A0A061IKZ1_CRIGR Loading...

Armadillo-type fold containing protein

AlphaFold DB , UniProt , Accession A0A061IKZ1, Species CRIGR (Cricetulus griseus, Chinese hamster), Gene Cfap69, Length 940 aa.

						>A0A061IKZ1_CRIGR|A0A061IKZ1|Cfap69
MSTLEAATTADAAETSCRPKSNSPRTIPVIGVVTPQEDVQGIFKSMDLNRIIRLLEVNDKDDLEEKQLNSVTNLVQYYQNGFPLRDLAQVFKILSLCADKIEKQPCFVEPASDLIKLCGLPFLKKKVSDEITYTEDTANSLALLGELMKVRSSKLRIQICKCIVDFYHAQPPKKHIPGYQQVSSSYKIKMAEVGGLAKAMIQSVHLLEIQLIEKLWVLKVLQHLSTSEANCTLMVKSQAASRICAHLNDPDPSEQLLFRSSEILWNLLEKSSKEEIIQQLSNLECLLALKEVFKNLFTKGQSHYDRQLRNDILVITTIIAQNPGAPMIECGFTRDLILFATFNEVKSQNPLVKSLKLSNSYEDFELKKLLFNIIVILCKDLTTIQLLIDGKVILALFTYVKKPERLKIIEWSAAQYEELQLHAIATLSSVAPLLIEEYMSCQGNARILAFLEWCEHENSCFLHGNSFHGTGGRGNKYAQMRYTLRLLRAMVYLEDEIVNTDLCERGVIHQLIGIFKTMASRPDEKEDAIALEIQSDALLILSGLCEHYIQRKEMFGTEGVDIILHVMKTDPKKLQSGLGYNVLLFSTLDSIWCCILGCYSSEDYFLEKEGIFLLLDILALKQKKFCNLILGIMVEFCDNPKTSAHVNAWRGKKDLTAASLLIKLWRKEEKELGVKRDKNGMIVDTKKPLFTSFQEEQKIMPLPANCPSVAVMDVAENIRAKIYAVLGKLDFENLPGLSAEDFVTLCIIHRYLDFKIGEIWNEICEEIKLEQLKLVTSDKMSLESITAATENIGKMVATLQSEMIESQARQDVQNEQRVYAKIQATHKQRELANKSWENFLARTSNAKTLKKAKALQEKAIESSKYSERPQNALFHQTVIKGLNTTVPSGRVVTVESTPTRLLGGPLADTDMALKRLPVRGGALQRVKVKTLNEPKKTAPI
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	28.5	Very low	24.5	Very low	246 Å²	246	140.8 Å²	140.8	100%	1.212	86%	0.855	S	S	*	*				0	131	0	-88.3	-172.9	-179	0	0	108.6
2	S	26.1	Very low	24.6	Very low	98 Å²	98	137.5 Å²	137.5	69%	0.685	85%	0.853	S	S	*	*			trans	-43.6	147.7	179.2	51.4	0	0	0	0	116.6
3	T	24	Very low	24.6	Very low	124 Å²	124	134.8 Å²	134.8	76%	0.761	85%	0.852	S	S	*	*				174.6	117.5	101.5	37.7	0	0	0	0	108
4	L	25	Very low	24.5	Very low	147 Å²	147	139.2 Å²	139.2	77%	0.77	86%	0.857	S	S	*	*				75.4	112.7	84.8	-105.8	145.6	0	0	0	114.9
5	E	25.9	Very low	24.5	Very low	180 Å²	180	139.7 Å²	139.7	84%	0.841	86%	0.86	S	S	*	*			trans	8.9	137.4	151.7	-61.7	174.4	150.9	0	0	121
6	A	23.3	Very low	24.5	Very low	96 Å²	96	137.9 Å²	137.9	79%	0.793	85%	0.854	S	S	*	*			trans	-160.9	124.3	135	0	0	0	0	0	111.4
7	A	22.4	Very low	24.4	Very low	102 Å²	102	137.7 Å²	137.7	84%	0.843	86%	0.858	S	S	*	*			trans	-76.2	141.7	164.3	0	0	0	0	0	110.4
8	T	23.8	Very low	24.5	Very low	136 Å²	136	142.1 Å²	142.1	83%	0.834	86%	0.855	S	S	*	*			trans	-134	115.2	167.3	39.3	0	0	0	0	110.9
9	T	23.5	Very low	24.6	Very low	145 Å²	145	141.5 Å²	141.5	89%	0.89	86%	0.856	S	S	*	*			trans	-66.4	137.9	161.6	44.7	0	0	0	0	110.6
10	A	24.6	Very low	24.7	Very low	103 Å²	103	143.3 Å²	143.3	85%	0.851	85%	0.851	S	S	*	*			trans	-146	121	162	0	0	0	0	0	110.8
11	D	22.1	Very low	24.7	Very low	172 Å²	172	142.2 Å²	142.2	92%	0.92	85%	0.851	S	S	*	*			trans	-56.3	144.8	175.5	-71.1	-54.4	0	0	0	113.6
12	A	25.8	Very low	24.5	Very low	101 Å²	101	137.6 Å²	137.6	84%	0.835	83%	0.831	S	S	*	*			trans	-116.4	125.3	161.6	0	0	0	0	0	109.6
13	A	24.5	Very low	24.6	Very low	102 Å²	102	138.5 Å²	138.5	84%	0.843	84%	0.837	S	S	*	*	P	Polyproline II helix	trans	-78.4	133.7	-169.5	0	0	0	0	0	113.7
14	E	23.7	Very low	25	Very low	197 Å²	197	137.8 Å²	137.8	92%	0.921	84%	0.835	S	S	*	*	P	Polyproline II helix	trans	-87.8	128.6	163.8	-76.3	-176.2	154.3	0	0	110.9
15	T	25.1	Very low	25.1	Very low	146 Å²	146	141.6 Å²	141.6	90%	0.896	84%	0.839	S	S	*	*	P	Polyproline II helix	trans	-82.8	137	172.7	38.7	0	0	0	0	112.4
16	S	23.2	Very low	25	Very low	111 Å²	111	139.5 Å²	139.5	78%	0.776	84%	0.839	S	S	*	*	P	Polyproline II helix	trans	-87.2	150.1	-173.4	60.3	0	0	0	0	114.7
17	C	23.2	Very low	25.6	Very low	135 Å²	135	142.5 Å²	142.5	91%	0.912	84%	0.84	S	S	*	*			trans	-149.7	117.8	143	-102.6	0	0	0	0	110.6
18	R	26.4	Very low	25.9	Very low	216 Å²	216	143.3 Å²	143.3	82%	0.815	84%	0.836	S	S	*	*			trans	-115.8	162.5	164.5	-88.9	-173.5	178.2	179.1	0.6	108.1
19	P	26.8	Very low	26.1	Very low	132 Å²	132	142.9 Å²	142.9	86%	0.857	83%	0.833	S	S	*	*				-122.8	147.2	129.5	25.9	-10.8	0	0	0	112.3
20	K	26.3	Very low	26.6	Very low	176 Å²	176	143.1 Å²	143.1	77%	0.765	83%	0.827	S	S	*	*			trans	-92	154.4	178.3	-69.1	173.9	174.4	175	0	110.7
21	S	24.4	Very low	26.6	Very low	121 Å²	121	141.8 Å²	141.8	85%	0.846	82%	0.824	S	S	*	*			trans	-153.1	134.7	135.2	62.7	0	0	0	0	112.5
22	N	24.9	Very low	27.2	Very low	150 Å²	150	139.6 Å²	139.6	80%	0.802	82%	0.816	S	S	*	*			trans	-57.9	159.2	-178.9	-63.5	-32.3	0	0	0	114.1
23	S	27.3	Very low	27.3	Very low	116 Å²	116	141.3 Å²	141.3	81%	0.811	82%	0.816	S	S	*	*				-172.8	171.8	72.2	60	0	0	0	0	113.2
24	P	33.1	Very low	27.4	Very low	109 Å²	109	142.2 Å²	142.2	71%	0.708	81%	0.812	S	S	*	*			trans	-121	-179.4	-142.2	45.1	-36.6	0	0	0	117.8
25	R	25.9	Very low	28.4	Very low	228 Å²	228	138.1 Å²	138.1	86%	0.86	80%	0.802	S	S	*	*			trans	83.5	120.1	155.9	-66.9	-179.5	179.7	173.3	-0	118.8
26	T	25.3	Very low	28.5	Very low	136 Å²	136	139.9 Å²	139.9	83%	0.834	80%	0.8	S	S	*	*				-174.4	134.6	105	25.2	0	0	0	0	111.3
27	I	36.1	Very low	28.7	Very low	158 Å²	158	143 Å²	143	81%	0.81	80%	0.802	S	S	*	*			trans	-93.4	143.7	161.2	-62	167.2	0	0	0	106
28	P	28.3	Very low	29.3	Very low	120 Å²	120	143 Å²	143	78%	0.779	79%	0.793	S	S	*	*			trans	-126.5	156.6	143.2	29.7	-13.9	0	0	0	113.2
29	V	27.1	Very low	29.7	Very low	126 Å²	126	139.7 Å²	139.7	76%	0.764	80%	0.797	S	S	*	*			trans	-82.4	152.2	-168.6	167.5	0	0	0	0	111.9
30	I	34.3	Very low	29.9	Very low	150 Å²	150	141.4 Å²	141.4	77%	0.769	79%	0.793	S	S	*	*			trans	-14.2	125.6	161.4	-58.8	163.3	0	0	0	116	V32	I30-V32 HydrophobicContact CG2-CG2 4.09Å
31	G	25.6	Very low	30.6	Very low	75 Å²	75	135.5 Å²	135.5	77%	0.773	78%	0.782	S	S	*	*			trans	-123.9	114.6	153.6	0	0	0	0	0	109.4
32	V	33.4	Very low	31.7	Very low	126 Å²	126	135.1 Å²	135.1	76%	0.764	77%	0.77	S	S	*	*			trans	-81.3	119.7	169	171.8	0	0	0	0	107.9	I30	I30-V32 HydrophobicContact CG2-CG2 4.09Å
33	V	29	Very low	32.9	Very low	138 Å²	138	129.3 Å²	129.3	84%	0.836	74%	0.737	S	S	*	*			trans	-135.4	131.6	157.8	-179.6	0	0	0	0	107.7
34	T	26.7	Very low	34.1	Very low	121 Å²	121	132.4 Å²	132.4	74%	0.742	74%	0.736	S	S	*	*			trans	-65.2	170	-175.9	26	0	0	0	0	114.6
35	P	44.3	Very low	35.1	Very low	110 Å²	110	133 Å²	133	71%	0.714	74%	0.743	S	S	*	*			trans	-88.8	140.7	-158.3	35.3	-31.5	0	0	0	112.8
36	Q	26.8	Very low	37.2	Very low	184 Å²	184	124.5 Å²	124.5	86%	0.86	71%	0.713	S	S	*	*			trans	172.4	160.2	136.4	-100.8	178.2	-31.5	0	0	111.3
37	E	26.7	Very low	39.8	Very low	175 Å²	175	122.4 Å²	122.4	82%	0.818	70%	0.697	S	S	*	*			trans	99.6	85.9	163.7	-51	-162.3	160.3	0	0	117.1
38	D	36.7	Very low	42.2	Very low	137 Å²	137	115 Å²	115	73%	0.733	66%	0.659	S	S	*	*			trans	9.6	116.3	140.7	-66.8	-52.4	0	0	0	118.5
39	V	33.7	Very low	44.9	Very low	146 Å²	146	113 Å²	113	89%	0.885	64%	0.642	S	S	*	*			trans	-118.5	81.9	148.1	-174.8	0	0	0	0	108.7
40	Q	33	Very low	47.6	Very low	168 Å²	168	115.7 Å²	115.7	79%	0.785	64%	0.638	S	S	*	*			trans	-52	142.3	148.4	-70.1	158.2	-13.2	0	0	108.2
41	G	41	Very low	50	Low	52 Å²	52	109.3 Å²	109.3	54%	0.536	61%	0.606	S	S	.	*			cis	150	99.8	19.8	0	0	0	0	0	105.5
42	I	46.4	Very low	52.9	Low	113 Å²	113	106.6 Å²	106.6	58%	0.579	57%	0.573	S	S	*	*	S	Bend	trans	-75.4	-21.5	172.7	-67.5	173.1	0	0	0	110.4	I176 P177	I42-I176 HydrophobicContact CD1-CG2 4.46Å; I42-I176 HydrophobicContact CG2-CG2 4.36Å; I42-P177 HydrophobicContact CD1-CB 3.94Å; I42-P177 VanDerWaalsContact CD1-CD 3.46Å; I42-P177 HydrophobicContact CD1-CG 3.64Å
43	F	50.3	Low	55.4	Low	27 Å²	27	109.1 Å²	109.1	12%	0.118	57%	0.569	C	S	.	*	S	Bend	trans	-109.8	89.9	166.3	-78.1	-53.5	0	0	0	108.7	S45 Y77 Y78 P83 L123 Y179	F43-S45 PolarHBondContact O-N 3.2Å; F43-Y77 WeakPolarHBondContact CA-OH 3.45Å; F43-Y77 HydrophobicContact CB-CE1 4.47Å; F43-Y77 WeakPolarHBondContact CB-OH 2.97Å; F43-Y77 AromaticContact CD1-CD1 3.85Å; F43-Y77 HydrophobicContact CD1-CD1 3.85Å; F43-Y77 HydrophobicContact CD1-CD2 4.46Å; F43-Y77 AromaticContact CD1-CE1 3.2Å; F43-Y77 HydrophobicContact CD1-CE1 3.2Å; F43-Y77 AromaticContact CD1-CE2 3.9Å; F43-Y77 HydrophobicContact CD1-CE2 3.9Å; F43-Y77 HydrophobicContact CD1-CG 4.44Å; F43-Y77 AromaticContact CD1-CZ 3.24Å; F43-Y77 VanDerWaalsContact CD1-OH 3.31Å; F43-Y77 WeakPolarHBondContact CD1-OH 3.36Å; F43-Y77 AromaticContact CE1-CD1 3.86Å; F43-Y77 HydrophobicContact CE1-CD1 3.86Å; F43-Y77 AromaticContact CE1-CE1 3.63Å; F43-Y77 HydrophobicContact CE1-CE1 3.63Å; F43-Y77 WeakPolarHBondContact CE1-O 3.45Å; F43-Y77 HydrophobicContact CG-CE1 4.16Å; F43-Y78 HydrophobicContact CD1-CE1 4.25Å; F43-Y78 AromaticContact CE1-CD1 3.53Å; F43-Y78 HydrophobicContact CE1-CD1 3.53Å; F43-Y78 AromaticContact CE1-CE1 3.66Å; F43-Y78 HydrophobicContact CE1-CE1 3.66Å; F43-Y78 HydrophobicContact CE1-CG 4.42Å; F43-Y78 AromaticContact CZ-CD1 3.62Å; F43-Y78 HydrophobicContact CZ-CD1 3.62Å; F43-Y78 AromaticContact CZ-CE1 3.84Å; F43-Y78 HydrophobicContact CZ-CE1 3.84Å; F43-P83 HydrophobicContact CD2-CG 4.28Å; F43-P83 HydrophobicContact CE2-CG 3.84Å; F43-P83 HydrophobicContact CZ-CG 4.32Å; F43-L123 HydrophobicContact CE2-CD1 4.41Å; F43-Y179 AromaticContact CD2-CE2 3.95Å; F43-Y179 HydrophobicContact CD2-CE2 3.95Å; F43-Y179 HydrophobicContact CE2-CE2 4.39Å
