; L1163-L1167 HydrophobicContact CG-CD1 3.95Å; L1163-L1167 VanDerWaalsContact O-CB 3.31Å; L1163-L1167 WeakPolarHBondContact O-CB 3.49Å; L1163-L1167 WeakPolarHBondContact O-CD1 3.22Å; L1163-L1167 VanDerWaalsContact O-CG 3.23Å; L1163-L1167 WeakPolarHBondContact O-CG 3.36Å; L1163-L1167 PolarHBondContact O-N 3.24Å; A1164-L1167 PolarHBondContact O-N 3.11Å; D1165-L1167 VanDerWaalsContact C-N 3.29Å; D1165-L1167 PolarHBondContact O-N 2.97Å; L1167-A1170 PolarHBondContact O-N 3.15Å; L1167-F1171 HydrophobicContact CB-CD2 4.3Å; L1167-F1171 HydrophobicContact CB-CE2 4.09Å; L1167-F1171 HydrophobicContact CD2-CE2 4.1Å; L1167-F1171 HydrophobicContact CD2-CZ 4.05Å; L1167-F1171 WeakPolarHBondContact O-CB 3.33Å; L1167-F1171 WeakPolarHBondContact O-CD2 3.28Å; L1167-F1171 WeakPolarHBondContact O-CG 3.33Å; L1167-F1171 PolarHBondContact O-N 2.95Å
1168	R	73.7	Confident	69.3	Low	85 Å²	85	52.6 Å²	52.6	32%	0.321	26%	0.261	S	S	.	.	H	α-helix	trans	-58.3	-54.9	172.8	-175	178.2	-179.7	173.9	1.8	111.2	T748 I1098 A1164 D1165 A1170 F1171 D1172	T748-R1168 VanDerWaalsContact CG2-NH2 3.32Å; I1098-R1168 HydrophobicContact CD1-CB 4Å; I1098-R1168 HydrophobicContact CD1-CG 4.18Å; I1098-R1168 HydrophobicContact CG1-CB 4.35Å; A1164-R1168 PolarHBondContact O-N 3Å; D1165-R1168 PolarHBondContact O-N 3.36Å; D1165-R1168 VanDerWaalsContact O-N 3.16Å; R1168-A1170 PolarHBondContact O-N 3.37Å; R1168-F1171 CarbonylContact O-C 3.55Å; R1168-F1171 PolarHBondContact O-N 3.07Å; R1168-F1171 VanDerWaalsContact O-N 3.09Å; R1168-D1172 WeakPolarHBondContact O-CB 3.37Å; R1168-D1172 PolarHBondContact O-N 2.77Å; R1168-D1172 VanDerWaalsContact O-N 3.11Å
1169	D	67.8	Low	67.5	Low	66 Å²	66	55.4 Å²	55.4	35%	0.353	29%	0.289	S	S	.	.	H	α-helix	trans	-64.9	-26.4	179.2	-76.1	-33.8	0	0	0	113	D1165 K1174	D1165-D1169 PolarHBondContact O-N 2.81Å; D1169-K1174 IonicContact OD1-NZ 3.12Å; D1169-K1174 PolarHBondContact OD1-NZ 2.88Å
1170	A	69.2	Low	65.9	Low	2 Å²	2	61.4 Å²	61.4	2%	0.017	32%	0.321	C	S	.	.	H	α-helix	trans	-74	-35	172.5	0	0	0	0	0	112.9	S874 R877 L878 G1166 L1167 R1168 D1172	S874-A1170 WeakPolarHBondContact CA-O 3.35Å; S874-A1170 VanDerWaalsContact CB-O 3.22Å; S874-A1170 WeakPolarHBondContact CB-O 3.17Å; S874-A1170 WeakPolarHBondContact O-CB 3.44Å; S874-A1170 PolarHBondContact OG-O 2.96Å; R877-A1170 HydrophobicContact CB-CB 4.15Å; R877-A1170 WeakPolarHBondContact CD-O 3.49Å; L878-A1170 HydrophobicContact CB-CB 3.95Å; L878-A1170 HydrophobicContact CD1-CB 4.4Å; G1166-A1170 WeakPolarHBondContact O-CB 3.2Å; G1166-A1170 PolarHBondContact O-N 2.93Å; L1167-A1170 PolarHBondContact O-N 3.15Å; R1168-A1170 PolarHBondContact O-N 3.37Å; A1170-D1172 VanDerWaalsContact C-N 3.3Å
1171	F	67.5	Low	64.6	Low	25 Å²	25	65.5 Å²	65.5	11%	0.11	34%	0.343	C	S	.	.	H	α-helix	trans	-84.5	-0.7	179.7	-70.7	-29.1	0	0	0	113.8	F870 S874 I1097 I1098 L1167 R1168	F870-F1171 HydrophobicContact CD1-CD1 4.04Å; F870-F1171 HydrophobicContact CD1-CE1 4.26Å; F870-F1171 HydrophobicContact CE1-CB 4.23Å; F870-F1171 AromaticContact CE1-CD1 3.15Å; F870-F1171 HydrophobicContact CE1-CD1 3.15Å; F870-F1171 AromaticContact CE1-CE1 3.61Å; F870-F1171 HydrophobicContact CE1-CE1 3.61Å; F870-F1171 AromaticContact CE1-CG 3.82Å; F870-F1171 HydrophobicContact CE1-CG 3.82Å; F870-F1171 HydrophobicContact CE2-CB 4.36Å; F870-F1171 HydrophobicContact CE2-CD1 4.41Å; F870-F1171 VanDerWaalsContact CE2-O 3.32Å; F870-F1171 WeakPolarHBondContact CE2-O 3.33Å; F870-F1171 HydrophobicContact CZ-CB 3.56Å; F870-F1171 AromaticContact CZ-CD1 3.4Å; F870-F1171 HydrophobicContact CZ-CD1 3.4Å; F870-F1171 VanDerWaalsContact CZ-CD1 3.4Å; F870-F1171 HydrophobicContact CZ-CE1 4.31Å; F870-F1171 AromaticContact CZ-CG 3.69Å; F870-F1171 HydrophobicContact CZ-CG 3.69Å; S874-F1171 WeakPolarHBondContact OG-CD1 3.49Å; I1097-F1171 HydrophobicContact CB-CE2 4.07Å; I1097-F1171 HydrophobicContact CD1-CE2 4.35Å; I1097-F1171 HydrophobicContact CD1-CZ 4.08Å; I1097-F1171 HydrophobicContact CG2-CE2 3.84Å; I1097-F1171 HydrophobicContact CG2-CZ 4.3Å; I1098-F1171 HydrophobicContact CD1-CD2 4.04Å; I1098-F1171 HydrophobicContact CG1-CD2 4.08Å; L1167-F1171 HydrophobicContact CB-CD2 4.3Å; L1167-F1171 HydrophobicContact CB-CE2 4.09Å; L1167-F1171 HydrophobicContact CD2-CE2 4.1Å; L1167-F1171 HydrophobicContact CD2-CZ 4.05Å; L1167-F1171 WeakPolarHBondContact O-CB 3.33Å; L1167-F1171 WeakPolarHBondContact O-CD2 3.28Å; L1167-F1171 WeakPolarHBondContact O-CG 3.33Å; L1167-F1171 PolarHBondContact O-N 2.95Å; R1168-F1171 CarbonylContact O-C 3.55Å; R1168-F1171 PolarHBondContact O-N 3.07Å; R1168-F1171 VanDerWaalsContact O-N 3.09Å
1172	D	59.7	Low	63.7	Low	48 Å²	48	72.1 Å²	72.1	26%	0.257	38%	0.378	S	S	.	.			trans	-115.5	110.1	-173.8	-177.8	-5.5	0	0	0	110.5	R877 R1168 A1170 K1174	R877-D1172 PolarHBondContact NH1-O 2.8Å; R1168-D1172 WeakPolarHBondContact O-CB 3.37Å; R1168-D1172 PolarHBondContact O-N 2.77Å; R1168-D1172 VanDerWaalsContact O-N 3.11Å; A1170-D1172 VanDerWaalsContact C-N 3.3Å; D1172-K1174 VanDerWaalsContact C-N 3.26Å; D1172-K1174 PolarHBondContact O-N 2.85Å; D1172-K1174 WeakPolarHBondContact OD2-CE 3.48Å; D1172-K1174 IonicContact OD2-NZ 3.35Å; D1172-K1174 PolarHBondContact OD2-NZ 3.41Å; D1172-K1174 VanDerWaalsContact OD2-NZ 3.15Å
1173	P	51.6	Low	62.9	Low	55 Å²	55	79.2 Å²	79.2	36%	0.357	41%	0.41	S	S	.	.			trans	-81.4	67.3	176.6	36.1	-34.7	0	0	0	112.7	L868 M1175	L868-P1173 HydrophobicContact CD1-CB 4.49Å; P1173-M1175 PolarHBondContact O-N 3.16Å
1174	K	48.6	Very low	62.4	Low	87 Å²	87	81.2 Å²	81.2	38%	0.378	44%	0.436	S	S	.	.			trans	-57	108.5	161.5	-66.6	175.5	-179.3	144.7	0	109.2	V751 D1169 D1172	V751-K1174 HydrophobicContact CG1-CD 4.46Å; D1169-K1174 IonicContact OD1-NZ 3.12Å; D1169-K1174 PolarHBondContact OD1-NZ 2.88Å; D1172-K1174 VanDerWaalsContact C-N 3.26Å; D1172-K1174 PolarHBondContact O-N 2.85Å; D1172-K1174 WeakPolarHBondContact OD2-CE 3.48Å; D1172-K1174 IonicContact OD2-NZ 3.35Å; D1172-K1174 PolarHBondContact OD2-NZ 3.41Å; D1172-K1174 VanDerWaalsContact OD2-NZ 3.15Å
1175	M	42.8	Very low	62.3	Low	142 Å²	142	87.6 Å²	87.6	70%	0.7	47%	0.465	S	S	*	.			trans	-53.5	141.4	169.2	-62	-95.6	-103.9	0	0	108.2	P1173	P1173-M1175 PolarHBondContact O-N 3.16Å
1176	K	40.2	Very low	62.5	Low	164 Å²	164	90.7 Å²	90.7	71%	0.713	48%	0.481	S	S	*	.			trans	-122.9	121.6	178.2	-87.7	-178.7	157.7	-96.7	0	108	N1178	K1176-N1178 PolarHBondContact O-N 3.17Å; K1176-N1178 VanDerWaalsContact O-N 3.11Å
1177	D	40.8	Very low	62.5	Low	148 Å²	148	95.3 Å²	95.3	79%	0.791	51%	0.505	S	S	*	.			trans	27	72.9	157.7	-54	-53	0	0	0	112.8	A1179	D1177-A1179 PolarHBondContact O-N 2.82Å
1178	N	48.6	Very low	62.5	Low	133 Å²	133	96.6 Å²	96.6	71%	0.711	51%	0.51	S	S	*	.			trans	-60.3	-19.5	-160.1	-68.4	-11.1	0	0	0	115.2	K1176	K1176-N1178 PolarHBondContact O-N 3.17Å; K1176-N1178 VanDerWaalsContact O-N 3.11Å
1179	A	51.5	Low	62.7	Low	93 Å²	93	99.7 Å²	99.7	77%	0.769	53%	0.526	S	S	*	.			trans	-147.2	152.2	176.3	0	0	0	0	0	111.1	D1177	D1177-A1179 PolarHBondContact O-N 2.82Å
1180	N	58.1	Low	63.2	Low	128 Å²	128	99.8 Å²	99.8	68%	0.684	54%	0.542	S	S	*	.			trans	-128.3	141.1	168.9	-167.8	68.2	0	0	0	108.5	D1182	N1180-D1182 PolarHBondContact ND2-OD1 3.43Å; N1180-D1182 PolarHBondContact O-N 3.05Å
1181	I	63.7	Low	63.9	Low	94 Å²	94	105 Å²	105	48%	0.482	57%	0.566	S	S	.	*			trans	-88.2	95.6	176.3	-56.9	177.2	0	0	0	107.4	E1183 I1186 V1194	I1181-E1183 WeakPolarHBondContact CG2-O 3.18Å; I1181-I1186 HydrophobicContact CD1-CD1 4.1Å; I1181-V1194 HydrophobicContact CB-CG1 4.27Å; I1181-V1194 HydrophobicContact CD1-CG1 4.23Å; I1181-V1194 HydrophobicContact CD1-CG2 4.08Å; I1181-V1194 HydrophobicContact CG2-CG1 3.92Å; I1181-V1194 HydrophobicContact CG2-CG2 4.48Å
1182	D	63.4	Low	64.8	Low	145 Å²	145	105.6 Å²	105.6	78%	0.775	57%	0.571	S	S	*	*			trans	-77.8	-32.2	-178.7	-71	-13.3	0	0	0	112.2	N1180	N1180-D1182 PolarHBondContact ND2-OD1 3.43Å; N1180-D1182 PolarHBondContact O-N 3.05Å
1183	E	70.1	Confident	66.1	Low	184 Å²	184	104.4 Å²	104.4	86%	0.86	56%	0.564	S	S	*	*	S	Bend	trans	-150.3	166.8	169.6	65.6	-179.6	171	0	0	112.4	I1181	I1181-E1183 WeakPolarHBondContact CG2-O 3.18Å
1184	G	75.3	Confident	67.6	Low	61 Å²	61	103.9 Å²	103.9	63%	0.629	56%	0.56	S	S	*	*			trans	111.4	-178	-179	0	0	0	0	0	114.6
1185	Q	80.8	Confident	69.1	Low	133 Å²	133	106.4 Å²	106.4	62%	0.621	58%	0.577	S	S	*	*			trans	-146.4	149.4	176.8	61.8	178.1	-6.1	0	0	110	L1187	Q1185-L1187 HydrophobicContact CG-CD2 4.44Å; Q1185-L1187 HydrophobicContact CG-CG 4.31Å
1186	I	80.8	Confident	71.1	Confident	87 Å²	87	101.9 Å²	101.9	45%	0.446	55%	0.554	S	S	.	*			trans	-122	104.2	176.8	-60.6	173.4	0	0	0	108	I1181 F1188 D1192 I1193 V1194	I1181-I1186 HydrophobicContact CD1-CD1 4.1Å; I1186-F1188 PolarHBondContact O-N 3.22Å; I1186-D1192 PolarHBondContact N-OD1 3.37Å; I1186-D1192 CarbonylContact O-C 3.6Å; I1186-D1192 WeakPolarHBondContact O-CA 3.2Å; I1186-I1193 HydrophobicContact CB-CD1 4.43Å; I1186-I1193 HydrophobicContact CB-CG1 3.84Å; I1186-I1193 HydrophobicContact CG2-CD1 3.83Å; I1186-I1193 HydrophobicContact CG2-CG1 3.78Å; I1186-I1193 PolarHBondContact O-N 3.13Å; I1186-V1194 HydrophobicContact CB-CG2 3.98Å; I1186-V1194 HydrophobicContact CD1-CG2 3.93Å; I1186-V1194 HydrophobicContact CG1-CG2 3.69Å
1187	L	79.4	Confident	73.3	Confident	97 Å²	97	96.8 Å²	96.8	51%	0.508	54%	0.539	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	93.8	-171.8	-62.9	-179.1	0	0	0	112.2	Q1185 Q1191 D1192	Q1185-L1187 HydrophobicContact CG-CD2 4.44Å; Q1185-L1187 HydrophobicContact CG-CG 4.31Å; L1187-Q1191 CarbonylContact C-O 3.52Å; L1187-Q1191 WeakPolarHBondContact CA-O 3.07Å; L1187-D1192 HydrophobicContact CD2-CB 4.26Å
1188	F	79.6	Confident	75.2	Confident	52 Å²	52	92.5 Å²	92.5	23%	0.228	51%	0.514	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	119.7	170.5	-176.8	-104.5	0	0	0	110.5	I1186 G1190 Q1191 I1193 I1204 E1208 I1209	I1186-F1188 PolarHBondContact O-N 3.22Å; F1188-G1190 PolarHBondContact O-N 2.77Å; F1188-Q1191 PolarHBondContact N-O 3.04Å; F1188-Q1191 PolarHBondContact O-N 2.94Å; F1188-I1193 HydrophobicContact CB-CD1 4.45Å; F1188-I1193 HydrophobicContact CB-CG2 3.86Å; F1188-I1204 HydrophobicContact CD1-CG2 4.42Å; F1188-I1204 HydrophobicContact CE1-CG2 4.38Å; F1188-E1208 HydrophobicContact CE1-CB 3.8Å; F1188-E1208 HydrophobicContact CZ-CB 3.87Å; F1188-E1208 VanDerWaalsContact CZ-O 3.29Å; F1188-E1208 WeakPolarHBondContact CZ-O 3.4Å; F1188-I1209 HydrophobicContact CB-CD1 4.43Å; F1188-I1209 HydrophobicContact CD1-CD1 4.28Å; F1188-I1209 HydrophobicContact CD1-CG1 4.47Å; F1188-I1209 HydrophobicContact CD2-CD1 3.79Å; F1188-I1209 HydrophobicContact CD2-CG1 3.92Å; F1188-I1209 HydrophobicContact CE1-CG1 4.21Å; F1188-I1209 HydrophobicContact CE2-CD1 4.05Å; F1188-I1209 HydrophobicContact CE2-CG1 3.62Å; F1188-I1209 HydrophobicContact CG-CD1 3.9Å; F1188-I1209 HydrophobicContact CG-CG1 4.33Å; F1188-I1209 HydrophobicContact CZ-CD1 4.39Å; F1188-I1209 HydrophobicContact CZ-CG1 3.77Å
1189	K	77.3	Confident	76.9	Confident	150 Å²	150	94 Å²	94	65%	0.652	51%	0.514	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.5	38.4	-174.8	-60.4	178.7	-178.4	173	0	112.8	Q1191 E1208	K1189-Q1191 VanDerWaalsContact C-N 3.32Å; K1189-Q1191 PolarHBondContact O-N 3.2Å; K1189-E1208 IonicContact NZ-OE2 2.77Å; K1189-E1208 PolarHBondContact NZ-OE2 3.22Å
1190	G	79.1	Confident	78.6	Confident	68 Å²	68	93.9 Å²	93.9	70%	0.701	50%	0.498	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.1	5.2	-178.2	0	0	0	0	0	115.9	F1188	F1188-G1190 PolarHBondContact O-N 2.77Å
1191	Q	83.2	Confident	79.9	Confident	111 Å²	111	88.8 Å²	88.8	52%	0.519	47%	0.47	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	131.9	176.4	-57	179.6	19.4	0	0	110.5	L1187 F1188 K1189 I1193	L1187-Q1191 CarbonylContact C-O 3.52Å; L1187-Q1191 WeakPolarHBondContact CA-O 3.07Å; F1188-Q1191 PolarHBondContact N-O 3.04Å; F1188-Q1191 PolarHBondContact O-N 2.94Å; K1189-Q1191 VanDerWaalsContact C-N 3.32Å; K1189-Q1191 PolarHBondContact O-N 3.2Å; Q1191-I1193 PolarHBondContact O-N 3.46Å
1192	D	86.5	Confident	81	Confident	38 Å²	38	86.1 Å²	86.1	20%	0.203	46%	0.456	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.4	134.1	166.3	176.1	48	0	0	0	110.5	I1186 L1187 V1194 N1195 K1196	I1186-D1192 PolarHBondContact N-OD1 3.37Å; I1186-D1192 CarbonylContact O-C 3.6Å; I1186-D1192 WeakPolarHBondContact O-CA 3.2Å; L1187-D1192 HydrophobicContact CD2-CB 4.26Å; D1192-V1194 WeakPolarHBondContact OD1-CB 3.39Å; D1192-V1194 WeakPolarHBondContact OD1-CG2 3.42Å; D1192-V1194 PolarHBondContact OD1-N 2.9Å; D1192-V1194 PolarHBondContact OD2-N 3.19Å; D1192-N1195 PolarHBondContact OD2-N 3.47Å; D1192-N1195 VanDerWaalsContact OD2-N 3.12Å; D1192-N1195 PolarHBondContact OD2-ND2 3.05Å; D1192-K1196 WeakPolarHBondContact O-CE 3.38Å
1193	I	86.8	Confident	82	Confident	23 Å²	23	86.2 Å²	86.2	12%	0.118	45%	0.449	C	S	.	.			trans	-108.1	-9.4	174.4	69.1	176.1	0	0	0	113.7	I1186 F1188 Q1191 N1195 K1196 M1201 I1204 I1209	I1186-I1193 HydrophobicContact CB-CD1 4.43Å; I1186-I1193 HydrophobicContact CB-CG1 3.84Å; I1186-I1193 HydrophobicContact CG2-CD1 3.83Å; I1186-I1193 HydrophobicContact CG2-CG1 3.78Å; I1186-I1193 PolarHBondContact O-N 3.13Å; F1188-I1193 HydrophobicContact CB-CD1 4.45Å; F1188-I1193 HydrophobicContact CB-CG2 3.86Å; Q1191-I1193 PolarHBondContact O-N 3.46Å; I1193-N1195 VanDerWaalsContact C-N 3.34Å; I1193-N1195 PolarHBondContact O-N 3.26Å; I1193-K1196 HydrophobicContact CB-CD 4.34Å; I1193-K1196 HydrophobicContact CG2-CD 4.17Å; I1193-K1196 PolarHBondContact O-N 3.04Å; I1193-M1201 HydrophobicContact CB-CE 4.49Å; I1193-M1201 HydrophobicContact CB-SD 4.05Å; I1193-M1201 HydrophobicContact CD1-CE 4.33Å; I1193-I1204 HydrophobicContact CG2-CD1 4.28Å; I1193-I1209 HydrophobicContact CD1-CD1 4.05Å
1194	V	83.2	Confident	82.6	Confident	44 Å²	44	78 Å²	78	27%	0.267	41%	0.411	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-44	178.5	176.7	0	0	0	0	110.6	I1181 I1186 D1192 K1196	I1181-V1194 HydrophobicContact CB-CG1 4.27Å; I1181-V1194 HydrophobicContact CD1-CG1 4.23Å; I1181-V1194 HydrophobicContact CD1-CG2 4.08Å; I1181-V1194 HydrophobicContact CG2-CG1 3.92Å; I1181-V1194 HydrophobicContact CG2-CG2 4.48Å; I1186-V1194 HydrophobicContact CB-CG2 3.98Å; I1186-V1194 HydrophobicContact CD1-CG2 3.93Å; I1186-V1194 HydrophobicContact CG1-CG2 3.69Å; D1192-V1194 WeakPolarHBondContact OD1-CB 3.39Å; D1192-V1194 WeakPolarHBondContact OD1-CG2 3.42Å; D1192-V1194 PolarHBondContact OD1-N 2.9Å; D1192-V1194 PolarHBondContact OD2-N 3.19Å; V1194-K1196 VanDerWaalsContact C-N 3.34Å; V1194-K1196 PolarHBondContact O-N 3.29Å
1195	N	79.5	Confident	83.1	Confident	139 Å²	139	78.5 Å²	78.5	74%	0.743	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.8	6.6	-175.5	-69.5	-83.8	0	0	0	114.9	D1192 I1193	D1192-N1195 PolarHBondContact OD2-N 3.47Å; D1192-N1195 VanDerWaalsContact OD2-N 3.12Å; D1192-N1195 PolarHBondContact OD2-ND2 3.05Å; I1193-N1195 VanDerWaalsContact C-N 3.34Å; I1193-N1195 PolarHBondContact O-N 3.26Å
1196	K	85.9	Confident	82.8	Confident	47 Å²	47	73.2 Å²	73.2	20%	0.204	38%	0.375	C	S	.	.			trans	-80.6	140.6	-176.2	-73.7	-173.6	176.5	177.2	0	112.6	D1192 I1193 V1194 E1200 M1201 I1204	D1192-K1196 WeakPolarHBondContact O-CE 3.38Å; I1193-K1196 HydrophobicContact CB-CD 4.34Å; I1193-K1196 HydrophobicContact CG2-CD 4.17Å; I1193-K1196 PolarHBondContact O-N 3.04Å; V1194-K1196 VanDerWaalsContact C-N 3.34Å; V1194-K1196 PolarHBondContact O-N 3.29Å; K1196-E1200 HydrophobicContact CB-CB 4.2Å; K1196-M1201 HydrophobicContact CB-CG 4.02Å; K1196-M1201 HydrophobicContact CB-SD 3.97Å; K1196-M1201 HydrophobicContact CD-SD 4.42Å; K1196-I1204 HydrophobicContact CD-CD1 3.79Å
1197	S	85.3	Confident	82.9	Confident	58 Å²	58	77.1 Å²	77.1	41%	0.406	38%	0.384	S	S	.	.			trans	-67.8	155.3	176.1	73.7	0	0	0	0	111.6	K1199 E1200 M1201	S1197-K1199 PolarHBondContact O-N 2.66Å; S1197-E1200 WeakPolarHBondContact CB-OE2 3.41Å; S1197-E1200 PolarHBondContact N-OE2 2.81Å; S1197-E1200 WeakPolarHBondContact O-CA 3.1Å; S1197-E1200 WeakPolarHBondContact O-CB 3.49Å; S1197-E1200 PolarHBondContact O-N 2.98Å; S1197-E1200 PolarHBondContact OG-OE2 3.01Å; S1197-M1201 PolarHBondContact O-N 3.31Å
1198	E	81.9	Confident	82.8	Confident	58 Å²	58	76.6 Å²	76.6	27%	0.271	38%	0.379	S	S	.	.	H	α-helix	trans	-56	-26.3	177.7	-171	86.5	124.8	0	0	112.2	R763 R769 Q1202 R1205	R763-E1198 IonicContact CZ-OE1 3.56Å; R763-E1198 IonicContact NE-OE1 3.81Å; R763-E1198 PolarHBondContact NE-OE1 3.18Å; R763-E1198 IonicContact NH2-OE1 3.96Å; R763-E1198 PolarHBondContact NH2-OE1 2.73Å; R763-E1198 IonicContact NH2-OE2 2.74Å; R769-E1198 IonicContact NE-OE1 2.74Å; E1198-Q1202 WeakPolarHBondContact O-CB 3.23Å; E1198-Q1202 WeakPolarHBondContact O-CG 3.49Å; E1198-Q1202 PolarHBondContact O-N 3.06Å; E1198-Q1202 PolarHBondContact O-NE2 3.41Å; E1198-R1205 IonicContact OE2-CZ 3.72Å; E1198-R1205 IonicContact OE2-NH1 3.61Å; E1198-R1205 PolarHBondContact OE2-NH1 2.98Å
1199	K	83.8	Confident	82.9	Confident	163 Å²	163	76.7 Å²	76.7	71%	0.709	38%	0.382	S	S	*	.	H	α-helix	trans	-74.4	-23.7	174.1	-80.7	-171	174.9	-176.3	0	114.2	S1197	S1197-K1199 PolarHBondContact O-N 2.66Å
1200	E	86.2	Confident	82.8	Confident	92 Å²	92	73.7 Å²	73.7	43%	0.43	38%	0.384	S	S	.	.	H	α-helix	trans	-88.1	-40.9	174.8	-68.6	158.8	119.3	0	0	110	K1196 S1197 Q1202 K1203	K1196-E1200 HydrophobicContact CB-CB 4.2Å; S1197-E1200 WeakPolarHBondContact CB-OE2 3.41Å; S1197-E1200 PolarHBondContact N-OE2 2.81Å; S1197-E1200 WeakPolarHBondContact O-CA 3.1Å; S1197-E1200 WeakPolarHBondContact O-CB 3.49Å; S1197-E1200 PolarHBondContact O-N 2.98Å; S1197-E1200 PolarHBondContact OG-OE2 3.01Å; E1200-Q1202 VanDerWaalsContact C-N 3.26Å; E1200-Q1202 PolarHBondContact O-N 3.28Å; E1200-K1203 WeakPolarHBondContact O-CB 3.25Å; E1200-K1203 PolarHBondContact O-N 2.61Å
1201	M	86.8	Confident	82.5	Confident	20 Å²	20	75 Å²	75	10%	0.099	37%	0.374	C	S	.	.	H	α-helix	trans	-60.1	-34.9	171.5	-69.2	-57.5	-71.1	0	0	112.5	I1193 K1196 S1197 K1203 I1204 R1205	I1193-M1201 HydrophobicContact CB-CE 4.49Å; I1193-M1201 HydrophobicContact CB-SD 4.05Å; I1193-M1201 HydrophobicContact CD1-CE 4.33Å; K1196-M1201 HydrophobicContact CB-CG 4.02Å; K1196-M1201 HydrophobicContact CB-SD 3.97Å; K1196-M1201 HydrophobicContact CD-SD 4.42Å; S1197-M1201 PolarHBondContact O-N 3.31Å; M1201-K1203 PolarHBondContact O-N 3.2Å; M1201-K1203 VanDerWaalsContact O-N 3.13Å; M1201-I1204 PolarHBondContact O-N 3.47Å; M1201-I1204 HydrophobicContact SD-CD1 4.17Å; M1201-R1205 HydrophobicContact CE-CG 4.43Å; M1201-R1205 WeakPolarHBondContact O-CB 3.37Å; M1201-R1205 PolarHBondContact O-N 2.74Å
1202	Q	86	Confident	81.7	Confident	39 Å²	39	72.9 Å²	72.9	18%	0.182	37%	0.365	C	S	.	.	H	α-helix	trans	-60.1	-14.8	170.6	-81.8	166.7	45.2	0	0	114.8	G766 E1198 E1200 H1237	G766-Q1202 WeakPolarHBondContact O-CG 3.19Å; E1198-Q1202 WeakPolarHBondContact O-CB 3.23Å; E1198-Q1202 WeakPolarHBondContact O-CG 3.49Å; E1198-Q1202 PolarHBondContact O-N 3.06Å; E1198-Q1202 PolarHBondContact O-NE2 3.41Å; E1200-Q1202 VanDerWaalsContact C-N 3.26Å; E1200-Q1202 PolarHBondContact O-N 3.28Å; Q1202-H1237 PolarHBondContact O-CE1 2.93Å
1203	K	83.8	Confident	80.7	Confident	146 Å²	146	72 Å²	72	64%	0.635	36%	0.359	S	S	*	.	H	α-helix	trans	-93.3	-17.2	174.7	-59.7	178.7	-178.6	178	0	113.3	E1200 M1201	E1200-K1203 WeakPolarHBondContact O-CB 3.25Å; E1200-K1203 PolarHBondContact O-N 2.61Å; M1201-K1203 PolarHBondContact O-N 3.2Å; M1201-K1203 VanDerWaalsContact O-N 3.13Å
1204	I	83.1	Confident	79.3	Confident	11 Å²	11	76.7 Å²	76.7	6%	0.056	38%	0.381	C	S	.	.	H	α-helix	trans	-99.9	-51.2	-175.8	-58.9	170.5	0	0	0	109.3	F1188 I1193 K1196 M1201 G1206 R1207 E1208 I1209	F1188-I1204 HydrophobicContact CD1-CG2 4.42Å; F1188-I1204 HydrophobicContact CE1-CG2 4.38Å; I1193-I1204 HydrophobicContact CG2-CD1 4.28Å; K1196-I1204 HydrophobicContact CD-CD1 3.79Å; M1201-I1204 PolarHBondContact O-N 3.47Å; M1201-I1204 HydrophobicContact SD-CD1 4.17Å; I1204-G1206 PolarHBondContact O-N 3.22Å; I1204-R1207 PolarHBondContact O-N 2.78Å; I1204-E1208 HydrophobicContact CG2-CB 4.31Å; I1204-E1208 PolarHBondContact O-N 3.34Å; I1204-I1209 HydrophobicContact CG2-CB 4.28Å; I1204-I1209 HydrophobicContact CG2-CD1 3.63Å; I1204-I1209 HydrophobicContact CG2-CG1 3.75Å; I1204-I1209 PolarHBondContact O-N 3.24Å
1205	R	86.2	Confident	78.1	Confident	73 Å²	73	77.5 Å²	77.5	28%	0.275	38%	0.384	S	S	.	.	B	Isolated β-bridge	trans	-59.9	121.2	176.4	-72.5	-174.4	-179.2	134.8	-1.5	110.8	R763 A764 K765 G766 E1198 M1201 R1207 H1237	R763-R1205 WeakPolarHBondContact O-CD 3.22Å; A764-R1205 CarbonylContact O-C 3.57Å; A764-R1205 WeakPolarHBondContact O-CB 3.38Å; K765-R1205 CarbonylContact C-O 3.38Å; G766-R1205 WeakPolarHBondContact CA-O 3.32Å; G766-R1205 PolarHBondContact N-O 3.11Å; E1198-R1205 IonicContact OE2-CZ 3.72Å; E1198-R1205 IonicContact OE2-NH1 3.61Å; E1198-R1205 PolarHBondContact OE2-NH1 2.98Å; M1201-R1205 HydrophobicContact CE-CG 4.43Å; M1201-R1205 WeakPolarHBondContact O-CB 3.37Å; M1201-R1205 PolarHBondContact O-N 2.74Å; R1205-R1207 VanDerWaalsContact C-N 3.32Å; R1205-H1237 PolarHBondContact O-CE1 3Å; R1205-H1237 VanDerWaalsContact O-CE1 3.23Å; R1205-H1237 PolarHBondContact O-NE2 2.76Å
1206	G	75.6	Confident	77.2	Confident	22 Å²	22	72.3 Å²	72.3	23%	0.227	36%	0.358	C	S	.	.	T	Hydrogen-bonded Turn	trans	86.6	-5	178	0	0	0	0	0	114.7	A764 I1204 I1209 S1233 H1237	A764-G1206 WeakPolarHBondContact O-CA 3.35Å; A764-G1206 PolarHBondContact O-N 3.31Å; I1204-G1206 PolarHBondContact O-N 3.22Å; G1206-I1209 PolarHBondContact N-O 3.07Å; G1206-S1233 PolarHBondContact O-OG 2.98Å; G1206-S1233 VanDerWaalsContact O-OG 3.08Å; G1206-H1237 PolarHBondContact O-CD2 3.12Å
1207	R	81.2	Confident	76	Confident	169 Å²	169	75 Å²	75	64%	0.638	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-120.4	-45.1	179.5	-177.2	-178.4	169.7	149.1	0.4	113.3	I1204 R1205 H1237	I1204-R1207 PolarHBondContact O-N 2.78Å; R1205-R1207 VanDerWaalsContact C-N 3.32Å; R1207-H1237 HydrophobicContact CB-CB 4.14Å; R1207-H1237 HydrophobicContact CG-CB 4.24Å
1208	E	78.9	Confident	75.2	Confident	85 Å²	85	74.8 Å²	74.8	40%	0.397	37%	0.368	S	S	.	.	T	Hydrogen-bonded Turn	trans	-121.9	-22.4	-176.6	-60.3	-166.4	-120.7	0	0	112.4	F1188 K1189 I1204	F1188-E1208 HydrophobicContact CE1-CB 3.8Å; F1188-E1208 HydrophobicContact CZ-CB 3.87Å; F1188-E1208 VanDerWaalsContact CZ-O 3.29Å; F1188-E1208 WeakPolarHBondContact CZ-O 3.4Å; K1189-E1208 IonicContact NZ-OE2 2.77Å; K1189-E1208 PolarHBondContact NZ-OE2 3.22Å; I1204-E1208 HydrophobicContact CG2-CB 4.31Å; I1204-E1208 PolarHBondContact O-N 3.34Å
1209	I	80.1	Confident	74.7	Confident	55 Å²	55	72.3 Å²	72.3	28%	0.282	36%	0.358	S	S	.	.	B	Isolated β-bridge	trans	-128.1	118.7	168.7	-59.2	176.5	0	0	0	107.1	F1188 I1193 I1204 G1206	F1188-I1209 HydrophobicContact CB-CD1 4.43Å; F1188-I1209 HydrophobicContact CD1-CD1 4.28Å; F1188-I1209 HydrophobicContact CD1-CG1 4.47Å; F1188-I1209 HydrophobicContact CD2-CD1 3.79Å; F1188-I1209 HydrophobicContact CD2-CG1 3.92Å; F1188-I1209 HydrophobicContact CE1-CG1 4.21Å; F1188-I1209 HydrophobicContact CE2-CD1 4.05Å; F1188-I1209 HydrophobicContact CE2-CG1 3.62Å; F1188-I1209 HydrophobicContact CG-CD1 3.9Å; F1188-I1209 HydrophobicContact CG-CG1 4.33Å; F1188-I1209 HydrophobicContact CZ-CD1 4.39Å; F1188-I1209 HydrophobicContact CZ-CG1 3.77Å; I1193-I1209 HydrophobicContact CD1-CD1 4.05Å; I1204-I1209 HydrophobicContact CG2-CB 4.28Å; I1204-I1209 HydrophobicContact CG2-CD1 3.63Å; I1204-I1209 HydrophobicContact CG2-CG1 3.75Å; I1204-I1209 PolarHBondContact O-N 3.24Å; G1206-I1209 PolarHBondContact N-O 3.07Å
1210	A	76	Confident	74.5	Confident	86 Å²	86	66.3 Å²	66.3	71%	0.711	33%	0.333	S	S	*	.			trans	-89.1	151.5	161.7	0	0	0	0	0	109
1211	M	71.9	Confident	74.3	Confident	96 Å²	96	61.9 Å²	61.9	47%	0.473	31%	0.313	S	S	.	.			trans	-117.5	149.9	164	176.7	171.7	174	0	0	107.8	A764 F1213	A764-M1211 HydrophobicContact CB-CB 4.04Å; M1211-F1213 HydrophobicContact CB-CE2 4.36Å; M1211-F1213 HydrophobicContact CE-CD1 3.97Å; M1211-F1213 HydrophobicContact CE-CE1 3.7Å; M1211-F1213 HydrophobicContact CE-CE2 4.31Å; M1211-F1213 HydrophobicContact CE-CG 4.37Å; M1211-F1213 HydrophobicContact CE-CZ 3.89Å; M1211-F1213 HydrophobicContact CG-CD2 4.36Å; M1211-F1213 HydrophobicContact CG-CE2 3.92Å; M1211-F1213 HydrophobicContact CG-CZ 4.18Å; M1211-F1213 HydrophobicContact SD-CE1 4.17Å; M1211-F1213 HydrophobicContact SD-CE2 4.13Å; M1211-F1213 HydrophobicContact SD-CZ 3.76Å
1212	I	68.1	Low	73.5	Confident	66 Å²	66	62.1 Å²	62.1	34%	0.338	32%	0.315	S	S	.	.			trans	-122.9	151.9	173.4	-49.9	176.3	0	0	0	108.2	I1277 A1278	I1212-I1277 HydrophobicContact CG2-CB 3.58Å; I1212-I1277 HydrophobicContact CG2-CG2 4.34Å; I1212-I1277 WeakPolarHBondContact CG2-O 3.17Å; I1212-A1278 HydrophobicContact CD1-CB 4.33Å; I1212-A1278 VanDerWaalsContact CG2-C 3.47Å; I1212-A1278 VanDerWaalsContact CG2-CA 3.43Å; I1212-A1278 HydrophobicContact CG2-CB 3.69Å
1213	F	65.5	Low	73	Confident	20 Å²	20	60.4 Å²	60.4	9%	0.088	31%	0.307	C	S	.	.	B	Isolated β-bridge	trans	-119.5	164.4	-171.4	-70.1	-98.5	0	0	0	111.2	E760 L761 A764 M1211 S1219 I1277 A1278 D1279	E760-F1213 HydrophobicContact CB-CE1 3.54Å; E760-F1213 HydrophobicContact CB-CZ 3.69Å; L761-F1213 HydrophobicContact CB-CD2 4.38Å; L761-F1213 HydrophobicContact CB-CE2 3.94Å; L761-F1213 HydrophobicContact CB-CZ 4.47Å; L761-F1213 HydrophobicContact CD1-CD2 3.97Å; L761-F1213 HydrophobicContact CD1-CE2 3.75Å; L761-F1213 HydrophobicContact CG-CE2 4.47Å; A764-F1213 HydrophobicContact CB-CE2 4.3Å; A764-F1213 HydrophobicContact CB-CZ 4.49Å; M1211-F1213 HydrophobicContact CB-CE2 4.36Å; M1211-F1213 HydrophobicContact CE-CD1 3.97Å; M1211-F1213 HydrophobicContact CE-CE1 3.7Å; M1211-F1213 HydrophobicContact CE-CE2 4.31Å; M1211-F1213 HydrophobicContact CE-CG 4.37Å; M1211-F1213 HydrophobicContact CE-CZ 3.89Å; M1211-F1213 HydrophobicContact CG-CD2 4.36Å; M1211-F1213 HydrophobicContact CG-CE2 3.92Å; M1211-F1213 HydrophobicContact CG-CZ 4.18Å; M1211-F1213 HydrophobicContact SD-CE1 4.17Å; M1211-F1213 HydrophobicContact SD-CE2 4.13Å; M1211-F1213 HydrophobicContact SD-CZ 3.76Å; F1213-S1219 VanDerWaalsContact CB-OG 3.22Å; F1213-S1219 WeakPolarHBondContact CB-OG 3.16Å; F1213-I1277 CarbonylContact O-C 3.4Å; F1213-A1278 PolarHBondContact O-N 3.1Å; F1213-D1279 PolarHBondContact O-N 3.25Å; F1213-D1279 VanDerWaalsContact O-N 3.15Å
1214	Q	56.9	Low	73	Confident	121 Å²	121	54.4 Å²	54.4	57%	0.565	28%	0.282	S	S	*	.	S	Bend	trans	-78.1	-37.9	-176.3	-171.3	174.2	26.6	0	0	113.7	D1279 E1280	Q1214-D1279 VanDerWaalsContact CA-O 3.29Å; Q1214-D1279 WeakPolarHBondContact CA-O 3.38Å; Q1214-D1279 WeakPolarHBondContact CG-O 3.37Å; Q1214-E1280 HydrophobicContact CG-CB 4.4Å
1215	D	58.2	Low	73	Confident	61 Å²	61	54.3 Å²	54.3	33%	0.326	28%	0.282	S	S	.	.			trans	-109.6	116.5	175.8	-178	-29.8	0	0	0	110	M1217 T1218 S1219	D1215-M1217 WeakPolarHBondContact OD1-CA 3.37Å; D1215-M1217 WeakPolarHBondContact OD1-CB 3.27Å; D1215-M1217 PolarHBondContact OD1-N 3.22Å; D1215-T1218 HydrophobicContact CB-CG2 4.44Å; D1215-T1218 WeakPolarHBondContact CB-OG1 3.15Å; D1215-T1218 PolarHBondContact O-OG1 3.32Å; D1215-T1218 PolarHBondContact OD1-N 2.84Å; D1215-T1218 WeakPolarHBondContact OD2-CG2 3.07Å; D1215-S1219 VanDerWaalsContact O-CB 3.22Å; D1215-S1219 WeakPolarHBondContact O-CB 3.37Å; D1215-S1219 PolarHBondContact O-N 3.38Å; D1215-S1219 PolarHBondContact O-OG 3.38Å
1216	P	60.7	Low	72.8	Confident	31 Å²	31	51.1 Å²	51.1	20%	0.201	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.7	-24	179.5	30.9	-34.4	0	0	0	113.5	S1219 L1220 I1275	P1216-S1219 PolarHBondContact O-N 3.06Å; P1216-L1220 WeakPolarHBondContact O-CG 3.46Å; P1216-I1275 WeakPolarHBondContact CG-O 3.16Å
1217	M	59.6	Low	73.2	Confident	104 Å²	104	50.1 Å²	50.1	51%	0.512	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.8	-38.4	-177.4	-173.9	60.9	67.6	0	0	111.3	D1215	D1215-M1217 WeakPolarHBondContact OD1-CA 3.37Å; D1215-M1217 WeakPolarHBondContact OD1-CB 3.27Å; D1215-M1217 PolarHBondContact OD1-N 3.22Å
1218	T	68.4	Low	73.4	Confident	52 Å²	52	47 Å²	47	32%	0.319	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75	-25.9	171	60.5	0	0	0	0	112.8	D757 Y758 D1215 L1220	D757-T1218 WeakPolarHBondContact OD2-CB 3.09Å; D757-T1218 PolarHBondContact OD2-OG1 3.19Å; Y758-T1218 WeakPolarHBondContact CD1-O 3.45Å; Y758-T1218 PolarHBondContact N-O 2.83Å; D1215-T1218 HydrophobicContact CB-CG2 4.44Å; D1215-T1218 WeakPolarHBondContact CB-OG1 3.15Å; D1215-T1218 PolarHBondContact O-OG1 3.32Å; D1215-T1218 PolarHBondContact OD1-N 2.84Å; D1215-T1218 WeakPolarHBondContact OD2-CG2 3.07Å; T1218-L1220 PolarHBondContact O-N 2.84Å
1219	S	72.4	Confident	73.8	Confident	7 Å²	7	43.2 Å²	43.2	5%	0.049	23%	0.233	C	C	.	.	S	Bend	trans	-79.6	-8.8	-176.2	-67	0	0	0	0	115.1	Y758 L761 F1213 D1215 P1216	Y758-S1219 VanDerWaalsContact CA-O 3.25Å; Y758-S1219 WeakPolarHBondContact CA-O 3.15Å; Y758-S1219 WeakPolarHBondContact CB-O 3.07Å; L761-S1219 WeakPolarHBondContact CD2-O 3.16Å; F1213-S1219 VanDerWaalsContact CB-OG 3.22Å; F1213-S1219 WeakPolarHBondContact CB-OG 3.16Å; D1215-S1219 VanDerWaalsContact O-CB 3.22Å; D1215-S1219 WeakPolarHBondContact O-CB 3.37Å; D1215-S1219 PolarHBondContact O-N 3.38Å; D1215-S1219 PolarHBondContact O-OG 3.38Å; P1216-S1219 PolarHBondContact O-N 3.06Å
1220	L	79.6	Confident	74.1	Confident	36 Å²	36	42.7 Å²	42.7	19%	0.188	23%	0.232	C	C	.	.	S	Bend	trans	-112.9	133.2	178.9	-65.3	173.1	0	0	0	111.6	L761 P1216 T1218 P1222 I1226 P1269	L761-L1220 HydrophobicContact CD2-CD2 4.04Å; P1216-L1220 WeakPolarHBondContact O-CG 3.46Å; T1218-L1220 PolarHBondContact O-N 2.84Å; L1220-P1222 VanDerWaalsContact O-CD 3.23Å; L1220-P1222 WeakPolarHBondContact O-CD 3.47Å; L1220-P1222 VanDerWaalsContact O-N 3.13Å; L1220-I1226 HydrophobicContact CD1-CD1 3.93Å; L1220-P1269 HydrophobicContact CB-CB 3.8Å; L1220-P1269 HydrophobicContact CB-CG 3.54Å; L1220-P1269 HydrophobicContact CD1-CB 4.27Å; L1220-P1269 HydrophobicContact CD1-CG 4.44Å
1221	D	80.5	Confident	74.7	Confident	0 Å²	0	38.7 Å²	38.7	0%	0	20%	0.199	C	C	.	.			trans	-65	113	-178.2	176.7	-12.8	0	0	0	110.4	Y758 H776 N780 T1223 M1224 Q1229	Y758-D1221 HydrophobicContact CD2-CB 3.97Å; Y758-D1221 HydrophobicContact CE2-CB 4.49Å; Y758-D1221 HydrophobicContact CG-CB 4.26Å; H776-D1221 WeakPolarHBondContact CA-OD2 3.27Å; H776-D1221 IonicContact CE1-OD2 3.69Å; H776-D1221 IonicContact CG-OD2 3.25Å; H776-D1221 IonicContact ND1-OD2 2.74Å; H776-D1221 PolarHBondContact ND1-OD2 2.99Å; N780-D1221 PolarHBondContact ND2-OD1 3.1Å; D1221-T1223 PolarHBondContact O-N 3.27Å; D1221-T1223 WeakPolarHBondContact OD1-CB 3.49Å; D1221-T1223 PolarHBondContact OD1-N 3.19Å; D1221-T1223 PolarHBondContact OD1-OG1 2.9Å; D1221-M1224 HydrophobicContact CB-CB 4.19Å; D1221-M1224 HydrophobicContact CB-CG 4.46Å; D1221-M1224 PolarHBondContact O-N 3Å; D1221-Q1229 PolarHBondContact O-NE2 3.02Å
1222	P	71.5	Confident	75.5	Confident	24 Å²	24	34.4 Å²	34.4	16%	0.156	18%	0.178	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.7	-9.1	-173.8	28.1	-36.7	0	0	0	113.4	L1220 Y1268	L1220-P1222 VanDerWaalsContact O-CD 3.23Å; L1220-P1222 WeakPolarHBondContact O-CD 3.47Å; L1220-P1222 VanDerWaalsContact O-N 3.13Å; P1222-Y1268 WeakPolarHBondContact O-CD1 3.42Å
1223	T	75.7	Confident	76.2	Confident	3 Å²	3	32.6 Å²	32.6	2%	0.018	17%	0.171	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.7	-3	174.5	73.7	0	0	0	0	113.7	R779 N780 I783 D1221 Y1268	R779-T1223 PolarHBondContact NH1-O 2.69Å; N780-T1223 WeakPolarHBondContact OD1-CG2 3.36Å; I783-T1223 HydrophobicContact CD1-CG2 3.89Å; D1221-T1223 PolarHBondContact O-N 3.27Å; D1221-T1223 WeakPolarHBondContact OD1-CB 3.49Å; D1221-T1223 PolarHBondContact OD1-N 3.19Å; D1221-T1223 PolarHBondContact OD1-OG1 2.9Å; T1223-Y1268 WeakPolarHBondContact O-CE1 3.28Å
1224	M	82.6	Confident	77.2	Confident	20 Å²	20	32.5 Å²	32.5	10%	0.099	17%	0.172	C	C	.	.	S	Bend	trans	-116.8	131.3	179.6	-73	-175.6	51.6	0	0	111.8	H776 D1221 K1228 Q1229	H776-M1224 VanDerWaalsContact CE1-SD 3.51Å; H776-M1224 PolarHBondContact ND1-SD 3.03Å; D1221-M1224 HydrophobicContact CB-CB 4.19Å; D1221-M1224 HydrophobicContact CB-CG 4.46Å; D1221-M1224 PolarHBondContact O-N 3Å; M1224-K1228 HydrophobicContact CE-CB 4.03Å; M1224-Q1229 HydrophobicContact CB-CG 3.61Å; M1224-Q1229 HydrophobicContact CE-CG 4.26Å; M1224-Q1229 PolarHBondContact O-NE2 3.12Å
1225	T	83.6	Confident	78.6	Confident	9 Å²	9	32.7 Å²	32.7	6%	0.055	17%	0.167	C	C	.	.			trans	-66.8	145.9	178.3	65.8	0	0	0	0	110.9	G1227 K1228 Q1229 K1266 N1267 Y1268	T1225-G1227 VanDerWaalsContact C-N 3.27Å; T1225-G1227 PolarHBondContact O-N 2.85Å; T1225-G1227 VanDerWaalsContact O-N 3.16Å; T1225-K1228 WeakPolarHBondContact O-CA 3.18Å; T1225-K1228 WeakPolarHBondContact O-CB 3.35Å; T1225-K1228 PolarHBondContact O-N 3.29Å; T1225-K1228 VanDerWaalsContact OG1-CD 3.31Å; T1225-K1228 WeakPolarHBondContact OG1-CD 3.28Å; T1225-K1228 WeakPolarHBondContact OG1-CE 3.32Å; T1225-K1228 WeakPolarHBondContact OG1-CG 3.42Å; T1225-K1228 PolarHBondContact OG1-NZ 3.14Å; T1225-K1228 VanDerWaalsContact OG1-NZ 3.08Å; T1225-Q1229 PolarHBondContact O-N 3.35Å; T1225-K1266 WeakPolarHBondContact CB-O 3.2Å; T1225-K1266 WeakPolarHBondContact CG2-O 3.39Å; T1225-N1267 CarbonylContact C-O 3.17Å; T1225-N1267 WeakPolarHBondContact CA-O 3.42Å; T1225-N1267 VanDerWaalsContact CB-O 3.23Å; T1225-N1267 WeakPolarHBondContact CB-O 3.42Å; T1225-Y1268 HydrophobicContact CG2-CD1 4.23Å; T1225-Y1268 HydrophobicContact CG2-CD2 4.14Å; T1225-Y1268 HydrophobicContact CG2-CE1 3.96Å; T1225-Y1268 HydrophobicContact CG2-CE2 3.87Å; T1225-Y1268 HydrophobicContact CG2-CG 4.31Å
1226	I	81.9	Confident	79.9	Confident	7 Å²	7	32.8 Å²	32.8	4%	0.036	17%	0.165	C	C	.	.	H	α-helix	trans	-49.4	-47.8	-173.1	-62	-58.1	0	0	0	111.6	L1220 K1228 Q1229 V1230 L1253 N1267 P1269 F1272	L1220-I1226 HydrophobicContact CD1-CD1 3.93Å; I1226-K1228 VanDerWaalsContact C-N 3.28Å; I1226-K1228 PolarHBondContact O-N 2.92Å; I1226-Q1229 WeakPolarHBondContact O-CA 3.44Å; I1226-Q1229 WeakPolarHBondContact O-CB 3.44Å; I1226-Q1229 PolarHBondContact O-N 3.23Å; I1226-V1230 HydrophobicContact CG2-CG2 4.11Å; I1226-V1230 WeakPolarHBondContact O-CG2 3.28Å; I1226-V1230 PolarHBondContact O-N 3.05Å; I1226-L1253 HydrophobicContact CG2-CD1 4.39Å; I1226-L1253 HydrophobicContact CG2-CD2 4.22Å; I1226-N1267 PolarHBondContact N-O 3.39Å; I1226-P1269 HydrophobicContact CD1-CB 4.4Å; I1226-P1269 HydrophobicContact CD1-CG 4.02Å; I1226-F1272 HydrophobicContact CD1-CD2 4.44Å; I1226-F1272 HydrophobicContact CG1-CD2 3.85Å; I1226-F1272 HydrophobicContact CG1-CE2 3.81Å
1227	G	83.6	Confident	81.1	Confident	0 Å²	0	33 Å²	33	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-57.1	-36.1	177.4	0	0	0	0	0	114.6	T1225 A1231 L1265	T1225-G1227 VanDerWaalsContact C-N 3.27Å; T1225-G1227 PolarHBondContact O-N 2.85Å; T1225-G1227 VanDerWaalsContact O-N 3.16Å; G1227-A1231 WeakPolarHBondContact O-CB 3.41Å; G1227-A1231 PolarHBondContact O-N 3.11Å; G1227-L1265 WeakPolarHBondContact CA-O 3.16Å; G1227-L1265 PolarHBondContact N-O 3.01Å
1228	K	86.1	Confident	82.2	Confident	105 Å²	105	34.1 Å²	34.1	46%	0.457	17%	0.165	S	C	.	.	H	α-helix	trans	-71.7	-34.1	175.6	-65.5	168.4	-169.3	131.3	0	111.4	M1224 T1225 I1226 E1232	M1224-K1228 HydrophobicContact CE-CB 4.03Å; T1225-K1228 WeakPolarHBondContact O-CA 3.18Å; T1225-K1228 WeakPolarHBondContact O-CB 3.35Å; T1225-K1228 PolarHBondContact O-N 3.29Å; T1225-K1228 VanDerWaalsContact OG1-CD 3.31Å; T1225-K1228 WeakPolarHBondContact OG1-CD 3.28Å; T1225-K1228 WeakPolarHBondContact OG1-CE 3.32Å; T1225-K1228 WeakPolarHBondContact OG1-CG 3.42Å; T1225-K1228 PolarHBondContact OG1-NZ 3.14Å; T1225-K1228 VanDerWaalsContact OG1-NZ 3.08Å; I1226-K1228 VanDerWaalsContact C-N 3.28Å; I1226-K1228 PolarHBondContact O-N 2.92Å; K1228-E1232 WeakPolarHBondContact O-CB 3.39Å; K1228-E1232 PolarHBondContact O-N 3.08Å
1229	Q	87.7	Confident	82.7	Confident	5 Å²	5	40.2 Å²	40.2	2%	0.023	20%	0.195	C	C	.	.	H	α-helix	trans	-75.5	-36.7	179.5	-62	-159.8	58.1	0	0	112.9	K765 D1221 M1224 T1225 I1226 E1232	K765-Q1229 PolarHBondContact NZ-O 3.19Å; D1221-Q1229 PolarHBondContact O-NE2 3.02Å; M1224-Q1229 HydrophobicContact CB-CG 3.61Å; M1224-Q1229 HydrophobicContact CE-CG 4.26Å; M1224-Q1229 PolarHBondContact O-NE2 3.12Å; T1225-Q1229 PolarHBondContact O-N 3.35Å; I1226-Q1229 WeakPolarHBondContact O-CA 3.44Å; I1226-Q1229 WeakPolarHBondContact O-CB 3.44Å; I1226-Q1229 PolarHBondContact O-N 3.23Å; Q1229-E1232 WeakPolarHBondContact O-CB 3.18Å
1230	V	86	Confident	83.3	Confident	44 Å²	44	42 Å²	42	27%	0.267	21%	0.206	S	C	.	.	H	α-helix	trans	-72.8	-47.7	174.1	176.4	0	0	0	0	110.4	I1226 E1232 S1233 A1249 L1252	I1226-V1230 HydrophobicContact CG2-CG2 4.11Å; I1226-V1230 WeakPolarHBondContact O-CG2 3.28Å; I1226-V1230 PolarHBondContact O-N 3.05Å; V1230-E1232 PolarHBondContact O-N 2.94Å; V1230-S1233 PolarHBondContact O-N 3.2Å; V1230-A1249 HydrophobicContact CB-CB 3.91Å; V1230-A1249 HydrophobicContact CG1-CB 3.63Å; V1230-L1252 HydrophobicContact CG1-CB 4.41Å; V1230-L1252 HydrophobicContact CG1-CD1 3.99Å
1231	A	88	Confident	83.6	Confident	2 Å²	2	42.9 Å²	42.9	2%	0.017	22%	0.215	C	C	.	.	H	α-helix	trans	-60.7	-17.7	175.8	0	0	0	0	0	113.8	G1227 L1234 R1235 S1245 L1246 A1249	G1227-A1231 WeakPolarHBondContact O-CB 3.41Å; G1227-A1231 PolarHBondContact O-N 3.11Å; A1231-L1234 PolarHBondContact O-N 2.59Å; A1231-R1235 WeakPolarHBondContact O-CB 3.36Å; A1231-R1235 VanDerWaalsContact O-CG 3.28Å; A1231-R1235 WeakPolarHBondContact O-CG 3.25Å; A1231-R1235 PolarHBondContact O-N 3.34Å; A1231-S1245 VanDerWaalsContact CB-O 3.23Å; A1231-S1245 WeakPolarHBondContact CB-O 3.35Å; A1231-L1246 HydrophobicContact CB-CD2 3.97Å; A1231-L1246 HydrophobicContact CB-CG 4.47Å; A1231-A1249 HydrophobicContact CB-CB 4.2Å
1232	E	88.4	Confident	83.5	Confident	5 Å²	5	50 Å²	50	2%	0.023	25%	0.246	C	C	.	.	H	α-helix	trans	-65.9	-44.2	-178.1	-174.7	152.9	-119.3	0	0	113.6	K765 L767 R775 H776 K1228 Q1229 V1230 L1234 R1235 K1236	K765-E1232 HydrophobicContact CD-CB 4.49Å; K765-E1232 HydrophobicContact CD-CG 4.5Å; K765-E1232 IonicContact NZ-OE2 3.72Å; L767-E1232 HydrophobicContact CD1-CG 4.06Å; L767-E1232 HydrophobicContact CD2-CG 4.26Å; R775-E1232 WeakPolarHBondContact CD-OE1 3.32Å; R775-E1232 IonicContact CZ-OE1 3.58Å; R775-E1232 IonicContact NE-OE1 2.69Å; R775-E1232 IonicContact NH1-OE1 3.61Å; R775-E1232 PolarHBondContact NH1-OE1 2.92Å; H776-E1232 IonicContact CE1-OE1 3.27Å; H776-E1232 IonicContact CE1-OE2 2.91Å; H776-E1232 PolarHBondContact CE1-OE2 3.34Å; H776-E1232 VanDerWaalsContact CE1-OE2 3.3Å; H776-E1232 IonicContact NE2-OE1 2.59Å; H776-E1232 IonicContact NE2-OE2 3.75Å; H776-E1232 PolarHBondContact NE2-OE2 2.87Å; K1228-E1232 WeakPolarHBondContact O-CB 3.39Å; K1228-E1232 PolarHBondContact O-N 3.08Å; Q1229-E1232 WeakPolarHBondContact O-CB 3.18Å; V1230-E1232 PolarHBondContact O-N 2.94Å; E1232-L1234 VanDerWaalsContact C-N 3.33Å; E1232-R1235 PolarHBondContact O-N 3.34Å; E1232-K1236 WeakPolarHBondContact O-CB 2.77Å; E1232-K1236 PolarHBondContact O-N 3.45Å
1233	S	84.2	Confident	83.9	Confident	28 Å²	28	57.2 Å²	57.2	20%	0.196	28%	0.275	C	S	.	.	H	α-helix	trans	-65	-42.2	175.8	-169.3	0	0	0	0	110.5	G1206 V1230 R1235 K1236 H1237	G1206-S1233 PolarHBondContact O-OG 2.98Å; G1206-S1233 VanDerWaalsContact O-OG 3.08Å; V1230-S1233 PolarHBondContact O-N 3.2Å; S1233-R1235 PolarHBondContact O-N 3.37Å; S1233-K1236 WeakPolarHBondContact O-CB 3.26Å; S1233-K1236 PolarHBondContact O-N 2.84Å; S1233-H1237 PolarHBondContact O-CD2 2.84Å; S1233-H1237 PolarHBondContact O-N 3.15Å
1234	L	85.4	Confident	84.3	Confident	18 Å²	18	62.5 Å²	62.5	9%	0.094	30%	0.3	C	S	.	.	H	α-helix	trans	-57.9	-47.4	175.5	-63.3	173.6	0	0	0	111.6	A1231 E1232 K1236 H1237 K1238 A1248 L1252	A1231-L1234 PolarHBondContact O-N 2.59Å; E1232-L1234 VanDerWaalsContact C-N 3.33Å; L1234-K1236 PolarHBondContact O-N 2.88Å; L1234-H1237 PolarHBondContact O-N 2.88Å; L1234-K1238 HydrophobicContact CD2-CD 4.06Å; L1234-K1238 WeakPolarHBondContact O-CA 3.36Å; L1234-K1238 WeakPolarHBondContact O-CB 3.18Å; L1234-K1238 PolarHBondContact O-N 3.42Å; L1234-K1238 VanDerWaalsContact O-O 3.09Å; L1234-A1248 HydrophobicContact CD1-CB 3.65Å; L1234-L1252 HydrophobicContact CD1-CD1 4.11Å; L1234-L1252 HydrophobicContact CD2-CD1 4.45Å
1235	R	85.7	Confident	84.6	Confident	126 Å²	126	61.6 Å²	61.6	48%	0.475	30%	0.295	S	S	.	.	H	α-helix	trans	-71.6	-11.5	176.1	-68.9	179.1	69.7	-150	-3.4	114.7	A1231 E1232 S1233 V1240 S1245	A1231-R1235 WeakPolarHBondContact O-CB 3.36Å; A1231-R1235 VanDerWaalsContact O-CG 3.28Å; A1231-R1235 WeakPolarHBondContact O-CG 3.25Å; A1231-R1235 PolarHBondContact O-N 3.34Å; E1232-R1235 PolarHBondContact O-N 3.34Å; S1233-R1235 PolarHBondContact O-N 3.37Å; R1235-V1240 HydrophobicContact CG-CG2 4.33Å; R1235-S1245 VanDerWaalsContact CD-OG 3.28Å; R1235-S1245 WeakPolarHBondContact CD-OG 3.33Å; R1235-S1245 WeakPolarHBondContact CG-OG 3.29Å
1236	K	86	Confident	84.7	Confident	63 Å²	63	63.4 Å²	63.4	27%	0.274	30%	0.304	S	S	.	.	H	α-helix	trans	-89.8	-37.5	176.3	-174.2	55.3	166.8	-173.2	0	111.9	G766 L767 E771 E1232 S1233 L1234	G766-K1236 WeakPolarHBondContact O-CE 3.29Å; L767-K1236 HydrophobicContact CD2-CB 4.34Å; L767-K1236 HydrophobicContact CD2-CD 3.92Å; L767-K1236 HydrophobicContact CD2-CG 4.07Å; E771-K1236 IonicContact OE1-NZ 2.75Å; E771-K1236 PolarHBondContact OE1-NZ 2.88Å; E771-K1236 IonicContact OE2-NZ 3.28Å; E771-K1236 PolarHBondContact OE2-NZ 3.27Å; E1232-K1236 WeakPolarHBondContact O-CB 2.77Å; E1232-K1236 PolarHBondContact O-N 3.45Å; S1233-K1236 WeakPolarHBondContact O-CB 3.26Å; S1233-K1236 PolarHBondContact O-N 2.84Å; L1234-K1236 PolarHBondContact O-N 2.88Å
1237	H	86.9	Confident	84.9	Confident	34 Å²	34	69.4 Å²	69.4	16%	0.157	33%	0.33	C	S	.	.	H	α-helix	trans	-112.8	-17.1	-169.6	-62.9	-61.1	0	0	0	115.2	K765 Q1202 R1205 G1206 R1207 S1233 L1234	K765-H1237 PolarHBondContact O-NE2 3.49Å; Q1202-H1237 PolarHBondContact O-CE1 2.93Å; R1205-H1237 PolarHBondContact O-CE1 3Å; R1205-H1237 VanDerWaalsContact O-CE1 3.23Å; R1205-H1237 PolarHBondContact O-NE2 2.76Å; G1206-H1237 PolarHBondContact O-CD2 3.12Å; R1207-H1237 HydrophobicContact CB-CB 4.14Å; R1207-H1237 HydrophobicContact CG-CB 4.24Å; S1233-H1237 PolarHBondContact O-CD2 2.84Å; S1233-H1237 PolarHBondContact O-N 3.15Å; L1234-H1237 PolarHBondContact O-N 2.88Å
1238	K	81.9	Confident	84.9	Confident	129 Å²	129	70.9 Å²	70.9	56%	0.561	34%	0.343	S	S	*	.	S	Bend	trans	-117.2	143.1	173.2	-54.2	-178.3	-179	178.7	0	109	L1234 V1240	L1234-K1238 HydrophobicContact CD2-CD 4.06Å; L1234-K1238 WeakPolarHBondContact O-CA 3.36Å; L1234-K1238 WeakPolarHBondContact O-CB 3.18Å; L1234-K1238 PolarHBondContact O-N 3.42Å; L1234-K1238 VanDerWaalsContact O-O 3.09Å; K1238-V1240 VanDerWaalsContact C-N 3.3Å; K1238-V1240 HydrophobicContact CB-CG1 3.97Å; K1238-V1240 HydrophobicContact CB-CG2 4.19Å; K1238-V1240 PolarHBondContact O-N 3.45Å
1239	D	78.8	Confident	84.9	Confident	179 Å²	179	65.9 Å²	65.9	96%	0.957	32%	0.321	S	S	*	.			trans	-81.5	80.5	175.6	-164.8	17	0	0	0	109.1
1240	V	86.2	Confident	84.8	Confident	44 Å²	44	66.9 Å²	66.9	27%	0.267	33%	0.326	S	S	.	.			trans	-127.4	140.4	-173.8	-69.5	0	0	0	0	111.7	R1235 K1238 E1244	R1235-V1240 HydrophobicContact CG-CG2 4.33Å; K1238-V1240 VanDerWaalsContact C-N 3.3Å; K1238-V1240 HydrophobicContact CB-CG1 3.97Å; K1238-V1240 HydrophobicContact CB-CG2 4.19Å; K1238-V1240 PolarHBondContact O-N 3.45Å; V1240-E1244 HydrophobicContact CB-CB 4.23Å
1241	S	84.4	Confident	84.6	Confident	56 Å²	56	68.6 Å²	68.6	39%	0.392	33%	0.334	S	S	.	.			trans	-66.4	165.4	175.3	74.5	0	0	0	0	111.9	K1243 E1244 S1245	S1241-K1243 PolarHBondContact O-N 2.76Å; S1241-K1243 PolarHBondContact OG-N 2.97Å; S1241-E1244 WeakPolarHBondContact CA-OE2 3.48Å; S1241-E1244 WeakPolarHBondContact CB-OE2 3.33Å; S1241-E1244 PolarHBondContact N-OE2 3.33Å; S1241-E1244 PolarHBondContact O-N 3.47Å; S1241-E1244 PolarHBondContact OG-N 3Å; S1241-E1244 PolarHBondContact OG-OE2 3.23Å; S1241-S1245 WeakPolarHBondContact O-CB 3.38Å; S1241-S1245 PolarHBondContact O-N 3.36Å; S1241-S1245 PolarHBondContact O-OG 3.41Å; S1241-S1245 VanDerWaalsContact O-OG 3.11Å
1242	K	80	Confident	84.3	Confident	148 Å²	148	71.8 Å²	71.8	64%	0.643	35%	0.35	S	S	*	.	H	α-helix	trans	-53.9	-38	173.6	-175	-174.9	172.9	-169.2	0	111.9	S1245 L1246	K1242-S1245 PolarHBondContact O-OG 3.14Å; K1242-L1246 HydrophobicContact CG-CD1 4.29Å; K1242-L1246 WeakPolarHBondContact O-CD1 3.46Å; K1242-L1246 VanDerWaalsContact O-CG 3.28Å; K1242-L1246 WeakPolarHBondContact O-CG 3.39Å; K1242-L1246 PolarHBondContact O-N 3.18Å
1243	K	79.5	Confident	83.7	Confident	177 Å²	177	72 Å²	72	77%	0.77	35%	0.351	S	S	*	.	H	α-helix	trans	-72.5	-48.9	-179	-168.3	177.3	-178.3	-178.9	0	111.5	S1241 S1245 L1246 K1247	S1241-K1243 PolarHBondContact O-N 2.76Å; S1241-K1243 PolarHBondContact OG-N 2.97Å; K1243-S1245 VanDerWaalsContact C-N 3.33Å; K1243-S1245 PolarHBondContact O-N 3.17Å; K1243-L1246 PolarHBondContact O-N 3.21Å; K1243-K1247 PolarHBondContact O-N 2.93Å