44	K	53.1	Low	58	Low	181 Å²	181	104.7 Å²	104.7	79%	0.787	54%	0.541	S	S	*	.			trans	-58.7	126.2	163.3	-92.6	-175.4	176.3	179.3	0	107.7	M46 Y77	K44-M46 PolarHBondContact O-N 2.86Å; K44-Y77 PolarHBondContact N-OH 3.45Å; K44-Y77 PolarHBondContact O-OH 3.3Å
45	S	53.3	Low	60.7	Low	121 Å²	121	99 Å²	99	85%	0.846	51%	0.506	S	S	*	.			trans	-43.9	97	-175.3	58.6	0	0	0	0	112.8	F43 D47	F43-S45 PolarHBondContact O-N 3.2Å; S45-D47 PolarHBondContact O-N 3.44Å
46	M	70.3	Confident	62.6	Low	50 Å²	50	98.9 Å²	98.9	25%	0.246	50%	0.496	C	S	.	.			trans	-73.4	122	168.1	-179.2	168.6	-77	0	0	106.4	K44 L48 I51 L74 Y77	K44-M46 PolarHBondContact O-N 2.86Å; M46-L48 VanDerWaalsContact C-N 3.33Å; M46-L48 HydrophobicContact CG-CD2 4.24Å; M46-L48 PolarHBondContact O-N 3.22Å; M46-L48 HydrophobicContact SD-CD2 4.4Å; M46-I51 HydrophobicContact CG-CD1 4.3Å; M46-I51 HydrophobicContact SD-CD1 4.2Å; M46-L74 HydrophobicContact SD-CB 4.25Å; M46-L74 HydrophobicContact SD-CD1 3.43Å; M46-L74 WeakPolarHBondContact SD-CD1 3.31Å; M46-L74 HydrophobicContact SD-CG 4.47Å; M46-Y77 HydrophobicContact CB-CD1 4.25Å; M46-Y77 HydrophobicContact CB-CE1 3.77Å; M46-Y77 HydrophobicContact CB-CE2 4.34Å; M46-Y77 HydrophobicContact CE-CD1 3.8Å; M46-Y77 HydrophobicContact CE-CD2 3.63Å; M46-Y77 HydrophobicContact CE-CE1 4.42Å; M46-Y77 HydrophobicContact CE-CE2 4.28Å; M46-Y77 HydrophobicContact CE-CG 3.33Å; M46-Y77 HydrophobicContact SD-CD1 3.81Å; M46-Y77 HydrophobicContact SD-CE1 4.29Å; M46-Y77 HydrophobicContact SD-CG 3.99Å
47	D	80.5	Confident	65	Low	93 Å²	93	93.9 Å²	93.9	50%	0.497	48%	0.477	S	S	.	.			trans	-78.7	85	-179.3	-172.8	-5	0	0	0	109.8	S45 N49 R50 I51	S45-D47 PolarHBondContact O-N 3.44Å; D47-N49 PolarHBondContact O-N 2.88Å; D47-N49 WeakPolarHBondContact OD1-CB 3.24Å; D47-N49 PolarHBondContact OD1-N 3.26Å; D47-R50 HydrophobicContact CB-CB 3.98Å; D47-R50 WeakPolarHBondContact O-CB 3.5Å; D47-R50 PolarHBondContact O-N 3.1Å; D47-R50 VanDerWaalsContact O-N 3.12Å; D47-R50 PolarHBondContact OD1-N 2.85Å; D47-R50 VanDerWaalsContact OD1-N 3.13Å; D47-I51 PolarHBondContact O-N 2.99Å
48	L	85.3	Confident	66.7	Low	3 Å²	3	91.1 Å²	91.1	2%	0.016	47%	0.468	C	S	.	.	H	α-helix	trans	-60.2	-30.6	178.2	-61.7	178.9	0	0	0	111.8	M46 R50 I51 I52 L74 Y78 D86 Q89 V90 I93	M46-L48 VanDerWaalsContact C-N 3.33Å; M46-L48 HydrophobicContact CG-CD2 4.24Å; M46-L48 PolarHBondContact O-N 3.22Å; M46-L48 HydrophobicContact SD-CD2 4.4Å; L48-R50 VanDerWaalsContact C-N 3.32Å; L48-R50 PolarHBondContact O-N 3Å; L48-I51 HydrophobicContact CD2-CD1 4.45Å; L48-I51 PolarHBondContact O-N 2.86Å; L48-I52 WeakPolarHBondContact O-CG1 3.39Å; L48-I52 PolarHBondContact O-N 3.39Å; L48-L74 HydrophobicContact CD2-CD1 3.37Å; L48-Y78 HydrophobicContact CD2-CE2 4.25Å; L48-D86 HydrophobicContact CD1-CB 4Å; L48-Q89 HydrophobicContact CB-CB 4.04Å; L48-Q89 HydrophobicContact CD1-CB 3.76Å; L48-V90 HydrophobicContact CD1-CG2 4.24Å; L48-I93 HydrophobicContact CB-CD1 4.32Å; L48-I93 HydrophobicContact CD2-CD1 4.03Å
49	N	84.8	Confident	67.8	Low	78 Å²	78	89.2 Å²	89.2	42%	0.417	46%	0.458	S	S	.	.	H	α-helix	trans	-66.9	-34.5	176.4	-68.4	-42.9	0	0	0	111.9	D47 I51 I52 R53	D47-N49 PolarHBondContact O-N 2.88Å; D47-N49 WeakPolarHBondContact OD1-CB 3.24Å; D47-N49 PolarHBondContact OD1-N 3.26Å; N49-I51 VanDerWaalsContact C-N 3.34Å; N49-I52 PolarHBondContact O-N 3.05Å; N49-R53 WeakPolarHBondContact O-CG 3.5Å; N49-R53 PolarHBondContact O-N 3.45Å
50	R	84.6	Confident	69	Low	181 Å²	181	90.2 Å²	90.2	68%	0.683	45%	0.45	S	S	*	.	H	α-helix	trans	-63.9	-39.5	172.3	-176.5	179.7	176.7	-173.3	-0.5	111.8	D47 L48 L54	D47-R50 HydrophobicContact CB-CB 3.98Å; D47-R50 WeakPolarHBondContact O-CB 3.5Å; D47-R50 PolarHBondContact O-N 3.1Å; D47-R50 VanDerWaalsContact O-N 3.12Å; D47-R50 PolarHBondContact OD1-N 2.85Å; D47-R50 VanDerWaalsContact OD1-N 3.13Å; L48-R50 VanDerWaalsContact C-N 3.32Å; L48-R50 PolarHBondContact O-N 3Å; R50-L54 VanDerWaalsContact O-CB 3.3Å; R50-L54 WeakPolarHBondContact O-CB 3.39Å; R50-L54 PolarHBondContact O-N 3.16Å
51	I	84.6	Confident	70	Confident	17 Å²	17	89.3 Å²	89.3	9%	0.087	45%	0.451	C	S	.	.	H	α-helix	trans	-67.7	-44.1	176.8	-58.9	175.6	0	0	0	110.4	M46 D47 L48 N49 L54 L55 L74 I93	M46-I51 HydrophobicContact CG-CD1 4.3Å; M46-I51 HydrophobicContact SD-CD1 4.2Å; D47-I51 PolarHBondContact O-N 2.99Å; L48-I51 HydrophobicContact CD2-CD1 4.45Å; L48-I51 PolarHBondContact O-N 2.86Å; N49-I51 VanDerWaalsContact C-N 3.34Å; I51-L54 PolarHBondContact O-N 3.44Å; I51-L55 HydrophobicContact CG2-CD1 4Å; I51-L55 WeakPolarHBondContact O-CG 3.45Å; I51-L55 PolarHBondContact O-N 2.95Å; I51-L74 HydrophobicContact CD1-CB 4.36Å; I51-L74 HydrophobicContact CD1-CD1 4.36Å; I51-I93 HydrophobicContact CB-CD1 4Å; I51-I93 HydrophobicContact CG2-CD1 3.84Å; I51-I93 HydrophobicContact CG2-CG1 4.18Å; I51-I93 HydrophobicContact CG2-CG2 4.31Å
52	I	87.1	Confident	70.9	Confident	17 Å²	17	93.3 Å²	93.3	9%	0.087	46%	0.46	C	S	.	.	H	α-helix	trans	-56.4	-52.8	175.2	-69.6	167.8	0	0	0	110.7	L48 N49 L54 L55 E56 Q89 K92 I93 L96	L48-I52 WeakPolarHBondContact O-CG1 3.39Å; L48-I52 PolarHBondContact O-N 3.39Å; N49-I52 PolarHBondContact O-N 3.05Å; I52-L54 PolarHBondContact O-N 3.26Å; I52-L55 PolarHBondContact O-N 3.18Å; I52-E56 HydrophobicContact CG2-CG 4.41Å; I52-E56 WeakPolarHBondContact O-CG 3.5Å; I52-E56 PolarHBondContact O-N 2.96Å; I52-Q89 HydrophobicContact CD1-CB 4.23Å; I52-Q89 HydrophobicContact CD1-CG 4.41Å; I52-K92 HydrophobicContact CD1-CB 4.28Å; I52-K92 HydrophobicContact CD1-CG 4.13Å; I52-K92 HydrophobicContact CG1-CG 4.39Å; I52-K92 HydrophobicContact CG2-CG 4.48Å; I52-I93 HydrophobicContact CD1-CG1 4.34Å; I52-I93 HydrophobicContact CG1-CD1 4.16Å; I52-I93 HydrophobicContact CG1-CG1 3.52Å; I52-L96 HydrophobicContact CG2-CD1 4.03Å
53	R	85.1	Confident	72.1	Confident	180 Å²	180	89.9 Å²	89.9	68%	0.679	44%	0.443	S	S	*	.	H	α-helix	trans	-58.5	-37.2	178	-72.7	178	-170.6	178.4	4.3	112.5	N49 L55 E56 V57	N49-R53 WeakPolarHBondContact O-CG 3.5Å; N49-R53 PolarHBondContact O-N 3.45Å; R53-L55 VanDerWaalsContact C-N 3.33Å; R53-E56 PolarHBondContact O-N 3.46Å; R53-V57 WeakPolarHBondContact O-CG2 3.35Å
54	L	83.8	Confident	73.3	Confident	45 Å²	45	91.4 Å²	91.4	24%	0.236	45%	0.45	C	S	.	.	H	α-helix	trans	-69	-33.1	179.3	-171.3	121.5	0	0	0	111.8	R50 I51 I52 Q67	R50-L54 VanDerWaalsContact O-CB 3.3Å; R50-L54 WeakPolarHBondContact O-CB 3.39Å; R50-L54 PolarHBondContact O-N 3.16Å; I51-L54 PolarHBondContact O-N 3.44Å; I52-L54 PolarHBondContact O-N 3.26Å; L54-Q67 VanDerWaalsContact CD2-CA 3.49Å; L54-Q67 HydrophobicContact CD2-CB 4Å; L54-Q67 HydrophobicContact CD2-CG 3.42Å; L54-Q67 VanDerWaalsContact CD2-CG 3.42Å; L54-Q67 HydrophobicContact CG-CG 4.13Å; L54-Q67 PolarHBondContact O-NE2 2.66Å
55	L	82.8	Confident	74.5	Confident	2 Å²	2	89.5 Å²	89.5	1%	0.01	44%	0.444	C	S	.	.	H	α-helix	trans	-80.1	-25.6	175.6	-69.2	169.6	0	0	0	113.3	I51 I52 R53 V57 Q67 V71 I93 L96 K100 F107	I51-L55 HydrophobicContact CG2-CD1 4Å; I51-L55 WeakPolarHBondContact O-CG 3.45Å; I51-L55 PolarHBondContact O-N 2.95Å; I52-L55 PolarHBondContact O-N 3.18Å; R53-L55 VanDerWaalsContact C-N 3.33Å; L55-V57 VanDerWaalsContact C-N 3.28Å; L55-V57 PolarHBondContact O-N 3.44Å; L55-Q67 HydrophobicContact CD2-CB 4.03Å; L55-Q67 HydrophobicContact CD2-CG 4.11Å; L55-V71 HydrophobicContact CD1-CG2 4.2Å; L55-V71 HydrophobicContact CD2-CG2 4.33Å; L55-I93 HydrophobicContact CD1-CB 4.39Å; L55-I93 HydrophobicContact CD1-CG1 4.49Å; L55-I93 HydrophobicContact CD1-CG2 3.72Å; L55-L96 HydrophobicContact CB-CB 4.03Å; L55-L96 HydrophobicContact CB-CD1 3.94Å; L55-L96 HydrophobicContact CD1-CB 4.34Å; L55-K100 WeakPolarHBondContact O-CE 3.45Å; L55-K100 PolarHBondContact O-NZ 2.91Å; L55-F107 HydrophobicContact CD2-CE1 3.85Å; L55-F107 HydrophobicContact CD2-CZ 4.4Å
56	E	84.2	Confident	75.8	Confident	107 Å²	107	89.9 Å²	89.9	50%	0.5	43%	0.431	S	S	.	.	H	α-helix	trans	-71.7	-19.4	175.1	-73.6	173.9	163.8	0	0	113.4	I52 R53 L96	I52-E56 HydrophobicContact CG2-CG 4.41Å; I52-E56 WeakPolarHBondContact O-CG 3.5Å; I52-E56 PolarHBondContact O-N 2.96Å; R53-E56 PolarHBondContact O-N 3.46Å; E56-L96 HydrophobicContact CG-CD1 4Å; E56-L96 HydrophobicContact CG-CD2 4.28Å
57	V	78.6	Confident	76.4	Confident	78 Å²	78	87.7 Å²	87.7	47%	0.473	42%	0.42	S	S	.	.	S	Bend	trans	-77.8	127.3	177	178.9	0	0	0	0	110.4	R53 L55 L63 Q67 K100	R53-V57 WeakPolarHBondContact O-CG2 3.35Å; L55-V57 VanDerWaalsContact C-N 3.28Å; L55-V57 PolarHBondContact O-N 3.44Å; V57-L63 HydrophobicContact CB-CD2 3.96Å; V57-L63 HydrophobicContact CG1-CD2 3.6Å; V57-Q67 PolarHBondContact O-NE2 3.34Å; V57-K100 PolarHBondContact O-NZ 3.37Å
58	N	60.7	Low	76.6	Confident	117 Å²	117	85.6 Å²	85.6	63%	0.626	41%	0.408	S	S	*	.			trans	-87	139.8	177.5	-77.1	-18.6	0	0	0	113.3
59	D	61.6	Low	76.5	Confident	97 Å²	97	89.3 Å²	89.3	52%	0.519	43%	0.428	S	S	.	.			trans	41.4	89.9	153.7	-54.1	-19.9	0	0	0	118.9
60	K	57.3	Low	76.5	Confident	167 Å²	167	86.6 Å²	86.6	73%	0.726	42%	0.415	S	S	*	.			trans	-142.2	135	146.8	-67.9	-172	178.9	-178.9	0	108	D62 L63	K60-D62 PolarHBondContact O-N 2.93Å; K60-D62 VanDerWaalsContact O-N 3.1Å; K60-L63 WeakPolarHBondContact O-CB 3.33Å; K60-L63 PolarHBondContact O-N 3.44Å
61	D	54.3	Low	76.6	Confident	149 Å²	149	78 Å²	78	80%	0.797	38%	0.383	S	S	*	.	H	α-helix	trans	-53.9	-33.8	-175.5	-63.8	-27.9	0	0	0	113.3	L63	D61-L63 VanDerWaalsContact C-N 3.27Å; D61-L63 PolarHBondContact O-N 2.97Å
62	D	61.1	Low	76.6	Confident	137 Å²	137	79.5 Å²	79.5	73%	0.733	39%	0.393	S	S	*	.	H	α-helix	trans	-72.7	-10.7	176.7	-81.6	-16.1	0	0	0	115.2	K60	K60-D62 PolarHBondContact O-N 2.93Å; K60-D62 VanDerWaalsContact O-N 3.1Å
63	L	70	Confident	76.6	Confident	41 Å²	41	82.8 Å²	82.8	22%	0.215	41%	0.411	C	S	.	.	H	α-helix	trans	-96.8	-22.5	-178.3	-156.1	69.2	0	0	0	112.1	V57 K60 D61 K66 Q67	V57-L63 HydrophobicContact CB-CD2 3.96Å; V57-L63 HydrophobicContact CG1-CD2 3.6Å; K60-L63 WeakPolarHBondContact O-CB 3.33Å; K60-L63 PolarHBondContact O-N 3.44Å; D61-L63 VanDerWaalsContact C-N 3.27Å; D61-L63 PolarHBondContact O-N 2.97Å; L63-K66 PolarHBondContact O-N 2.97Å; L63-Q67 HydrophobicContact CG-CG 4.47Å; L63-Q67 WeakPolarHBondContact O-CB 3.47Å; L63-Q67 VanDerWaalsContact O-CG 3.23Å; L63-Q67 WeakPolarHBondContact O-CG 3.22Å; L63-Q67 PolarHBondContact O-N 3.36Å
64	E	76	Confident	76.7	Confident	58 Å²	58	74.2 Å²	74.2	27%	0.271	38%	0.378	S	S	.	.	H	α-helix	trans	-64.1	-47.6	-179.1	-171.4	175.4	144.3	0	0	111.6	K66 Q67 L68 Q104 C106 F107	E64-K66 VanDerWaalsContact C-N 3.29Å; E64-K66 PolarHBondContact O-N 2.96Å; E64-Q67 WeakPolarHBondContact O-CB 3.42Å; E64-Q67 PolarHBondContact O-N 3.38Å; E64-L68 WeakPolarHBondContact O-CB 3.4Å; E64-L68 PolarHBondContact O-N 3.19Å; E64-Q104 PolarHBondContact OE2-NE2 2.98Å; E64-Q104 VanDerWaalsContact OE2-NE2 3.13Å; E64-C106 PolarHBondContact OE1-SG 2.99Å; E64-F107 HydrophobicContact CG-CE2 4.28Å
65	E	78.5	Confident	76.8	Confident	141 Å²	141	73.2 Å²	73.2	66%	0.659	37%	0.374	S	S	*	.	H	α-helix	trans	-63.5	-36.4	177.3	-168.8	-177.9	-178.5	0	0	111.7	N69	E65-N69 VanDerWaalsContact O-CB 3.29Å; E65-N69 WeakPolarHBondContact O-CB 3.46Å; E65-N69 PolarHBondContact O-N 3.33Å; E65-N69 PolarHBondContact O-ND2 3.47Å
66	K	80.6	Confident	76.9	Confident	130 Å²	130	78.9 Å²	78.9	57%	0.565	40%	0.4	S	S	*	.	H	α-helix	trans	-68.5	-39.1	175.5	-70.3	175.3	-177.7	160.4	0	111.8	L63 E64 S70	L63-K66 PolarHBondContact O-N 2.97Å; E64-K66 VanDerWaalsContact C-N 3.29Å; E64-K66 PolarHBondContact O-N 2.96Å; K66-S70 WeakPolarHBondContact O-CB 3.36Å; K66-S70 PolarHBondContact O-N 2.85Å; K66-S70 PolarHBondContact O-OG 2.78Å
67	Q	83.3	Confident	76.9	Confident	4 Å²	4	76.2 Å²	76.2	2%	0.019	39%	0.386	C	S	.	.	H	α-helix	trans	-63.1	-49.7	173.7	-74.7	168.4	-11.8	0	0	110.5	L54 L55 V57 L63 E64 N69 S70 V71 F107	L54-Q67 VanDerWaalsContact CD2-CA 3.49Å; L54-Q67 HydrophobicContact CD2-CB 4Å; L54-Q67 HydrophobicContact CD2-CG 3.42Å; L54-Q67 VanDerWaalsContact CD2-CG 3.42Å; L54-Q67 HydrophobicContact CG-CG 4.13Å; L54-Q67 PolarHBondContact O-NE2 2.66Å; L55-Q67 HydrophobicContact CD2-CB 4.03Å; L55-Q67 HydrophobicContact CD2-CG 4.11Å; V57-Q67 PolarHBondContact O-NE2 3.34Å; L63-Q67 HydrophobicContact CG-CG 4.47Å; L63-Q67 WeakPolarHBondContact O-CB 3.47Å; L63-Q67 VanDerWaalsContact O-CG 3.23Å; L63-Q67 WeakPolarHBondContact O-CG 3.22Å; L63-Q67 PolarHBondContact O-N 3.36Å; E64-Q67 WeakPolarHBondContact O-CB 3.42Å; E64-Q67 PolarHBondContact O-N 3.38Å; Q67-N69 PolarHBondContact O-N 3.06Å; Q67-S70 PolarHBondContact O-N 3.29Å; Q67-S70 VanDerWaalsContact O-N 3.16Å; Q67-S70 PolarHBondContact O-OG 3.05Å; Q67-V71 WeakPolarHBondContact O-CG2 3.48Å; Q67-V71 PolarHBondContact O-N 3.19Å; Q67-V71 VanDerWaalsContact O-N 3.14Å; Q67-F107 HydrophobicContact CB-CE1 4.18Å; Q67-F107 HydrophobicContact CB-CZ 3.74Å
68	L	83.7	Confident	77.2	Confident	49 Å²	49	72.7 Å²	72.7	26%	0.257	36%	0.364	S	S	.	.	H	α-helix	trans	-61.1	-45.4	179.6	-154.8	80.1	0	0	0	112.3	E64 S70 V71 T72 F107 P110	E64-L68 WeakPolarHBondContact O-CB 3.4Å; E64-L68 PolarHBondContact O-N 3.19Å; L68-S70 VanDerWaalsContact C-N 3.32Å; L68-S70 PolarHBondContact O-N 2.97Å; L68-V71 PolarHBondContact O-N 2.98Å; L68-T72 WeakPolarHBondContact O-CB 3.44Å; L68-T72 PolarHBondContact O-N 3.09Å; L68-T72 PolarHBondContact O-OG1 2.93Å; L68-F107 HydrophobicContact CD1-CD1 4.49Å; L68-P110 HydrophobicContact CD1-CG 3.46Å; L68-P110 VanDerWaalsContact CD1-CG 3.46Å; L68-P110 HydrophobicContact CG-CG 3.99Å
69	N	84.2	Confident	78.3	Confident	81 Å²	81	73.1 Å²	73.1	43%	0.433	36%	0.362	S	S	.	.	H	α-helix	trans	-63.4	-37	176.2	-82.6	-29	0	0	0	112	E65 Q67 T72 N73	E65-N69 VanDerWaalsContact O-CB 3.29Å; E65-N69 WeakPolarHBondContact O-CB 3.46Å; E65-N69 PolarHBondContact O-N 3.33Å; E65-N69 PolarHBondContact O-ND2 3.47Å; Q67-N69 PolarHBondContact O-N 3.06Å; N69-T72 PolarHBondContact O-N 2.87Å; N69-N73 WeakPolarHBondContact O-CB 3.38Å; N69-N73 PolarHBondContact O-N 2.93Å; N69-N73 PolarHBondContact O-ND2 2.66Å
70	S	85.4	Confident	79.1	Confident	21 Å²	21	71 Å²	71	15%	0.147	35%	0.351	C	S	.	.	H	α-helix	trans	-65.2	-39.6	177.7	74.5	0	0	0	0	112.7	K66 Q67 L68 L74	K66-S70 WeakPolarHBondContact O-CB 3.36Å; K66-S70 PolarHBondContact O-N 2.85Å; K66-S70 PolarHBondContact O-OG 2.78Å; Q67-S70 PolarHBondContact O-N 3.29Å; Q67-S70 VanDerWaalsContact O-N 3.16Å; Q67-S70 PolarHBondContact O-OG 3.05Å; L68-S70 VanDerWaalsContact C-N 3.32Å; L68-S70 PolarHBondContact O-N 2.97Å; S70-L74 PolarHBondContact O-N 2.87Å; S70-L74 VanDerWaalsContact O-N 3.15Å
71	V	85.4	Confident	80.4	Confident	0 Å²	0	63.1 Å²	63.1	0%	0	32%	0.317	C	S	.	.	H	α-helix	trans	-74	-37	176.4	-177.1	0	0	0	0	111.2	L55 Q67 L68 N73 L74 V75 I93 P110 L114	L55-V71 HydrophobicContact CD1-CG2 4.2Å; L55-V71 HydrophobicContact CD2-CG2 4.33Å; Q67-V71 WeakPolarHBondContact O-CG2 3.48Å; Q67-V71 PolarHBondContact O-N 3.19Å; Q67-V71 VanDerWaalsContact O-N 3.14Å; L68-V71 PolarHBondContact O-N 2.98Å; V71-N73 PolarHBondContact O-N 3.43Å; V71-L74 VanDerWaalsContact O-CB 3.28Å; V71-L74 WeakPolarHBondContact O-CB 2.92Å; V71-L74 PolarHBondContact O-N 3.18Å; V71-V75 WeakPolarHBondContact O-CG2 3.27Å; V71-V75 PolarHBondContact O-N 3.31Å; V71-I93 HydrophobicContact CG2-CG2 4.48Å; V71-P110 HydrophobicContact CB-CB 4.1Å; V71-P110 HydrophobicContact CG1-CB 3.55Å; V71-L114 HydrophobicContact CG1-CD1 3.7Å; V71-L114 HydrophobicContact CG1-CG 4.24Å
72	T	85.9	Confident	82	Confident	48 Å²	48	56 Å²	56	29%	0.294	28%	0.279	S	S	.	.	H	α-helix	trans	-64.7	-41.1	175.6	-54.8	0	0	0	0	111.5	L68 N69 L74 V75 Q76	L68-T72 WeakPolarHBondContact O-CB 3.44Å; L68-T72 PolarHBondContact O-N 3.09Å; L68-T72 PolarHBondContact O-OG1 2.93Å; N69-T72 PolarHBondContact O-N 2.87Å; T72-L74 VanDerWaalsContact C-N 3.29Å; T72-L74 PolarHBondContact O-N 3.19Å; T72-V75 PolarHBondContact O-N 3.35Å; T72-Q76 WeakPolarHBondContact O-CG 3.42Å; T72-Q76 PolarHBondContact O-N 3.22Å
73	N	85.9	Confident	83.4	Confident	87 Å²	87	49.5 Å²	49.5	47%	0.465	24%	0.244	S	C	.	.	H	α-helix	trans	-63.2	-36	173.5	-71.6	-22.8	0	0	0	112	N69 V71 Q76 Y77	N69-N73 WeakPolarHBondContact O-CB 3.38Å; N69-N73 PolarHBondContact O-N 2.93Å; N69-N73 PolarHBondContact O-ND2 2.66Å; V71-N73 PolarHBondContact O-N 3.43Å; N73-Q76 PolarHBondContact O-N 3.16Å; N73-Y77 VanDerWaalsContact O-CB 3.28Å; N73-Y77 WeakPolarHBondContact O-CB 3.32Å; N73-Y77 PolarHBondContact O-N 2.99Å
74	L	86.9	Confident	84.3	Confident	0 Å²	0	47.7 Å²	47.7	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-62.6	-45.5	174.1	178.8	71	0	0	0	111.8	M46 L48 I51 S70 V71 T72 Y77 Y78 I93 L114	M46-L74 HydrophobicContact SD-CB 4.25Å; M46-L74 HydrophobicContact SD-CD1 3.43Å; M46-L74 WeakPolarHBondContact SD-CD1 3.31Å; M46-L74 HydrophobicContact SD-CG 4.47Å; L48-L74 HydrophobicContact CD2-CD1 3.37Å; I51-L74 HydrophobicContact CD1-CB 4.36Å; I51-L74 HydrophobicContact CD1-CD1 4.36Å; S70-L74 PolarHBondContact O-N 2.87Å; S70-L74 VanDerWaalsContact O-N 3.15Å; V71-L74 VanDerWaalsContact O-CB 3.28Å; V71-L74 WeakPolarHBondContact O-CB 2.92Å; V71-L74 PolarHBondContact O-N 3.18Å; T72-L74 VanDerWaalsContact C-N 3.29Å; T72-L74 PolarHBondContact O-N 3.19Å; L74-Y77 PolarHBondContact O-N 3.2Å; L74-Y78 HydrophobicContact CD1-CD2 3.51Å; L74-Y78 HydrophobicContact CD1-CE2 3.41Å; L74-Y78 VanDerWaalsContact CD1-CE2 3.41Å; L74-Y78 HydrophobicContact CG-CD2 4.18Å; L74-Y78 PolarHBondContact O-N 3.08Å; L74-I93 HydrophobicContact CD2-CD1 3.87Å; L74-I93 HydrophobicContact CD2-CG2 3.92Å; L74-L114 HydrophobicContact CD2-CD1 4.3Å; L74-L114 HydrophobicContact CD2-CD2 3.87Å; L74-L114 HydrophobicContact CG-CD2 4.1Å
75	V	86.1	Confident	84.9	Confident	23 Å²	23	50 Å²	50	14%	0.139	24%	0.241	C	C	.	.	H	α-helix	trans	-58.4	-48.2	175.6	170.5	0	0	0	0	110.8	V71 T72 Y77 Y78 Q79 D113 L114 L117	V71-V75 WeakPolarHBondContact O-CG2 3.27Å; V71-V75 PolarHBondContact O-N 3.31Å; T72-V75 PolarHBondContact O-N 3.35Å; V75-Y77 VanDerWaalsContact C-N 3.3Å; V75-Y77 PolarHBondContact O-N 3.49Å; V75-Y78 CarbonylContact O-C 3.34Å; V75-Y78 PolarHBondContact O-N 3.05Å; V75-Q79 PolarHBondContact O-N 3.34Å; V75-Q79 VanDerWaalsContact O-N 3.16Å; V75-D113 HydrophobicContact CG1-CB 3.87Å; V75-D113 HydrophobicContact CG2-CB 3.88Å; V75-L114 HydrophobicContact CG2-CD2 3.63Å; V75-L114 HydrophobicContact CG2-CG 3.75Å; V75-L117 HydrophobicContact CB-CD1 4.31Å; V75-L117 HydrophobicContact CG1-CD1 3.96Å; V75-L117 WeakPolarHBondContact O-CD1 3.44Å