1244	E	83.8	Confident	83.3	Confident	113 Å²	113	75.1 Å²	75.1	53%	0.528	37%	0.366	S	S	.	.	H	α-helix	trans	-62.3	-40.4	179.3	-67.5	153.8	137.3	0	0	111.8	V1240 S1241 L1246 K1247 A1248	V1240-E1244 HydrophobicContact CB-CB 4.23Å; S1241-E1244 WeakPolarHBondContact CA-OE2 3.48Å; S1241-E1244 WeakPolarHBondContact CB-OE2 3.33Å; S1241-E1244 PolarHBondContact N-OE2 3.33Å; S1241-E1244 PolarHBondContact O-N 3.47Å; S1241-E1244 PolarHBondContact OG-N 3Å; S1241-E1244 PolarHBondContact OG-OE2 3.23Å; E1244-L1246 VanDerWaalsContact C-N 3.28Å; E1244-L1246 PolarHBondContact O-N 2.9Å; E1244-K1247 PolarHBondContact O-N 2.91Å; E1244-A1248 WeakPolarHBondContact O-CB 3.35Å; E1244-A1248 PolarHBondContact O-N 3.43Å
1245	S	87.6	Confident	82.6	Confident	1 Å²	1	76.9 Å²	76.9	1%	0.007	38%	0.375	C	S	.	.	H	α-helix	trans	-65.5	-28.5	177.7	67.8	0	0	0	0	114.3	A1231 R1235 S1241 K1242 K1243 A1249	A1231-S1245 VanDerWaalsContact CB-O 3.23Å; A1231-S1245 WeakPolarHBondContact CB-O 3.35Å; R1235-S1245 VanDerWaalsContact CD-OG 3.28Å; R1235-S1245 WeakPolarHBondContact CD-OG 3.33Å; R1235-S1245 WeakPolarHBondContact CG-OG 3.29Å; S1241-S1245 WeakPolarHBondContact O-CB 3.38Å; S1241-S1245 PolarHBondContact O-N 3.36Å; S1241-S1245 PolarHBondContact O-OG 3.41Å; S1241-S1245 VanDerWaalsContact O-OG 3.11Å; K1242-S1245 PolarHBondContact O-OG 3.14Å; K1243-S1245 VanDerWaalsContact C-N 3.33Å; K1243-S1245 PolarHBondContact O-N 3.17Å; S1245-A1249 WeakPolarHBondContact O-CB 3.31Å; S1245-A1249 PolarHBondContact O-N 2.93Å; S1245-A1249 VanDerWaalsContact O-N 3.14Å
1246	L	86.3	Confident	81.8	Confident	47 Å²	47	73.3 Å²	73.3	25%	0.246	37%	0.367	C	S	.	.	H	α-helix	trans	-79.2	-38.4	174.5	-68	166.8	0	0	0	110.4	A1231 K1242 K1243 E1244 A1249 L1250 L1265	A1231-L1246 HydrophobicContact CB-CD2 3.97Å; A1231-L1246 HydrophobicContact CB-CG 4.47Å; K1242-L1246 HydrophobicContact CG-CD1 4.29Å; K1242-L1246 WeakPolarHBondContact O-CD1 3.46Å; K1242-L1246 VanDerWaalsContact O-CG 3.28Å; K1242-L1246 WeakPolarHBondContact O-CG 3.39Å; K1242-L1246 PolarHBondContact O-N 3.18Å; K1243-L1246 PolarHBondContact O-N 3.21Å; E1244-L1246 VanDerWaalsContact C-N 3.28Å; E1244-L1246 PolarHBondContact O-N 2.9Å; L1246-A1249 WeakPolarHBondContact O-CB 3.34Å; L1246-A1249 PolarHBondContact O-N 3Å; L1246-A1249 VanDerWaalsContact O-N 3.14Å; L1246-L1250 PolarHBondContact O-N 3.31Å; L1246-L1265 HydrophobicContact CD2-CD2 3.98Å; L1246-L1265 WeakPolarHBondContact O-CD1 3.09Å
1247	K	86.4	Confident	80.6	Confident	134 Å²	134	73 Å²	73	58%	0.583	38%	0.382	S	S	*	.	H	α-helix	trans	-60.3	-49.2	170.7	-173.7	-179.8	175.8	179.6	0	111.3	K1243 E1244 A1249 L1250 D1251	K1243-K1247 PolarHBondContact O-N 2.93Å; E1244-K1247 PolarHBondContact O-N 2.91Å; K1247-A1249 PolarHBondContact O-N 2.9Å; K1247-A1249 VanDerWaalsContact O-N 3.14Å; K1247-L1250 WeakPolarHBondContact O-CA 3.12Å; K1247-L1250 VanDerWaalsContact O-CB 3.27Å; K1247-L1250 WeakPolarHBondContact O-CB 3.34Å; K1247-L1250 PolarHBondContact O-N 2.86Å; K1247-D1251 PolarHBondContact O-N 2.83Å
1248	A	84.5	Confident	79.5	Confident	31 Å²	31	72.7 Å²	72.7	26%	0.256	38%	0.381	S	S	.	.	H	α-helix	trans	-66.8	-14.9	177.1	0	0	0	0	0	113.6	L1234 E1244 D1251 L1252	L1234-A1248 HydrophobicContact CD1-CB 3.65Å; E1244-A1248 WeakPolarHBondContact O-CB 3.35Å; E1244-A1248 PolarHBondContact O-N 3.43Å; A1248-D1251 WeakPolarHBondContact CA-OD2 3.34Å; A1248-L1252 WeakPolarHBondContact O-CD1 3.38Å; A1248-L1252 VanDerWaalsContact O-CG 3.25Å; A1248-L1252 WeakPolarHBondContact O-CG 3.18Å; A1248-L1252 PolarHBondContact O-N 3.31Å
1249	A	85.9	Confident	78.1	Confident	0 Å²	0	70.5 Å²	70.5	0%	0	38%	0.38	C	S	.	.	H	α-helix	trans	-80.9	-35.8	167.3	0	0	0	0	0	112.5	V1230 A1231 S1245 L1246 K1247 L1252 L1253	V1230-A1249 HydrophobicContact CB-CB 3.91Å; V1230-A1249 HydrophobicContact CG1-CB 3.63Å; A1231-A1249 HydrophobicContact CB-CB 4.2Å; S1245-A1249 WeakPolarHBondContact O-CB 3.31Å; S1245-A1249 PolarHBondContact O-N 2.93Å; S1245-A1249 VanDerWaalsContact O-N 3.14Å; L1246-A1249 WeakPolarHBondContact O-CB 3.34Å; L1246-A1249 PolarHBondContact O-N 3Å; L1246-A1249 VanDerWaalsContact O-N 3.14Å; K1247-A1249 PolarHBondContact O-N 2.9Å; K1247-A1249 VanDerWaalsContact O-N 3.14Å; A1249-L1252 PolarHBondContact O-N 2.9Å; A1249-L1253 WeakPolarHBondContact O-CG 3.37Å; A1249-L1253 PolarHBondContact O-N 3.05Å
1250	L	84.3	Confident	77.4	Confident	25 Å²	25	65 Å²	65	13%	0.131	35%	0.351	C	S	.	.	H	α-helix	trans	-61.9	-48.1	169.1	175.1	55.3	0	0	0	111	L1246 K1247 L1252 L1253 N1254 A1261 E1262 L1265	L1246-L1250 PolarHBondContact O-N 3.31Å; K1247-L1250 WeakPolarHBondContact O-CA 3.12Å; K1247-L1250 VanDerWaalsContact O-CB 3.27Å; K1247-L1250 WeakPolarHBondContact O-CB 3.34Å; K1247-L1250 PolarHBondContact O-N 2.86Å; L1250-L1252 PolarHBondContact O-N 3.24Å; L1250-L1253 PolarHBondContact O-N 2.86Å; L1250-L1253 VanDerWaalsContact O-N 3.1Å; L1250-N1254 PolarHBondContact O-N 2.92Å; L1250-N1254 PolarHBondContact O-ND2 3.32Å; L1250-A1261 HydrophobicContact CD1-CB 3.49Å; L1250-A1261 VanDerWaalsContact CD1-CB 3.49Å; L1250-E1262 HydrophobicContact CD1-CB 3.79Å; L1250-E1262 VanDerWaalsContact CD1-N 3.35Å; L1250-E1262 HydrophobicContact CD2-CB 4.04Å; L1250-E1262 HydrophobicContact CD2-CG 4.34Å; L1250-E1262 WeakPolarHBondContact CD2-OE2 3.35Å; L1250-L1265 HydrophobicContact CB-CD1 3.63Å
1251	D	81.5	Confident	76.6	Confident	80 Å²	80	63.1 Å²	63.1	43%	0.428	34%	0.34	S	S	.	.	H	α-helix	trans	-57	-36	177.1	-57.4	-33.1	0	0	0	111.3	K1247 A1248 L1255	K1247-D1251 PolarHBondContact O-N 2.83Å; A1248-D1251 WeakPolarHBondContact CA-OD2 3.34Å; D1251-L1255 WeakPolarHBondContact O-CB 3.4Å; D1251-L1255 PolarHBondContact O-N 3.19Å; D1251-L1255 VanDerWaalsContact O-N 3.07Å
1252	L	81.7	Confident	76	Confident	70 Å²	70	65.1 Å²	65.1	37%	0.366	34%	0.343	S	S	.	.	H	α-helix	trans	-74.3	-38	174.9	-75.8	171.6	0	0	0	113.8	V1230 L1234 A1248 A1249 L1250 L1255 V1256	V1230-L1252 HydrophobicContact CG1-CB 4.41Å; V1230-L1252 HydrophobicContact CG1-CD1 3.99Å; L1234-L1252 HydrophobicContact CD1-CD1 4.11Å; L1234-L1252 HydrophobicContact CD2-CD1 4.45Å; A1248-L1252 WeakPolarHBondContact O-CD1 3.38Å; A1248-L1252 VanDerWaalsContact O-CG 3.25Å; A1248-L1252 WeakPolarHBondContact O-CG 3.18Å; A1248-L1252 PolarHBondContact O-N 3.31Å; A1249-L1252 PolarHBondContact O-N 2.9Å; L1250-L1252 PolarHBondContact O-N 3.24Å; L1252-L1255 HydrophobicContact CD2-CD2 4.09Å; L1252-L1255 WeakPolarHBondContact O-CB 3.43Å; L1252-L1255 PolarHBondContact O-N 3.38Å; L1252-V1256 WeakPolarHBondContact O-CG2 3.38Å; L1252-V1256 PolarHBondContact O-N 2.98Å; L1252-V1256 VanDerWaalsContact O-N 3.14Å
1253	L	76.2	Confident	75.2	Confident	9 Å²	9	60.6 Å²	60.6	5%	0.047	32%	0.323	C	S	.	.	H	α-helix	trans	-66.5	-40.4	176.1	-74.4	170.3	0	0	0	111.3	I1226 A1249 L1250 L1255 V1256 G1257 I1258 A1261 L1265	I1226-L1253 HydrophobicContact CG2-CD1 4.39Å; I1226-L1253 HydrophobicContact CG2-CD2 4.22Å; A1249-L1253 WeakPolarHBondContact O-CG 3.37Å; A1249-L1253 PolarHBondContact O-N 3.05Å; L1250-L1253 PolarHBondContact O-N 2.86Å; L1250-L1253 VanDerWaalsContact O-N 3.1Å; L1253-L1255 VanDerWaalsContact C-N 3.33Å; L1253-V1256 PolarHBondContact O-N 3.07Å; L1253-G1257 PolarHBondContact O-N 3.13Å; L1253-I1258 HydrophobicContact CB-CB 4.49Å; L1253-I1258 HydrophobicContact CD2-CB 4.47Å; L1253-I1258 HydrophobicContact CD2-CG1 4.24Å; L1253-I1258 WeakPolarHBondContact O-CB 3.5Å; L1253-I1258 PolarHBondContact O-N 2.93Å; L1253-I1258 VanDerWaalsContact O-N 3.12Å; L1253-A1261 HydrophobicContact CB-CB 3.7Å; L1253-L1265 HydrophobicContact CD1-CB 4.32Å
1254	N	75.2	Confident	74.7	Confident	93 Å²	93	54.8 Å²	54.8	50%	0.497	30%	0.297	S	S	.	.	H	α-helix	trans	-62.1	-39.5	170.3	-72	-37.1	0	0	0	111.8	L1250 V1256 G1257 A1261	L1250-N1254 PolarHBondContact O-N 2.92Å; L1250-N1254 PolarHBondContact O-ND2 3.32Å; N1254-V1256 VanDerWaalsContact C-N 3.31Å; N1254-V1256 PolarHBondContact O-N 2.97Å; N1254-G1257 PolarHBondContact O-N 3.14Å; N1254-A1261 WeakPolarHBondContact OD1-CB 3.49Å
1255	L	71.9	Confident	74.4	Confident	55 Å²	55	50.5 Å²	50.5	29%	0.288	28%	0.277	S	S	.	.	H	α-helix	trans	-63.3	-34.1	179.6	177.6	62.2	0	0	0	113.1	D1251 L1252 L1253 G1257 K1303 I1304	D1251-L1255 WeakPolarHBondContact O-CB 3.4Å; D1251-L1255 PolarHBondContact O-N 3.19Å; D1251-L1255 VanDerWaalsContact O-N 3.07Å; L1252-L1255 HydrophobicContact CD2-CD2 4.09Å; L1252-L1255 WeakPolarHBondContact O-CB 3.43Å; L1252-L1255 PolarHBondContact O-N 3.38Å; L1253-L1255 VanDerWaalsContact C-N 3.33Å; L1255-G1257 VanDerWaalsContact C-N 3.34Å; L1255-K1303 HydrophobicContact CD1-CD 3.75Å; L1255-K1303 HydrophobicContact CD1-CG 4.48Å; L1255-I1304 HydrophobicContact CD2-CD1 4.22Å
1256	V	68.1	Low	74	Confident	51 Å²	51	56.5 Å²	56.5	31%	0.309	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95	19.9	177.7	-58.9	0	0	0	0	113.4	L1252 L1253 N1254 I1258 I1300	L1252-V1256 WeakPolarHBondContact O-CG2 3.38Å; L1252-V1256 PolarHBondContact O-N 2.98Å; L1252-V1256 VanDerWaalsContact O-N 3.14Å; L1253-V1256 PolarHBondContact O-N 3.07Å; N1254-V1256 VanDerWaalsContact C-N 3.31Å; N1254-V1256 PolarHBondContact O-N 2.97Å; V1256-I1258 VanDerWaalsContact C-N 3.35Å; V1256-I1258 HydrophobicContact CG2-CG1 3.83Å; V1256-I1258 PolarHBondContact O-N 3.23Å; V1256-I1300 HydrophobicContact CB-CD1 4.41Å; V1256-I1300 HydrophobicContact CG1-CD1 3.79Å
1257	G	61.3	Low	73.4	Confident	58 Å²	58	55.8 Å²	55.8	60%	0.598	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.6	14.1	169.9	0	0	0	0	0	116.4	L1253 N1254 L1255 P1259	L1253-G1257 PolarHBondContact O-N 3.13Å; N1254-G1257 PolarHBondContact O-N 3.14Å; L1255-G1257 VanDerWaalsContact C-N 3.34Å; G1257-P1259 VanDerWaalsContact O-CD 3.31Å; G1257-P1259 WeakPolarHBondContact O-CD 3.47Å
1258	I	63.4	Low	72.7	Confident	26 Å²	26	52.1 Å²	52.1	13%	0.133	28%	0.282	C	S	.	.			trans	-74.3	119.6	-177	-62.8	-61.7	0	0	0	110.9	L1253 V1256 R1264 F1272 I1275	L1253-I1258 HydrophobicContact CB-CB 4.49Å; L1253-I1258 HydrophobicContact CD2-CB 4.47Å; L1253-I1258 HydrophobicContact CD2-CG1 4.24Å; L1253-I1258 WeakPolarHBondContact O-CB 3.5Å; L1253-I1258 PolarHBondContact O-N 2.93Å; L1253-I1258 VanDerWaalsContact O-N 3.12Å; V1256-I1258 VanDerWaalsContact C-N 3.35Å; V1256-I1258 HydrophobicContact CG2-CG1 3.83Å; V1256-I1258 PolarHBondContact O-N 3.23Å; I1258-R1264 HydrophobicContact CG2-CB 4.28Å; I1258-R1264 HydrophobicContact CG2-CG 3.94Å; I1258-F1272 HydrophobicContact CG2-CE1 4.23Å; I1258-F1272 HydrophobicContact CG2-CZ 3.95Å; I1258-I1275 HydrophobicContact CD1-CD1 3.71Å; I1258-I1275 HydrophobicContact CD1-CG1 3.7Å; I1258-I1275 HydrophobicContact CG1-CD1 4.17Å
1259	P	52.7	Low	71.7	Confident	83 Å²	83	50.9 Å²	50.9	54%	0.539	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.1	151.4	175.3	-22	34.4	0	0	0	112.5	G1257 A1261 R1264	G1257-P1259 VanDerWaalsContact O-CD 3.31Å; G1257-P1259 WeakPolarHBondContact O-CD 3.47Å; P1259-A1261 PolarHBondContact O-N 3.23Å; P1259-R1264 WeakPolarHBondContact O-CG 3.47Å
1260	D	64.3	Low	70.6	Confident	65 Å²	65	54.2 Å²	54.2	35%	0.348	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.5	38	179.3	-40.4	-42.1	0	0	0	113.5	E1262 K1263 R1264	D1260-E1262 PolarHBondContact O-N 3.24Å; D1260-K1263 HydrophobicContact CB-CB 3.94Å; D1260-K1263 HydrophobicContact CB-CD 3.98Å; D1260-K1263 WeakPolarHBondContact O-CA 3.35Å; D1260-K1263 VanDerWaalsContact O-CB 3.3Å; D1260-K1263 WeakPolarHBondContact O-CB 3.28Å; D1260-K1263 PolarHBondContact O-N 3.06Å; D1260-R1264 HydrophobicContact CB-CG 4.46Å; D1260-R1264 WeakPolarHBondContact O-CG 3.37Å; D1260-R1264 PolarHBondContact O-N 2.92Å
1261	A	70.3	Confident	69.1	Low	4 Å²	4	57.5 Å²	57.5	3%	0.033	30%	0.302	C	S	.	.	H	α-helix	trans	-48.8	-35.2	-168.4	0	0	0	0	0	114.9	L1250 L1253 N1254 P1259 L1265	L1250-A1261 HydrophobicContact CD1-CB 3.49Å; L1250-A1261 VanDerWaalsContact CD1-CB 3.49Å; L1253-A1261 HydrophobicContact CB-CB 3.7Å; N1254-A1261 WeakPolarHBondContact OD1-CB 3.49Å; P1259-A1261 PolarHBondContact O-N 3.23Å; A1261-L1265 WeakPolarHBondContact O-CB 3.39Å; A1261-L1265 PolarHBondContact O-N 3.29Å
1262	E	71.4	Confident	67.5	Low	98 Å²	98	54.4 Å²	54.4	46%	0.458	29%	0.285	S	S	.	.	H	α-helix	trans	-76.2	-29.2	177.8	-177.3	149.5	-167.9	0	0	114.1	L1250 D1260 K1266	L1250-E1262 HydrophobicContact CD1-CB 3.79Å; L1250-E1262 VanDerWaalsContact CD1-N 3.35Å; L1250-E1262 HydrophobicContact CD2-CB 4.04Å; L1250-E1262 HydrophobicContact CD2-CG 4.34Å; L1250-E1262 WeakPolarHBondContact CD2-OE2 3.35Å; D1260-E1262 PolarHBondContact O-N 3.24Å; E1262-K1266 VanDerWaalsContact O-CE 3.24Å; E1262-K1266 WeakPolarHBondContact O-CE 3.32Å
1263	K	62.6	Low	65.2	Low	52 Å²	52	55.4 Å²	55.4	23%	0.226	30%	0.298	C	S	.	.	H	α-helix	trans	-68	-54.7	166	173.9	-172.9	-174	164.9	0	109.3	E233 D1260 L1265 K1266 N1267	E233-K1263 HydrophobicContact CG-CD 4.43Å; E233-K1263 WeakPolarHBondContact OE1-CD 3.42Å; E233-K1263 WeakPolarHBondContact OE1-CE 3.43Å; E233-K1263 WeakPolarHBondContact OE1-CG 3.38Å; E233-K1263 IonicContact OE1-NZ 2.59Å; E233-K1263 WeakPolarHBondContact OE2-CE 3.47Å; E233-K1263 IonicContact OE2-NZ 3.24Å; E233-K1263 PolarHBondContact OE2-NZ 3.45Å; D1260-K1263 HydrophobicContact CB-CB 3.94Å; D1260-K1263 HydrophobicContact CB-CD 3.98Å; D1260-K1263 WeakPolarHBondContact O-CA 3.35Å; D1260-K1263 VanDerWaalsContact O-CB 3.3Å; D1260-K1263 WeakPolarHBondContact O-CB 3.28Å; D1260-K1263 PolarHBondContact O-N 3.06Å; K1263-L1265 PolarHBondContact O-N 3.2Å; K1263-L1265 VanDerWaalsContact O-N 3.12Å; K1263-K1266 WeakPolarHBondContact O-CA 3.48Å; K1263-K1266 VanDerWaalsContact O-CB 3.3Å; K1263-K1266 WeakPolarHBondContact O-CB 3.31Å; K1263-K1266 PolarHBondContact O-N 2.95Å; K1263-N1267 PolarHBondContact O-OD1 2.75Å
1264	R	69	Low	62.9	Low	56 Å²	56	62.9 Å²	62.9	21%	0.211	33%	0.333	C	S	.	.	H	α-helix	trans	-55.6	-31.4	179.9	-65.4	-53.4	-175.7	125.4	-1	113.6	I1258 P1259 D1260 K1266 N1267 F1272	I1258-R1264 HydrophobicContact CG2-CB 4.28Å; I1258-R1264 HydrophobicContact CG2-CG 3.94Å; P1259-R1264 WeakPolarHBondContact O-CG 3.47Å; D1260-R1264 HydrophobicContact CB-CG 4.46Å; D1260-R1264 WeakPolarHBondContact O-CG 3.37Å; D1260-R1264 PolarHBondContact O-N 2.92Å; R1264-K1266 PolarHBondContact O-N 3.37Å; R1264-N1267 WeakPolarHBondContact O-CB 3.27Å; R1264-N1267 PolarHBondContact O-N 3.11Å; R1264-N1267 VanDerWaalsContact O-N 3.14Å; R1264-F1272 HydrophobicContact CB-CE2 3.64Å; R1264-F1272 HydrophobicContact CB-CZ 3.55Å; R1264-F1272 VanDerWaalsContact CD-CZ 3.47Å; R1264-F1272 HydrophobicContact CG-CE1 4.38Å; R1264-F1272 HydrophobicContact CG-CE2 3.99Å; R1264-F1272 HydrophobicContact CG-CZ 3.57Å; R1264-F1272 VanDerWaalsContact NH1-CD1 3.3Å
1265	L	78.3	Confident	60.9	Low	22 Å²	22	60.9 Å²	60.9	12%	0.115	32%	0.321	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.7	-30.1	172.6	-157.9	150.4	0	0	0	113.3	G1227 L1246 L1250 L1253 A1261 K1263	G1227-L1265 WeakPolarHBondContact CA-O 3.16Å; G1227-L1265 PolarHBondContact N-O 3.01Å; L1246-L1265 HydrophobicContact CD2-CD2 3.98Å; L1246-L1265 WeakPolarHBondContact O-CD1 3.09Å; L1250-L1265 HydrophobicContact CB-CD1 3.63Å; L1253-L1265 HydrophobicContact CD1-CB 4.32Å; A1261-L1265 WeakPolarHBondContact O-CB 3.39Å; A1261-L1265 PolarHBondContact O-N 3.29Å; K1263-L1265 PolarHBondContact O-N 3.2Å; K1263-L1265 VanDerWaalsContact O-N 3.12Å
1266	K	78.7	Confident	59.2	Low	127 Å²	127	60.3 Å²	60.3	55%	0.552	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.8	-21.7	-179	-55.9	158.4	-169.7	158.6	0	112.5	T1225 E1262 K1263 R1264	T1225-K1266 WeakPolarHBondContact CB-O 3.2Å; T1225-K1266 WeakPolarHBondContact CG2-O 3.39Å; E1262-K1266 VanDerWaalsContact O-CE 3.24Å; E1262-K1266 WeakPolarHBondContact O-CE 3.32Å; K1263-K1266 WeakPolarHBondContact O-CA 3.48Å; K1263-K1266 VanDerWaalsContact O-CB 3.3Å; K1263-K1266 WeakPolarHBondContact O-CB 3.31Å; K1263-K1266 PolarHBondContact O-N 2.95Å; R1264-K1266 PolarHBondContact O-N 3.37Å
1267	N	73.2	Confident	57.9	Low	32 Å²	32	62.2 Å²	62.2	17%	0.171	33%	0.326	C	S	.	.	S	Bend	trans	-67.8	156.6	179.7	-73.7	26.4	0	0	0	113.2	T1225 I1226 K1263 R1264 Q1271 F1272	T1225-N1267 CarbonylContact C-O 3.17Å; T1225-N1267 WeakPolarHBondContact CA-O 3.42Å; T1225-N1267 VanDerWaalsContact CB-O 3.23Å; T1225-N1267 WeakPolarHBondContact CB-O 3.42Å; I1226-N1267 PolarHBondContact N-O 3.39Å; K1263-N1267 PolarHBondContact O-OD1 2.75Å; R1264-N1267 WeakPolarHBondContact O-CB 3.27Å; R1264-N1267 PolarHBondContact O-N 3.11Å; R1264-N1267 VanDerWaalsContact O-N 3.14Å; N1267-Q1271 HydrophobicContact CB-CB 4.06Å; N1267-Q1271 PolarHBondContact ND2-O 2.73Å; N1267-F1272 HydrophobicContact CB-CD2 4.2Å; N1267-F1272 HydrophobicContact CB-CE2 4.39Å
1268	Y	71.9	Confident	57.6	Low	57 Å²	57	60.3 Å²	60.3	22%	0.224	30%	0.304	C	S	.	.			trans	-90.5	163.2	166	-66	-95.8	0	0	0	111.3	P1222 T1223 T1225 H1270 Q1271	P1222-Y1268 WeakPolarHBondContact O-CD1 3.42Å; T1223-Y1268 WeakPolarHBondContact O-CE1 3.28Å; T1225-Y1268 HydrophobicContact CG2-CD1 4.23Å; T1225-Y1268 HydrophobicContact CG2-CD2 4.14Å; T1225-Y1268 HydrophobicContact CG2-CE1 3.96Å; T1225-Y1268 HydrophobicContact CG2-CE2 3.87Å; T1225-Y1268 HydrophobicContact CG2-CG 4.31Å; Y1268-H1270 VanDerWaalsContact C-N 3.31Å; Y1268-H1270 WeakPolarHBondContact CB-CE1 3.35Å; Y1268-H1270 AromaticContact CG-CE1 3.94Å; Y1268-H1270 PolarHBondContact O-N 2.77Å; Y1268-Q1271 WeakPolarHBondContact O-CA 3.41Å; Y1268-Q1271 WeakPolarHBondContact O-CB 3.47Å; Y1268-Q1271 PolarHBondContact O-N 2.91Å
1269	P	63.8	Low	57.5	Low	5 Å²	5	61.7 Å²	61.7	3%	0.032	31%	0.312	C	S	.	.	G	3₁₀ helix	trans	-58.4	-34.7	-177.6	-27	35.7	0	0	0	115.3	L1220 I1226 Q1271 F1272	L1220-P1269 HydrophobicContact CB-CB 3.8Å; L1220-P1269 HydrophobicContact CB-CG 3.54Å; L1220-P1269 HydrophobicContact CD1-CB 4.27Å; L1220-P1269 HydrophobicContact CD1-CG 4.44Å; I1226-P1269 HydrophobicContact CD1-CB 4.4Å; I1226-P1269 HydrophobicContact CD1-CG 4.02Å; P1269-Q1271 PolarHBondContact O-N 2.95Å; P1269-F1272 VanDerWaalsContact O-CB 3.3Å; P1269-F1272 WeakPolarHBondContact O-CB 3.49Å; P1269-F1272 PolarHBondContact O-N 3.31Å
1270	H	62.3	Low	57.9	Low	71 Å²	71	59.1 Å²	59.1	33%	0.329	29%	0.292	S	S	.	.	G	3₁₀ helix	trans	-76	-8.3	175.3	56.7	-93.2	0	0	0	113.5	Y1268 F1272	Y1268-H1270 VanDerWaalsContact C-N 3.31Å; Y1268-H1270 WeakPolarHBondContact CB-CE1 3.35Å; Y1268-H1270 AromaticContact CG-CE1 3.94Å; Y1268-H1270 PolarHBondContact O-N 2.77Å; H1270-F1272 PolarHBondContact O-N 2.92Å
1271	Q	53.3	Low	57.7	Low	94 Å²	94	56.2 Å²	56.2	44%	0.439	28%	0.277	S	S	.	.	G	3₁₀ helix	trans	-97.2	34.6	171.3	-56.7	179.1	-50.2	0	0	110.4	N1267 Y1268 P1269	N1267-Q1271 HydrophobicContact CB-CB 4.06Å; N1267-Q1271 PolarHBondContact ND2-O 2.73Å; Y1268-Q1271 WeakPolarHBondContact O-CA 3.41Å; Y1268-Q1271 WeakPolarHBondContact O-CB 3.47Å; Y1268-Q1271 PolarHBondContact O-N 2.91Å; P1269-Q1271 PolarHBondContact O-N 2.95Å
1272	F	47.4	Very low	57.2	Low	14 Å²	14	56.3 Å²	56.3	6%	0.061	28%	0.277	C	S	.	.			trans	-148.2	92.9	-176.1	-114.5	-73.7	0	0	0	107.7	I1226 I1258 R1264 N1267 P1269 H1270 I1275	I1226-F1272 HydrophobicContact CD1-CD2 4.44Å; I1226-F1272 HydrophobicContact CG1-CD2 3.85Å; I1226-F1272 HydrophobicContact CG1-CE2 3.81Å; I1258-F1272 HydrophobicContact CG2-CE1 4.23Å; I1258-F1272 HydrophobicContact CG2-CZ 3.95Å; R1264-F1272 HydrophobicContact CB-CE2 3.64Å; R1264-F1272 HydrophobicContact CB-CZ 3.55Å; R1264-F1272 VanDerWaalsContact CD-CZ 3.47Å; R1264-F1272 HydrophobicContact CG-CE1 4.38Å; R1264-F1272 HydrophobicContact CG-CE2 3.99Å; R1264-F1272 HydrophobicContact CG-CZ 3.57Å; R1264-F1272 VanDerWaalsContact NH1-CD1 3.3Å; N1267-F1272 HydrophobicContact CB-CD2 4.2Å; N1267-F1272 HydrophobicContact CB-CE2 4.39Å; P1269-F1272 VanDerWaalsContact O-CB 3.3Å; P1269-F1272 WeakPolarHBondContact O-CB 3.49Å; P1269-F1272 PolarHBondContact O-N 3.31Å; H1270-F1272 PolarHBondContact O-N 2.92Å; F1272-I1275 HydrophobicContact CD1-CD1 3.91Å; F1272-I1275 HydrophobicContact CD1-CG1 3.73Å; F1272-I1275 HydrophobicContact CE1-CD1 3.38Å; F1272-I1275 HydrophobicContact CE1-CG1 3.52Å; F1272-I1275 HydrophobicContact CE2-CD1 4.4Å; F1272-I1275 HydrophobicContact CZ-CD1 3.63Å; F1272-I1275 HydrophobicContact CZ-CG1 4.29Å
1273	S	34.6	Very low	56.6	Low	92 Å²	92	53.9 Å²	53.9	64%	0.643	27%	0.27	S	S	*	.	S	Bend	trans	-64.3	143.9	144	46.6	0	0	0	0	108
1274	E	28.1	Very low	56.1	Low	166 Å²	166	55.5 Å²	55.5	78%	0.776	29%	0.292	S	S	*	.			trans	60.6	82.6	171.1	-62.1	162.2	-150.1	0	0	116.3
1275	I	32.7	Very low	55.5	Low	51 Å²	51	54.5 Å²	54.5	26%	0.262	29%	0.291	S	S	.	.			trans	-138.5	134.8	143.7	-77.5	-169.6	0	0	0	106.9	P1216 I1258 F1272 I1277	P1216-I1275 WeakPolarHBondContact CG-O 3.16Å; I1258-I1275 HydrophobicContact CD1-CD1 3.71Å; I1258-I1275 HydrophobicContact CD1-CG1 3.7Å; I1258-I1275 HydrophobicContact CG1-CD1 4.17Å; F1272-I1275 HydrophobicContact CD1-CD1 3.91Å; F1272-I1275 HydrophobicContact CD1-CG1 3.73Å; F1272-I1275 HydrophobicContact CE1-CD1 3.38Å; F1272-I1275 HydrophobicContact CE1-CG1 3.52Å; F1272-I1275 HydrophobicContact CE2-CD1 4.4Å; F1272-I1275 HydrophobicContact CZ-CD1 3.63Å; F1272-I1275 HydrophobicContact CZ-CG1 4.29Å; I1275-I1277 HydrophobicContact CG2-CG1 4.43Å
1276	L	36.3	Very low	54.7	Low	43 Å²	43	54.5 Å²	54.5	23%	0.225	29%	0.291	C	S	.	.			trans	-131.6	137.9	172.6	-175.3	136.5	0	0	0	112.6	A1278 P1281 L1285 I1293	L1276-A1278 HydrophobicContact CD2-CB 4.34Å; L1276-P1281 VanDerWaalsContact CD1-O 3.3Å; L1276-P1281 WeakPolarHBondContact CD1-O 3.24Å; L1276-P1281 HydrophobicContact CD2-CB 3.92Å; L1276-P1281 WeakPolarHBondContact CD2-O 3.33Å; L1276-L1285 HydrophobicContact CD1-CD1 3.9Å; L1276-L1285 HydrophobicContact CD1-CD2 4.1Å; L1276-L1285 HydrophobicContact CD1-CG 3.99Å; L1276-L1285 HydrophobicContact CD2-CD1 4.31Å; L1276-I1293 HydrophobicContact CB-CD1 3.99Å; L1276-I1293 HydrophobicContact CD2-CD1 4.11Å; L1276-I1293 HydrophobicContact CD2-CG2 4.07Å
1277	I	40	Very low	54	Low	91 Å²	91	48.8 Å²	48.8	47%	0.467	27%	0.267	S	S	.	.			trans	-159.7	113.9	169.8	27.5	164.3	0	0	0	104.1	I1212 F1213 I1275	I1212-I1277 HydrophobicContact CG2-CB 3.58Å; I1212-I1277 HydrophobicContact CG2-CG2 4.34Å; I1212-I1277 WeakPolarHBondContact CG2-O 3.17Å; F1213-I1277 CarbonylContact O-C 3.4Å; I1275-I1277 HydrophobicContact CG2-CG1 4.43Å
1278	A	56.1	Low	53.5	Low	17 Å²	17	48.4 Å²	48.4	14%	0.14	27%	0.266	C	S	.	.	B	Isolated β-bridge	cis	136.8	52.8	14.7	0	0	0	0	0	114.3	I1212 F1213 L1276 P1281	I1212-A1278 HydrophobicContact CD1-CB 4.33Å; I1212-A1278 VanDerWaalsContact CG2-C 3.47Å; I1212-A1278 VanDerWaalsContact CG2-CA 3.43Å; I1212-A1278 HydrophobicContact CG2-CB 3.69Å; F1213-A1278 PolarHBondContact O-N 3.1Å; L1276-A1278 HydrophobicContact CD2-CB 4.34Å; A1278-P1281 HydrophobicContact CB-CB 3.57Å; A1278-P1281 HydrophobicContact CB-CG 4.25Å
1279	D	59.6	Low	53.2	Low	55 Å²	55	48.3 Å²	48.3	29%	0.294	27%	0.269	S	S	.	.	S	Bend	trans	-112.7	130.7	147.2	176.3	20.6	0	0	0	105.6	F1213 Q1214 P1281 I1311	F1213-D1279 PolarHBondContact O-N 3.25Å; F1213-D1279 VanDerWaalsContact O-N 3.15Å; Q1214-D1279 VanDerWaalsContact CA-O 3.29Å; Q1214-D1279 WeakPolarHBondContact CA-O 3.38Å; Q1214-D1279 WeakPolarHBondContact CG-O 3.37Å; D1279-P1281 VanDerWaalsContact C-CD 3.49Å; D1279-P1281 VanDerWaalsContact C-N 3.27Å; D1279-I1311 WeakPolarHBondContact OD1-CB 3.33Å
1280	E	61.7	Low	53.5	Low	29 Å²	29	48.6 Å²	48.6	14%	0.136	27%	0.27	C	S	.	.	S	Bend	trans	45.1	48.3	-154.9	-86	-74.9	-165.9	0	0	112.8	Q1214 T1282 T1283 I1311 T1312 H1313	Q1214-E1280 HydrophobicContact CG-CB 4.4Å; E1280-T1282 PolarHBondContact O-N 3.42Å; E1280-T1283 VanDerWaalsContact CD-OG1 3.32Å; E1280-T1283 WeakPolarHBondContact O-CB 3.19Å; E1280-T1283 PolarHBondContact O-N 3.11Å; E1280-T1283 PolarHBondContact OE2-OG1 2.97Å; E1280-I1311 WeakPolarHBondContact CA-O 3.08Å; E1280-I1311 PolarHBondContact N-O 2.75Å; E1280-T1312 VanDerWaalsContact CD-CA 3.45Å; E1280-T1312 VanDerWaalsContact OE1-CA 3.32Å; E1280-T1312 WeakPolarHBondContact OE1-CA 3.38Å; E1280-T1312 WeakPolarHBondContact OE2-CA 3.21Å; E1280-T1312 WeakPolarHBondContact OE2-CB 3.18Å; E1280-T1312 PolarHBondContact OE2-OG1 3.42Å; E1280-H1313 IonicContact OE1-CE1 2.94Å; E1280-H1313 IonicContact OE1-CG 3.61Å; E1280-H1313 PolarHBondContact OE1-N 3.03Å; E1280-H1313 IonicContact OE1-ND1 2.69Å; E1280-H1313 PolarHBondContact OE1-ND1 2.89Å; E1280-H1313 IonicContact OE2-ND1 2.62Å
1281	P	59.4	Low	53.8	Low	5 Å²	5	45.5 Å²	45.5	3%	0.032	26%	0.256	C	S	.	.	T	Hydrogen-bonded Turn	trans	-49.4	-35.4	-169.2	13.4	-29.4	0	0	0	116.2	L1276 A1278 D1279 L1285 F1310	L1276-P1281 VanDerWaalsContact CD1-O 3.3Å; L1276-P1281 WeakPolarHBondContact CD1-O 3.24Å; L1276-P1281 HydrophobicContact CD2-CB 3.92Å; L1276-P1281 WeakPolarHBondContact CD2-O 3.33Å; A1278-P1281 HydrophobicContact CB-CB 3.57Å; A1278-P1281 HydrophobicContact CB-CG 4.25Å; D1279-P1281 VanDerWaalsContact C-CD 3.49Å; D1279-P1281 VanDerWaalsContact C-N 3.27Å; P1281-L1285 WeakPolarHBondContact O-CD1 3.39Å; P1281-F1310 HydrophobicContact CB-CZ 4.45Å; P1281-F1310 HydrophobicContact CG-CD2 4.42Å; P1281-F1310 HydrophobicContact CG-CE1 3.76Å; P1281-F1310 HydrophobicContact CG-CE2 3.58Å; P1281-F1310 HydrophobicContact CG-CZ 3.2Å
1282	T	60.7	Low	54.7	Low	5 Å²	5	45 Å²	45	3%	0.031	25%	0.254	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97	-5.7	-171.5	51.8	0	0	0	0	112.4	E1280 A1284 L1285 Q1290 L1294	E1280-T1282 PolarHBondContact O-N 3.42Å; T1282-A1284 PolarHBondContact O-N 2.87Å; T1282-L1285 PolarHBondContact O-N 3.26Å; T1282-Q1290 HydrophobicContact CG2-CB 3.7Å; T1282-Q1290 HydrophobicContact CG2-CG 3.57Å; T1282-L1294 HydrophobicContact CG2-CD1 4.35Å; T1282-L1294 HydrophobicContact CG2-CD2 4.02Å; T1282-L1294 HydrophobicContact CG2-CG 4.12Å
1283	T	58.2	Low	55.8	Low	48 Å²	48	45.5 Å²	45.5	29%	0.294	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.7	134.3	178.1	-76.7	0	0	0	0	110.9	E1280 L1285 H1313	E1280-T1283 VanDerWaalsContact CD-OG1 3.32Å; E1280-T1283 WeakPolarHBondContact O-CB 3.19Å; E1280-T1283 PolarHBondContact O-N 3.11Å; E1280-T1283 PolarHBondContact OE2-OG1 2.97Å; T1283-L1285 PolarHBondContact O-N 2.88Å; T1283-L1285 VanDerWaalsContact O-N 3.1Å; T1283-H1313 PolarHBondContact OG1-CE1 2.8Å
1284	A	52.5	Low	57.9	Low	85 Å²	85	41.1 Å²	41.1	70%	0.702	23%	0.226	S	C	*	.	T	Hydrogen-bonded Turn	trans	59.6	7.7	-175.3	0	0	0	0	0	116	T1282	T1282-A1284 PolarHBondContact O-N 2.87Å
1285	L	56.6	Low	60.2	Low	36 Å²	36	37 Å²	37	19%	0.188	21%	0.207	C	C	.	.	S	Bend	trans	-79.6	162.3	167.4	-78.4	-174.1	0	0	0	112.4	L1276 P1281 T1282 T1283 I1289 Q1290 I1293	L1276-L1285 HydrophobicContact CD1-CD1 3.9Å; L1276-L1285 HydrophobicContact CD1-CD2 4.1Å; L1276-L1285 HydrophobicContact CD1-CG 3.99Å; L1276-L1285 HydrophobicContact CD2-CD1 4.31Å; P1281-L1285 WeakPolarHBondContact O-CD1 3.39Å; T1282-L1285 PolarHBondContact O-N 3.26Å; T1283-L1285 PolarHBondContact O-N 2.88Å; T1283-L1285 VanDerWaalsContact O-N 3.1Å; L1285-I1289 HydrophobicContact CD1-CG2 4.11Å; L1285-I1289 HydrophobicContact CD2-CG2 4.01Å; L1285-Q1290 HydrophobicContact CB-CB 4.27Å; L1285-I1293 HydrophobicContact CD1-CD1 3.46Å; L1285-I1293 VanDerWaalsContact CD1-CD1 3.46Å
1286	D	60.9	Low	62.1	Low	22 Å²	22	37.2 Å²	37.2	12%	0.118	21%	0.208	C	C	.	.			trans	-70.7	145.7	162	178.3	81.1	0	0	0	111.9	T1288 I1289 Q1290 E1437 S1438	D1286-T1288 PolarHBondContact O-N 3.26Å; D1286-T1288 PolarHBondContact OD2-N 3.06Å; D1286-T1288 PolarHBondContact OD2-OG1 3.06Å; D1286-I1289 HydrophobicContact CB-CB 4.08Å; D1286-I1289 HydrophobicContact CB-CG1 3.84Å; D1286-I1289 CarbonylContact O-C 3.53Å; D1286-I1289 PolarHBondContact O-N 3.01Å; D1286-I1289 VanDerWaalsContact O-N 3.16Å; D1286-I1289 PolarHBondContact OD2-N 2.93Å; D1286-Q1290 WeakPolarHBondContact O-CB 3.45Å; D1286-Q1290 PolarHBondContact O-N 3.4Å; D1286-E1437 WeakPolarHBondContact OD1-CA 3.4Å; D1286-E1437 WeakPolarHBondContact OD1-CB 3.4Å; D1286-E1437 WeakPolarHBondContact OD1-CG 3.49Å; D1286-E1437 WeakPolarHBondContact OD2-CG 3.41Å; D1286-S1438 PolarHBondContact OD1-N 2.93Å
1287	V	65	Low	64	Low	7 Å²	7	36.5 Å²	36.5	4%	0.042	20%	0.204	C	C	.	.	H	α-helix	trans	-71.8	-26.2	-175.5	-60.9	0	0	0	0	115.9	A1291 G1436 E1437 A1647	V1287-A1291 WeakPolarHBondContact O-CB 3.37Å; V1287-A1291 PolarHBondContact O-N 2.95Å; V1287-G1436 VanDerWaalsContact CG1-O 3.23Å; V1287-G1436 WeakPolarHBondContact CG1-O 3.48Å; V1287-G1436 VanDerWaalsContact CG2-C 3.43Å; V1287-E1437 HydrophobicContact CG2-CB 4.36Å; V1287-E1437 HydrophobicContact CG2-CG 3.45Å; V1287-E1437 VanDerWaalsContact CG2-CG 3.45Å; V1287-A1647 HydrophobicContact CG2-CB 4.03Å
1288	T	62.3	Low	65.7	Low	24 Å²	24	36.4 Å²	36.4	15%	0.147	20%	0.201	C	C	.	.	H	α-helix	trans	-73.1	-33.1	167.8	46.6	0	0	0	0	111.3	D1286 A1291 Q1292 E1437 A1647	D1286-T1288 PolarHBondContact O-N 3.26Å; D1286-T1288 PolarHBondContact OD2-N 3.06Å; D1286-T1288 PolarHBondContact OD2-OG1 3.06Å; T1288-A1291 PolarHBondContact O-N 2.83Å; T1288-Q1292 WeakPolarHBondContact O-CB 3.39Å; T1288-Q1292 WeakPolarHBondContact O-CG 3.33Å; T1288-Q1292 PolarHBondContact O-N 2.76Å; T1288-Q1292 PolarHBondContact O-NE2 3.04Å; T1288-Q1292 VanDerWaalsContact O-NE2 3.16Å; T1288-E1437 VanDerWaalsContact CB-OE1 3.23Å; T1288-E1437 WeakPolarHBondContact CB-OE1 3.3Å; T1288-E1437 WeakPolarHBondContact CG2-OE1 3.3Å; T1288-E1437 PolarHBondContact OG1-OE1 3.36Å; T1288-A1647 HydrophobicContact CG2-CB 3.39Å
1289	I	66.3	Low	66.5	Low	55 Å²	55	41 Å²	41	28%	0.282	22%	0.219	S	C	.	.	H	α-helix	trans	-70.5	-44.2	176.8	-55.5	-60.7	0	0	0	110.6	L1285 D1286 A1291 Q1292 I1293	L1285-I1289 HydrophobicContact CD1-CG2 4.11Å; L1285-I1289 HydrophobicContact CD2-CG2 4.01Å; D1286-I1289 HydrophobicContact CB-CB 4.08Å; D1286-I1289 HydrophobicContact CB-CG1 3.84Å; D1286-I1289 CarbonylContact O-C 3.53Å; D1286-I1289 PolarHBondContact O-N 3.01Å; D1286-I1289 VanDerWaalsContact O-N 3.16Å; D1286-I1289 PolarHBondContact OD2-N 2.93Å; I1289-A1291 PolarHBondContact O-N 3.16Å; I1289-Q1292 PolarHBondContact O-N 2.86Å; I1289-I1293 HydrophobicContact CG2-CD1 3.78Å; I1289-I1293 WeakPolarHBondContact O-CB 3.11Å; I1289-I1293 WeakPolarHBondContact O-CD1 3.14Å; I1289-I1293 WeakPolarHBondContact O-CG1 3.43Å; I1289-I1293 PolarHBondContact O-N 2.94Å
1290	Q	68.8	Low	67	Low	11 Å²	11	40 Å²	40	5%	0.051	21%	0.214	C	C	.	.	H	α-helix	trans	-56.1	-48.3	168.9	139.5	174.1	1.4	0	0	110.7	T1282 L1285 D1286 Q1292 I1293 L1294 D1314	T1282-Q1290 HydrophobicContact CG2-CB 3.7Å; T1282-Q1290 HydrophobicContact CG2-CG 3.57Å; L1285-Q1290 HydrophobicContact CB-CB 4.27Å; D1286-Q1290 WeakPolarHBondContact O-CB 3.45Å; D1286-Q1290 PolarHBondContact O-N 3.4Å; Q1290-Q1292 PolarHBondContact O-N 2.9Å; Q1290-I1293 PolarHBondContact O-N 2.83Å; Q1290-L1294 HydrophobicContact CG-CD1 4.14Å; Q1290-L1294 VanDerWaalsContact O-CG 3.24Å; Q1290-L1294 WeakPolarHBondContact O-CG 3.47Å; Q1290-L1294 PolarHBondContact O-N 2.96Å; Q1290-D1314 PolarHBondContact NE2-OD2 3.17Å
1291	A	69.7	Low	67.3	Low	5 Å²	5	40.9 Å²	40.9	4%	0.041	22%	0.218	C	C	.	.	H	α-helix	trans	-59.2	-42	177	0	0	0	0	0	113.7	V1287 T1288 I1289 E1295 R1661	V1287-A1291 WeakPolarHBondContact O-CB 3.37Å; V1287-A1291 PolarHBondContact O-N 2.95Å; T1288-A1291 PolarHBondContact O-N 2.83Å; I1289-A1291 PolarHBondContact O-N 3.16Å; A1291-E1295 WeakPolarHBondContact O-CB 3.46Å; A1291-E1295 PolarHBondContact O-N 3.06Å; A1291-E1295 VanDerWaalsContact O-N 3.12Å; A1291-R1661 PolarHBondContact O-NH1 3.21Å
1292	Q	71.5	Confident	67.9	Low	85 Å²	85	47 Å²	47	40%	0.397	25%	0.246	S	C	.	.	H	α-helix	trans	-66.5	-38.4	176.4	-74.7	169.1	64	0	0	112.2	T1288 I1289 Q1290 E1295 L1296	T1288-Q1292 WeakPolarHBondContact O-CB 3.39Å; T1288-Q1292 WeakPolarHBondContact O-CG 3.33Å; T1288-Q1292 PolarHBondContact O-N 2.76Å; T1288-Q1292 PolarHBondContact O-NE2 3.04Å; T1288-Q1292 VanDerWaalsContact O-NE2 3.16Å; I1289-Q1292 PolarHBondContact O-N 2.86Å; Q1290-Q1292 PolarHBondContact O-N 2.9Å; Q1292-E1295 WeakPolarHBondContact O-CB 3.25Å; Q1292-E1295 PolarHBondContact O-N 3.5Å; Q1292-L1296 WeakPolarHBondContact O-CB 3.46Å; Q1292-L1296 PolarHBondContact O-N 3.36Å
1293	I	70.7	Confident	68.3	Low	23 Å²	23	53.5 Å²	53.5	12%	0.118	27%	0.274	C	S	.	.	H	α-helix	trans	-72.3	-35.1	179.9	-74.5	161.4	0	0	0	111.6	L1276 L1285 I1289 Q1290 L1296 L1297	L1276-I1293 HydrophobicContact CB-CD1 3.99Å; L1276-I1293 HydrophobicContact CD2-CD1 4.11Å; L1276-I1293 HydrophobicContact CD2-CG2 4.07Å; L1285-I1293 HydrophobicContact CD1-CD1 3.46Å; L1285-I1293 VanDerWaalsContact CD1-CD1 3.46Å; I1289-I1293 HydrophobicContact CG2-CD1 3.78Å; I1289-I1293 WeakPolarHBondContact O-CB 3.11Å; I1289-I1293 WeakPolarHBondContact O-CD1 3.14Å; I1289-I1293 WeakPolarHBondContact O-CG1 3.43Å; I1289-I1293 PolarHBondContact O-N 2.94Å; Q1290-I1293 PolarHBondContact O-N 2.83Å; I1293-L1296 PolarHBondContact O-N 3.03Å; I1293-L1297 HydrophobicContact CG2-CD1 3.98Å; I1293-L1297 HydrophobicContact CG2-CG 4.36Å; I1293-L1297 VanDerWaalsContact O-CB 3.31Å; I1293-L1297 WeakPolarHBondContact O-CB 3.06Å; I1293-L1297 VanDerWaalsContact O-CG 3.23Å; I1293-L1297 WeakPolarHBondContact O-CG 3.46Å; I1293-L1297 PolarHBondContact O-N 2.79Å
1294	L	78.3	Confident	69	Low	1 Å²	1	55.7 Å²	55.7	1%	0.005	28%	0.282	C	S	.	.	H	α-helix	trans	-66.2	-41.1	171.9	-63.7	169.7	0	0	0	111.7	T1282 Q1290 K1298 F1310 V1317 V1321	T1282-L1294 HydrophobicContact CG2-CD1 4.35Å; T1282-L1294 HydrophobicContact CG2-CD2 4.02Å; T1282-L1294 HydrophobicContact CG2-CG 4.12Å; Q1290-L1294 HydrophobicContact CG-CD1 4.14Å; Q1290-L1294 VanDerWaalsContact O-CG 3.24Å; Q1290-L1294 WeakPolarHBondContact O-CG 3.47Å; Q1290-L1294 PolarHBondContact O-N 2.96Å; L1294-K1298 WeakPolarHBondContact O-CB 3.35Å; L1294-K1298 PolarHBondContact O-N 2.81Å; L1294-K1298 VanDerWaalsContact O-N 3.11Å; L1294-F1310 HydrophobicContact CD2-CE2 3.69Å; L1294-F1310 HydrophobicContact CD2-CZ 3.51Å; L1294-V1317 HydrophobicContact CD1-CB 4.44Å; L1294-V1317 HydrophobicContact CD1-CG1 3.94Å; L1294-V1317 HydrophobicContact CD1-CG2 3.95Å; L1294-V1317 HydrophobicContact CD2-CG1 3.61Å; L1294-V1317 HydrophobicContact CG-CG1 4.44Å; L1294-V1321 HydrophobicContact CB-CG1 3.92Å; L1294-V1321 HydrophobicContact CD2-CG1 3.77Å; L1294-V1321 HydrophobicContact CD2-CG2 4.28Å; L1294-V1321 HydrophobicContact CG-CG1 4.28Å
1295	E	76.6	Confident	69.5	Low	80 Å²	80	60.5 Å²	60.5	37%	0.374	29%	0.291	S	S	.	.	H	α-helix	trans	-59.7	-49.1	173.4	-172.2	166.9	-111.6	0	0	110.5	A1291 Q1292 K1298 E1299 K1663	A1291-E1295 WeakPolarHBondContact O-CB 3.46Å; A1291-E1295 PolarHBondContact O-N 3.06Å; A1291-E1295 VanDerWaalsContact O-N 3.12Å; Q1292-E1295 WeakPolarHBondContact O-CB 3.25Å; Q1292-E1295 PolarHBondContact O-N 3.5Å; E1295-K1298 PolarHBondContact O-N 2.93Å; E1295-E1299 PolarHBondContact O-N 3.16Å; E1295-K1663 IonicContact OE2-NZ 3.55Å; E1295-K1663 PolarHBondContact OE2-NZ 3.37Å
1296	L	73.9	Confident	69.9	Low	55 Å²	55	61.9 Å²	61.9	29%	0.288	30%	0.301	S	S	.	.	H	α-helix	trans	-64.1	-43.3	176.9	179.6	62.6	0	0	0	113.6	Q1292 I1293 K1298 E1299 I1300	Q1292-L1296 WeakPolarHBondContact O-CB 3.46Å; Q1292-L1296 PolarHBondContact O-N 3.36Å; I1293-L1296 PolarHBondContact O-N 3.03Å; L1296-K1298 PolarHBondContact O-N 3.13Å; L1296-E1299 PolarHBondContact O-N 2.75Å; L1296-I1300 HydrophobicContact CD1-CD1 3.96Å; L1296-I1300 HydrophobicContact CD1-CG1 4.3Å; L1296-I1300 HydrophobicContact CG-CD1 3.83Å; L1296-I1300 WeakPolarHBondContact O-CB 3.4Å; L1296-I1300 WeakPolarHBondContact O-CD1 2.93Å; L1296-I1300 VanDerWaalsContact O-CG1 3.23Å; L1296-I1300 WeakPolarHBondContact O-CG1 3.22Å; L1296-I1300 PolarHBondContact O-N 2.98Å
1297	L	75.8	Confident	70.2	Confident	27 Å²	27	66.3 Å²	66.3	14%	0.141	33%	0.333	C	S	.	.	H	α-helix	trans	-61.5	-36.1	177.4	-78.1	170.6	0	0	0	111.4	I1293 I1300 Q1301 F1310	I1293-L1297 HydrophobicContact CG2-CD1 3.98Å; I1293-L1297 HydrophobicContact CG2-CG 4.36Å; I1293-L1297 VanDerWaalsContact O-CB 3.31Å; I1293-L1297 WeakPolarHBondContact O-CB 3.06Å; I1293-L1297 VanDerWaalsContact O-CG 3.23Å; I1293-L1297 WeakPolarHBondContact O-CG 3.46Å; I1293-L1297 PolarHBondContact O-N 2.79Å; L1297-I1300 PolarHBondContact O-N 2.96Å; L1297-Q1301 WeakPolarHBondContact O-CB 3.38Å; L1297-Q1301 PolarHBondContact O-N 3.46Å; L1297-F1310 HydrophobicContact CD1-CE2 4.05Å
1298	K	76.2	Confident	70.6	Confident	90 Å²	90	69.3 Å²	69.3	39%	0.391	35%	0.348	S	S	.	.	H	α-helix	trans	-71	-44.9	175.6	-170.9	172.4	-176.3	170.9	0	112.5	L1294 E1295 L1296 I1300 Q1301 E1302	L1294-K1298 WeakPolarHBondContact O-CB 3.35Å; L1294-K1298 PolarHBondContact O-N 2.81Å; L1294-K1298 VanDerWaalsContact O-N 3.11Å; E1295-K1298 PolarHBondContact O-N 2.93Å; L1296-K1298 PolarHBondContact O-N 3.13Å; K1298-I1300 PolarHBondContact O-N 3.27Å; K1298-Q1301 WeakPolarHBondContact O-CB 3.47Å; K1298-Q1301 PolarHBondContact O-N 3.47Å; K1298-Q1301 VanDerWaalsContact O-N 3.13Å; K1298-E1302 WeakPolarHBondContact CE-OE1 3.36Å; K1298-E1302 WeakPolarHBondContact O-CG 3.26Å; K1298-E1302 PolarHBondContact O-N 2.96Å
1299	E	72	Confident	71.2	Confident	112 Å²	112	76 Å²	76	52%	0.523	38%	0.381	S	S	.	.	H	α-helix	trans	-56.6	-40.5	171.9	-73.3	-170.5	-173.1	0	0	111.8	E1295 L1296 K1303	E1295-E1299 PolarHBondContact O-N 3.16Å; L1296-E1299 PolarHBondContact O-N 2.75Å; E1299-K1303 WeakPolarHBondContact O-CB 3.09Å; E1299-K1303 PolarHBondContact O-N 3.32Å
1300	I	70.3	Confident	71.7	Confident	35 Å²	35	76 Å²	76	18%	0.179	38%	0.379	C	S	.	.	H	α-helix	trans	-67.9	-40.7	176.4	-68.8	166	0	0	0	111.4	V1256 L1296 L1297 K1298 K1303 I1304	V1256-I1300 HydrophobicContact CB-CD1 4.41Å; V1256-I1300 HydrophobicContact CG1-CD1 3.79Å; L1296-I1300 HydrophobicContact CD1-CD1 3.96Å; L1296-I1300 HydrophobicContact CD1-CG1 4.3Å; L1296-I1300 HydrophobicContact CG-CD1 3.83Å; L1296-I1300 WeakPolarHBondContact O-CB 3.4Å; L1296-I1300 WeakPolarHBondContact O-CD1 2.93Å; L1296-I1300 VanDerWaalsContact O-CG1 3.23Å; L1296-I1300 WeakPolarHBondContact O-CG1 3.22Å; L1296-I1300 PolarHBondContact O-N 2.98Å; L1297-I1300 PolarHBondContact O-N 2.96Å; K1298-I1300 PolarHBondContact O-N 3.27Å; I1300-K1303 PolarHBondContact O-N 2.96Å; I1300-I1304 HydrophobicContact CG2-CD1 3.84Å; I1300-I1304 HydrophobicContact CG2-CG1 4.47Å; I1300-I1304 WeakPolarHBondContact O-CB 3.46Å; I1300-I1304 WeakPolarHBondContact O-CG1 3.49Å; I1300-I1304 PolarHBondContact O-N 3.07Å; I1300-I1304 VanDerWaalsContact O-N 3.08Å
1301	Q	67.7	Low	72.2	Confident	48 Å²	48	80 Å²	80	22%	0.224	40%	0.4	C	S	.	.	H	α-helix	trans	-57.6	-53.2	175.7	-172.5	-166	-5.1	0	0	111.1	L1297 K1298 E1305 T1306 I1308	L1297-Q1301 WeakPolarHBondContact O-CB 3.38Å; L1297-Q1301 PolarHBondContact O-N 3.46Å; K1298-Q1301 WeakPolarHBondContact O-CB 3.47Å; K1298-Q1301 PolarHBondContact O-N 3.47Å; K1298-Q1301 VanDerWaalsContact O-N 3.13Å; Q1301-E1305 PolarHBondContact O-N 2.79Å; Q1301-T1306 VanDerWaalsContact CG-O 3.25Å; Q1301-T1306 WeakPolarHBondContact CG-O 3.13Å; Q1301-T1306 PolarHBondContact O-N 2.77Å; Q1301-I1308 HydrophobicContact CB-CD1 3.93Å; Q1301-I1308 HydrophobicContact CG-CD1 4.2Å; Q1301-I1308 HydrophobicContact CG-CG1 4.43Å
1302	E	71.2	Confident	72.3	Confident	134 Å²	134	81.1 Å²	81.1	63%	0.626	41%	0.406	S	S	*	.	H	α-helix	trans	-63.3	-42.3	-179.2	-69	178.6	-164.7	0	0	111.6	K1298	K1298-E1302 WeakPolarHBondContact CE-OE1 3.36Å; K1298-E1302 WeakPolarHBondContact O-CG 3.26Å; K1298-E1302 PolarHBondContact O-N 2.96Å
1303	K	69.8	Low	72.4	Confident	141 Å²	141	80.3 Å²	80.3	61%	0.613	40%	0.403	S	S	*	.	H	α-helix	trans	-80	-15.8	-173.9	-168.5	170.1	-178.2	179	0	114.9	L1255 E1299 I1300	L1255-K1303 HydrophobicContact CD1-CD 3.75Å; L1255-K1303 HydrophobicContact CD1-CG 4.48Å; E1299-K1303 WeakPolarHBondContact O-CB 3.09Å; E1299-K1303 PolarHBondContact O-N 3.32Å; I1300-K1303 PolarHBondContact O-N 2.96Å
1304	I	72.7	Confident	72.5	Confident	93 Å²	93	81.1 Å²	81.1	48%	0.477	41%	0.407	S	S	.	.	H	α-helix	trans	-114.2	-4.1	179.6	-55.7	-175.2	0	0	0	112	L1255 I1300 T1306	L1255-I1304 HydrophobicContact CD2-CD1 4.22Å; I1300-I1304 HydrophobicContact CG2-CD1 3.84Å; I1300-I1304 HydrophobicContact CG2-CG1 4.47Å; I1300-I1304 WeakPolarHBondContact O-CB 3.46Å; I1300-I1304 WeakPolarHBondContact O-CG1 3.49Å; I1300-I1304 PolarHBondContact O-N 3.07Å; I1300-I1304 VanDerWaalsContact O-N 3.08Å; I1304-T1306 VanDerWaalsContact C-N 3.28Å; I1304-T1306 HydrophobicContact CB-CG2 4.45Å; I1304-T1306 PolarHBondContact O-N 3.33Å
1305	E	62.7	Low	72.4	Confident	187 Å²	187	82.1 Å²	82.1	87%	0.874	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.4	41.9	-176.3	-60	-176.2	172.3	0	0	112.7	Q1301	Q1301-E1305 PolarHBondContact O-N 2.79Å
1306	T	65.4	Low	72.2	Confident	65 Å²	65	78.4 Å²	78.4	40%	0.399	40%	0.395	S	S	.	.			trans	-106.2	148.2	-176	-167.9	0	0	0	0	112.7	Q1301 I1304	Q1301-T1306 VanDerWaalsContact CG-O 3.25Å; Q1301-T1306 WeakPolarHBondContact CG-O 3.13Å; Q1301-T1306 PolarHBondContact O-N 2.77Å; I1304-T1306 VanDerWaalsContact C-N 3.28Å; I1304-T1306 HydrophobicContact CB-CG2 4.45Å; I1304-T1306 PolarHBondContact O-N 3.33Å
1307	S	68.4	Low	72.4	Confident	115 Å²	115	75.8 Å²	75.8	80%	0.804	38%	0.382	S	S	*	.			trans	-84.9	137.3	166.9	-50.2	0	0	0	0	110.1
1308	I	71.5	Confident	72.6	Confident	70 Å²	70	75.3 Å²	75.3	36%	0.359	38%	0.38	S	S	.	.			trans	-108.4	137.5	173.9	-62.1	177.4	0	0	0	108.3	Q1301 F1310	Q1301-I1308 HydrophobicContact CB-CD1 3.93Å; Q1301-I1308 HydrophobicContact CG-CD1 4.2Å; Q1301-I1308 HydrophobicContact CG-CG1 4.43Å; I1308-F1310 HydrophobicContact CG2-CB 4.41Å; I1308-F1310 HydrophobicContact CG2-CD2 4.48Å
1309	I	75.3	Confident	72.7	Confident	163 Å²	163	71.2 Å²	71.2	84%	0.836	36%	0.363	S	S	*	.			trans	-102	115.8	161.7	-62.3	176.2	0	0	0	105.3
1310	F	77.6	Confident	73	Confident	55 Å²	55	67.4 Å²	67.4	24%	0.241	35%	0.346	C	S	.	.			trans	-105.7	127.3	-178.1	-158.7	-76.1	0	0	0	108.7	P1281 L1294 L1297 I1308 T1312 V1317 V1321	P1281-F1310 HydrophobicContact CB-CZ 4.45Å; P1281-F1310 HydrophobicContact CG-CD2 4.42Å; P1281-F1310 HydrophobicContact CG-CE1 3.76Å; P1281-F1310 HydrophobicContact CG-CE2 3.58Å; P1281-F1310 HydrophobicContact CG-CZ 3.2Å; L1294-F1310 HydrophobicContact CD2-CE2 3.69Å; L1294-F1310 HydrophobicContact CD2-CZ 3.51Å; L1297-F1310 HydrophobicContact CD1-CE2 4.05Å; I1308-F1310 HydrophobicContact CG2-CB 4.41Å; I1308-F1310 HydrophobicContact CG2-CD2 4.48Å; F1310-T1312 HydrophobicContact CD1-CG2 3.92Å; F1310-T1312 HydrophobicContact CE1-CG2 3.68Å; F1310-V1317 HydrophobicContact CD1-CG1 4.48Å; F1310-V1317 HydrophobicContact CE1-CG1 3.49Å; F1310-V1317 VanDerWaalsContact CE1-CG1 3.49Å; F1310-V1317 HydrophobicContact CZ-CG1 3.53Å; F1310-V1321 HydrophobicContact CD2-CG2 3.93Å; F1310-V1321 HydrophobicContact CE2-CG2 3.96Å; F1310-V1321 HydrophobicContact CG-CG2 4.2Å; F1310-V1321 HydrophobicContact CZ-CG2 4.26Å
1311	I	78.3	Confident	73.4	Confident	95 Å²	95	67.2 Å²	67.2	49%	0.487	35%	0.347	S	S	.	.			trans	-113.1	119	177.9	-60.7	175.5	0	0	0	106.9	D1279 E1280	D1279-I1311 WeakPolarHBondContact OD1-CB 3.33Å; E1280-I1311 WeakPolarHBondContact CA-O 3.08Å; E1280-I1311 PolarHBondContact N-O 2.75Å
1312	T	73.5	Confident	74.1	Confident	29 Å²	29	66 Å²	66	18%	0.178	35%	0.345	C	S	.	.			trans	-157.3	157.2	168.9	-167.9	0	0	0	0	113.1	E1280 F1310 D1314 V1317 V1318	E1280-T1312 VanDerWaalsContact CD-CA 3.45Å; E1280-T1312 VanDerWaalsContact OE1-CA 3.32Å; E1280-T1312 WeakPolarHBondContact OE1-CA 3.38Å; E1280-T1312 WeakPolarHBondContact OE2-CA 3.21Å; E1280-T1312 WeakPolarHBondContact OE2-CB 3.18Å; E1280-T1312 PolarHBondContact OE2-OG1 3.42Å; F1310-T1312 HydrophobicContact CD1-CG2 3.92Å; F1310-T1312 HydrophobicContact CE1-CG2 3.68Å; T1312-D1314 PolarHBondContact OG1-N 3.43Å; T1312-V1317 HydrophobicContact CG2-CB 4.24Å; T1312-V1317 HydrophobicContact CG2-CG1 4.18Å; T1312-V1318 HydrophobicContact CG2-CG2 3.65Å
1313	H	73	Confident	74.6	Confident	69 Å²	69	64.9 Å²	64.9	32%	0.319	34%	0.343	S	S	.	.	S	Bend	trans	-89.4	-12.1	166.6	69.3	-77.5	0	0	0	114.1	E1280 T1283 L1315	E1280-H1313 IonicContact OE1-CE1 2.94Å; E1280-H1313 IonicContact OE1-CG 3.61Å; E1280-H1313 PolarHBondContact OE1-N 3.03Å; E1280-H1313 IonicContact OE1-ND1 2.69Å; E1280-H1313 PolarHBondContact OE1-ND1 2.89Å; E1280-H1313 IonicContact OE2-ND1 2.62Å; T1283-H1313 PolarHBondContact OG1-CE1 2.8Å; H1313-L1315 PolarHBondContact O-N 3.06Å
1314	D	73.1	Confident	75.3	Confident	40 Å²	40	65.4 Å²	65.4	21%	0.214	34%	0.341	C	S	.	.			trans	-80.5	99.3	175.8	-175.8	-8.6	0	0	0	111	Q1290 T1312 G1316 V1317 V1318	Q1290-D1314 PolarHBondContact NE2-OD2 3.17Å; T1312-D1314 PolarHBondContact OG1-N 3.43Å; D1314-G1316 PolarHBondContact O-N 2.98Å; D1314-G1316 WeakPolarHBondContact OD1-CA 3.33Å; D1314-G1316 PolarHBondContact OD1-N 2.8Å; D1314-V1317 HydrophobicContact CB-CB 4.17Å; D1314-V1317 HydrophobicContact CB-CG2 4.02Å; D1314-V1317 WeakPolarHBondContact O-CB 3.42Å; D1314-V1317 PolarHBondContact O-N 3.15Å; D1314-V1317 VanDerWaalsContact O-N 3.07Å; D1314-V1317 PolarHBondContact OD1-N 3.1Å; D1314-V1317 WeakPolarHBondContact OD2-CG2 3.45Å; D1314-V1318 WeakPolarHBondContact O-CG2 3.34Å; D1314-V1318 PolarHBondContact O-N 3.13Å; D1314-V1318 VanDerWaalsContact O-N 3.1Å
1315	L	75.1	Confident	76.1	Confident	22 Å²	22	61.5 Å²	61.5	12%	0.115	32%	0.322	C	S	.	.	H	α-helix	trans	-62	-26	176.4	-71.8	179.7	0	0	0	113.6	H1313 V1317 V1318 A1319 F1343 L1354 L1355 M1358	H1313-L1315 PolarHBondContact O-N 3.06Å; L1315-V1317 VanDerWaalsContact C-N 3.31Å; L1315-V1318 PolarHBondContact O-N 3.32Å; L1315-A1319 PolarHBondContact O-N 2.75Å; L1315-F1343 HydrophobicContact CB-CE1 4.02Å; L1315-F1343 HydrophobicContact CB-CZ 4Å; L1315-F1343 HydrophobicContact CD2-CZ 4.14Å; L1315-F1343 WeakPolarHBondContact O-CZ 2.96Å; L1315-L1354 HydrophobicContact CD1-CB 3.86Å; L1315-L1355 HydrophobicContact CD1-CD2 3.9Å; L1315-L1355 HydrophobicContact CD1-CG 4.14Å; L1315-M1358 HydrophobicContact CB-CE 3.93Å; L1315-M1358 HydrophobicContact CB-SD 3.7Å; L1315-M1358 HydrophobicContact CD1-SD 3.99Å; L1315-M1358 HydrophobicContact CG-SD 4.44Å