76	Q	84.3	Confident	85.4	Confident	121 Å²	121	44.1 Å²	44.1	57%	0.565	21%	0.214	S	C	*	.	H	α-helix	trans	-62.8	-38.7	179.2	-70.1	-179.2	5.1	0	0	112.3	T72 N73 Q79	T72-Q76 WeakPolarHBondContact O-CG 3.42Å; T72-Q76 PolarHBondContact O-N 3.22Å; N73-Q76 PolarHBondContact O-N 3.16Å; Q76-Q79 WeakPolarHBondContact O-CB 3.33Å; Q76-Q79 VanDerWaalsContact O-CG 3.29Å; Q76-Q79 WeakPolarHBondContact O-CG 3.37Å; Q76-Q79 PolarHBondContact O-N 3.41Å
77	Y	84.3	Confident	85.9	Confident	51 Å²	51	38 Å²	38	20%	0.2	19%	0.187	C	C	.	.	H	α-helix	trans	-66.8	-42.9	179.9	-179.7	-96.8	0	0	0	112.2	F43 K44 M46 N73 L74 V75 Q79	F43-Y77 WeakPolarHBondContact CA-OH 3.45Å; F43-Y77 HydrophobicContact CB-CE1 4.47Å; F43-Y77 WeakPolarHBondContact CB-OH 2.97Å; F43-Y77 AromaticContact CD1-CD1 3.85Å; F43-Y77 HydrophobicContact CD1-CD1 3.85Å; F43-Y77 HydrophobicContact CD1-CD2 4.46Å; F43-Y77 AromaticContact CD1-CE1 3.2Å; F43-Y77 HydrophobicContact CD1-CE1 3.2Å; F43-Y77 AromaticContact CD1-CE2 3.9Å; F43-Y77 HydrophobicContact CD1-CE2 3.9Å; F43-Y77 HydrophobicContact CD1-CG 4.44Å; F43-Y77 AromaticContact CD1-CZ 3.24Å; F43-Y77 VanDerWaalsContact CD1-OH 3.31Å; F43-Y77 WeakPolarHBondContact CD1-OH 3.36Å; F43-Y77 AromaticContact CE1-CD1 3.86Å; F43-Y77 HydrophobicContact CE1-CD1 3.86Å; F43-Y77 AromaticContact CE1-CE1 3.63Å; F43-Y77 HydrophobicContact CE1-CE1 3.63Å; F43-Y77 WeakPolarHBondContact CE1-O 3.45Å; F43-Y77 HydrophobicContact CG-CE1 4.16Å; K44-Y77 PolarHBondContact N-OH 3.45Å; K44-Y77 PolarHBondContact O-OH 3.3Å; M46-Y77 HydrophobicContact CB-CD1 4.25Å; M46-Y77 HydrophobicContact CB-CE1 3.77Å; M46-Y77 HydrophobicContact CB-CE2 4.34Å; M46-Y77 HydrophobicContact CE-CD1 3.8Å; M46-Y77 HydrophobicContact CE-CD2 3.63Å; M46-Y77 HydrophobicContact CE-CE1 4.42Å; M46-Y77 HydrophobicContact CE-CE2 4.28Å; M46-Y77 HydrophobicContact CE-CG 3.33Å; M46-Y77 HydrophobicContact SD-CD1 3.81Å; M46-Y77 HydrophobicContact SD-CE1 4.29Å; M46-Y77 HydrophobicContact SD-CG 3.99Å; N73-Y77 VanDerWaalsContact O-CB 3.28Å; N73-Y77 WeakPolarHBondContact O-CB 3.32Å; N73-Y77 PolarHBondContact O-N 2.99Å; L74-Y77 PolarHBondContact O-N 3.2Å; V75-Y77 VanDerWaalsContact C-N 3.3Å; V75-Y77 PolarHBondContact O-N 3.49Å; Y77-Q79 PolarHBondContact O-N 3.47Å
78	Y	86.3	Confident	86.2	Confident	4 Å²	4	39.9 Å²	39.9	2%	0.016	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.6	21.6	178.2	-70.6	-68.5	0	0	0	114.7	F43 L48 L74 V75 N80 G81 F82 P83 D86 V90	F43-Y78 HydrophobicContact CD1-CE1 4.25Å; F43-Y78 AromaticContact CE1-CD1 3.53Å; F43-Y78 HydrophobicContact CE1-CD1 3.53Å; F43-Y78 AromaticContact CE1-CE1 3.66Å; F43-Y78 HydrophobicContact CE1-CE1 3.66Å; F43-Y78 HydrophobicContact CE1-CG 4.42Å; F43-Y78 AromaticContact CZ-CD1 3.62Å; F43-Y78 HydrophobicContact CZ-CD1 3.62Å; F43-Y78 AromaticContact CZ-CE1 3.84Å; F43-Y78 HydrophobicContact CZ-CE1 3.84Å; L48-Y78 HydrophobicContact CD2-CE2 4.25Å; L74-Y78 HydrophobicContact CD1-CD2 3.51Å; L74-Y78 HydrophobicContact CD1-CE2 3.41Å; L74-Y78 VanDerWaalsContact CD1-CE2 3.41Å; L74-Y78 HydrophobicContact CG-CD2 4.18Å; L74-Y78 PolarHBondContact O-N 3.08Å; V75-Y78 CarbonylContact O-C 3.34Å; V75-Y78 PolarHBondContact O-N 3.05Å; Y78-N80 PolarHBondContact O-N 2.95Å; Y78-G81 PolarHBondContact O-N 3.33Å; Y78-F82 AromaticContact CD1-CD1 3.87Å; Y78-F82 HydrophobicContact CD1-CD1 3.87Å; Y78-F82 HydrophobicContact CD1-CE1 4.39Å; Y78-F82 HydrophobicContact CD2-CD1 4.04Å; Y78-F82 AromaticContact CD2-CE1 3.86Å; Y78-F82 HydrophobicContact CD2-CE1 3.86Å; Y78-F82 AromaticContact CG-CD1 3.58Å; Y78-F82 HydrophobicContact CG-CD1 3.58Å; Y78-F82 AromaticContact CG-CE1 3.64Å; Y78-F82 HydrophobicContact CG-CE1 3.64Å; Y78-P83 HydrophobicContact CE1-CG 3.98Å; Y78-D86 PolarHBondContact OH-OD2 3.29Å; Y78-V90 HydrophobicContact CE2-CG2 4.32Å
79	Q	83.3	Confident	86.5	Confident	126 Å²	126	40.8 Å²	40.8	59%	0.589	21%	0.207	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54	-18.8	-177.9	65.3	-178.3	-33.8	0	0	115.5	V75 Q76 Y77 L120	V75-Q79 PolarHBondContact O-N 3.34Å; V75-Q79 VanDerWaalsContact O-N 3.16Å; Q76-Q79 WeakPolarHBondContact O-CB 3.33Å; Q76-Q79 VanDerWaalsContact O-CG 3.29Å; Q76-Q79 WeakPolarHBondContact O-CG 3.37Å; Q76-Q79 PolarHBondContact O-N 3.41Å; Y77-Q79 PolarHBondContact O-N 3.47Å; Q79-L120 WeakPolarHBondContact O-CD1 2.86Å
80	N	78.6	Confident	86.9	Confident	54 Å²	54	37 Å²	37	29%	0.289	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	-105.6	9.8	180	-56.8	-59.5	0	0	0	114.3	Y78 I176	Y78-N80 PolarHBondContact O-N 2.95Å; N80-I176 HydrophobicContact CB-CD1 3.64Å; N80-I176 HydrophobicContact CB-CG1 4.43Å
81	G	84.3	Confident	87.2	Confident	0 Å²	0	36.2 Å²	36.2	0%	0	18%	0.18	C	C	.	.			trans	113.2	161.4	178.3	0	0	0	0	0	114.2	Y78 L123	Y78-G81 PolarHBondContact O-N 3.33Å; G81-L123 WeakPolarHBondContact O-CD1 3.37Å
82	F	88.3	Confident	87.5	Confident	0 Å²	0	40.6 Å²	40.6	0%	0	20%	0.2	C	C	.	.			trans	-93.4	131	-175.2	-63.4	-59.5	0	0	0	112.8	Y78 L87 V90 L114 L117 C118 F122 L123	Y78-F82 AromaticContact CD1-CD1 3.87Å; Y78-F82 HydrophobicContact CD1-CD1 3.87Å; Y78-F82 HydrophobicContact CD1-CE1 4.39Å; Y78-F82 HydrophobicContact CD2-CD1 4.04Å; Y78-F82 AromaticContact CD2-CE1 3.86Å; Y78-F82 HydrophobicContact CD2-CE1 3.86Å; Y78-F82 AromaticContact CG-CD1 3.58Å; Y78-F82 HydrophobicContact CG-CD1 3.58Å; Y78-F82 AromaticContact CG-CE1 3.64Å; Y78-F82 HydrophobicContact CG-CE1 3.64Å; F82-L87 HydrophobicContact CB-CD1 4.01Å; F82-V90 HydrophobicContact CD1-CG1 4.14Å; F82-V90 HydrophobicContact CD1-CG2 4.09Å; F82-V90 HydrophobicContact CE1-CG1 3.7Å; F82-V90 HydrophobicContact CE1-CG2 4.15Å; F82-V90 HydrophobicContact CE2-CG1 4.26Å; F82-V90 HydrophobicContact CZ-CG1 3.77Å; F82-L114 HydrophobicContact CZ-CD2 4.26Å; F82-L117 HydrophobicContact CE1-CD1 4.48Å; F82-L117 HydrophobicContact CE2-CB 3.6Å; F82-L117 HydrophobicContact CZ-CB 3.6Å; F82-L117 HydrophobicContact CZ-CD1 4.05Å; F82-L117 HydrophobicContact CZ-CG 4.5Å; F82-C118 HydrophobicContact CE2-CB 4.49Å; F82-F122 HydrophobicContact CB-CD1 4.43Å; F82-F122 WeakPolarHBondContact O-CA 3.46Å; F82-L123 PolarHBondContact O-N 2.87Å
83	P	89.3	Confident	87.7	Confident	0 Å²	0	38.3 Å²	38.3	0%	0	19%	0.186	C	C	.	.	B	Isolated β-bridge	trans	-62.9	136.9	163.7	-23.4	36.2	0	0	0	112	F43 Y78 R85 D86 L87 L123 Y179	F43-P83 HydrophobicContact CD2-CG 4.28Å; F43-P83 HydrophobicContact CE2-CG 3.84Å; F43-P83 HydrophobicContact CZ-CG 4.32Å; Y78-P83 HydrophobicContact CE1-CG 3.98Å; P83-R85 HydrophobicContact CB-CG 3.97Å; P83-R85 PolarHBondContact O-N 3.36Å; P83-D86 HydrophobicContact CB-CB 4.41Å; P83-D86 WeakPolarHBondContact CG-OD2 3.21Å; P83-D86 PolarHBondContact O-N 3.09Å; P83-L87 PolarHBondContact O-N 2.97Å; P83-L123 WeakPolarHBondContact CA-O 3.46Å; P83-Y179 HydrophobicContact CB-CE1 3.9Å; P83-Y179 HydrophobicContact CG-CE1 3.99Å
84	L	89.4	Confident	87.9	Confident	3 Å²	3	34.3 Å²	34.3	2%	0.016	16%	0.164	C	C	.	.	G	3₁₀ helix	trans	-53.1	-40.6	178.2	-69.8	176.4	0	0	0	112.7	D86 L87 F122 L123 K124 D129 E130 Y133 T137 V182 Y186	L84-D86 PolarHBondContact O-N 3.12Å; L84-L87 VanDerWaalsContact O-CB 3.29Å; L84-L87 WeakPolarHBondContact O-CB 3.25Å; L84-L87 PolarHBondContact O-N 3.18Å; L84-F122 HydrophobicContact CD2-CB 3.87Å; L84-F122 HydrophobicContact CD2-CD2 4.1Å; L84-F122 HydrophobicContact CD2-CG 4.36Å; L84-L123 PolarHBondContact N-O 2.99Å; L84-K124 HydrophobicContact CD1-CB 4.14Å; L84-D129 HydrophobicContact CD1-CB 4.11Å; L84-E130 HydrophobicContact CD1-CG 4.47Å; L84-Y133 HydrophobicContact CB-CD2 3.79Å; L84-Y133 HydrophobicContact CB-CG 4.08Å; L84-T137 HydrophobicContact CD2-CG2 4.42Å; L84-V182 HydrophobicContact CD1-CG2 3.91Å; L84-V182 HydrophobicContact CD2-CG2 4.36Å; L84-V182 HydrophobicContact CG-CG2 4.22Å; L84-Y186 HydrophobicContact CD2-CE1 4.21Å
85	R	88.8	Confident	88.1	Confident	107 Å²	107	35.5 Å²	35.5	40%	0.404	17%	0.173	S	C	.	.	G	3₁₀ helix	trans	-62.7	-23.5	178.8	61	156	-161.3	-156.8	1	115.5	P83 Y133 Y179	P83-R85 HydrophobicContact CB-CG 3.97Å; P83-R85 PolarHBondContact O-N 3.36Å; R85-Y133 HydrophobicContact CB-CE1 4.04Å; R85-Y133 HydrophobicContact CB-CE2 4.09Å; R85-Y133 WeakPolarHBondContact CB-OH 3.49Å; R85-Y179 PolarHBondContact NH2-OH 3.18Å
86	D	89.6	Confident	88.3	Confident	18 Å²	18	35.4 Å²	35.4	10%	0.096	17%	0.171	C	C	.	.	G	3₁₀ helix	trans	-100	-8.4	-174.6	-60.5	-15.1	0	0	0	110.6	L48 Y78 P83 L84 A88 Q89 V90	L48-D86 HydrophobicContact CD1-CB 4Å; Y78-D86 PolarHBondContact OH-OD2 3.29Å; P83-D86 HydrophobicContact CB-CB 4.41Å; P83-D86 WeakPolarHBondContact CG-OD2 3.21Å; P83-D86 PolarHBondContact O-N 3.09Å; L84-D86 PolarHBondContact O-N 3.12Å; D86-A88 PolarHBondContact O-N 3.03Å; D86-Q89 PolarHBondContact O-N 3.46Å; D86-V90 WeakPolarHBondContact O-CG2 3.28Å; D86-V90 PolarHBondContact O-N 3.42Å
87	L	90.1	Very high	88.5	Confident	0 Å²	0	29.6 Å²	29.6	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-61.5	-46.9	-169.3	-158.4	87.9	0	0	0	112.4	F82 P83 L84 Q89 V90 F91 F122 T137 S140	F82-L87 HydrophobicContact CB-CD1 4.01Å; P83-L87 PolarHBondContact O-N 2.97Å; L84-L87 VanDerWaalsContact O-CB 3.29Å; L84-L87 WeakPolarHBondContact O-CB 3.25Å; L84-L87 PolarHBondContact O-N 3.18Å; L87-Q89 VanDerWaalsContact C-N 3.29Å; L87-Q89 PolarHBondContact O-N 3.38Å; L87-V90 PolarHBondContact O-N 3.16Å; L87-F91 HydrophobicContact CD1-CD2 4.28Å; L87-F91 HydrophobicContact CD1-CE2 3.84Å; L87-F91 HydrophobicContact CD2-CE2 4.44Å; L87-F91 HydrophobicContact CG-CD2 3.85Å; L87-F91 HydrophobicContact CG-CE2 3.83Å; L87-F91 WeakPolarHBondContact O-CB 3.43Å; L87-F91 VanDerWaalsContact O-CD2 3.31Å; L87-F91 WeakPolarHBondContact O-CD2 3.01Å; L87-F91 PolarHBondContact O-N 3.33Å; L87-F122 HydrophobicContact CD1-CD1 4.14Å; L87-F122 HydrophobicContact CD1-CD2 4.43Å; L87-F122 HydrophobicContact CD1-CE1 3.87Å; L87-F122 HydrophobicContact CD1-CE2 4.17Å; L87-F122 HydrophobicContact CD1-CG 4.43Å; L87-F122 HydrophobicContact CD1-CZ 3.88Å; L87-F122 HydrophobicContact CD2-CE2 4.35Å; L87-T137 HydrophobicContact CD2-CG2 3.8Å; L87-S140 WeakPolarHBondContact CD2-OG 3.19Å
88	A	90.7	Very high	88.7	Confident	45 Å²	45	27.4 Å²	27.4	37%	0.372	14%	0.136	S	C	.	.	H	α-helix	trans	-57.5	-41.3	179.4	0	0	0	0	0	112.5	D86 K92 D136	D86-A88 PolarHBondContact O-N 3.03Å; A88-K92 WeakPolarHBondContact O-CB 3.12Å; A88-K92 PolarHBondContact O-N 2.98Å; A88-D136 HydrophobicContact CB-CB 4.47Å
89	Q	90.3	Very high	88.8	Confident	67 Å²	67	32.5 Å²	32.5	31%	0.313	16%	0.164	S	C	.	.	H	α-helix	trans	-73.2	-40.2	179.3	-69.2	175.2	-0.2	0	0	111.9	L48 I52 D86 L87 F91 K92 I93	L48-Q89 HydrophobicContact CB-CB 4.04Å; L48-Q89 HydrophobicContact CD1-CB 3.76Å; I52-Q89 HydrophobicContact CD1-CB 4.23Å; I52-Q89 HydrophobicContact CD1-CG 4.41Å; D86-Q89 PolarHBondContact O-N 3.46Å; L87-Q89 VanDerWaalsContact C-N 3.29Å; L87-Q89 PolarHBondContact O-N 3.38Å; Q89-F91 VanDerWaalsContact C-N 3.34Å; Q89-F91 PolarHBondContact O-N 3.04Å; Q89-K92 WeakPolarHBondContact O-CB 3.38Å; Q89-K92 PolarHBondContact O-N 3.04Å; Q89-I93 WeakPolarHBondContact O-CG1 3.09Å; Q89-I93 PolarHBondContact O-N 3.44Å
90	V	91.3	Very high	88.9	Confident	2 Å²	2	27.4 Å²	27.4	1%	0.012	14%	0.139	C	C	.	.	H	α-helix	trans	-61.4	-43.6	174.7	170.7	0	0	0	0	111	L48 Y78 F82 D86 L87 K92 I93 L94	L48-V90 HydrophobicContact CD1-CG2 4.24Å; Y78-V90 HydrophobicContact CE2-CG2 4.32Å; F82-V90 HydrophobicContact CD1-CG1 4.14Å; F82-V90 HydrophobicContact CD1-CG2 4.09Å; F82-V90 HydrophobicContact CE1-CG1 3.7Å; F82-V90 HydrophobicContact CE1-CG2 4.15Å; F82-V90 HydrophobicContact CE2-CG1 4.26Å; F82-V90 HydrophobicContact CZ-CG1 3.77Å; D86-V90 WeakPolarHBondContact O-CG2 3.28Å; D86-V90 PolarHBondContact O-N 3.42Å; L87-V90 PolarHBondContact O-N 3.16Å; V90-K92 VanDerWaalsContact C-N 3.34Å; V90-I93 WeakPolarHBondContact O-CB 3.43Å; V90-I93 PolarHBondContact O-N 2.79Å; V90-L94 PolarHBondContact O-N 3.32Å
91	F	91.9	Very high	89.4	Confident	4 Å²	4	25.4 Å²	25.4	2%	0.018	13%	0.129	C	C	.	.	H	α-helix	trans	-70.6	-30.5	177.9	-85.9	-99	0	0	0	112.4	L87 Q89 L94 S95 C118 S140 L143 L144	L87-F91 HydrophobicContact CD1-CD2 4.28Å; L87-F91 HydrophobicContact CD1-CE2 3.84Å; L87-F91 HydrophobicContact CD2-CE2 4.44Å; L87-F91 HydrophobicContact CG-CD2 3.85Å; L87-F91 HydrophobicContact CG-CE2 3.83Å; L87-F91 WeakPolarHBondContact O-CB 3.43Å; L87-F91 VanDerWaalsContact O-CD2 3.31Å; L87-F91 WeakPolarHBondContact O-CD2 3.01Å; L87-F91 PolarHBondContact O-N 3.33Å; Q89-F91 VanDerWaalsContact C-N 3.34Å; Q89-F91 PolarHBondContact O-N 3.04Å; F91-L94 HydrophobicContact CD1-CD2 4.29Å; F91-L94 HydrophobicContact CE1-CD2 4.33Å; F91-L94 PolarHBondContact O-N 3.38Å; F91-S95 PolarHBondContact O-N 3.41Å; F91-C118 HydrophobicContact CZ-CB 4.44Å; F91-C118 VanDerWaalsContact CZ-SG 3.56Å; F91-S140 WeakPolarHBondContact CD1-O 3.36Å; F91-S140 VanDerWaalsContact CD2-CB 3.5Å; F91-S140 WeakPolarHBondContact CE1-O 3.45Å; F91-L143 HydrophobicContact CB-CD2 3.89Å; F91-L143 HydrophobicContact CD1-CB 4.08Å; F91-L143 HydrophobicContact CD1-CD2 3.94Å; F91-L143 HydrophobicContact CD1-CG 4.47Å; F91-L143 HydrophobicContact CG-CD2 4.44Å; F91-L143 WeakPolarHBondContact O-CD2 3.37Å; F91-L144 HydrophobicContact CE1-CD1 4.5Å; F91-L144 HydrophobicContact CE1-CD2 3.61Å; F91-L144 HydrophobicContact CE1-CG 3.75Å; F91-L144 HydrophobicContact CZ-CD2 4.15Å; F91-L144 HydrophobicContact CZ-CG 4.28Å
92	K	91.4	Very high	89.3	Confident	93 Å²	93	32.1 Å²	32.1	40%	0.404	16%	0.16	S	C	.	.	H	α-helix	trans	-63.2	-43.1	168.8	-176.6	59.2	176.5	175.7	0	111.9	I52 A88 Q89 V90 L94 S95 L96	I52-K92 HydrophobicContact CD1-CB 4.28Å; I52-K92 HydrophobicContact CD1-CG 4.13Å; I52-K92 HydrophobicContact CG1-CG 4.39Å; I52-K92 HydrophobicContact CG2-CG 4.48Å; A88-K92 WeakPolarHBondContact O-CB 3.12Å; A88-K92 PolarHBondContact O-N 2.98Å; Q89-K92 WeakPolarHBondContact O-CB 3.38Å; Q89-K92 PolarHBondContact O-N 3.04Å; V90-K92 VanDerWaalsContact C-N 3.34Å; K92-L94 VanDerWaalsContact C-N 3.33Å; K92-S95 WeakPolarHBondContact O-CB 3.46Å; K92-S95 PolarHBondContact O-N 2.73Å; K92-L96 WeakPolarHBondContact O-CG 3.39Å; K92-L96 PolarHBondContact O-N 3.4Å; K92-L96 VanDerWaalsContact O-N 3.08Å
93	I	90.9	Very high	89	Confident	0 Å²	0	39.8 Å²	39.8	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-60.3	-44.4	173.7	-69.9	167.6	0	0	0	110.4	L48 I51 I52 L55 V71 L74 Q89 V90 S95 L96 C97 L114	L48-I93 HydrophobicContact CB-CD1 4.32Å; L48-I93 HydrophobicContact CD2-CD1 4.03Å; I51-I93 HydrophobicContact CB-CD1 4Å; I51-I93 HydrophobicContact CG2-CD1 3.84Å; I51-I93 HydrophobicContact CG2-CG1 4.18Å; I51-I93 HydrophobicContact CG2-CG2 4.31Å; I52-I93 HydrophobicContact CD1-CG1 4.34Å; I52-I93 HydrophobicContact CG1-CD1 4.16Å; I52-I93 HydrophobicContact CG1-CG1 3.52Å; L55-I93 HydrophobicContact CD1-CB 4.39Å; L55-I93 HydrophobicContact CD1-CG1 4.49Å; L55-I93 HydrophobicContact CD1-CG2 3.72Å; V71-I93 HydrophobicContact CG2-CG2 4.48Å; L74-I93 HydrophobicContact CD2-CD1 3.87Å; L74-I93 HydrophobicContact CD2-CG2 3.92Å; Q89-I93 WeakPolarHBondContact O-CG1 3.09Å; Q89-I93 PolarHBondContact O-N 3.44Å; V90-I93 WeakPolarHBondContact O-CB 3.43Å; V90-I93 PolarHBondContact O-N 2.79Å; I93-S95 PolarHBondContact O-N 3.28Å; I93-L96 PolarHBondContact O-N 3.3Å; I93-C97 PolarHBondContact O-N 3.28Å; I93-C97 PolarHBondContact O-SG 3.34Å; I93-L114 HydrophobicContact CG2-CD1 4.28Å
94	L	91	Very high	88.8	Confident	3 Å²	3	40.9 Å²	40.9	2%	0.016	20%	0.199	C	C	.	.	H	α-helix	trans	-61.1	-42.3	177.5	-176.6	63.4	0	0	0	112.1	V90 F91 K92 C97 A98 A111 L114 I115 L144 L147	V90-L94 PolarHBondContact O-N 3.32Å; F91-L94 HydrophobicContact CD1-CD2 4.29Å; F91-L94 HydrophobicContact CE1-CD2 4.33Å; F91-L94 PolarHBondContact O-N 3.38Å; K92-L94 VanDerWaalsContact C-N 3.33Å; L94-C97 PolarHBondContact O-N 3.09Å; L94-A98 WeakPolarHBondContact O-CB 3.19Å; L94-A98 PolarHBondContact O-N 3.05Å; L94-A111 HydrophobicContact CD1-CB 4.02Å; L94-L114 HydrophobicContact CD1-CB 4.18Å; L94-L114 HydrophobicContact CD1-CD1 4.41Å; L94-I115 HydrophobicContact CD1-CD1 4.08Å; L94-I115 HydrophobicContact CD1-CG1 3.86Å; L94-I115 HydrophobicContact CD2-CD1 4.43Å; L94-I115 HydrophobicContact CD2-CG1 3.78Å; L94-I115 HydrophobicContact CG-CG1 4.44Å; L94-L144 HydrophobicContact CD2-CD2 4.34Å; L94-L147 HydrophobicContact CD2-CD1 3.47Å; L94-L147 VanDerWaalsContact CD2-CD1 3.47Å; L94-L147 HydrophobicContact CG-CD1 3.66Å
95	S	90.6	Very high	88.6	Confident	25 Å²	25	45.2 Å²	45.2	18%	0.175	23%	0.227	C	C	.	.	H	α-helix	trans	-58.1	-47.8	173.7	-167.2	0	0	0	0	111.9	F91 K92 I93 C97 A98 D99	F91-S95 PolarHBondContact O-N 3.41Å; K92-S95 WeakPolarHBondContact O-CB 3.46Å; K92-S95 PolarHBondContact O-N 2.73Å; I93-S95 PolarHBondContact O-N 3.28Å; S95-C97 VanDerWaalsContact C-N 3.32Å; S95-C97 PolarHBondContact O-N 3.13Å; S95-A98 WeakPolarHBondContact O-CB 3.43Å; S95-A98 PolarHBondContact O-N 3.21Å; S95-A98 VanDerWaalsContact O-N 3.12Å; S95-D99 VanDerWaalsContact O-CG 3.29Å; S95-D99 PolarHBondContact O-N 3.4Å
96	L	89.8	Confident	88.4	Confident	20 Å²	20	42.4 Å²	42.4	11%	0.105	22%	0.223	C	C	.	.	H	α-helix	trans	-65.9	-36.1	-179.7	-68.5	172	0	0	0	112	I52 L55 E56 K92 I93 A98 K100	I52-L96 HydrophobicContact CG2-CD1 4.03Å; L55-L96 HydrophobicContact CB-CB 4.03Å; L55-L96 HydrophobicContact CB-CD1 3.94Å; L55-L96 HydrophobicContact CD1-CB 4.34Å; E56-L96 HydrophobicContact CG-CD1 4Å; E56-L96 HydrophobicContact CG-CD2 4.28Å; K92-L96 WeakPolarHBondContact O-CG 3.39Å; K92-L96 PolarHBondContact O-N 3.4Å; K92-L96 VanDerWaalsContact O-N 3.08Å; I93-L96 PolarHBondContact O-N 3.3Å; L96-A98 VanDerWaalsContact C-N 3.33Å; L96-K100 WeakPolarHBondContact O-CG 3.3Å; L96-K100 PolarHBondContact O-N 3.26Å
97	C	89.1	Confident	88.3	Confident	0 Å²	0	41.5 Å²	41.5	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-63	-43.6	172.1	-64.9	0	0	0	0	110.5	I93 L94 S95 K100 I101 F107 A111	I93-C97 PolarHBondContact O-N 3.28Å; I93-C97 PolarHBondContact O-SG 3.34Å; L94-C97 PolarHBondContact O-N 3.09Å; S95-C97 VanDerWaalsContact C-N 3.32Å; S95-C97 PolarHBondContact O-N 3.13Å; C97-K100 PolarHBondContact O-N 3.23Å; C97-I101 WeakPolarHBondContact O-CG1 3.48Å; C97-I101 PolarHBondContact O-N 3.08Å; C97-F107 HydrophobicContact CB-CD1 4.29Å; C97-A111 HydrophobicContact CB-CB 4.21Å