1316	G	73.5	Confident	77.4	Confident	1 Å²	1	55.3 Å²	55.3	1%	0.01	30%	0.302	C	S	.	.	H	α-helix	trans	-69	-31.8	173.7	0	0	0	0	0	112.2	D1314 N1320 P1649	D1314-G1316 PolarHBondContact O-N 2.98Å; D1314-G1316 WeakPolarHBondContact OD1-CA 3.33Å; D1314-G1316 PolarHBondContact OD1-N 2.8Å; G1316-N1320 PolarHBondContact O-N 3.46Å; G1316-P1649 WeakPolarHBondContact O-CB 3.47Å
1317	V	78.2	Confident	78.6	Confident	0 Å²	0	52.8 Å²	52.8	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-70	-44.4	169.5	171.7	0	0	0	0	110.9	L1294 F1310 T1312 D1314 L1315 A1319 N1320 V1321 P1649	L1294-V1317 HydrophobicContact CD1-CB 4.44Å; L1294-V1317 HydrophobicContact CD1-CG1 3.94Å; L1294-V1317 HydrophobicContact CD1-CG2 3.95Å; L1294-V1317 HydrophobicContact CD2-CG1 3.61Å; L1294-V1317 HydrophobicContact CG-CG1 4.44Å; F1310-V1317 HydrophobicContact CD1-CG1 4.48Å; F1310-V1317 HydrophobicContact CE1-CG1 3.49Å; F1310-V1317 VanDerWaalsContact CE1-CG1 3.49Å; F1310-V1317 HydrophobicContact CZ-CG1 3.53Å; T1312-V1317 HydrophobicContact CG2-CB 4.24Å; T1312-V1317 HydrophobicContact CG2-CG1 4.18Å; D1314-V1317 HydrophobicContact CB-CB 4.17Å; D1314-V1317 HydrophobicContact CB-CG2 4.02Å; D1314-V1317 WeakPolarHBondContact O-CB 3.42Å; D1314-V1317 PolarHBondContact O-N 3.15Å; D1314-V1317 VanDerWaalsContact O-N 3.07Å; D1314-V1317 PolarHBondContact OD1-N 3.1Å; D1314-V1317 WeakPolarHBondContact OD2-CG2 3.45Å; L1315-V1317 VanDerWaalsContact C-N 3.31Å; V1317-A1319 VanDerWaalsContact C-N 3.29Å; V1317-A1319 PolarHBondContact O-N 3.37Å; V1317-N1320 WeakPolarHBondContact O-CB 3.12Å; V1317-N1320 PolarHBondContact O-N 2.86Å; V1317-V1321 HydrophobicContact CG1-CG2 4.24Å; V1317-V1321 PolarHBondContact O-N 3.38Å; V1317-V1321 VanDerWaalsContact O-N 3.13Å; V1317-P1649 HydrophobicContact CG2-CB 4.4Å; V1317-P1649 HydrophobicContact CG2-CG 4.08Å
1318	V	80.2	Confident	79.6	Confident	18 Å²	18	53 Å²	53	11%	0.109	28%	0.276	C	S	.	.	H	α-helix	trans	-56.2	-44.7	176.9	-179.9	0	0	0	0	111.1	T1312 D1314 L1315 N1320 V1321 A1322 V1325 F1343	T1312-V1318 HydrophobicContact CG2-CG2 3.65Å; D1314-V1318 WeakPolarHBondContact O-CG2 3.34Å; D1314-V1318 PolarHBondContact O-N 3.13Å; D1314-V1318 VanDerWaalsContact O-N 3.1Å; L1315-V1318 PolarHBondContact O-N 3.32Å; V1318-N1320 PolarHBondContact O-N 3.02Å; V1318-V1321 PolarHBondContact O-N 3.13Å; V1318-A1322 HydrophobicContact CG1-CB 3.83Å; V1318-A1322 WeakPolarHBondContact O-CB 3.4Å; V1318-A1322 PolarHBondContact O-N 2.94Å; V1318-V1325 HydrophobicContact CG1-CB 4.19Å; V1318-V1325 HydrophobicContact CG1-CG1 3.76Å; V1318-V1325 HydrophobicContact CG1-CG2 3.38Å; V1318-F1343 HydrophobicContact CB-CE2 4.38Å; V1318-F1343 HydrophobicContact CB-CZ 4.23Å; V1318-F1343 HydrophobicContact CG1-CE2 4Å; V1318-F1343 HydrophobicContact CG1-CZ 4.29Å
1319	A	78	Confident	80.3	Confident	4 Å²	4	50.1 Å²	50.1	3%	0.033	26%	0.261	C	S	.	.	H	α-helix	trans	-62	-26.5	176.4	0	0	0	0	0	114	L1315 V1317 F1343 M1650 P1653	L1315-A1319 PolarHBondContact O-N 2.75Å; V1317-A1319 VanDerWaalsContact C-N 3.29Å; V1317-A1319 PolarHBondContact O-N 3.37Å; A1319-F1343 HydrophobicContact CB-CD1 4.42Å; A1319-F1343 HydrophobicContact CB-CD2 4.34Å; A1319-F1343 HydrophobicContact CB-CE1 4.05Å; A1319-F1343 HydrophobicContact CB-CE2 3.97Å; A1319-F1343 HydrophobicContact CB-CZ 3.83Å; A1319-M1650 WeakPolarHBondContact CB-O 3.25Å; A1319-P1653 HydrophobicContact CB-CG 4.07Å
1320	N	77.2	Confident	80.5	Confident	32 Å²	32	43.9 Å²	43.9	17%	0.171	23%	0.234	C	C	.	.	H	α-helix	trans	-82	-41.2	179.4	-173.6	-84.7	0	0	0	113.3	G1316 V1317 V1318 E1656 R1661	G1316-N1320 PolarHBondContact O-N 3.46Å; V1317-N1320 WeakPolarHBondContact O-CB 3.12Å; V1317-N1320 PolarHBondContact O-N 2.86Å; V1318-N1320 PolarHBondContact O-N 3.02Å; N1320-E1656 HydrophobicContact CB-CB 4.47Å; N1320-E1656 HydrophobicContact CB-CG 4.43Å; N1320-E1656 PolarHBondContact ND2-OE2 2.8Å; N1320-R1661 PolarHBondContact ND2-NH2 3.26Å
1321	V	78.3	Confident	80.4	Confident	31 Å²	31	44.2 Å²	44.2	19%	0.188	25%	0.253	C	S	.	.	H	α-helix	trans	-117.1	-11.1	-168.8	-57.4	0	0	0	0	116.8	L1294 F1310 V1317 V1318	L1294-V1321 HydrophobicContact CB-CG1 3.92Å; L1294-V1321 HydrophobicContact CD2-CG1 3.77Å; L1294-V1321 HydrophobicContact CD2-CG2 4.28Å; L1294-V1321 HydrophobicContact CG-CG1 4.28Å; F1310-V1321 HydrophobicContact CD2-CG2 3.93Å; F1310-V1321 HydrophobicContact CE2-CG2 3.96Å; F1310-V1321 HydrophobicContact CG-CG2 4.2Å; F1310-V1321 HydrophobicContact CZ-CG2 4.26Å; V1317-V1321 HydrophobicContact CG1-CG2 4.24Å; V1317-V1321 PolarHBondContact O-N 3.38Å; V1317-V1321 VanDerWaalsContact O-N 3.13Å; V1318-V1321 PolarHBondContact O-N 3.13Å
1322	A	82.8	Confident	80.6	Confident	22 Å²	22	44.6 Å²	44.6	18%	0.182	25%	0.251	C	S	.	.			trans	-93.6	123.1	-175.7	0	0	0	0	0	112.8	V1318 R1324 V1325 A1339	V1318-A1322 HydrophobicContact CG1-CB 3.83Å; V1318-A1322 WeakPolarHBondContact O-CB 3.4Å; V1318-A1322 PolarHBondContact O-N 2.94Å; A1322-R1324 VanDerWaalsContact C-N 3.33Å; A1322-V1325 HydrophobicContact CB-CG2 3.91Å; A1322-A1339 VanDerWaalsContact O-CB 3.31Å; A1322-A1339 WeakPolarHBondContact O-CB 3.02Å
1323	D	82.3	Confident	81.3	Confident	111 Å²	111	47.4 Å²	47.4	59%	0.594	26%	0.264	S	S	*	.	S	Bend	trans	-70.7	-34.6	164.1	-58.7	-63.4	0	0	0	111.3	T1338 A1339	D1323-T1338 WeakPolarHBondContact O-CA 3.04Å; D1323-A1339 PolarHBondContact O-N 3.08Å
1324	R	84.3	Confident	82.2	Confident	152 Å²	152	44.5 Å²	44.5	57%	0.574	25%	0.251	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-139.3	137.9	-178.1	-65.9	-174.6	67.3	-150.5	0.7	110.8	A1322 G1337	A1322-R1324 VanDerWaalsContact C-N 3.33Å; R1324-G1337 CarbonylContact C-O 3.55Å; R1324-G1337 VanDerWaalsContact CA-O 3.25Å; R1324-G1337 WeakPolarHBondContact CA-O 3.41Å; R1324-G1337 WeakPolarHBondContact CB-O 3.46Å
1325	V	90	Very high	83.2	Confident	11 Å²	11	42.6 Å²	42.6	7%	0.067	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	137.8	-173.6	-177.4	0	0	0	0	109	V1318 A1322 V1327 V1336 G1337 A1339 I1342 F1343	V1318-V1325 HydrophobicContact CG1-CB 4.19Å; V1318-V1325 HydrophobicContact CG1-CG1 3.76Å; V1318-V1325 HydrophobicContact CG1-CG2 3.38Å; A1322-V1325 HydrophobicContact CB-CG2 3.91Å; V1325-V1327 HydrophobicContact CG1-CG2 4.35Å; V1325-V1336 VanDerWaalsContact O-CA 3.26Å; V1325-V1336 WeakPolarHBondContact O-CA 3.29Å; V1325-G1337 PolarHBondContact N-O 3.03Å; V1325-G1337 PolarHBondContact O-N 3.26Å; V1325-A1339 HydrophobicContact CG2-CB 4.19Å; V1325-I1342 HydrophobicContact CB-CB 4.27Å; V1325-I1342 HydrophobicContact CB-CG1 4.05Å; V1325-I1342 HydrophobicContact CB-CG2 4.34Å; V1325-I1342 HydrophobicContact CG1-CG1 4.49Å; V1325-I1342 HydrophobicContact CG1-CG2 4.03Å; V1325-F1343 HydrophobicContact CG2-CE2 4.46Å
1326	A	90	Very high	84	Confident	57 Å²	57	43 Å²	43	47%	0.471	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	108	172.9	0	0	0	0	0	109.1	I1333 E1335 V1336	A1326-I1333 HydrophobicContact CB-CD1 4.39Å; A1326-I1333 HydrophobicContact CB-CG2 4.2Å; A1326-E1335 CarbonylContact C-O 3.5Å; A1326-E1335 WeakPolarHBondContact CA-O 3.33Å; A1326-V1336 HydrophobicContact CB-CB 4.44Å; A1326-V1336 HydrophobicContact CB-CG2 4.22Å
1327	V	90.7	Very high	84.9	Confident	11 Å²	11	42.9 Å²	42.9	7%	0.067	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	121.1	-179.1	-174.8	0	0	0	0	108.7	V1325 I1333 V1334 E1335 I1342 Y1350 T1351 L1354	V1325-V1327 HydrophobicContact CG1-CG2 4.35Å; V1327-I1333 CarbonylContact O-C 3.55Å; V1327-I1333 WeakPolarHBondContact O-CA 3.43Å; V1327-V1334 HydrophobicContact CB-CG2 4.29Å; V1327-V1334 HydrophobicContact CG1-CG2 4.02Å; V1327-V1334 WeakPolarHBondContact O-CG2 3.21Å; V1327-V1334 PolarHBondContact O-N 3.44Å; V1327-E1335 HydrophobicContact CB-CB 4.14Å; V1327-E1335 HydrophobicContact CG2-CB 4.24Å; V1327-E1335 PolarHBondContact N-O 3.48Å; V1327-E1335 PolarHBondContact O-N 3.11Å; V1327-I1342 HydrophobicContact CG2-CG2 4.17Å; V1327-Y1350 HydrophobicContact CG1-CD1 3.65Å; V1327-Y1350 HydrophobicContact CG1-CE1 3.77Å; V1327-T1351 HydrophobicContact CG2-CG2 4.14Å; V1327-L1354 HydrophobicContact CG1-CD1 4.05Å
1328	M	88.6	Confident	85.4	Confident	119 Å²	119	44.2 Å²	44.2	59%	0.586	25%	0.252	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-108.9	137.4	179.3	-174.7	174.7	63.5	0	0	111.8	K1332 Y1350	M1328-K1332 CarbonylContact C-O 3.59Å; M1328-K1332 VanDerWaalsContact CA-O 3.31Å; M1328-K1332 WeakPolarHBondContact CA-O 3.38Å; M1328-K1332 WeakPolarHBondContact CG-O 3.47Å; M1328-Y1350 WeakPolarHBondContact O-CE1 3.37Å
1329	Y	86.6	Confident	85.6	Confident	11 Å²	11	43.4 Å²	43.4	4%	0.043	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	137.3	170.6	-175.6	-103.4	0	0	0	110.7	G1331 K1332 Y1350 P1376 A1386 F1387 R1390	Y1329-G1331 PolarHBondContact O-N 3Å; Y1329-K1332 PolarHBondContact N-O 3.28Å; Y1329-K1332 PolarHBondContact O-N 3.05Å; Y1329-K1332 VanDerWaalsContact O-O 3.08Å; Y1329-Y1350 HydrophobicContact CD2-CD1 4.29Å; Y1329-Y1350 AromaticContact CD2-CD2 3.88Å; Y1329-Y1350 HydrophobicContact CD2-CD2 3.88Å; Y1329-Y1350 AromaticContact CD2-CE1 3.94Å; Y1329-Y1350 HydrophobicContact CD2-CE1 3.94Å; Y1329-Y1350 AromaticContact CD2-CE2 3.49Å; Y1329-Y1350 HydrophobicContact CD2-CE2 3.49Å; Y1329-Y1350 VanDerWaalsContact CD2-CE2 3.49Å; Y1329-Y1350 HydrophobicContact CD2-CG 4.25Å; Y1329-Y1350 AromaticContact CD2-CZ 3.51Å; Y1329-Y1350 HydrophobicContact CE2-CD2 4.3Å; Y1329-Y1350 AromaticContact CE2-CE2 3.92Å; Y1329-Y1350 HydrophobicContact CE2-CE2 3.92Å; Y1329-Y1350 HydrophobicContact CG-CD1 4.36Å; Y1329-Y1350 HydrophobicContact CG-CD2 4.47Å; Y1329-Y1350 HydrophobicContact CG-CE1 4.28Å; Y1329-Y1350 HydrophobicContact CG-CE2 4.41Å; Y1329-Y1350 HydrophobicContact CG-CG 4.43Å; Y1329-P1376 WeakPolarHBondContact OH-CD 3.39Å; Y1329-A1386 HydrophobicContact CD1-CB 4.12Å; Y1329-A1386 HydrophobicContact CE1-CB 4.07Å; Y1329-A1386 WeakPolarHBondContact CE1-O 3.34Å; Y1329-F1387 HydrophobicContact CD1-CB 3.96Å; Y1329-F1387 HydrophobicContact CD1-CD2 4.28Å; Y1329-F1387 HydrophobicContact CD2-CD2 4.41Å; Y1329-F1387 HydrophobicContact CE1-CB 3.9Å; Y1329-F1387 AromaticContact CE1-CD2 3.93Å; Y1329-F1387 HydrophobicContact CE1-CD2 3.93Å; Y1329-F1387 HydrophobicContact CE1-CG 4.43Å; Y1329-F1387 HydrophobicContact CE2-CD2 4.05Å; Y1329-F1387 HydrophobicContact CG-CD2 4.49Å; Y1329-F1387 AromaticContact CZ-CD2 3.76Å; Y1329-R1390 WeakPolarHBondContact OH-CD 3.19Å
1330	A	80	Confident	85.8	Confident	31 Å²	31	45.9 Å²	45.9	26%	0.256	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	49	32.5	178.1	0	0	0	0	0	115.1	P1376 L1378 A1386	A1330-P1376 HydrophobicContact CB-CG 4.38Å; A1330-L1378 HydrophobicContact CB-CD2 3.91Å; A1330-A1386 HydrophobicContact CB-CB 3.81Å
1331	G	75.4	Confident	86.3	Confident	63 Å²	63	46.1 Å²	46.1	65%	0.649	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	82.5	8.6	-177.7	0	0	0	0	0	115.7	Y1329	Y1329-G1331 PolarHBondContact O-N 3Å
1332	K	81.9	Confident	86.8	Confident	103 Å²	103	44.7 Å²	44.7	45%	0.448	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	138.4	178.2	-56.9	-175.2	-174.9	-173.4	0	110.6	M1328 Y1329 V1334 E1402	M1328-K1332 CarbonylContact C-O 3.59Å; M1328-K1332 VanDerWaalsContact CA-O 3.31Å; M1328-K1332 WeakPolarHBondContact CA-O 3.38Å; M1328-K1332 WeakPolarHBondContact CG-O 3.47Å; Y1329-K1332 PolarHBondContact N-O 3.28Å; Y1329-K1332 PolarHBondContact O-N 3.05Å; Y1329-K1332 VanDerWaalsContact O-O 3.08Å; K1332-V1334 PolarHBondContact O-N 2.82Å; K1332-E1402 IonicContact NZ-OE1 2.72Å; K1332-E1402 PolarHBondContact NZ-OE1 2.92Å
1333	I	88.1	Confident	86.8	Confident	87 Å²	87	44.2 Å²	44.2	45%	0.446	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.5	125.3	167.3	-57.5	173.8	0	0	0	107.1	A1326 V1327 E1335 V1336 F1405	A1326-I1333 HydrophobicContact CB-CD1 4.39Å; A1326-I1333 HydrophobicContact CB-CG2 4.2Å; V1327-I1333 CarbonylContact O-C 3.55Å; V1327-I1333 WeakPolarHBondContact O-CA 3.43Å; I1333-E1335 WeakPolarHBondContact CG2-O 3.49Å; I1333-V1336 HydrophobicContact CG2-CB 4.37Å; I1333-F1405 HydrophobicContact CB-CZ 4.18Å; I1333-F1405 HydrophobicContact CG2-CZ 3.98Å; I1333-F1405 VanDerWaalsContact O-CZ 3.24Å; I1333-F1405 WeakPolarHBondContact O-CZ 3.33Å
1334	V	92	Very high	86.8	Confident	9 Å²	9	44.2 Å²	44.2	6%	0.055	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	-22.2	179.2	-64.4	0	0	0	0	112.7	V1327 K1332 Y1350 A1415	V1327-V1334 HydrophobicContact CB-CG2 4.29Å; V1327-V1334 HydrophobicContact CG1-CG2 4.02Å; V1327-V1334 WeakPolarHBondContact O-CG2 3.21Å; V1327-V1334 PolarHBondContact O-N 3.44Å; K1332-V1334 PolarHBondContact O-N 2.82Å; V1334-Y1350 HydrophobicContact CG2-CD1 3.97Å; V1334-A1415 PolarHBondContact O-N 2.69Å
1335	E	93.5	Very high	86.7	Confident	0 Å²	0	41.3 Å²	41.3	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.7	145.8	174.7	-158.7	170	179	0	0	110.8	A1326 V1327 I1333 I1342 Q1347 H1348 T1351 H1412 K1413 A1414	A1326-E1335 CarbonylContact C-O 3.5Å; A1326-E1335 WeakPolarHBondContact CA-O 3.33Å; V1327-E1335 HydrophobicContact CB-CB 4.14Å; V1327-E1335 HydrophobicContact CG2-CB 4.24Å; V1327-E1335 PolarHBondContact N-O 3.48Å; V1327-E1335 PolarHBondContact O-N 3.11Å; I1333-E1335 WeakPolarHBondContact CG2-O 3.49Å; E1335-I1342 HydrophobicContact CB-CD1 4.38Å; E1335-I1342 HydrophobicContact CG-CD1 3.56Å; E1335-Q1347 PolarHBondContact OE1-N 2.93Å; E1335-H1348 HydrophobicContact CB-CB 4.05Å; E1335-H1348 HydrophobicContact CG-CB 4.36Å; E1335-H1348 WeakPolarHBondContact OE2-CB 3.48Å; E1335-H1348 PolarHBondContact OE2-N 2.83Å; E1335-T1351 WeakPolarHBondContact OE2-CB 3.41Å; E1335-T1351 PolarHBondContact OE2-OG1 3.37Å; E1335-H1412 IonicContact OE1-CD2 3.66Å; E1335-H1412 IonicContact OE1-CE1 2.64Å; E1335-H1412 IonicContact OE1-NE2 3.83Å; E1335-H1412 PolarHBondContact OE1-NE2 3.43Å; E1335-K1413 CarbonylContact C-O 3.55Å; E1335-K1413 WeakPolarHBondContact CA-O 3.35Å; E1335-A1414 HydrophobicContact CB-CB 4.48Å; E1335-A1414 HydrophobicContact CG-CB 3.76Å
1336	V	93	Very high	86.5	Confident	29 Å²	29	41.3 Å²	41.3	18%	0.176	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.5	136.5	175.9	59	0	0	0	0	110.6	V1325 A1326 I1333 F1405 H1412 K1413	V1325-V1336 VanDerWaalsContact O-CA 3.26Å; V1325-V1336 WeakPolarHBondContact O-CA 3.29Å; A1326-V1336 HydrophobicContact CB-CB 4.44Å; A1326-V1336 HydrophobicContact CB-CG2 4.22Å; I1333-V1336 HydrophobicContact CG2-CB 4.37Å; V1336-F1405 HydrophobicContact CG1-CE1 4.28Å; V1336-H1412 CarbonylContact O-C 3.54Å; V1336-H1412 VanDerWaalsContact O-CA 3.27Å; V1336-H1412 WeakPolarHBondContact O-CA 3.34Å; V1336-H1412 PolarHBondContact O-CD2 3.44Å; V1336-K1413 HydrophobicContact CG1-CB 4.02Å; V1336-K1413 PolarHBondContact N-O 3.33Å; V1336-K1413 PolarHBondContact O-N 2.6Å
1337	G	91.8	Very high	86.4	Confident	0 Å²	0	40.3 Å²	40.3	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-164.7	-170.1	-178.4	0	0	0	0	0	112.6	R1324 V1325 E1341	R1324-G1337 CarbonylContact C-O 3.55Å; R1324-G1337 VanDerWaalsContact CA-O 3.25Å; R1324-G1337 WeakPolarHBondContact CA-O 3.41Å; R1324-G1337 WeakPolarHBondContact CB-O 3.46Å; V1325-G1337 PolarHBondContact N-O 3.03Å; V1325-G1337 PolarHBondContact O-N 3.26Å; G1337-E1341 WeakPolarHBondContact CA-OE2 3.3Å
1338	T	88.6	Confident	86.4	Confident	28 Å²	28	39.8 Å²	39.8	17%	0.172	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.9	170.6	156.7	79.6	0	0	0	0	110.5	D1323 E1340 E1341 I1342 T1411	D1323-T1338 WeakPolarHBondContact O-CA 3.04Å; T1338-E1340 WeakPolarHBondContact CB-OE2 3.4Å; T1338-E1340 PolarHBondContact OG1-N 2.83Å; T1338-E1340 PolarHBondContact OG1-OE2 3.23Å; T1338-E1341 PolarHBondContact N-OE2 2.74Å; T1338-E1341 PolarHBondContact O-N 3.47Å; T1338-E1341 WeakPolarHBondContact OG1-CG 3.43Å; T1338-E1341 PolarHBondContact OG1-N 3.37Å; T1338-I1342 WeakPolarHBondContact O-CG1 3.2Å; T1338-I1342 PolarHBondContact O-N 3.44Å; T1338-T1411 HydrophobicContact CG2-CG2 4.25Å
1339	A	84.5	Confident	86.3	Confident	1 Å²	1	34.4 Å²	34.4	1%	0.008	19%	0.188	C	C	.	.	H	α-helix	trans	-61.1	-44.6	172.3	0	0	0	0	0	111.8	A1322 D1323 V1325 E1341 I1342 F1343 P1653	A1322-A1339 VanDerWaalsContact O-CB 3.31Å; A1322-A1339 WeakPolarHBondContact O-CB 3.02Å; D1323-A1339 PolarHBondContact O-N 3.08Å; V1325-A1339 HydrophobicContact CG2-CB 4.19Å; A1339-E1341 VanDerWaalsContact C-N 3.32Å; A1339-E1341 PolarHBondContact O-N 3.18Å; A1339-I1342 PolarHBondContact O-N 2.84Å; A1339-F1343 HydrophobicContact CB-CD2 4.35Å; A1339-F1343 WeakPolarHBondContact O-CB 3.38Å; A1339-F1343 VanDerWaalsContact O-CD2 3.29Å; A1339-F1343 WeakPolarHBondContact O-CD2 3.43Å; A1339-F1343 PolarHBondContact O-N 3Å; A1339-P1653 HydrophobicContact CB-CB 4.43Å; A1339-P1653 HydrophobicContact CB-CG 4.11Å
1340	E	82.9	Confident	86.4	Confident	56 Å²	56	35.5 Å²	35.5	26%	0.262	19%	0.192	S	C	.	.	H	α-helix	trans	-60.7	-41.3	179.1	-52.7	86.8	167.1	0	0	111.9	T1338 I1342 Y1344 R1657	T1338-E1340 WeakPolarHBondContact CB-OE2 3.4Å; T1338-E1340 PolarHBondContact OG1-N 2.83Å; T1338-E1340 PolarHBondContact OG1-OE2 3.23Å; E1340-I1342 PolarHBondContact O-N 3.26Å; E1340-Y1344 HydrophobicContact CB-CD2 3.97Å; E1340-Y1344 HydrophobicContact CB-CE2 4.22Å; E1340-Y1344 HydrophobicContact CG-CE2 4.33Å; E1340-Y1344 WeakPolarHBondContact O-CB 3.48Å; E1340-Y1344 PolarHBondContact O-N 3.24Å; E1340-R1657 IonicContact OE1-CZ 2.78Å; E1340-R1657 IonicContact OE1-NH1 2.68Å; E1340-R1657 PolarHBondContact OE1-NH1 3.07Å; E1340-R1657 IonicContact OE1-NH2 2.76Å; E1340-R1657 PolarHBondContact OE1-NH2 3.23Å
1341	E	87.3	Confident	86.7	Confident	36 Å²	36	34.2 Å²	34.2	17%	0.168	18%	0.181	C	C	.	.	H	α-helix	trans	-62.3	-40.4	176.9	-69.8	176.7	142.2	0	0	112.1	G1337 T1338 A1339 N1345 S1409 T1411 H1412	G1337-E1341 WeakPolarHBondContact CA-OE2 3.3Å; T1338-E1341 PolarHBondContact N-OE2 2.74Å; T1338-E1341 PolarHBondContact O-N 3.47Å; T1338-E1341 WeakPolarHBondContact OG1-CG 3.43Å; T1338-E1341 PolarHBondContact OG1-N 3.37Å; A1339-E1341 VanDerWaalsContact C-N 3.32Å; A1339-E1341 PolarHBondContact O-N 3.18Å; E1341-N1345 CarbonylContact O-C 3.11Å; E1341-N1345 WeakPolarHBondContact O-CA 3.46Å; E1341-N1345 PolarHBondContact O-N 3.1Å; E1341-S1409 PolarHBondContact OE1-OG 3.16Å; E1341-T1411 VanDerWaalsContact CD-OG1 3.23Å; E1341-T1411 PolarHBondContact OE1-OG1 2.76Å; E1341-T1411 VanDerWaalsContact OE2-CB 3.24Å; E1341-T1411 WeakPolarHBondContact OE2-CB 3.3Å; E1341-T1411 PolarHBondContact OE2-OG1 2.88Å; E1341-H1412 HydrophobicContact CB-CB 4.3Å; E1341-H1412 HydrophobicContact CG-CB 4.32Å; E1341-H1412 PolarHBondContact OE2-N 2.87Å
1342	I	88	Confident	87.1	Confident	2 Å²	2	32 Å²	32	1%	0.01	15%	0.153	C	C	.	.	H	α-helix	trans	-83.2	-33.4	-177.5	-62.6	-58.8	0	0	0	113.4	V1325 V1327 E1335 T1338 A1339 E1340 P1346 T1351	V1325-I1342 HydrophobicContact CB-CB 4.27Å; V1325-I1342 HydrophobicContact CB-CG1 4.05Å; V1325-I1342 HydrophobicContact CB-CG2 4.34Å; V1325-I1342 HydrophobicContact CG1-CG1 4.49Å; V1325-I1342 HydrophobicContact CG1-CG2 4.03Å; V1327-I1342 HydrophobicContact CG2-CG2 4.17Å; E1335-I1342 HydrophobicContact CB-CD1 4.38Å; E1335-I1342 HydrophobicContact CG-CD1 3.56Å; T1338-I1342 WeakPolarHBondContact O-CG1 3.2Å; T1338-I1342 PolarHBondContact O-N 3.44Å; A1339-I1342 PolarHBondContact O-N 2.84Å; E1340-I1342 PolarHBondContact O-N 3.26Å; I1342-P1346 WeakPolarHBondContact O-CB 3.46Å; I1342-P1346 WeakPolarHBondContact O-CD 3.06Å; I1342-T1351 HydrophobicContact CG2-CG2 4.01Å
1343	F	83.7	Confident	86.9	Confident	12 Å²	12	27.2 Å²	27.2	5%	0.053	13%	0.132	C	C	.	.	H	α-helix	trans	-86.1	-37.7	179.9	-79.3	-84.2	0	0	0	113.2	L1315 V1318 A1319 V1325 A1339 L1355 P1651 P1653	L1315-F1343 HydrophobicContact CB-CE1 4.02Å; L1315-F1343 HydrophobicContact CB-CZ 4Å; L1315-F1343 HydrophobicContact CD2-CZ 4.14Å; L1315-F1343 WeakPolarHBondContact O-CZ 2.96Å; V1318-F1343 HydrophobicContact CB-CE2 4.38Å; V1318-F1343 HydrophobicContact CB-CZ 4.23Å; V1318-F1343 HydrophobicContact CG1-CE2 4Å; V1318-F1343 HydrophobicContact CG1-CZ 4.29Å; A1319-F1343 HydrophobicContact CB-CD1 4.42Å; A1319-F1343 HydrophobicContact CB-CD2 4.34Å; A1319-F1343 HydrophobicContact CB-CE1 4.05Å; A1319-F1343 HydrophobicContact CB-CE2 3.97Å; A1319-F1343 HydrophobicContact CB-CZ 3.83Å; V1325-F1343 HydrophobicContact CG2-CE2 4.46Å; A1339-F1343 HydrophobicContact CB-CD2 4.35Å; A1339-F1343 WeakPolarHBondContact O-CB 3.38Å; A1339-F1343 VanDerWaalsContact O-CD2 3.29Å; A1339-F1343 WeakPolarHBondContact O-CD2 3.43Å; A1339-F1343 PolarHBondContact O-N 3Å; F1343-L1355 HydrophobicContact CD1-CD2 3.66Å; F1343-L1355 HydrophobicContact CE1-CD2 3.7Å; F1343-P1651 HydrophobicContact CD1-CB 4.16Å; F1343-P1651 WeakPolarHBondContact CD1-O 3.48Å; F1343-P1651 HydrophobicContact CE1-CB 3.95Å; F1343-P1653 HydrophobicContact CB-CG 3.99Å; F1343-P1653 HydrophobicContact CD2-CG 3.94Å; F1343-P1653 HydrophobicContact CG-CG 4.03Å
1344	Y	81.5	Confident	86.5	Confident	111 Å²	111	24.4 Å²	24.4	44%	0.435	12%	0.118	S	C	.	.	H	α-helix	trans	-97.2	-22.5	-177.4	-55.3	-41.4	0	0	0	114.2	E1340 D1652 D1654	E1340-Y1344 HydrophobicContact CB-CD2 3.97Å; E1340-Y1344 HydrophobicContact CB-CE2 4.22Å; E1340-Y1344 HydrophobicContact CG-CE2 4.33Å; E1340-Y1344 WeakPolarHBondContact O-CB 3.48Å; E1340-Y1344 PolarHBondContact O-N 3.24Å; Y1344-D1652 PolarHBondContact OH-OD1 2.86Å; Y1344-D1654 WeakPolarHBondContact OH-CB 3.4Å; Y1344-D1654 PolarHBondContact OH-N 3.37Å; Y1344-D1654 PolarHBondContact OH-OD2 2.9Å
1345	N	82.5	Confident	85.8	Confident	90 Å²	90	24.8 Å²	24.8	48%	0.481	12%	0.12	S	C	.	.	S	Bend	trans	-139.1	44.3	-178.9	-170.6	53.6	0	0	0	113.9	E1341 Q1347 H1412	E1341-N1345 CarbonylContact O-C 3.11Å; E1341-N1345 WeakPolarHBondContact O-CA 3.46Å; E1341-N1345 PolarHBondContact O-N 3.1Å; N1345-Q1347 VanDerWaalsContact CG-NE2 3.35Å; N1345-Q1347 PolarHBondContact ND2-NE2 3.39Å; N1345-Q1347 PolarHBondContact O-NE2 3Å; N1345-Q1347 PolarHBondContact OD1-NE2 3.44Å; N1345-Q1347 VanDerWaalsContact OD1-NE2 3.13Å; N1345-H1412 PolarHBondContact O-CE1 2.97Å
1346	P	86.2	Confident	84.7	Confident	11 Å²	11	25.8 Å²	25.8	7%	0.071	13%	0.131	C	C	.	.			trans	-55.7	142.9	178.5	27	-36.8	0	0	0	111.6	I1342 T1351 W1352 L1355	I1342-P1346 WeakPolarHBondContact O-CB 3.46Å; I1342-P1346 WeakPolarHBondContact O-CD 3.06Å; P1346-T1351 HydrophobicContact CB-CG2 3.65Å; P1346-W1352 PolarHBondContact O-NE1 2.85Å; P1346-L1355 HydrophobicContact CB-CD1 4.01Å; P1346-L1355 HydrophobicContact CG-CD1 3.71Å
1347	Q	87.3	Confident	83.5	Confident	37 Å²	37	24.5 Å²	24.5	17%	0.173	12%	0.122	C	C	.	.			trans	-117.5	-22	-178.5	-59.8	-59	-59.3	0	0	114	E1335 N1345 W1352 L1408 A1414 L1419	E1335-Q1347 PolarHBondContact OE1-N 2.93Å; N1345-Q1347 VanDerWaalsContact CG-NE2 3.35Å; N1345-Q1347 PolarHBondContact ND2-NE2 3.39Å; N1345-Q1347 PolarHBondContact O-NE2 3Å; N1345-Q1347 PolarHBondContact OD1-NE2 3.44Å; N1345-Q1347 VanDerWaalsContact OD1-NE2 3.13Å; Q1347-W1352 WeakPolarHBondContact O-CZ2 3.3Å; Q1347-L1408 HydrophobicContact CB-CD1 4.08Å; Q1347-L1408 HydrophobicContact CG-CD1 3.63Å; Q1347-L1408 HydrophobicContact CG-CD2 4.02Å; Q1347-L1408 HydrophobicContact CG-CG 4.46Å; Q1347-A1414 HydrophobicContact CB-CB 3.98Å; Q1347-L1419 HydrophobicContact CB-CD1 4.14Å; Q1347-L1419 HydrophobicContact CB-CD2 4.42Å
1348	H	90.7	Very high	82.3	Confident	0 Å²	0	25.2 Å²	25.2	0%	0	13%	0.126	C	C	.	.	S	Bend	trans	-88	132.4	-179.1	-167	-87.1	0	0	0	111.6	E1335 Y1350 T1351 W1352 A1415	E1335-H1348 HydrophobicContact CB-CB 4.05Å; E1335-H1348 HydrophobicContact CG-CB 4.36Å; E1335-H1348 WeakPolarHBondContact OE2-CB 3.48Å; E1335-H1348 PolarHBondContact OE2-N 2.83Å; H1348-Y1350 VanDerWaalsContact ND1-CB 3.28Å; H1348-Y1350 WeakPolarHBondContact ND1-CB 3.47Å; H1348-Y1350 PolarHBondContact ND1-N 3.36Å; H1348-Y1350 VanDerWaalsContact ND1-N 3.12Å; H1348-Y1350 PolarHBondContact O-N 3.44Å; H1348-Y1350 VanDerWaalsContact O-N 3.12Å; H1348-T1351 WeakPolarHBondContact O-CA 3.24Å; H1348-T1351 VanDerWaalsContact O-CB 3.3Å; H1348-T1351 WeakPolarHBondContact O-CB 3.36Å; H1348-T1351 PolarHBondContact O-N 3.29Å; H1348-W1352 PolarHBondContact O-N 2.87Å; H1348-A1415 PolarHBondContact CD2-O 3.21Å; H1348-A1415 PolarHBondContact NE2-O 3.07Å
1349	P	87.1	Confident	80.8	Confident	6 Å²	6	24.2 Å²	24.2	4%	0.039	12%	0.12	C	C	.	.	H	α-helix	trans	-56.5	-29.1	179.6	-32.3	39	0	0	0	115.8	W1352 G1353 F1387 N1391 F1393 L1418	P1349-W1352 HydrophobicContact CB-CE3 4.1Å; P1349-W1352 HydrophobicContact CB-CZ3 4.39Å; P1349-W1352 HydrophobicContact CG-CE3 4.11Å; P1349-W1352 HydrophobicContact CG-CH2 4.47Å; P1349-W1352 HydrophobicContact CG-CZ3 3.95Å; P1349-G1353 PolarHBondContact O-N 3.16Å; P1349-F1387 HydrophobicContact CB-CD1 4.36Å; P1349-F1387 HydrophobicContact CB-CE1 3.95Å; P1349-N1391 VanDerWaalsContact CB-OD1 3.31Å; P1349-N1391 WeakPolarHBondContact CB-OD1 3.48Å; P1349-F1393 HydrophobicContact CB-CD2 4.44Å; P1349-L1418 HydrophobicContact CG-CD1 3.49Å; P1349-L1418 VanDerWaalsContact CG-CD1 3.49Å; P1349-L1418 HydrophobicContact CG-CG 4.36Å
1350	Y	88.7	Confident	79.5	Confident	34 Å²	34	25.2 Å²	25.2	13%	0.133	13%	0.126	C	C	.	.	H	α-helix	trans	-66.3	-39.1	170.7	179	-119.3	0	0	0	112.2	V1327 M1328 Y1329 V1334 H1348 G1353 L1354 I1371 F1387	V1327-Y1350 HydrophobicContact CG1-CD1 3.65Å; V1327-Y1350 HydrophobicContact CG1-CE1 3.77Å; M1328-Y1350 WeakPolarHBondContact O-CE1 3.37Å; Y1329-Y1350 HydrophobicContact CD2-CD1 4.29Å; Y1329-Y1350 AromaticContact CD2-CD2 3.88Å; Y1329-Y1350 HydrophobicContact CD2-CD2 3.88Å; Y1329-Y1350 AromaticContact CD2-CE1 3.94Å; Y1329-Y1350 HydrophobicContact CD2-CE1 3.94Å; Y1329-Y1350 AromaticContact CD2-CE2 3.49Å; Y1329-Y1350 HydrophobicContact CD2-CE2 3.49Å; Y1329-Y1350 VanDerWaalsContact CD2-CE2 3.49Å; Y1329-Y1350 HydrophobicContact CD2-CG 4.25Å; Y1329-Y1350 AromaticContact CD2-CZ 3.51Å; Y1329-Y1350 HydrophobicContact CE2-CD2 4.3Å; Y1329-Y1350 AromaticContact CE2-CE2 3.92Å; Y1329-Y1350 HydrophobicContact CE2-CE2 3.92Å; Y1329-Y1350 HydrophobicContact CG-CD1 4.36Å; Y1329-Y1350 HydrophobicContact CG-CD2 4.47Å; Y1329-Y1350 HydrophobicContact CG-CE1 4.28Å; Y1329-Y1350 HydrophobicContact CG-CE2 4.41Å; Y1329-Y1350 HydrophobicContact CG-CG 4.43Å; V1334-Y1350 HydrophobicContact CG2-CD1 3.97Å; H1348-Y1350 VanDerWaalsContact ND1-CB 3.28Å; H1348-Y1350 WeakPolarHBondContact ND1-CB 3.47Å; H1348-Y1350 PolarHBondContact ND1-N 3.36Å; H1348-Y1350 VanDerWaalsContact ND1-N 3.12Å; H1348-Y1350 PolarHBondContact O-N 3.44Å; H1348-Y1350 VanDerWaalsContact O-N 3.12Å; Y1350-G1353 CarbonylContact O-C 3.39Å; Y1350-G1353 WeakPolarHBondContact O-CA 3.14Å; Y1350-G1353 PolarHBondContact O-N 3.28Å; Y1350-L1354 HydrophobicContact CD1-CD1 4.03Å; Y1350-L1354 HydrophobicContact CD1-CG 4.43Å; Y1350-L1354 HydrophobicContact CD2-CG 4.33Å; Y1350-L1354 HydrophobicContact CE1-CD1 3.51Å; Y1350-L1354 HydrophobicContact CE1-CG 4.06Å; Y1350-L1354 HydrophobicContact CE2-CD1 4.3Å; Y1350-L1354 HydrophobicContact CE2-CD2 3.96Å; Y1350-L1354 HydrophobicContact CE2-CG 3.94Å; Y1350-L1354 WeakPolarHBondContact O-CG 3.27Å; Y1350-L1354 PolarHBondContact O-N 2.94Å; Y1350-I1371 HydrophobicContact CD2-CD1 3.77Å; Y1350-I1371 HydrophobicContact CE2-CD1 3.8Å; Y1350-F1387 AromaticContact CD2-CD2 3.84Å; Y1350-F1387 HydrophobicContact CD2-CD2 3.84Å; Y1350-F1387 AromaticContact CD2-CE2 3.49Å; Y1350-F1387 HydrophobicContact CD2-CE2 3.49Å; Y1350-F1387 VanDerWaalsContact CD2-CE2 3.49Å; Y1350-F1387 HydrophobicContact CD2-CZ 4.03Å; Y1350-F1387 HydrophobicContact CE2-CE2 4.41Å; Y1350-F1387 HydrophobicContact CG-CD2 4.24Å; Y1350-F1387 HydrophobicContact CG-CE2 4.18Å
1351	T	86.6	Confident	78	Confident	3 Å²	3	22.9 Å²	22.9	2%	0.018	12%	0.115	C	C	.	.	H	α-helix	trans	-67.4	-44.3	177	-46	0	0	0	0	110.8	V1327 E1335 I1342 P1346 H1348 G1353 L1354 L1355	V1327-T1351 HydrophobicContact CG2-CG2 4.14Å; E1335-T1351 WeakPolarHBondContact OE2-CB 3.41Å; E1335-T1351 PolarHBondContact OE2-OG1 3.37Å; I1342-T1351 HydrophobicContact CG2-CG2 4.01Å; P1346-T1351 HydrophobicContact CB-CG2 3.65Å; H1348-T1351 WeakPolarHBondContact O-CA 3.24Å; H1348-T1351 VanDerWaalsContact O-CB 3.3Å; H1348-T1351 WeakPolarHBondContact O-CB 3.36Å; H1348-T1351 PolarHBondContact O-N 3.29Å; T1351-G1353 PolarHBondContact O-N 3.48Å; T1351-L1354 PolarHBondContact O-N 3.31Å; T1351-L1355 HydrophobicContact CG2-CD1 4.08Å; T1351-L1355 WeakPolarHBondContact O-CB 3.38Å; T1351-L1355 WeakPolarHBondContact O-CG 3.11Å; T1351-L1355 PolarHBondContact O-N 2.72Å
1352	W	82.8	Confident	76.2	Confident	18 Å²	18	29.1 Å²	29.1	7%	0.068	15%	0.145	C	C	.	.	H	α-helix	trans	-55.1	-44.4	168.5	-56	-20.3	0	0	0	111.1	P1346 Q1347 H1348 P1349 G1356 F1393 L1418 I1426 P1428	P1346-W1352 PolarHBondContact O-NE1 2.85Å; Q1347-W1352 WeakPolarHBondContact O-CZ2 3.3Å; H1348-W1352 PolarHBondContact O-N 2.87Å; P1349-W1352 HydrophobicContact CB-CE3 4.1Å; P1349-W1352 HydrophobicContact CB-CZ3 4.39Å; P1349-W1352 HydrophobicContact CG-CE3 4.11Å; P1349-W1352 HydrophobicContact CG-CH2 4.47Å; P1349-W1352 HydrophobicContact CG-CZ3 3.95Å; W1352-G1356 PolarHBondContact O-N 3.02Å; W1352-F1393 AromaticContact CE3-CD2 3.87Å; W1352-F1393 HydrophobicContact CE3-CD2 3.87Å; W1352-F1393 AromaticContact CE3-CE2 3.86Å; W1352-F1393 HydrophobicContact CE3-CE2 3.86Å; W1352-F1393 AromaticContact CZ3-CD2 3.76Å; W1352-F1393 HydrophobicContact CZ3-CD2 3.76Å; W1352-F1393 HydrophobicContact CZ3-CE2 4.05Å; W1352-F1393 HydrophobicContact CZ3-CG 4.22Å; W1352-L1418 HydrophobicContact CH2-CD1 3.64Å; W1352-L1418 HydrophobicContact CZ3-CD1 3.76Å; W1352-I1426 HydrophobicContact CH2-CB 4.26Å; W1352-I1426 HydrophobicContact CH2-CG2 4.02Å; W1352-I1426 HydrophobicContact CZ3-CB 4.48Å; W1352-I1426 HydrophobicContact CZ3-CG2 3.84Å; W1352-P1428 HydrophobicContact CG-CB 4.47Å; W1352-P1428 HydrophobicContact CZ2-CG 4.28Å
1353	G	77.4	Confident	74.3	Confident	1 Å²	1	30.2 Å²	30.2	1%	0.01	15%	0.152	C	C	.	.	H	α-helix	trans	-65.1	-36.4	179.5	0	0	0	0	0	113.9	P1349 Y1350 T1351 S1357 I1371	P1349-G1353 PolarHBondContact O-N 3.16Å; Y1350-G1353 CarbonylContact O-C 3.39Å; Y1350-G1353 WeakPolarHBondContact O-CA 3.14Å; Y1350-G1353 PolarHBondContact O-N 3.28Å; T1351-G1353 PolarHBondContact O-N 3.48Å; G1353-S1357 VanDerWaalsContact O-CB 3.28Å; G1353-S1357 WeakPolarHBondContact O-CB 3.23Å; G1353-S1357 PolarHBondContact O-N 3.23Å; G1353-S1357 VanDerWaalsContact O-N 3.07Å; G1353-S1357 PolarHBondContact O-OG 3.11Å; G1353-I1371 VanDerWaalsContact C-CG1 3.49Å; G1353-I1371 VanDerWaalsContact O-CG1 3.28Å; G1353-I1371 WeakPolarHBondContact O-CG1 2.83Å
1354	L	80.8	Confident	72.5	Confident	28 Å²	28	39 Å²	39	15%	0.147	19%	0.193	C	C	.	.	H	α-helix	trans	-71.8	-51	176.1	-74.7	177.7	0	0	0	111.2	L1315 V1327 Y1350 T1351 G1356 S1357 M1358 I1371	L1315-L1354 HydrophobicContact CD1-CB 3.86Å; V1327-L1354 HydrophobicContact CG1-CD1 4.05Å; Y1350-L1354 HydrophobicContact CD1-CD1 4.03Å; Y1350-L1354 HydrophobicContact CD1-CG 4.43Å; Y1350-L1354 HydrophobicContact CD2-CG 4.33Å; Y1350-L1354 HydrophobicContact CE1-CD1 3.51Å; Y1350-L1354 HydrophobicContact CE1-CG 4.06Å; Y1350-L1354 HydrophobicContact CE2-CD1 4.3Å; Y1350-L1354 HydrophobicContact CE2-CD2 3.96Å; Y1350-L1354 HydrophobicContact CE2-CG 3.94Å; Y1350-L1354 WeakPolarHBondContact O-CG 3.27Å; Y1350-L1354 PolarHBondContact O-N 2.94Å; T1351-L1354 PolarHBondContact O-N 3.31Å; L1354-G1356 PolarHBondContact O-N 2.93Å; L1354-S1357 WeakPolarHBondContact O-CB 3.26Å; L1354-S1357 PolarHBondContact O-N 2.95Å; L1354-S1357 VanDerWaalsContact O-N 3.08Å; L1354-M1358 WeakPolarHBondContact O-CG 3.04Å; L1354-M1358 PolarHBondContact O-N 3.2Å; L1354-I1371 HydrophobicContact CD2-CD1 4.22Å; L1354-I1371 HydrophobicContact CG-CD1 4.4Å
1355	L	77.5	Confident	71	Confident	17 Å²	17	39 Å²	39	9%	0.089	20%	0.201	C	C	.	.	H	α-helix	trans	-60	-46.3	178.4	-72.5	164.1	0	0	0	111.2	L1315 F1343 P1346 T1351 S1357 M1358	L1315-L1355 HydrophobicContact CD1-CD2 3.9Å; L1315-L1355 HydrophobicContact CD1-CG 4.14Å; F1343-L1355 HydrophobicContact CD1-CD2 3.66Å; F1343-L1355 HydrophobicContact CE1-CD2 3.7Å; P1346-L1355 HydrophobicContact CB-CD1 4.01Å; P1346-L1355 HydrophobicContact CG-CD1 3.71Å; T1351-L1355 HydrophobicContact CG2-CD1 4.08Å; T1351-L1355 WeakPolarHBondContact O-CB 3.38Å; T1351-L1355 WeakPolarHBondContact O-CG 3.11Å; T1351-L1355 PolarHBondContact O-N 2.72Å; L1355-S1357 VanDerWaalsContact C-N 3.27Å; L1355-S1357 PolarHBondContact O-N 3.42Å; L1355-M1358 VanDerWaalsContact O-CB 3.29Å; L1355-M1358 WeakPolarHBondContact O-CB 3.41Å; L1355-M1358 VanDerWaalsContact O-CG 3.3Å; L1355-M1358 WeakPolarHBondContact O-CG 3.41Å; L1355-M1358 PolarHBondContact O-N 3.47Å; L1355-M1358 VanDerWaalsContact O-N 3.12Å
1356	G	68.9	Low	69.9	Low	22 Å²	22	39.7 Å²	39.7	23%	0.227	21%	0.205	C	C	.	.	H	α-helix	trans	-70.1	-17.7	175.1	0	0	0	0	0	114.4	W1352 L1354 M1358 Y1369	W1352-G1356 PolarHBondContact O-N 3.02Å; L1354-G1356 PolarHBondContact O-N 2.93Å; G1356-M1358 VanDerWaalsContact C-N 3.26Å; G1356-Y1369 WeakPolarHBondContact O-CB 3.46Å
1357	S	69.5	Low	68.8	Low	1 Å²	1	45.8 Å²	45.8	1%	0.007	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79	-10.8	171.4	-64.2	0	0	0	0	112.9	G1353 L1354 L1355 V1577 S1578	G1353-S1357 VanDerWaalsContact O-CB 3.28Å; G1353-S1357 WeakPolarHBondContact O-CB 3.23Å; G1353-S1357 PolarHBondContact O-N 3.23Å; G1353-S1357 VanDerWaalsContact O-N 3.07Å; G1353-S1357 PolarHBondContact O-OG 3.11Å; L1354-S1357 WeakPolarHBondContact O-CB 3.26Å; L1354-S1357 PolarHBondContact O-N 2.95Å; L1354-S1357 VanDerWaalsContact O-N 3.08Å; L1355-S1357 VanDerWaalsContact C-N 3.27Å; L1355-S1357 PolarHBondContact O-N 3.42Å; S1357-V1577 WeakPolarHBondContact O-CG1 3.45Å; S1357-S1578 WeakPolarHBondContact OG-CB 3.37Å
1358	M	65.3	Low	67.9	Low	16 Å²	16	44.7 Å²	44.7	8%	0.079	22%	0.222	C	C	.	.	S	Bend	trans	-71.2	144	174	-52.6	-162.1	80.4	0	0	109.6	L1315 L1354 L1355 G1356 V1577 P1651	L1315-M1358 HydrophobicContact CB-CE 3.93Å; L1315-M1358 HydrophobicContact CB-SD 3.7Å; L1315-M1358 HydrophobicContact CD1-SD 3.99Å; L1315-M1358 HydrophobicContact CG-SD 4.44Å; L1354-M1358 WeakPolarHBondContact O-CG 3.04Å; L1354-M1358 PolarHBondContact O-N 3.2Å; L1355-M1358 VanDerWaalsContact O-CB 3.29Å; L1355-M1358 WeakPolarHBondContact O-CB 3.41Å; L1355-M1358 VanDerWaalsContact O-CG 3.3Å; L1355-M1358 WeakPolarHBondContact O-CG 3.41Å; L1355-M1358 PolarHBondContact O-N 3.47Å; L1355-M1358 VanDerWaalsContact O-N 3.12Å; G1356-M1358 VanDerWaalsContact C-N 3.26Å; M1358-V1577 HydrophobicContact CG-CG1 4.24Å; M1358-P1651 HydrophobicContact CE-CG 3.53Å; M1358-P1651 HydrophobicContact SD-CB 3.92Å; M1358-P1651 HydrophobicContact SD-CG 3.37Å; M1358-P1651 WeakPolarHBondContact SD-CG 3.36Å
1359	P	57.2	Low	66.8	Low	7 Å²	7	49.1 Å²	49.1	5%	0.045	24%	0.239	C	C	.	.			trans	-62.6	151	172.2	27.1	-33.8	0	0	0	111.2	L1368 Q1433 L1435 S1606 M1607	P1359-L1368 HydrophobicContact CB-CD2 3.9Å; P1359-Q1433 VanDerWaalsContact O-O 3.05Å; P1359-L1435 HydrophobicContact CG-CD1 4.29Å; P1359-S1606 WeakPolarHBondContact CB-OG 3.47Å; P1359-M1607 HydrophobicContact CB-CE 3.56Å; P1359-M1607 HydrophobicContact CG-CE 3.62Å
1360	T	56.7	Low	66.1	Low	21 Å²	21	49.8 Å²	49.8	13%	0.129	25%	0.245	C	C	.	.			trans	-130.5	138.8	175.2	89.3	0	0	0	0	108.2	S1363 E1431 H1610	T1360-S1363 WeakPolarHBondContact OG1-CB 3.29Å; T1360-E1431 HydrophobicContact CG2-CB 3.73Å; T1360-E1431 VanDerWaalsContact CG2-O 3.26Å; T1360-E1431 WeakPolarHBondContact CG2-O 3.47Å; T1360-E1431 PolarHBondContact OG1-OE2 2.98Å; T1360-H1610 PolarHBondContact O-CE1 2.93Å
1361	L	53	Low	65.5	Low	7 Å²	7	48.2 Å²	48.2	4%	0.037	24%	0.239	C	C	.	.	S	Bend	trans	-93.7	-27.7	-165.8	-71.4	162.3	0	0	0	114.8	S1363 Q1433 R1434 S1606 K1609 Y1633	L1361-S1363 VanDerWaalsContact C-N 3.35Å; L1361-Q1433 HydrophobicContact CD1-CB 3.86Å; L1361-Q1433 HydrophobicContact CD1-CG 3.63Å; L1361-Q1433 WeakPolarHBondContact CG-O 3.29Å; L1361-R1434 HydrophobicContact CD1-CB 3.91Å; L1361-S1606 WeakPolarHBondContact CD2-OG 3.37Å; L1361-K1609 HydrophobicContact CD2-CD 3.71Å; L1361-K1609 PolarHBondContact O-NZ 3.39Å; L1361-Y1633 HydrophobicContact CB-CE1 4.48Å; L1361-Y1633 HydrophobicContact CD1-CE1 3.57Å; L1361-Y1633 HydrophobicContact CD1-CE2 4.15Å; L1361-Y1633 WeakPolarHBondContact CD1-OH 3.21Å; L1361-Y1633 HydrophobicContact CD2-CD1 4Å; L1361-Y1633 HydrophobicContact CD2-CD2 4.12Å; L1361-Y1633 HydrophobicContact CD2-CE1 3.67Å; L1361-Y1633 HydrophobicContact CD2-CE2 3.79Å; L1361-Y1633 HydrophobicContact CD2-CG 4.28Å; L1361-Y1633 HydrophobicContact CG-CE1 4.11Å
1362	E	48.2	Very low	64.6	Low	168 Å²	168	50.2 Å²	50.2	79%	0.785	25%	0.252	S	S	*	.	S	Bend	trans	-87.6	-12.4	-178.8	-62.8	-178.8	-178.7	0	0	111.5	E1364	E1362-E1364 PolarHBondContact O-N 2.91Å
1363	S	48.1	Very low	63.9	Low	25 Å²	25	51.6 Å²	51.6	18%	0.175	27%	0.272	C	S	.	.			trans	-59.6	118.4	169.9	167.3	0	0	0	0	111.6	T1360 L1361 N1365	T1360-S1363 WeakPolarHBondContact OG1-CB 3.29Å; L1361-S1363 VanDerWaalsContact C-N 3.35Å; S1363-N1365 PolarHBondContact O-N 2.81Å; S1363-N1365 VanDerWaalsContact OG-CB 3.31Å; S1363-N1365 WeakPolarHBondContact OG-CB 3.21Å; S1363-N1365 PolarHBondContact OG-N 3.33Å
1364	E	46.9	Very low	63.2	Low	195 Å²	195	54 Å²	54	91%	0.911	29%	0.288	S	S	*	.			trans	-74.5	-1.3	163.9	-64.3	-166.8	144.4	0	0	112.8	E1362 D1366	E1362-E1364 PolarHBondContact O-N 2.91Å; E1364-D1366 PolarHBondContact O-N 2.96Å
1365	N	49.6	Very low	62.8	Low	113 Å²	113	55.7 Å²	55.7	60%	0.604	30%	0.301	S	S	*	.			trans	-73.1	121.7	176.5	-66.5	-68	0	0	0	111.2	S1363 R1367	S1363-N1365 PolarHBondContact O-N 2.81Å; S1363-N1365 VanDerWaalsContact OG-CB 3.31Å; S1363-N1365 WeakPolarHBondContact OG-CB 3.21Å; S1363-N1365 PolarHBondContact OG-N 3.33Å; N1365-R1367 PolarHBondContact O-N 2.71Å
1366	D	58.8	Low	62.3	Low	104 Å²	104	56.5 Å²	56.5	56%	0.556	31%	0.307	S	S	*	.	S	Bend	trans	-48	-28.4	168.5	-94.7	22.2	0	0	0	114.1	E1364 Q1588 K1592	E1364-D1366 PolarHBondContact O-N 2.96Å; D1366-Q1588 PolarHBondContact O-NE2 3.32Å; D1366-Q1588 PolarHBondContact O-OE1 2.79Å; D1366-K1592 IonicContact OD2-NZ 3.9Å; D1366-K1592 PolarHBondContact OD2-NZ 3.42Å
1367	R	63.4	Low	62.1	Low	138 Å²	138	60.2 Å²	60.2	52%	0.521	32%	0.322	S	S	.	.	S	Bend	trans	-116.4	139.4	-168.7	-76.7	-175.5	169.2	-151.2	0.1	112.9	N1365 D1589	N1365-R1367 PolarHBondContact O-N 2.71Å; R1367-D1589 IonicContact CZ-OD1 3.9Å; R1367-D1589 IonicContact CZ-OD2 3.21Å; R1367-D1589 IonicContact NE-OD1 2.83Å; R1367-D1589 IonicContact NH2-OD1 3.84Å; R1367-D1589 PolarHBondContact NH2-OD1 3.01Å; R1367-D1589 IonicContact NH2-OD2 3.97Å; R1367-D1589 PolarHBondContact NH2-OD2 3.44Å
1368	L	69.1	Low	62	Low	15 Å²	15	65.6 Å²	65.6	8%	0.079	35%	0.35	C	S	.	.			trans	-76.9	142.7	170.3	-63.4	160.3	0	0	0	110	P1359 A1581 V1584 N1585 M1607	P1359-L1368 HydrophobicContact CB-CD2 3.9Å; L1368-A1581 HydrophobicContact CB-CB 3.82Å; L1368-A1581 HydrophobicContact CD1-CB 4.03Å; L1368-V1584 HydrophobicContact CD1-CB 3.98Å; L1368-V1584 HydrophobicContact CD1-CG1 3.83Å; L1368-N1585 PolarHBondContact N-OD1 2.99Å; L1368-N1585 VanDerWaalsContact N-OD1 3.08Å; L1368-N1585 PolarHBondContact O-ND2 2.81Å; L1368-M1607 HydrophobicContact CD1-CE 3.48Å; L1368-M1607 VanDerWaalsContact CD1-CE 3.48Å; L1368-M1607 HydrophobicContact CD1-SD 3.84Å; L1368-M1607 HydrophobicContact CD2-CE 3.91Å; L1368-M1607 HydrophobicContact CG-CE 4.36Å
1369	Y	67.5	Low	61.9	Low	93 Å²	93	72.4 Å²	72.4	37%	0.365	39%	0.386	S	S	.	.			trans	-69.8	150.6	162.6	173.2	-83.7	0	0	0	109.2	G1356 E1392 A1581	G1356-Y1369 WeakPolarHBondContact O-CB 3.46Å; Y1369-E1392 PolarHBondContact OH-OE2 3Å; Y1369-A1581 WeakPolarHBondContact O-CB 3.45Å
1370	A	71.4	Confident	62.3	Low	20 Å²	20	78.7 Å²	78.7	17%	0.165	42%	0.419	C	S	.	.			trans	-155.1	132.5	177.4	0	0	0	0	0	111	A1581 Q1582	A1370-A1581 HydrophobicContact CB-CB 3.88Å; A1370-Q1582 HydrophobicContact CB-CG 3.77Å
1371	I	76.2	Confident	63.1	Low	1 Å²	1	81.5 Å²	81.5	1%	0.005	44%	0.438	C	S	.	.			trans	-54.4	122	-179.1	-52.8	177.9	0	0	0	110.8	Y1350 G1353 L1354 F1387 R1390 Q1582	Y1350-I1371 HydrophobicContact CD2-CD1 3.77Å; Y1350-I1371 HydrophobicContact CE2-CD1 3.8Å; G1353-I1371 VanDerWaalsContact C-CG1 3.49Å; G1353-I1371 VanDerWaalsContact O-CG1 3.28Å; G1353-I1371 WeakPolarHBondContact O-CG1 2.83Å; L1354-I1371 HydrophobicContact CD2-CD1 4.22Å; L1354-I1371 HydrophobicContact CG-CD1 4.4Å; I1371-F1387 HydrophobicContact CG2-CE2 3.74Å; I1371-F1387 HydrophobicContact CG2-CZ 3.75Å; I1371-R1390 HydrophobicContact CG2-CB 4.11Å; I1371-R1390 PolarHBondContact O-NH2 3.03Å; I1371-Q1582 PolarHBondContact O-NE2 2.87Å
1372	P	67.9	Low	64.3	Low	45 Å²	45	83 Å²	83	29%	0.292	45%	0.448	S	S	.	.			trans	-66.1	163.1	-173.4	25.4	-34	0	0	0	113.4	R1390 E1392	P1372-R1390 WeakPolarHBondContact CG-O 3.38Å; P1372-R1390 WeakPolarHBondContact O-CG 3.25Å; P1372-R1390 PolarHBondContact O-NE 3.39Å; P1372-E1392 HydrophobicContact CG-CG 3.8Å
1373	G	68.1	Low	65.9	Low	47 Å²	47	82.5 Å²	82.5	49%	0.485	44%	0.443	S	S	.	.	S	Bend	trans	70.7	-152	177	0	0	0	0	0	114.8	Q1582	G1373-Q1582 PolarHBondContact O-NE2 3.46Å
1374	S	63.9	Low	67.8	Low	51 Å²	51	81.4 Å²	81.4	36%	0.357	44%	0.436	S	S	.	.			trans	-135.8	155.1	175.3	-68.4	0	0	0	0	109.2	R1390 Q1549	S1374-R1390 WeakPolarHBondContact O-CD 3.33Å; S1374-Q1549 PolarHBondContact OG-NE2 2.83Å
1375	P	70.9	Confident	69.7	Low	64 Å²	64	72.3 Å²	72.3	42%	0.416	39%	0.394	S	S	.	.	P	Polyproline II helix	trans	-54.8	149.8	171.7	-24.3	34.1	0	0	0	112.7
1376	P	68.3	Low	71.4	Confident	33 Å²	33	67.3 Å²	67.3	21%	0.214	37%	0.368	C	S	.	.	P	Polyproline II helix	trans	-67.6	160.8	175.8	29.7	-35.8	0	0	0	112.1	Y1329 A1330 P1382	Y1329-P1376 WeakPolarHBondContact OH-CD 3.39Å; A1330-P1376 HydrophobicContact CB-CG 4.38Å; P1376-P1382 HydrophobicContact CB-CG 4Å; P1376-P1382 HydrophobicContact CG-CG 4.37Å
1377	D	64.1	Low	72.9	Confident	100 Å²	100	62.5 Å²	62.5	54%	0.535	34%	0.342	S	S	.	.	P	Polyproline II helix	trans	-75.6	123.9	169.1	-168	-16	0	0	0	109.4	L1379 D1380	D1377-L1379 PolarHBondContact O-N 2.6Å; D1377-L1379 VanDerWaalsContact OD1-CB 3.3Å; D1377-L1379 WeakPolarHBondContact OD1-CB 3.5Å; D1377-L1379 WeakPolarHBondContact OD1-CG 3.48Å; D1377-L1379 PolarHBondContact OD1-N 2.74Å; D1377-D1380 CarbonylContact O-C 3.49Å; D1377-D1380 PolarHBondContact O-N 2.87Å; D1377-D1380 VanDerWaalsContact O-N 3.11Å
1378	L	67	Low	74	Confident	115 Å²	115	60.3 Å²	60.3	60%	0.602	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.9	-8.5	177.2	-59.7	180	0	0	0	112.7	A1330	A1330-L1378 HydrophobicContact CB-CD2 3.91Å
1379	L	63.8	Low	74.6	Confident	158 Å²	158	63.5 Å²	63.5	83%	0.827	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.4	-17.3	169.8	-57.7	175.3	0	0	0	113.3	D1377	D1377-L1379 PolarHBondContact O-N 2.6Å; D1377-L1379 VanDerWaalsContact OD1-CB 3.3Å; D1377-L1379 WeakPolarHBondContact OD1-CB 3.5Å; D1377-L1379 WeakPolarHBondContact OD1-CG 3.48Å; D1377-L1379 PolarHBondContact OD1-N 2.74Å
1380	D	65.6	Low	75.5	Confident	139 Å²	139	59.6 Å²	59.6	74%	0.743	34%	0.341	S	S	*	.	S	Bend	trans	-145.8	66.7	177.8	-165.4	29.5	0	0	0	110	D1377	D1377-D1380 CarbonylContact O-C 3.49Å; D1377-D1380 PolarHBondContact O-N 2.87Å; D1377-D1380 VanDerWaalsContact O-N 3.11Å
1381	P	73.4	Confident	76.2	Confident	81 Å²	81	59.1 Å²	59.1	53%	0.526	34%	0.335	S	S	.	.			trans	-71.1	155.6	-171.3	29.1	-36.1	0	0	0	112.9
1382	P	78.8	Confident	76.3	Confident	39 Å²	39	64.8 Å²	64.8	25%	0.253	36%	0.362	S	S	.	.			trans	-56.3	155.3	174.5	-26.5	37.1	0	0	0	113.7	P1376 P1389	P1376-P1382 HydrophobicContact CB-CG 4Å; P1376-P1382 HydrophobicContact CG-CG 4.37Å; P1382-P1389 HydrophobicContact CG-CG 4.25Å
1383	K	81.6	Confident	77.1	Confident	157 Å²	157	65.9 Å²	65.9	68%	0.683	36%	0.362	S	S	*	.	S	Bend	trans	-80.2	-36.5	-178	177	178	172.5	-79.9	0	113.7	E1400	K1383-E1400 PolarHBondContact NZ-O 3.34Å
1384	G	87.3	Confident	77.9	Confident	1 Å²	1	65.4 Å²	65.4	1%	0.01	35%	0.353	C	S	.	.	S	Bend	trans	-100	-144.8	170.1	0	0	0	0	0	110.5	A1386 D1398 L1401 E1402	G1384-A1386 PolarHBondContact O-N 2.93Å; G1384-D1398 CarbonylContact C-O 3.56Å; G1384-D1398 VanDerWaalsContact CA-O 3.27Å; G1384-D1398 WeakPolarHBondContact CA-O 3.35Å; G1384-L1401 VanDerWaalsContact CA-C 3.5Å; G1384-E1402 VanDerWaalsContact O-CD 3.25Å
1385	D	87.9	Confident	79	Confident	5 Å²	5	65.1 Å²	65.1	3%	0.027	35%	0.348	C	S	.	.			trans	-47.4	125.4	174.2	169.2	29.8	0	0	0	111.5	F1387 Y1388 D1398 E1402 P1403	D1385-F1387 VanDerWaalsContact CG-N 3.31Å; D1385-F1387 PolarHBondContact O-N 2.76Å; D1385-F1387 WeakPolarHBondContact OD1-CB 3.34Å; D1385-F1387 PolarHBondContact OD1-N 3.19Å; D1385-F1387 WeakPolarHBondContact OD2-CB 3.35Å; D1385-Y1388 VanDerWaalsContact O-CB 3.25Å; D1385-Y1388 WeakPolarHBondContact O-CB 3.21Å; D1385-Y1388 PolarHBondContact O-N 3.46Å; D1385-Y1388 PolarHBondContact OD2-N 3.37Å; D1385-D1398 HydrophobicContact CB-CB 4.13Å; D1385-D1398 PolarHBondContact N-O 2.69Å; D1385-E1402 WeakPolarHBondContact CA-OE2 3.29Å; D1385-P1403 HydrophobicContact CB-CG 4.48Å
1386	A	85.4	Confident	79.7	Confident	8 Å²	8	70.9 Å²	70.9	7%	0.066	37%	0.366	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61	-28.1	175.8	0	0	0	0	0	112.7	Y1329 A1330 G1384 P1389	Y1329-A1386 HydrophobicContact CD1-CB 4.12Å; Y1329-A1386 HydrophobicContact CE1-CB 4.07Å; Y1329-A1386 WeakPolarHBondContact CE1-O 3.34Å; A1330-A1386 HydrophobicContact CB-CB 3.81Å; G1384-A1386 PolarHBondContact O-N 2.93Å; A1386-P1389 WeakPolarHBondContact O-CD 3.48Å