98	A	88.1	Confident	88.2	Confident	4 Å²	4	42.3 Å²	42.3	3%	0.033	22%	0.223	C	C	.	.	H	α-helix	trans	-64.4	-42	179.8	0	0	0	0	0	113.4	L94 S95 L96 K100 I101 L147 V150	L94-A98 WeakPolarHBondContact O-CB 3.19Å; L94-A98 PolarHBondContact O-N 3.05Å; S95-A98 WeakPolarHBondContact O-CB 3.43Å; S95-A98 PolarHBondContact O-N 3.21Å; S95-A98 VanDerWaalsContact O-N 3.12Å; L96-A98 VanDerWaalsContact C-N 3.33Å; A98-K100 PolarHBondContact O-N 2.9Å; A98-I101 WeakPolarHBondContact O-CB 3.37Å; A98-I101 PolarHBondContact O-N 3.17Å; A98-I101 VanDerWaalsContact O-N 3.15Å; A98-L147 HydrophobicContact CB-CD2 3.24Å; A98-V150 HydrophobicContact CB-CG2 4.01Å
99	D	87.9	Confident	88.1	Confident	111 Å²	111	44.8 Å²	44.8	59%	0.594	23%	0.227	S	C	*	.	H	α-helix	trans	-61.6	-29.9	176.8	-66	-25.5	0	0	0	112.1	S95	S95-D99 VanDerWaalsContact O-CG 3.29Å; S95-D99 PolarHBondContact O-N 3.4Å
100	K	86.8	Confident	88	Confident	19 Å²	19	41.9 Å²	41.9	8%	0.083	21%	0.214	C	C	.	.	H	α-helix	trans	-79.8	-21.9	177.6	-72.8	177.4	179	-78.1	0	113.8	L55 V57 L96 C97 A98 E102 K103 Q104 F107	L55-K100 WeakPolarHBondContact O-CE 3.45Å; L55-K100 PolarHBondContact O-NZ 2.91Å; V57-K100 PolarHBondContact O-NZ 3.37Å; L96-K100 WeakPolarHBondContact O-CG 3.3Å; L96-K100 PolarHBondContact O-N 3.26Å; C97-K100 PolarHBondContact O-N 3.23Å; A98-K100 PolarHBondContact O-N 2.9Å; K100-E102 PolarHBondContact O-N 3.42Å; K100-E102 VanDerWaalsContact O-N 3.16Å; K100-K103 PolarHBondContact O-N 2.88Å; K100-Q104 PolarHBondContact O-N 3.49Å; K100-F107 HydrophobicContact CB-CD2 4.17Å; K100-F107 HydrophobicContact CB-CE2 4.49Å; K100-F107 HydrophobicContact CB-CG 4.38Å; K100-F107 HydrophobicContact CD-CE1 4.35Å; K100-F107 HydrophobicContact CD-CE2 4.17Å; K100-F107 HydrophobicContact CD-CZ 4.03Å
101	I	88.5	Confident	87.9	Confident	12 Å²	12	41.8 Å²	41.8	6%	0.062	21%	0.213	C	C	.	.	H	α-helix	trans	-57.5	-35	-174.4	-74.3	170.3	0	0	0	112.7	C97 A98 K103 Q104 F107 V108 A111 V150 L155	C97-I101 WeakPolarHBondContact O-CG1 3.48Å; C97-I101 PolarHBondContact O-N 3.08Å; A98-I101 WeakPolarHBondContact O-CB 3.37Å; A98-I101 PolarHBondContact O-N 3.17Å; A98-I101 VanDerWaalsContact O-N 3.15Å; I101-K103 VanDerWaalsContact C-N 3.26Å; I101-K103 PolarHBondContact O-N 3.27Å; I101-Q104 CarbonylContact O-C 3.32Å; I101-F107 HydrophobicContact CG1-CB 3.99Å; I101-V108 HydrophobicContact CB-CG2 4.43Å; I101-V108 HydrophobicContact CD1-CG2 4.08Å; I101-V108 HydrophobicContact CG1-CG2 4.02Å; I101-V108 HydrophobicContact CG2-CG2 3.58Å; I101-A111 HydrophobicContact CD1-CB 4.28Å; I101-V150 HydrophobicContact CB-CG1 4.22Å; I101-V150 HydrophobicContact CD1-CG1 4.27Å; I101-V150 HydrophobicContact CG2-CG1 3.93Å; I101-L155 HydrophobicContact CD1-CD1 4.44Å; I101-L155 HydrophobicContact CD1-CD2 3.82Å
102	E	82.1	Confident	87.9	Confident	141 Å²	141	41.8 Å²	41.8	66%	0.659	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.6	-32.1	179.8	-67.7	-164.1	157.8	0	0	113	K100	K100-E102 PolarHBondContact O-N 3.42Å; K100-E102 VanDerWaalsContact O-N 3.16Å
103	K	82	Confident	87.7	Confident	162 Å²	162	40.6 Å²	40.6	70%	0.704	21%	0.212	S	C	*	.	T	Hydrogen-bonded Turn	trans	-99.8	-30.7	-179.6	-62.9	-178.7	-179.2	179.6	0	112.7	K100 I101	K100-K103 PolarHBondContact O-N 2.88Å; I101-K103 VanDerWaalsContact C-N 3.26Å; I101-K103 PolarHBondContact O-N 3.27Å
104	Q	84.9	Confident	87.7	Confident	23 Å²	23	40.6 Å²	40.6	11%	0.107	21%	0.212	C	C	.	.			trans	-131.4	85.6	-173.4	-68.8	174.4	-32.6	0	0	109.8	E64 K100 I101 C106 F107	E64-Q104 PolarHBondContact OE2-NE2 2.98Å; E64-Q104 VanDerWaalsContact OE2-NE2 3.13Å; K100-Q104 PolarHBondContact O-N 3.49Å; I101-Q104 CarbonylContact O-C 3.32Å; Q104-C106 PolarHBondContact O-N 3.47Å; Q104-F107 HydrophobicContact CB-CD2 3.73Å; Q104-F107 HydrophobicContact CB-CE2 4.07Å; Q104-F107 PolarHBondContact O-N 3.35Å; Q104-F107 VanDerWaalsContact OE1-CE2 3.23Å
105	P	84.2	Confident	87.7	Confident	94 Å²	94	40.5 Å²	40.5	61%	0.61	21%	0.211	S	C	*	.	G	3₁₀ helix	trans	-61	-18.8	-177.1	-25.3	35	0	0	0	114.8	F107 V108	P105-F107 PolarHBondContact O-N 2.73Å; P105-V108 WeakPolarHBondContact O-CB 3.4Å; P105-V108 VanDerWaalsContact O-CG2 3.24Å; P105-V108 WeakPolarHBondContact O-CG2 3.35Å; P105-V108 PolarHBondContact O-N 3.25Å; P105-V108 VanDerWaalsContact O-N 3.1Å
106	C	85	Confident	87.7	Confident	47 Å²	47	45.5 Å²	45.5	32%	0.318	23%	0.23	S	C	.	.	G	3₁₀ helix	trans	-58.9	-24.8	176.3	59.6	0	0	0	0	113.3	E64 Q104 V108 P110	E64-C106 PolarHBondContact OE1-SG 2.99Å; Q104-C106 PolarHBondContact O-N 3.47Å; C106-V108 PolarHBondContact O-N 2.77Å; C106-P110 VanDerWaalsContact O-CD 3.3Å; C106-P110 WeakPolarHBondContact O-CD 3.31Å
107	F	87.6	Confident	87.6	Confident	0 Å²	0	45.5 Å²	45.5	0%	0	23%	0.23	C	C	.	.	G	3₁₀ helix	trans	-73	-8.1	176.6	-78.7	-89.5	0	0	0	114.2	L55 E64 Q67 L68 C97 K100 I101 Q104 P105 E109 P110 A111	L55-F107 HydrophobicContact CD2-CE1 3.85Å; L55-F107 HydrophobicContact CD2-CZ 4.4Å; E64-F107 HydrophobicContact CG-CE2 4.28Å; Q67-F107 HydrophobicContact CB-CE1 4.18Å; Q67-F107 HydrophobicContact CB-CZ 3.74Å; L68-F107 HydrophobicContact CD1-CD1 4.49Å; C97-F107 HydrophobicContact CB-CD1 4.29Å; K100-F107 HydrophobicContact CB-CD2 4.17Å; K100-F107 HydrophobicContact CB-CE2 4.49Å; K100-F107 HydrophobicContact CB-CG 4.38Å; K100-F107 HydrophobicContact CD-CE1 4.35Å; K100-F107 HydrophobicContact CD-CE2 4.17Å; K100-F107 HydrophobicContact CD-CZ 4.03Å; I101-F107 HydrophobicContact CG1-CB 3.99Å; Q104-F107 HydrophobicContact CB-CD2 3.73Å; Q104-F107 HydrophobicContact CB-CE2 4.07Å; Q104-F107 PolarHBondContact O-N 3.35Å; Q104-F107 VanDerWaalsContact OE1-CE2 3.23Å; P105-F107 PolarHBondContact O-N 2.73Å; F107-E109 PolarHBondContact O-N 2.92Å; F107-P110 WeakPolarHBondContact O-CD 3.41Å; F107-A111 WeakPolarHBondContact O-CB 3.01Å; F107-A111 PolarHBondContact O-N 3.33Å; F107-A111 VanDerWaalsContact O-N 3.14Å
108	V	88.3	Confident	87.5	Confident	17 Å²	17	45.5 Å²	45.5	10%	0.103	23%	0.23	C	C	.	.	H	α-helix	trans	-63.4	-41.8	178.1	174.4	0	0	0	0	111.8	I101 P105 C106 S112 K154	I101-V108 HydrophobicContact CB-CG2 4.43Å; I101-V108 HydrophobicContact CD1-CG2 4.08Å; I101-V108 HydrophobicContact CG1-CG2 4.02Å; I101-V108 HydrophobicContact CG2-CG2 3.58Å; P105-V108 WeakPolarHBondContact O-CB 3.4Å; P105-V108 VanDerWaalsContact O-CG2 3.24Å; P105-V108 WeakPolarHBondContact O-CG2 3.35Å; P105-V108 PolarHBondContact O-N 3.25Å; P105-V108 VanDerWaalsContact O-N 3.1Å; C106-V108 PolarHBondContact O-N 2.77Å; V108-S112 VanDerWaalsContact O-CB 3.23Å; V108-S112 WeakPolarHBondContact O-CB 2.97Å; V108-S112 PolarHBondContact O-N 3.12Å; V108-S112 PolarHBondContact O-OG 2.96Å; V108-K154 HydrophobicContact CG1-CB 4.34Å; V108-K154 HydrophobicContact CG1-CD 4.39Å; V108-K154 HydrophobicContact CG1-CG 4.47Å
109	E	88.7	Confident	87.3	Confident	96 Å²	96	45.5 Å²	45.5	45%	0.449	23%	0.23	S	C	.	.	H	α-helix	trans	-66.6	-53.5	-179.3	-60.5	-63.1	152.4	0	0	111.9	F107 A111 S112 D113 K154	F107-E109 PolarHBondContact O-N 2.92Å; E109-A111 VanDerWaalsContact C-N 3.32Å; E109-A111 PolarHBondContact O-N 3.1Å; E109-S112 WeakPolarHBondContact O-CB 3.23Å; E109-S112 PolarHBondContact O-N 3.15Å; E109-S112 VanDerWaalsContact O-N 3.1Å; E109-D113 PolarHBondContact O-N 2.87Å; E109-K154 WeakPolarHBondContact OE1-CE 3.48Å; E109-K154 IonicContact OE1-NZ 3.58Å; E109-K154 PolarHBondContact OE1-NZ 2.88Å; E109-K154 WeakPolarHBondContact OE2-CE 3.47Å; E109-K154 IonicContact OE2-NZ 3.65Å; E109-K154 PolarHBondContact OE2-NZ 2.59Å
110	P	88.2	Confident	87.1	Confident	6 Å²	6	42.5 Å²	42.5	4%	0.039	21%	0.214	C	C	.	.	H	α-helix	trans	-65	-34.4	-179.1	-20.5	33.6	0	0	0	113.3	L68 V71 C106 F107 D113 L114	L68-P110 HydrophobicContact CD1-CG 3.46Å; L68-P110 VanDerWaalsContact CD1-CG 3.46Å; L68-P110 HydrophobicContact CG-CG 3.99Å; V71-P110 HydrophobicContact CB-CB 4.1Å; V71-P110 HydrophobicContact CG1-CB 3.55Å; C106-P110 VanDerWaalsContact O-CD 3.3Å; C106-P110 WeakPolarHBondContact O-CD 3.31Å; F107-P110 WeakPolarHBondContact O-CD 3.41Å; P110-D113 PolarHBondContact O-N 3.35Å; P110-L114 WeakPolarHBondContact O-CG 3.45Å; P110-L114 PolarHBondContact O-N 3.26Å
111	A	89.7	Confident	87	Confident	0 Å²	0	42.3 Å²	42.3	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-65.4	-41.8	173.6	0	0	0	0	0	111.5	L94 C97 I101 F107 E109 D113 L114 I115 L155	L94-A111 HydrophobicContact CD1-CB 4.02Å; C97-A111 HydrophobicContact CB-CB 4.21Å; I101-A111 HydrophobicContact CD1-CB 4.28Å; F107-A111 WeakPolarHBondContact O-CB 3.01Å; F107-A111 PolarHBondContact O-N 3.33Å; F107-A111 VanDerWaalsContact O-N 3.14Å; E109-A111 VanDerWaalsContact C-N 3.32Å; E109-A111 PolarHBondContact O-N 3.1Å; A111-D113 VanDerWaalsContact C-N 3.34Å; A111-D113 PolarHBondContact O-N 3.19Å; A111-L114 PolarHBondContact O-N 2.89Å; A111-I115 WeakPolarHBondContact O-CD1 3.3Å; A111-I115 VanDerWaalsContact O-CG1 3.26Å; A111-I115 WeakPolarHBondContact O-CG1 3.23Å; A111-I115 PolarHBondContact O-N 2.99Å; A111-L155 HydrophobicContact CB-CD1 3.87Å