1387	F	89.5	Confident	80.6	Confident	3 Å²	3	72.2 Å²	72.2	1%	0.013	37%	0.371	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84	-15.4	179.6	-169.2	-115.2	0	0	0	113.7	Y1329 P1349 Y1350 I1371 D1385 P1389 R1390 N1391	Y1329-F1387 HydrophobicContact CD1-CB 3.96Å; Y1329-F1387 HydrophobicContact CD1-CD2 4.28Å; Y1329-F1387 HydrophobicContact CD2-CD2 4.41Å; Y1329-F1387 HydrophobicContact CE1-CB 3.9Å; Y1329-F1387 AromaticContact CE1-CD2 3.93Å; Y1329-F1387 HydrophobicContact CE1-CD2 3.93Å; Y1329-F1387 HydrophobicContact CE1-CG 4.43Å; Y1329-F1387 HydrophobicContact CE2-CD2 4.05Å; Y1329-F1387 HydrophobicContact CG-CD2 4.49Å; Y1329-F1387 AromaticContact CZ-CD2 3.76Å; P1349-F1387 HydrophobicContact CB-CD1 4.36Å; P1349-F1387 HydrophobicContact CB-CE1 3.95Å; Y1350-F1387 AromaticContact CD2-CD2 3.84Å; Y1350-F1387 HydrophobicContact CD2-CD2 3.84Å; Y1350-F1387 AromaticContact CD2-CE2 3.49Å; Y1350-F1387 HydrophobicContact CD2-CE2 3.49Å; Y1350-F1387 VanDerWaalsContact CD2-CE2 3.49Å; Y1350-F1387 HydrophobicContact CD2-CZ 4.03Å; Y1350-F1387 HydrophobicContact CE2-CE2 4.41Å; Y1350-F1387 HydrophobicContact CG-CD2 4.24Å; Y1350-F1387 HydrophobicContact CG-CE2 4.18Å; I1371-F1387 HydrophobicContact CG2-CE2 3.74Å; I1371-F1387 HydrophobicContact CG2-CZ 3.75Å; D1385-F1387 VanDerWaalsContact CG-N 3.31Å; D1385-F1387 PolarHBondContact O-N 2.76Å; D1385-F1387 WeakPolarHBondContact OD1-CB 3.34Å; D1385-F1387 PolarHBondContact OD1-N 3.19Å; D1385-F1387 WeakPolarHBondContact OD2-CB 3.35Å; F1387-P1389 VanDerWaalsContact C-N 3.32Å; F1387-P1389 WeakPolarHBondContact O-CD 3.36Å; F1387-R1390 HydrophobicContact CD2-CB 4.04Å; F1387-R1390 HydrophobicContact CE2-CB 3.64Å; F1387-R1390 HydrophobicContact CZ-CB 4.1Å; F1387-R1390 PolarHBondContact O-N 2.95Å; F1387-N1391 HydrophobicContact CD1-CB 3.63Å; F1387-N1391 HydrophobicContact CE1-CB 3.71Å; F1387-N1391 PolarHBondContact O-N 3.42Å; F1387-N1391 VanDerWaalsContact O-N 3.12Å
1388	Y	86.4	Confident	81.8	Confident	91 Å²	91	67.5 Å²	67.5	36%	0.357	35%	0.346	S	S	.	.	G	3₁₀ helix	trans	-41	-47.3	178.7	170.1	-104.2	0	0	0	114.6	D1385 R1390 N1391 A1394 L1395 D1398 A1399	D1385-Y1388 VanDerWaalsContact O-CB 3.25Å; D1385-Y1388 WeakPolarHBondContact O-CB 3.21Å; D1385-Y1388 PolarHBondContact O-N 3.46Å; D1385-Y1388 PolarHBondContact OD2-N 3.37Å; Y1388-R1390 PolarHBondContact O-N 3.34Å; Y1388-N1391 PolarHBondContact O-N 3Å; Y1388-A1394 HydrophobicContact CD2-CB 3.54Å; Y1388-A1394 HydrophobicContact CE2-CB 3.61Å; Y1388-L1395 WeakPolarHBondContact CE2-O 3.41Å; Y1388-D1398 HydrophobicContact CD2-CB 3.57Å; Y1388-D1398 HydrophobicContact CE2-CB 4.44Å; Y1388-D1398 HydrophobicContact CG-CB 4.19Å; Y1388-A1399 HydrophobicContact CD1-CB 3.96Å; Y1388-A1399 HydrophobicContact CD2-CB 4.25Å; Y1388-A1399 HydrophobicContact CE1-CB 3.59Å; Y1388-A1399 HydrophobicContact CE2-CB 3.88Å; Y1388-A1399 HydrophobicContact CG-CB 4.29Å
1389	P	81.9	Confident	82.8	Confident	83 Å²	83	63.7 Å²	63.7	54%	0.539	33%	0.331	S	S	.	.	G	3₁₀ helix	trans	-68.2	-7.2	-177.4	-18.6	33.7	0	0	0	115	P1382 A1386 F1387	P1382-P1389 HydrophobicContact CG-CG 4.25Å; A1386-P1389 WeakPolarHBondContact O-CD 3.48Å; F1387-P1389 VanDerWaalsContact C-N 3.32Å; F1387-P1389 WeakPolarHBondContact O-CD 3.36Å
1390	R	85.8	Confident	83.9	Confident	10 Å²	10	62 Å²	62	4%	0.038	32%	0.319	C	S	.	.	G	3₁₀ helix	trans	-124	-4.2	-179	-56.3	-176.4	74.4	-165.6	0.1	113.2	Y1329 I1371 P1372 S1374 F1387 Y1388 E1392	Y1329-R1390 WeakPolarHBondContact OH-CD 3.19Å; I1371-R1390 HydrophobicContact CG2-CB 4.11Å; I1371-R1390 PolarHBondContact O-NH2 3.03Å; P1372-R1390 WeakPolarHBondContact CG-O 3.38Å; P1372-R1390 WeakPolarHBondContact O-CG 3.25Å; P1372-R1390 PolarHBondContact O-NE 3.39Å; S1374-R1390 WeakPolarHBondContact O-CD 3.33Å; F1387-R1390 HydrophobicContact CD2-CB 4.04Å; F1387-R1390 HydrophobicContact CE2-CB 3.64Å; F1387-R1390 HydrophobicContact CZ-CB 4.1Å; F1387-R1390 PolarHBondContact O-N 2.95Å; Y1388-R1390 PolarHBondContact O-N 3.34Å; R1390-E1392 PolarHBondContact O-N 3.42Å
1391	N	85.3	Confident	84.9	Confident	10 Å²	10	60 Å²	60	5%	0.053	31%	0.308	C	S	.	.			trans	-86.5	108.9	-176.4	-178.3	1.3	0	0	0	110.2	P1349 F1387 Y1388 F1393 A1394	P1349-N1391 VanDerWaalsContact CB-OD1 3.31Å; P1349-N1391 WeakPolarHBondContact CB-OD1 3.48Å; F1387-N1391 HydrophobicContact CD1-CB 3.63Å; F1387-N1391 HydrophobicContact CE1-CB 3.71Å; F1387-N1391 PolarHBondContact O-N 3.42Å; F1387-N1391 VanDerWaalsContact O-N 3.12Å; Y1388-N1391 PolarHBondContact O-N 3Å; N1391-F1393 PolarHBondContact O-N 3.41Å; N1391-F1393 WeakPolarHBondContact OD1-CA 3.35Å; N1391-F1393 WeakPolarHBondContact OD1-CB 3.45Å; N1391-F1393 PolarHBondContact OD1-N 3.46Å; N1391-A1394 HydrophobicContact CB-CB 4.08Å; N1391-A1394 WeakPolarHBondContact O-CB 3.47Å; N1391-A1394 PolarHBondContact O-N 3.4Å; N1391-A1394 VanDerWaalsContact O-N 3.14Å; N1391-A1394 PolarHBondContact OD1-N 3.45Å
1392	E	79.9	Confident	85.5	Confident	120 Å²	120	59.6 Å²	59.6	56%	0.561	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.8	-19.8	178.2	-59.3	-168.6	121.7	0	0	113.1	Y1369 P1372 R1390	Y1369-E1392 PolarHBondContact OH-OE2 3Å; P1372-E1392 HydrophobicContact CG-CG 3.8Å; R1390-E1392 PolarHBondContact O-N 3.42Å
1393	F	84.8	Confident	86	Confident	69 Å²	69	58.5 Å²	58.5	30%	0.303	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.2	10.9	179.8	-53.2	-72.7	0	0	0	113.3	P1349 W1352 N1391 L1395 L1418 I1426	P1349-F1393 HydrophobicContact CB-CD2 4.44Å; W1352-F1393 AromaticContact CE3-CD2 3.87Å; W1352-F1393 HydrophobicContact CE3-CD2 3.87Å; W1352-F1393 AromaticContact CE3-CE2 3.86Å; W1352-F1393 HydrophobicContact CE3-CE2 3.86Å; W1352-F1393 AromaticContact CZ3-CD2 3.76Å; W1352-F1393 HydrophobicContact CZ3-CD2 3.76Å; W1352-F1393 HydrophobicContact CZ3-CE2 4.05Å; W1352-F1393 HydrophobicContact CZ3-CG 4.22Å; N1391-F1393 PolarHBondContact O-N 3.41Å; N1391-F1393 WeakPolarHBondContact OD1-CA 3.35Å; N1391-F1393 WeakPolarHBondContact OD1-CB 3.45Å; N1391-F1393 PolarHBondContact OD1-N 3.46Å; F1393-L1395 PolarHBondContact O-N 2.97Å; F1393-L1418 HydrophobicContact CB-CD1 4Å; F1393-I1426 HydrophobicContact CB-CD1 3.88Å; F1393-I1426 HydrophobicContact CD1-CD1 3.76Å; F1393-I1426 HydrophobicContact CD1-CG1 4.33Å; F1393-I1426 HydrophobicContact CD1-CG2 3.89Å; F1393-I1426 HydrophobicContact CE1-CG2 3.79Å; F1393-I1426 HydrophobicContact CG-CD1 4.05Å; F1393-I1426 HydrophobicContact CG-CG2 4.43Å; F1393-I1426 HydrophobicContact CZ-CG2 4.27Å
1394	A	84.7	Confident	86.3	Confident	36 Å²	36	54.1 Å²	54.1	30%	0.298	28%	0.279	S	S	.	.			trans	-52.6	127.3	-175.9	0	0	0	0	0	114	Y1388 N1391	Y1388-A1394 HydrophobicContact CD2-CB 3.54Å; Y1388-A1394 HydrophobicContact CE2-CB 3.61Å; N1391-A1394 HydrophobicContact CB-CB 4.08Å; N1391-A1394 WeakPolarHBondContact O-CB 3.47Å; N1391-A1394 PolarHBondContact O-N 3.4Å; N1391-A1394 VanDerWaalsContact O-N 3.14Å; N1391-A1394 PolarHBondContact OD1-N 3.45Å
1395	L	87.4	Confident	86.4	Confident	46 Å²	46	58.7 Å²	58.7	24%	0.241	30%	0.299	C	S	.	.			trans	-85.9	171.3	167.9	-47.3	178.6	0	0	0	109.5	Y1388 F1393 I1397 D1398 W1417 L1418 A1423 P1424	Y1388-L1395 WeakPolarHBondContact CE2-O 3.41Å; F1393-L1395 PolarHBondContact O-N 2.97Å; L1395-I1397 VanDerWaalsContact C-N 3.26Å; L1395-I1397 HydrophobicContact CB-CG2 4.07Å; L1395-I1397 PolarHBondContact O-N 2.8Å; L1395-D1398 VanDerWaalsContact CA-OD2 3.27Å; L1395-D1398 WeakPolarHBondContact CA-OD2 3.49Å; L1395-D1398 WeakPolarHBondContact CB-OD2 3.36Å; L1395-D1398 PolarHBondContact N-OD2 2.73Å; L1395-W1417 HydrophobicContact CD1-CB 4.27Å; L1395-L1418 HydrophobicContact CD1-CD2 4.16Å; L1395-L1418 HydrophobicContact CD2-CD2 4.19Å; L1395-L1418 HydrophobicContact CG-CD2 4.05Å; L1395-A1423 HydrophobicContact CD1-CB 4.25Å; L1395-P1424 HydrophobicContact CD2-CG 4.18Å
1396	K	84	Confident	86.5	Confident	184 Å²	184	60.5 Å²	60.5	80%	0.8	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.3	-24.9	178.2	-67.5	-176.5	179.1	179.4	0	113.3
1397	I	88.1	Confident	86.7	Confident	61 Å²	61	67 Å²	67	31%	0.313	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.1	-33.1	-178	-174.7	166.4	0	0	0	112	L1395 A1399 E1400 L1401 W1417	L1395-I1397 VanDerWaalsContact C-N 3.26Å; L1395-I1397 HydrophobicContact CB-CG2 4.07Å; L1395-I1397 PolarHBondContact O-N 2.8Å; I1397-A1399 PolarHBondContact O-N 3.31Å; I1397-A1399 VanDerWaalsContact O-N 3.14Å; I1397-E1400 PolarHBondContact O-N 3.21Å; I1397-L1401 HydrophobicContact CD1-CD1 4.39Å; I1397-L1401 HydrophobicContact CG1-CB 4.25Å; I1397-L1401 HydrophobicContact CG1-CD1 4.41Å; I1397-L1401 PolarHBondContact O-N 3.12Å; I1397-W1417 HydrophobicContact CD1-CD2 3.9Å; I1397-W1417 HydrophobicContact CD1-CE3 3.99Å; I1397-W1417 HydrophobicContact CD1-CH2 3.84Å; I1397-W1417 HydrophobicContact CD1-CZ2 3.73Å; I1397-W1417 HydrophobicContact CD1-CZ3 3.96Å; I1397-W1417 HydrophobicContact CG1-CD2 4.11Å; I1397-W1417 HydrophobicContact CG1-CG 4.46Å; I1397-W1417 HydrophobicContact CG1-CZ2 4.05Å; I1397-W1417 HydrophobicContact CG2-CB 3.81Å; I1397-W1417 HydrophobicContact CG2-CD2 3.92Å; I1397-W1417 HydrophobicContact CG2-CG 3.56Å
1398	D	89.6	Confident	86.5	Confident	1 Å²	1	70.2 Å²	70.2	1%	0.005	35%	0.352	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.2	-27.4	174.9	-56.8	-91.6	0	0	0	112.4	G1384 D1385 Y1388 L1395 W1417	G1384-D1398 CarbonylContact C-O 3.56Å; G1384-D1398 VanDerWaalsContact CA-O 3.27Å; G1384-D1398 WeakPolarHBondContact CA-O 3.35Å; D1385-D1398 HydrophobicContact CB-CB 4.13Å; D1385-D1398 PolarHBondContact N-O 2.69Å; Y1388-D1398 HydrophobicContact CD2-CB 3.57Å; Y1388-D1398 HydrophobicContact CE2-CB 4.44Å; Y1388-D1398 HydrophobicContact CG-CB 4.19Å; L1395-D1398 VanDerWaalsContact CA-OD2 3.27Å; L1395-D1398 WeakPolarHBondContact CA-OD2 3.49Å; L1395-D1398 WeakPolarHBondContact CB-OD2 3.36Å; L1395-D1398 PolarHBondContact N-OD2 2.73Å; D1398-W1417 VanDerWaalsContact OD1-CD1 3.31Å
1399	A	87.1	Confident	86.6	Confident	36 Å²	36	67.9 Å²	67.9	30%	0.298	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.2	-22.8	174.4	0	0	0	0	0	114.1	Y1388 I1397	Y1388-A1399 HydrophobicContact CD1-CB 3.96Å; Y1388-A1399 HydrophobicContact CD2-CB 4.25Å; Y1388-A1399 HydrophobicContact CE1-CB 3.59Å; Y1388-A1399 HydrophobicContact CE2-CB 3.88Å; Y1388-A1399 HydrophobicContact CG-CB 4.29Å; I1397-A1399 PolarHBondContact O-N 3.31Å; I1397-A1399 VanDerWaalsContact O-N 3.14Å
1400	E	86.8	Confident	86.5	Confident	123 Å²	123	72 Å²	72	58%	0.575	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.2	-32.4	-167.2	-68.2	-170.1	-157.9	0	0	113.8	K1383 I1397	K1383-E1400 PolarHBondContact NZ-O 3.34Å; I1397-E1400 PolarHBondContact O-N 3.21Å
1401	L	87	Confident	86.6	Confident	96 Å²	96	73.9 Å²	73.9	50%	0.503	38%	0.38	S	S	.	.	S	Bend	trans	-143.2	138.8	-173.9	-66.7	175	0	0	0	111.2	G1384 I1397 W1417	G1384-L1401 VanDerWaalsContact CA-C 3.5Å; I1397-L1401 HydrophobicContact CD1-CD1 4.39Å; I1397-L1401 HydrophobicContact CG1-CB 4.25Å; I1397-L1401 HydrophobicContact CG1-CD1 4.41Å; I1397-L1401 PolarHBondContact O-N 3.12Å; L1401-W1417 HydrophobicContact CB-CZ2 4.11Å; L1401-W1417 PolarHBondContact O-NE1 3.33Å
1402	E	86.6	Confident	87	Confident	73 Å²	73	73.6 Å²	73.6	34%	0.341	38%	0.378	S	S	.	.	P	Polyproline II helix	trans	-65.5	134.8	170.5	-71.9	-81	-160.1	0	0	111.1	K1332 G1384 D1385 W1417	K1332-E1402 IonicContact NZ-OE1 2.72Å; K1332-E1402 PolarHBondContact NZ-OE1 2.92Å; G1384-E1402 VanDerWaalsContact O-CD 3.25Å; D1385-E1402 WeakPolarHBondContact CA-OE2 3.29Å; E1402-W1417 WeakPolarHBondContact O-CZ2 3.29Å
1403	P	89.3	Confident	87.6	Confident	15 Å²	15	70.9 Å²	70.9	10%	0.097	36%	0.364	C	S	.	.	P	Polyproline II helix	trans	-70.2	141.2	174.7	27.2	-33.5	0	0	0	111.9	D1385 A1415 W1417	D1385-P1403 HydrophobicContact CB-CG 4.48Å; P1403-A1415 HydrophobicContact CG-CB 4.36Å; P1403-A1415 WeakPolarHBondContact CG-O 3.36Å; P1403-W1417 HydrophobicContact CB-CD2 4.16Å; P1403-W1417 HydrophobicContact CB-CG 4.02Å
1404	P	88.6	Confident	88	Confident	65 Å²	65	67.6 Å²	67.6	42%	0.422	35%	0.35	S	S	.	.	P	Polyproline II helix	trans	-72.2	159.2	166.9	33.2	-35	0	0	0	110.4	F1406 A1415	P1404-F1406 HydrophobicContact CG-CD2 4.37Å; P1404-F1406 HydrophobicContact CG-CE2 3.77Å; P1404-F1406 HydrophobicContact CG-CZ 3.87Å; P1404-F1406 WeakPolarHBondContact O-CD2 3.38Å; P1404-F1406 WeakPolarHBondContact O-CE2 3.47Å; P1404-F1406 PolarHBondContact O-N 3.36Å; P1404-A1415 WeakPolarHBondContact O-CA 3.36Å
1405	F	88.9	Confident	88.4	Confident	97 Å²	97	66.4 Å²	66.4	43%	0.425	34%	0.34	S	S	.	.	P	Polyproline II helix	trans	-64	116.9	162.5	-85.2	-74.6	0	0	0	109.9	I1333 V1336 K1413 A1415	I1333-F1405 HydrophobicContact CB-CZ 4.18Å; I1333-F1405 HydrophobicContact CG2-CZ 3.98Å; I1333-F1405 VanDerWaalsContact O-CZ 3.24Å; I1333-F1405 WeakPolarHBondContact O-CZ 3.33Å; V1336-F1405 HydrophobicContact CG1-CE1 4.28Å; F1405-K1413 HydrophobicContact CB-CB 4.44Å; F1405-K1413 HydrophobicContact CD1-CB 3.75Å; F1405-K1413 HydrophobicContact CE1-CB 4.46Å; F1405-K1413 HydrophobicContact CG-CB 4.44Å; F1405-A1415 HydrophobicContact CD1-CB 4.09Å; F1405-A1415 HydrophobicContact CE1-CB 4.19Å; F1405-A1415 HydrophobicContact CG-CB 4.29Å; F1405-A1415 HydrophobicContact CZ-CB 4.47Å
1406	F	90.2	Very high	88.5	Confident	44 Å²	44	64.2 Å²	64.2	19%	0.193	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	132.3	166.4	-64.9	-95.2	0	0	0	108.7	P1404 K1413 A1414 T1416 W1417 L1419 A1420	P1404-F1406 HydrophobicContact CG-CD2 4.37Å; P1404-F1406 HydrophobicContact CG-CE2 3.77Å; P1404-F1406 HydrophobicContact CG-CZ 3.87Å; P1404-F1406 WeakPolarHBondContact O-CD2 3.38Å; P1404-F1406 WeakPolarHBondContact O-CE2 3.47Å; P1404-F1406 PolarHBondContact O-N 3.36Å; F1406-K1413 VanDerWaalsContact O-CA 3.24Å; F1406-K1413 WeakPolarHBondContact O-CA 3.47Å; F1406-A1414 PolarHBondContact N-O 2.92Å; F1406-A1414 PolarHBondContact O-N 3.12Å; F1406-A1414 VanDerWaalsContact O-N 3.1Å; F1406-T1416 WeakPolarHBondContact CD2-O 3.38Å; F1406-T1416 WeakPolarHBondContact CE2-O 3.32Å; F1406-W1417 HydrophobicContact CZ-CE3 4.2Å; F1406-W1417 HydrophobicContact CZ-CZ3 4.35Å; F1406-L1419 HydrophobicContact CB-CB 3.83Å; F1406-L1419 HydrophobicContact CB-CD1 3.81Å; F1406-L1419 HydrophobicContact CD1-CB 4.08Å; F1406-L1419 HydrophobicContact CD2-CB 3.86Å; F1406-L1419 HydrophobicContact CE2-CB 4.45Å; F1406-L1419 HydrophobicContact CG-CB 3.65Å; F1406-L1419 HydrophobicContact CG-CD1 4.43Å; F1406-A1420 HydrophobicContact CE1-CB 4.37Å; F1406-A1420 HydrophobicContact CZ-CB 4.1Å
1407	E	88	Confident	88.8	Confident	145 Å²	145	57.5 Å²	57.5	68%	0.678	30%	0.298	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86.5	127.2	177	-56.4	-171.1	142.7	0	0	109.6	K1413	E1407-K1413 HydrophobicContact CG-CD 3.98Å; E1407-K1413 HydrophobicContact CG-CG 4.26Å; E1407-K1413 WeakPolarHBondContact OE1-CE 3.28Å; E1407-K1413 IonicContact OE1-NZ 3.34Å; E1407-K1413 PolarHBondContact OE1-NZ 3.34Å
1408	L	87.3	Confident	88.8	Confident	69 Å²	69	55.5 Å²	55.5	36%	0.361	29%	0.288	S	S	.	.	S	Bend	trans	-110.3	-38.4	-174.9	-65.8	150.7	0	0	0	110.8	Q1347 H1412 A1414 L1419	Q1347-L1408 HydrophobicContact CB-CD1 4.08Å; Q1347-L1408 HydrophobicContact CG-CD1 3.63Å; Q1347-L1408 HydrophobicContact CG-CD2 4.02Å; Q1347-L1408 HydrophobicContact CG-CG 4.46Å; L1408-H1412 HydrophobicContact CB-CB 3.98Å; L1408-H1412 WeakPolarHBondContact CB-O 3.41Å; L1408-H1412 HydrophobicContact CD1-CB 4.46Å; L1408-H1412 PolarHBondContact N-O 3.23Å; L1408-A1414 HydrophobicContact CD1-CB 3.99Å; L1408-L1419 HydrophobicContact CD1-CD1 3.95Å; L1408-L1419 HydrophobicContact CD2-CD1 3.81Å; L1408-L1419 HydrophobicContact CD2-CD2 3.85Å; L1408-L1419 HydrophobicContact CD2-CG 4.48Å; L1408-L1419 HydrophobicContact CG-CD1 4.11Å
1409	S	88.1	Confident	88.7	Confident	42 Å²	42	57.4 Å²	57.4	29%	0.294	30%	0.298	S	S	.	.	S	Bend	trans	-142.4	-178.1	168.2	77.7	0	0	0	0	109	E1341 T1411 H1412	E1341-S1409 PolarHBondContact OE1-OG 3.16Å; S1409-T1411 PolarHBondContact O-N 3.02Å; S1409-T1411 PolarHBondContact OG-N 2.76Å; S1409-T1411 VanDerWaalsContact OG-N 3.09Å; S1409-T1411 PolarHBondContact OG-OG1 3.2Å; S1409-T1411 VanDerWaalsContact OG-OG1 3.09Å; S1409-H1412 PolarHBondContact N-O 3.34Å; S1409-H1412 VanDerWaalsContact OG-CB 3.31Å; S1409-H1412 WeakPolarHBondContact OG-CB 3.49Å; S1409-H1412 PolarHBondContact OG-N 3.03Å
1410	D	79.7	Confident	88.7	Confident	169 Å²	169	56.5 Å²	56.5	90%	0.904	29%	0.29	S	S	*	.	S	Bend	trans	-61.4	-23.5	171.3	-69.3	-39.5	0	0	0	112.5
1411	T	87.3	Confident	88.2	Confident	50 Å²	50	56.3 Å²	56.3	31%	0.307	30%	0.3	S	S	.	.	S	Bend	trans	-105.4	-33.1	-178.4	33	0	0	0	0	114.3	T1338 E1341 S1409	T1338-T1411 HydrophobicContact CG2-CG2 4.25Å; E1341-T1411 VanDerWaalsContact CD-OG1 3.23Å; E1341-T1411 PolarHBondContact OE1-OG1 2.76Å; E1341-T1411 VanDerWaalsContact OE2-CB 3.24Å; E1341-T1411 WeakPolarHBondContact OE2-CB 3.3Å; E1341-T1411 PolarHBondContact OE2-OG1 2.88Å; S1409-T1411 PolarHBondContact O-N 3.02Å; S1409-T1411 PolarHBondContact OG-N 2.76Å; S1409-T1411 VanDerWaalsContact OG-N 3.09Å; S1409-T1411 PolarHBondContact OG-OG1 3.2Å; S1409-T1411 VanDerWaalsContact OG-OG1 3.09Å
1412	H	93.1	Very high	87.9	Confident	5 Å²	5	59.7 Å²	59.7	2%	0.023	31%	0.313	C	S	.	.			trans	-99.3	125.8	-171.6	-165.6	-175.8	0	0	0	112.9	E1335 V1336 E1341 N1345 L1408 S1409	E1335-H1412 IonicContact OE1-CD2 3.66Å; E1335-H1412 IonicContact OE1-CE1 2.64Å; E1335-H1412 IonicContact OE1-NE2 3.83Å; E1335-H1412 PolarHBondContact OE1-NE2 3.43Å; V1336-H1412 CarbonylContact O-C 3.54Å; V1336-H1412 VanDerWaalsContact O-CA 3.27Å; V1336-H1412 WeakPolarHBondContact O-CA 3.34Å; V1336-H1412 PolarHBondContact O-CD2 3.44Å; E1341-H1412 HydrophobicContact CB-CB 4.3Å; E1341-H1412 HydrophobicContact CG-CB 4.32Å; E1341-H1412 PolarHBondContact OE2-N 2.87Å; N1345-H1412 PolarHBondContact O-CE1 2.97Å; L1408-H1412 HydrophobicContact CB-CB 3.98Å; L1408-H1412 WeakPolarHBondContact CB-O 3.41Å; L1408-H1412 HydrophobicContact CD1-CB 4.46Å; L1408-H1412 PolarHBondContact N-O 3.23Å; S1409-H1412 PolarHBondContact N-O 3.34Å; S1409-H1412 VanDerWaalsContact OG-CB 3.31Å; S1409-H1412 WeakPolarHBondContact OG-CB 3.49Å; S1409-H1412 PolarHBondContact OG-N 3.03Å
1413	K	93.4	Very high	87.6	Confident	63 Å²	63	57.4 Å²	57.4	27%	0.274	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	134.8	177.2	-48.2	-174.2	-178.5	-165.7	0	110.3	E1335 V1336 F1405 F1406 E1407	E1335-K1413 CarbonylContact C-O 3.55Å; E1335-K1413 WeakPolarHBondContact CA-O 3.35Å; V1336-K1413 HydrophobicContact CG1-CB 4.02Å; V1336-K1413 PolarHBondContact N-O 3.33Å; V1336-K1413 PolarHBondContact O-N 2.6Å; F1405-K1413 HydrophobicContact CB-CB 4.44Å; F1405-K1413 HydrophobicContact CD1-CB 3.75Å; F1405-K1413 HydrophobicContact CE1-CB 4.46Å; F1405-K1413 HydrophobicContact CG-CB 4.44Å; F1406-K1413 VanDerWaalsContact O-CA 3.24Å; F1406-K1413 WeakPolarHBondContact O-CA 3.47Å; E1407-K1413 HydrophobicContact CG-CD 3.98Å; E1407-K1413 HydrophobicContact CG-CG 4.26Å; E1407-K1413 WeakPolarHBondContact OE1-CE 3.28Å; E1407-K1413 IonicContact OE1-NZ 3.34Å; E1407-K1413 PolarHBondContact OE1-NZ 3.34Å
1414	A	92.8	Very high	87	Confident	0 Å²	0	60.1 Å²	60.1	0%	0	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	138.9	177	0	0	0	0	0	111.4	E1335 Q1347 F1406 L1408 T1416 L1419	E1335-A1414 HydrophobicContact CB-CB 4.48Å; E1335-A1414 HydrophobicContact CG-CB 3.76Å; Q1347-A1414 HydrophobicContact CB-CB 3.98Å; F1406-A1414 PolarHBondContact N-O 2.92Å; F1406-A1414 PolarHBondContact O-N 3.12Å; F1406-A1414 VanDerWaalsContact O-N 3.1Å; L1408-A1414 HydrophobicContact CD1-CB 3.99Å; A1414-T1416 PolarHBondContact O-N 3.02Å; A1414-L1419 HydrophobicContact CB-CD1 3.77Å
1415	A	92.6	Very high	85.9	Confident	10 Å²	10	64.3 Å²	64.3	8%	0.083	35%	0.348	C	S	.	.			trans	-98.1	73.3	178.3	0	0	0	0	0	110.3	V1334 H1348 P1403 P1404 F1405	V1334-A1415 PolarHBondContact O-N 2.69Å; H1348-A1415 PolarHBondContact CD2-O 3.21Å; H1348-A1415 PolarHBondContact NE2-O 3.07Å; P1403-A1415 HydrophobicContact CG-CB 4.36Å; P1403-A1415 WeakPolarHBondContact CG-O 3.36Å; P1404-A1415 WeakPolarHBondContact O-CA 3.36Å; F1405-A1415 HydrophobicContact CD1-CB 4.09Å; F1405-A1415 HydrophobicContact CE1-CB 4.19Å; F1405-A1415 HydrophobicContact CG-CB 4.29Å; F1405-A1415 HydrophobicContact CZ-CB 4.47Å
1416	T	90.5	Very high	85	Confident	0 Å²	0	62 Å²	62	0%	0	34%	0.34	C	S	.	.			trans	-138.4	140.2	174.5	-179	0	0	0	0	111.8	F1406 A1414 L1418 L1419	F1406-T1416 WeakPolarHBondContact CD2-O 3.38Å; F1406-T1416 WeakPolarHBondContact CE2-O 3.32Å; A1414-T1416 PolarHBondContact O-N 3.02Å; T1416-L1418 HydrophobicContact CG2-CB 4.14Å; T1416-L1418 PolarHBondContact O-N 3.11Å; T1416-L1418 VanDerWaalsContact O-N 3.16Å; T1416-L1418 PolarHBondContact OG1-N 2.82Å; T1416-L1419 HydrophobicContact CG2-CD1 4.14Å; T1416-L1419 HydrophobicContact CG2-CG 3.97Å; T1416-L1419 PolarHBondContact O-N 2.91Å
1417	W	90.8	Very high	83.1	Confident	43 Å²	43	63.9 Å²	63.9	16%	0.163	36%	0.364	C	S	.	.	G	3₁₀ helix	trans	-66.1	-11.6	174.9	-71.2	112.7	0	0	0	113.5	L1395 I1397 D1398 L1401 E1402 P1403 F1406 L1419 A1420	L1395-W1417 HydrophobicContact CD1-CB 4.27Å; I1397-W1417 HydrophobicContact CD1-CD2 3.9Å; I1397-W1417 HydrophobicContact CD1-CE3 3.99Å; I1397-W1417 HydrophobicContact CD1-CH2 3.84Å; I1397-W1417 HydrophobicContact CD1-CZ2 3.73Å; I1397-W1417 HydrophobicContact CD1-CZ3 3.96Å; I1397-W1417 HydrophobicContact CG1-CD2 4.11Å; I1397-W1417 HydrophobicContact CG1-CG 4.46Å; I1397-W1417 HydrophobicContact CG1-CZ2 4.05Å; I1397-W1417 HydrophobicContact CG2-CB 3.81Å; I1397-W1417 HydrophobicContact CG2-CD2 3.92Å; I1397-W1417 HydrophobicContact CG2-CG 3.56Å; D1398-W1417 VanDerWaalsContact OD1-CD1 3.31Å; L1401-W1417 HydrophobicContact CB-CZ2 4.11Å; L1401-W1417 PolarHBondContact O-NE1 3.33Å; E1402-W1417 WeakPolarHBondContact O-CZ2 3.29Å; P1403-W1417 HydrophobicContact CB-CD2 4.16Å; P1403-W1417 HydrophobicContact CB-CG 4.02Å; F1406-W1417 HydrophobicContact CZ-CE3 4.2Å; F1406-W1417 HydrophobicContact CZ-CZ3 4.35Å; W1417-L1419 PolarHBondContact O-N 3.01Å; W1417-A1420 HydrophobicContact CE3-CB 4.29Å; W1417-A1420 VanDerWaalsContact O-CB 3.25Å; W1417-A1420 WeakPolarHBondContact O-CB 3.13Å; W1417-A1420 PolarHBondContact O-N 2.94Å; W1417-A1420 VanDerWaalsContact O-N 3.11Å
1418	L	88.1	Confident	81.2	Confident	20 Å²	20	60 Å²	60	11%	0.105	35%	0.351	C	S	.	.	G	3₁₀ helix	trans	-65.4	-18.1	172.2	-63.1	-172.3	0	0	0	113.9	P1349 W1352 F1393 L1395 T1416 A1423 I1426	P1349-L1418 HydrophobicContact CG-CD1 3.49Å; P1349-L1418 VanDerWaalsContact CG-CD1 3.49Å; P1349-L1418 HydrophobicContact CG-CG 4.36Å; W1352-L1418 HydrophobicContact CH2-CD1 3.64Å; W1352-L1418 HydrophobicContact CZ3-CD1 3.76Å; F1393-L1418 HydrophobicContact CB-CD1 4Å; L1395-L1418 HydrophobicContact CD1-CD2 4.16Å; L1395-L1418 HydrophobicContact CD2-CD2 4.19Å; L1395-L1418 HydrophobicContact CG-CD2 4.05Å; T1416-L1418 HydrophobicContact CG2-CB 4.14Å; T1416-L1418 PolarHBondContact O-N 3.11Å; T1416-L1418 VanDerWaalsContact O-N 3.16Å; T1416-L1418 PolarHBondContact OG1-N 2.82Å; L1418-A1423 VanDerWaalsContact O-CB 3.27Å; L1418-A1423 WeakPolarHBondContact O-CB 3.32Å; L1418-I1426 HydrophobicContact CD1-CD1 3.98Å; L1418-I1426 HydrophobicContact CD2-CD1 3.96Å
1419	L	87.4	Confident	79.3	Confident	41 Å²	41	61 Å²	61	22%	0.215	36%	0.361	C	S	.	.	G	3₁₀ helix	trans	-90.9	0.3	174.1	-66.3	175.7	0	0	0	113.5	Q1347 F1406 L1408 A1414 T1416 W1417	Q1347-L1419 HydrophobicContact CB-CD1 4.14Å; Q1347-L1419 HydrophobicContact CB-CD2 4.42Å; F1406-L1419 HydrophobicContact CB-CB 3.83Å; F1406-L1419 HydrophobicContact CB-CD1 3.81Å; F1406-L1419 HydrophobicContact CD1-CB 4.08Å; F1406-L1419 HydrophobicContact CD2-CB 3.86Å; F1406-L1419 HydrophobicContact CE2-CB 4.45Å; F1406-L1419 HydrophobicContact CG-CB 3.65Å; F1406-L1419 HydrophobicContact CG-CD1 4.43Å; L1408-L1419 HydrophobicContact CD1-CD1 3.95Å; L1408-L1419 HydrophobicContact CD2-CD1 3.81Å; L1408-L1419 HydrophobicContact CD2-CD2 3.85Å; L1408-L1419 HydrophobicContact CD2-CG 4.48Å; L1408-L1419 HydrophobicContact CG-CD1 4.11Å; A1414-L1419 HydrophobicContact CB-CD1 3.77Å; T1416-L1419 HydrophobicContact CG2-CD1 4.14Å; T1416-L1419 HydrophobicContact CG2-CG 3.97Å; T1416-L1419 PolarHBondContact O-N 2.91Å; W1417-L1419 PolarHBondContact O-N 3.01Å
1420	A	85.4	Confident	76.6	Confident	16 Å²	16	63.2 Å²	63.2	13%	0.132	38%	0.382	C	S	.	.	S	Bend	trans	-67.5	139.5	172.6	0	0	0	0	0	110.5	F1406 W1417 Q1422 A1423	F1406-A1420 HydrophobicContact CE1-CB 4.37Å; F1406-A1420 HydrophobicContact CZ-CB 4.1Å; W1417-A1420 HydrophobicContact CE3-CB 4.29Å; W1417-A1420 VanDerWaalsContact O-CB 3.25Å; W1417-A1420 WeakPolarHBondContact O-CB 3.13Å; W1417-A1420 PolarHBondContact O-N 2.94Å; W1417-A1420 VanDerWaalsContact O-N 3.11Å; A1420-Q1422 PolarHBondContact O-N 3.42Å; A1420-A1423 VanDerWaalsContact O-CB 3.28Å; A1420-A1423 WeakPolarHBondContact O-CB 3.37Å; A1420-A1423 PolarHBondContact O-N 2.96Å
1421	P	77.1	Confident	74.2	Confident	120 Å²	120	60.7 Å²	60.7	78%	0.779	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.1	2.7	-178	-25.8	35.1	0	0	0	117.1
1422	Q	80.5	Confident	71.4	Confident	167 Å²	167	61 Å²	61	78%	0.78	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-115.4	1.1	176.2	-52.3	81	22.4	0	0	112.9	A1420	A1420-Q1422 PolarHBondContact O-N 3.42Å
1423	A	80.6	Confident	68.7	Low	25 Å²	25	62.7 Å²	62.7	21%	0.207	37%	0.373	C	S	.	.	S	Bend	trans	-77.2	156.7	-179.5	0	0	0	0	0	112.6	L1395 L1418 A1420	L1395-A1423 HydrophobicContact CD1-CB 4.25Å; L1418-A1423 VanDerWaalsContact O-CB 3.27Å; L1418-A1423 WeakPolarHBondContact O-CB 3.32Å; A1420-A1423 VanDerWaalsContact O-CB 3.28Å; A1420-A1423 WeakPolarHBondContact O-CB 3.37Å; A1420-A1423 PolarHBondContact O-N 2.96Å
1424	P	77.5	Confident	65.7	Low	72 Å²	72	62.4 Å²	62.4	47%	0.468	37%	0.37	S	S	.	.	P	Polyproline II helix	trans	-71.7	135.5	170.4	30.7	-33.9	0	0	0	110.9	L1395 I1426	L1395-P1424 HydrophobicContact CD2-CG 4.18Å; P1424-I1426 HydrophobicContact CG-CD1 4.2Å; P1424-I1426 PolarHBondContact O-N 2.93Å
1425	V	64.8	Low	62.9	Low	153 Å²	153	64 Å²	64	93%	0.927	38%	0.378	S	S	*	.	P	Polyproline II helix	trans	-70	124.9	170.2	-179	0	0	0	0	109
1426	I	70	Confident	60	Low	47 Å²	47	63.6 Å²	63.6	24%	0.241	37%	0.374	C	S	.	.			trans	-122.8	138.9	-179.8	-68.6	156.6	0	0	0	107.9	W1352 F1393 L1418 P1424	W1352-I1426 HydrophobicContact CH2-CB 4.26Å; W1352-I1426 HydrophobicContact CH2-CG2 4.02Å; W1352-I1426 HydrophobicContact CZ3-CB 4.48Å; W1352-I1426 HydrophobicContact CZ3-CG2 3.84Å; F1393-I1426 HydrophobicContact CB-CD1 3.88Å; F1393-I1426 HydrophobicContact CD1-CD1 3.76Å; F1393-I1426 HydrophobicContact CD1-CG1 4.33Å; F1393-I1426 HydrophobicContact CD1-CG2 3.89Å; F1393-I1426 HydrophobicContact CE1-CG2 3.79Å; F1393-I1426 HydrophobicContact CG-CD1 4.05Å; F1393-I1426 HydrophobicContact CG-CG2 4.43Å; F1393-I1426 HydrophobicContact CZ-CG2 4.27Å; L1418-I1426 HydrophobicContact CD1-CD1 3.98Å; L1418-I1426 HydrophobicContact CD2-CD1 3.96Å; P1424-I1426 HydrophobicContact CG-CD1 4.2Å; P1424-I1426 PolarHBondContact O-N 2.93Å
1427	A	50.9	Low	57.3	Low	85 Å²	85	64.1 Å²	64.1	70%	0.702	38%	0.377	S	S	*	.	P	Polyproline II helix	trans	-94	131.5	176.5	0	0	0	0	0	110.1
1428	P	47.3	Very low	54.7	Low	62 Å²	62	63.3 Å²	63.3	40%	0.403	38%	0.378	S	S	.	.	P	Polyproline II helix	trans	-64.5	148.8	174.2	-22.1	33.8	0	0	0	112.9	W1352	W1352-P1428 HydrophobicContact CG-CB 4.47Å; W1352-P1428 HydrophobicContact CZ2-CG 4.28Å
1429	P	47.3	Very low	52.6	Low	90 Å²	90	66 Å²	66	58%	0.584	41%	0.41	S	S	*	.	P	Polyproline II helix	trans	-66.2	164.8	165	-18	32.6	0	0	0	112.6
1430	A	31.4	Very low	51.1	Low	89 Å²	89	64.4 Å²	64.4	74%	0.736	40%	0.402	S	S	*	.			trans	-129.2	176.9	-178.1	0	0	0	0	0	112.5
1431	E	29.6	Very low	49.7	Very low	117 Å²	117	65 Å²	65	55%	0.547	41%	0.41	S	S	.	.			trans	89.8	141.3	179.7	-53.9	166.8	-154.2	0	0	116.4	T1360	T1360-E1431 HydrophobicContact CG2-CB 3.73Å; T1360-E1431 VanDerWaalsContact CG2-O 3.26Å; T1360-E1431 WeakPolarHBondContact CG2-O 3.47Å; T1360-E1431 PolarHBondContact OG1-OE2 2.98Å
1432	I	28.1	Very low	49.5	Very low	57 Å²	57	60.9 Å²	60.9	29%	0.292	38%	0.38	S	S	.	.			trans	-157.3	169.2	-162.8	-89.3	161.5	0	0	0	110.6	P1651	I1432-P1651 HydrophobicContact CD1-CB 4.13Å; I1432-P1651 HydrophobicContact CG1-CB 4.02Å; I1432-P1651 HydrophobicContact CG2-CB 3.74Å; I1432-P1651 HydrophobicContact CG2-CG 3.95Å
1433	Q	37.2	Very low	49.1	Very low	40 Å²	40	54.2 Å²	54.2	19%	0.187	35%	0.352	C	S	.	.			trans	108	145.8	167.4	-161.5	-162.6	147.2	0	0	115.2	P1359 L1361 M1650	P1359-Q1433 VanDerWaalsContact O-O 3.05Å; L1361-Q1433 HydrophobicContact CD1-CB 3.86Å; L1361-Q1433 HydrophobicContact CD1-CG 3.63Å; L1361-Q1433 WeakPolarHBondContact CG-O 3.29Å; Q1433-M1650 HydrophobicContact CG-CE 4.2Å; Q1433-M1650 HydrophobicContact CG-CG 4.37Å; Q1433-M1650 HydrophobicContact CG-SD 4.36Å
1434	R	30.4	Very low	48.9	Very low	57 Å²	57	56.9 Å²	56.9	22%	0.215	37%	0.366	C	S	.	.			cis	-163.1	149.3	-6.1	-105.1	169.9	-173.1	154.7	-7.6	109.7	L1361 S1606 I1648 M1650 H1655	L1361-R1434 HydrophobicContact CD1-CB 3.91Å; R1434-S1606 VanDerWaalsContact O-CB 3.26Å; R1434-S1606 WeakPolarHBondContact O-CB 3.21Å; R1434-I1648 VanDerWaalsContact CA-CG2 3.5Å; R1434-I1648 HydrophobicContact CB-CB 4.41Å; R1434-I1648 HydrophobicContact CB-CD1 3.93Å; R1434-I1648 HydrophobicContact CB-CG1 4.24Å; R1434-I1648 HydrophobicContact CB-CG2 3.5Å; R1434-I1648 VanDerWaalsContact CB-CG2 3.5Å; R1434-I1648 HydrophobicContact CG-CB 4.15Å; R1434-I1648 HydrophobicContact CG-CD1 4.39Å; R1434-I1648 HydrophobicContact CG-CG1 4.16Å; R1434-I1648 HydrophobicContact CG-CG2 3.37Å; R1434-M1650 HydrophobicContact CG-CG 3.58Å; R1434-M1650 HydrophobicContact CG-SD 4.04Å; R1434-M1650 PolarHBondContact NE-SD 3.25Å; R1434-M1650 PolarHBondContact NH2-SD 3.29Å; R1434-H1655 PolarHBondContact NH2-NE2 2.96Å
1435	L	34.4	Very low	49	Very low	34 Å²	34	56.4 Å²	56.4	18%	0.178	36%	0.361	C	S	.	.			trans	-137.6	168	-173.7	-70.4	170.2	0	0	0	122.9	P1359 D1604 I1648	P1359-L1435 HydrophobicContact CG-CD1 4.29Å; L1435-D1604 WeakPolarHBondContact CB-OD1 3.22Å; L1435-D1604 VanDerWaalsContact CD1-OD1 3.25Å; L1435-D1604 WeakPolarHBondContact CD1-OD1 3.48Å; L1435-D1604 WeakPolarHBondContact CD1-OD2 3.22Å; L1435-D1604 HydrophobicContact CD2-CB 4.28Å; L1435-D1604 VanDerWaalsContact CD2-OD1 3.23Å; L1435-D1604 WeakPolarHBondContact CD2-OD1 3.47Å; L1435-D1604 WeakPolarHBondContact CD2-OD2 3.34Å; L1435-D1604 WeakPolarHBondContact CG-OD1 3.38Å; L1435-I1648 WeakPolarHBondContact O-CA 3.46Å; L1435-I1648 VanDerWaalsContact O-CB 3.31Å; L1435-I1648 WeakPolarHBondContact O-CB 3.5Å; L1435-I1648 WeakPolarHBondContact O-CD1 3.1Å; L1435-I1648 WeakPolarHBondContact O-CG1 3.42Å
1436	G	31.4	Very low	49.8	Very low	0 Å²	0	49.1 Å²	49.1	0%	0	32%	0.317	C	S	.	.			trans	-133.8	-164.8	-159.2	0	0	0	0	0	121.3	V1287 H1603	V1287-G1436 VanDerWaalsContact CG1-O 3.23Å; V1287-G1436 WeakPolarHBondContact CG1-O 3.48Å; V1287-G1436 VanDerWaalsContact CG2-C 3.43Å; G1436-H1603 CarbonylContact C-O 3.53Å; G1436-H1603 WeakPolarHBondContact CA-O 3.47Å; G1436-H1603 CarbonylContact O-C 3.18Å; G1436-H1603 WeakPolarHBondContact O-CB 3.21Å
1437	E	33.3	Very low	50.6	Low	12 Å²	12	49.5 Å²	49.5	6%	0.056	32%	0.316	C	S	.	.			trans	-106.6	157.5	-151.9	-84.1	-163	-165.2	0	0	123.2	D1286 V1287 T1288 K1442 H1603 Y1640 L1644	D1286-E1437 WeakPolarHBondContact OD1-CA 3.4Å; D1286-E1437 WeakPolarHBondContact OD1-CB 3.4Å; D1286-E1437 WeakPolarHBondContact OD1-CG 3.49Å; D1286-E1437 WeakPolarHBondContact OD2-CG 3.41Å; V1287-E1437 HydrophobicContact CG2-CB 4.36Å; V1287-E1437 HydrophobicContact CG2-CG 3.45Å; V1287-E1437 VanDerWaalsContact CG2-CG 3.45Å; T1288-E1437 VanDerWaalsContact CB-OE1 3.23Å; T1288-E1437 WeakPolarHBondContact CB-OE1 3.3Å; T1288-E1437 WeakPolarHBondContact CG2-OE1 3.3Å; T1288-E1437 PolarHBondContact OG1-OE1 3.36Å; E1437-K1442 PolarHBondContact O-NZ 3.2Å; E1437-H1603 PolarHBondContact N-O 3.36Å; E1437-H1603 VanDerWaalsContact N-O 3.12Å; E1437-H1603 WeakPolarHBondContact O-CA 3.28Å; E1437-H1603 WeakPolarHBondContact O-CB 3.13Å; E1437-Y1640 WeakPolarHBondContact OE2-CE2 3.43Å; E1437-Y1640 PolarHBondContact OE2-OH 3.07Å; E1437-L1644 HydrophobicContact CB-CD1 4.33Å; E1437-L1644 HydrophobicContact CB-CD2 3.57Å; E1437-L1644 HydrophobicContact CB-CG 4.49Å; E1437-L1644 HydrophobicContact CG-CD2 3.49Å; E1437-L1644 VanDerWaalsContact CG-CD2 3.49Å; E1437-L1644 WeakPolarHBondContact OE2-CD2 3.47Å
1438	S	35.9	Very low	52.2	Low	26 Å²	26	46.6 Å²	46.6	18%	0.182	29%	0.289	C	S	.	.			trans	-107.2	-164.3	-168.2	-163.5	0	0	0	0	115.5	D1286 S1440 K1442	D1286-S1438 PolarHBondContact OD1-N 2.93Å; S1438-S1440 VanDerWaalsContact C-N 3.3Å; S1438-S1440 PolarHBondContact O-N 3.22Å; S1438-K1442 PolarHBondContact O-NZ 2.85Å
1439	G	44.9	Very low	54	Low	76 Å²	76	45.2 Å²	45.2	78%	0.784	28%	0.278	S	S	*	.			trans	74.7	-28.8	166.8	0	0	0	0	0	119.4	G1441	G1439-G1441 VanDerWaalsContact C-N 3.3Å; G1439-G1441 PolarHBondContact O-N 2.97Å
1440	S	55.1	Low	56	Low	7 Å²	7	40.9 Å²	40.9	5%	0.049	25%	0.25	C	S	.	.	S	Bend	trans	-73.8	14.7	-156.7	53.2	0	0	0	0	120.3	S1438 K1442 M1618 G1621	S1438-S1440 VanDerWaalsContact C-N 3.3Å; S1438-S1440 PolarHBondContact O-N 3.22Å; S1440-K1442 PolarHBondContact OG-NZ 3.08Å; S1440-M1618 WeakPolarHBondContact CB-O 3.03Å; S1440-M1618 WeakPolarHBondContact O-CG 3.45Å; S1440-M1618 PolarHBondContact OG-O 3.12Å; S1440-G1621 PolarHBondContact O-N 3.36Å; S1440-G1621 VanDerWaalsContact O-N 3.1Å
1441	G	56.8	Low	58.6	Low	29 Å²	29	39.7 Å²	39.7	30%	0.299	23%	0.227	S	C	.	.	S	Bend	trans	93.5	2.3	178.2	0	0	0	0	0	115.7	G1439 S1443 T1444 T1445	G1439-G1441 VanDerWaalsContact C-N 3.3Å; G1439-G1441 PolarHBondContact O-N 2.97Å; G1441-S1443 PolarHBondContact O-N 2.77Å; G1441-T1444 WeakPolarHBondContact O-CB 3.34Å; G1441-T1444 PolarHBondContact O-N 3.2Å; G1441-T1445 PolarHBondContact O-N 2.92Å
1442	K	72.6	Confident	61.2	Low	33 Å²	33	35.8 Å²	35.8	14%	0.143	21%	0.21	C	C	.	.	H	α-helix	trans	-48.8	-50.8	-175.2	-55.7	-177	-82.7	-95.4	0	113.5	E1437 S1438 S1440 T1444 T1445 G1446 I1601 A1602 M1618	E1437-K1442 PolarHBondContact O-NZ 3.2Å; S1438-K1442 PolarHBondContact O-NZ 2.85Å; S1440-K1442 PolarHBondContact OG-NZ 3.08Å; K1442-T1444 VanDerWaalsContact C-N 3.35Å; K1442-T1444 PolarHBondContact O-N 3.46Å; K1442-T1445 WeakPolarHBondContact O-CB 3.26Å; K1442-T1445 PolarHBondContact O-N 3.08Å; K1442-G1446 PolarHBondContact O-N 3.33Å; K1442-I1601 HydrophobicContact CB-CG1 4.38Å; K1442-I1601 HydrophobicContact CB-CG2 3.51Å; K1442-I1601 HydrophobicContact CD-CG2 4.19Å; K1442-I1601 HydrophobicContact CG-CG2 4.44Å; K1442-I1601 WeakPolarHBondContact O-CD1 3.3Å; K1442-A1602 WeakPolarHBondContact CE-O 3.44Å; K1442-M1618 HydrophobicContact CG-CB 4.45Å; K1442-M1618 HydrophobicContact CG-SD 4.19Å
1443	S	71.8	Confident	63.7	Low	27 Å²	27	36.1 Å²	36.1	19%	0.189	21%	0.212	C	C	.	.	H	α-helix	trans	-63.2	-35.6	179.9	-52	0	0	0	0	113.6	G1441 T1445 G1446 R1447 D1569	G1441-S1443 PolarHBondContact O-N 2.77Å; S1443-T1445 VanDerWaalsContact C-N 3.33Å; S1443-T1445 PolarHBondContact O-N 2.9Å; S1443-G1446 PolarHBondContact O-N 3.08Å; S1443-R1447 WeakPolarHBondContact O-CB 3.22Å; S1443-R1447 WeakPolarHBondContact O-CD 3.13Å; S1443-R1447 VanDerWaalsContact O-CG 3.23Å; S1443-R1447 WeakPolarHBondContact O-CG 3.36Å; S1443-R1447 PolarHBondContact O-N 3.07Å; S1443-D1569 VanDerWaalsContact CA-OD1 3.27Å; S1443-D1569 WeakPolarHBondContact CA-OD1 3.43Å; S1443-D1569 WeakPolarHBondContact CB-OD1 3.45Å; S1443-D1569 WeakPolarHBondContact CB-OD2 3.29Å; S1443-D1569 PolarHBondContact OG-OD1 2.85Å
1444	T	76.5	Confident	65.6	Low	82 Å²	82	42.3 Å²	42.3	50%	0.503	24%	0.241	S	C	.	.	H	α-helix	trans	-64.1	-39	176.1	-61.3	0	0	0	0	111.2	G1441 K1442 T1448	G1441-T1444 WeakPolarHBondContact O-CB 3.34Å; G1441-T1444 PolarHBondContact O-N 3.2Å; K1442-T1444 VanDerWaalsContact C-N 3.35Å; K1442-T1444 PolarHBondContact O-N 3.46Å; T1444-T1448 WeakPolarHBondContact O-CB 3.47Å; T1444-T1448 PolarHBondContact O-N 3.47Å; T1444-T1448 PolarHBondContact O-OG1 2.79Å
1445	T	79.6	Confident	67.9	Low	61 Å²	61	43.5 Å²	43.5	37%	0.374	25%	0.247	S	C	.	.	H	α-helix	trans	-62.9	-48.9	173.3	-57.2	0	0	0	0	110.7	G1441 K1442 S1443 R1447 T1448 I1449	G1441-T1445 PolarHBondContact O-N 2.92Å; K1442-T1445 WeakPolarHBondContact O-CB 3.26Å; K1442-T1445 PolarHBondContact O-N 3.08Å; S1443-T1445 VanDerWaalsContact C-N 3.33Å; S1443-T1445 PolarHBondContact O-N 2.9Å; T1445-R1447 PolarHBondContact O-N 2.98Å; T1445-T1448 PolarHBondContact O-N 3.44Å; T1445-T1448 VanDerWaalsContact O-N 3.13Å; T1445-I1449 HydrophobicContact CG2-CD1 4.06Å; T1445-I1449 WeakPolarHBondContact O-CG1 3.37Å; T1445-I1449 PolarHBondContact O-N 2.91Å
1446	G	82.4	Confident	69.9	Low	0 Å²	0	49.1 Å²	49.1	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-56.6	-49.9	176.4	0	0	0	0	0	113.5	K1442 S1443 T1448 I1449 I1450 I1567	K1442-G1446 PolarHBondContact O-N 3.33Å; S1443-G1446 PolarHBondContact O-N 3.08Å; G1446-T1448 PolarHBondContact O-N 3.04Å; G1446-I1449 PolarHBondContact O-N 3.2Å; G1446-I1450 PolarHBondContact O-N 3.1Å; G1446-I1567 WeakPolarHBondContact O-CD1 3.38Å
1447	R	85.3	Confident	72	Confident	55 Å²	55	56 Å²	56	21%	0.208	32%	0.32	C	S	.	.	H	α-helix	trans	-62.5	-27.4	177.5	-67.3	166.2	-169.6	-143	-10.1	112.7	E1068 S1443 T1445 L1452 N1453 M1485 D1569	E1068-R1447 IonicContact OE1-CZ 2.78Å; E1068-R1447 IonicContact OE1-NH1 2.73Å; E1068-R1447 IonicContact OE1-NH2 3.09Å; E1068-R1447 PolarHBondContact OE1-NH2 2.69Å; S1443-R1447 WeakPolarHBondContact O-CB 3.22Å; S1443-R1447 WeakPolarHBondContact O-CD 3.13Å; S1443-R1447 VanDerWaalsContact O-CG 3.23Å; S1443-R1447 WeakPolarHBondContact O-CG 3.36Å; S1443-R1447 PolarHBondContact O-N 3.07Å; T1445-R1447 PolarHBondContact O-N 2.98Å; R1447-L1452 HydrophobicContact CB-CB 4.48Å; R1447-L1452 WeakPolarHBondContact O-CB 3.47Å; R1447-L1452 PolarHBondContact O-N 2.85Å; R1447-N1453 PolarHBondContact O-N 3.38Å; R1447-M1485 HydrophobicContact CG-CE 3.76Å; R1447-M1485 HydrophobicContact CG-SD 4.38Å; R1447-D1569 IonicContact CZ-OD2 3.28Å; R1447-D1569 IonicContact NE-OD2 2.76Å; R1447-D1569 PolarHBondContact NE-OD2 3.37Å; R1447-D1569 IonicContact NH2-OD2 2.93Å; R1447-D1569 PolarHBondContact NH2-OD2 3Å
1448	T	85.4	Confident	74.2	Confident	24 Å²	24	57.5 Å²	57.5	15%	0.147	34%	0.339	C	S	.	.	H	α-helix	trans	-77.2	-40.8	175.8	-54.8	0	0	0	0	112.1	T1444 T1445 G1446 I1450 R1451 N1453 K1455 I1460	T1444-T1448 WeakPolarHBondContact O-CB 3.47Å; T1444-T1448 PolarHBondContact O-N 3.47Å; T1444-T1448 PolarHBondContact O-OG1 2.79Å; T1445-T1448 PolarHBondContact O-N 3.44Å; T1445-T1448 VanDerWaalsContact O-N 3.13Å; G1446-T1448 PolarHBondContact O-N 3.04Å; T1448-I1450 PolarHBondContact O-N 2.93Å; T1448-R1451 PolarHBondContact O-N 2.79Å; T1448-N1453 WeakPolarHBondContact OG1-CB 3.23Å; T1448-K1455 HydrophobicContact CG2-CB 4.43Å; T1448-I1460 HydrophobicContact CG2-CD1 4.07Å
1449	I	85.5	Confident	76.4	Confident	33 Å²	33	61.5 Å²	61.5	17%	0.169	36%	0.355	C	S	.	.	H	α-helix	trans	-59.1	-45.9	178.9	-67.6	163	0	0	0	111.5	T1445 G1446 R1451 I1460 F1479 F1565 I1567 L1599	T1445-I1449 HydrophobicContact CG2-CD1 4.06Å; T1445-I1449 WeakPolarHBondContact O-CG1 3.37Å; T1445-I1449 PolarHBondContact O-N 2.91Å; G1446-I1449 PolarHBondContact O-N 3.2Å; I1449-R1451 PolarHBondContact O-N 2.84Å; I1449-I1460 HydrophobicContact CG1-CG2 4.47Å; I1449-I1460 HydrophobicContact CG2-CG2 4.41Å; I1449-F1479 WeakPolarHBondContact O-CZ 3.33Å; I1449-F1565 HydrophobicContact CG2-CE1 4.05Å; I1449-I1567 HydrophobicContact CB-CD1 3.9Å; I1449-I1567 HydrophobicContact CG2-CD1 3.87Å; I1449-L1599 HydrophobicContact CD1-CD2 3.63Å
1450	I	87.9	Confident	78.4	Confident	0 Å²	0	59.8 Å²	59.8	0%	0	33%	0.327	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.8	11.6	178.1	-162.4	163.1	0	0	0	114	T1075 G1446 T1448 L1452 R1480 V1483 M1485 I1567	T1075-I1450 HydrophobicContact CG2-CD1 3.73Å; T1075-I1450 HydrophobicContact CG2-CG1 4.23Å; T1075-I1450 HydrophobicContact CG2-CG2 4.39Å; G1446-I1450 PolarHBondContact O-N 3.1Å; T1448-I1450 PolarHBondContact O-N 2.93Å; I1450-L1452 VanDerWaalsContact C-N 3.29Å; I1450-L1452 HydrophobicContact CG2-CD1 4.02Å; I1450-L1452 HydrophobicContact CG2-CG 4Å; I1450-L1452 PolarHBondContact O-N 2.86Å; I1450-R1480 HydrophobicContact CG1-CG 4.49Å; I1450-R1480 PolarHBondContact O-NE 3.28Å; I1450-R1480 PolarHBondContact O-NH2 3.04Å; I1450-V1483 HydrophobicContact CD1-CG1 4.26Å; I1450-V1483 WeakPolarHBondContact CD1-O 3.42Å; I1450-V1483 HydrophobicContact CG1-CG1 4.28Å; I1450-M1485 HydrophobicContact CD1-CB 3.81Å; I1450-M1485 HydrophobicContact CG2-SD 4.07Å; I1450-I1567 HydrophobicContact CB-CD1 4.17Å
1451	R	86.6	Confident	79.7	Confident	64 Å²	64	64.4 Å²	64.4	24%	0.242	35%	0.351	C	S	.	.	T	Hydrogen-bonded Turn	trans	57.6	31.3	179.8	-60.3	-67.7	-52.8	-83.6	7.4	114	T1448 I1449 V1467 T1468 L1476 F1479 R1480	T1448-R1451 PolarHBondContact O-N 2.79Å; I1449-R1451 PolarHBondContact O-N 2.84Å; R1451-V1467 HydrophobicContact CG-CG2 4.43Å; R1451-V1467 PolarHBondContact NH1-O 2.58Å; R1451-T1468 PolarHBondContact NH1-O 2.83Å; R1451-L1476 HydrophobicContact CB-CD1 4.15Å; R1451-L1476 HydrophobicContact CG-CD1 4.27Å; R1451-F1479 HydrophobicContact CG-CE1 4.16Å; R1451-R1480 PolarHBondContact O-NH2 3.25Å
1452	L	85	Confident	81.1	Confident	35 Å²	35	65 Å²	65	18%	0.183	35%	0.345	C	S	.	.	S	Bend	trans	-74.6	-52	165.4	-71.8	171	0	0	0	108.9	L1071 M1074 T1075 R1447 I1450 M1485 F1487	L1071-L1452 HydrophobicContact CB-CD1 4.19Å; L1071-L1452 HydrophobicContact CB-CD2 4.24Å; L1071-L1452 HydrophobicContact CD2-CD2 4.34Å; M1074-L1452 HydrophobicContact CB-CD2 3.99Å; T1075-L1452 HydrophobicContact CG2-CD1 3.76Å; T1075-L1452 HydrophobicContact CG2-CD2 4.1Å; T1075-L1452 HydrophobicContact CG2-CG 4.07Å; R1447-L1452 HydrophobicContact CB-CB 4.48Å; R1447-L1452 WeakPolarHBondContact O-CB 3.47Å; R1447-L1452 PolarHBondContact O-N 2.85Å; I1450-L1452 VanDerWaalsContact C-N 3.29Å; I1450-L1452 HydrophobicContact CG2-CD1 4.02Å; I1450-L1452 HydrophobicContact CG2-CG 4Å; I1450-L1452 PolarHBondContact O-N 2.86Å; L1452-M1485 HydrophobicContact CD1-SD 4.2Å; L1452-F1487 HydrophobicContact CD1-CE1 4.41Å; L1452-F1487 HydrophobicContact CD1-CZ 4.24Å
1453	N	80.5	Confident	81.5	Confident	63 Å²	63	68.2 Å²	68.2	34%	0.337	36%	0.364	S	S	.	.	S	Bend	trans	-82	158	170.2	-67.7	-4.4	0	0	0	111	R1447 T1448	R1447-N1453 PolarHBondContact O-N 3.38Å; T1448-N1453 WeakPolarHBondContact OG1-CB 3.23Å
1454	Q	75.8	Confident	81.8	Confident	171 Å²	171	70.3 Å²	70.3	80%	0.799	39%	0.39	S	S	*	.	P	Polyproline II helix	trans	-94.4	140.7	168.3	-61.5	-170.7	17	0	0	109
1455	K	79.8	Confident	82.2	Confident	81 Å²	81	72.9 Å²	72.9	35%	0.352	39%	0.394	S	S	.	.	P	Polyproline II helix	trans	-65.6	149.3	171	71.9	174.9	-174.4	-176.1	0	110.4	T1448 G1458 T1468	T1448-K1455 HydrophobicContact CG2-CB 4.43Å; K1455-G1458 VanDerWaalsContact CD-O 3.29Å; K1455-G1458 WeakPolarHBondContact CD-O 3.44Å; K1455-G1458 WeakPolarHBondContact CE-O 3.49Å; K1455-G1458 PolarHBondContact NZ-O 2.9Å; K1455-T1468 HydrophobicContact CD-CG2 3.82Å; K1455-T1468 PolarHBondContact NZ-OG1 3.01Å
1456	T	75.5	Confident	82.6	Confident	152 Å²	152	70.9 Å²	70.9	93%	0.933	38%	0.381	S	S	*	.	S	Bend	trans	-80.5	-49.3	163.4	-49.2	0	0	0	0	109.9
1457	D	76.1	Confident	82.7	Confident	145 Å²	145	71 Å²	71	78%	0.775	38%	0.382	S	S	*	.	S	Bend	trans	-151.5	-172.1	174.5	-162.1	8.9	0	0	0	111.2
1458	G	80.2	Confident	82.6	Confident	44 Å²	44	69 Å²	69	45%	0.454	38%	0.376	S	S	.	.	S	Bend	trans	83.1	-173.5	-179.7	0	0	0	0	0	113.4	K1455	K1455-G1458 VanDerWaalsContact CD-O 3.29Å; K1455-G1458 WeakPolarHBondContact CD-O 3.44Å; K1455-G1458 WeakPolarHBondContact CE-O 3.49Å; K1455-G1458 PolarHBondContact NZ-O 2.9Å
1459	E	81.8	Confident	82.5	Confident	110 Å²	110	73.7 Å²	73.7	51%	0.514	39%	0.394	S	S	.	.			trans	-138.5	159.7	169.6	67.4	177.7	-171.3	0	0	112.4	L1461 K1469	E1459-L1461 HydrophobicContact CG-CD2 4.28Å; E1459-K1469 IonicContact OE2-NZ 3.79Å; E1459-K1469 PolarHBondContact OE2-NZ 3.47Å
1460	I	86.3	Confident	82.2	Confident	39 Å²	39	73.9 Å²	73.9	20%	0.2	40%	0.395	C	S	.	.			trans	-130.3	109.4	-174.2	-57.9	174.1	0	0	0	107	T1448 I1449 D1466 V1467 T1468	T1448-I1460 HydrophobicContact CG2-CD1 4.07Å; I1449-I1460 HydrophobicContact CG1-CG2 4.47Å; I1449-I1460 HydrophobicContact CG2-CG2 4.41Å; I1460-D1466 CarbonylContact O-C 3.15Å; I1460-D1466 WeakPolarHBondContact O-CA 3.44Å; I1460-V1467 HydrophobicContact CB-CG2 3.81Å; I1460-V1467 HydrophobicContact CG2-CG2 3.67Å; I1460-V1467 PolarHBondContact O-N 3.35Å; I1460-T1468 HydrophobicContact CB-CG2 3.86Å; I1460-T1468 HydrophobicContact CD1-CG2 4.1Å; I1460-T1468 HydrophobicContact CG1-CG2 3.91Å
1461	L	83.3	Confident	81.7	Confident	105 Å²	105	81.6 Å²	81.6	55%	0.55	43%	0.431	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	121.6	-174.2	-56.1	-178.3	0	0	0	110.7	E1459 K1465 D1466	E1459-L1461 HydrophobicContact CG-CD2 4.28Å; L1461-K1465 WeakPolarHBondContact CA-O 3.15Å; L1461-D1466 HydrophobicContact CD2-CB 3.85Å
1462	F	84.8	Confident	81	Confident	40 Å²	40	81.2 Å²	81.2	18%	0.175	45%	0.447	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	121.7	170.8	-176.3	-100.1	0	0	0	109.2	G1464 K1465 V1467 F1479 D1482 V1483 F1565	F1462-G1464 PolarHBondContact O-N 2.9Å; F1462-K1465 PolarHBondContact N-O 2.89Å; F1462-K1465 WeakPolarHBondContact O-CB 3.44Å; F1462-K1465 PolarHBondContact O-N 3.09Å; F1462-V1467 HydrophobicContact CB-CG1 3.42Å; F1462-V1467 VanDerWaalsContact CB-CG1 3.42Å; F1462-F1479 HydrophobicContact CB-CD2 4.48Å; F1462-F1479 HydrophobicContact CB-CE2 3.98Å; F1462-F1479 AromaticContact CD1-CD2 3.99Å; F1462-F1479 HydrophobicContact CD1-CD2 3.99Å; F1462-F1479 HydrophobicContact CD1-CE2 4.08Å; F1462-F1479 HydrophobicContact CD2-CE2 4.45Å; F1462-F1479 HydrophobicContact CG-CD2 4.29Å; F1462-F1479 AromaticContact CG-CE2 3.91Å; F1462-F1479 HydrophobicContact CG-CE2 3.91Å; F1462-D1482 HydrophobicContact CE1-CB 3.75Å; F1462-D1482 HydrophobicContact CZ-CB 3.85Å; F1462-V1483 HydrophobicContact CD1-CG2 4.42Å; F1462-V1483 HydrophobicContact CD2-CG2 3.87Å; F1462-V1483 HydrophobicContact CE1-CG2 4.11Å; F1462-V1483 HydrophobicContact CE2-CG2 3.52Å; F1462-V1483 HydrophobicContact CG-CG2 4.32Å; F1462-V1483 HydrophobicContact CZ-CG2 3.65Å; F1462-F1565 HydrophobicContact CE2-CB 4.06Å; F1462-F1565 HydrophobicContact CE2-CD1 4.2Å
1463	D	80.6	Confident	80.5	Confident	102 Å²	102	85.3 Å²	85.3	55%	0.545	46%	0.463	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.4	39.8	-175.3	-133.1	-13.9	0	0	0	112.5	K1465 R1564	D1463-K1465 PolarHBondContact O-N 3.36Å; D1463-R1564 IonicContact OD1-NH2 3.58Å; D1463-R1564 IonicContact OD2-CZ 2.65Å; D1463-R1564 VanDerWaalsContact OD2-CZ 3.22Å; D1463-R1564 IonicContact OD2-NH1 3.9Å; D1463-R1564 PolarHBondContact OD2-NH1 3.12Å; D1463-R1564 IonicContact OD2-NH2 2.75Å; D1463-R1564 PolarHBondContact OD2-NH2 3.33Å
1464	G	79.9	Confident	80.3	Confident	71 Å²	71	87.1 Å²	87.1	73%	0.732	48%	0.481	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.5	-2.8	-175.2	0	0	0	0	0	116	F1462	F1462-G1464 PolarHBondContact O-N 2.9Å
1465	K	84.3	Confident	80.5	Confident	135 Å²	135	80.9 Å²	80.9	59%	0.587	46%	0.459	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.2	130	-179.7	-57.3	168.4	-171.7	166.6	0	110.4	L1461 F1462 D1463 V1467	L1461-K1465 WeakPolarHBondContact CA-O 3.15Å; F1462-K1465 PolarHBondContact N-O 2.89Å; F1462-K1465 WeakPolarHBondContact O-CB 3.44Å; F1462-K1465 PolarHBondContact O-N 3.09Å; D1463-K1465 PolarHBondContact O-N 3.36Å; K1465-V1467 PolarHBondContact O-N 2.93Å; K1465-V1467 VanDerWaalsContact O-N 3.11Å
1466	D	87.2	Confident	80.7	Confident	20 Å²	20	79.2 Å²	79.2	11%	0.107	45%	0.453	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.9	107	170.7	177.6	8.1	0	0	0	110.9	I1460 L1461 T1468 K1469	I1460-D1466 CarbonylContact O-C 3.15Å; I1460-D1466 WeakPolarHBondContact O-CA 3.44Å; L1461-D1466 HydrophobicContact CD2-CB 3.85Å; D1466-T1468 PolarHBondContact O-N 2.69Å; D1466-T1468 WeakPolarHBondContact OD1-CA 3.5Å; D1466-T1468 WeakPolarHBondContact OD1-CB 3.26Å; D1466-T1468 WeakPolarHBondContact OD1-CG2 3.44Å; D1466-T1468 PolarHBondContact OD1-N 3.23Å; D1466-T1468 PolarHBondContact OD1-OG1 3.22Å; D1466-T1468 PolarHBondContact OD2-OG1 3.29Å; D1466-K1469 HydrophobicContact CB-CB 4.46Å; D1466-K1469 HydrophobicContact CB-CD 4.08Å; D1466-K1469 HydrophobicContact CB-CG 4.44Å; D1466-K1469 PolarHBondContact O-N 3.47Å; D1466-K1469 WeakPolarHBondContact OD2-CD 3.23Å; D1466-K1469 WeakPolarHBondContact OD2-CE 3.13Å; D1466-K1469 WeakPolarHBondContact OD2-CG 3Å; D1466-K1469 IonicContact OD2-NZ 3.33Å; D1466-K1469 PolarHBondContact OD2-NZ 2.79Å
1467	V	85.5	Confident	81	Confident	1 Å²	1	73 Å²	73	1%	0.006	42%	0.415	C	S	.	.	G	3₁₀ helix	trans	-70.4	-15.4	-178.1	-48.4	0	0	0	0	112.3	R1451 I1460 F1462 K1465 I1470 F1479	R1451-V1467 HydrophobicContact CG-CG2 4.43Å; R1451-V1467 PolarHBondContact NH1-O 2.58Å; I1460-V1467 HydrophobicContact CB-CG2 3.81Å; I1460-V1467 HydrophobicContact CG2-CG2 3.67Å; I1460-V1467 PolarHBondContact O-N 3.35Å; F1462-V1467 HydrophobicContact CB-CG1 3.42Å; F1462-V1467 VanDerWaalsContact CB-CG1 3.42Å; K1465-V1467 PolarHBondContact O-N 2.93Å; K1465-V1467 VanDerWaalsContact O-N 3.11Å; V1467-I1470 HydrophobicContact CB-CD1 3.97Å; V1467-I1470 HydrophobicContact CG1-CD1 4.26Å; V1467-I1470 WeakPolarHBondContact O-CB 3.37Å; V1467-I1470 PolarHBondContact O-N 3.01Å; V1467-F1479 HydrophobicContact CB-CD2 4.37Å; V1467-F1479 HydrophobicContact CB-CE1 4.26Å; V1467-F1479 HydrophobicContact CB-CE2 4.07Å; V1467-F1479 HydrophobicContact CB-CZ 4Å; V1467-F1479 HydrophobicContact CG1-CD2 3.78Å; V1467-F1479 HydrophobicContact CG1-CE2 3.47Å; V1467-F1479 VanDerWaalsContact CG1-CE2 3.47Å; V1467-F1479 HydrophobicContact CG1-CG 4.45Å; V1467-F1479 HydrophobicContact CG1-CZ 3.88Å; V1467-F1479 HydrophobicContact CG2-CE1 4.42Å; V1467-F1479 HydrophobicContact CG2-CE2 4.47Å; V1467-F1479 HydrophobicContact CG2-CZ 4.04Å
1468	T	83.4	Confident	81.4	Confident	14 Å²	14	72 Å²	72	9%	0.086	41%	0.406	C	S	.	.	G	3₁₀ helix	trans	-75.4	-32.5	178.4	81.1	0	0	0	0	111.1	R1451 K1455 I1460 D1466 I1470	R1451-T1468 PolarHBondContact NH1-O 2.83Å; K1455-T1468 HydrophobicContact CD-CG2 3.82Å; K1455-T1468 PolarHBondContact NZ-OG1 3.01Å; I1460-T1468 HydrophobicContact CB-CG2 3.86Å; I1460-T1468 HydrophobicContact CD1-CG2 4.1Å; I1460-T1468 HydrophobicContact CG1-CG2 3.91Å; D1466-T1468 PolarHBondContact O-N 2.69Å; D1466-T1468 WeakPolarHBondContact OD1-CA 3.5Å; D1466-T1468 WeakPolarHBondContact OD1-CB 3.26Å; D1466-T1468 WeakPolarHBondContact OD1-CG2 3.44Å; D1466-T1468 PolarHBondContact OD1-N 3.23Å; D1466-T1468 PolarHBondContact OD1-OG1 3.22Å; D1466-T1468 PolarHBondContact OD2-OG1 3.29Å; T1468-I1470 VanDerWaalsContact C-N 3.33Å
1469	K	81.9	Confident	81.8	Confident	123 Å²	123	70.5 Å²	70.5	54%	0.535	39%	0.387	S	S	.	.	G	3₁₀ helix	trans	-82.4	0.5	173.7	-67.6	167.3	-168.2	113.8	0	113.8	E1459 D1466 H1471	E1459-K1469 IonicContact OE2-NZ 3.79Å; E1459-K1469 PolarHBondContact OE2-NZ 3.47Å; D1466-K1469 HydrophobicContact CB-CB 4.46Å; D1466-K1469 HydrophobicContact CB-CD 4.08Å; D1466-K1469 HydrophobicContact CB-CG 4.44Å; D1466-K1469 PolarHBondContact O-N 3.47Å; D1466-K1469 WeakPolarHBondContact OD2-CD 3.23Å; D1466-K1469 WeakPolarHBondContact OD2-CE 3.13Å; D1466-K1469 WeakPolarHBondContact OD2-CG 3Å; D1466-K1469 IonicContact OD2-NZ 3.33Å; D1466-K1469 PolarHBondContact OD2-NZ 2.79Å; K1469-H1471 PolarHBondContact O-CD2 3.12Å; K1469-H1471 PolarHBondContact O-N 3.12Å
1470	I	80.4	Confident	82.2	Confident	37 Å²	37	66.2 Å²	66.2	19%	0.19	37%	0.366	C	S	.	.			trans	-66.3	118.5	173.1	-67.7	174.3	0	0	0	109.9	V1467 T1468 A1475 L1476 F1479	V1467-I1470 HydrophobicContact CB-CD1 3.97Å; V1467-I1470 HydrophobicContact CG1-CD1 4.26Å; V1467-I1470 WeakPolarHBondContact O-CB 3.37Å; V1467-I1470 PolarHBondContact O-N 3.01Å; T1468-I1470 VanDerWaalsContact C-N 3.33Å; I1470-A1475 HydrophobicContact CG2-CB 3.82Å; I1470-L1476 HydrophobicContact CG2-CB 4.17Å; I1470-L1476 HydrophobicContact CG2-CD1 4.46Å; I1470-F1479 HydrophobicContact CD1-CB 3.84Å; I1470-F1479 HydrophobicContact CD1-CG 4.08Å
1471	H	76.7	Confident	82.2	Confident	162 Å²	162	69 Å²	69	75%	0.75	37%	0.374	S	S	*	.			trans	-120.6	140.7	176.9	-61.8	-55.9	0	0	0	111.1	K1469	K1469-H1471 PolarHBondContact O-CD2 3.12Å; K1469-H1471 PolarHBondContact O-N 3.12Å
1472	G	72.7	Confident	82.5	Confident	56 Å²	56	66.3 Å²	66.3	58%	0.577	36%	0.36	S	S	*	.	S	Bend	trans	91.9	145.7	-179.3	0	0	0	0	0	113.7	S1474 L1476	G1472-S1474 PolarHBondContact O-N 2.9Å; G1472-L1476 PolarHBondContact O-N 3.3Å
1473	K	73.6	Confident	82.8	Confident	121 Å²	121	64.4 Å²	64.4	53%	0.526	35%	0.352	S	S	.	.	H	α-helix	trans	-60.8	-45	-170.5	-165.9	-161.3	174.7	-149.4	0	112.9	G1077 A1475 L1476 T1477	G1077-K1473 WeakPolarHBondContact O-CE 3.32Å; K1473-A1475 PolarHBondContact O-N 3.13Å; K1473-L1476 PolarHBondContact O-N 2.85Å; K1473-T1477 PolarHBondContact O-N 3.33Å; K1473-T1477 PolarHBondContact O-OG1 3.18Å
1474	S	75.9	Confident	83.4	Confident	100 Å²	100	59.5 Å²	59.5	70%	0.699	33%	0.326	S	S	*	.	H	α-helix	trans	-61.4	-47.8	-171.4	-157.3	0	0	0	0	112.5	G1472 L1476 T1477 E1478	G1472-S1474 PolarHBondContact O-N 2.9Å; S1474-L1476 VanDerWaalsContact C-N 3.32Å; S1474-L1476 PolarHBondContact O-N 2.63Å; S1474-T1477 PolarHBondContact O-N 2.98Å; S1474-E1478 WeakPolarHBondContact O-CB 3.38Å; S1474-E1478 PolarHBondContact O-N 2.84Å
1475	A	80.9	Confident	83.9	Confident	41 Å²	41	56.1 Å²	56.1	34%	0.339	29%	0.291	S	S	.	.	H	α-helix	trans	-67.6	-31	178.6	0	0	0	0	0	112.6	I1470 K1473 F1479	I1470-A1475 HydrophobicContact CG2-CB 3.82Å; K1473-A1475 PolarHBondContact O-N 3.13Å; A1475-F1479 WeakPolarHBondContact O-CB 3.39Å; A1475-F1479 PolarHBondContact O-N 3.37Å
1476	L	83.6	Confident	84.1	Confident	46 Å²	46	49.8 Å²	49.8	24%	0.241	26%	0.263	C	S	.	.	H	α-helix	trans	-72	-37.8	173.6	-172.3	66.1	0	0	0	112.1	R1451 I1470 G1472 K1473 S1474 F1479 R1480	R1451-L1476 HydrophobicContact CB-CD1 4.15Å; R1451-L1476 HydrophobicContact CG-CD1 4.27Å; I1470-L1476 HydrophobicContact CG2-CB 4.17Å; I1470-L1476 HydrophobicContact CG2-CD1 4.46Å; G1472-L1476 PolarHBondContact O-N 3.3Å; K1473-L1476 PolarHBondContact O-N 2.85Å; S1474-L1476 VanDerWaalsContact C-N 3.32Å; S1474-L1476 PolarHBondContact O-N 2.63Å; L1476-F1479 HydrophobicContact CD1-CD1 4.3Å; L1476-R1480 VanDerWaalsContact O-CB 3.22Å; L1476-R1480 WeakPolarHBondContact O-CB 3.32Å; L1476-R1480 WeakPolarHBondContact O-CG 3.38Å; L1476-R1480 PolarHBondContact O-N 3.48Å
1477	T	83.1	Confident	84	Confident	22 Å²	22	49 Å²	49	14%	0.135	26%	0.259	C	S	.	.	H	α-helix	trans	-65.8	-38.9	171.6	-61.7	0	0	0	0	111.2	G1077 K1473 S1474 R1480 R1481	G1077-T1477 PolarHBondContact O-OG1 2.93Å; K1473-T1477 PolarHBondContact O-N 3.33Å; K1473-T1477 PolarHBondContact O-OG1 3.18Å; S1474-T1477 PolarHBondContact O-N 2.98Å; T1477-R1480 CarbonylContact O-C 3.48Å; T1477-R1480 PolarHBondContact O-N 3.2Å; T1477-R1481 PolarHBondContact O-N 3.13Å
1478	E	84.3	Confident	83.6	Confident	123 Å²	123	52.4 Å²	52.4	58%	0.575	28%	0.275	S	S	*	.	H	α-helix	trans	-62.3	-51.4	175.6	-173.4	-179.3	169.8	0	0	111.7	S1474 R1480 R1481 D1482	S1474-E1478 WeakPolarHBondContact O-CB 3.38Å; S1474-E1478 PolarHBondContact O-N 2.84Å; E1478-R1480 VanDerWaalsContact C-N 3.31Å; E1478-R1480 PolarHBondContact O-N 3.17Å; E1478-R1481 VanDerWaalsContact O-CB 3.28Å; E1478-R1481 WeakPolarHBondContact O-CB 3.19Å; E1478-R1481 PolarHBondContact O-N 3Å; E1478-D1482 PolarHBondContact O-N 3.24Å
1479	F	88.7	Confident	83.2	Confident	13 Å²	13	54.7 Å²	54.7	6%	0.057	29%	0.286	C	S	.	.	H	α-helix	trans	-56.5	-43.7	172.8	166.2	-112.6	0	0	0	112.5	I1449 R1451 F1462 V1467 I1470 A1475 L1476 R1481 D1482 V1483	I1449-F1479 WeakPolarHBondContact O-CZ 3.33Å; R1451-F1479 HydrophobicContact CG-CE1 4.16Å; F1462-F1479 HydrophobicContact CB-CD2 4.48Å; F1462-F1479 HydrophobicContact CB-CE2 3.98Å; F1462-F1479 AromaticContact CD1-CD2 3.99Å; F1462-F1479 HydrophobicContact CD1-CD2 3.99Å; F1462-F1479 HydrophobicContact CD1-CE2 4.08Å; F1462-F1479 HydrophobicContact CD2-CE2 4.45Å; F1462-F1479 HydrophobicContact CG-CD2 4.29Å; F1462-F1479 AromaticContact CG-CE2 3.91Å; F1462-F1479 HydrophobicContact CG-CE2 3.91Å; V1467-F1479 HydrophobicContact CB-CD2 4.37Å; V1467-F1479 HydrophobicContact CB-CE1 4.26Å; V1467-F1479 HydrophobicContact CB-CE2 4.07Å; V1467-F1479 HydrophobicContact CB-CZ 4Å; V1467-F1479 HydrophobicContact CG1-CD2 3.78Å; V1467-F1479 HydrophobicContact CG1-CE2 3.47Å; V1467-F1479 VanDerWaalsContact CG1-CE2 3.47Å; V1467-F1479 HydrophobicContact CG1-CG 4.45Å; V1467-F1479 HydrophobicContact CG1-CZ 3.88Å; V1467-F1479 HydrophobicContact CG2-CE1 4.42Å; V1467-F1479 HydrophobicContact CG2-CE2 4.47Å; V1467-F1479 HydrophobicContact CG2-CZ 4.04Å; I1470-F1479 HydrophobicContact CD1-CB 3.84Å; I1470-F1479 HydrophobicContact CD1-CG 4.08Å; A1475-F1479 WeakPolarHBondContact O-CB 3.39Å; A1475-F1479 PolarHBondContact O-N 3.37Å; L1476-F1479 HydrophobicContact CD1-CD1 4.3Å; F1479-R1481 PolarHBondContact O-N 3.17Å; F1479-D1482 PolarHBondContact O-N 2.81Å; F1479-V1483 HydrophobicContact CD2-CG2 3.97Å; F1479-V1483 HydrophobicContact CE2-CB 4.03Å; F1479-V1483 HydrophobicContact CE2-CG2 3.39Å; F1479-V1483 HydrophobicContact CZ-CB 4.12Å; F1479-V1483 HydrophobicContact CZ-CG1 4.37Å; F1479-V1483 HydrophobicContact CZ-CG2 3.93Å; F1479-V1483 PolarHBondContact O-N 3.15Å
1480	R	88.9	Confident	82.9	Confident	20 Å²	20	49.1 Å²	49.1	8%	0.075	26%	0.263	C	S	.	.	H	α-helix	trans	-69.7	-12.2	176.2	-83.8	180	176.9	169.5	8.6	114.7	M1074 T1075 I1450 R1451 L1476 T1477 E1478 V1483 Q1484	M1074-R1480 WeakPolarHBondContact O-CD 3.15Å; M1074-R1480 PolarHBondContact O-NH1 2.88Å; T1075-R1480 VanDerWaalsContact O-CB 3.28Å; T1075-R1480 WeakPolarHBondContact O-CB 3.48Å; T1075-R1480 WeakPolarHBondContact O-CD 3.47Å; I1450-R1480 HydrophobicContact CG1-CG 4.49Å; I1450-R1480 PolarHBondContact O-NE 3.28Å; I1450-R1480 PolarHBondContact O-NH2 3.04Å; R1451-R1480 PolarHBondContact O-NH2 3.25Å; L1476-R1480 VanDerWaalsContact O-CB 3.22Å; L1476-R1480 WeakPolarHBondContact O-CB 3.32Å; L1476-R1480 WeakPolarHBondContact O-CG 3.38Å; L1476-R1480 PolarHBondContact O-N 3.48Å; T1477-R1480 CarbonylContact O-C 3.48Å; T1477-R1480 PolarHBondContact O-N 3.2Å; E1478-R1480 VanDerWaalsContact C-N 3.31Å; E1478-R1480 PolarHBondContact O-N 3.17Å; R1480-V1483 CarbonylContact C-O 3.5Å; R1480-Q1484 PolarHBondContact O-NE2 2.91Å
1481	R	87.6	Confident	82.6	Confident	98 Å²	98	49.2 Å²	49.2	37%	0.37	26%	0.261	S	S	.	.	H	α-helix	trans	-78.7	-40.8	170.2	-166.5	-173.3	166.6	-165.7	-9.6	110.6	T1477 E1478 F1479 V1561 P1563	T1477-R1481 PolarHBondContact O-N 3.13Å; E1478-R1481 VanDerWaalsContact O-CB 3.28Å; E1478-R1481 WeakPolarHBondContact O-CB 3.19Å; E1478-R1481 PolarHBondContact O-N 3Å; F1479-R1481 PolarHBondContact O-N 3.17Å; R1481-V1561 HydrophobicContact CG-CB 4.06Å; R1481-V1561 PolarHBondContact NE-O 2.87Å; R1481-V1561 WeakPolarHBondContact O-CG2 3.49Å; R1481-P1563 WeakPolarHBondContact O-CA 3.24Å
1482	D	89.1	Confident	82.7	Confident	47 Å²	47	42.4 Å²	42.4	25%	0.251	23%	0.233	S	C	.	.	H	α-helix	trans	-74.7	-29.4	177	-80.5	11.5	0	0	0	112.7	F1462 E1478 F1479 R1564 F1565	F1462-D1482 HydrophobicContact CE1-CB 3.75Å; F1462-D1482 HydrophobicContact CZ-CB 3.85Å; E1478-D1482 PolarHBondContact O-N 3.24Å; F1479-D1482 PolarHBondContact O-N 2.81Å; D1482-R1564 PolarHBondContact O-N 2.79Å; D1482-R1564 IonicContact OD2-NH1 3.89Å; D1482-R1564 PolarHBondContact OD2-NH1 3.26Å; D1482-F1565 PolarHBondContact O-N 3.19Å
1483	V	90.6	Very high	83.3	Confident	0 Å²	0	39.9 Å²	39.9	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	121	-177.9	-176	0	0	0	0	112	I1450 F1462 F1479 R1480 F1565	I1450-V1483 HydrophobicContact CD1-CG1 4.26Å; I1450-V1483 WeakPolarHBondContact CD1-O 3.42Å; I1450-V1483 HydrophobicContact CG1-CG1 4.28Å; F1462-V1483 HydrophobicContact CD1-CG2 4.42Å; F1462-V1483 HydrophobicContact CD2-CG2 3.87Å; F1462-V1483 HydrophobicContact CE1-CG2 4.11Å; F1462-V1483 HydrophobicContact CE2-CG2 3.52Å; F1462-V1483 HydrophobicContact CG-CG2 4.32Å; F1462-V1483 HydrophobicContact CZ-CG2 3.65Å; F1479-V1483 HydrophobicContact CD2-CG2 3.97Å; F1479-V1483 HydrophobicContact CE2-CB 4.03Å; F1479-V1483 HydrophobicContact CE2-CG2 3.39Å; F1479-V1483 HydrophobicContact CZ-CB 4.12Å; F1479-V1483 HydrophobicContact CZ-CG1 4.37Å; F1479-V1483 HydrophobicContact CZ-CG2 3.93Å; F1479-V1483 PolarHBondContact O-N 3.15Å; R1480-V1483 CarbonylContact C-O 3.5Å; V1483-F1565 WeakPolarHBondContact CA-O 3.39Å; V1483-F1565 HydrophobicContact CB-CD1 4.31Å; V1483-F1565 HydrophobicContact CG1-CD1 3.61Å; V1483-F1565 HydrophobicContact CG1-CE1 4.12Å; V1483-F1565 HydrophobicContact CG1-CG 4.48Å; V1483-F1565 HydrophobicContact CG2-CB 4.31Å; V1483-F1565 HydrophobicContact CG2-CD1 3.87Å
1484	Q	92.5	Very high	83.9	Confident	0 Å²	0	34.1 Å²	34.1	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	172.1	177.5	-84.2	-57.6	-47.1	0	0	113.9	T1075 R1480 A1558 V1561 P1563 F1565 I1566 I1567	T1075-Q1484 PolarHBondContact O-NE2 3.46Å; T1075-Q1484 PolarHBondContact OG1-OE1 3.14Å; R1480-Q1484 PolarHBondContact O-NE2 2.91Å; Q1484-A1558 HydrophobicContact CB-CB 4.15Å; Q1484-V1561 HydrophobicContact CG-CG2 3.46Å; Q1484-V1561 VanDerWaalsContact CG-CG2 3.46Å; Q1484-P1563 HydrophobicContact CB-CB 4.12Å; Q1484-P1563 HydrophobicContact CB-CG 4.28Å; Q1484-P1563 HydrophobicContact CG-CB 4.14Å; Q1484-P1563 HydrophobicContact CG-CG 4.39Å; Q1484-F1565 PolarHBondContact N-O 3.1Å; Q1484-I1566 HydrophobicContact CB-CG1 4.41Å; Q1484-I1566 WeakPolarHBondContact O-CA 3.22Å; Q1484-I1567 PolarHBondContact O-N 2.98Å
1485	M	90.4	Very high	84.3	Confident	0 Å²	0	29.5 Å²	29.5	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	130.1	-179.1	-173.7	176.3	179.8	0	0	111.9	T1075 R1447 I1450 L1452 F1487 R1557 I1567 D1569	T1075-M1485 HydrophobicContact CG2-CB 4.39Å; R1447-M1485 HydrophobicContact CG-CE 3.76Å; R1447-M1485 HydrophobicContact CG-SD 4.38Å; I1450-M1485 HydrophobicContact CD1-CB 3.81Å; I1450-M1485 HydrophobicContact CG2-SD 4.07Å; L1452-M1485 HydrophobicContact CD1-SD 4.2Å; M1485-F1487 HydrophobicContact CB-CE2 4.1Å; M1485-F1487 HydrophobicContact CE-CD1 4.17Å; M1485-F1487 HydrophobicContact CE-CE1 4.23Å; M1485-F1487 HydrophobicContact CG-CD2 4.17Å; M1485-F1487 HydrophobicContact CG-CE2 4.02Å; M1485-F1487 HydrophobicContact CG-CZ 4.33Å; M1485-F1487 HydrophobicContact SD-CD1 4.48Å; M1485-F1487 HydrophobicContact SD-CE1 4.07Å; M1485-F1487 HydrophobicContact SD-CE2 4.23Å; M1485-F1487 HydrophobicContact SD-CZ 3.93Å; M1485-R1557 PolarHBondContact O-NH2 2.81Å; M1485-I1567 CarbonylContact C-O 3.53Å; M1485-I1567 VanDerWaalsContact CA-O 3.27Å; M1485-I1567 WeakPolarHBondContact CA-O 3.4Å; M1485-I1567 HydrophobicContact CB-CB 4.47Å; M1485-I1567 HydrophobicContact CG-CB 4.28Å; M1485-I1567 HydrophobicContact CG-CG2 4.5Å; M1485-D1569 HydrophobicContact CE-CB 3.51Å; M1485-D1569 WeakPolarHBondContact CE-OD2 3.5Å
1486	I	89.9	Confident	84.2	Confident	2 Å²	2	27.8 Å²	27.8	1%	0.01	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	138.1	160.3	-62.9	158.9	0	0	0	106.4	I1555 A1558 I1566 I1567 D1569 P1571 L1587	I1486-I1555 HydrophobicContact CD1-CB 4.47Å; I1486-I1555 HydrophobicContact CD1-CG1 3.73Å; I1486-I1555 HydrophobicContact CG1-CG1 4.38Å; I1486-A1558 HydrophobicContact CG1-CB 3.99Å; I1486-I1566 HydrophobicContact CD1-CG2 3.82Å; I1486-I1566 HydrophobicContact CG1-CG2 4.01Å; I1486-I1567 PolarHBondContact N-O 3.01Å; I1486-D1569 WeakPolarHBondContact O-CB 3.41Å; I1486-D1569 PolarHBondContact O-N 3.21Å; I1486-P1571 HydrophobicContact CG2-CB 4.13Å; I1486-L1587 HydrophobicContact CD1-CD2 4.11Å
1487	F	85.2	Confident	83.9	Confident	2 Å²	2	27.8 Å²	27.8	1%	0.009	13%	0.131	C	C	.	.			trans	-106.3	162.7	-172.7	-70.3	-107.7	0	0	0	110.8	E1068 L1071 A1072 T1075 L1452 M1485 D1569	E1068-F1487 HydrophobicContact CB-CD1 4.01Å; E1068-F1487 HydrophobicContact CB-CE1 4.41Å; E1068-F1487 HydrophobicContact CG-CD1 4.15Å; E1068-F1487 WeakPolarHBondContact OE2-CB 3.23Å; L1071-F1487 HydrophobicContact CB-CE1 3.99Å; L1071-F1487 HydrophobicContact CB-CZ 4.12Å; A1072-F1487 HydrophobicContact CB-CE2 3.99Å; A1072-F1487 HydrophobicContact CB-CZ 4.3Å; T1075-F1487 HydrophobicContact CG2-CE2 4.41Å; T1075-F1487 HydrophobicContact CG2-CZ 4.09Å; L1452-F1487 HydrophobicContact CD1-CE1 4.41Å; L1452-F1487 HydrophobicContact CD1-CZ 4.24Å; M1485-F1487 HydrophobicContact CB-CE2 4.1Å; M1485-F1487 HydrophobicContact CE-CD1 4.17Å; M1485-F1487 HydrophobicContact CE-CE1 4.23Å; M1485-F1487 HydrophobicContact CG-CD2 4.17Å; M1485-F1487 HydrophobicContact CG-CE2 4.02Å; M1485-F1487 HydrophobicContact CG-CZ 4.33Å; M1485-F1487 HydrophobicContact SD-CD1 4.48Å; M1485-F1487 HydrophobicContact SD-CE1 4.07Å; M1485-F1487 HydrophobicContact SD-CE2 4.23Å; M1485-F1487 HydrophobicContact SD-CZ 3.93Å; F1487-D1569 CarbonylContact C-O 3.54Å; F1487-D1569 VanDerWaalsContact C-O 3.24Å
1488	Q	76.3	Confident	84	Confident	73 Å²	73	27.7 Å²	27.7	34%	0.341	13%	0.129	S	C	.	.	S	Bend	trans	-66.6	-44.7	-175.5	178.5	176.2	41.8	0	0	112.4	P1490 D1569 E1570	Q1488-P1490 WeakPolarHBondContact O-CD 3.31Å; Q1488-D1569 WeakPolarHBondContact CA-O 3.49Å; Q1488-D1569 PolarHBondContact N-O 2.93Å; Q1488-E1570 HydrophobicContact CB-CB 4.23Å; Q1488-E1570 HydrophobicContact CG-CB 3.87Å; Q1488-E1570 PolarHBondContact NE2-OE2 3.19Å
1489	D	75.7	Confident	84.2	Confident	62 Å²	62	25.2 Å²	25.2	33%	0.332	12%	0.117	S	C	.	.			trans	-95.2	108.4	172.7	-177.5	12.3	0	0	0	111.6	Y1491 A1492 S1493	D1489-Y1491 PolarHBondContact O-N 2.97Å; D1489-Y1491 VanDerWaalsContact O-N 3.13Å; D1489-Y1491 WeakPolarHBondContact OD1-CA 3.43Å; D1489-Y1491 WeakPolarHBondContact OD1-CB 3.37Å; D1489-Y1491 PolarHBondContact OD1-N 2.67Å; D1489-A1492 HydrophobicContact CB-CB 3.98Å; D1489-A1492 VanDerWaalsContact CG-N 3.27Å; D1489-A1492 WeakPolarHBondContact OD2-CB 3.42Å; D1489-A1492 PolarHBondContact OD2-N 2.9Å; D1489-S1493 VanDerWaalsContact O-CB 3.25Å; D1489-S1493 WeakPolarHBondContact O-CB 3.41Å; D1489-S1493 PolarHBondContact O-N 2.77Å; D1489-S1493 VanDerWaalsContact O-N 3.11Å; D1489-S1493 PolarHBondContact O-OG 2.71Å
1490	P	76	Confident	84.2	Confident	6 Å²	6	24.6 Å²	24.6	4%	0.039	11%	0.114	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.8	-19.7	170.2	11.5	-22.7	0	0	0	114.9	Q1488 L1494 R1550 Q1551	Q1488-P1490 WeakPolarHBondContact O-CD 3.31Å; P1490-L1494 WeakPolarHBondContact O-CD1 3.47Å; P1490-L1494 WeakPolarHBondContact O-CG 3.36Å; P1490-R1550 HydrophobicContact CB-CB 3.63Å; P1490-Q1551 HydrophobicContact CB-CB 4.21Å; P1490-Q1551 HydrophobicContact CG-CB 4.36Å
1491	Y	74.1	Confident	84.3	Confident	39 Å²	39	26 Å²	26	15%	0.153	12%	0.12	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.4	-55.5	179	-170.5	-129.1	0	0	0	112.3	P866 D1489 S1493 L1494 P1542 H1543	P866-Y1491 HydrophobicContact CB-CE1 4.1Å; P866-Y1491 HydrophobicContact CG-CD1 4.38Å; P866-Y1491 HydrophobicContact CG-CE1 3.95Å; P866-Y1491 PolarHBondContact O-OH 3.5Å; D1489-Y1491 PolarHBondContact O-N 2.97Å; D1489-Y1491 VanDerWaalsContact O-N 3.13Å; D1489-Y1491 WeakPolarHBondContact OD1-CA 3.43Å; D1489-Y1491 WeakPolarHBondContact OD1-CB 3.37Å; D1489-Y1491 PolarHBondContact OD1-N 2.67Å; Y1491-S1493 PolarHBondContact O-N 3.48Å; Y1491-L1494 PolarHBondContact O-N 2.73Å; Y1491-P1542 HydrophobicContact CD2-CB 4.5Å; Y1491-H1543 HydrophobicContact CE2-CB 3.97Å
1492	A	78.8	Confident	84.4	Confident	19 Å²	19	23.3 Å²	23.3	16%	0.157	11%	0.114	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.3	-28.6	176.9	0	0	0	0	0	112.9	E1068 Y1069 D1489 L1494	E1068-A1492 HydrophobicContact CB-CB 4.31Å; E1068-A1492 HydrophobicContact CG-CB 4.43Å; Y1069-A1492 WeakPolarHBondContact CB-O 3.02Å; Y1069-A1492 WeakPolarHBondContact CD1-O 3.49Å; Y1069-A1492 PolarHBondContact N-O 2.77Å; D1489-A1492 HydrophobicContact CB-CB 3.98Å; D1489-A1492 VanDerWaalsContact CG-N 3.27Å; D1489-A1492 WeakPolarHBondContact OD2-CB 3.42Å; D1489-A1492 PolarHBondContact OD2-N 2.9Å; A1492-L1494 VanDerWaalsContact C-N 3.31Å; A1492-L1494 PolarHBondContact O-N 2.95Å
1493	S	83.4	Confident	84.5	Confident	4 Å²	4	21.3 Å²	21.3	3%	0.028	10%	0.103	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.1	-5.8	176.9	69.8	0	0	0	0	114.8	Y1069 D1489 Y1491 R1557	Y1069-S1493 WeakPolarHBondContact CA-O 3.37Å; D1489-S1493 VanDerWaalsContact O-CB 3.25Å; D1489-S1493 WeakPolarHBondContact O-CB 3.41Å; D1489-S1493 PolarHBondContact O-N 2.77Å; D1489-S1493 VanDerWaalsContact O-N 3.11Å; D1489-S1493 PolarHBondContact O-OG 2.71Å; Y1491-S1493 PolarHBondContact O-N 3.48Å; S1493-R1557 PolarHBondContact O-NH1 2.88Å
1494	L	87	Confident	84.6	Confident	0 Å²	0	21.3 Å²	21.3	0%	0	10%	0.103	C	C	.	.	S	Bend	trans	-115.1	119.1	178.3	-63.5	179.4	0	0	0	111.4	P1490 Y1491 A1492 P1496 I1503 P1542 R1550 I1553	P1490-L1494 WeakPolarHBondContact O-CD1 3.47Å; P1490-L1494 WeakPolarHBondContact O-CG 3.36Å; Y1491-L1494 PolarHBondContact O-N 2.73Å; A1492-L1494 VanDerWaalsContact C-N 3.31Å; A1492-L1494 PolarHBondContact O-N 2.95Å; L1494-P1496 VanDerWaalsContact O-CD 3.27Å; L1494-P1496 WeakPolarHBondContact O-CD 3.25Å; L1494-I1503 HydrophobicContact CB-CD1 4.25Å; L1494-I1503 HydrophobicContact CD2-CD1 4.49Å; L1494-I1503 HydrophobicContact CD2-CG2 3.8Å; L1494-P1542 HydrophobicContact CB-CB 3.9Å; L1494-P1542 HydrophobicContact CB-CG 3.7Å; L1494-P1542 HydrophobicContact CD1-CB 4.09Å; L1494-P1542 HydrophobicContact CD1-CG 4.32Å; L1494-R1550 HydrophobicContact CD1-CB 4.15Å; L1494-I1553 HydrophobicContact CD1-CB 3.96Å; L1494-I1553 HydrophobicContact CD1-CG2 3.73Å; L1494-I1553 HydrophobicContact CD2-CG2 3.84Å; L1494-I1553 HydrophobicContact CG-CG2 4.49Å
1495	N	85	Confident	84.6	Confident	2 Å²	2	21.3 Å²	21.3	1%	0.011	10%	0.103	C	C	.	.			trans	-60.8	112.8	-177.8	179.8	-5.6	0	0	0	111	Y1069 K1086 H1087 N1091 R1497 M1498	Y1069-N1495 HydrophobicContact CD2-CB 3.85Å; Y1069-N1495 HydrophobicContact CG-CB 4.17Å; K1086-N1495 PolarHBondContact O-ND2 2.76Å; H1087-N1495 PolarHBondContact ND1-ND2 3.04Å; N1091-N1495 PolarHBondContact ND2-OD1 2.96Å; N1495-R1497 PolarHBondContact O-N 3.39Å; N1495-R1497 VanDerWaalsContact O-N 3.08Å; N1495-R1497 PolarHBondContact OD1-N 2.93Å; N1495-M1498 HydrophobicContact CB-CB 4.27Å; N1495-M1498 HydrophobicContact CB-CG 4.24Å; N1495-M1498 HydrophobicContact CB-SD 3.93Å; N1495-M1498 PolarHBondContact ND2-SD 3.28Å; N1495-M1498 PolarHBondContact O-N 2.77Å
1496	P	77.2	Confident	84.6	Confident	5 Å²	5	21.5 Å²	21.5	3%	0.032	10%	0.104	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.7	-17.3	-169.7	27.8	-37.2	0	0	0	113.7	P866 L1494	P866-P1496 HydrophobicContact CB-CG 4Å; L1494-P1496 VanDerWaalsContact O-CD 3.27Å; L1494-P1496 WeakPolarHBondContact O-CD 3.25Å
1497	R	78.5	Confident	84.5	Confident	47 Å²	47	21.4 Å²	21.4	18%	0.177	10%	0.103	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.3	0.9	176.9	-64.7	-172.8	-172.1	-145.8	-9.3	114	P1090 N1091 S1093 N1495	P1090-R1497 WeakPolarHBondContact O-CD 3.37Å; P1090-R1497 PolarHBondContact O-NH1 3.43Å; N1091-R1497 WeakPolarHBondContact OD1-CD 3.43Å; N1091-R1497 WeakPolarHBondContact OD1-CG 3.35Å; N1091-R1497 PolarHBondContact OD1-NE 2.92Å; S1093-R1497 PolarHBondContact OG-NH1 3.22Å; S1093-R1497 VanDerWaalsContact OG-NH1 3.14Å; N1495-R1497 PolarHBondContact O-N 3.39Å; N1495-R1497 VanDerWaalsContact O-N 3.08Å; N1495-R1497 PolarHBondContact OD1-N 2.93Å
1498	M	85.1	Confident	84.7	Confident	19 Å²	19	21.4 Å²	21.4	9%	0.094	10%	0.103	C	C	.	.	S	Bend	trans	-104.8	145.3	172.8	-73.7	171.7	52.1	0	0	110.7	K1086 N1495 D1502 I1503 Y1541 P1542	K1086-M1498 HydrophobicContact CG-SD 4.11Å; N1495-M1498 HydrophobicContact CB-CB 4.27Å; N1495-M1498 HydrophobicContact CB-CG 4.24Å; N1495-M1498 HydrophobicContact CB-SD 3.93Å; N1495-M1498 PolarHBondContact ND2-SD 3.28Å; N1495-M1498 PolarHBondContact O-N 2.77Å; M1498-D1502 VanDerWaalsContact CE-C 3.5Å; M1498-D1502 WeakPolarHBondContact CE-O 3.46Å; M1498-I1503 HydrophobicContact CB-CD1 4.1Å; M1498-I1503 HydrophobicContact CB-CG1 3.57Å; M1498-I1503 HydrophobicContact CE-CB 4.37Å; M1498-I1503 HydrophobicContact CE-CG1 3.85Å; M1498-Y1541 VanDerWaalsContact O-CD1 3.32Å; M1498-Y1541 WeakPolarHBondContact O-CD1 3.44Å; M1498-P1542 WeakPolarHBondContact O-CD 3.49Å
1499	K	87.4	Confident	85.3	Confident	72 Å²	72	21.2 Å²	21.2	31%	0.313	11%	0.105	S	C	.	.			trans	-72.1	148.9	170.4	-68.1	-177.8	171.9	-131.6	0	110	K1501 D1502 I1503 T1539 R1540 Y1541	K1499-K1501 HydrophobicContact CB-CG 4.44Å; K1499-K1501 PolarHBondContact O-N 3.32Å; K1499-K1501 VanDerWaalsContact O-N 3.16Å; K1499-D1502 WeakPolarHBondContact O-CA 3.23Å; K1499-D1502 PolarHBondContact O-N 3.16Å; K1499-I1503 PolarHBondContact O-N 2.9Å; K1499-T1539 WeakPolarHBondContact CD-O 3.19Å; K1499-T1539 WeakPolarHBondContact CE-O 3.49Å; K1499-T1539 PolarHBondContact NZ-O 2.91Å; K1499-R1540 CarbonylContact C-O 3.54Å; K1499-R1540 VanDerWaalsContact CA-O 3.28Å; K1499-R1540 WeakPolarHBondContact CA-O 3.29Å; K1499-Y1541 HydrophobicContact CG-CD1 4.2Å; K1499-Y1541 HydrophobicContact CG-CE1 3.72Å; K1499-Y1541 HydrophobicContact CG-CE2 4.22Å
1500	V	88.8	Confident	85.9	Confident	0 Å²	0	19.5 Å²	19.5	0%	0	10%	0.096	C	C	.	.	H	α-helix	trans	-51.2	-42.4	179.7	166.9	0	0	0	0	112.1	D1502 I1503 I1504 L1528 R1540 F1545 I1553	V1500-D1502 PolarHBondContact O-N 3.4Å; V1500-I1503 PolarHBondContact O-N 2.77Å; V1500-I1504 HydrophobicContact CG1-CD1 3.7Å; V1500-I1504 HydrophobicContact CG1-CG1 4.42Å; V1500-I1504 WeakPolarHBondContact O-CG1 3.37Å; V1500-I1504 PolarHBondContact O-N 2.89Å; V1500-L1528 HydrophobicContact CG1-CD2 3.93Å; V1500-R1540 PolarHBondContact N-O 2.97Å; V1500-F1545 HydrophobicContact CB-CE2 4.47Å; V1500-F1545 HydrophobicContact CB-CZ 4.49Å; V1500-F1545 HydrophobicContact CG2-CD2 4.23Å; V1500-F1545 HydrophobicContact CG2-CE2 3.4Å; V1500-F1545 VanDerWaalsContact CG2-CE2 3.4Å; V1500-F1545 HydrophobicContact CG2-CZ 3.8Å; V1500-I1553 HydrophobicContact CB-CD1 4.46Å; V1500-I1553 HydrophobicContact CG1-CD1 3.99Å; V1500-I1553 HydrophobicContact CG1-CG1 3.81Å; V1500-I1553 HydrophobicContact CG1-CG2 3.89Å; V1500-I1553 HydrophobicContact CG2-CD1 3.58Å; V1500-I1553 HydrophobicContact CG2-CG1 4.3Å; V1500-I1553 HydrophobicContact CG2-CG2 4.32Å
1501	K	91.6	Very high	86.3	Confident	48 Å²	48	21 Å²	21	21%	0.209	10%	0.104	C	C	.	.	H	α-helix	trans	-61.1	-33	177.7	77	-179	-147.5	116.9	0	113.8	K1499 A1505 D1521 V1524 G1538	K1499-K1501 HydrophobicContact CB-CG 4.44Å; K1499-K1501 PolarHBondContact O-N 3.32Å; K1499-K1501 VanDerWaalsContact O-N 3.16Å; K1501-A1505 WeakPolarHBondContact O-CB 3.33Å; K1501-A1505 PolarHBondContact O-N 3.47Å; K1501-D1521 IonicContact NZ-OD1 2.69Å; K1501-D1521 PolarHBondContact NZ-OD1 2.91Å; K1501-D1521 IonicContact NZ-OD2 2.93Å; K1501-D1521 PolarHBondContact NZ-OD2 3.25Å; K1501-V1524 HydrophobicContact CB-CG1 3.72Å; K1501-G1538 WeakPolarHBondContact CB-O 3.37Å; K1501-G1538 VanDerWaalsContact CG-O 3.31Å; K1501-G1538 WeakPolarHBondContact CG-O 3.45Å; K1501-G1538 PolarHBondContact N-O 3.17Å
1502	D	90.1	Very high	86.8	Confident	43 Å²	43	21.5 Å²	21.5	23%	0.23	12%	0.121	C	C	.	.	H	α-helix	trans	-90.6	-16	-176.3	-63.2	-55.7	0	0	0	112.6	M1498 K1499 V1500 R1520	M1498-D1502 VanDerWaalsContact CE-C 3.5Å; M1498-D1502 WeakPolarHBondContact CE-O 3.46Å; K1499-D1502 WeakPolarHBondContact O-CA 3.23Å; K1499-D1502 PolarHBondContact O-N 3.16Å; V1500-D1502 PolarHBondContact O-N 3.4Å; D1502-R1520 IonicContact OD1-CZ 3.78Å; D1502-R1520 VanDerWaalsContact OD1-CZ 3.28Å; D1502-R1520 IonicContact OD1-NH1 2.78Å; D1502-R1520 PolarHBondContact OD1-NH1 3.47Å; D1502-R1520 IonicContact OD1-NH2 2.75Å; D1502-R1520 PolarHBondContact OD1-NH2 3.38Å
1503	I	91.4	Very high	87.2	Confident	4 Å²	4	22 Å²	22	2%	0.021	12%	0.121	C	C	.	.	H	α-helix	trans	-75.7	-53	164.4	-58.8	167.1	0	0	0	109.6	L1494 M1498 K1499 V1500 A1505 E1506 P1542 R1557	L1494-I1503 HydrophobicContact CB-CD1 4.25Å; L1494-I1503 HydrophobicContact CD2-CD1 4.49Å; L1494-I1503 HydrophobicContact CD2-CG2 3.8Å; M1498-I1503 HydrophobicContact CB-CD1 4.1Å; M1498-I1503 HydrophobicContact CB-CG1 3.57Å; M1498-I1503 HydrophobicContact CE-CB 4.37Å; M1498-I1503 HydrophobicContact CE-CG1 3.85Å; K1499-I1503 PolarHBondContact O-N 2.9Å; V1500-I1503 PolarHBondContact O-N 2.77Å; I1503-A1505 VanDerWaalsContact C-N 3.34Å; I1503-A1505 PolarHBondContact O-N 3.41Å; I1503-E1506 WeakPolarHBondContact O-CB 3.49Å; I1503-E1506 PolarHBondContact O-N 3.11Å; I1503-P1542 HydrophobicContact CD1-CG 3.56Å; I1503-R1557 HydrophobicContact CG2-CG 4.12Å
1504	I	92.1	Very high	87.4	Confident	0 Å²	0	22.8 Å²	22.8	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-60.2	-45	178.4	-64.9	168.8	0	0	0	110.4	V1500 E1506 V1524 L1527 L1528 I1553 A1556 A1560	V1500-I1504 HydrophobicContact CG1-CD1 3.7Å; V1500-I1504 HydrophobicContact CG1-CG1 4.42Å; V1500-I1504 WeakPolarHBondContact O-CG1 3.37Å; V1500-I1504 PolarHBondContact O-N 2.89Å; I1504-E1506 PolarHBondContact O-N 2.84Å; I1504-E1506 VanDerWaalsContact O-N 3.11Å; I1504-V1524 HydrophobicContact CB-CG1 4.29Å; I1504-V1524 HydrophobicContact CG2-CG1 4.28Å; I1504-V1524 HydrophobicContact CG2-CG2 4.25Å; I1504-L1527 HydrophobicContact CG2-CB 4.19Å; I1504-L1527 HydrophobicContact CG2-CD1 3.72Å; I1504-L1528 HydrophobicContact CD1-CD2 3.57Å; I1504-L1528 HydrophobicContact CD1-CG 3.86Å; I1504-I1553 HydrophobicContact CD1-CG2 4.44Å; I1504-I1553 HydrophobicContact CG1-CG2 4.34Å; I1504-A1556 HydrophobicContact CD1-CB 3.73Å; I1504-A1556 HydrophobicContact CG1-CB 3.98Å; I1504-A1556 HydrophobicContact CG2-CB 4.43Å; I1504-A1560 HydrophobicContact CG2-CB 4.29Å; I1504-A1560 WeakPolarHBondContact O-CB 3.12Å
1505	A	91.9	Very high	87.3	Confident	0 Å²	0	31.9 Å²	31.9	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-65.9	-9.6	176.5	0	0	0	0	0	114.8	K1501 I1503 G1507 I1508 D1509 R1520 V1524	K1501-A1505 WeakPolarHBondContact O-CB 3.33Å; K1501-A1505 PolarHBondContact O-N 3.47Å; I1503-A1505 VanDerWaalsContact C-N 3.34Å; I1503-A1505 PolarHBondContact O-N 3.41Å; A1505-G1507 VanDerWaalsContact C-N 3.32Å; A1505-G1507 PolarHBondContact O-N 3.12Å; A1505-I1508 WeakPolarHBondContact O-CB 3.5Å; A1505-I1508 PolarHBondContact O-N 3.49Å; A1505-I1508 VanDerWaalsContact O-N 3.11Å; A1505-D1509 WeakPolarHBondContact O-CB 3.11Å; A1505-D1509 PolarHBondContact O-N 2.99Å; A1505-R1520 HydrophobicContact CB-CG 3.97Å; A1505-V1524 HydrophobicContact CB-CG2 3.72Å
1506	E	90.5	Very high	87.4	Confident	4 Å²	4	35.1 Å²	35.1	2%	0.019	19%	0.187	C	C	.	.	H	α-helix	trans	-59.6	-43.6	179.5	-176.7	147.2	-125.3	0	0	111.8	L1076 K1086 H1087 I1503 I1504 I1508 D1509 V1510	L1076-E1506 HydrophobicContact CD1-CB 3.86Å; L1076-E1506 HydrophobicContact CD1-CG 3.66Å; K1086-E1506 VanDerWaalsContact CD-OE1 3.27Å; K1086-E1506 WeakPolarHBondContact CD-OE1 3.48Å; K1086-E1506 WeakPolarHBondContact CE-OE1 3.46Å; K1086-E1506 IonicContact NZ-OE1 3.62Å; K1086-E1506 PolarHBondContact NZ-OE1 3.31Å; K1086-E1506 IonicContact NZ-OE2 2.74Å; H1087-E1506 IonicContact CE1-OE1 3.82Å; H1087-E1506 IonicContact CE1-OE2 3.24Å; H1087-E1506 PolarHBondContact CE1-OE2 2.76Å; H1087-E1506 VanDerWaalsContact CE1-OE2 3.24Å; H1087-E1506 IonicContact NE2-OE1 2.96Å; H1087-E1506 PolarHBondContact NE2-OE1 2.91Å; H1087-E1506 IonicContact NE2-OE2 3.58Å; H1087-E1506 PolarHBondContact NE2-OE2 3.07Å; I1503-E1506 WeakPolarHBondContact O-CB 3.49Å; I1503-E1506 PolarHBondContact O-N 3.11Å; I1504-E1506 PolarHBondContact O-N 2.84Å; I1504-E1506 VanDerWaalsContact O-N 3.11Å; E1506-I1508 VanDerWaalsContact C-N 3.28Å; E1506-I1508 PolarHBondContact O-N 3.38Å; E1506-D1509 PolarHBondContact O-N 3Å; E1506-V1510 HydrophobicContact CG-CG2 4.1Å; E1506-V1510 WeakPolarHBondContact O-CB 3.43Å; E1506-V1510 WeakPolarHBondContact O-CG2 3.47Å; E1506-V1510 PolarHBondContact O-N 2.97Å
1507	G	87.5	Confident	87.7	Confident	0 Å²	0	39.8 Å²	39.8	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-60.4	-39.7	174.9	0	0	0	0	0	112.8	A1505 N1511	A1505-G1507 VanDerWaalsContact C-N 3.32Å; A1505-G1507 PolarHBondContact O-N 3.12Å; G1507-N1511 WeakPolarHBondContact O-CB 3.24Å; G1507-N1511 PolarHBondContact O-N 3.07Å; G1507-N1511 VanDerWaalsContact O-N 3.15Å; G1507-N1511 PolarHBondContact O-ND2 3.37Å
1508	I	90.9	Very high	88.1	Confident	2 Å²	2	46.2 Å²	46.2	1%	0.01	25%	0.247	C	C	.	.	H	α-helix	trans	-66.3	-48	179.1	-54.6	179.7	0	0	0	110.9	A1505 E1506 G1512 I1513 A1514 L1523 V1524 L1527 A1560	A1505-I1508 WeakPolarHBondContact O-CB 3.5Å; A1505-I1508 PolarHBondContact O-N 3.49Å; A1505-I1508 VanDerWaalsContact O-N 3.11Å; E1506-I1508 VanDerWaalsContact C-N 3.28Å; E1506-I1508 PolarHBondContact O-N 3.38Å; I1508-G1512 PolarHBondContact O-N 3.13Å; I1508-I1513 HydrophobicContact CG2-CB 4.01Å; I1508-I1513 HydrophobicContact CG2-CG2 4.4Å; I1508-I1513 PolarHBondContact O-N 3.08Å; I1508-A1514 HydrophobicContact CG2-CB 3.54Å; I1508-L1523 HydrophobicContact CD1-CB 3.73Å; I1508-L1523 HydrophobicContact CD1-CD1 4.37Å; I1508-L1523 HydrophobicContact CG2-CD1 4.34Å; I1508-V1524 HydrophobicContact CD1-CG2 4.06Å; I1508-L1527 HydrophobicContact CD1-CD1 4.29Å; I1508-A1560 HydrophobicContact CG1-CB 4.19Å
1509	D	89.3	Confident	88.3	Confident	70 Å²	70	49 Å²	49	37%	0.374	26%	0.26	S	S	.	.	H	α-helix	trans	-68.7	-34.9	-177.8	-69.4	-23.3	0	0	0	112.1	A1505 E1506 R1520	A1505-D1509 WeakPolarHBondContact O-CB 3.11Å; A1505-D1509 PolarHBondContact O-N 2.99Å; E1506-D1509 PolarHBondContact O-N 3Å; D1509-R1520 VanDerWaalsContact CG-NE 3.33Å; D1509-R1520 WeakPolarHBondContact OD1-CD 3.29Å; D1509-R1520 IonicContact OD1-CZ 3.4Å; D1509-R1520 IonicContact OD1-NE 3.33Å; D1509-R1520 PolarHBondContact OD1-NE 3.39Å; D1509-R1520 IonicContact OD1-NH2 2.71Å; D1509-R1520 IonicContact OD2-CZ 3.64Å; D1509-R1520 IonicContact OD2-NE 2.81Å; D1509-R1520 PolarHBondContact OD2-NE 3.01Å; D1509-R1520 VanDerWaalsContact OD2-NE 3.07Å; D1509-R1520 IonicContact OD2-NH2 3.56Å; D1509-R1520 PolarHBondContact OD2-NH2 3.49Å
1510	V	86.6	Confident	88.5	Confident	26 Å²	26	47.3 Å²	47.3	16%	0.158	25%	0.251	C	S	.	.	H	α-helix	trans	-76	-40.8	-179.4	176.1	0	0	0	0	112	L1076 E1078 E1506	L1076-V1510 WeakPolarHBondContact O-CG1 3.19Å; E1078-V1510 HydrophobicContact CG-CG2 3.55Å; E1078-V1510 WeakPolarHBondContact OE1-CG2 3Å; E1506-V1510 HydrophobicContact CG-CG2 4.1Å; E1506-V1510 WeakPolarHBondContact O-CB 3.43Å; E1506-V1510 WeakPolarHBondContact O-CG2 3.47Å; E1506-V1510 PolarHBondContact O-N 2.97Å
1511	N	85.6	Confident	88.6	Confident	36 Å²	36	49.9 Å²	49.9	19%	0.193	27%	0.265	C	S	.	.	H	α-helix	trans	-91.5	-0	-178	-68.5	-86.7	0	0	0	113.1	G1507 I1513 V1561	G1507-N1511 WeakPolarHBondContact O-CB 3.24Å; G1507-N1511 PolarHBondContact O-N 3.07Å; G1507-N1511 VanDerWaalsContact O-N 3.15Å; G1507-N1511 PolarHBondContact O-ND2 3.37Å; N1511-I1513 VanDerWaalsContact C-N 3.29Å; N1511-I1513 HydrophobicContact CB-CD1 3.87Å; N1511-I1513 HydrophobicContact CB-CG1 3.86Å; N1511-I1513 PolarHBondContact O-N 3.31Å; N1511-V1561 WeakPolarHBondContact ND2-CG1 3.4Å
1512	G	83.5	Confident	88.6	Confident	50 Å²	50	53.3 Å²	53.3	52%	0.515	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	65.1	29.7	178.2	0	0	0	0	0	113.9	I1508	I1508-G1512 PolarHBondContact O-N 3.13Å
1513	I	87.1	Confident	88.7	Confident	30 Å²	30	52.7 Å²	52.7	15%	0.154	28%	0.277	C	S	.	.			trans	-71	-35.5	-171.8	-67.7	171.1	0	0	0	111.3	I1508 N1511 L1523	I1508-I1513 HydrophobicContact CG2-CB 4.01Å; I1508-I1513 HydrophobicContact CG2-CG2 4.4Å; I1508-I1513 PolarHBondContact O-N 3.08Å; N1511-I1513 VanDerWaalsContact C-N 3.29Å; N1511-I1513 HydrophobicContact CB-CD1 3.87Å; N1511-I1513 HydrophobicContact CB-CG1 3.86Å; N1511-I1513 PolarHBondContact O-N 3.31Å; I1513-L1523 HydrophobicContact CG2-CD1 4.12Å
1514	A	88	Confident	88.8	Confident	21 Å²	21	52.5 Å²	52.5	17%	0.174	28%	0.276	C	S	.	.			trans	-102.2	138.7	170	0	0	0	0	0	110.9	I1508 E1519 R1520 L1523	I1508-A1514 HydrophobicContact CG2-CB 3.54Å; A1514-E1519 HydrophobicContact CB-CB 4.19Å; A1514-E1519 HydrophobicContact CB-CG 3.94Å; A1514-R1520 HydrophobicContact CB-CB 3.84Å; A1514-L1523 HydrophobicContact CB-CD1 4.26Å
1515	K	85.1	Confident	88.8	Confident	190 Å²	190	55.6 Å²	55.6	83%	0.826	29%	0.292	S	S	*	.	S	Bend	trans	-97.3	-15.3	177.3	-62.3	175.3	-175.6	172.4	0	112.7	E1519	K1515-E1519 PolarHBondContact N-OE2 2.98Å
1516	T	87.4	Confident	88.8	Confident	71 Å²	71	58.2 Å²	58.2	44%	0.436	31%	0.306	S	S	.	.	S	Bend	trans	-134.8	152.2	179.3	69.9	0	0	0	0	112.4	K1518 E1519 R1520	T1516-K1518 PolarHBondContact O-N 3.38Å; T1516-E1519 PolarHBondContact N-OE2 2.84Å; T1516-E1519 WeakPolarHBondContact O-CB 3.13Å; T1516-E1519 PolarHBondContact O-N 2.9Å; T1516-E1519 VanDerWaalsContact O-N 3.14Å; T1516-E1519 VanDerWaalsContact OG1-CB 3.25Å; T1516-E1519 WeakPolarHBondContact OG1-CB 3.17Å; T1516-E1519 PolarHBondContact OG1-N 3.17Å; T1516-R1520 PolarHBondContact O-N 3.34Å
1517	P	82.9	Confident	88.9	Confident	103 Å²	103	59.1 Å²	59.1	67%	0.669	31%	0.311	S	S	*	.	H	α-helix	trans	-58.7	-31.5	175.5	-26.5	35.5	0	0	0	114	D1521	P1517-D1521 WeakPolarHBondContact O-CB 3.39Å; P1517-D1521 PolarHBondContact O-N 3.44Å
1518	K	86.6	Confident	89.1	Confident	181 Å²	181	59.1 Å²	59.1	79%	0.787	31%	0.311	S	S	*	.	H	α-helix	trans	-71.1	-36.2	177.3	-174.3	177.2	178.6	-178.5	0	112.4	T1516 K1522	T1516-K1518 PolarHBondContact O-N 3.38Å; K1518-K1522 WeakPolarHBondContact O-CB 3.34Å; K1518-K1522 PolarHBondContact O-N 2.94Å
1519	E	90.7	Very high	89	Confident	78 Å²	78	65.4 Å²	65.4	36%	0.364	34%	0.34	S	S	.	.	H	α-helix	trans	-70.7	-41.9	174.4	-178.5	179.2	-150.7	0	0	111.1	A1514 K1515 T1516 K1522 L1523	A1514-E1519 HydrophobicContact CB-CB 4.19Å; A1514-E1519 HydrophobicContact CB-CG 3.94Å; K1515-E1519 PolarHBondContact N-OE2 2.98Å; T1516-E1519 PolarHBondContact N-OE2 2.84Å; T1516-E1519 WeakPolarHBondContact O-CB 3.13Å; T1516-E1519 PolarHBondContact O-N 2.9Å; T1516-E1519 VanDerWaalsContact O-N 3.14Å; T1516-E1519 VanDerWaalsContact OG1-CB 3.25Å; T1516-E1519 WeakPolarHBondContact OG1-CB 3.17Å; T1516-E1519 PolarHBondContact OG1-N 3.17Å; E1519-K1522 PolarHBondContact O-N 2.65Å; E1519-L1523 HydrophobicContact CG-CD1 4.47Å; E1519-L1523 WeakPolarHBondContact O-CG 3.47Å; E1519-L1523 PolarHBondContact O-N 2.75Å
1520	R	91.6	Very high	89	Confident	36 Å²	36	64.5 Å²	64.5	14%	0.136	34%	0.337	C	S	.	.	H	α-helix	trans	-57.3	-56.9	172.2	179.1	-164.1	-171.7	-99.7	9.8	111.6	D1502 A1505 D1509 A1514 T1516 K1522 L1523 V1524	D1502-R1520 IonicContact OD1-CZ 3.78Å; D1502-R1520 VanDerWaalsContact OD1-CZ 3.28Å; D1502-R1520 IonicContact OD1-NH1 2.78Å; D1502-R1520 PolarHBondContact OD1-NH1 3.47Å; D1502-R1520 IonicContact OD1-NH2 2.75Å; D1502-R1520 PolarHBondContact OD1-NH2 3.38Å; A1505-R1520 HydrophobicContact CB-CG 3.97Å; D1509-R1520 VanDerWaalsContact CG-NE 3.33Å; D1509-R1520 WeakPolarHBondContact OD1-CD 3.29Å; D1509-R1520 IonicContact OD1-CZ 3.4Å; D1509-R1520 IonicContact OD1-NE 3.33Å; D1509-R1520 PolarHBondContact OD1-NE 3.39Å; D1509-R1520 IonicContact OD1-NH2 2.71Å; D1509-R1520 IonicContact OD2-CZ 3.64Å; D1509-R1520 IonicContact OD2-NE 2.81Å; D1509-R1520 PolarHBondContact OD2-NE 3.01Å; D1509-R1520 VanDerWaalsContact OD2-NE 3.07Å; D1509-R1520 IonicContact OD2-NH2 3.56Å; D1509-R1520 PolarHBondContact OD2-NH2 3.49Å; A1514-R1520 HydrophobicContact CB-CB 3.84Å; T1516-R1520 PolarHBondContact O-N 3.34Å; R1520-K1522 VanDerWaalsContact C-N 3.26Å; R1520-K1522 PolarHBondContact O-N 3.08Å; R1520-L1523 PolarHBondContact O-N 2.89Å; R1520-V1524 WeakPolarHBondContact O-CG2 3.29Å; R1520-V1524 PolarHBondContact O-N 3.19Å
1521	D	89.7	Confident	89.1	Confident	55 Å²	55	63.3 Å²	63.3	29%	0.294	33%	0.33	S	S	.	.	H	α-helix	trans	-65.4	-28.8	-179.4	-80	-4.5	0	0	0	111.6	K1501 P1517 N1525	K1501-D1521 IonicContact NZ-OD1 2.69Å; K1501-D1521 PolarHBondContact NZ-OD1 2.91Å; K1501-D1521 IonicContact NZ-OD2 2.93Å; K1501-D1521 PolarHBondContact NZ-OD2 3.25Å; P1517-D1521 WeakPolarHBondContact O-CB 3.39Å; P1517-D1521 PolarHBondContact O-N 3.44Å; D1521-N1525 WeakPolarHBondContact O-CB 3.47Å; D1521-N1525 PolarHBondContact O-N 3.43Å; D1521-N1525 VanDerWaalsContact O-N 3.12Å; D1521-N1525 PolarHBondContact O-ND2 3.26Å; D1521-N1525 PolarHBondContact O-OD1 3.48Å
1522	K	92.6	Very high	89	Confident	119 Å²	119	64.2 Å²	64.2	52%	0.517	35%	0.348	S	S	.	.	H	α-helix	trans	-64.9	-54.4	169.3	-169.2	-165.5	-178	-68.6	0	111.3	K1518 E1519 R1520 V1524 N1525 D1526	K1518-K1522 WeakPolarHBondContact O-CB 3.34Å; K1518-K1522 PolarHBondContact O-N 2.94Å; E1519-K1522 PolarHBondContact O-N 2.65Å; R1520-K1522 VanDerWaalsContact C-N 3.26Å; R1520-K1522 PolarHBondContact O-N 3.08Å; K1522-V1524 PolarHBondContact O-N 3.33Å; K1522-N1525 WeakPolarHBondContact O-CA 3.27Å; K1522-N1525 WeakPolarHBondContact O-CB 3.22Å; K1522-N1525 PolarHBondContact O-N 2.99Å; K1522-D1526 IonicContact NZ-OD1 3.57Å; K1522-D1526 PolarHBondContact NZ-OD1 2.82Å; K1522-D1526 IonicContact NZ-OD2 2.68Å; K1522-D1526 PolarHBondContact NZ-OD2 2.82Å; K1522-D1526 PolarHBondContact O-N 3.48Å
1523	L	91.7	Very high	89.1	Confident	31 Å²	31	62.3 Å²	62.3	16%	0.162	33%	0.326	C	S	.	.	H	α-helix	trans	-57.7	-34.6	-178.2	-73.8	171.1	0	0	0	112.3	I1508 I1513 A1514 E1519 R1520 L1527	I1508-L1523 HydrophobicContact CD1-CB 3.73Å; I1508-L1523 HydrophobicContact CD1-CD1 4.37Å; I1508-L1523 HydrophobicContact CG2-CD1 4.34Å; I1513-L1523 HydrophobicContact CG2-CD1 4.12Å; A1514-L1523 HydrophobicContact CB-CD1 4.26Å; E1519-L1523 HydrophobicContact CG-CD1 4.47Å; E1519-L1523 WeakPolarHBondContact O-CG 3.47Å; E1519-L1523 PolarHBondContact O-N 2.75Å; R1520-L1523 PolarHBondContact O-N 2.89Å; L1523-L1527 WeakPolarHBondContact O-CB 3.32Å; L1523-L1527 WeakPolarHBondContact O-CD1 3.48Å; L1523-L1527 WeakPolarHBondContact O-CG 3.18Å; L1523-L1527 PolarHBondContact O-N 3.26Å
1524	V	92.8	Very high	88.9	Confident	0 Å²	0	65.2 Å²	65.2	0%	0	34%	0.342	C	S	.	.	H	α-helix	trans	-68.7	-41.6	173.7	173.8	0	0	0	0	112.5	K1501 I1504 A1505 I1508 R1520 K1522 L1527 L1528	K1501-V1524 HydrophobicContact CB-CG1 3.72Å; I1504-V1524 HydrophobicContact CB-CG1 4.29Å; I1504-V1524 HydrophobicContact CG2-CG1 4.28Å; I1504-V1524 HydrophobicContact CG2-CG2 4.25Å; A1505-V1524 HydrophobicContact CB-CG2 3.72Å; I1508-V1524 HydrophobicContact CD1-CG2 4.06Å; R1520-V1524 WeakPolarHBondContact O-CG2 3.29Å; R1520-V1524 PolarHBondContact O-N 3.19Å; K1522-V1524 PolarHBondContact O-N 3.33Å; V1524-L1527 PolarHBondContact O-N 3.41Å; V1524-L1528 HydrophobicContact CG1-CD1 4.11Å; V1524-L1528 WeakPolarHBondContact O-CB 3.47Å; V1524-L1528 WeakPolarHBondContact O-CG 3.27Å; V1524-L1528 PolarHBondContact O-N 3.31Å