112	S	90.4	Very high	87	Confident	5 Å²	5	41.8 Å²	41.8	4%	0.035	21%	0.212	C	C	.	.	H	α-helix	trans	-63.5	-39.8	176.1	-63.2	0	0	0	0	111.9	V108 E109 I115 K116 Q158	V108-S112 VanDerWaalsContact O-CB 3.23Å; V108-S112 WeakPolarHBondContact O-CB 2.97Å; V108-S112 PolarHBondContact O-N 3.12Å; V108-S112 PolarHBondContact O-OG 2.96Å; E109-S112 WeakPolarHBondContact O-CB 3.23Å; E109-S112 PolarHBondContact O-N 3.15Å; E109-S112 VanDerWaalsContact O-N 3.1Å; S112-I115 PolarHBondContact O-N 3.35Å; S112-K116 WeakPolarHBondContact O-CB 3.49Å; S112-K116 PolarHBondContact O-N 3.11Å; S112-Q158 WeakPolarHBondContact O-CG 3.42Å
113	D	88.7	Confident	87.3	Confident	67 Å²	67	35.3 Å²	35.3	36%	0.358	18%	0.182	S	C	.	.	H	α-helix	trans	-67.2	-40.6	176.8	-76.8	-24.8	0	0	0	112.2	V75 E109 P110 A111 K116 L117	V75-D113 HydrophobicContact CG1-CB 3.87Å; V75-D113 HydrophobicContact CG2-CB 3.88Å; E109-D113 PolarHBondContact O-N 2.87Å; P110-D113 PolarHBondContact O-N 3.35Å; A111-D113 VanDerWaalsContact C-N 3.34Å; A111-D113 PolarHBondContact O-N 3.19Å; D113-K116 WeakPolarHBondContact O-CB 3.31Å; D113-K116 PolarHBondContact O-N 2.69Å; D113-L117 WeakPolarHBondContact O-CG 3.38Å; D113-L117 PolarHBondContact O-N 2.6Å; D113-L117 VanDerWaalsContact O-N 3.16Å
114	L	90.7	Very high	87.6	Confident	1 Å²	1	28.8 Å²	28.8	1%	0.005	15%	0.154	C	C	.	.	H	α-helix	trans	-60.7	-44.7	171.9	-76.7	177.3	0	0	0	111.9	V71 L74 V75 F82 I93 L94 P110 A111 K116 L117 C118	V71-L114 HydrophobicContact CG1-CD1 3.7Å; V71-L114 HydrophobicContact CG1-CG 4.24Å; L74-L114 HydrophobicContact CD2-CD1 4.3Å; L74-L114 HydrophobicContact CD2-CD2 3.87Å; L74-L114 HydrophobicContact CG-CD2 4.1Å; V75-L114 HydrophobicContact CG2-CD2 3.63Å; V75-L114 HydrophobicContact CG2-CG 3.75Å; F82-L114 HydrophobicContact CZ-CD2 4.26Å; I93-L114 HydrophobicContact CG2-CD1 4.28Å; L94-L114 HydrophobicContact CD1-CB 4.18Å; L94-L114 HydrophobicContact CD1-CD1 4.41Å; P110-L114 WeakPolarHBondContact O-CG 3.45Å; P110-L114 PolarHBondContact O-N 3.26Å; A111-L114 PolarHBondContact O-N 2.89Å; L114-K116 VanDerWaalsContact C-N 3.29Å; L114-K116 PolarHBondContact O-N 2.85Å; L114-L117 WeakPolarHBondContact O-CB 3.41Å; L114-L117 PolarHBondContact O-N 2.75Å; L114-L117 VanDerWaalsContact O-N 3.14Å; L114-C118 PolarHBondContact O-N 2.66Å; L114-C118 PolarHBondContact O-SG 3.04Å; L114-C118 VanDerWaalsContact O-SG 3.41Å
115	I	91.3	Very high	87.7	Confident	0 Å²	0	32.7 Å²	32.7	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-63.1	-37.9	176.8	-69	160.9	0	0	0	110.9	L94 A111 S112 L117 C118 L155 Q158 I159 C162	L94-I115 HydrophobicContact CD1-CD1 4.08Å; L94-I115 HydrophobicContact CD1-CG1 3.86Å; L94-I115 HydrophobicContact CD2-CD1 4.43Å; L94-I115 HydrophobicContact CD2-CG1 3.78Å; L94-I115 HydrophobicContact CG-CG1 4.44Å; A111-I115 WeakPolarHBondContact O-CD1 3.3Å; A111-I115 VanDerWaalsContact O-CG1 3.26Å; A111-I115 WeakPolarHBondContact O-CG1 3.23Å; A111-I115 PolarHBondContact O-N 2.99Å; S112-I115 PolarHBondContact O-N 3.35Å; I115-L117 VanDerWaalsContact C-N 3.26Å; I115-L117 PolarHBondContact O-N 3.08Å; I115-C118 VanDerWaalsContact O-CB 3.29Å; I115-C118 WeakPolarHBondContact O-CB 3.34Å; I115-C118 PolarHBondContact O-N 3.3Å; I115-C118 VanDerWaalsContact O-N 3.07Å; I115-L155 HydrophobicContact CD1-CD1 3.47Å; I115-L155 VanDerWaalsContact CD1-CD1 3.47Å; I115-L155 HydrophobicContact CD1-CG 4.09Å; I115-Q158 HydrophobicContact CB-CG 4.32Å; I115-Q158 HydrophobicContact CG2-CG 4.05Å; I115-I159 HydrophobicContact CD1-CD1 4.39Å; I115-I159 HydrophobicContact CD1-CG1 3.77Å; I115-I159 HydrophobicContact CG2-CG1 4.16Å; I115-C162 HydrophobicContact CG2-CB 3.71Å; I115-C162 PolarHBondContact O-SG 3.31Å
116	K	89.4	Confident	87.7	Confident	131 Å²	131	35 Å²	35	57%	0.57	17%	0.171	S	C	*	.	H	α-helix	trans	-58.8	-39.2	174.7	-167.1	176.5	176.8	-177.1	0	112	S112 D113 L114 C118 G119 Q158	S112-K116 WeakPolarHBondContact O-CB 3.49Å; S112-K116 PolarHBondContact O-N 3.11Å; D113-K116 WeakPolarHBondContact O-CB 3.31Å; D113-K116 PolarHBondContact O-N 2.69Å; L114-K116 VanDerWaalsContact C-N 3.29Å; L114-K116 PolarHBondContact O-N 2.85Å; K116-C118 VanDerWaalsContact C-N 3.3Å; K116-C118 PolarHBondContact O-N 3.46Å; K116-G119 PolarHBondContact O-N 3.26Å; K116-Q158 VanDerWaalsContact CB-NE2 3.27Å
117	L	88	Confident	87.6	Confident	19 Å²	19	37.6 Å²	37.6	10%	0.099	19%	0.185	C	C	.	.	H	α-helix	trans	-68.7	-28.3	176.3	-64.6	177.1	0	0	0	112.7	V75 F82 D113 L114 I115 G119 L120	V75-L117 HydrophobicContact CB-CD1 4.31Å; V75-L117 HydrophobicContact CG1-CD1 3.96Å; V75-L117 WeakPolarHBondContact O-CD1 3.44Å; F82-L117 HydrophobicContact CE1-CD1 4.48Å; F82-L117 HydrophobicContact CE2-CB 3.6Å; F82-L117 HydrophobicContact CZ-CB 3.6Å; F82-L117 HydrophobicContact CZ-CD1 4.05Å; F82-L117 HydrophobicContact CZ-CG 4.5Å; D113-L117 WeakPolarHBondContact O-CG 3.38Å; D113-L117 PolarHBondContact O-N 2.6Å; D113-L117 VanDerWaalsContact O-N 3.16Å; L114-L117 WeakPolarHBondContact O-CB 3.41Å; L114-L117 PolarHBondContact O-N 2.75Å; L114-L117 VanDerWaalsContact O-N 3.14Å; I115-L117 VanDerWaalsContact C-N 3.26Å; I115-L117 PolarHBondContact O-N 3.08Å; L117-G119 PolarHBondContact O-N 3.21Å; L117-L120 HydrophobicContact CD2-CD1 3.92Å; L117-L120 WeakPolarHBondContact O-CB 3.35Å; L117-L120 PolarHBondContact O-N 3.18Å
118	C	87.4	Confident	87.4	Confident	1 Å²	1	40.5 Å²	40.5	1%	0.007	21%	0.205	C	C	.	.	H	α-helix	trans	-61.5	-25.8	174.5	-61.6	0	0	0	0	112.4	F82 F91 L114 I115 K116 L120 C162 F166 K187	F82-C118 HydrophobicContact CE2-CB 4.49Å; F91-C118 HydrophobicContact CZ-CB 4.44Å; F91-C118 VanDerWaalsContact CZ-SG 3.56Å; L114-C118 PolarHBondContact O-N 2.66Å; L114-C118 PolarHBondContact O-SG 3.04Å; L114-C118 VanDerWaalsContact O-SG 3.41Å; I115-C118 VanDerWaalsContact O-CB 3.29Å; I115-C118 WeakPolarHBondContact O-CB 3.34Å; I115-C118 PolarHBondContact O-N 3.3Å; I115-C118 VanDerWaalsContact O-N 3.07Å; K116-C118 VanDerWaalsContact C-N 3.3Å; K116-C118 PolarHBondContact O-N 3.46Å; C118-L120 VanDerWaalsContact C-N 3.25Å; C118-L120 PolarHBondContact O-N 3.06Å; C118-C162 VanDerWaalsContact C-SG 3.55Å; C118-C162 WeakPolarHBondContact CB-SG 3.4Å; C118-F166 WeakPolarHBondContact O-CE1 3.31Å; C118-K187 PolarHBondContact O-NZ 3.11Å
119	G	83.4	Confident	87.4	Confident	3 Å²	3	40.8 Å²	40.8	3%	0.031	21%	0.206	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.8	-27.5	174.5	0	0	0	0	0	113.4	K116 L117 C162 K187	K116-G119 PolarHBondContact O-N 3.26Å; L117-G119 PolarHBondContact O-N 3.21Å; G119-C162 PolarHBondContact N-SG 3.17Å; G119-K187 PolarHBondContact O-NZ 3.17Å
120	L	84.4	Confident	87.2	Confident	49 Å²	49	38 Å²	38	26%	0.257	19%	0.193	S	C	.	.	S	Bend	trans	-73.1	147.8	179.4	-60.1	176.4	0	0	0	112.2	Q79 L117 C118 F122 K187	Q79-L120 WeakPolarHBondContact O-CD1 2.86Å; L117-L120 HydrophobicContact CD2-CD1 3.92Å; L117-L120 WeakPolarHBondContact O-CB 3.35Å; L117-L120 PolarHBondContact O-N 3.18Å; C118-L120 VanDerWaalsContact C-N 3.25Å; C118-L120 PolarHBondContact O-N 3.06Å; L120-F122 PolarHBondContact O-N 3.45Å; L120-K187 VanDerWaalsContact C-NZ 3.33Å; L120-K187 WeakPolarHBondContact O-CE 3.4Å; L120-K187 PolarHBondContact O-NZ 3.01Å
121	P	83.5	Confident	87.1	Confident	15 Å²	15	44.2 Å²	44.2	10%	0.097	23%	0.225	C	C	.	.	P	Polyproline II helix	trans	-50.3	133.6	176.2	-27.5	35.6	0	0	0	112.8	P172 Q181	P121-P172 HydrophobicContact CG-CG 4.48Å; P121-Q181 HydrophobicContact CB-CB 4.04Å; P121-Q181 HydrophobicContact CB-CG 3.98Å
122	F	88.9	Confident	87	Confident	0 Å²	0	48.6 Å²	48.6	0%	0	25%	0.251	C	S	.	.	P	Polyproline II helix	trans	-71.1	154.3	174.9	-61.6	-27.1	0	0	0	110.3	F82 L84 L87 L120 T137 L141 V182 K187	F82-F122 HydrophobicContact CB-CD1 4.43Å; F82-F122 WeakPolarHBondContact O-CA 3.46Å; L84-F122 HydrophobicContact CD2-CB 3.87Å; L84-F122 HydrophobicContact CD2-CD2 4.1Å; L84-F122 HydrophobicContact CD2-CG 4.36Å; L87-F122 HydrophobicContact CD1-CD1 4.14Å; L87-F122 HydrophobicContact CD1-CD2 4.43Å; L87-F122 HydrophobicContact CD1-CE1 3.87Å; L87-F122 HydrophobicContact CD1-CE2 4.17Å; L87-F122 HydrophobicContact CD1-CG 4.43Å; L87-F122 HydrophobicContact CD1-CZ 3.88Å; L87-F122 HydrophobicContact CD2-CE2 4.35Å; L120-F122 PolarHBondContact O-N 3.45Å; F122-T137 HydrophobicContact CD2-CG2 4.08Å; F122-T137 HydrophobicContact CE2-CG2 3.88Å; F122-L141 HydrophobicContact CE2-CD2 4.12Å; F122-L141 HydrophobicContact CZ-CD2 3.95Å; F122-V182 HydrophobicContact CB-CB 4.35Å; F122-V182 HydrophobicContact CB-CG2 4.16Å; F122-V182 WeakPolarHBondContact O-CB 3.46Å; F122-V182 WeakPolarHBondContact O-CG2 3.44Å; F122-V182 PolarHBondContact O-N 3.47Å; F122-K187 HydrophobicContact CD2-CG 4.18Å; F122-K187 HydrophobicContact CE2-CG 4.31Å
123	L	88.3	Confident	87	Confident	6 Å²	6	51.2 Å²	51.2	3%	0.031	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	129.4	-171.9	-55.5	174.6	0	0	0	111.1	F43 G81 F82 P83 L84 I176 Y179 Q180 Q181	F43-L123 HydrophobicContact CE2-CD1 4.41Å; G81-L123 WeakPolarHBondContact O-CD1 3.37Å; F82-L123 PolarHBondContact O-N 2.87Å; P83-L123 WeakPolarHBondContact CA-O 3.46Å; L84-L123 PolarHBondContact N-O 2.99Å; L123-I176 HydrophobicContact CD1-CD1 3.66Å; L123-I176 HydrophobicContact CD2-CD1 4.4Å; L123-Y179 HydrophobicContact CB-CD1 3.69Å; L123-Y179 HydrophobicContact CB-CE1 4.41Å; L123-Y179 HydrophobicContact CB-CG 4.31Å; L123-Q180 CarbonylContact C-O 3.57Å; L123-Q180 WeakPolarHBondContact CA-O 3.36Å; L123-Q181 HydrophobicContact CD2-CG 4.23Å