1525	N	93	Very high	88.8	Confident	65 Å²	65	65.9 Å²	65.9	35%	0.348	35%	0.345	S	S	.	.	H	α-helix	trans	-64.4	-45.2	175.9	-69.7	-10.9	0	0	0	110.9	D1521 K1522 L1527 L1528 E1529 P1535	D1521-N1525 WeakPolarHBondContact O-CB 3.47Å; D1521-N1525 PolarHBondContact O-N 3.43Å; D1521-N1525 VanDerWaalsContact O-N 3.12Å; D1521-N1525 PolarHBondContact O-ND2 3.26Å; D1521-N1525 PolarHBondContact O-OD1 3.48Å; K1522-N1525 WeakPolarHBondContact O-CA 3.27Å; K1522-N1525 WeakPolarHBondContact O-CB 3.22Å; K1522-N1525 PolarHBondContact O-N 2.99Å; N1525-L1527 PolarHBondContact O-N 2.99Å; N1525-L1528 PolarHBondContact O-N 3.35Å; N1525-E1529 PolarHBondContact O-N 2.83Å; N1525-P1535 HydrophobicContact CB-CB 3.81Å; N1525-P1535 HydrophobicContact CB-CG 4.2Å
1526	D	91.3	Very high	88.6	Confident	54 Å²	54	60 Å²	60	29%	0.289	33%	0.328	S	S	.	.	H	α-helix	trans	-55.8	-49.8	174.3	-58.1	-18.3	0	0	0	109.9	K1522 L1528 E1529 T1530	K1522-D1526 IonicContact NZ-OD1 3.57Å; K1522-D1526 PolarHBondContact NZ-OD1 2.82Å; K1522-D1526 IonicContact NZ-OD2 2.68Å; K1522-D1526 PolarHBondContact NZ-OD2 2.82Å; K1522-D1526 PolarHBondContact O-N 3.48Å; D1526-L1528 PolarHBondContact O-N 2.78Å; D1526-E1529 PolarHBondContact O-N 3.01Å; D1526-T1530 PolarHBondContact O-N 2.65Å; D1526-T1530 PolarHBondContact O-OG1 2.96Å; D1526-T1530 VanDerWaalsContact O-OG1 3.08Å
1527	L	92.5	Very high	88.5	Confident	23 Å²	23	58.2 Å²	58.2	12%	0.12	31%	0.314	C	S	.	.	H	α-helix	trans	-63.1	-36.4	178	-77.4	164	0	0	0	114	I1504 I1508 L1523 V1524 N1525 V1531 L1559 A1560	I1504-L1527 HydrophobicContact CG2-CB 4.19Å; I1504-L1527 HydrophobicContact CG2-CD1 3.72Å; I1508-L1527 HydrophobicContact CD1-CD1 4.29Å; L1523-L1527 WeakPolarHBondContact O-CB 3.32Å; L1523-L1527 WeakPolarHBondContact O-CD1 3.48Å; L1523-L1527 WeakPolarHBondContact O-CG 3.18Å; L1523-L1527 PolarHBondContact O-N 3.26Å; V1524-L1527 PolarHBondContact O-N 3.41Å; N1525-L1527 PolarHBondContact O-N 2.99Å; L1527-V1531 WeakPolarHBondContact O-CG2 3.45Å; L1527-V1531 PolarHBondContact O-N 2.83Å; L1527-L1559 HydrophobicContact CD2-CB 3.73Å; L1527-A1560 HydrophobicContact CD1-CB 3.91Å
1528	L	91.7	Very high	88.5	Confident	0 Å²	0	53.3 Å²	53.3	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-64.8	-45.4	174.7	-79.8	168.1	0	0	0	110.6	V1500 I1504 V1524 N1525 D1526 V1531 G1532 L1533	V1500-L1528 HydrophobicContact CG1-CD2 3.93Å; I1504-L1528 HydrophobicContact CD1-CD2 3.57Å; I1504-L1528 HydrophobicContact CD1-CG 3.86Å; V1524-L1528 HydrophobicContact CG1-CD1 4.11Å; V1524-L1528 WeakPolarHBondContact O-CB 3.47Å; V1524-L1528 WeakPolarHBondContact O-CG 3.27Å; V1524-L1528 PolarHBondContact O-N 3.31Å; N1525-L1528 PolarHBondContact O-N 3.35Å; D1526-L1528 PolarHBondContact O-N 2.78Å; L1528-V1531 WeakPolarHBondContact O-CG2 3.38Å; L1528-V1531 PolarHBondContact O-N 3.27Å; L1528-G1532 PolarHBondContact O-N 3.27Å; L1528-L1533 CarbonylContact C-O 3.51Å; L1528-L1533 HydrophobicContact CB-CB 4.4Å; L1528-L1533 HydrophobicContact CD2-CB 3.97Å; L1528-L1533 HydrophobicContact CD2-CD1 3.94Å; L1528-L1533 WeakPolarHBondContact O-CA 3.41Å; L1528-L1533 PolarHBondContact O-N 3.36Å
1529	E	89.1	Confident	88.3	Confident	134 Å²	134	48.6 Å²	48.6	63%	0.626	27%	0.269	S	S	*	.	H	α-helix	trans	-63.3	-43.6	178	-168.2	163.2	-166.8	0	0	111.2	N1525 D1526 V1531 G1532 L1533 P1535	N1525-E1529 PolarHBondContact O-N 2.83Å; D1526-E1529 PolarHBondContact O-N 3.01Å; E1529-V1531 VanDerWaalsContact C-N 3.32Å; E1529-V1531 PolarHBondContact O-N 3.45Å; E1529-G1532 PolarHBondContact O-N 2.76Å; E1529-L1533 PolarHBondContact N-O 3.44Å; E1529-P1535 HydrophobicContact CB-CG 4.42Å
1530	T	88.6	Confident	88	Confident	52 Å²	52	49.4 Å²	49.4	32%	0.319	27%	0.269	S	S	.	.	H	α-helix	trans	-54.9	-40.8	172.6	-63.1	0	0	0	0	113.1	D1526 G1532 L1590	D1526-T1530 PolarHBondContact O-N 2.65Å; D1526-T1530 PolarHBondContact O-OG1 2.96Å; D1526-T1530 VanDerWaalsContact O-OG1 3.08Å; T1530-G1532 VanDerWaalsContact C-N 3.26Å; T1530-G1532 PolarHBondContact O-N 2.92Å; T1530-L1590 HydrophobicContact CG2-CD2 3.66Å
1531	V	89.5	Confident	87.4	Confident	0 Å²	0	50 Å²	50	0%	0	27%	0.271	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.1	11.7	176.8	-57.1	0	0	0	0	114	L1527 L1528 E1529 L1533 R1552 I1555 A1556 L1559 L1586	L1527-V1531 WeakPolarHBondContact O-CG2 3.45Å; L1527-V1531 PolarHBondContact O-N 2.83Å; L1528-V1531 WeakPolarHBondContact O-CG2 3.38Å; L1528-V1531 PolarHBondContact O-N 3.27Å; E1529-V1531 VanDerWaalsContact C-N 3.32Å; E1529-V1531 PolarHBondContact O-N 3.45Å; V1531-L1533 HydrophobicContact CG2-CB 4.37Å; V1531-L1533 HydrophobicContact CG2-CD1 3.89Å; V1531-L1533 HydrophobicContact CG2-CG 4.04Å; V1531-R1552 HydrophobicContact CB-CB 4.1Å; V1531-R1552 HydrophobicContact CG2-CB 4.06Å; V1531-R1552 WeakPolarHBondContact CG2-O 3.28Å; V1531-R1552 VanDerWaalsContact O-CD 3.29Å; V1531-R1552 WeakPolarHBondContact O-CD 3.21Å; V1531-R1552 WeakPolarHBondContact O-CG 3.23Å; V1531-R1552 PolarHBondContact O-NH1 2.83Å; V1531-I1555 HydrophobicContact CG1-CB 4.37Å; V1531-I1555 HydrophobicContact CG1-CG2 3.94Å; V1531-A1556 HydrophobicContact CG1-CB 3.84Å; V1531-A1556 HydrophobicContact CG2-CB 3.94Å; V1531-L1559 HydrophobicContact CG1-CD1 4.22Å; V1531-L1586 HydrophobicContact CB-CD2 4.08Å; V1531-L1586 HydrophobicContact CG1-CD2 4.35Å
1532	G	83	Confident	86.9	Confident	56 Å²	56	47.4 Å²	47.4	58%	0.577	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.9	26.5	177.6	0	0	0	0	0	114.7	L1528 E1529 T1530	L1528-G1532 PolarHBondContact O-N 3.27Å; E1529-G1532 PolarHBondContact O-N 2.76Å; T1530-G1532 VanDerWaalsContact C-N 3.26Å; T1530-G1532 PolarHBondContact O-N 2.92Å
1533	L	86.6	Confident	86	Confident	10 Å²	10	43.3 Å²	43.3	5%	0.052	24%	0.24	C	C	.	.			trans	-113.4	135.7	177.1	-63.7	175.4	0	0	0	111	L1528 E1529 V1531 P1535 Q1549 R1552 I1553	L1528-L1533 CarbonylContact C-O 3.51Å; L1528-L1533 HydrophobicContact CB-CB 4.4Å; L1528-L1533 HydrophobicContact CD2-CB 3.97Å; L1528-L1533 HydrophobicContact CD2-CD1 3.94Å; L1528-L1533 WeakPolarHBondContact O-CA 3.41Å; L1528-L1533 PolarHBondContact O-N 3.36Å; E1529-L1533 PolarHBondContact N-O 3.44Å; V1531-L1533 HydrophobicContact CG2-CB 4.37Å; V1531-L1533 HydrophobicContact CG2-CD1 3.89Å; V1531-L1533 HydrophobicContact CG2-CG 4.04Å; L1533-P1535 WeakPolarHBondContact O-CD 3.31Å; L1533-Q1549 HydrophobicContact CD2-CB 4.21Å; L1533-Q1549 HydrophobicContact CD2-CG 4.03Å; L1533-R1552 HydrophobicContact CD1-CB 3.92Å; L1533-R1552 HydrophobicContact CG-CB 4.21Å; L1533-I1553 HydrophobicContact CD1-CD1 4.35Å; L1533-I1553 HydrophobicContact CD1-CG1 3.62Å
1534	N	82.9	Confident	85	Confident	90 Å²	90	45.3 Å²	45.3	48%	0.481	25%	0.249	S	C	.	.			trans	-62.5	128.8	176.9	-175.7	-63.7	0	0	0	110.6	S1536 H1537	N1534-S1536 PolarHBondContact O-N 2.99Å; N1534-S1536 VanDerWaalsContact OD1-CB 3.29Å; N1534-S1536 WeakPolarHBondContact OD1-CB 3.31Å; N1534-S1536 PolarHBondContact OD1-N 3.04Å; N1534-S1536 PolarHBondContact OD1-OG 2.85Å; N1534-H1537 WeakPolarHBondContact O-CB 3.45Å; N1534-H1537 VanDerWaalsContact O-CG 3.27Å; N1534-H1537 PolarHBondContact O-N 3.28Å
1535	P	86.2	Confident	84.1	Confident	36 Å²	36	45.9 Å²	45.9	23%	0.234	25%	0.251	C	S	.	.	G	3₁₀ helix	trans	-52.4	-29.3	-178.5	-33.4	38.1	0	0	0	116	N1525 E1529 L1533 H1537 G1538	N1525-P1535 HydrophobicContact CB-CB 3.81Å; N1525-P1535 HydrophobicContact CB-CG 4.2Å; E1529-P1535 HydrophobicContact CB-CG 4.42Å; L1533-P1535 WeakPolarHBondContact O-CD 3.31Å; P1535-H1537 PolarHBondContact O-N 2.91Å; P1535-G1538 PolarHBondContact O-N 2.99Å; P1535-G1538 VanDerWaalsContact O-N 3.08Å
1536	S	79.6	Confident	83.1	Confident	67 Å²	67	45.1 Å²	45.1	47%	0.469	25%	0.251	S	S	.	.	G	3₁₀ helix	trans	-59.7	-27.7	174.5	67.2	0	0	0	0	113.2	N1534 G1538 T1539	N1534-S1536 PolarHBondContact O-N 2.99Å; N1534-S1536 VanDerWaalsContact OD1-CB 3.29Å; N1534-S1536 WeakPolarHBondContact OD1-CB 3.31Å; N1534-S1536 PolarHBondContact OD1-N 3.04Å; N1534-S1536 PolarHBondContact OD1-OG 2.85Å; S1536-G1538 PolarHBondContact O-N 3.2Å; S1536-T1539 PolarHBondContact O-N 3.16Å; S1536-T1539 PolarHBondContact O-OG1 3Å
1537	H	84.7	Confident	82.1	Confident	32 Å²	32	43.9 Å²	43.9	15%	0.148	25%	0.251	C	S	.	.	G	3₁₀ helix	trans	-62	-23.2	176.5	-64.9	-176.3	0	0	0	112.6	N1534 P1535 T1539 R1540 F1545	N1534-H1537 WeakPolarHBondContact O-CB 3.45Å; N1534-H1537 VanDerWaalsContact O-CG 3.27Å; N1534-H1537 PolarHBondContact O-N 3.28Å; P1535-H1537 PolarHBondContact O-N 2.91Å; H1537-T1539 PolarHBondContact O-N 3.31Å; H1537-R1540 VanDerWaalsContact CD2-CZ 3.47Å; H1537-R1540 PolarHBondContact CD2-NH2 3.05Å; H1537-R1540 PolarHBondContact NE2-NH2 3.2Å; H1537-R1540 VanDerWaalsContact O-CB 3.29Å; H1537-R1540 WeakPolarHBondContact O-CB 3.2Å; H1537-R1540 PolarHBondContact O-N 3.12Å; H1537-F1545 HydrophobicContact CB-CE1 3.79Å; H1537-F1545 HydrophobicContact CB-CZ 3.87Å; H1537-F1545 AromaticContact ND1-CE1 3.99Å
1538	G	83.8	Confident	81.2	Confident	1 Å²	1	43 Å²	43	1%	0.01	25%	0.247	C	C	.	.	G	3₁₀ helix	trans	-56.9	-19.1	175	0	0	0	0	0	114	K1501 P1535 S1536	K1501-G1538 WeakPolarHBondContact CB-O 3.37Å; K1501-G1538 VanDerWaalsContact CG-O 3.31Å; K1501-G1538 WeakPolarHBondContact CG-O 3.45Å; K1501-G1538 PolarHBondContact N-O 3.17Å; P1535-G1538 PolarHBondContact O-N 2.99Å; P1535-G1538 VanDerWaalsContact O-N 3.08Å; S1536-G1538 PolarHBondContact O-N 3.2Å
1539	T	82.5	Confident	80.8	Confident	82 Å²	82	44.5 Å²	44.5	50%	0.503	25%	0.254	S	S	.	.	G	3₁₀ helix	trans	-80	-12.2	176.4	64.5	0	0	0	0	115.1	K1499 S1536 H1537	K1499-T1539 WeakPolarHBondContact CD-O 3.19Å; K1499-T1539 WeakPolarHBondContact CE-O 3.49Å; K1499-T1539 PolarHBondContact NZ-O 2.91Å; S1536-T1539 PolarHBondContact O-N 3.16Å; S1536-T1539 PolarHBondContact O-OG1 3Å; H1537-T1539 PolarHBondContact O-N 3.31Å
1540	R	83.5	Confident	80.6	Confident	94 Å²	94	40.8 Å²	40.8	36%	0.355	23%	0.234	S	C	.	.	S	Bend	trans	-87.2	172.6	-179.6	-60.7	-176.5	-170.9	175.8	5.5	112.8	K1499 V1500 H1537 E1544 F1545	K1499-R1540 CarbonylContact C-O 3.54Å; K1499-R1540 VanDerWaalsContact CA-O 3.28Å; K1499-R1540 WeakPolarHBondContact CA-O 3.29Å; V1500-R1540 PolarHBondContact N-O 2.97Å; H1537-R1540 VanDerWaalsContact CD2-CZ 3.47Å; H1537-R1540 PolarHBondContact CD2-NH2 3.05Å; H1537-R1540 PolarHBondContact NE2-NH2 3.2Å; H1537-R1540 VanDerWaalsContact O-CB 3.29Å; H1537-R1540 WeakPolarHBondContact O-CB 3.2Å; H1537-R1540 PolarHBondContact O-N 3.12Å; R1540-E1544 WeakPolarHBondContact CA-OE2 3.45Å; R1540-E1544 HydrophobicContact CB-CB 4.24Å; R1540-E1544 WeakPolarHBondContact CB-OE2 3.3Å; R1540-F1545 HydrophobicContact CB-CE2 3.54Å; R1540-F1545 HydrophobicContact CB-CZ 3.72Å; R1540-F1545 HydrophobicContact CG-CZ 4.36Å
1541	Y	79.3	Confident	80.5	Confident	49 Å²	49	38.4 Å²	38.4	19%	0.192	22%	0.22	C	C	.	.			trans	-108.5	155.7	176.1	-62.6	-90.8	0	0	0	111.9	N869 M1498 K1499 H1543 E1544 F1545	N869-Y1541 WeakPolarHBondContact ND2-CD2 3.42Å; N869-Y1541 WeakPolarHBondContact ND2-CE2 3.01Å; N869-Y1541 WeakPolarHBondContact OD1-CE2 3.36Å; M1498-Y1541 VanDerWaalsContact O-CD1 3.32Å; M1498-Y1541 WeakPolarHBondContact O-CD1 3.44Å; K1499-Y1541 HydrophobicContact CG-CD1 4.2Å; K1499-Y1541 HydrophobicContact CG-CE1 3.72Å; K1499-Y1541 HydrophobicContact CG-CE2 4.22Å; Y1541-H1543 VanDerWaalsContact C-N 3.27Å; Y1541-H1543 PolarHBondContact O-N 2.95Å; Y1541-E1544 PolarHBondContact N-OE2 2.9Å; Y1541-E1544 WeakPolarHBondContact O-CB 3.47Å; Y1541-E1544 PolarHBondContact O-N 3.31Å; Y1541-F1545 WeakPolarHBondContact O-CD2 2.96Å; Y1541-F1545 WeakPolarHBondContact O-CE2 3.32Å
1542	P	79.9	Confident	80.5	Confident	0 Å²	0	40 Å²	40	0%	0	23%	0.226	C	C	.	.	G	3₁₀ helix	trans	-52.6	-31.4	-173.2	-30.9	36	0	0	0	117.1	Y1491 L1494 M1498 I1503 E1544 R1550	Y1491-P1542 HydrophobicContact CD2-CB 4.5Å; L1494-P1542 HydrophobicContact CB-CB 3.9Å; L1494-P1542 HydrophobicContact CB-CG 3.7Å; L1494-P1542 HydrophobicContact CD1-CB 4.09Å; L1494-P1542 HydrophobicContact CD1-CG 4.32Å; M1498-P1542 WeakPolarHBondContact O-CD 3.49Å; I1503-P1542 HydrophobicContact CD1-CG 3.56Å; P1542-E1544 VanDerWaalsContact C-N 3.3Å; P1542-E1544 PolarHBondContact O-N 2.91Å; P1542-R1550 WeakPolarHBondContact O-CG 3.39Å; P1542-R1550 PolarHBondContact O-NE 3.32Å
1543	H	73.9	Confident	80.9	Confident	34 Å²	34	37.4 Å²	37.4	16%	0.157	20%	0.199	C	C	.	.	G	3₁₀ helix	trans	-75.5	-15.6	178	57.8	-89.6	0	0	0	113.6	N869 Y1491 Y1541 F1545	N869-H1543 WeakPolarHBondContact CB-NE2 3.49Å; N869-H1543 PolarHBondContact N-CE1 2.65Å; N869-H1543 PolarHBondContact N-NE2 3.21Å; Y1491-H1543 HydrophobicContact CE2-CB 3.97Å; Y1541-H1543 VanDerWaalsContact C-N 3.27Å; Y1541-H1543 PolarHBondContact O-N 2.95Å; H1543-F1545 PolarHBondContact O-N 2.98Å; H1543-F1545 VanDerWaalsContact O-N 3.16Å
1544	E	70.2	Confident	81.1	Confident	73 Å²	73	37 Å²	37	34%	0.341	20%	0.197	S	C	.	.	G	3₁₀ helix	trans	-83.6	27.1	176.8	-56.4	172.2	151	0	0	111.9	N869 R1540 Y1541 P1542	N869-E1544 PolarHBondContact ND2-OE1 3.23Å; R1540-E1544 WeakPolarHBondContact CA-OE2 3.45Å; R1540-E1544 HydrophobicContact CB-CB 4.24Å; R1540-E1544 WeakPolarHBondContact CB-OE2 3.3Å; Y1541-E1544 PolarHBondContact N-OE2 2.9Å; Y1541-E1544 WeakPolarHBondContact O-CB 3.47Å; Y1541-E1544 PolarHBondContact O-N 3.31Å; P1542-E1544 VanDerWaalsContact C-N 3.3Å; P1542-E1544 PolarHBondContact O-N 2.91Å
1545	F	74.9	Confident	81.5	Confident	11 Å²	11	32.8 Å²	32.8	5%	0.048	18%	0.175	C	C	.	.	S	Bend	trans	-145.6	151.6	-175.6	-65.1	-88	0	0	0	111	V1500 H1537 R1540 Y1541 H1543 Q1549 R1550 I1553	V1500-F1545 HydrophobicContact CB-CE2 4.47Å; V1500-F1545 HydrophobicContact CB-CZ 4.49Å; V1500-F1545 HydrophobicContact CG2-CD2 4.23Å; V1500-F1545 HydrophobicContact CG2-CE2 3.4Å; V1500-F1545 VanDerWaalsContact CG2-CE2 3.4Å; V1500-F1545 HydrophobicContact CG2-CZ 3.8Å; H1537-F1545 HydrophobicContact CB-CE1 3.79Å; H1537-F1545 HydrophobicContact CB-CZ 3.87Å; H1537-F1545 AromaticContact ND1-CE1 3.99Å; R1540-F1545 HydrophobicContact CB-CE2 3.54Å; R1540-F1545 HydrophobicContact CB-CZ 3.72Å; R1540-F1545 HydrophobicContact CG-CZ 4.36Å; Y1541-F1545 WeakPolarHBondContact O-CD2 2.96Å; Y1541-F1545 WeakPolarHBondContact O-CE2 3.32Å; H1543-F1545 PolarHBondContact O-N 2.98Å; H1543-F1545 VanDerWaalsContact O-N 3.16Å; F1545-Q1549 HydrophobicContact CB-CB 3.86Å; F1545-Q1549 HydrophobicContact CD1-CB 3.86Å; F1545-Q1549 HydrophobicContact CG-CB 4.31Å; F1545-R1550 HydrophobicContact CB-CG 3.97Å; F1545-R1550 VanDerWaalsContact O-CZ 3.31Å; F1545-R1550 PolarHBondContact O-NE 2.9Å; F1545-R1550 PolarHBondContact O-NH2 3.17Å; F1545-I1553 HydrophobicContact CD1-CD1 3.97Å; F1545-I1553 HydrophobicContact CD2-CD1 3.85Å; F1545-I1553 HydrophobicContact CE1-CD1 3.98Å; F1545-I1553 HydrophobicContact CE2-CD1 3.91Å; F1545-I1553 HydrophobicContact CG-CD1 3.87Å; F1545-I1553 HydrophobicContact CZ-CD1 3.95Å
1546	S	71.8	Confident	81.8	Confident	50 Å²	50	31.1 Å²	31.1	35%	0.35	16%	0.163	S	C	.	.			trans	-73.4	166.7	170.1	67.6	0	0	0	0	112.4	G1548 Q1549 R1550	S1546-G1548 PolarHBondContact O-N 2.86Å; S1546-Q1549 PolarHBondContact O-N 2.68Å; S1546-Q1549 VanDerWaalsContact O-N 3.09Å; S1546-Q1549 WeakPolarHBondContact OG-CG 3.3Å; S1546-R1550 WeakPolarHBondContact O-CG 3.41Å; S1546-R1550 PolarHBondContact O-N 2.98Å
1547	G	70.5	Confident	82.4	Confident	28 Å²	28	28.1 Å²	28.1	29%	0.289	14%	0.142	S	C	.	.	H	α-helix	trans	-51.1	-51.6	179.3	0	0	0	0	0	113.2	Q1549 R1550 Q1551	G1547-Q1549 VanDerWaalsContact C-N 3.32Å; G1547-Q1549 PolarHBondContact O-N 2.76Å; G1547-R1550 WeakPolarHBondContact O-CB 3.36Å; G1547-R1550 PolarHBondContact O-N 3.15Å; G1547-R1550 VanDerWaalsContact O-N 3.12Å; G1547-Q1551 PolarHBondContact O-N 3.35Å
1548	G	73.3	Confident	82.7	Confident	4 Å²	4	26.6 Å²	26.6	4%	0.041	14%	0.135	C	C	.	.	H	α-helix	trans	-62.3	-35	177.7	0	0	0	0	0	114.4	S1546 Q1551 R1552	S1546-G1548 PolarHBondContact O-N 2.86Å; G1548-Q1551 PolarHBondContact O-N 3.4Å; G1548-R1552 WeakPolarHBondContact O-CG 3.31Å; G1548-R1552 PolarHBondContact O-N 3.11Å
1549	Q	82.5	Confident	83.1	Confident	32 Å²	32	26.9 Å²	26.9	15%	0.15	14%	0.136	C	C	.	.	H	α-helix	trans	-71.2	-36.1	175.4	-69.4	173	-2.4	0	0	111.6	S1374 L1533 F1545 S1546 G1547 Q1551 R1552 I1553	S1374-Q1549 PolarHBondContact OG-NE2 2.83Å; L1533-Q1549 HydrophobicContact CD2-CB 4.21Å; L1533-Q1549 HydrophobicContact CD2-CG 4.03Å; F1545-Q1549 HydrophobicContact CB-CB 3.86Å; F1545-Q1549 HydrophobicContact CD1-CB 3.86Å; F1545-Q1549 HydrophobicContact CG-CB 4.31Å; S1546-Q1549 PolarHBondContact O-N 2.68Å; S1546-Q1549 VanDerWaalsContact O-N 3.09Å; S1546-Q1549 WeakPolarHBondContact OG-CG 3.3Å; G1547-Q1549 VanDerWaalsContact C-N 3.32Å; G1547-Q1549 PolarHBondContact O-N 2.76Å; Q1549-Q1551 VanDerWaalsContact C-N 3.34Å; Q1549-R1552 PolarHBondContact O-N 2.8Å; Q1549-I1553 WeakPolarHBondContact O-CD1 3.33Å; Q1549-I1553 VanDerWaalsContact O-CG1 3.3Å; Q1549-I1553 WeakPolarHBondContact O-CG1 2.89Å; Q1549-I1553 PolarHBondContact O-N 3.33Å
1550	R	85.8	Confident	83.6	Confident	55 Å²	55	23.2 Å²	23.2	21%	0.208	11%	0.114	C	C	.	.	H	α-helix	trans	-64.1	-39.2	170.2	-63.9	171.6	-163.2	169.1	10.6	111.2	P1490 L1494 P1542 F1545 S1546 G1547 I1553 G1554	P1490-R1550 HydrophobicContact CB-CB 3.63Å; L1494-R1550 HydrophobicContact CD1-CB 4.15Å; P1542-R1550 WeakPolarHBondContact O-CG 3.39Å; P1542-R1550 PolarHBondContact O-NE 3.32Å; F1545-R1550 HydrophobicContact CB-CG 3.97Å; F1545-R1550 VanDerWaalsContact O-CZ 3.31Å; F1545-R1550 PolarHBondContact O-NE 2.9Å; F1545-R1550 PolarHBondContact O-NH2 3.17Å; S1546-R1550 WeakPolarHBondContact O-CG 3.41Å; S1546-R1550 PolarHBondContact O-N 2.98Å; G1547-R1550 WeakPolarHBondContact O-CB 3.36Å; G1547-R1550 PolarHBondContact O-N 3.15Å; G1547-R1550 VanDerWaalsContact O-N 3.12Å; R1550-I1553 CarbonylContact O-C 3.52Å; R1550-I1553 WeakPolarHBondContact O-CA 3.43Å; R1550-I1553 WeakPolarHBondContact O-CB 3.26Å; R1550-I1553 PolarHBondContact O-N 3.42Å; R1550-I1553 VanDerWaalsContact O-N 3.08Å; R1550-G1554 PolarHBondContact O-N 2.72Å
1551	Q	86	Confident	83.9	Confident	2 Å²	2	18.7 Å²	18.7	1%	0.009	10%	0.097	C	C	.	.	H	α-helix	trans	-64	-43	175.8	-164.7	65	-9.4	0	0	112.3	P1490 G1547 G1548 Q1549 I1553 G1554 I1555 P1571 L1575 V1583	P1490-Q1551 HydrophobicContact CB-CB 4.21Å; P1490-Q1551 HydrophobicContact CG-CB 4.36Å; G1547-Q1551 PolarHBondContact O-N 3.35Å; G1548-Q1551 PolarHBondContact O-N 3.4Å; Q1549-Q1551 VanDerWaalsContact C-N 3.34Å; Q1551-I1553 VanDerWaalsContact C-N 3.27Å; Q1551-I1553 PolarHBondContact O-N 2.86Å; Q1551-G1554 WeakPolarHBondContact O-CA 3.42Å; Q1551-G1554 PolarHBondContact O-N 2.91Å; Q1551-G1554 VanDerWaalsContact O-N 3.08Å; Q1551-I1555 HydrophobicContact CG-CD1 4.48Å; Q1551-I1555 WeakPolarHBondContact O-CG1 3.41Å; Q1551-I1555 PolarHBondContact O-N 3.29Å; Q1551-P1571 VanDerWaalsContact NE2-C 3.3Å; Q1551-P1571 PolarHBondContact NE2-O 2.96Å; Q1551-L1575 HydrophobicContact CB-CD1 4.11Å; Q1551-L1575 HydrophobicContact CG-CD1 4.05Å; Q1551-V1583 HydrophobicContact CB-CG2 4.39Å; Q1551-V1583 HydrophobicContact CG-CG1 4.22Å; Q1551-V1583 HydrophobicContact CG-CG2 4.16Å
1552	R	89.9	Confident	84.4	Confident	35 Å²	35	24 Å²	24	13%	0.132	12%	0.117	C	C	.	.	H	α-helix	trans	-56.1	-39	169.6	-71.1	168.1	-179.3	-79.6	2.7	112.2	V1531 L1533 G1548 Q1549 I1555 A1556 L1586	V1531-R1552 HydrophobicContact CB-CB 4.1Å; V1531-R1552 HydrophobicContact CG2-CB 4.06Å; V1531-R1552 WeakPolarHBondContact CG2-O 3.28Å; V1531-R1552 VanDerWaalsContact O-CD 3.29Å; V1531-R1552 WeakPolarHBondContact O-CD 3.21Å; V1531-R1552 WeakPolarHBondContact O-CG 3.23Å; V1531-R1552 PolarHBondContact O-NH1 2.83Å; L1533-R1552 HydrophobicContact CD1-CB 3.92Å; L1533-R1552 HydrophobicContact CG-CB 4.21Å; G1548-R1552 WeakPolarHBondContact O-CG 3.31Å; G1548-R1552 PolarHBondContact O-N 3.11Å; Q1549-R1552 PolarHBondContact O-N 2.8Å; R1552-I1555 PolarHBondContact O-N 2.81Å; R1552-A1556 WeakPolarHBondContact O-CB 3.34Å; R1552-A1556 PolarHBondContact O-N 3Å; R1552-L1586 HydrophobicContact CG-CD2 3.99Å
1553	I	91.5	Very high	85	Confident	0 Å²	0	24.5 Å²	24.5	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-67.7	-39.2	174.3	-64.6	157	0	0	0	112	L1494 V1500 I1504 L1533 F1545 Q1549 R1550 Q1551 A1556 R1557	L1494-I1553 HydrophobicContact CD1-CB 3.96Å; L1494-I1553 HydrophobicContact CD1-CG2 3.73Å; L1494-I1553 HydrophobicContact CD2-CG2 3.84Å; L1494-I1553 HydrophobicContact CG-CG2 4.49Å; V1500-I1553 HydrophobicContact CB-CD1 4.46Å; V1500-I1553 HydrophobicContact CG1-CD1 3.99Å; V1500-I1553 HydrophobicContact CG1-CG1 3.81Å; V1500-I1553 HydrophobicContact CG1-CG2 3.89Å; V1500-I1553 HydrophobicContact CG2-CD1 3.58Å; V1500-I1553 HydrophobicContact CG2-CG1 4.3Å; V1500-I1553 HydrophobicContact CG2-CG2 4.32Å; I1504-I1553 HydrophobicContact CD1-CG2 4.44Å; I1504-I1553 HydrophobicContact CG1-CG2 4.34Å; L1533-I1553 HydrophobicContact CD1-CD1 4.35Å; L1533-I1553 HydrophobicContact CD1-CG1 3.62Å; F1545-I1553 HydrophobicContact CD1-CD1 3.97Å; F1545-I1553 HydrophobicContact CD2-CD1 3.85Å; F1545-I1553 HydrophobicContact CE1-CD1 3.98Å; F1545-I1553 HydrophobicContact CE2-CD1 3.91Å; F1545-I1553 HydrophobicContact CG-CD1 3.87Å; F1545-I1553 HydrophobicContact CZ-CD1 3.95Å; Q1549-I1553 WeakPolarHBondContact O-CD1 3.33Å; Q1549-I1553 VanDerWaalsContact O-CG1 3.3Å; Q1549-I1553 WeakPolarHBondContact O-CG1 2.89Å; Q1549-I1553 PolarHBondContact O-N 3.33Å; R1550-I1553 CarbonylContact O-C 3.52Å; R1550-I1553 WeakPolarHBondContact O-CA 3.43Å; R1550-I1553 WeakPolarHBondContact O-CB 3.26Å; R1550-I1553 PolarHBondContact O-N 3.42Å; R1550-I1553 VanDerWaalsContact O-N 3.08Å; Q1551-I1553 VanDerWaalsContact C-N 3.27Å; Q1551-I1553 PolarHBondContact O-N 2.86Å; I1553-A1556 PolarHBondContact O-N 2.87Å; I1553-R1557 PolarHBondContact O-N 3.32Å
1554	G	90.3	Very high	85.7	Confident	2 Å²	2	28.1 Å²	28.1	2%	0.021	13%	0.132	C	C	.	.	H	α-helix	trans	-59.7	-45.9	173.2	0	0	0	0	0	112.3	R1550 Q1551 R1557 A1558	R1550-G1554 PolarHBondContact O-N 2.72Å; Q1551-G1554 WeakPolarHBondContact O-CA 3.42Å; Q1551-G1554 PolarHBondContact O-N 2.91Å; Q1551-G1554 VanDerWaalsContact O-N 3.08Å; G1554-R1557 PolarHBondContact O-N 2.88Å; G1554-A1558 PolarHBondContact O-N 3.03Å
1555	I	91.8	Very high	86.7	Confident	2 Å²	2	26.2 Å²	26.2	1%	0.01	12%	0.123	C	C	.	.	H	α-helix	trans	-59.1	-50.7	173.3	-66.1	164	0	0	0	110.5	I1486 V1531 Q1551 R1552 R1557 A1558 L1559 V1583 L1586 L1587 L1590	I1486-I1555 HydrophobicContact CD1-CB 4.47Å; I1486-I1555 HydrophobicContact CD1-CG1 3.73Å; I1486-I1555 HydrophobicContact CG1-CG1 4.38Å; V1531-I1555 HydrophobicContact CG1-CB 4.37Å; V1531-I1555 HydrophobicContact CG1-CG2 3.94Å; Q1551-I1555 HydrophobicContact CG-CD1 4.48Å; Q1551-I1555 WeakPolarHBondContact O-CG1 3.41Å; Q1551-I1555 PolarHBondContact O-N 3.29Å; R1552-I1555 PolarHBondContact O-N 2.81Å; I1555-R1557 VanDerWaalsContact C-N 3.26Å; I1555-R1557 PolarHBondContact O-N 2.85Å; I1555-A1558 PolarHBondContact O-N 3.41Å; I1555-L1559 HydrophobicContact CG2-CD1 3.92Å; I1555-L1559 HydrophobicContact CG2-CG 4.34Å; I1555-L1559 WeakPolarHBondContact O-CG 3.25Å; I1555-L1559 PolarHBondContact O-N 3.2Å; I1555-V1583 HydrophobicContact CD1-CG1 4.19Å; I1555-L1586 HydrophobicContact CD1-CD2 3.9Å; I1555-L1586 HydrophobicContact CG2-CD2 4.48Å; I1555-L1587 HydrophobicContact CD1-CD2 4.11Å; I1555-L1587 HydrophobicContact CD1-CG 4.35Å; I1555-L1587 HydrophobicContact CG1-CD2 4.22Å; I1555-L1587 HydrophobicContact CG2-CD2 4.45Å; I1555-L1590 HydrophobicContact CG2-CD1 3.48Å; I1555-L1590 VanDerWaalsContact CG2-CD1 3.48Å
1556	A	92.4	Very high	87.5	Confident	0 Å²	0	25.8 Å²	25.8	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-58.4	-36.1	178	0	0	0	0	0	113	I1504 V1531 R1552 I1553 A1560	I1504-A1556 HydrophobicContact CD1-CB 3.73Å; I1504-A1556 HydrophobicContact CG1-CB 3.98Å; I1504-A1556 HydrophobicContact CG2-CB 4.43Å; V1531-A1556 HydrophobicContact CG1-CB 3.84Å; V1531-A1556 HydrophobicContact CG2-CB 3.94Å; R1552-A1556 WeakPolarHBondContact O-CB 3.34Å; R1552-A1556 PolarHBondContact O-N 3Å; I1553-A1556 PolarHBondContact O-N 2.87Å; A1556-A1560 PolarHBondContact O-N 2.99Å; A1556-A1560 VanDerWaalsContact O-N 3.11Å
1557	R	92.3	Very high	88.4	Confident	4 Å²	4	23.4 Å²	23.4	2%	0.015	10%	0.104	C	C	.	.	H	α-helix	trans	-67.8	-39.6	174.8	-167	-160.2	71.2	-141	-4.6	112.2	A1072 L1076 M1485 S1493 I1503 I1553 G1554 I1555 A1560	A1072-R1557 VanDerWaalsContact CB-CZ 3.42Å; L1076-R1557 HydrophobicContact CD1-CG 4.18Å; M1485-R1557 PolarHBondContact O-NH2 2.81Å; S1493-R1557 PolarHBondContact O-NH1 2.88Å; I1503-R1557 HydrophobicContact CG2-CG 4.12Å; I1553-R1557 PolarHBondContact O-N 3.32Å; G1554-R1557 PolarHBondContact O-N 2.88Å; I1555-R1557 VanDerWaalsContact C-N 3.26Å; I1555-R1557 PolarHBondContact O-N 2.85Å; R1557-A1560 WeakPolarHBondContact O-CB 3.44Å; R1557-A1560 PolarHBondContact O-N 3.2Å
1558	A	91.3	Very high	89.2	Confident	0 Å²	0	22 Å²	22	0%	0	9%	0.091	C	C	.	.	H	α-helix	trans	-65.9	-42.6	175.2	0	0	0	0	0	111.5	Q1484 I1486 G1554 I1555 A1560 P1563 I1566	Q1484-A1558 HydrophobicContact CB-CB 4.15Å; I1486-A1558 HydrophobicContact CG1-CB 3.99Å; G1554-A1558 PolarHBondContact O-N 3.03Å; I1555-A1558 PolarHBondContact O-N 3.41Å; A1558-A1560 VanDerWaalsContact C-N 3.26Å; A1558-A1560 PolarHBondContact O-N 2.92Å; A1558-P1563 WeakPolarHBondContact O-CD 3.42Å; A1558-P1563 WeakPolarHBondContact O-CG 3.45Å; A1558-I1566 HydrophobicContact CB-CD1 4.3Å
1559	L	92.5	Very high	89.8	Confident	7 Å²	7	21.9 Å²	21.9	4%	0.037	9%	0.089	C	C	.	.	H	α-helix	trans	-65.1	-25.8	176.6	-66.5	172.5	0	0	0	113.7	L1527 V1531 I1555 V1561 R1562 I1566 L1590 L1596	L1527-L1559 HydrophobicContact CD2-CB 3.73Å; V1531-L1559 HydrophobicContact CG1-CD1 4.22Å; I1555-L1559 HydrophobicContact CG2-CD1 3.92Å; I1555-L1559 HydrophobicContact CG2-CG 4.34Å; I1555-L1559 WeakPolarHBondContact O-CG 3.25Å; I1555-L1559 PolarHBondContact O-N 3.2Å; L1559-V1561 PolarHBondContact O-N 2.73Å; L1559-R1562 WeakPolarHBondContact O-CA 3.31Å; L1559-R1562 PolarHBondContact O-N 3.21Å; L1559-I1566 HydrophobicContact CD2-CD1 4.21Å; L1559-L1590 HydrophobicContact CD1-CD1 3.82Å; L1559-L1590 HydrophobicContact CD1-CD2 3.48Å; L1559-L1590 VanDerWaalsContact CD1-CD2 3.48Å; L1559-L1590 HydrophobicContact CD1-CG 4.29Å; L1559-L1590 HydrophobicContact CD2-CD2 4.18Å; L1559-L1590 HydrophobicContact CG-CD2 4.48Å; L1559-L1596 HydrophobicContact CD2-CD1 3.92Å
1560	A	91.7	Very high	89.7	Confident	5 Å²	5	20.8 Å²	20.8	4%	0.041	8%	0.084	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.4	-21.7	-171.4	0	0	0	0	0	115.7	I1504 I1508 L1527 A1556 R1557 A1558	I1504-A1560 HydrophobicContact CG2-CB 4.29Å; I1504-A1560 WeakPolarHBondContact O-CB 3.12Å; I1508-A1560 HydrophobicContact CG1-CB 4.19Å; L1527-A1560 HydrophobicContact CD1-CB 3.91Å; A1556-A1560 PolarHBondContact O-N 2.99Å; A1556-A1560 VanDerWaalsContact O-N 3.11Å; R1557-A1560 WeakPolarHBondContact O-CB 3.44Å; R1557-A1560 PolarHBondContact O-N 3.2Å; A1558-A1560 VanDerWaalsContact C-N 3.26Å; A1558-A1560 PolarHBondContact O-N 2.92Å
1561	V	91.1	Very high	89.4	Confident	0 Å²	0	18.2 Å²	18.2	0%	0	7%	0.074	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91	-9.3	176.5	-60.7	0	0	0	0	114.3	L1076 R1481 Q1484 N1511 L1559 P1563	L1076-V1561 HydrophobicContact CD2-CG1 3.69Å; R1481-V1561 HydrophobicContact CG-CB 4.06Å; R1481-V1561 PolarHBondContact NE-O 2.87Å; R1481-V1561 WeakPolarHBondContact O-CG2 3.49Å; Q1484-V1561 HydrophobicContact CG-CG2 3.46Å; Q1484-V1561 VanDerWaalsContact CG-CG2 3.46Å; N1511-V1561 WeakPolarHBondContact ND2-CG1 3.4Å; L1559-V1561 PolarHBondContact O-N 2.73Å; V1561-P1563 HydrophobicContact CG2-CB 4.25Å; V1561-P1563 HydrophobicContact CG2-CG 4.42Å
1562	R	89.9	Confident	88.9	Confident	159 Å²	159	18.3 Å²	18.3	60%	0.6	8%	0.075	S	C	*	.			trans	57.5	66	-165.2	-56.7	-178.7	-172.6	149.4	4.3	112.2	L1559	L1559-R1562 WeakPolarHBondContact O-CA 3.31Å; L1559-R1562 PolarHBondContact O-N 3.21Å
1563	P	91.2	Very high	87.9	Confident	11 Å²	11	17.8 Å²	17.8	7%	0.071	8%	0.076	C	C	.	.			trans	-70.2	165.7	178.6	33.6	-36.8	0	0	0	111.7	R1481 Q1484 A1558 V1561 I1566 L1596	R1481-P1563 WeakPolarHBondContact O-CA 3.24Å; Q1484-P1563 HydrophobicContact CB-CB 4.12Å; Q1484-P1563 HydrophobicContact CB-CG 4.28Å; Q1484-P1563 HydrophobicContact CG-CB 4.14Å; Q1484-P1563 HydrophobicContact CG-CG 4.39Å; A1558-P1563 WeakPolarHBondContact O-CD 3.42Å; A1558-P1563 WeakPolarHBondContact O-CG 3.45Å; V1561-P1563 HydrophobicContact CG2-CB 4.25Å; V1561-P1563 HydrophobicContact CG2-CG 4.42Å; P1563-I1566 HydrophobicContact CB-CG1 4.25Å; P1563-I1566 HydrophobicContact CG-CD1 3.76Å; P1563-I1566 HydrophobicContact CG-CG1 3.74Å; P1563-L1596 HydrophobicContact CG-CD2 4.38Å; P1563-L1596 WeakPolarHBondContact O-CD2 3.49Å
1564	R	89.6	Confident	86.5	Confident	111 Å²	111	21.2 Å²	21.2	42%	0.419	11%	0.105	S	C	.	.	S	Bend	trans	-101.3	-29.6	168.9	-68.9	164.3	59.7	-166.5	3.5	111.8	D1463 D1482 T1597	D1463-R1564 IonicContact OD1-NH2 3.58Å; D1463-R1564 IonicContact OD2-CZ 2.65Å; D1463-R1564 VanDerWaalsContact OD2-CZ 3.22Å; D1463-R1564 IonicContact OD2-NH1 3.9Å; D1463-R1564 PolarHBondContact OD2-NH1 3.12Å; D1463-R1564 IonicContact OD2-NH2 2.75Å; D1463-R1564 PolarHBondContact OD2-NH2 3.33Å; D1482-R1564 PolarHBondContact O-N 2.79Å; D1482-R1564 IonicContact OD2-NH1 3.89Å; D1482-R1564 PolarHBondContact OD2-NH1 3.26Å; R1564-T1597 PolarHBondContact O-N 3.32Å
1565	F	91	Very high	85.5	Confident	32 Å²	32	21.4 Å²	21.4	14%	0.14	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	131.9	-176	174.7	-135.1	0	0	0	109.8	I1449 F1462 D1482 V1483 Q1484 I1567 T1597 L1599	I1449-F1565 HydrophobicContact CG2-CE1 4.05Å; F1462-F1565 HydrophobicContact CE2-CB 4.06Å; F1462-F1565 HydrophobicContact CE2-CD1 4.2Å; D1482-F1565 PolarHBondContact O-N 3.19Å; V1483-F1565 WeakPolarHBondContact CA-O 3.39Å; V1483-F1565 HydrophobicContact CB-CD1 4.31Å; V1483-F1565 HydrophobicContact CG1-CD1 3.61Å; V1483-F1565 HydrophobicContact CG1-CE1 4.12Å; V1483-F1565 HydrophobicContact CG1-CG 4.48Å; V1483-F1565 HydrophobicContact CG2-CB 4.31Å; V1483-F1565 HydrophobicContact CG2-CD1 3.87Å; Q1484-F1565 PolarHBondContact N-O 3.1Å; F1565-I1567 HydrophobicContact CE1-CD1 4.44Å; F1565-I1567 HydrophobicContact CE1-CG1 4.06Å; F1565-I1567 HydrophobicContact CZ-CG1 4Å; F1565-T1597 WeakPolarHBondContact CA-O 3.4Å; F1565-T1597 HydrophobicContact CD2-CG2 3.81Å; F1565-T1597 WeakPolarHBondContact CD2-O 3.46Å; F1565-T1597 HydrophobicContact CE2-CG2 4.24Å; F1565-L1599 HydrophobicContact CE2-CB 3.69Å; F1565-L1599 HydrophobicContact CZ-CB 3.73Å; F1565-L1599 HydrophobicContact CZ-CD2 4.43Å
1566	I	91.6	Very high	84.3	Confident	2 Å²	2	25.7 Å²	25.7	1%	0.01	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	129.3	176	-55.1	-179	0	0	0	109.4	Q1484 I1486 A1558 L1559 P1563 L1596 T1597 Y1598 L1599	Q1484-I1566 HydrophobicContact CB-CG1 4.41Å; Q1484-I1566 WeakPolarHBondContact O-CA 3.22Å; I1486-I1566 HydrophobicContact CD1-CG2 3.82Å; I1486-I1566 HydrophobicContact CG1-CG2 4.01Å; A1558-I1566 HydrophobicContact CB-CD1 4.3Å; L1559-I1566 HydrophobicContact CD2-CD1 4.21Å; P1563-I1566 HydrophobicContact CB-CG1 4.25Å; P1563-I1566 HydrophobicContact CG-CD1 3.76Å; P1563-I1566 HydrophobicContact CG-CG1 3.74Å; I1566-L1596 HydrophobicContact CD1-CD1 4.19Å; I1566-L1596 HydrophobicContact CD1-CD2 4.46Å; I1566-T1597 PolarHBondContact N-O 3.49Å; I1566-Y1598 HydrophobicContact CB-CD1 4Å; I1566-Y1598 HydrophobicContact CB-CE1 4.13Å; I1566-Y1598 HydrophobicContact CD1-CE1 4.3Å; I1566-Y1598 HydrophobicContact CG1-CE1 4.48Å; I1566-Y1598 WeakPolarHBondContact O-CA 3.23Å; I1566-L1599 PolarHBondContact O-N 3.25Å
1567	I	89.9	Confident	83.2	Confident	0 Å²	0	26.6 Å²	26.6	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	123.7	168.8	-55.1	177.2	0	0	0	107.2	G1446 I1449 I1450 Q1484 M1485 I1486 F1565 L1599 I1601	G1446-I1567 WeakPolarHBondContact O-CD1 3.38Å; I1449-I1567 HydrophobicContact CB-CD1 3.9Å; I1449-I1567 HydrophobicContact CG2-CD1 3.87Å; I1450-I1567 HydrophobicContact CB-CD1 4.17Å; Q1484-I1567 PolarHBondContact O-N 2.98Å; M1485-I1567 CarbonylContact C-O 3.53Å; M1485-I1567 VanDerWaalsContact CA-O 3.27Å; M1485-I1567 WeakPolarHBondContact CA-O 3.4Å; M1485-I1567 HydrophobicContact CB-CB 4.47Å; M1485-I1567 HydrophobicContact CG-CB 4.28Å; M1485-I1567 HydrophobicContact CG-CG2 4.5Å; I1486-I1567 PolarHBondContact N-O 3.01Å; F1565-I1567 HydrophobicContact CE1-CD1 4.44Å; F1565-I1567 HydrophobicContact CE1-CG1 4.06Å; F1565-I1567 HydrophobicContact CZ-CG1 4Å; I1567-L1599 HydrophobicContact CG1-CB 4.42Å; I1567-L1599 HydrophobicContact CG1-CD2 4.37Å; I1567-L1599 HydrophobicContact CG2-CD2 4.21Å; I1567-L1599 HydrophobicContact CG2-CG 4.42Å; I1567-I1601 HydrophobicContact CG2-CD1 4.21Å
1568	C	87.7	Confident	82	Confident	0 Å²	0	26.7 Å²	26.7	0%	0	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	96.9	178	-50.9	0	0	0	0	108.1	E1570 P1571 L1599 F1600 I1601	C1568-E1570 PolarHBondContact O-N 2.87Å; C1568-P1571 HydrophobicContact CB-CB 4.23Å; C1568-P1571 HydrophobicContact CB-CG 3.81Å; C1568-L1599 PolarHBondContact N-O 3Å; C1568-F1600 HydrophobicContact CB-CD2 3.96Å; C1568-I1601 WeakPolarHBondContact O-CB 3.14Å; C1568-I1601 PolarHBondContact O-N 3.36Å
1569	D	85.1	Confident	81.2	Confident	0 Å²	0	27 Å²	27	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	100.8	-179.3	-157.9	10.3	0	0	0	108.7	S1443 R1447 M1485 I1486 F1487 Q1488	S1443-D1569 VanDerWaalsContact CA-OD1 3.27Å; S1443-D1569 WeakPolarHBondContact CA-OD1 3.43Å; S1443-D1569 WeakPolarHBondContact CB-OD1 3.45Å; S1443-D1569 WeakPolarHBondContact CB-OD2 3.29Å; S1443-D1569 PolarHBondContact OG-OD1 2.85Å; R1447-D1569 IonicContact CZ-OD2 3.28Å; R1447-D1569 IonicContact NE-OD2 2.76Å; R1447-D1569 PolarHBondContact NE-OD2 3.37Å; R1447-D1569 IonicContact NH2-OD2 2.93Å; R1447-D1569 PolarHBondContact NH2-OD2 3Å; M1485-D1569 HydrophobicContact CE-CB 3.51Å; M1485-D1569 WeakPolarHBondContact CE-OD2 3.5Å; I1486-D1569 WeakPolarHBondContact O-CB 3.41Å; I1486-D1569 PolarHBondContact O-N 3.21Å; F1487-D1569 CarbonylContact C-O 3.54Å; F1487-D1569 VanDerWaalsContact C-O 3.24Å; Q1488-D1569 WeakPolarHBondContact CA-O 3.49Å; Q1488-D1569 PolarHBondContact N-O 2.93Å
1570	E	80.9	Confident	80.4	Confident	9 Å²	9	27.7 Å²	27.7	4%	0.042	14%	0.14	C	C	.	.	S	Bend	trans	41	57.8	-177.4	-62.4	-144.7	152	0	0	115.9	Q1488 C1568 I1572 S1573 I1601 H1603	Q1488-E1570 HydrophobicContact CB-CB 4.23Å; Q1488-E1570 HydrophobicContact CG-CB 3.87Å; Q1488-E1570 PolarHBondContact NE2-OE2 3.19Å; C1568-E1570 PolarHBondContact O-N 2.87Å; E1570-I1572 PolarHBondContact O-N 3.19Å; E1570-S1573 PolarHBondContact O-OG 3.31Å; E1570-S1573 PolarHBondContact OE2-OG 3.21Å; E1570-S1573 VanDerWaalsContact OE2-OG 3.1Å; E1570-I1601 WeakPolarHBondContact CA-O 3.45Å; E1570-I1601 HydrophobicContact CG-CG2 4.01Å; E1570-I1601 PolarHBondContact N-O 3.14Å; E1570-H1603 IonicContact OE1-ND1 2.58Å; E1570-H1603 PolarHBondContact OE1-ND1 2.83Å; E1570-H1603 VanDerWaalsContact OE1-ND1 3.17Å; E1570-H1603 IonicContact OE2-ND1 2.69Å
1571	P	79	Confident	79.6	Confident	2 Å²	2	27.5 Å²	27.5	1%	0.013	14%	0.138	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.2	12	-166.5	35.6	-41.9	0	0	0	115.3	I1486 Q1551 C1568 F1600 I1601	I1486-P1571 HydrophobicContact CG2-CB 4.13Å; Q1551-P1571 VanDerWaalsContact NE2-C 3.3Å; Q1551-P1571 PolarHBondContact NE2-O 2.96Å; C1568-P1571 HydrophobicContact CB-CB 4.23Å; C1568-P1571 HydrophobicContact CB-CG 3.81Å; P1571-F1600 HydrophobicContact CG-CD2 3.96Å; P1571-F1600 HydrophobicContact CG-CE1 4.5Å; P1571-F1600 HydrophobicContact CG-CE2 3.26Å; P1571-F1600 HydrophobicContact CG-CZ 3.6Å; P1571-I1601 VanDerWaalsContact CD-O 3.32Å; P1571-I1601 WeakPolarHBondContact CD-O 3.18Å
1572	I	77	Confident	79	Confident	3 Å²	3	28.8 Å²	28.8	2%	0.015	14%	0.144	C	C	.	.	T	Hydrogen-bonded Turn	trans	-137.7	-17	-169.6	50.1	167.7	0	0	0	114.1	E1570 A1574 L1575 Q1580 V1583 V1584 F1600 A1602 D1604 M1607	E1570-I1572 PolarHBondContact O-N 3.19Å; I1572-A1574 PolarHBondContact O-N 2.99Å; I1572-A1574 VanDerWaalsContact O-N 3.12Å; I1572-L1575 WeakPolarHBondContact O-CB 3.35Å; I1572-L1575 PolarHBondContact O-N 3.45Å; I1572-Q1580 HydrophobicContact CB-CB 4.31Å; I1572-Q1580 HydrophobicContact CB-CG 4.01Å; I1572-Q1580 HydrophobicContact CG2-CB 4.15Å; I1572-Q1580 HydrophobicContact CG2-CG 4.36Å; I1572-V1583 HydrophobicContact CG2-CG1 4.3Å; I1572-V1584 HydrophobicContact CG2-CG2 4.37Å; I1572-F1600 HydrophobicContact CD1-CE1 4.37Å; I1572-F1600 HydrophobicContact CD1-CZ 4.17Å; I1572-F1600 HydrophobicContact CG1-CZ 4.42Å; I1572-A1602 HydrophobicContact CD1-CB 4.19Å; I1572-D1604 HydrophobicContact CD1-CB 3.9Å; I1572-M1607 HydrophobicContact CD1-CB 3.6Å; I1572-M1607 HydrophobicContact CD1-CG 3.75Å
1573	S	67.8	Low	78.7	Confident	24 Å²	24	21.2 Å²	21.2	17%	0.168	12%	0.115	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.6	-13.4	-164.6	52.2	0	0	0	0	115.7	E1570 H1603	E1570-S1573 PolarHBondContact O-OG 3.31Å; E1570-S1573 PolarHBondContact OE2-OG 3.21Å; E1570-S1573 VanDerWaalsContact OE2-OG 3.1Å; S1573-H1603 VanDerWaalsContact CB-CE1 3.47Å; S1573-H1603 WeakPolarHBondContact CB-CE1 3.39Å
1574	A	62.5	Low	78.3	Confident	72 Å²	72	20.7 Å²	20.7	60%	0.595	11%	0.112	S	C	*	.	T	Hydrogen-bonded Turn	trans	-112.7	27.2	176.8	0	0	0	0	0	113.1	I1572	I1572-A1574 PolarHBondContact O-N 2.99Å; I1572-A1574 VanDerWaalsContact O-N 3.12Å
1575	L	68.7	Low	78	Confident	7 Å²	7	16.4 Å²	16.4	4%	0.037	10%	0.097	C	C	.	.	S	Bend	trans	-129.7	142.9	-173.3	-55.4	178.3	0	0	0	111.8	Q1551 I1572 I1579 Q1580 V1583	Q1551-L1575 HydrophobicContact CB-CD1 4.11Å; Q1551-L1575 HydrophobicContact CG-CD1 4.05Å; I1572-L1575 WeakPolarHBondContact O-CB 3.35Å; I1572-L1575 PolarHBondContact O-N 3.45Å; L1575-I1579 HydrophobicContact CB-CB 4.27Å; L1575-I1579 HydrophobicContact CB-CG2 3.97Å; L1575-I1579 HydrophobicContact CD1-CG2 4.1Å; L1575-I1579 HydrophobicContact CD2-CG2 4.16Å; L1575-I1579 HydrophobicContact CG-CG2 4.31Å; L1575-Q1580 HydrophobicContact CB-CG 4.01Å; L1575-Q1580 WeakPolarHBondContact O-CG 3.16Å; L1575-Q1580 PolarHBondContact O-NE2 2.83Å; L1575-V1583 HydrophobicContact CD1-CG2 4Å
1576	D	67.9	Low	77.8	Confident	91 Å²	91	15.7 Å²	15.7	49%	0.487	10%	0.095	S	C	.	.			trans	-58.2	148.9	173.8	-35.5	-81	0	0	0	111.1	S1578 I1579 Q1580	D1576-S1578 VanDerWaalsContact C-N 3.31Å; D1576-S1578 PolarHBondContact O-N 3.13Å; D1576-S1578 VanDerWaalsContact O-N 3.15Å; D1576-I1579 HydrophobicContact CB-CB 4.45Å; D1576-I1579 HydrophobicContact CB-CG1 4.14Å; D1576-I1579 CarbonylContact O-C 3.51Å; D1576-I1579 VanDerWaalsContact O-CA 3.3Å; D1576-I1579 WeakPolarHBondContact O-CA 3.37Å; D1576-I1579 VanDerWaalsContact O-CB 3.3Å; D1576-I1579 WeakPolarHBondContact O-CB 3.33Å; D1576-I1579 PolarHBondContact O-N 3.35Å; D1576-I1579 WeakPolarHBondContact OD2-CG1 3.48Å; D1576-Q1580 PolarHBondContact O-N 3.47Å
1577	V	67.9	Low	77.6	Confident	20 Å²	20	15.7 Å²	15.7	12%	0.121	10%	0.095	C	C	.	.	H	α-helix	trans	-49.2	-47.1	-178.1	-175.4	0	0	0	0	113.1	S1357 M1358 I1579 Q1580 A1581	S1357-V1577 WeakPolarHBondContact O-CG1 3.45Å; M1358-V1577 HydrophobicContact CG-CG1 4.24Å; V1577-I1579 PolarHBondContact O-N 3.07Å; V1577-Q1580 WeakPolarHBondContact O-CB 3.38Å; V1577-Q1580 PolarHBondContact O-N 2.95Å; V1577-Q1580 VanDerWaalsContact O-N 3.17Å; V1577-A1581 PolarHBondContact O-N 3Å; V1577-A1581 VanDerWaalsContact O-N 3.09Å
1578	S	68.3	Low	77.5	Confident	5 Å²	5	16 Å²	16	4%	0.035	10%	0.096	C	C	.	.	H	α-helix	trans	-63.7	-21.9	176.9	72.3	0	0	0	0	114.5	S1357 D1576 Q1582	S1357-S1578 WeakPolarHBondContact OG-CB 3.37Å; D1576-S1578 VanDerWaalsContact C-N 3.31Å; D1576-S1578 PolarHBondContact O-N 3.13Å; D1576-S1578 VanDerWaalsContact O-N 3.15Å; S1578-Q1582 WeakPolarHBondContact O-CG 3.35Å; S1578-Q1582 PolarHBondContact O-N 3.24Å
1579	I	74.1	Confident	77.5	Confident	7 Å²	7	19 Å²	19	4%	0.036	11%	0.112	C	C	.	.	H	α-helix	trans	-88.8	-34.8	175.8	-59.1	-59.3	0	0	0	111	L1575 D1576 V1577 Q1582 V1583	L1575-I1579 HydrophobicContact CB-CB 4.27Å; L1575-I1579 HydrophobicContact CB-CG2 3.97Å; L1575-I1579 HydrophobicContact CD1-CG2 4.1Å; L1575-I1579 HydrophobicContact CD2-CG2 4.16Å; L1575-I1579 HydrophobicContact CG-CG2 4.31Å; D1576-I1579 HydrophobicContact CB-CB 4.45Å; D1576-I1579 HydrophobicContact CB-CG1 4.14Å; D1576-I1579 CarbonylContact O-C 3.51Å; D1576-I1579 VanDerWaalsContact O-CA 3.3Å; D1576-I1579 WeakPolarHBondContact O-CA 3.37Å; D1576-I1579 VanDerWaalsContact O-CB 3.3Å; D1576-I1579 WeakPolarHBondContact O-CB 3.33Å; D1576-I1579 PolarHBondContact O-N 3.35Å; D1576-I1579 WeakPolarHBondContact OD2-CG1 3.48Å; V1577-I1579 PolarHBondContact O-N 3.07Å; I1579-Q1582 WeakPolarHBondContact O-CB 3.37Å; I1579-Q1582 PolarHBondContact O-N 3.1Å; I1579-V1583 WeakPolarHBondContact O-CG2 3.27Å; I1579-V1583 PolarHBondContact O-N 3.33Å
1580	Q	76.3	Confident	77.6	Confident	22 Å²	22	19.1 Å²	19.1	10%	0.103	11%	0.113	C	C	.	.	H	α-helix	trans	-58.2	-50.5	171.4	-59.8	179.8	9	0	0	110.6	I1572 L1575 D1576 V1577 Q1582 V1583 V1584 M1607	I1572-Q1580 HydrophobicContact CB-CB 4.31Å; I1572-Q1580 HydrophobicContact CB-CG 4.01Å; I1572-Q1580 HydrophobicContact CG2-CB 4.15Å; I1572-Q1580 HydrophobicContact CG2-CG 4.36Å; L1575-Q1580 HydrophobicContact CB-CG 4.01Å; L1575-Q1580 WeakPolarHBondContact O-CG 3.16Å; L1575-Q1580 PolarHBondContact O-NE2 2.83Å; D1576-Q1580 PolarHBondContact O-N 3.47Å; V1577-Q1580 WeakPolarHBondContact O-CB 3.38Å; V1577-Q1580 PolarHBondContact O-N 2.95Å; V1577-Q1580 VanDerWaalsContact O-N 3.17Å; Q1580-Q1582 VanDerWaalsContact C-N 3.33Å; Q1580-Q1582 PolarHBondContact O-N 2.95Å; Q1580-V1583 PolarHBondContact O-N 3.35Å; Q1580-V1584 PolarHBondContact O-N 3.04Å; Q1580-M1607 HydrophobicContact CB-SD 4.22Å
1581	A	73.7	Confident	77.8	Confident	0 Å²	0	20.8 Å²	20.8	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-57.9	-42.3	176	0	0	0	0	0	112.7	L1368 Y1369 A1370 V1577 V1583 V1584 N1585	L1368-A1581 HydrophobicContact CB-CB 3.82Å; L1368-A1581 HydrophobicContact CD1-CB 4.03Å; Y1369-A1581 WeakPolarHBondContact O-CB 3.45Å; A1370-A1581 HydrophobicContact CB-CB 3.88Å; V1577-A1581 PolarHBondContact O-N 3Å; V1577-A1581 VanDerWaalsContact O-N 3.09Å; A1581-V1583 VanDerWaalsContact C-N 3.31Å; A1581-V1583 PolarHBondContact O-N 3.45Å; A1581-V1584 PolarHBondContact O-N 3.4Å; A1581-N1585 WeakPolarHBondContact O-CB 3.24Å; A1581-N1585 VanDerWaalsContact O-CG 3.3Å; A1581-N1585 PolarHBondContact O-N 2.97Å; A1581-N1585 PolarHBondContact O-ND2 3.27Å
1582	Q	79	Confident	78.1	Confident	28 Å²	28	26.9 Å²	26.9	13%	0.131	15%	0.147	C	C	.	.	H	α-helix	trans	-60.5	-35.5	172.8	-83.5	-168.6	24.2	0	0	113.6	A1370 I1371 G1373 S1578 I1579 Q1580 L1586	A1370-Q1582 HydrophobicContact CB-CG 3.77Å; I1371-Q1582 PolarHBondContact O-NE2 2.87Å; G1373-Q1582 PolarHBondContact O-NE2 3.46Å; S1578-Q1582 WeakPolarHBondContact O-CG 3.35Å; S1578-Q1582 PolarHBondContact O-N 3.24Å; I1579-Q1582 WeakPolarHBondContact O-CB 3.37Å; I1579-Q1582 PolarHBondContact O-N 3.1Å; Q1580-Q1582 VanDerWaalsContact C-N 3.33Å; Q1580-Q1582 PolarHBondContact O-N 2.95Å; Q1582-L1586 WeakPolarHBondContact O-CB 3.24Å; Q1582-L1586 PolarHBondContact O-N 3.4Å
1583	V	83.4	Confident	78.6	Confident	0 Å²	0	33.2 Å²	33.2	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-77.8	-40.8	179.9	166.3	0	0	0	0	111.5	Q1551 I1555 I1572 L1575 I1579 Q1580 A1581 L1586 L1587	Q1551-V1583 HydrophobicContact CB-CG2 4.39Å; Q1551-V1583 HydrophobicContact CG-CG1 4.22Å; Q1551-V1583 HydrophobicContact CG-CG2 4.16Å; I1555-V1583 HydrophobicContact CD1-CG1 4.19Å; I1572-V1583 HydrophobicContact CG2-CG1 4.3Å; L1575-V1583 HydrophobicContact CD1-CG2 4Å; I1579-V1583 WeakPolarHBondContact O-CG2 3.27Å; I1579-V1583 PolarHBondContact O-N 3.33Å; Q1580-V1583 PolarHBondContact O-N 3.35Å; A1581-V1583 VanDerWaalsContact C-N 3.31Å; A1581-V1583 PolarHBondContact O-N 3.45Å; V1583-L1586 PolarHBondContact O-N 3.01Å; V1583-L1587 HydrophobicContact CG1-CD1 4.15Å; V1583-L1587 WeakPolarHBondContact O-CG 3.45Å; V1583-L1587 PolarHBondContact O-N 3.39Å
1584	V	83.9	Confident	79.5	Confident	0 Å²	0	35.9 Å²	35.9	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-62.9	-49.6	175.5	169	0	0	0	0	111	L1368 I1572 Q1580 A1581 L1586 L1587 Q1588 M1607 H1610 I1611	L1368-V1584 HydrophobicContact CD1-CB 3.98Å; L1368-V1584 HydrophobicContact CD1-CG1 3.83Å; I1572-V1584 HydrophobicContact CG2-CG2 4.37Å; Q1580-V1584 PolarHBondContact O-N 3.04Å; A1581-V1584 PolarHBondContact O-N 3.4Å; V1584-L1586 VanDerWaalsContact C-N 3.29Å; V1584-L1586 PolarHBondContact O-N 3.08Å; V1584-L1587 PolarHBondContact O-N 2.87Å; V1584-L1587 VanDerWaalsContact O-N 3.11Å; V1584-Q1588 WeakPolarHBondContact O-CG 3.49Å; V1584-Q1588 PolarHBondContact O-N 2.95Å; V1584-M1607 HydrophobicContact CB-SD 4.46Å; V1584-M1607 HydrophobicContact CG2-CB 4.38Å; V1584-M1607 HydrophobicContact CG2-SD 3.71Å; V1584-H1610 HydrophobicContact CG1-CB 4.42Å; V1584-I1611 HydrophobicContact CG1-CB 4.28Å; V1584-I1611 HydrophobicContact CG1-CD1 4.49Å
1585	N	83.4	Confident	80.6	Confident	21 Å²	21	39.4 Å²	39.4	11%	0.112	20%	0.195	C	C	.	.	H	α-helix	trans	-57.2	-41.1	175.7	-73.8	-22.1	0	0	0	112	L1368 A1581 Q1588 D1589	L1368-N1585 PolarHBondContact N-OD1 2.99Å; L1368-N1585 VanDerWaalsContact N-OD1 3.08Å; L1368-N1585 PolarHBondContact O-ND2 2.81Å; A1581-N1585 WeakPolarHBondContact O-CB 3.24Å; A1581-N1585 VanDerWaalsContact O-CG 3.3Å; A1581-N1585 PolarHBondContact O-N 2.97Å; A1581-N1585 PolarHBondContact O-ND2 3.27Å; N1585-Q1588 PolarHBondContact O-N 3.11Å; N1585-D1589 PolarHBondContact O-N 2.81Å
1586	L	86.5	Confident	81.6	Confident	17 Å²	17	39.5 Å²	39.5	9%	0.089	20%	0.196	C	C	.	.	H	α-helix	trans	-62.9	-43.3	175.8	171.3	63	0	0	0	111.9	V1531 R1552 I1555 Q1582 V1583 V1584 D1589 L1590	V1531-L1586 HydrophobicContact CB-CD2 4.08Å; V1531-L1586 HydrophobicContact CG1-CD2 4.35Å; R1552-L1586 HydrophobicContact CG-CD2 3.99Å; I1555-L1586 HydrophobicContact CD1-CD2 3.9Å; I1555-L1586 HydrophobicContact CG2-CD2 4.48Å; Q1582-L1586 WeakPolarHBondContact O-CB 3.24Å; Q1582-L1586 PolarHBondContact O-N 3.4Å; V1583-L1586 PolarHBondContact O-N 3.01Å; V1584-L1586 VanDerWaalsContact C-N 3.29Å; V1584-L1586 PolarHBondContact O-N 3.08Å; L1586-D1589 PolarHBondContact O-N 3.25Å; L1586-L1590 HydrophobicContact CD1-CD1 3.92Å; L1586-L1590 HydrophobicContact CD1-CG 4.11Å; L1586-L1590 HydrophobicContact CG-CD1 3.89Å; L1586-L1590 WeakPolarHBondContact O-CB 3.37Å; L1586-L1590 WeakPolarHBondContact O-CD1 3.22Å; L1586-L1590 VanDerWaalsContact O-CG 3.23Å; L1586-L1590 WeakPolarHBondContact O-CG 3.47Å; L1586-L1590 PolarHBondContact O-N 2.96Å
1587	L	87.8	Confident	82.5	Confident	1 Å²	1	39.2 Å²	39.2	1%	0.005	20%	0.197	C	C	.	.	H	α-helix	trans	-66.5	-41	178.5	-70.6	169.9	0	0	0	111.5	I1486 I1555 V1583 V1584 D1589 L1590 Q1591 Y1598 F1600 I1611	I1486-L1587 HydrophobicContact CD1-CD2 4.11Å; I1555-L1587 HydrophobicContact CD1-CD2 4.11Å; I1555-L1587 HydrophobicContact CD1-CG 4.35Å; I1555-L1587 HydrophobicContact CG1-CD2 4.22Å; I1555-L1587 HydrophobicContact CG2-CD2 4.45Å; V1583-L1587 HydrophobicContact CG1-CD1 4.15Å; V1583-L1587 WeakPolarHBondContact O-CG 3.45Å; V1583-L1587 PolarHBondContact O-N 3.39Å; V1584-L1587 PolarHBondContact O-N 2.87Å; V1584-L1587 VanDerWaalsContact O-N 3.11Å; L1587-D1589 VanDerWaalsContact C-N 3.35Å; L1587-D1589 PolarHBondContact O-N 2.94Å; L1587-L1590 HydrophobicContact CD2-CD1 4.49Å; L1587-L1590 PolarHBondContact O-N 3.46Å; L1587-Q1591 WeakPolarHBondContact O-CB 3.41Å; L1587-Q1591 PolarHBondContact O-N 3.34Å; L1587-Y1598 HydrophobicContact CB-CE2 4.04Å; L1587-Y1598 WeakPolarHBondContact O-CE2 3.41Å; L1587-Y1598 PolarHBondContact O-OH 2.89Å; L1587-F1600 HydrophobicContact CD1-CD2 4.49Å; L1587-F1600 HydrophobicContact CD1-CE2 4.03Å; L1587-I1611 HydrophobicContact CB-CD1 3.51Å; L1587-I1611 HydrophobicContact CD1-CD1 3.82Å; L1587-I1611 HydrophobicContact CG-CD1 4.32Å
1588	Q	86.2	Confident	83.6	Confident	8 Å²	8	39.8 Å²	39.8	4%	0.037	20%	0.197	C	C	.	.	H	α-helix	trans	-58.6	-44.4	172.9	-69	175.4	-27.4	0	0	112.4	D1366 V1584 N1585 Q1591 K1592 H1610	D1366-Q1588 PolarHBondContact O-NE2 3.32Å; D1366-Q1588 PolarHBondContact O-OE1 2.79Å; V1584-Q1588 WeakPolarHBondContact O-CG 3.49Å; V1584-Q1588 PolarHBondContact O-N 2.95Å; N1585-Q1588 PolarHBondContact O-N 3.11Å; Q1588-Q1591 WeakPolarHBondContact O-CB 3.35Å; Q1588-Q1591 PolarHBondContact O-N 2.97Å; Q1588-K1592 WeakPolarHBondContact O-CG 3.42Å; Q1588-K1592 PolarHBondContact O-N 3.27Å; Q1588-H1610 PolarHBondContact NE2-O 3.27Å
1589	D	87.2	Confident	84.5	Confident	61 Å²	61	42.3 Å²	42.3	33%	0.326	21%	0.21	S	C	.	.	H	α-helix	trans	-63.7	-43.4	179	-77.8	-10.4	0	0	0	111.3	R1367 N1585 L1586 L1587 Q1591 K1592 E1593	R1367-D1589 IonicContact CZ-OD1 3.9Å; R1367-D1589 IonicContact CZ-OD2 3.21Å; R1367-D1589 IonicContact NE-OD1 2.83Å; R1367-D1589 IonicContact NH2-OD1 3.84Å; R1367-D1589 PolarHBondContact NH2-OD1 3.01Å; R1367-D1589 IonicContact NH2-OD2 3.97Å; R1367-D1589 PolarHBondContact NH2-OD2 3.44Å; N1585-D1589 PolarHBondContact O-N 2.81Å; L1586-D1589 PolarHBondContact O-N 3.25Å; L1587-D1589 VanDerWaalsContact C-N 3.35Å; L1587-D1589 PolarHBondContact O-N 2.94Å; D1589-Q1591 VanDerWaalsContact C-N 3.33Å; D1589-Q1591 PolarHBondContact O-N 3.44Å; D1589-K1592 PolarHBondContact O-N 3.39Å; D1589-E1593 WeakPolarHBondContact O-CB 3.42Å; D1589-E1593 PolarHBondContact O-N 3.04Å
1590	L	89	Confident	85	Confident	3 Å²	3	43.1 Å²	43.1	2%	0.016	21%	0.213	C	C	.	.	H	α-helix	trans	-62.5	-37.8	173.4	-71.9	166.8	0	0	0	112.7	T1530 I1555 L1559 L1586 L1587 H1594 L1596	T1530-L1590 HydrophobicContact CG2-CD2 3.66Å; I1555-L1590 HydrophobicContact CG2-CD1 3.48Å; I1555-L1590 VanDerWaalsContact CG2-CD1 3.48Å; L1559-L1590 HydrophobicContact CD1-CD1 3.82Å; L1559-L1590 HydrophobicContact CD1-CD2 3.48Å; L1559-L1590 VanDerWaalsContact CD1-CD2 3.48Å; L1559-L1590 HydrophobicContact CD1-CG 4.29Å; L1559-L1590 HydrophobicContact CD2-CD2 4.18Å; L1559-L1590 HydrophobicContact CG-CD2 4.48Å; L1586-L1590 HydrophobicContact CD1-CD1 3.92Å; L1586-L1590 HydrophobicContact CD1-CG 4.11Å; L1586-L1590 HydrophobicContact CG-CD1 3.89Å; L1586-L1590 WeakPolarHBondContact O-CB 3.37Å; L1586-L1590 WeakPolarHBondContact O-CD1 3.22Å; L1586-L1590 VanDerWaalsContact O-CG 3.23Å; L1586-L1590 WeakPolarHBondContact O-CG 3.47Å; L1586-L1590 PolarHBondContact O-N 2.96Å; L1587-L1590 HydrophobicContact CD2-CD1 4.49Å; L1587-L1590 PolarHBondContact O-N 3.46Å; L1590-H1594 WeakPolarHBondContact O-CB 3.4Å; L1590-H1594 PolarHBondContact O-N 3.47Å; L1590-L1596 HydrophobicContact CB-CD1 4.16Å
1591	Q	85.4	Confident	85.3	Confident	45 Å²	45	42.6 Å²	42.6	21%	0.21	21%	0.211	C	C	.	.	H	α-helix	trans	-61.1	-46.2	175.2	-159.1	-172.1	4.3	0	0	110.8	L1587 Q1588 D1589 N1595 L1596 Y1598	L1587-Q1591 WeakPolarHBondContact O-CB 3.41Å; L1587-Q1591 PolarHBondContact O-N 3.34Å; Q1588-Q1591 WeakPolarHBondContact O-CB 3.35Å; Q1588-Q1591 PolarHBondContact O-N 2.97Å; D1589-Q1591 VanDerWaalsContact C-N 3.33Å; D1589-Q1591 PolarHBondContact O-N 3.44Å; Q1591-N1595 WeakPolarHBondContact O-CA 3.48Å; Q1591-N1595 PolarHBondContact O-N 2.98Å; Q1591-L1596 VanDerWaalsContact CG-O 3.29Å; Q1591-L1596 WeakPolarHBondContact CG-O 3.42Å; Q1591-L1596 PolarHBondContact O-N 2.97Å; Q1591-Y1598 HydrophobicContact CB-CE2 3.73Å; Q1591-Y1598 HydrophobicContact CG-CD2 4.24Å; Q1591-Y1598 HydrophobicContact CG-CE2 3.92Å; Q1591-Y1598 PolarHBondContact N-OH 3.39Å
1592	K	85	Confident	85.4	Confident	129 Å²	129	43.2 Å²	43.2	56%	0.561	22%	0.216	S	C	*	.	H	α-helix	trans	-72.1	-37.4	-179.5	-70.6	170.1	176.8	174.4	0	112.6	D1366 Q1588 D1589	D1366-K1592 IonicContact OD2-NZ 3.9Å; D1366-K1592 PolarHBondContact OD2-NZ 3.42Å; Q1588-K1592 WeakPolarHBondContact O-CG 3.42Å; Q1588-K1592 PolarHBondContact O-N 3.27Å; D1589-K1592 PolarHBondContact O-N 3.39Å
1593	E	86.9	Confident	84.8	Confident	137 Å²	137	43.4 Å²	43.4	64%	0.64	22%	0.217	S	C	*	.	H	α-helix	trans	-77.5	-38.3	179.2	-165.9	-171.4	147.9	0	0	113.1	D1589	D1589-E1593 WeakPolarHBondContact O-CB 3.42Å; D1589-E1593 PolarHBondContact O-N 3.04Å
1594	H	86.7	Confident	84.1	Confident	80 Å²	80	44 Å²	44	37%	0.37	22%	0.22	S	C	.	.	H	α-helix	trans	-110.5	1.3	-171.5	-61.2	-15.3	0	0	0	114.3	L1590 L1596	L1590-H1594 WeakPolarHBondContact O-CB 3.4Å; L1590-H1594 PolarHBondContact O-N 3.47Å; H1594-L1596 HydrophobicContact CB-CD1 4.12Å; H1594-L1596 HydrophobicContact CB-CD2 4.37Å; H1594-L1596 HydrophobicContact CB-CG 3.88Å; H1594-L1596 PolarHBondContact O-N 3.02Å
1595	N	85.7	Confident	83.3	Confident	145 Å²	145	44.5 Å²	44.5	78%	0.775	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	53.8	50.2	-178	-168.7	92.2	0	0	0	111.8	Q1591	Q1591-N1595 WeakPolarHBondContact O-CA 3.48Å; Q1591-N1595 PolarHBondContact O-N 2.98Å
1596	L	88.8	Confident	82.4	Confident	10 Å²	10	43.5 Å²	43.5	5%	0.052	22%	0.218	C	C	.	.			trans	-83.2	145.8	-178.2	-63.5	167.3	0	0	0	111.4	L1559 P1563 I1566 L1590 Q1591 H1594 Y1598	L1559-L1596 HydrophobicContact CD2-CD1 3.92Å; P1563-L1596 HydrophobicContact CG-CD2 4.38Å; P1563-L1596 WeakPolarHBondContact O-CD2 3.49Å; I1566-L1596 HydrophobicContact CD1-CD1 4.19Å; I1566-L1596 HydrophobicContact CD1-CD2 4.46Å; L1590-L1596 HydrophobicContact CB-CD1 4.16Å; Q1591-L1596 VanDerWaalsContact CG-O 3.29Å; Q1591-L1596 WeakPolarHBondContact CG-O 3.42Å; Q1591-L1596 PolarHBondContact O-N 2.97Å; H1594-L1596 HydrophobicContact CB-CD1 4.12Å; H1594-L1596 HydrophobicContact CB-CD2 4.37Å; H1594-L1596 HydrophobicContact CB-CG 3.88Å; H1594-L1596 PolarHBondContact O-N 3.02Å; L1596-Y1598 HydrophobicContact CB-CD1 4.43Å; L1596-Y1598 HydrophobicContact CB-CE1 3.81Å; L1596-Y1598 HydrophobicContact CD1-CE1 3.99Å; L1596-Y1598 WeakPolarHBondContact CD1-OH 3.07Å
1597	T	88.3	Confident	81.6	Confident	85 Å²	85	42.8 Å²	42.8	52%	0.521	21%	0.214	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	139.7	162.6	-53.5	0	0	0	0	109.3	R1564 F1565 I1566	R1564-T1597 PolarHBondContact O-N 3.32Å; F1565-T1597 WeakPolarHBondContact CA-O 3.4Å; F1565-T1597 HydrophobicContact CD2-CG2 3.81Å; F1565-T1597 WeakPolarHBondContact CD2-O 3.46Å; F1565-T1597 HydrophobicContact CE2-CG2 4.24Å; I1566-T1597 PolarHBondContact N-O 3.49Å
1598	Y	89.5	Confident	80.9	Confident	32 Å²	32	43.3 Å²	43.3	13%	0.125	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	143.9	174.8	-63.3	-35.4	0	0	0	112.6	I1566 L1587 Q1591 L1596 I1611	I1566-Y1598 HydrophobicContact CB-CD1 4Å; I1566-Y1598 HydrophobicContact CB-CE1 4.13Å; I1566-Y1598 HydrophobicContact CD1-CE1 4.3Å; I1566-Y1598 HydrophobicContact CG1-CE1 4.48Å; I1566-Y1598 WeakPolarHBondContact O-CA 3.23Å; L1587-Y1598 HydrophobicContact CB-CE2 4.04Å; L1587-Y1598 WeakPolarHBondContact O-CE2 3.41Å; L1587-Y1598 PolarHBondContact O-OH 2.89Å; Q1591-Y1598 HydrophobicContact CB-CE2 3.73Å; Q1591-Y1598 HydrophobicContact CG-CD2 4.24Å; Q1591-Y1598 HydrophobicContact CG-CE2 3.92Å; Q1591-Y1598 PolarHBondContact N-OH 3.39Å; L1596-Y1598 HydrophobicContact CB-CD1 4.43Å; L1596-Y1598 HydrophobicContact CB-CE1 3.81Å; L1596-Y1598 HydrophobicContact CD1-CE1 3.99Å; L1596-Y1598 WeakPolarHBondContact CD1-OH 3.07Å; Y1598-I1611 HydrophobicContact CD2-CD1 4.45Å; Y1598-I1611 HydrophobicContact CD2-CG1 4.39Å
1599	L	87.1	Confident	80.2	Confident	58 Å²	58	44.1 Å²	44.1	30%	0.304	22%	0.221	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	93	155.4	171	59.1	0	0	0	106.2	I1449 F1565 I1566 I1567 C1568 I1601	I1449-L1599 HydrophobicContact CD1-CD2 3.63Å; F1565-L1599 HydrophobicContact CE2-CB 3.69Å; F1565-L1599 HydrophobicContact CZ-CB 3.73Å; F1565-L1599 HydrophobicContact CZ-CD2 4.43Å; I1566-L1599 PolarHBondContact O-N 3.25Å; I1567-L1599 HydrophobicContact CG1-CB 4.42Å; I1567-L1599 HydrophobicContact CG1-CD2 4.37Å; I1567-L1599 HydrophobicContact CG2-CD2 4.21Å; I1567-L1599 HydrophobicContact CG2-CG 4.42Å; C1568-L1599 PolarHBondContact N-O 3Å; L1599-I1601 HydrophobicContact CG-CG1 4.48Å
1600	F	85	Confident	79.4	Confident	23 Å²	23	42.7 Å²	42.7	10%	0.101	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	110.6	-178.4	-166.5	-87.9	0	0	0	109.7	C1568 P1571 I1572 L1587 A1602 V1608 I1611	C1568-F1600 HydrophobicContact CB-CD2 3.96Å; P1571-F1600 HydrophobicContact CG-CD2 3.96Å; P1571-F1600 HydrophobicContact CG-CE1 4.5Å; P1571-F1600 HydrophobicContact CG-CE2 3.26Å; P1571-F1600 HydrophobicContact CG-CZ 3.6Å; I1572-F1600 HydrophobicContact CD1-CE1 4.37Å; I1572-F1600 HydrophobicContact CD1-CZ 4.17Å; I1572-F1600 HydrophobicContact CG1-CZ 4.42Å; L1587-F1600 HydrophobicContact CD1-CD2 4.49Å; L1587-F1600 HydrophobicContact CD1-CE2 4.03Å; F1600-A1602 HydrophobicContact CD1-CB 4.27Å; F1600-A1602 HydrophobicContact CE1-CB 3.76Å; F1600-V1608 HydrophobicContact CD1-CG2 3.94Å; F1600-V1608 HydrophobicContact CE1-CG2 4Å; F1600-I1611 HydrophobicContact CB-CG2 4.2Å; F1600-I1611 HydrophobicContact CD1-CG2 3.77Å; F1600-I1611 HydrophobicContact CD2-CD1 3.75Å; F1600-I1611 HydrophobicContact CD2-CG1 4.43Å; F1600-I1611 HydrophobicContact CD2-CG2 3.81Å; F1600-I1611 HydrophobicContact CE1-CG2 4Å; F1600-I1611 HydrophobicContact CE2-CD1 3.75Å; F1600-I1611 HydrophobicContact CE2-CG2 4.03Å; F1600-I1611 HydrophobicContact CG-CG2 3.67Å; F1600-I1611 HydrophobicContact CZ-CG2 4.12Å
1601	I	82.8	Confident	78.7	Confident	11 Å²	11	43 Å²	43	6%	0.056	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	126.3	173.1	-66.1	161	0	0	0	107.1	K1442 I1567 C1568 E1570 P1571 L1599	K1442-I1601 HydrophobicContact CB-CG1 4.38Å; K1442-I1601 HydrophobicContact CB-CG2 3.51Å; K1442-I1601 HydrophobicContact CD-CG2 4.19Å; K1442-I1601 HydrophobicContact CG-CG2 4.44Å; K1442-I1601 WeakPolarHBondContact O-CD1 3.3Å; I1567-I1601 HydrophobicContact CG2-CD1 4.21Å; C1568-I1601 WeakPolarHBondContact O-CB 3.14Å; C1568-I1601 PolarHBondContact O-N 3.36Å; E1570-I1601 WeakPolarHBondContact CA-O 3.45Å; E1570-I1601 HydrophobicContact CG-CG2 4.01Å; E1570-I1601 PolarHBondContact N-O 3.14Å; P1571-I1601 VanDerWaalsContact CD-O 3.32Å; P1571-I1601 WeakPolarHBondContact CD-O 3.18Å; L1599-I1601 HydrophobicContact CG-CG1 4.48Å
1602	A	75.2	Confident	78.4	Confident	13 Å²	13	41.6 Å²	41.6	11%	0.107	21%	0.209	C	C	.	.			trans	-152.1	170.6	162.4	0	0	0	0	0	108.3	K1442 I1572 F1600 D1604 V1608	K1442-A1602 WeakPolarHBondContact CE-O 3.44Å; I1572-A1602 HydrophobicContact CD1-CB 4.19Å; F1600-A1602 HydrophobicContact CD1-CB 4.27Å; F1600-A1602 HydrophobicContact CE1-CB 3.76Å; A1602-D1604 VanDerWaalsContact C-N 3.29Å; A1602-D1604 HydrophobicContact CB-CB 4.14Å; A1602-V1608 HydrophobicContact CB-CG2 3.88Å
1603	H	67.8	Low	78.1	Confident	33 Å²	33	41.4 Å²	41.4	15%	0.153	21%	0.214	C	C	.	.	S	Bend	trans	-74.5	-27.1	154.3	47.3	-96.2	0	0	0	112.1	G1436 E1437 E1570 S1573 L1605	G1436-H1603 CarbonylContact C-O 3.53Å; G1436-H1603 WeakPolarHBondContact CA-O 3.47Å; G1436-H1603 CarbonylContact O-C 3.18Å; G1436-H1603 WeakPolarHBondContact O-CB 3.21Å; E1437-H1603 PolarHBondContact N-O 3.36Å; E1437-H1603 VanDerWaalsContact N-O 3.12Å; E1437-H1603 WeakPolarHBondContact O-CA 3.28Å; E1437-H1603 WeakPolarHBondContact O-CB 3.13Å; E1570-H1603 IonicContact OE1-ND1 2.58Å; E1570-H1603 PolarHBondContact OE1-ND1 2.83Å; E1570-H1603 VanDerWaalsContact OE1-ND1 3.17Å; E1570-H1603 IonicContact OE2-ND1 2.69Å; S1573-H1603 VanDerWaalsContact CB-CE1 3.47Å; S1573-H1603 WeakPolarHBondContact CB-CE1 3.39Å; H1603-L1605 PolarHBondContact O-N 3.49Å
1604	D	67	Low	77.8	Confident	12 Å²	12	41 Å²	41	6%	0.064	21%	0.206	C	C	.	.			trans	-84	80.9	-155.1	-154.2	60.1	0	0	0	115.3	L1435 I1572 A1602 S1606 M1607 V1608	L1435-D1604 WeakPolarHBondContact CB-OD1 3.22Å; L1435-D1604 VanDerWaalsContact CD1-OD1 3.25Å; L1435-D1604 WeakPolarHBondContact CD1-OD1 3.48Å; L1435-D1604 WeakPolarHBondContact CD1-OD2 3.22Å; L1435-D1604 HydrophobicContact CD2-CB 4.28Å; L1435-D1604 VanDerWaalsContact CD2-OD1 3.23Å; L1435-D1604 WeakPolarHBondContact CD2-OD1 3.47Å; L1435-D1604 WeakPolarHBondContact CD2-OD2 3.34Å; L1435-D1604 WeakPolarHBondContact CG-OD1 3.38Å; I1572-D1604 HydrophobicContact CD1-CB 3.9Å; A1602-D1604 VanDerWaalsContact C-N 3.29Å; A1602-D1604 HydrophobicContact CB-CB 4.14Å; D1604-S1606 PolarHBondContact O-N 3.33Å; D1604-M1607 HydrophobicContact CB-CB 4.29Å; D1604-M1607 PolarHBondContact O-N 3.04Å; D1604-M1607 VanDerWaalsContact OD2-CB 3.32Å; D1604-M1607 WeakPolarHBondContact OD2-CB 3.49Å; D1604-M1607 WeakPolarHBondContact OD2-CG 3.42Å; D1604-V1608 WeakPolarHBondContact O-CB 3.5Å; D1604-V1608 WeakPolarHBondContact O-CG2 3.26Å; D1604-V1608 PolarHBondContact O-N 3.07Å
1605	L	67.3	Low	77.7	Confident	11 Å²	11	37.5 Å²	37.5	6%	0.058	19%	0.19	C	C	.	.	H	α-helix	trans	-49.5	-22.5	-170	-85.1	173.1	0	0	0	117.9	H1603 K1609 I1615 L1644 L1645	H1603-L1605 PolarHBondContact O-N 3.49Å; L1605-K1609 WeakPolarHBondContact O-CB 3.44Å; L1605-K1609 PolarHBondContact O-N 3.39Å; L1605-I1615 HydrophobicContact CD2-CD1 4.4Å; L1605-I1615 HydrophobicContact CD2-CG2 3.86Å; L1605-L1644 HydrophobicContact CD1-CB 3.94Å; L1605-L1644 HydrophobicContact CD1-CD1 4.12Å; L1605-L1645 HydrophobicContact CD1-CD2 4.12Å
1606	S	65.3	Low	77.5	Confident	0 Å²	0	32.5 Å²	32.5	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-94.6	-42.6	179.8	-162.8	0	0	0	0	112.5	P1359 L1361 R1434 D1604 V1608 K1609 H1610	P1359-S1606 WeakPolarHBondContact CB-OG 3.47Å; L1361-S1606 WeakPolarHBondContact CD2-OG 3.37Å; R1434-S1606 VanDerWaalsContact O-CB 3.26Å; R1434-S1606 WeakPolarHBondContact O-CB 3.21Å; D1604-S1606 PolarHBondContact O-N 3.33Å; S1606-V1608 PolarHBondContact O-N 3.06Å; S1606-K1609 WeakPolarHBondContact O-CA 3.48Å; S1606-K1609 WeakPolarHBondContact O-CB 3.39Å; S1606-K1609 PolarHBondContact O-N 2.86Å; S1606-H1610 PolarHBondContact O-CD2 3.1Å; S1606-H1610 PolarHBondContact O-N 3.14Å
1607	M	70.6	Confident	77.3	Confident	1 Å²	1	32.3 Å²	32.3	1%	0.005	17%	0.172	C	C	.	.	H	α-helix	trans	-54.4	-40.1	162.9	-70.6	-67.9	104.2	0	0	110.1	P1359 L1368 I1572 Q1580 V1584 D1604 H1610 I1611	P1359-M1607 HydrophobicContact CB-CE 3.56Å; P1359-M1607 HydrophobicContact CG-CE 3.62Å; L1368-M1607 HydrophobicContact CD1-CE 3.48Å; L1368-M1607 VanDerWaalsContact CD1-CE 3.48Å; L1368-M1607 HydrophobicContact CD1-SD 3.84Å; L1368-M1607 HydrophobicContact CD2-CE 3.91Å; L1368-M1607 HydrophobicContact CG-CE 4.36Å; I1572-M1607 HydrophobicContact CD1-CB 3.6Å; I1572-M1607 HydrophobicContact CD1-CG 3.75Å; Q1580-M1607 HydrophobicContact CB-SD 4.22Å; V1584-M1607 HydrophobicContact CB-SD 4.46Å; V1584-M1607 HydrophobicContact CG2-CB 4.38Å; V1584-M1607 HydrophobicContact CG2-SD 3.71Å; D1604-M1607 HydrophobicContact CB-CB 4.29Å; D1604-M1607 PolarHBondContact O-N 3.04Å; D1604-M1607 VanDerWaalsContact OD2-CB 3.32Å; D1604-M1607 WeakPolarHBondContact OD2-CB 3.49Å; D1604-M1607 WeakPolarHBondContact OD2-CG 3.42Å; M1607-H1610 PolarHBondContact O-N 3.19Å; M1607-I1611 WeakPolarHBondContact O-CG2 3.45Å; M1607-I1611 PolarHBondContact O-N 3.38Å
1608	V	72	Confident	76.9	Confident	12 Å²	12	29.2 Å²	29.2	7%	0.073	15%	0.152	C	C	.	.	H	α-helix	trans	-61.3	-44.7	171.5	176.7	0	0	0	0	111.8	F1600 A1602 D1604 S1606 H1610 I1611 S1612 I1615	F1600-V1608 HydrophobicContact CD1-CG2 3.94Å; F1600-V1608 HydrophobicContact CE1-CG2 4Å; A1602-V1608 HydrophobicContact CB-CG2 3.88Å; D1604-V1608 WeakPolarHBondContact O-CB 3.5Å; D1604-V1608 WeakPolarHBondContact O-CG2 3.26Å; D1604-V1608 PolarHBondContact O-N 3.07Å; S1606-V1608 PolarHBondContact O-N 3.06Å; V1608-H1610 PolarHBondContact O-N 2.79Å; V1608-I1611 PolarHBondContact O-N 3.09Å; V1608-S1612 WeakPolarHBondContact O-CB 3.21Å; V1608-S1612 PolarHBondContact O-N 3.18Å; V1608-S1612 PolarHBondContact O-OG 2.81Å; V1608-I1615 HydrophobicContact CG1-CD1 3.77Å; V1608-I1615 HydrophobicContact CG1-CG1 3.7Å; V1608-I1615 HydrophobicContact CG1-CG2 4.32Å
1609	K	71.2	Confident	76.2	Confident	26 Å²	26	29.1 Å²	29.1	11%	0.113	15%	0.154	C	C	.	.	H	α-helix	trans	-56	-45.3	177.2	-176.6	-169.1	172.7	-175.3	0	112.1	L1361 L1605 S1606 I1611 N1630 Y1633	L1361-K1609 HydrophobicContact CD2-CD 3.71Å; L1361-K1609 PolarHBondContact O-NZ 3.39Å; L1605-K1609 WeakPolarHBondContact O-CB 3.44Å; L1605-K1609 PolarHBondContact O-N 3.39Å; S1606-K1609 WeakPolarHBondContact O-CA 3.48Å; S1606-K1609 WeakPolarHBondContact O-CB 3.39Å; S1606-K1609 PolarHBondContact O-N 2.86Å; K1609-I1611 VanDerWaalsContact C-N 3.33Å; K1609-I1611 PolarHBondContact O-N 3.09Å; K1609-N1630 VanDerWaalsContact CE-OD1 3.28Å; K1609-N1630 WeakPolarHBondContact CE-OD1 3.42Å; K1609-Y1633 HydrophobicContact CD-CG 4.18Å
1610	H	71.5	Confident	75.4	Confident	31 Å²	31	32.7 Å²	32.7	14%	0.144	17%	0.173	C	C	.	.	H	α-helix	trans	-71.4	-23	-177.7	-66.9	-76	0	0	0	113.7	T1360 V1584 Q1588 S1606 M1607 V1608	T1360-H1610 PolarHBondContact O-CE1 2.93Å; V1584-H1610 HydrophobicContact CG1-CB 4.42Å; Q1588-H1610 PolarHBondContact NE2-O 3.27Å; S1606-H1610 PolarHBondContact O-CD2 3.1Å; S1606-H1610 PolarHBondContact O-N 3.14Å; M1607-H1610 PolarHBondContact O-N 3.19Å; V1608-H1610 PolarHBondContact O-N 2.79Å
1611	I	74.6	Confident	74.6	Confident	8 Å²	8	33.8 Å²	33.8	4%	0.041	19%	0.191	C	C	.	.	H	α-helix	trans	-108	-13.8	-176.7	-162.2	162.4	0	0	0	115.1	V1584 L1587 Y1598 F1600 M1607 V1608 K1609	V1584-I1611 HydrophobicContact CG1-CB 4.28Å; V1584-I1611 HydrophobicContact CG1-CD1 4.49Å; L1587-I1611 HydrophobicContact CB-CD1 3.51Å; L1587-I1611 HydrophobicContact CD1-CD1 3.82Å; L1587-I1611 HydrophobicContact CG-CD1 4.32Å; Y1598-I1611 HydrophobicContact CD2-CD1 4.45Å; Y1598-I1611 HydrophobicContact CD2-CG1 4.39Å; F1600-I1611 HydrophobicContact CB-CG2 4.2Å; F1600-I1611 HydrophobicContact CD1-CG2 3.77Å; F1600-I1611 HydrophobicContact CD2-CD1 3.75Å; F1600-I1611 HydrophobicContact CD2-CG1 4.43Å; F1600-I1611 HydrophobicContact CD2-CG2 3.81Å; F1600-I1611 HydrophobicContact CE1-CG2 4Å; F1600-I1611 HydrophobicContact CE2-CD1 3.75Å; F1600-I1611 HydrophobicContact CE2-CG2 4.03Å; F1600-I1611 HydrophobicContact CG-CG2 3.67Å; F1600-I1611 HydrophobicContact CZ-CG2 4.12Å; M1607-I1611 WeakPolarHBondContact O-CG2 3.45Å; M1607-I1611 PolarHBondContact O-N 3.38Å; V1608-I1611 PolarHBondContact O-N 3.09Å; K1609-I1611 VanDerWaalsContact C-N 3.33Å; K1609-I1611 PolarHBondContact O-N 3.09Å
1612	S	78.4	Confident	74.3	Confident	17 Å²	17	37.6 Å²	37.6	12%	0.119	21%	0.209	C	C	.	.			trans	-118.9	125.7	-169	-42.4	0	0	0	0	112.2	V1608 R1614 S1629	V1608-S1612 WeakPolarHBondContact O-CB 3.21Å; V1608-S1612 PolarHBondContact O-N 3.18Å; V1608-S1612 PolarHBondContact O-OG 2.81Å; S1612-R1614 WeakPolarHBondContact CB-O 3.3Å; S1612-R1614 PolarHBondContact O-N 2.97Å; S1612-S1629 WeakPolarHBondContact O-CB 3.46Å; S1612-S1629 PolarHBondContact O-OG 3.04Å
1613	D	79.3	Confident	74.6	Confident	125 Å²	125	40.2 Å²	40.2	67%	0.668	22%	0.221	S	C	*	.	S	Bend	trans	-64.6	-32	171.1	-48.8	-92.5	0	0	0	111.9	T1628 S1629	D1613-T1628 WeakPolarHBondContact O-CA 3.5Å; D1613-S1629 PolarHBondContact O-N 2.86Å; D1613-S1629 VanDerWaalsContact O-N 3.08Å
1614	R	79.4	Confident	75.4	Confident	127 Å²	127	39.2 Å²	39.2	48%	0.479	22%	0.216	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	142.9	-178.6	-62.5	-173.5	74.2	-156.9	4.5	110.7	S1612 G1627 G1682	S1612-R1614 WeakPolarHBondContact CB-O 3.3Å; S1612-R1614 PolarHBondContact O-N 2.97Å; R1614-G1627 CarbonylContact C-O 3.09Å; R1614-G1627 WeakPolarHBondContact CA-O 2.91Å; R1614-G1627 VanDerWaalsContact CB-O 3.24Å; R1614-G1627 WeakPolarHBondContact CB-O 3.41Å; R1614-G1682 PolarHBondContact NH2-O 3.4Å
1615	I	83.9	Confident	76.4	Confident	7 Å²	7	38.6 Å²	38.6	4%	0.036	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115	139.2	178.4	-61.4	-176.9	0	0	0	108.5	L1605 V1608 V1626 G1627 I1632	L1605-I1615 HydrophobicContact CD2-CD1 4.4Å; L1605-I1615 HydrophobicContact CD2-CG2 3.86Å; V1608-I1615 HydrophobicContact CG1-CD1 3.77Å; V1608-I1615 HydrophobicContact CG1-CG1 3.7Å; V1608-I1615 HydrophobicContact CG1-CG2 4.32Å; I1615-V1626 CarbonylContact O-C 3.59Å; I1615-V1626 VanDerWaalsContact O-CA 3.27Å; I1615-V1626 WeakPolarHBondContact O-CA 3.38Å; I1615-G1627 PolarHBondContact N-O 2.85Å; I1615-G1627 PolarHBondContact O-N 3.46Å; I1615-I1632 HydrophobicContact CB-CB 4.11Å; I1615-I1632 HydrophobicContact CB-CG1 4.14Å; I1615-I1632 HydrophobicContact CB-CG2 4.19Å; I1615-I1632 HydrophobicContact CG2-CB 4.38Å; I1615-I1632 HydrophobicContact CG2-CG2 3.9Å
1616	G	83.5	Confident	77.3	Confident	40 Å²	40	39.1 Å²	39.1	41%	0.412	22%	0.216	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	109.1	171.2	0	0	0	0	0	110.7	E1625	G1616-E1625 CarbonylContact C-O 3.57Å; G1616-E1625 WeakPolarHBondContact CA-O 3.39Å
1617	V	84.4	Confident	78.2	Confident	7 Å²	7	39.1 Å²	39.1	4%	0.042	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	134.6	173	179.5	0	0	0	0	108.7	L1623 L1624 E1625 I1632 Y1640 T1641 L1644	V1617-L1623 CarbonylContact O-C 3.6Å; V1617-L1623 WeakPolarHBondContact O-CA 3.16Å; V1617-L1624 PolarHBondContact O-N 3.27Å; V1617-E1625 HydrophobicContact CB-CB 4.32Å; V1617-E1625 PolarHBondContact N-O 2.84Å; V1617-I1632 HydrophobicContact CG2-CG2 4.02Å; V1617-Y1640 HydrophobicContact CG1-CD1 3.59Å; V1617-Y1640 HydrophobicContact CG1-CE1 3.83Å; V1617-T1641 HydrophobicContact CG2-CG2 4.2Å; V1617-L1644 HydrophobicContact CG1-CD1 3.86Å
1618	M	79.3	Confident	78.7	Confident	20 Å²	20	41.5 Å²	41.5	10%	0.099	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	140.6	-179.2	179.1	176.2	-83.8	0	0	110.4	S1440 K1442 H1622 L1623	S1440-M1618 WeakPolarHBondContact CB-O 3.03Å; S1440-M1618 WeakPolarHBondContact O-CG 3.45Å; S1440-M1618 PolarHBondContact OG-O 3.12Å; K1442-M1618 HydrophobicContact CG-CB 4.45Å; K1442-M1618 HydrophobicContact CG-SD 4.19Å; M1618-H1622 CarbonylContact C-O 3.51Å; M1618-H1622 VanDerWaalsContact CA-O 3.22Å; M1618-H1622 WeakPolarHBondContact CA-O 3.14Å; M1618-H1622 WeakPolarHBondContact CG-O 3.43Å; M1618-L1623 HydrophobicContact CB-CD2 4.27Å; M1618-L1623 HydrophobicContact CE-CD2 4.09Å; M1618-L1623 HydrophobicContact CE-CG 3.9Å
1619	N	75	Confident	78.9	Confident	29 Å²	29	41.6 Å²	41.6	16%	0.155	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	140.5	168.7	-165.4	-17.3	0	0	0	109.2	G1621 H1622 L1624 Y1640	N1619-G1621 PolarHBondContact O-N 3.16Å; N1619-H1622 PolarHBondContact N-O 2.83Å; N1619-H1622 PolarHBondContact O-N 3.28Å; N1619-L1624 HydrophobicContact CB-CD1 3.39Å; N1619-L1624 HydrophobicContact CB-CG 4.12Å; N1619-Y1640 HydrophobicContact CB-CD1 3.97Å; N1619-Y1640 HydrophobicContact CB-CE1 3.71Å; N1619-Y1640 WeakPolarHBondContact ND2-CE2 3.48Å
1620	N	69.3	Low	79.2	Confident	133 Å²	133	44.5 Å²	44.5	71%	0.711	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	46.7	35.3	179.6	-69.5	-30.8	0	0	0	114.9	H1622	N1620-H1622 VanDerWaalsContact C-N 3.28Å; N1620-H1622 PolarHBondContact O-CD2 2.74Å; N1620-H1622 PolarHBondContact O-N 2.87Å
1621	G	68	Low	79.6	Confident	47 Å²	47	44.5 Å²	44.5	49%	0.485	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	80.3	-8.2	-176.6	0	0	0	0	0	116.2	S1440 N1619	S1440-G1621 PolarHBondContact O-N 3.36Å; S1440-G1621 VanDerWaalsContact O-N 3.1Å; N1619-G1621 PolarHBondContact O-N 3.16Å
1622	H	76.3	Confident	79.9	Confident	90 Å²	90	44.2 Å²	44.2	42%	0.417	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	130.6	175.2	-64.9	-98.7	0	0	0	110.8	M1618 N1619 N1620 L1624 Y1686	M1618-H1622 CarbonylContact C-O 3.51Å; M1618-H1622 VanDerWaalsContact CA-O 3.22Å; M1618-H1622 WeakPolarHBondContact CA-O 3.14Å; M1618-H1622 WeakPolarHBondContact CG-O 3.43Å; N1619-H1622 PolarHBondContact N-O 2.83Å; N1619-H1622 PolarHBondContact O-N 3.28Å; N1620-H1622 VanDerWaalsContact C-N 3.28Å; N1620-H1622 PolarHBondContact O-CD2 2.74Å; N1620-H1622 PolarHBondContact O-N 2.87Å; H1622-L1624 HydrophobicContact CB-CD2 4.21Å; H1622-L1624 PolarHBondContact O-N 2.56Å; H1622-Y1686 PolarHBondContact CE1-OH 3Å; H1622-Y1686 AromaticContact ND1-CE2 3.84Å; H1622-Y1686 AromaticContact ND1-CZ 3.4Å; H1622-Y1686 PolarHBondContact ND1-OH 2.76Å
1623	L	82	Confident	79.7	Confident	69 Å²	69	44.1 Å²	44.1	36%	0.361	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	113	165.6	-80.3	168.5	0	0	0	108.5	V1617 M1618 V1626 L1676 Y1686	V1617-L1623 CarbonylContact O-C 3.6Å; V1617-L1623 WeakPolarHBondContact O-CA 3.16Å; M1618-L1623 HydrophobicContact CB-CD2 4.27Å; M1618-L1623 HydrophobicContact CE-CD2 4.09Å; M1618-L1623 HydrophobicContact CE-CG 3.9Å; L1623-V1626 HydrophobicContact CB-CG2 4.18Å; L1623-V1626 HydrophobicContact CD1-CG2 4.38Å; L1623-V1626 HydrophobicContact CD2-CG2 4.2Å; L1623-V1626 HydrophobicContact CG-CG2 4.5Å; L1623-L1676 HydrophobicContact CB-CD1 3.98Å; L1623-L1676 HydrophobicContact CB-CD2 4.44Å; L1623-L1676 HydrophobicContact CD1-CD1 4.26Å; L1623-L1676 WeakPolarHBondContact O-CD2 3.37Å; L1623-Y1686 WeakPolarHBondContact O-CB 3.41Å
1624	L	85.4	Confident	79.6	Confident	11 Å²	11	40.8 Å²	40.8	6%	0.058	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	-37.2	-174.2	-67.8	-174.3	0	0	0	113.5	V1617 N1619 H1622 H1638 Y1640 I1685 Y1686	V1617-L1624 PolarHBondContact O-N 3.27Å; N1619-L1624 HydrophobicContact CB-CD1 3.39Å; N1619-L1624 HydrophobicContact CB-CG 4.12Å; H1622-L1624 HydrophobicContact CB-CD2 4.21Å; H1622-L1624 PolarHBondContact O-N 2.56Å; L1624-H1638 PolarHBondContact O-CD2 3.31Å; L1624-Y1640 HydrophobicContact CD1-CD1 3.6Å; L1624-Y1640 HydrophobicContact CD1-CE1 4.45Å; L1624-Y1640 HydrophobicContact CD1-CG 3.95Å; L1624-I1685 WeakPolarHBondContact O-CG1 3.49Å; L1624-Y1686 HydrophobicContact CD2-CD1 3.66Å; L1624-Y1686 HydrophobicContact CD2-CE1 4.38Å; L1624-Y1686 HydrophobicContact CD2-CG 4.11Å; L1624-Y1686 WeakPolarHBondContact O-CB 3.39Å; L1624-Y1686 PolarHBondContact O-N 3.39Å
1625	E	88.1	Confident	79.7	Confident	0 Å²	0	37.3 Å²	37.3	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.8	133.2	178.7	-151.1	-179.1	162.6	0	0	110	G1616 V1617 I1632 G1636 V1637 H1638 T1641 H1683 I1685	G1616-E1625 CarbonylContact C-O 3.57Å; G1616-E1625 WeakPolarHBondContact CA-O 3.39Å; V1617-E1625 HydrophobicContact CB-CB 4.32Å; V1617-E1625 PolarHBondContact N-O 2.84Å; E1625-I1632 HydrophobicContact CB-CD1 4.14Å; E1625-I1632 HydrophobicContact CG-CD1 3.63Å; E1625-G1636 WeakPolarHBondContact OE1-CA 3.08Å; E1625-V1637 VanDerWaalsContact OE1-CG2 3.31Å; E1625-V1637 WeakPolarHBondContact OE1-CG2 3.37Å; E1625-V1637 PolarHBondContact OE1-N 3.27Å; E1625-V1637 PolarHBondContact OE2-N 2.77Å; E1625-H1638 HydrophobicContact CB-CB 4.15Å; E1625-H1638 HydrophobicContact CG-CB 4.32Å; E1625-H1638 WeakPolarHBondContact OE2-CB 3.4Å; E1625-H1638 PolarHBondContact OE2-N 3.43Å; E1625-T1641 WeakPolarHBondContact OE2-CB 3.48Å; E1625-T1641 PolarHBondContact OE2-OG1 2.95Å; E1625-H1683 IonicContact OE1-CD2 3.94Å; E1625-H1683 IonicContact OE1-CE1 2.65Å; E1625-H1683 IonicContact OE1-NE2 3.97Å; E1625-H1683 PolarHBondContact OE1-NE2 3.14Å; E1625-I1685 HydrophobicContact CG-CB 4.29Å; E1625-I1685 HydrophobicContact CG-CD1 4.29Å; E1625-I1685 HydrophobicContact CG-CG1 4.2Å
1626	V	86.6	Confident	79.8	Confident	21 Å²	21	37.2 Å²	37.2	13%	0.127	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	110.1	-175.7	-173	0	0	0	0	110.7	I1615 L1623 L1676 H1683 F1684	I1615-V1626 CarbonylContact O-C 3.59Å; I1615-V1626 VanDerWaalsContact O-CA 3.27Å; I1615-V1626 WeakPolarHBondContact O-CA 3.38Å; L1623-V1626 HydrophobicContact CB-CG2 4.18Å; L1623-V1626 HydrophobicContact CD1-CG2 4.38Å; L1623-V1626 HydrophobicContact CD2-CG2 4.2Å; L1623-V1626 HydrophobicContact CG-CG2 4.5Å; V1626-L1676 HydrophobicContact CG2-CD1 4.08Å; V1626-L1676 HydrophobicContact CG2-CD2 3.92Å; V1626-H1683 CarbonylContact O-C 3.55Å; V1626-H1683 WeakPolarHBondContact O-CA 3.33Å; V1626-F1684 HydrophobicContact CB-CB 4.42Å; V1626-F1684 PolarHBondContact N-O 3.12Å; V1626-F1684 PolarHBondContact O-N 3.18Å
1627	G	83.3	Confident	80	Confident	0 Å²	0	35.3 Å²	35.3	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	-173.5	-174.2	0	0	0	0	0	112.9	R1614 I1615	R1614-G1627 CarbonylContact C-O 3.09Å; R1614-G1627 WeakPolarHBondContact CA-O 2.91Å; R1614-G1627 VanDerWaalsContact CB-O 3.24Å; R1614-G1627 WeakPolarHBondContact CB-O 3.41Å; I1615-G1627 PolarHBondContact N-O 2.85Å; I1615-G1627 PolarHBondContact O-N 3.46Å
1628	T	80.4	Confident	80.2	Confident	51 Å²	51	35 Å²	35	31%	0.313	19%	0.192	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.9	152.7	163	62.1	0	0	0	0	109.4	D1613 N1630 E1631 I1632	D1613-T1628 WeakPolarHBondContact O-CA 3.5Å; T1628-N1630 VanDerWaalsContact C-N 3.28Å; T1628-N1630 PolarHBondContact O-N 2.78Å; T1628-E1631 PolarHBondContact O-N 3.36Å; T1628-E1631 VanDerWaalsContact OG1-CB 3.28Å; T1628-E1631 WeakPolarHBondContact OG1-CB 3.24Å; T1628-E1631 WeakPolarHBondContact OG1-CG 3.12Å; T1628-E1631 PolarHBondContact OG1-N 3Å; T1628-E1631 PolarHBondContact OG1-OE2 3.27Å; T1628-I1632 PolarHBondContact O-N 3.42Å
1629	S	77.7	Confident	80.5	Confident	15 Å²	15	36.1 Å²	36.1	11%	0.105	20%	0.2	C	C	.	.	H	α-helix	trans	-58.9	-40.7	-179.9	47.3	0	0	0	0	112.7	S1612 D1613 E1631 Y1633	S1612-S1629 WeakPolarHBondContact O-CB 3.46Å; S1612-S1629 PolarHBondContact O-OG 3.04Å; D1613-S1629 PolarHBondContact O-N 2.86Å; D1613-S1629 VanDerWaalsContact O-N 3.08Å; S1629-E1631 VanDerWaalsContact C-N 3.33Å; S1629-E1631 PolarHBondContact O-N 3.18Å; S1629-Y1633 WeakPolarHBondContact O-CB 3.31Å; S1629-Y1633 PolarHBondContact O-N 3.04Å
1630	N	77	Confident	80.9	Confident	87 Å²	87	35.2 Å²	35.2	47%	0.465	20%	0.195	S	C	.	.	H	α-helix	trans	-66.3	-29.1	173.4	-81.6	-30.7	0	0	0	113.6	K1609 T1628 H1634	K1609-N1630 VanDerWaalsContact CE-OD1 3.28Å; K1609-N1630 WeakPolarHBondContact CE-OD1 3.42Å; T1628-N1630 VanDerWaalsContact C-N 3.28Å; T1628-N1630 PolarHBondContact O-N 2.78Å; N1630-H1634 WeakPolarHBondContact O-CB 3.26Å; N1630-H1634 PolarHBondContact O-N 3.02Å; N1630-H1634 PolarHBondContact O-ND1 2.94Å; N1630-H1634 PolarHBondContact OD1-CE1 3.2Å; N1630-H1634 VanDerWaalsContact OD1-CE1 3.31Å
1631	E	80	Confident	81.6	Confident	30 Å²	30	28.9 Å²	28.9	14%	0.14	16%	0.161	C	C	.	.	H	α-helix	trans	-79.3	-46.5	176.4	-76.4	175.5	123.6	0	0	113.2	T1628 S1629 Y1633 Y1635 G1636 K1703	T1628-E1631 PolarHBondContact O-N 3.36Å; T1628-E1631 VanDerWaalsContact OG1-CB 3.28Å; T1628-E1631 WeakPolarHBondContact OG1-CB 3.24Å; T1628-E1631 WeakPolarHBondContact OG1-CG 3.12Å; T1628-E1631 PolarHBondContact OG1-N 3Å; T1628-E1631 PolarHBondContact OG1-OE2 3.27Å; S1629-E1631 VanDerWaalsContact C-N 3.33Å; S1629-E1631 PolarHBondContact O-N 3.18Å; E1631-Y1633 VanDerWaalsContact C-N 3.25Å; E1631-Y1633 PolarHBondContact O-N 3Å; E1631-Y1635 HydrophobicContact CG-CD2 4.33Å; E1631-Y1635 CarbonylContact O-C 3.51Å; E1631-Y1635 WeakPolarHBondContact O-CA 3.39Å; E1631-Y1635 WeakPolarHBondContact O-CB 3.31Å; E1631-Y1635 PolarHBondContact O-N 2.62Å; E1631-G1636 PolarHBondContact O-N 2.68Å; E1631-K1703 IonicContact OE1-NZ 3.41Å; E1631-K1703 PolarHBondContact OE1-NZ 3.37Å
1632	I	81	Confident	82.4	Confident	2 Å²	2	29 Å²	29	1%	0.01	15%	0.149	C	C	.	.	H	α-helix	trans	-62.3	-38	175.3	-61.8	-58.1	0	0	0	110.6	I1615 V1617 E1625 T1628 G1636 T1641	I1615-I1632 HydrophobicContact CB-CB 4.11Å; I1615-I1632 HydrophobicContact CB-CG1 4.14Å; I1615-I1632 HydrophobicContact CB-CG2 4.19Å; I1615-I1632 HydrophobicContact CG2-CB 4.38Å; I1615-I1632 HydrophobicContact CG2-CG2 3.9Å; V1617-I1632 HydrophobicContact CG2-CG2 4.02Å; E1625-I1632 HydrophobicContact CB-CD1 4.14Å; E1625-I1632 HydrophobicContact CG-CD1 3.63Å; T1628-I1632 PolarHBondContact O-N 3.42Å; I1632-G1636 WeakPolarHBondContact O-CA 3.28Å; I1632-G1636 PolarHBondContact O-N 2.65Å; I1632-G1636 VanDerWaalsContact O-N 3.14Å; I1632-T1641 HydrophobicContact CG2-CG2 4.11Å
1633	Y	74.2	Confident	82.6	Confident	16 Å²	16	24.8 Å²	24.8	6%	0.063	13%	0.129	C	C	.	.	H	α-helix	trans	-71.9	-49.1	179.4	-168.5	-86.6	0	0	0	113.3	L1361 K1609 S1629 E1631 L1645	L1361-Y1633 HydrophobicContact CB-CE1 4.48Å; L1361-Y1633 HydrophobicContact CD1-CE1 3.57Å; L1361-Y1633 HydrophobicContact CD1-CE2 4.15Å; L1361-Y1633 WeakPolarHBondContact CD1-OH 3.21Å; L1361-Y1633 HydrophobicContact CD2-CD1 4Å; L1361-Y1633 HydrophobicContact CD2-CD2 4.12Å; L1361-Y1633 HydrophobicContact CD2-CE1 3.67Å; L1361-Y1633 HydrophobicContact CD2-CE2 3.79Å; L1361-Y1633 HydrophobicContact CD2-CG 4.28Å; L1361-Y1633 HydrophobicContact CG-CE1 4.11Å; K1609-Y1633 HydrophobicContact CD-CG 4.18Å; S1629-Y1633 WeakPolarHBondContact O-CB 3.31Å; S1629-Y1633 PolarHBondContact O-N 3.04Å; E1631-Y1633 VanDerWaalsContact C-N 3.25Å; E1631-Y1633 PolarHBondContact O-N 3Å; Y1633-L1645 HydrophobicContact CD2-CD2 4.02Å; Y1633-L1645 HydrophobicContact CE2-CD2 3.67Å
1634	H	76.8	Confident	82.2	Confident	54 Å²	54	21.9 Å²	21.9	25%	0.25	11%	0.114	C	C	.	.	H	α-helix	trans	-88.6	-22.7	-174.7	-57.9	99.2	0	0	0	114	N1630 K1706	N1630-H1634 WeakPolarHBondContact O-CB 3.26Å; N1630-H1634 PolarHBondContact O-N 3.02Å; N1630-H1634 PolarHBondContact O-ND1 2.94Å; N1630-H1634 PolarHBondContact OD1-CE1 3.2Å; N1630-H1634 VanDerWaalsContact OD1-CE1 3.31Å; H1634-K1706 HydrophobicContact CB-CD 4.44Å; H1634-K1706 PolarHBondContact O-NZ 3.41Å
1635	Y	82	Confident	81.8	Confident	55 Å²	55	22.9 Å²	22.9	22%	0.216	12%	0.119	C	C	.	.	H	α-helix	trans	-142.2	30.2	-170.8	-41.9	-67.5	0	0	0	112.6	E1631 V1637 L1699 L1702 K1703 K1706	E1631-Y1635 HydrophobicContact CG-CD2 4.33Å; E1631-Y1635 CarbonylContact O-C 3.51Å; E1631-Y1635 WeakPolarHBondContact O-CA 3.39Å; E1631-Y1635 WeakPolarHBondContact O-CB 3.31Å; E1631-Y1635 PolarHBondContact O-N 2.62Å; Y1635-V1637 PolarHBondContact O-N 2.79Å; Y1635-L1699 VanDerWaalsContact CB-CD1 3.5Å; Y1635-L1699 HydrophobicContact CG-CD1 4.28Å; Y1635-L1702 HydrophobicContact CD1-CB 3.98Å; Y1635-K1703 HydrophobicContact CD1-CB 4.44Å; Y1635-K1703 HydrophobicContact CD1-CG 3.6Å; Y1635-K1703 HydrophobicContact CD2-CD 4.29Å; Y1635-K1703 HydrophobicContact CD2-CG 3.86Å; Y1635-K1703 HydrophobicContact CE1-CB 4.19Å; Y1635-K1703 HydrophobicContact CE1-CG 3.56Å; Y1635-K1703 HydrophobicContact CE2-CD 4.4Å; Y1635-K1703 HydrophobicContact CE2-CG 3.83Å; Y1635-K1703 HydrophobicContact CG-CD 4.47Å; Y1635-K1703 HydrophobicContact CG-CG 3.75Å; Y1635-K1706 HydrophobicContact CD1-CD 4.44Å; Y1635-K1706 HydrophobicContact CE1-CB 4.25Å; Y1635-K1706 HydrophobicContact CE1-CD 3.85Å
1636	G	85.1	Confident	81.1	Confident	5 Å²	5	23.2 Å²	23.2	5%	0.052	12%	0.122	C	C	.	.			trans	-57.6	125.3	169.8	0	0	0	0	0	110.1	E1625 E1631 I1632	E1625-G1636 WeakPolarHBondContact OE1-CA 3.08Å; E1631-G1636 PolarHBondContact O-N 2.68Å; I1632-G1636 WeakPolarHBondContact O-CA 3.28Å; I1632-G1636 PolarHBondContact O-N 2.65Å; I1632-G1636 VanDerWaalsContact O-N 3.14Å
1637	V	88.8	Confident	80.3	Confident	0 Å²	0	22.3 Å²	22.3	0%	0	12%	0.116	C	C	.	.			trans	-116.4	-14.4	-169.1	-81.2	0	0	0	0	114.6	E1625 Y1635 I1679 I1685 Y1695 K1698 L1699 L1702	E1625-V1637 VanDerWaalsContact OE1-CG2 3.31Å; E1625-V1637 WeakPolarHBondContact OE1-CG2 3.37Å; E1625-V1637 PolarHBondContact OE1-N 3.27Å; E1625-V1637 PolarHBondContact OE2-N 2.77Å; Y1635-V1637 PolarHBondContact O-N 2.79Å; V1637-I1679 HydrophobicContact CG2-CD1 3.57Å; V1637-I1685 HydrophobicContact CG2-CD1 4.01Å; V1637-Y1695 HydrophobicContact CB-CD1 4.21Å; V1637-Y1695 HydrophobicContact CG2-CD1 4.28Å; V1637-K1698 HydrophobicContact CB-CD 4.07Å; V1637-K1698 HydrophobicContact CB-CG 4.44Å; V1637-K1698 HydrophobicContact CG1-CB 4.1Å; V1637-K1698 HydrophobicContact CG1-CD 4.03Å; V1637-K1698 HydrophobicContact CG1-CG 3.86Å; V1637-K1698 PolarHBondContact O-NZ 3.48Å; V1637-L1699 HydrophobicContact CG1-CB 4.12Å; V1637-L1702 HydrophobicContact CG1-CD1 3.73Å
1638	H	88	Confident	79.7	Confident	0 Å²	0	22.3 Å²	22.3	0%	0	12%	0.116	C	C	.	.	S	Bend	trans	-70.2	136.7	174.6	-167.4	-71.5	0	0	0	110	L1624 E1625 Y1640 T1641 E1642 E1667 I1685	L1624-H1638 PolarHBondContact O-CD2 3.31Å; E1625-H1638 HydrophobicContact CB-CB 4.15Å; E1625-H1638 HydrophobicContact CG-CB 4.32Å; E1625-H1638 WeakPolarHBondContact OE2-CB 3.4Å; E1625-H1638 PolarHBondContact OE2-N 3.43Å; H1638-Y1640 WeakPolarHBondContact ND1-CB 3.34Å; H1638-Y1640 PolarHBondContact ND1-N 3.14Å; H1638-Y1640 VanDerWaalsContact ND1-N 3.2Å; H1638-Y1640 PolarHBondContact O-N 2.8Å; H1638-Y1640 VanDerWaalsContact O-N 3.17Å; H1638-T1641 WeakPolarHBondContact O-CA 3.42Å; H1638-T1641 WeakPolarHBondContact O-CB 3.33Å; H1638-T1641 PolarHBondContact O-N 2.79Å; H1638-E1642 PolarHBondContact O-N 2.72Å; H1638-E1667 IonicContact CE1-OE1 2.74Å; H1638-E1667 PolarHBondContact CE1-OE1 3.05Å; H1638-E1667 IonicContact NE2-OE1 3.9Å; H1638-E1667 PolarHBondContact NE2-OE1 3.03Å; H1638-I1685 HydrophobicContact CB-CD1 3.62Å; H1638-I1685 HydrophobicContact CB-CG1 4.22Å
1639	P	85.6	Confident	78.8	Confident	43 Å²	43	20.4 Å²	20.4	28%	0.279	11%	0.105	S	C	.	.	H	α-helix	trans	-56.3	-36.2	-177.3	-26.9	35	0	0	0	114	E1642 S1643 Y1664	P1639-E1642 PolarHBondContact O-N 3.47Å; P1639-S1643 PolarHBondContact O-N 3.08Å; P1639-Y1664 HydrophobicContact CB-CD2 4.37Å; P1639-Y1664 HydrophobicContact CB-CE2 4.25Å
1640	Y	83.6	Confident	78.3	Confident	11 Å²	11	20.1 Å²	20.1	4%	0.043	10%	0.102	C	C	.	.	H	α-helix	trans	-59	-52.1	169.1	-171.4	-122.6	0	0	0	112.6	E1437 V1617 N1619 L1624 H1638 E1642 S1643 L1644 Y1664	E1437-Y1640 WeakPolarHBondContact OE2-CE2 3.43Å; E1437-Y1640 PolarHBondContact OE2-OH 3.07Å; V1617-Y1640 HydrophobicContact CG1-CD1 3.59Å; V1617-Y1640 HydrophobicContact CG1-CE1 3.83Å; N1619-Y1640 HydrophobicContact CB-CD1 3.97Å; N1619-Y1640 HydrophobicContact CB-CE1 3.71Å; N1619-Y1640 WeakPolarHBondContact ND2-CE2 3.48Å; L1624-Y1640 HydrophobicContact CD1-CD1 3.6Å; L1624-Y1640 HydrophobicContact CD1-CE1 4.45Å; L1624-Y1640 HydrophobicContact CD1-CG 3.95Å; H1638-Y1640 WeakPolarHBondContact ND1-CB 3.34Å; H1638-Y1640 PolarHBondContact ND1-N 3.14Å; H1638-Y1640 VanDerWaalsContact ND1-N 3.2Å; H1638-Y1640 PolarHBondContact O-N 2.8Å; H1638-Y1640 VanDerWaalsContact O-N 3.17Å; Y1640-E1642 VanDerWaalsContact C-N 3.26Å; Y1640-E1642 PolarHBondContact O-N 2.93Å; Y1640-S1643 WeakPolarHBondContact O-CA 3.4Å; Y1640-S1643 VanDerWaalsContact O-CB 3.29Å; Y1640-S1643 WeakPolarHBondContact O-CB 3.5Å; Y1640-S1643 PolarHBondContact O-N 3.43Å; Y1640-L1644 HydrophobicContact CD1-CD1 4.44Å; Y1640-L1644 HydrophobicContact CD1-CD2 4.23Å; Y1640-L1644 HydrophobicContact CD1-CG 4.4Å; Y1640-L1644 HydrophobicContact CD2-CD2 4Å; Y1640-L1644 HydrophobicContact CE1-CD1 4.11Å; Y1640-L1644 HydrophobicContact CE1-CD2 3.87Å; Y1640-L1644 HydrophobicContact CE1-CG 4.3Å; Y1640-L1644 HydrophobicContact CE2-CD2 3.58Å; Y1640-L1644 HydrophobicContact CG-CD2 4.31Å; Y1640-L1644 VanDerWaalsContact O-CG 3.26Å; Y1640-L1644 WeakPolarHBondContact O-CG 3.39Å; Y1640-L1644 PolarHBondContact O-N 3.44Å; Y1640-Y1664 VanDerWaalsContact CA-CD2 3.5Å; Y1640-Y1664 AromaticContact CD2-CD1 3.58Å; Y1640-Y1664 HydrophobicContact CD2-CD1 3.58Å; Y1640-Y1664 HydrophobicContact CD2-CD2 4.13Å; Y1640-Y1664 AromaticContact CD2-CE1 3.82Å; Y1640-Y1664 HydrophobicContact CD2-CE1 3.82Å; Y1640-Y1664 HydrophobicContact CD2-CE2 4.35Å; Y1640-Y1664 AromaticContact CD2-CG 3.75Å; Y1640-Y1664 HydrophobicContact CD2-CG 3.75Å; Y1640-Y1664 HydrophobicContact CE2-CD1 4.26Å; Y1640-Y1664 HydrophobicContact CG-CD1 4.49Å; Y1640-Y1664 HydrophobicContact CG-CE1 4.37Å; Y1640-Y1664 HydrophobicContact CG-CE2 4.43Å
1641	T	83.8	Confident	77.8	Confident	0 Å²	0	16.2 Å²	16.2	0%	0	8%	0.082	C	C	.	.	H	α-helix	trans	-55.7	-39.3	175.7	-49.1	0	0	0	0	112.2	V1617 E1625 I1632 H1638 L1644 L1645	V1617-T1641 HydrophobicContact CG2-CG2 4.2Å; E1625-T1641 WeakPolarHBondContact OE2-CB 3.48Å; E1625-T1641 PolarHBondContact OE2-OG1 2.95Å; I1632-T1641 HydrophobicContact CG2-CG2 4.11Å; H1638-T1641 WeakPolarHBondContact O-CA 3.42Å; H1638-T1641 WeakPolarHBondContact O-CB 3.33Å; H1638-T1641 PolarHBondContact O-N 2.79Å; T1641-L1644 WeakPolarHBondContact O-CB 3.41Å; T1641-L1644 PolarHBondContact O-N 3.06Å; T1641-L1645 HydrophobicContact CG2-CD1 4Å; T1641-L1645 HydrophobicContact CG2-CG 4.43Å; T1641-L1645 WeakPolarHBondContact O-CB 3.48Å; T1641-L1645 VanDerWaalsContact O-CG 3.26Å; T1641-L1645 WeakPolarHBondContact O-CG 3.34Å; T1641-L1645 PolarHBondContact O-N 2.72Å
1642	E	84.2	Confident	77.5	Confident	50 Å²	50	17 Å²	17	23%	0.234	9%	0.086	C	C	.	.	H	α-helix	trans	-66.6	-39.1	175.2	-68.1	175.7	137.3	0	0	112.6	H1638 P1639 Y1640 L1645 S1646 I1662 K1698	H1638-E1642 PolarHBondContact O-N 2.72Å; P1639-E1642 PolarHBondContact O-N 3.47Å; Y1640-E1642 VanDerWaalsContact C-N 3.26Å; Y1640-E1642 PolarHBondContact O-N 2.93Å; E1642-L1645 PolarHBondContact O-N 3.05Å; E1642-S1646 WeakPolarHBondContact O-CB 3.29Å; E1642-S1646 PolarHBondContact O-N 2.61Å; E1642-I1662 HydrophobicContact CB-CD1 4.34Å; E1642-K1698 WeakPolarHBondContact OE1-CE 3.42Å; E1642-K1698 IonicContact OE1-NZ 2.81Å; E1642-K1698 PolarHBondContact OE1-NZ 3.1Å; E1642-K1698 IonicContact OE2-NZ 3.55Å; E1642-K1698 PolarHBondContact OE2-NZ 2.99Å
1643	S	80.1	Confident	77	Confident	0 Å²	0	16.9 Å²	16.9	0%	0	9%	0.086	C	C	.	.	H	α-helix	trans	-59.4	-49	170	-174.8	0	0	0	0	110.8	P1639 Y1640 L1645 S1646 A1647 I1662 Y1664	P1639-S1643 PolarHBondContact O-N 3.08Å; Y1640-S1643 WeakPolarHBondContact O-CA 3.4Å; Y1640-S1643 VanDerWaalsContact O-CB 3.29Å; Y1640-S1643 WeakPolarHBondContact O-CB 3.5Å; Y1640-S1643 PolarHBondContact O-N 3.43Å; S1643-L1645 VanDerWaalsContact C-N 3.32Å; S1643-L1645 PolarHBondContact O-N 2.93Å; S1643-S1646 PolarHBondContact O-N 2.88Å; S1643-S1646 PolarHBondContact O-OG 3.47Å; S1643-A1647 WeakPolarHBondContact O-CB 3.28Å; S1643-A1647 PolarHBondContact O-N 3.48Å; S1643-I1662 PolarHBondContact OG-O 3.49Å; S1643-Y1664 WeakPolarHBondContact OG-CB 3.44Å; S1643-Y1664 PolarHBondContact OG-N 2.87Å; S1643-Y1664 VanDerWaalsContact OG-N 3.14Å
1644	L	75.6	Confident	76.9	Confident	8 Å²	8	19.2 Å²	19.2	4%	0.042	10%	0.1	C	C	.	.	H	α-helix	trans	-53.5	-50.7	176.2	-52.2	-156.7	0	0	0	110.9	E1437 L1605 V1617 Y1640 T1641 S1646 A1647 I1648	E1437-L1644 HydrophobicContact CB-CD1 4.33Å; E1437-L1644 HydrophobicContact CB-CD2 3.57Å; E1437-L1644 HydrophobicContact CB-CG 4.49Å; E1437-L1644 HydrophobicContact CG-CD2 3.49Å; E1437-L1644 VanDerWaalsContact CG-CD2 3.49Å; E1437-L1644 WeakPolarHBondContact OE2-CD2 3.47Å; L1605-L1644 HydrophobicContact CD1-CB 3.94Å; L1605-L1644 HydrophobicContact CD1-CD1 4.12Å; V1617-L1644 HydrophobicContact CG1-CD1 3.86Å; Y1640-L1644 HydrophobicContact CD1-CD1 4.44Å; Y1640-L1644 HydrophobicContact CD1-CD2 4.23Å; Y1640-L1644 HydrophobicContact CD1-CG 4.4Å; Y1640-L1644 HydrophobicContact CD2-CD2 4Å; Y1640-L1644 HydrophobicContact CE1-CD1 4.11Å; Y1640-L1644 HydrophobicContact CE1-CD2 3.87Å; Y1640-L1644 HydrophobicContact CE1-CG 4.3Å; Y1640-L1644 HydrophobicContact CE2-CD2 3.58Å; Y1640-L1644 HydrophobicContact CG-CD2 4.31Å; Y1640-L1644 VanDerWaalsContact O-CG 3.26Å; Y1640-L1644 WeakPolarHBondContact O-CG 3.39Å; Y1640-L1644 PolarHBondContact O-N 3.44Å; T1641-L1644 WeakPolarHBondContact O-CB 3.41Å; T1641-L1644 PolarHBondContact O-N 3.06Å; L1644-S1646 PolarHBondContact O-N 3.12Å; L1644-A1647 PolarHBondContact O-N 2.76Å; L1644-I1648 VanDerWaalsContact O-CD1 3.3Å; L1644-I1648 WeakPolarHBondContact O-CD1 3.42Å; L1644-I1648 WeakPolarHBondContact O-CG1 3.3Å
1645	L	75.9	Confident	76.6	Confident	32 Å²	32	20.3 Å²	20.3	17%	0.168	11%	0.105	C	C	.	.	H	α-helix	trans	-69.8	-9.4	-178.8	-68.5	172.7	0	0	0	113.8	L1605 Y1633 T1641 E1642 S1643 I1648 R1659	L1605-L1645 HydrophobicContact CD1-CD2 4.12Å; Y1633-L1645 HydrophobicContact CD2-CD2 4.02Å; Y1633-L1645 HydrophobicContact CE2-CD2 3.67Å; T1641-L1645 HydrophobicContact CG2-CD1 4Å; T1641-L1645 HydrophobicContact CG2-CG 4.43Å; T1641-L1645 WeakPolarHBondContact O-CB 3.48Å; T1641-L1645 VanDerWaalsContact O-CG 3.26Å; T1641-L1645 WeakPolarHBondContact O-CG 3.34Å; T1641-L1645 PolarHBondContact O-N 2.72Å; E1642-L1645 PolarHBondContact O-N 3.05Å; S1643-L1645 VanDerWaalsContact C-N 3.32Å; S1643-L1645 PolarHBondContact O-N 2.93Å; L1645-I1648 HydrophobicContact CD2-CD1 4.41Å; L1645-I1648 WeakPolarHBondContact O-CG1 3.46Å; L1645-R1659 PolarHBondContact O-NH2 2.84Å
1646	S	73.3	Confident	76	Confident	8 Å²	8	18.2 Å²	18.2	6%	0.056	10%	0.097	C	C	.	.	H	α-helix	trans	-101.4	-33.9	175.5	83.7	0	0	0	0	113.9	E1642 S1643 L1644 R1659 I1662	E1642-S1646 WeakPolarHBondContact O-CB 3.29Å; E1642-S1646 PolarHBondContact O-N 2.61Å; S1643-S1646 PolarHBondContact O-N 2.88Å; S1643-S1646 PolarHBondContact O-OG 3.47Å; L1644-S1646 PolarHBondContact O-N 3.12Å; S1646-R1659 PolarHBondContact O-NH2 3.12Å; S1646-R1659 VanDerWaalsContact O-NH2 3.16Å; S1646-I1662 WeakPolarHBondContact OG-CA 3.48Å; S1646-I1662 WeakPolarHBondContact OG-CB 3.28Å; S1646-I1662 PolarHBondContact OG-N 3.15Å; S1646-I1662 PolarHBondContact OG-O 3.46Å
1647	A	70.8	Confident	75.3	Confident	1 Å²	1	24.1 Å²	24.1	1%	0.008	12%	0.118	C	C	.	.	H	α-helix	trans	-75.7	-32.6	-167.8	0	0	0	0	0	113.4	V1287 T1288 S1643 L1644 R1661	V1287-A1647 HydrophobicContact CG2-CB 4.03Å; T1288-A1647 HydrophobicContact CG2-CB 3.39Å; S1643-A1647 WeakPolarHBondContact O-CB 3.28Å; S1643-A1647 PolarHBondContact O-N 3.48Å; L1644-A1647 PolarHBondContact O-N 2.76Å; A1647-R1661 PolarHBondContact O-NE 3.12Å
1648	I	69.4	Low	74.4	Confident	0 Å²	0	31.9 Å²	31.9	0%	0	15%	0.154	C	C	.	.			trans	-13.2	133.4	159.7	-33.6	-93.3	0	0	0	115.4	R1434 L1435 L1644 L1645 R1659	R1434-I1648 VanDerWaalsContact CA-CG2 3.5Å; R1434-I1648 HydrophobicContact CB-CB 4.41Å; R1434-I1648 HydrophobicContact CB-CD1 3.93Å; R1434-I1648 HydrophobicContact CB-CG1 4.24Å; R1434-I1648 HydrophobicContact CB-CG2 3.5Å; R1434-I1648 VanDerWaalsContact CB-CG2 3.5Å; R1434-I1648 HydrophobicContact CG-CB 4.15Å; R1434-I1648 HydrophobicContact CG-CD1 4.39Å; R1434-I1648 HydrophobicContact CG-CG1 4.16Å; R1434-I1648 HydrophobicContact CG-CG2 3.37Å; L1435-I1648 WeakPolarHBondContact O-CA 3.46Å; L1435-I1648 VanDerWaalsContact O-CB 3.31Å; L1435-I1648 WeakPolarHBondContact O-CB 3.5Å; L1435-I1648 WeakPolarHBondContact O-CD1 3.1Å; L1435-I1648 WeakPolarHBondContact O-CG1 3.42Å; L1644-I1648 VanDerWaalsContact O-CD1 3.3Å; L1644-I1648 WeakPolarHBondContact O-CD1 3.42Å; L1644-I1648 WeakPolarHBondContact O-CG1 3.3Å; L1645-I1648 HydrophobicContact CD2-CD1 4.41Å; L1645-I1648 WeakPolarHBondContact O-CG1 3.46Å; I1648-R1659 PolarHBondContact O-NH1 3.12Å
1649	P	62.7	Low	73.5	Confident	11 Å²	11	33.9 Å²	33.9	7%	0.071	16%	0.161	C	C	.	.			trans	-81.4	141.1	157	-7.3	25.4	0	0	0	112.4	G1316 V1317	G1316-P1649 WeakPolarHBondContact O-CB 3.47Å; V1317-P1649 HydrophobicContact CG2-CB 4.4Å; V1317-P1649 HydrophobicContact CG2-CG 4.08Å
1650	M	66.8	Low	72.6	Confident	9 Å²	9	42.7 Å²	42.7	4%	0.044	19%	0.189	C	C	.	.			trans	-109.7	138	170.4	-82.4	172.8	65.7	0	0	112	A1319 Q1433 R1434 D1652 H1655 E1656	A1319-M1650 WeakPolarHBondContact CB-O 3.25Å; Q1433-M1650 HydrophobicContact CG-CE 4.2Å; Q1433-M1650 HydrophobicContact CG-CG 4.37Å; Q1433-M1650 HydrophobicContact CG-SD 4.36Å; R1434-M1650 HydrophobicContact CG-CG 3.58Å; R1434-M1650 HydrophobicContact CG-SD 4.04Å; R1434-M1650 PolarHBondContact NE-SD 3.25Å; R1434-M1650 PolarHBondContact NH2-SD 3.29Å; M1650-D1652 HydrophobicContact CE-CB 4.24Å; M1650-D1652 PolarHBondContact O-N 3.4Å; M1650-H1655 HydrophobicContact CE-CB 4.11Å; M1650-H1655 PolarHBondContact SD-CD2 3.36Å; M1650-E1656 HydrophobicContact CB-CG 3.94Å; M1650-E1656 WeakPolarHBondContact CB-OE1 3.46Å; M1650-E1656 PolarHBondContact N-OE1 3.25Å; M1650-E1656 WeakPolarHBondContact O-CG 3.47Å
1651	P	67	Low	72.1	Confident	6 Å²	6	44.9 Å²	44.9	4%	0.039	20%	0.197	C	C	.	.	S	Bend	trans	-67.5	33.6	167.8	-20.1	31.9	0	0	0	115.4	F1343 M1358 I1432	F1343-P1651 HydrophobicContact CD1-CB 4.16Å; F1343-P1651 WeakPolarHBondContact CD1-O 3.48Å; F1343-P1651 HydrophobicContact CE1-CB 3.95Å; M1358-P1651 HydrophobicContact CE-CG 3.53Å; M1358-P1651 HydrophobicContact SD-CB 3.92Å; M1358-P1651 HydrophobicContact SD-CG 3.37Å; M1358-P1651 WeakPolarHBondContact SD-CG 3.36Å; I1432-P1651 HydrophobicContact CD1-CB 4.13Å; I1432-P1651 HydrophobicContact CG1-CB 4.02Å; I1432-P1651 HydrophobicContact CG2-CB 3.74Å; I1432-P1651 HydrophobicContact CG2-CG 3.95Å
1652	D	71.9	Confident	71.5	Confident	45 Å²	45	49.1 Å²	49.1	24%	0.241	22%	0.219	C	C	.	.			trans	-131.4	100.9	-179.8	-179.5	-14.5	0	0	0	108.5	Y1344 M1650 D1654 H1655 E1656	Y1344-D1652 PolarHBondContact OH-OD1 2.86Å; M1650-D1652 HydrophobicContact CE-CB 4.24Å; M1650-D1652 PolarHBondContact O-N 3.4Å; D1652-D1654 PolarHBondContact O-N 3.08Å; D1652-D1654 PolarHBondContact OD1-N 3.24Å; D1652-H1655 HydrophobicContact CB-CB 3.87Å; D1652-H1655 PolarHBondContact O-N 3.07Å; D1652-H1655 PolarHBondContact OD1-N 2.8Å; D1652-H1655 VanDerWaalsContact OD1-N 3.14Å; D1652-H1655 WeakPolarHBondContact OD2-CB 3.28Å; D1652-E1656 PolarHBondContact O-N 3.49Å
1653	P	72.3	Confident	70.8	Confident	1 Å²	1	52.5 Å²	52.5	1%	0.006	23%	0.233	C	C	.	.	H	α-helix	trans	-59.4	-41.6	-175.3	-26.8	35.1	0	0	0	114.1	A1319 A1339 F1343 R1657	A1319-P1653 HydrophobicContact CB-CG 4.07Å; A1339-P1653 HydrophobicContact CB-CB 4.43Å; A1339-P1653 HydrophobicContact CB-CG 4.11Å; F1343-P1653 HydrophobicContact CB-CG 3.99Å; F1343-P1653 HydrophobicContact CD2-CG 3.94Å; F1343-P1653 HydrophobicContact CG-CG 4.03Å; P1653-R1657 WeakPolarHBondContact O-CB 3.49Å; P1653-R1657 VanDerWaalsContact O-CD 3.32Å; P1653-R1657 WeakPolarHBondContact O-CD 3.2Å; P1653-R1657 WeakPolarHBondContact O-CG 3.3Å; P1653-R1657 PolarHBondContact O-N 2.76Å
1654	D	72.1	Confident	70.2	Confident	65 Å²	65	55.2 Å²	55.2	35%	0.348	24%	0.244	S	C	.	.	H	α-helix	trans	-77.2	-27.8	-177.7	-69.8	-35.7	0	0	0	112.9	Y1344 D1652 R1657 Q1658	Y1344-D1654 WeakPolarHBondContact OH-CB 3.4Å; Y1344-D1654 PolarHBondContact OH-N 3.37Å; Y1344-D1654 PolarHBondContact OH-OD2 2.9Å; D1652-D1654 PolarHBondContact O-N 3.08Å; D1652-D1654 PolarHBondContact OD1-N 3.24Å; D1654-R1657 IonicContact OD1-CZ 2.75Å; D1654-R1657 IonicContact OD1-NH1 2.79Å; D1654-R1657 PolarHBondContact OD1-NH1 3.18Å; D1654-Q1658 WeakPolarHBondContact O-CG 3.35Å; D1654-Q1658 PolarHBondContact O-NE2 2.9Å
1655	H	69.2	Low	69.5	Low	76 Å²	76	62.9 Å²	62.9	35%	0.352	28%	0.279	S	S	.	.	H	α-helix	trans	-70.4	-48.7	169.1	-166.5	98.7	0	0	0	111.5	R1434 M1650 D1652 R1657 Q1658 R1659	R1434-H1655 PolarHBondContact NH2-NE2 2.96Å; M1650-H1655 HydrophobicContact CE-CB 4.11Å; M1650-H1655 PolarHBondContact SD-CD2 3.36Å; D1652-H1655 HydrophobicContact CB-CB 3.87Å; D1652-H1655 PolarHBondContact O-N 3.07Å; D1652-H1655 PolarHBondContact OD1-N 2.8Å; D1652-H1655 VanDerWaalsContact OD1-N 3.14Å; D1652-H1655 WeakPolarHBondContact OD2-CB 3.28Å; H1655-R1657 VanDerWaalsContact C-N 3.3Å; H1655-R1657 PolarHBondContact O-N 3.21Å; H1655-Q1658 PolarHBondContact O-N 3.06Å; H1655-R1659 WeakPolarHBondContact O-CB 3.34Å; H1655-R1659 PolarHBondContact O-N 3.31Å
1656	E	70.8	Confident	68.7	Low	11 Å²	11	66.1 Å²	66.1	5%	0.051	30%	0.3	C	S	.	.	H	α-helix	trans	-59.2	-39.4	177.4	-79.1	-64.3	113.5	0	0	112.1	N1320 M1650 D1652 Q1658 R1659 R1661	N1320-E1656 HydrophobicContact CB-CB 4.47Å; N1320-E1656 HydrophobicContact CB-CG 4.43Å; N1320-E1656 PolarHBondContact ND2-OE2 2.8Å; M1650-E1656 HydrophobicContact CB-CG 3.94Å; M1650-E1656 WeakPolarHBondContact CB-OE1 3.46Å; M1650-E1656 PolarHBondContact N-OE1 3.25Å; M1650-E1656 WeakPolarHBondContact O-CG 3.47Å; D1652-E1656 PolarHBondContact O-N 3.49Å; E1656-Q1658 PolarHBondContact O-N 3.2Å; E1656-R1659 PolarHBondContact O-N 2.96Å; E1656-R1659 WeakPolarHBondContact OE1-CD 3.29Å; E1656-R1659 IonicContact OE1-CZ 2.69Å; E1656-R1659 IonicContact OE1-NE 3.63Å; E1656-R1659 IonicContact OE1-NH1 3.79Å; E1656-R1659 PolarHBondContact OE1-NH1 2.62Å; E1656-R1661 IonicContact OE2-NH2 3.3Å; E1656-R1661 PolarHBondContact OE2-NH2 2.95Å
1657	R	70.5	Confident	68	Low	129 Å²	129	67.4 Å²	67.4	49%	0.487	31%	0.305	S	S	.	.	H	α-helix	trans	-57.8	-26.4	174.2	-78.9	165.2	177.1	169.9	-2.2	114.5	E1340 P1653 D1654 H1655	E1340-R1657 IonicContact OE1-CZ 2.78Å; E1340-R1657 IonicContact OE1-NH1 2.68Å; E1340-R1657 PolarHBondContact OE1-NH1 3.07Å; E1340-R1657 IonicContact OE1-NH2 2.76Å; E1340-R1657 PolarHBondContact OE1-NH2 3.23Å; P1653-R1657 WeakPolarHBondContact O-CB 3.49Å; P1653-R1657 VanDerWaalsContact O-CD 3.32Å; P1653-R1657 WeakPolarHBondContact O-CD 3.2Å; P1653-R1657 WeakPolarHBondContact O-CG 3.3Å; P1653-R1657 PolarHBondContact O-N 2.76Å; D1654-R1657 IonicContact OD1-CZ 2.75Å; D1654-R1657 IonicContact OD1-NH1 2.79Å; D1654-R1657 PolarHBondContact OD1-NH1 3.18Å; H1655-R1657 VanDerWaalsContact C-N 3.3Å; H1655-R1657 PolarHBondContact O-N 3.21Å
1658	Q	68.3	Low	66.9	Low	163 Å²	163	69.4 Å²	69.4	76%	0.762	32%	0.319	S	S	*	.	H	α-helix	trans	-104.3	-8.1	-179.1	-65.4	-179.4	54.4	0	0	113.3	D1654 H1655 E1656	D1654-Q1658 WeakPolarHBondContact O-CG 3.35Å; D1654-Q1658 PolarHBondContact O-NE2 2.9Å; H1655-Q1658 PolarHBondContact O-N 3.06Å; E1656-Q1658 PolarHBondContact O-N 3.2Å
1659	R	70.1	Confident	66.1	Low	42 Å²	42	72.2 Å²	72.2	16%	0.158	33%	0.333	C	S	.	.			trans	-76.4	140.2	-167.9	-161.2	173.5	-179.1	-161.9	-10.9	112.1	L1645 S1646 I1648 H1655 E1656	L1645-R1659 PolarHBondContact O-NH2 2.84Å; S1646-R1659 PolarHBondContact O-NH2 3.12Å; S1646-R1659 VanDerWaalsContact O-NH2 3.16Å; I1648-R1659 PolarHBondContact O-NH1 3.12Å; H1655-R1659 WeakPolarHBondContact O-CB 3.34Å; H1655-R1659 PolarHBondContact O-N 3.31Å; E1656-R1659 PolarHBondContact O-N 2.96Å; E1656-R1659 WeakPolarHBondContact OE1-CD 3.29Å; E1656-R1659 IonicContact OE1-CZ 2.69Å; E1656-R1659 IonicContact OE1-NE 3.63Å; E1656-R1659 IonicContact OE1-NH1 3.79Å; E1656-R1659 PolarHBondContact OE1-NH1 2.62Å
1660	R	65.7	Low	66.3	Low	228 Å²	228	71.7 Å²	71.7	86%	0.86	33%	0.33	S	S	*	.			trans	-106.4	124.4	170.8	-64.4	-177.5	179.8	-175	-1.3	109.3
1661	R	72.7	Confident	66.1	Low	58 Å²	58	72.3 Å²	72.3	22%	0.219	34%	0.339	C	S	.	.			trans	-85.7	140.6	174.9	-64	-178.5	173	135.3	5.7	109.9	A1291 N1320 A1647 E1656	A1291-R1661 PolarHBondContact O-NH1 3.21Å; N1320-R1661 PolarHBondContact ND2-NH2 3.26Å; A1647-R1661 PolarHBondContact O-NE 3.12Å; E1656-R1661 IonicContact OE2-NH2 3.3Å; E1656-R1661 PolarHBondContact OE2-NH2 2.95Å
1662	I	72.6	Confident	66.2	Low	88 Å²	88	74.3 Å²	74.3	45%	0.451	35%	0.347	S	S	.	.			trans	-91.5	114.4	174.1	-56.6	172.4	0	0	0	106	E1642 S1643 S1646	E1642-I1662 HydrophobicContact CB-CD1 4.34Å; S1643-I1662 PolarHBondContact OG-O 3.49Å; S1646-I1662 WeakPolarHBondContact OG-CA 3.48Å; S1646-I1662 WeakPolarHBondContact OG-CB 3.28Å; S1646-I1662 PolarHBondContact OG-N 3.15Å; S1646-I1662 PolarHBondContact OG-O 3.46Å
1663	K	68.6	Low	66.2	Low	122 Å²	122	75.9 Å²	75.9	53%	0.53	37%	0.366	S	S	.	.	P	Polyproline II helix	trans	-81.6	118.7	172.6	-63	-171.6	179	-174.6	0	107.8	E1295 Q1665	E1295-K1663 IonicContact OE2-NZ 3.55Å; E1295-K1663 PolarHBondContact OE2-NZ 3.37Å; K1663-Q1665 PolarHBondContact O-N 2.83Å
1664	Y	68	Low	66.6	Low	56 Å²	56	77.3 Å²	77.3	22%	0.22	37%	0.372	C	S	.	.	P	Polyproline II helix	trans	-56.5	123.7	174.2	179.7	-127	0	0	0	110.1	P1639 Y1640 S1643 E1667	P1639-Y1664 HydrophobicContact CB-CD2 4.37Å; P1639-Y1664 HydrophobicContact CB-CE2 4.25Å; Y1640-Y1664 VanDerWaalsContact CA-CD2 3.5Å; Y1640-Y1664 AromaticContact CD2-CD1 3.58Å; Y1640-Y1664 HydrophobicContact CD2-CD1 3.58Å; Y1640-Y1664 HydrophobicContact CD2-CD2 4.13Å; Y1640-Y1664 AromaticContact CD2-CE1 3.82Å; Y1640-Y1664 HydrophobicContact CD2-CE1 3.82Å; Y1640-Y1664 HydrophobicContact CD2-CE2 4.35Å; Y1640-Y1664 AromaticContact CD2-CG 3.75Å; Y1640-Y1664 HydrophobicContact CD2-CG 3.75Å; Y1640-Y1664 HydrophobicContact CE2-CD1 4.26Å; Y1640-Y1664 HydrophobicContact CG-CD1 4.49Å; Y1640-Y1664 HydrophobicContact CG-CE1 4.37Å; Y1640-Y1664 HydrophobicContact CG-CE2 4.43Å; S1643-Y1664 WeakPolarHBondContact OG-CB 3.44Å; S1643-Y1664 PolarHBondContact OG-N 2.87Å; S1643-Y1664 VanDerWaalsContact OG-N 3.14Å; Y1664-E1667 PolarHBondContact OH-N 3.42Å
1665	Q	61.4	Low	67.2	Low	169 Å²	169	76.7 Å²	76.7	79%	0.79	37%	0.372	S	S	*	.	P	Polyproline II helix	trans	-94.3	123.7	161.1	-65.5	-178.7	-5.8	0	0	106.4	K1663 E1667	K1663-Q1665 PolarHBondContact O-N 2.83Å; Q1665-E1667 PolarHBondContact O-N 2.82Å
1666	T	58.8	Low	68	Low	100 Å²	100	76.5 Å²	76.5	61%	0.613	37%	0.373	S	S	*	.	P	Polyproline II helix	trans	-49.7	128.1	174.6	-41.5	0	0	0	0	109.1	P1668	T1666-P1668 VanDerWaalsContact O-N 3.14Å
1667	E	57.8	Low	68.9	Low	35 Å²	35	78.7 Å²	78.7	16%	0.164	38%	0.381	C	S	.	.	P	Polyproline II helix	trans	-51.4	125.8	178.6	-67.5	-163.1	157.6	0	0	109.3	H1638 Y1664 Q1665 N1669 R1674 Y1695	H1638-E1667 IonicContact CE1-OE1 2.74Å; H1638-E1667 PolarHBondContact CE1-OE1 3.05Å; H1638-E1667 IonicContact NE2-OE1 3.9Å; H1638-E1667 PolarHBondContact NE2-OE1 3.03Å; Y1664-E1667 PolarHBondContact OH-N 3.42Å; Q1665-E1667 PolarHBondContact O-N 2.82Å; E1667-N1669 PolarHBondContact O-N 3.39Å; E1667-R1674 IonicContact OE2-CZ 2.95Å; E1667-R1674 IonicContact OE2-NE 3.9Å; E1667-R1674 PolarHBondContact OE2-NE 2.81Å; E1667-Y1695 PolarHBondContact OE1-OH 2.85Å
1668	P	48.3	Very low	69.9	Low	44 Å²	44	77.2 Å²	77.2	29%	0.286	38%	0.38	S	S	.	.	P	Polyproline II helix	trans	-60.2	127.2	178.9	27.3	-34.6	0	0	0	107.9	K406 E410 T1666 D1670	K406-P1668 HydrophobicContact CB-CB 4.08Å; K406-P1668 HydrophobicContact CD-CB 3.74Å; K406-P1668 HydrophobicContact CG-CB 3.79Å; E410-P1668 VanDerWaalsContact OE1-CB 3.3Å; E410-P1668 WeakPolarHBondContact OE1-CB 3.27Å; E410-P1668 WeakPolarHBondContact OE1-CG 3.25Å; E410-P1668 WeakPolarHBondContact OE2-CG 3.36Å; T1666-P1668 VanDerWaalsContact O-N 3.14Å; P1668-D1670 PolarHBondContact O-N 3.35Å
1669	N	53.1	Low	71	Confident	58 Å²	58	70 Å²	70	31%	0.31	35%	0.347	S	S	.	.			trans	-69.1	108.5	-174.5	-168.1	-8.8	0	0	0	108.2	D403 K406 K407 E1667	D403-N1669 WeakPolarHBondContact OD1-CB 3.49Å; D403-N1669 VanDerWaalsContact OD1-CG 3.24Å; D403-N1669 PolarHBondContact OD1-ND2 3.2Å; K406-N1669 WeakPolarHBondContact CB-O 3.42Å; K407-N1669 VanDerWaalsContact CE-OD1 3.27Å; K407-N1669 WeakPolarHBondContact CE-OD1 3.36Å; K407-N1669 WeakPolarHBondContact CG-O 3.25Å; K407-N1669 PolarHBondContact N-O 2.83Å; K407-N1669 VanDerWaalsContact N-O 3.12Å; K407-N1669 VanDerWaalsContact NZ-CG 3.33Å; K407-N1669 PolarHBondContact NZ-ND2 2.84Å; K407-N1669 VanDerWaalsContact NZ-ND2 3.17Å; E1667-N1669 PolarHBondContact O-N 3.39Å
1670	D	65.9	Low	71.8	Confident	0 Å²	0	68.9 Å²	68.9	0%	0	35%	0.346	C	S	.	.			trans	-98.6	-3.7	-171.7	71.2	1.4	0	0	0	114.4	K407 E410 P1668 K1672 R1674	K407-D1670 WeakPolarHBondContact CA-O 3.41Å; E410-D1670 HydrophobicContact CB-CB 3.55Å; E410-D1670 HydrophobicContact CG-CB 4.26Å; P1668-D1670 PolarHBondContact O-N 3.35Å; D1670-K1672 HydrophobicContact CB-CG 4.47Å; D1670-K1672 PolarHBondContact O-N 3.33Å; D1670-K1672 VanDerWaalsContact OD1-CB 3.26Å; D1670-K1672 WeakPolarHBondContact OD1-CB 3.44Å; D1670-K1672 WeakPolarHBondContact OD1-CG 3.49Å; D1670-K1672 PolarHBondContact OD1-N 3.18Å; D1670-K1672 WeakPolarHBondContact OD2-CD 3.36Å; D1670-K1672 WeakPolarHBondContact OD2-CE 3.37Å; D1670-K1672 WeakPolarHBondContact OD2-CG 3.13Å; D1670-K1672 IonicContact OD2-NZ 3.15Å; D1670-K1672 PolarHBondContact OD2-NZ 2.87Å; D1670-R1674 VanDerWaalsContact CG-NH2 3.35Å; D1670-R1674 IonicContact OD1-CZ 2.76Å; D1670-R1674 IonicContact OD1-NH1 2.76Å; D1670-R1674 PolarHBondContact OD1-NH1 3.37Å; D1670-R1674 IonicContact OD1-NH2 3.22Å; D1670-R1674 IonicContact OD2-CZ 3.23Å; D1670-R1674 IonicContact OD2-NH1 2.83Å; D1670-R1674 PolarHBondContact OD2-NH1 3.19Å; D1670-R1674 IonicContact OD2-NH2 3.05Å; D1670-R1674 PolarHBondContact OD2-NH2 3.45Å
1671	G	63.8	Low	72.7	Confident	22 Å²	22	63.8 Å²	63.8	23%	0.227	34%	0.343	C	S	.	.			trans	71.8	2.3	-178.9	0	0	0	0	0	114.5
1672	K	68.3	Low	73	Confident	48 Å²	48	62 Å²	62	21%	0.209	34%	0.342	C	S	.	.			trans	-74	135.9	167.9	-55.5	177.8	-152.1	151.6	0	108.3	D1670 R1674 S1688 D1690	D1670-K1672 HydrophobicContact CB-CG 4.47Å; D1670-K1672 PolarHBondContact O-N 3.33Å; D1670-K1672 VanDerWaalsContact OD1-CB 3.26Å; D1670-K1672 WeakPolarHBondContact OD1-CB 3.44Å; D1670-K1672 WeakPolarHBondContact OD1-CG 3.49Å; D1670-K1672 PolarHBondContact OD1-N 3.18Å; D1670-K1672 WeakPolarHBondContact OD2-CD 3.36Å; D1670-K1672 WeakPolarHBondContact OD2-CE 3.37Å; D1670-K1672 WeakPolarHBondContact OD2-CG 3.13Å; D1670-K1672 IonicContact OD2-NZ 3.15Å; D1670-K1672 PolarHBondContact OD2-NZ 2.87Å; K1672-R1674 VanDerWaalsContact C-N 3.33Å; K1672-R1674 PolarHBondContact O-N 3.48Å; K1672-S1688 VanDerWaalsContact CD-CB 3.44Å; K1672-D1690 WeakPolarHBondContact CD-OD2 3.32Å; K1672-D1690 WeakPolarHBondContact CE-OD2 3.27Å; K1672-D1690 IonicContact NZ-OD2 2.79Å; K1672-D1690 PolarHBondContact NZ-OD2 3.06Å
1673	A	72.2	Confident	73.8	Confident	79 Å²	79	57.8 Å²	57.8	65%	0.653	32%	0.32	S	S	*	.			trans	-69.5	89	176	0	0	0	0	0	110.7	R1677	A1673-R1677 PolarHBondContact O-NH2 3.42Å
1674	R	81.4	Confident	74.8	Confident	31 Å²	31	54.7 Å²	54.7	12%	0.117	31%	0.307	C	S	.	.			trans	-66.8	138.6	172.8	-71.4	-173	176.4	55.3	17.4	110.5	E1667 D1670 K1672 Y1686 S1687 E1691	E1667-R1674 IonicContact OE2-CZ 2.95Å; E1667-R1674 IonicContact OE2-NE 3.9Å; E1667-R1674 PolarHBondContact OE2-NE 2.81Å; D1670-R1674 VanDerWaalsContact CG-NH2 3.35Å; D1670-R1674 IonicContact OD1-CZ 2.76Å; D1670-R1674 IonicContact OD1-NH1 2.76Å; D1670-R1674 PolarHBondContact OD1-NH1 3.37Å; D1670-R1674 IonicContact OD1-NH2 3.22Å; D1670-R1674 IonicContact OD2-CZ 3.23Å; D1670-R1674 IonicContact OD2-NH1 2.83Å; D1670-R1674 PolarHBondContact OD2-NH1 3.19Å; D1670-R1674 IonicContact OD2-NH2 3.05Å; D1670-R1674 PolarHBondContact OD2-NH2 3.45Å; K1672-R1674 VanDerWaalsContact C-N 3.33Å; K1672-R1674 PolarHBondContact O-N 3.48Å; R1674-Y1686 HydrophobicContact CB-CD1 3.67Å; R1674-Y1686 HydrophobicContact CB-CD2 4.3Å; R1674-Y1686 HydrophobicContact CB-CE1 3.36Å; R1674-Y1686 HydrophobicContact CB-CE2 4.02Å; R1674-Y1686 HydrophobicContact CB-CG 4.13Å; R1674-Y1686 HydrophobicContact CG-CD1 4.33Å; R1674-Y1686 HydrophobicContact CG-CE1 4.19Å; R1674-Y1686 WeakPolarHBondContact O-CE2 3.42Å; R1674-S1687 WeakPolarHBondContact CA-O 3.26Å; R1674-E1691 IonicContact CZ-OE1 3.18Å; R1674-E1691 IonicContact CZ-OE2 3.67Å; R1674-E1691 IonicContact NE-OE1 3.14Å; R1674-E1691 IonicContact NE-OE2 2.9Å; R1674-E1691 IonicContact NH2-OE1 2.92Å; R1674-E1691 PolarHBondContact NH2-OE1 2.69Å; R1674-E1691 IonicContact NH2-OE2 2.56Å
1675	S	83.9	Confident	75.9	Confident	52 Å²	52	52 Å²	52	36%	0.364	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152	165.5	173.3	60.5	0	0	0	0	109.7	R1677 I1685 Y1686 S1687	S1675-R1677 PolarHBondContact O-N 2.63Å; S1675-R1677 VanDerWaalsContact O-N 3.1Å; S1675-I1685 VanDerWaalsContact O-O 3.12Å; S1675-Y1686 WeakPolarHBondContact O-CA 3.25Å; S1675-S1687 PolarHBondContact N-O 2.99Å; S1675-S1687 PolarHBondContact O-N 2.75Å
1676	L	86	Confident	77.2	Confident	71 Å²	71	46.4 Å²	46.4	37%	0.372	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.1	109	175.6	-76.8	173.2	0	0	0	110.3	L1623 V1626 F1684	L1623-L1676 HydrophobicContact CB-CD1 3.98Å; L1623-L1676 HydrophobicContact CB-CD2 4.44Å; L1623-L1676 HydrophobicContact CD1-CD1 4.26Å; L1623-L1676 WeakPolarHBondContact O-CD2 3.37Å; V1626-L1676 HydrophobicContact CG2-CD1 4.08Å; V1626-L1676 HydrophobicContact CG2-CD2 3.92Å; L1676-F1684 HydrophobicContact CB-CB 4.39Å; L1676-F1684 HydrophobicContact CD2-CB 4.21Å
1677	R	89.8	Confident	78.6	Confident	57 Å²	57	41.6 Å²	41.6	22%	0.215	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	140.3	-178.8	-64.5	172.3	-171.9	-95.7	7.7	110.7	A1673 S1675 I1679 F1684 I1685 S1687 S1688 E1689 V1692	A1673-R1677 PolarHBondContact O-NH2 3.42Å; S1675-R1677 PolarHBondContact O-N 2.63Å; S1675-R1677 VanDerWaalsContact O-N 3.1Å; R1677-I1679 PolarHBondContact O-N 3.34Å; R1677-F1684 CarbonylContact O-C 3.41Å; R1677-F1684 VanDerWaalsContact O-CA 3.22Å; R1677-F1684 WeakPolarHBondContact O-CA 3.42Å; R1677-I1685 PolarHBondContact N-O 3.3Å; R1677-I1685 PolarHBondContact O-N 3.29Å; R1677-S1687 VanDerWaalsContact CD-O 3.24Å; R1677-S1687 WeakPolarHBondContact CD-O 3.31Å; R1677-S1687 PolarHBondContact NE-O 3.44Å; R1677-S1688 VanDerWaalsContact CD-O 3.28Å; R1677-S1688 WeakPolarHBondContact CD-O 3.27Å; R1677-S1688 PolarHBondContact NE-O 2.8Å; R1677-E1689 IonicContact CZ-OE2 2.93Å; R1677-E1689 IonicContact NH1-OE2 2.86Å; R1677-E1689 PolarHBondContact NH1-OE2 3.14Å; R1677-E1689 IonicContact NH2-OE2 3.04Å; R1677-V1692 HydrophobicContact CB-CG2 3.71Å; R1677-V1692 HydrophobicContact CG-CG2 4.27Å
1678	E	90.8	Very high	79.9	Confident	98 Å²	98	40 Å²	40	46%	0.458	23%	0.232	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-79	118.1	-175	-162.9	169.8	-146.4	0	0	112.1	A1680 P1681 G1682 F1684 K1696	E1678-A1680 WeakPolarHBondContact CG-O 3.35Å; E1678-P1681 WeakPolarHBondContact OE1-CA 3.31Å; E1678-G1682 PolarHBondContact OE1-N 3Å; E1678-F1684 HydrophobicContact CB-CD1 3.85Å; E1678-F1684 HydrophobicContact CB-CE1 3.68Å; E1678-F1684 HydrophobicContact CB-CZ 4.25Å; E1678-F1684 HydrophobicContact CG-CD1 4.32Å; E1678-F1684 HydrophobicContact CG-CE1 3.99Å; E1678-F1684 HydrophobicContact CG-CE2 4.44Å; E1678-F1684 HydrophobicContact CG-CZ 4.03Å; E1678-K1696 WeakPolarHBondContact O-CE 3.17Å; E1678-K1696 PolarHBondContact O-NZ 2.81Å
1679	I	90.8	Very high	81.6	Confident	12 Å²	12	44.9 Å²	44.9	6%	0.062	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	-35.6	177	53.9	170.1	0	0	0	112.7	V1637 R1677 H1683 I1685 V1692 K1696 L1699	V1637-I1679 HydrophobicContact CG2-CD1 3.57Å; R1677-I1679 PolarHBondContact O-N 3.34Å; I1679-H1683 HydrophobicContact CG1-CB 4.37Å; I1679-H1683 VanDerWaalsContact CG1-O 3.27Å; I1679-H1683 WeakPolarHBondContact CG1-O 3.09Å; I1679-H1683 PolarHBondContact N-O 3.32Å; I1679-I1685 HydrophobicContact CD1-CB 4.32Å; I1679-I1685 HydrophobicContact CD1-CG2 4.08Å; I1679-I1685 HydrophobicContact CG1-CG2 4.32Å; I1679-I1685 HydrophobicContact CG2-CG2 3.58Å; I1679-V1692 HydrophobicContact CG2-CG1 4.2Å; I1679-K1696 VanDerWaalsContact CA-CE 3.5Å; I1679-K1696 HydrophobicContact CB-CG 3.99Å; I1679-K1696 HydrophobicContact CG2-CG 4.21Å; I1679-K1696 WeakPolarHBondContact O-CE 3.24Å; I1679-K1696 VanDerWaalsContact O-CG 3.3Å; I1679-K1696 WeakPolarHBondContact O-CG 3.39Å; I1679-L1699 HydrophobicContact CD1-CD2 3.9Å; I1679-L1699 HydrophobicContact CG1-CD2 4.1Å
1680	A	87.3	Confident	83	Confident	19 Å²	19	46 Å²	46	16%	0.157	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	161.5	167.3	0	0	0	0	0	108.9	E1678 G1682 H1683 L1699	E1678-A1680 WeakPolarHBondContact CG-O 3.35Å; A1680-G1682 PolarHBondContact O-N 3.25Å; A1680-H1683 HydrophobicContact CB-CB 4.18Å; A1680-H1683 PolarHBondContact N-O 3.21Å; A1680-H1683 WeakPolarHBondContact O-CA 3.41Å; A1680-H1683 PolarHBondContact O-N 2.86Å; A1680-H1683 VanDerWaalsContact O-O 3.07Å; A1680-L1699 HydrophobicContact CB-CD2 3.7Å
1681	P	84.6	Confident	84	Confident	120 Å²	120	47.3 Å²	47.3	78%	0.779	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.5	111	-175.7	-27.6	36.4	0	0	0	112.8	E1678	E1678-P1681 WeakPolarHBondContact OE1-CA 3.31Å
1682	G	80.2	Confident	85.1	Confident	20 Å²	20	47.1 Å²	47.1	21%	0.206	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	89.3	-9.5	-175.9	0	0	0	0	0	116.2	R1614 E1678 A1680 F1684	R1614-G1682 PolarHBondContact NH2-O 3.4Å; E1678-G1682 PolarHBondContact OE1-N 3Å; A1680-G1682 PolarHBondContact O-N 3.25Å; G1682-F1684 WeakPolarHBondContact O-CD2 3.18Å
1683	H	89.7	Confident	85.9	Confident	0 Å²	0	48.2 Å²	48.2	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	110.5	179.8	-168.4	172.8	0	0	0	110.3	E1625 V1626 I1679 A1680	E1625-H1683 IonicContact OE1-CD2 3.94Å; E1625-H1683 IonicContact OE1-CE1 2.65Å; E1625-H1683 IonicContact OE1-NE2 3.97Å; E1625-H1683 PolarHBondContact OE1-NE2 3.14Å; V1626-H1683 CarbonylContact O-C 3.55Å; V1626-H1683 WeakPolarHBondContact O-CA 3.33Å; I1679-H1683 HydrophobicContact CG1-CB 4.37Å; I1679-H1683 VanDerWaalsContact CG1-O 3.27Å; I1679-H1683 WeakPolarHBondContact CG1-O 3.09Å; I1679-H1683 PolarHBondContact N-O 3.32Å; A1680-H1683 HydrophobicContact CB-CB 4.18Å; A1680-H1683 PolarHBondContact N-O 3.21Å; A1680-H1683 WeakPolarHBondContact O-CA 3.41Å; A1680-H1683 PolarHBondContact O-N 2.86Å; A1680-H1683 VanDerWaalsContact O-O 3.07Å
1684	F	88.7	Confident	86.7	Confident	58 Å²	58	51 Å²	51	25%	0.254	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	148.8	-177.4	-57.8	-103.3	0	0	0	110.3	V1626 L1676 R1677 E1678 G1682	V1626-F1684 HydrophobicContact CB-CB 4.42Å; V1626-F1684 PolarHBondContact N-O 3.12Å; V1626-F1684 PolarHBondContact O-N 3.18Å; L1676-F1684 HydrophobicContact CB-CB 4.39Å; L1676-F1684 HydrophobicContact CD2-CB 4.21Å; R1677-F1684 CarbonylContact O-C 3.41Å; R1677-F1684 VanDerWaalsContact O-CA 3.22Å; R1677-F1684 WeakPolarHBondContact O-CA 3.42Å; E1678-F1684 HydrophobicContact CB-CD1 3.85Å; E1678-F1684 HydrophobicContact CB-CE1 3.68Å; E1678-F1684 HydrophobicContact CB-CZ 4.25Å; E1678-F1684 HydrophobicContact CG-CD1 4.32Å; E1678-F1684 HydrophobicContact CG-CE1 3.99Å; E1678-F1684 HydrophobicContact CG-CE2 4.44Å; E1678-F1684 HydrophobicContact CG-CZ 4.03Å; G1682-F1684 WeakPolarHBondContact O-CD2 3.18Å
1685	I	91.6	Very high	87.2	Confident	0 Å²	0	49.9 Å²	49.9	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137	143.1	174	-170.5	160.5	0	0	0	110.5	L1624 E1625 V1637 H1638 S1675 R1677 I1679 S1687 Y1695	L1624-I1685 WeakPolarHBondContact O-CG1 3.49Å; E1625-I1685 HydrophobicContact CG-CB 4.29Å; E1625-I1685 HydrophobicContact CG-CD1 4.29Å; E1625-I1685 HydrophobicContact CG-CG1 4.2Å; V1637-I1685 HydrophobicContact CG2-CD1 4.01Å; H1638-I1685 HydrophobicContact CB-CD1 3.62Å; H1638-I1685 HydrophobicContact CB-CG1 4.22Å; S1675-I1685 VanDerWaalsContact O-O 3.12Å; R1677-I1685 PolarHBondContact N-O 3.3Å; R1677-I1685 PolarHBondContact O-N 3.29Å; I1679-I1685 HydrophobicContact CD1-CB 4.32Å; I1679-I1685 HydrophobicContact CD1-CG2 4.08Å; I1679-I1685 HydrophobicContact CG1-CG2 4.32Å; I1679-I1685 HydrophobicContact CG2-CG2 3.58Å; I1685-S1687 PolarHBondContact O-N 3.27Å; I1685-S1687 PolarHBondContact O-OG 2.98Å; I1685-Y1695 HydrophobicContact CD1-CD1 3.55Å; I1685-Y1695 HydrophobicContact CD1-CD2 3.87Å; I1685-Y1695 HydrophobicContact CD1-CE1 3.53Å; I1685-Y1695 HydrophobicContact CD1-CE2 3.85Å; I1685-Y1695 HydrophobicContact CD1-CG 3.73Å; I1685-Y1695 HydrophobicContact CG1-CD2 4.38Å; I1685-Y1695 HydrophobicContact CG1-CE2 4.3Å; I1685-Y1695 HydrophobicContact CG2-CD2 3.83Å; I1685-Y1695 HydrophobicContact CG2-CE2 4.45Å; I1685-Y1695 HydrophobicContact CG2-CG 4.13Å
1686	Y	87.8	Confident	87.4	Confident	50 Å²	50	52 Å²	52	20%	0.196	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	103.9	176.6	-171.6	-108.5	0	0	0	109.1	H1622 L1623 L1624 R1674 S1675	H1622-Y1686 PolarHBondContact CE1-OH 3Å; H1622-Y1686 AromaticContact ND1-CE2 3.84Å; H1622-Y1686 AromaticContact ND1-CZ 3.4Å; H1622-Y1686 PolarHBondContact ND1-OH 2.76Å; L1623-Y1686 WeakPolarHBondContact O-CB 3.41Å; L1624-Y1686 HydrophobicContact CD2-CD1 3.66Å; L1624-Y1686 HydrophobicContact CD2-CE1 4.38Å; L1624-Y1686 HydrophobicContact CD2-CG 4.11Å; L1624-Y1686 WeakPolarHBondContact O-CB 3.39Å; L1624-Y1686 PolarHBondContact O-N 3.39Å; R1674-Y1686 HydrophobicContact CB-CD1 3.67Å; R1674-Y1686 HydrophobicContact CB-CD2 4.3Å; R1674-Y1686 HydrophobicContact CB-CE1 3.36Å; R1674-Y1686 HydrophobicContact CB-CE2 4.02Å; R1674-Y1686 HydrophobicContact CB-CG 4.13Å; R1674-Y1686 HydrophobicContact CG-CD1 4.33Å; R1674-Y1686 HydrophobicContact CG-CE1 4.19Å; R1674-Y1686 WeakPolarHBondContact O-CE2 3.42Å; S1675-Y1686 WeakPolarHBondContact O-CA 3.25Å
1687	S	88.2	Confident	87.5	Confident	0 Å²	0	56.6 Å²	56.6	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.4	159.4	-166.5	51.3	0	0	0	0	112.5	R1674 S1675 R1677 I1685 E1691	R1674-S1687 WeakPolarHBondContact CA-O 3.26Å; S1675-S1687 PolarHBondContact N-O 2.99Å; S1675-S1687 PolarHBondContact O-N 2.75Å; R1677-S1687 VanDerWaalsContact CD-O 3.24Å; R1677-S1687 WeakPolarHBondContact CD-O 3.31Å; R1677-S1687 PolarHBondContact NE-O 3.44Å; I1685-S1687 PolarHBondContact O-N 3.27Å; I1685-S1687 PolarHBondContact O-OG 2.98Å; S1687-E1691 VanDerWaalsContact CA-OE2 3.29Å; S1687-E1691 WeakPolarHBondContact CA-OE2 3.42Å; S1687-E1691 WeakPolarHBondContact CB-OE2 3.38Å
1688	S	86.3	Confident	87.5	Confident	2 Å²	2	55.3 Å²	55.3	1%	0.014	28%	0.282	C	S	.	.			trans	-68.9	172.9	162.1	74.3	0	0	0	0	110.6	K1672 R1677 D1690 E1691 V1692	K1672-S1688 VanDerWaalsContact CD-CB 3.44Å; R1677-S1688 VanDerWaalsContact CD-O 3.28Å; R1677-S1688 WeakPolarHBondContact CD-O 3.27Å; R1677-S1688 PolarHBondContact NE-O 2.8Å; S1688-D1690 VanDerWaalsContact CB-OD1 3.25Å; S1688-D1690 WeakPolarHBondContact CB-OD1 3.48Å; S1688-D1690 PolarHBondContact OG-OD1 2.78Å; S1688-D1690 PolarHBondContact OG-OD2 3.32Å; S1688-E1691 PolarHBondContact N-OE2 2.89Å; S1688-E1691 WeakPolarHBondContact OG-CB 3.13Å; S1688-E1691 WeakPolarHBondContact OG-CG 3.33Å; S1688-E1691 PolarHBondContact OG-N 3.21Å; S1688-E1691 PolarHBondContact OG-OE2 2.91Å; S1688-V1692 WeakPolarHBondContact O-CG2 3.44Å
1689	E	83.4	Confident	87.3	Confident	146 Å²	146	51 Å²	51	68%	0.682	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.7	-30.4	-176.8	-157.3	152.9	139.1	0	0	112.8	R1677 V1692	R1677-E1689 IonicContact CZ-OE2 2.93Å; R1677-E1689 IonicContact NH1-OE2 2.86Å; R1677-E1689 PolarHBondContact NH1-OE2 3.14Å; R1677-E1689 IonicContact NH2-OE2 3.04Å; E1689-V1692 WeakPolarHBondContact O-CB 3.49Å
1690	D	82.5	Confident	87.1	Confident	80 Å²	80	55.4 Å²	55.4	43%	0.428	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.9	-45.2	174.4	42.4	-62.4	0	0	0	112.6	K1672 S1688 V1692 A1693	K1672-D1690 WeakPolarHBondContact CD-OD2 3.32Å; K1672-D1690 WeakPolarHBondContact CE-OD2 3.27Å; K1672-D1690 IonicContact NZ-OD2 2.79Å; K1672-D1690 PolarHBondContact NZ-OD2 3.06Å; S1688-D1690 VanDerWaalsContact CB-OD1 3.25Å; S1688-D1690 WeakPolarHBondContact CB-OD1 3.48Å; S1688-D1690 PolarHBondContact OG-OD1 2.78Å; S1688-D1690 PolarHBondContact OG-OD2 3.32Å; D1690-V1692 PolarHBondContact O-N 2.83Å; D1690-V1692 VanDerWaalsContact O-N 3.16Å; D1690-A1693 PolarHBondContact O-N 2.92Å; D1690-A1693 VanDerWaalsContact O-N 3.17Å
1691	E	86.6	Confident	86.9	Confident	28 Å²	28	59.5 Å²	59.5	13%	0.131	30%	0.297	C	S	.	.	H	α-helix	trans	-59.8	-26.1	178.5	-77.7	170.9	156.4	0	0	113.9	R1674 S1687 S1688 A1693 Y1694 Y1695	R1674-E1691 IonicContact CZ-OE1 3.18Å; R1674-E1691 IonicContact CZ-OE2 3.67Å; R1674-E1691 IonicContact NE-OE1 3.14Å; R1674-E1691 IonicContact NE-OE2 2.9Å; R1674-E1691 IonicContact NH2-OE1 2.92Å; R1674-E1691 PolarHBondContact NH2-OE1 2.69Å; R1674-E1691 IonicContact NH2-OE2 2.56Å; S1687-E1691 VanDerWaalsContact CA-OE2 3.29Å; S1687-E1691 WeakPolarHBondContact CA-OE2 3.42Å; S1687-E1691 WeakPolarHBondContact CB-OE2 3.38Å; S1688-E1691 PolarHBondContact N-OE2 2.89Å; S1688-E1691 WeakPolarHBondContact OG-CB 3.13Å; S1688-E1691 WeakPolarHBondContact OG-CG 3.33Å; S1688-E1691 PolarHBondContact OG-N 3.21Å; S1688-E1691 PolarHBondContact OG-OE2 2.91Å; E1691-A1693 PolarHBondContact O-N 2.76Å; E1691-A1693 VanDerWaalsContact O-N 3.12Å; E1691-Y1694 WeakPolarHBondContact O-CB 3.43Å; E1691-Y1694 PolarHBondContact O-N 3.3Å; E1691-Y1695 HydrophobicContact CB-CD2 3.95Å; E1691-Y1695 HydrophobicContact CB-CE2 3.84Å; E1691-Y1695 HydrophobicContact CG-CE2 4.4Å; E1691-Y1695 VanDerWaalsContact O-CD2 3.31Å; E1691-Y1695 WeakPolarHBondContact O-CD2 3.05Å; E1691-Y1695 PolarHBondContact O-N 3.23Å
1692	V	86.5	Confident	86.7	Confident	19 Å²	19	55.8 Å²	55.8	12%	0.115	27%	0.271	C	S	.	.	H	α-helix	trans	-53.8	-33.8	176.4	175.1	0	0	0	0	111.7	R1677 I1679 S1688 E1689 D1690 K1696	R1677-V1692 HydrophobicContact CB-CG2 3.71Å; R1677-V1692 HydrophobicContact CG-CG2 4.27Å; I1679-V1692 HydrophobicContact CG2-CG1 4.2Å; S1688-V1692 WeakPolarHBondContact O-CG2 3.44Å; E1689-V1692 WeakPolarHBondContact O-CB 3.49Å; D1690-V1692 PolarHBondContact O-N 2.83Å; D1690-V1692 VanDerWaalsContact O-N 3.16Å; V1692-K1696 HydrophobicContact CG1-CD 3.93Å; V1692-K1696 VanDerWaalsContact CG1-CE 3.42Å; V1692-K1696 VanDerWaalsContact O-CB 3.28Å; V1692-K1696 WeakPolarHBondContact O-CB 3.43Å; V1692-K1696 WeakPolarHBondContact O-CD 3.31Å; V1692-K1696 WeakPolarHBondContact O-CG 3.47Å; V1692-K1696 PolarHBondContact O-N 3.14Å
1693	A	85.2	Confident	86.8	Confident	70 Å²	70	57.3 Å²	57.3	58%	0.579	27%	0.272	S	S	*	.	H	α-helix	trans	-72.2	-40.3	177.1	0	0	0	0	0	112.5	D1690 E1691 K1697	D1690-A1693 PolarHBondContact O-N 2.92Å; D1690-A1693 VanDerWaalsContact O-N 3.17Å; E1691-A1693 PolarHBondContact O-N 2.76Å; E1691-A1693 VanDerWaalsContact O-N 3.12Å; A1693-K1697 PolarHBondContact O-N 2.79Å; A1693-K1697 VanDerWaalsContact O-N 3.1Å
1694	Y	89.6	Confident	86.2	Confident	139 Å²	139	61.3 Å²	61.3	55%	0.545	29%	0.293	S	S	.	.	H	α-helix	trans	-62.7	-52.1	174.4	168.2	-96.3	0	0	0	110.9	E1691 K1696 K1697 K1698	E1691-Y1694 WeakPolarHBondContact O-CB 3.43Å; E1691-Y1694 PolarHBondContact O-N 3.3Å; Y1694-K1696 VanDerWaalsContact C-N 3.34Å; Y1694-K1696 PolarHBondContact O-N 3.36Å; Y1694-K1697 WeakPolarHBondContact O-CB 3.24Å; Y1694-K1697 PolarHBondContact O-N 3.46Å; Y1694-K1697 VanDerWaalsContact O-N 3.07Å; Y1694-K1698 HydrophobicContact CE1-CD 3.91Å; Y1694-K1698 WeakPolarHBondContact O-CB 3.17Å; Y1694-K1698 PolarHBondContact O-N 3.21Å
1695	Y	90.7	Very high	85.3	Confident	6 Å²	6	63.3 Å²	63.3	2%	0.024	30%	0.303	C	S	.	.	H	α-helix	trans	-64.6	-35.6	-179.2	-69.8	-58.3	0	0	0	112.6	V1637 E1667 I1685 E1691 K1698 L1699	V1637-Y1695 HydrophobicContact CB-CD1 4.21Å; V1637-Y1695 HydrophobicContact CG2-CD1 4.28Å; E1667-Y1695 PolarHBondContact OE1-OH 2.85Å; I1685-Y1695 HydrophobicContact CD1-CD1 3.55Å; I1685-Y1695 HydrophobicContact CD1-CD2 3.87Å; I1685-Y1695 HydrophobicContact CD1-CE1 3.53Å; I1685-Y1695 HydrophobicContact CD1-CE2 3.85Å; I1685-Y1695 HydrophobicContact CD1-CG 3.73Å; I1685-Y1695 HydrophobicContact CG1-CD2 4.38Å; I1685-Y1695 HydrophobicContact CG1-CE2 4.3Å; I1685-Y1695 HydrophobicContact CG2-CD2 3.83Å; I1685-Y1695 HydrophobicContact CG2-CE2 4.45Å; I1685-Y1695 HydrophobicContact CG2-CG 4.13Å; E1691-Y1695 HydrophobicContact CB-CD2 3.95Å; E1691-Y1695 HydrophobicContact CB-CE2 3.84Å; E1691-Y1695 HydrophobicContact CG-CE2 4.4Å; E1691-Y1695 VanDerWaalsContact O-CD2 3.31Å; E1691-Y1695 WeakPolarHBondContact O-CD2 3.05Å; E1691-Y1695 PolarHBondContact O-N 3.23Å; Y1695-K1698 PolarHBondContact O-N 2.97Å; Y1695-L1699 WeakPolarHBondContact O-CB 3.16Å; Y1695-L1699 PolarHBondContact O-N 2.78Å
1696	K	89.3	Confident	84	Confident	96 Å²	96	67.3 Å²	67.3	42%	0.417	32%	0.321	S	S	.	.	H	α-helix	trans	-59	-44.9	169.5	-81.5	171.6	-174.4	173.6	0	112.5	E1678 I1679 V1692 Y1694 Q1700	E1678-K1696 WeakPolarHBondContact O-CE 3.17Å; E1678-K1696 PolarHBondContact O-NZ 2.81Å; I1679-K1696 VanDerWaalsContact CA-CE 3.5Å; I1679-K1696 HydrophobicContact CB-CG 3.99Å; I1679-K1696 HydrophobicContact CG2-CG 4.21Å; I1679-K1696 WeakPolarHBondContact O-CE 3.24Å; I1679-K1696 VanDerWaalsContact O-CG 3.3Å; I1679-K1696 WeakPolarHBondContact O-CG 3.39Å; V1692-K1696 HydrophobicContact CG1-CD 3.93Å; V1692-K1696 VanDerWaalsContact CG1-CE 3.42Å; V1692-K1696 VanDerWaalsContact O-CB 3.28Å; V1692-K1696 WeakPolarHBondContact O-CB 3.43Å; V1692-K1696 WeakPolarHBondContact O-CD 3.31Å; V1692-K1696 WeakPolarHBondContact O-CG 3.47Å; V1692-K1696 PolarHBondContact O-N 3.14Å; Y1694-K1696 VanDerWaalsContact C-N 3.34Å; Y1694-K1696 PolarHBondContact O-N 3.36Å; K1696-Q1700 WeakPolarHBondContact O-CB 3.4Å; K1696-Q1700 PolarHBondContact O-N 2.96Å
1697	K	87.5	Confident	82.4	Confident	168 Å²	168	68.5 Å²	68.5	73%	0.73	34%	0.341	S	S	*	.	H	α-helix	trans	-66.8	-41.1	178	-171.3	179.5	177.7	-175.4	0	111.8	A1693 Y1694 Q1700 H1701	A1693-K1697 PolarHBondContact O-N 2.79Å; A1693-K1697 VanDerWaalsContact O-N 3.1Å; Y1694-K1697 WeakPolarHBondContact O-CB 3.24Å; Y1694-K1697 PolarHBondContact O-N 3.46Å; Y1694-K1697 VanDerWaalsContact O-N 3.07Å; K1697-Q1700 PolarHBondContact O-N 3.49Å; K1697-H1701 WeakPolarHBondContact O-CB 3.42Å; K1697-H1701 PolarHBondContact O-N 2.88Å
1698	K	89.4	Confident	80.2	Confident	31 Å²	31	75.2 Å²	75.2	14%	0.135	38%	0.375	C	S	.	.	H	α-helix	trans	-64.9	-45.6	176.8	-166.1	-179.4	178.8	-177.4	0	111.9	V1637 E1642 Y1694 Y1695 Q1700 H1701 L1702	V1637-K1698 HydrophobicContact CB-CD 4.07Å; V1637-K1698 HydrophobicContact CB-CG 4.44Å; V1637-K1698 HydrophobicContact CG1-CB 4.1Å; V1637-K1698 HydrophobicContact CG1-CD 4.03Å; V1637-K1698 HydrophobicContact CG1-CG 3.86Å; V1637-K1698 PolarHBondContact O-NZ 3.48Å; E1642-K1698 WeakPolarHBondContact OE1-CE 3.42Å; E1642-K1698 IonicContact OE1-NZ 2.81Å; E1642-K1698 PolarHBondContact OE1-NZ 3.1Å; E1642-K1698 IonicContact OE2-NZ 3.55Å; E1642-K1698 PolarHBondContact OE2-NZ 2.99Å; Y1694-K1698 HydrophobicContact CE1-CD 3.91Å; Y1694-K1698 WeakPolarHBondContact O-CB 3.17Å; Y1694-K1698 PolarHBondContact O-N 3.21Å; Y1695-K1698 PolarHBondContact O-N 2.97Å; K1698-Q1700 VanDerWaalsContact C-N 3.34Å; K1698-Q1700 PolarHBondContact O-N 2.6Å; K1698-H1701 WeakPolarHBondContact O-CB 3.38Å; K1698-H1701 PolarHBondContact O-N 3.36Å; K1698-H1701 VanDerWaalsContact O-N 3.12Å; K1698-L1702 PolarHBondContact O-N 3.22Å
1699	L	88.2	Confident	78.2	Confident	6 Å²	6	79.4 Å²	79.4	3%	0.031	41%	0.41	C	S	.	.	H	α-helix	trans	-60.1	-42.9	175.4	178.2	55.6	0	0	0	111.7	Y1635 V1637 I1679 A1680 Y1695 K1703	Y1635-L1699 VanDerWaalsContact CB-CD1 3.5Å; Y1635-L1699 HydrophobicContact CG-CD1 4.28Å; V1637-L1699 HydrophobicContact CG1-CB 4.12Å; I1679-L1699 HydrophobicContact CD1-CD2 3.9Å; I1679-L1699 HydrophobicContact CG1-CD2 4.1Å; A1680-L1699 HydrophobicContact CB-CD2 3.7Å; Y1695-L1699 WeakPolarHBondContact O-CB 3.16Å; Y1695-L1699 PolarHBondContact O-N 2.78Å; L1699-K1703 HydrophobicContact CD1-CD 4.02Å; L1699-K1703 HydrophobicContact CD1-CG 4.46Å; L1699-K1703 HydrophobicContact CG-CD 4.24Å; L1699-K1703 WeakPolarHBondContact O-CB 3.12Å; L1699-K1703 WeakPolarHBondContact O-CG 3.27Å; L1699-K1703 PolarHBondContact O-N 3.09Å
1700	Q	85.2	Confident	76.1	Confident	106 Å²	106	80.7 Å²	80.7	50%	0.495	43%	0.427	S	S	.	.	H	α-helix	trans	-67.1	-35.9	174.6	-170.3	62.5	60.7	0	0	112.4	K1696 K1697 K1698 N1704	K1696-Q1700 WeakPolarHBondContact O-CB 3.4Å; K1696-Q1700 PolarHBondContact O-N 2.96Å; K1697-Q1700 PolarHBondContact O-N 3.49Å; K1698-Q1700 VanDerWaalsContact C-N 3.34Å; K1698-Q1700 PolarHBondContact O-N 2.6Å; Q1700-N1704 PolarHBondContact NE2-OD1 3.16Å; Q1700-N1704 WeakPolarHBondContact O-CB 3.25Å; Q1700-N1704 PolarHBondContact O-N 3.25Å; Q1700-N1704 PolarHBondContact O-OD1 2.9Å; Q1700-N1704 VanDerWaalsContact O-OD1 3.14Å
1701	H	83.8	Confident	75.8	Confident	104 Å²	104	80.8 Å²	80.8	48%	0.481	43%	0.427	S	S	.	.	H	α-helix	trans	-64.4	-48.4	176.7	-175.9	3.9	0	0	0	111.9	K1697 K1698 K1703 N1704 E1705	K1697-H1701 WeakPolarHBondContact O-CB 3.42Å; K1697-H1701 PolarHBondContact O-N 2.88Å; K1698-H1701 WeakPolarHBondContact O-CB 3.38Å; K1698-H1701 PolarHBondContact O-N 3.36Å; K1698-H1701 VanDerWaalsContact O-N 3.12Å; H1701-K1703 VanDerWaalsContact C-N 3.34Å; H1701-K1703 PolarHBondContact O-N 2.85Å; H1701-N1704 WeakPolarHBondContact O-CB 3.44Å; H1701-N1704 PolarHBondContact O-N 3.09Å; H1701-N1704 VanDerWaalsContact O-N 3.12Å; H1701-E1705 IonicContact CE1-OE1 3.17Å; H1701-E1705 PolarHBondContact CE1-OE1 3.13Å; H1701-E1705 IonicContact CE1-OE2 2.66Å; H1701-E1705 IonicContact ND1-OE1 2.69Å; H1701-E1705 PolarHBondContact O-N 3.24Å
1702	L	80.8	Confident	75.2	Confident	43 Å²	43	83.5 Å²	83.5	23%	0.225	44%	0.443	C	S	.	.	H	α-helix	trans	-63.9	-38.5	176.8	-65.2	176	0	0	0	112.1	Y1635 V1637 K1698 N1704 E1705 K1706	Y1635-L1702 HydrophobicContact CD1-CB 3.98Å; V1637-L1702 HydrophobicContact CG1-CD1 3.73Å; K1698-L1702 PolarHBondContact O-N 3.22Å; L1702-N1704 VanDerWaalsContact C-N 3.31Å; L1702-N1704 PolarHBondContact O-N 2.64Å; L1702-E1705 PolarHBondContact O-N 3.25Å; L1702-K1706 PolarHBondContact O-N 3.34Å; L1702-K1706 VanDerWaalsContact O-N 3.15Å
1703	K	81.5	Confident	74.6	Confident	51 Å²	51	87.1 Å²	87.1	22%	0.222	46%	0.461	C	S	.	.	H	α-helix	trans	-63.4	-35	172.9	-76.8	174.7	174.4	175	0	112	E1631 Y1635 L1699 H1701 A1707	E1631-K1703 IonicContact OE1-NZ 3.41Å; E1631-K1703 PolarHBondContact OE1-NZ 3.37Å; Y1635-K1703 HydrophobicContact CD1-CB 4.44Å; Y1635-K1703 HydrophobicContact CD1-CG 3.6Å; Y1635-K1703 HydrophobicContact CD2-CD 4.29Å; Y1635-K1703 HydrophobicContact CD2-CG 3.86Å; Y1635-K1703 HydrophobicContact CE1-CB 4.19Å; Y1635-K1703 HydrophobicContact CE1-CG 3.56Å; Y1635-K1703 HydrophobicContact CE2-CD 4.4Å; Y1635-K1703 HydrophobicContact CE2-CG 3.83Å; Y1635-K1703 HydrophobicContact CG-CD 4.47Å; Y1635-K1703 HydrophobicContact CG-CG 3.75Å; L1699-K1703 HydrophobicContact CD1-CD 4.02Å; L1699-K1703 HydrophobicContact CD1-CG 4.46Å; L1699-K1703 HydrophobicContact CG-CD 4.24Å; L1699-K1703 WeakPolarHBondContact O-CB 3.12Å; L1699-K1703 WeakPolarHBondContact O-CG 3.27Å; L1699-K1703 PolarHBondContact O-N 3.09Å; H1701-K1703 VanDerWaalsContact C-N 3.34Å; H1701-K1703 PolarHBondContact O-N 2.85Å; K1703-A1707 WeakPolarHBondContact O-CB 3.33Å; K1703-A1707 PolarHBondContact O-N 3.04Å
1704	N	77.6	Confident	74	Confident	84 Å²	84	88.1 Å²	88.1	45%	0.449	45%	0.454	S	S	.	.	H	α-helix	trans	-74.6	-41.4	175	-68.7	-0.9	0	0	0	112.9	Q1700 H1701 L1702 A1707 I1708	Q1700-N1704 PolarHBondContact NE2-OD1 3.16Å; Q1700-N1704 WeakPolarHBondContact O-CB 3.25Å; Q1700-N1704 PolarHBondContact O-N 3.25Å; Q1700-N1704 PolarHBondContact O-OD1 2.9Å; Q1700-N1704 VanDerWaalsContact O-OD1 3.14Å; H1701-N1704 WeakPolarHBondContact O-CB 3.44Å; H1701-N1704 PolarHBondContact O-N 3.09Å; H1701-N1704 VanDerWaalsContact O-N 3.12Å; L1702-N1704 VanDerWaalsContact C-N 3.31Å; L1702-N1704 PolarHBondContact O-N 2.64Å; N1704-A1707 CarbonylContact O-C 3.56Å; N1704-A1707 PolarHBondContact O-N 2.87Å; N1704-I1708 WeakPolarHBondContact O-CG1 3.44Å; N1704-I1708 PolarHBondContact O-N 3.39Å
1705	E	70.5	Confident	73	Confident	101 Å²	101	84.9 Å²	84.9	47%	0.472	45%	0.449	S	S	.	.	H	α-helix	trans	-65.3	-43.6	-179.5	-75	-171.1	140.8	0	0	112.3	H1701 L1702 A1707 I1708 A1709	H1701-E1705 IonicContact CE1-OE1 3.17Å; H1701-E1705 PolarHBondContact CE1-OE1 3.13Å; H1701-E1705 IonicContact CE1-OE2 2.66Å; H1701-E1705 IonicContact ND1-OE1 2.69Å; H1701-E1705 PolarHBondContact O-N 3.24Å; L1702-E1705 PolarHBondContact O-N 3.25Å; E1705-A1707 VanDerWaalsContact C-N 3.27Å; E1705-A1707 PolarHBondContact O-N 2.92Å; E1705-I1708 PolarHBondContact O-N 3.11Å; E1705-A1709 PolarHBondContact O-N 3.28Å
1706	K	62.7	Low	71.8	Confident	84 Å²	84	90.2 Å²	90.2	37%	0.365	48%	0.477	S	S	.	.	H	α-helix	trans	-64.9	-31.7	174.6	-80.7	-179.3	172.3	169.3	0	112.6	H1634 Y1635 L1702 I1708 A1709 V1710	H1634-K1706 HydrophobicContact CB-CD 4.44Å; H1634-K1706 PolarHBondContact O-NZ 3.41Å; Y1635-K1706 HydrophobicContact CD1-CD 4.44Å; Y1635-K1706 HydrophobicContact CE1-CB 4.25Å; Y1635-K1706 HydrophobicContact CE1-CD 3.85Å; L1702-K1706 PolarHBondContact O-N 3.34Å; L1702-K1706 VanDerWaalsContact O-N 3.15Å; K1706-I1708 PolarHBondContact O-N 2.79Å; K1706-A1709 PolarHBondContact O-N 3.29Å; K1706-V1710 WeakPolarHBondContact O-CB 3.27Å; K1706-V1710 WeakPolarHBondContact O-CG2 3.28Å; K1706-V1710 PolarHBondContact O-N 3.22Å
1707	A	55.1	Low	70.6	Confident	74 Å²	74	89.8 Å²	89.8	61%	0.612	48%	0.481	S	S	*	.	H	α-helix	trans	-75.9	5.4	171.6	0	0	0	0	0	114.7	K1703 N1704 E1705	K1703-A1707 WeakPolarHBondContact O-CB 3.33Å; K1703-A1707 PolarHBondContact O-N 3.04Å; N1704-A1707 CarbonylContact O-C 3.56Å; N1704-A1707 PolarHBondContact O-N 2.87Å; E1705-A1707 VanDerWaalsContact C-N 3.27Å; E1705-A1707 PolarHBondContact O-N 2.92Å
1708	I	41.6	Very low	69.3	Low	142 Å²	142	83.8 Å²	83.8	73%	0.728	46%	0.462	S	S	*	.	H	α-helix	trans	-114.8	-25.2	170.3	-66.5	164.5	0	0	0	110.9	N1704 E1705 K1706	N1704-I1708 WeakPolarHBondContact O-CG1 3.44Å; N1704-I1708 PolarHBondContact O-N 3.39Å; E1705-I1708 PolarHBondContact O-N 3.11Å; K1706-I1708 PolarHBondContact O-N 2.79Å
1709	A	45.4	Very low	67.6	Low	89 Å²	89	88.2 Å²	88.2	74%	0.736	49%	0.489	S	S	*	.	H	α-helix	trans	-86.9	-20.1	177	0	0	0	0	0	114.1	E1705 K1706	E1705-A1709 PolarHBondContact O-N 3.28Å; K1706-A1709 PolarHBondContact O-N 3.29Å
1710	V	39	Very low	65.8	Low	174 Å²	174	95.6 Å²	95.6	100%	1.055	53%	0.531	S	S	*	.			trans	-98.6	0	170.9	178.7	0	0	0	0	109.8	K1706	K1706-V1710 WeakPolarHBondContact O-CB 3.27Å; K1706-V1710 WeakPolarHBondContact O-CG2 3.28Å; K1706-V1710 PolarHBondContact O-N 3.22Å

Retrieved 1,710 of 1,710 residues in 11138.1 ms (Link to these results)

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