124	K	88.6	Confident	87	Confident	25 Å²	25	50.1 Å²	50.1	11%	0.109	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	146.1	174.9	63.7	-178.1	175.6	-172.5	0	111.1	L84 D129 E130 Y179 Q180 Q181 V182	L84-K124 HydrophobicContact CD1-CB 4.14Å; K124-D129 HydrophobicContact CB-CB 4.19Å; K124-E130 HydrophobicContact CD-CG 4.06Å; K124-E130 WeakPolarHBondContact CD-OE1 3.48Å; K124-E130 WeakPolarHBondContact CE-OE1 3.17Å; K124-E130 IonicContact NZ-OE1 2.65Å; K124-E130 PolarHBondContact NZ-OE1 3.33Å; K124-E130 IonicContact NZ-OE2 3.85Å; K124-Y179 WeakPolarHBondContact O-CA 3.29Å; K124-Q180 HydrophobicContact CG-CB 4Å; K124-Q180 WeakPolarHBondContact CG-O 3.45Å; K124-Q180 PolarHBondContact N-O 2.89Å; K124-Q180 PolarHBondContact O-N 3.15Å; K124-Q181 WeakPolarHBondContact CE-O 3.49Å; K124-V182 HydrophobicContact CB-CG2 4.03Å; K124-V182 HydrophobicContact CD-CG2 4.15Å; K124-V182 HydrophobicContact CG-CG2 4.14Å
125	K	86.1	Confident	86.9	Confident	105 Å²	105	56.9 Å²	56.9	46%	0.457	29%	0.288	S	S	.	.	S	Bend	trans	-95.1	-37.9	173	-80.7	-179.6	155.8	164.2	0	111.4	D129 Y179	K125-D129 WeakPolarHBondContact CA-OD2 3.48Å; K125-D129 PolarHBondContact N-OD2 3.44Å; K125-Y179 HydrophobicContact CD-CE1 4.08Å; K125-Y179 WeakPolarHBondContact CE-OH 3.49Å; K125-Y179 HydrophobicContact CG-CD1 3.8Å; K125-Y179 HydrophobicContact CG-CE1 3.56Å; K125-Y179 HydrophobicContact CG-CE2 4.41Å; K125-Y179 HydrophobicContact CG-CG 4.37Å; K125-Y179 PolarHBondContact NZ-OH 3.38Å
126	K	85.5	Confident	86.8	Confident	142 Å²	142	60 Å²	60	62%	0.617	31%	0.305	S	S	*	.	S	Bend	trans	-125.3	153.6	177.9	-58.7	178.6	-178.1	178.9	0	109.4	S128 D129	K126-S128 WeakPolarHBondContact CB-OG 3.4Å; K126-S128 PolarHBondContact O-N 2.97Å; K126-D129 PolarHBondContact N-OD2 3.12Å; K126-D129 VanDerWaalsContact O-CB 3.26Å; K126-D129 WeakPolarHBondContact O-CB 3.46Å; K126-D129 VanDerWaalsContact O-CG 3.32Å; K126-D129 PolarHBondContact O-N 2.91Å; K126-D129 VanDerWaalsContact O-N 3.1Å
127	V	81.7	Confident	86.9	Confident	101 Å²	101	53.8 Å²	53.8	61%	0.612	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62	-34.1	175	-178.5	0	0	0	0	111.2	D129 E130	V127-D129 PolarHBondContact O-N 3.34Å; V127-E130 PolarHBondContact O-N 2.97Å
128	S	85.3	Confident	87	Confident	61 Å²	61	53.1 Å²	53.1	43%	0.427	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.3	-21	175.3	55.1	0	0	0	0	114.3	K126 E130 I131 T132	K126-S128 WeakPolarHBondContact CB-OG 3.4Å; K126-S128 PolarHBondContact O-N 2.97Å; S128-E130 PolarHBondContact O-N 3.42Å; S128-I131 PolarHBondContact O-N 3.25Å; S128-I131 VanDerWaalsContact O-N 3.09Å; S128-T132 PolarHBondContact O-N 3.2Å; S128-T132 PolarHBondContact O-OG1 3.24Å; S128-T132 VanDerWaalsContact O-OG1 3.08Å
129	D	86.4	Confident	87.2	Confident	23 Å²	23	57.5 Å²	57.5	12%	0.123	30%	0.299	C	S	.	.	H	α-helix	trans	-62.7	-30.8	-177.6	-64.7	-11.6	0	0	0	111.6	L84 K124 K125 K126 V127 I131 T132 Y133	L84-D129 HydrophobicContact CD1-CB 4.11Å; K124-D129 HydrophobicContact CB-CB 4.19Å; K125-D129 WeakPolarHBondContact CA-OD2 3.48Å; K125-D129 PolarHBondContact N-OD2 3.44Å; K126-D129 PolarHBondContact N-OD2 3.12Å; K126-D129 VanDerWaalsContact O-CB 3.26Å; K126-D129 WeakPolarHBondContact O-CB 3.46Å; K126-D129 VanDerWaalsContact O-CG 3.32Å; K126-D129 PolarHBondContact O-N 2.91Å; K126-D129 VanDerWaalsContact O-N 3.1Å; V127-D129 PolarHBondContact O-N 3.34Å; D129-I131 PolarHBondContact O-N 3.42Å; D129-T132 PolarHBondContact O-N 2.94Å; D129-Y133 HydrophobicContact CB-CD2 3.94Å; D129-Y133 HydrophobicContact CB-CE2 4.1Å; D129-Y133 VanDerWaalsContact O-CD2 3.28Å; D129-Y133 WeakPolarHBondContact O-CD2 3.41Å; D129-Y133 PolarHBondContact O-N 3.15Å
130	E	85.2	Confident	87.5	Confident	37 Å²	37	57.6 Å²	57.6	17%	0.173	30%	0.299	C	S	.	.	H	α-helix	trans	-61.9	-34.4	176.4	-75.7	179.5	-176.9	0	0	111.9	L84 K124 V127 S128 T134 V182 Y186	L84-E130 HydrophobicContact CD1-CG 4.47Å; K124-E130 HydrophobicContact CD-CG 4.06Å; K124-E130 WeakPolarHBondContact CD-OE1 3.48Å; K124-E130 WeakPolarHBondContact CE-OE1 3.17Å; K124-E130 IonicContact NZ-OE1 2.65Å; K124-E130 PolarHBondContact NZ-OE1 3.33Å; K124-E130 IonicContact NZ-OE2 3.85Å; V127-E130 PolarHBondContact O-N 2.97Å; S128-E130 PolarHBondContact O-N 3.42Å; E130-T134 PolarHBondContact O-OG1 3.37Å; E130-V182 HydrophobicContact CG-CG1 4.48Å; E130-V182 HydrophobicContact CG-CG2 4.49Å; E130-Y186 HydrophobicContact CB-CD2 3.92Å; E130-Y186 HydrophobicContact CB-CE2 3.52Å; E130-Y186 HydrophobicContact CG-CD2 3.9Å; E130-Y186 HydrophobicContact CG-CE2 3.84Å; E130-Y186 HydrophobicContact CG-CG 4.4Å; E130-Y186 WeakPolarHBondContact O-CE2 3.35Å; E130-Y186 PolarHBondContact O-OH 3.36Å
131	I	85.6	Confident	87.8	Confident	138 Å²	138	55.3 Å²	55.3	71%	0.708	29%	0.287	S	S	*	.	H	α-helix	trans	-79.9	-48.6	177.1	-58.7	173.1	0	0	0	109.7	S128 D129 Y133 T134	S128-I131 PolarHBondContact O-N 3.25Å; S128-I131 VanDerWaalsContact O-N 3.09Å; D129-I131 PolarHBondContact O-N 3.42Å; I131-Y133 VanDerWaalsContact C-N 3.33Å; I131-Y133 PolarHBondContact O-N 3.16Å; I131-T134 WeakPolarHBondContact CA-OG1 3.33Å; I131-T134 WeakPolarHBondContact O-CB 3.1Å; I131-T134 PolarHBondContact O-N 3.43Å; I131-T134 PolarHBondContact O-OG1 3.4Å
132	T	89	Confident	88.2	Confident	92 Å²	92	55.7 Å²	55.7	56%	0.564	29%	0.291	S	S	*	.	H	α-helix	trans	-58.5	-42.1	-176.3	-53.5	0	0	0	0	112.8	S128 D129	S128-T132 PolarHBondContact O-N 3.2Å; S128-T132 PolarHBondContact O-OG1 3.24Å; S128-T132 VanDerWaalsContact O-OG1 3.08Å; D129-T132 PolarHBondContact O-N 2.94Å
133	Y	89.5	Confident	88.2	Confident	59 Å²	59	57.5 Å²	57.5	23%	0.231	30%	0.301	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101.2	18.9	-175.5	-59.2	-69	0	0	0	113.2	L84 R85 D129 I131 E135 T137	L84-Y133 HydrophobicContact CB-CD2 3.79Å; L84-Y133 HydrophobicContact CB-CG 4.08Å; R85-Y133 HydrophobicContact CB-CE1 4.04Å; R85-Y133 HydrophobicContact CB-CE2 4.09Å; R85-Y133 WeakPolarHBondContact CB-OH 3.49Å; D129-Y133 HydrophobicContact CB-CD2 3.94Å; D129-Y133 HydrophobicContact CB-CE2 4.1Å; D129-Y133 VanDerWaalsContact O-CD2 3.28Å; D129-Y133 WeakPolarHBondContact O-CD2 3.41Å; D129-Y133 PolarHBondContact O-N 3.15Å; I131-Y133 VanDerWaalsContact C-N 3.33Å; I131-Y133 PolarHBondContact O-N 3.16Å; Y133-E135 PolarHBondContact O-N 3.1Å; Y133-T137 VanDerWaalsContact O-CB 3.25Å; Y133-T137 WeakPolarHBondContact O-CB 3.32Å; Y133-T137 PolarHBondContact O-N 3.44Å; Y133-T137 PolarHBondContact O-OG1 3.49Å
134	T	88.3	Confident	88.4	Confident	45 Å²	45	57.2 Å²	57.2	28%	0.276	30%	0.299	S	S	.	.	H	α-helix	trans	-55.4	-52.3	-179.7	-58.5	0	0	0	0	111.5	E130 I131 T137 A138 M190	E130-T134 PolarHBondContact O-OG1 3.37Å; I131-T134 WeakPolarHBondContact CA-OG1 3.33Å; I131-T134 WeakPolarHBondContact O-CB 3.1Å; I131-T134 PolarHBondContact O-N 3.43Å; I131-T134 PolarHBondContact O-OG1 3.4Å; T134-T137 PolarHBondContact O-N 2.98Å; T134-A138 WeakPolarHBondContact O-CB 3.49Å; T134-A138 PolarHBondContact O-N 3.36Å; T134-M190 HydrophobicContact CG2-CE 3.84Å; T134-M190 HydrophobicContact CG2-SD 3.68Å
135	E	89.5	Confident	88.4	Confident	142 Å²	142	56.1 Å²	56.1	66%	0.664	30%	0.295	S	S	*	.	H	α-helix	trans	-67.2	-46.6	-176.4	-174.7	175.1	-176.7	0	0	111.6	Y133 T137 A138 N139	Y133-E135 PolarHBondContact O-N 3.1Å; E135-T137 VanDerWaalsContact C-N 3.27Å; E135-T137 PolarHBondContact O-N 2.94Å; E135-A138 PolarHBondContact O-N 3.22Å; E135-N139 WeakPolarHBondContact O-CB 3.47Å; E135-N139 VanDerWaalsContact O-CG 3.24Å; E135-N139 PolarHBondContact O-N 3.49Å; E135-N139 PolarHBondContact O-ND2 2.96Å
136	D	89.6	Confident	88.5	Confident	67 Å²	67	55.1 Å²	55.1	36%	0.358	29%	0.292	S	S	.	.	H	α-helix	trans	-57.9	-41.6	175.4	-69.4	-32.2	0	0	0	111.5	A88 S140	A88-D136 HydrophobicContact CB-CB 4.47Å; D136-S140 WeakPolarHBondContact O-CB 3.22Å; D136-S140 PolarHBondContact O-N 2.85Å; D136-S140 PolarHBondContact O-OG 3.08Å; D136-S140 VanDerWaalsContact O-OG 3.07Å
137	T	90.7	Very high	88.8	Confident	0 Å²	0	48.7 Å²	48.7	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-69.2	-44	179.1	-52.8	0	0	0	0	112.2	L84 L87 F122 Y133 T134 E135 S140 L141 Y186 M190	L84-T137 HydrophobicContact CD2-CG2 4.42Å; L87-T137 HydrophobicContact CD2-CG2 3.8Å; F122-T137 HydrophobicContact CD2-CG2 4.08Å; F122-T137 HydrophobicContact CE2-CG2 3.88Å; Y133-T137 VanDerWaalsContact O-CB 3.25Å; Y133-T137 WeakPolarHBondContact O-CB 3.32Å; Y133-T137 PolarHBondContact O-N 3.44Å; Y133-T137 PolarHBondContact O-OG1 3.49Å; T134-T137 PolarHBondContact O-N 2.98Å; E135-T137 VanDerWaalsContact C-N 3.27Å; E135-T137 PolarHBondContact O-N 2.94Å; T137-S140 PolarHBondContact O-N 3.29Å; T137-L141 WeakPolarHBondContact O-CG 3.45Å; T137-L141 PolarHBondContact O-N 2.95Å; T137-Y186 HydrophobicContact CG2-CE1 4.03Å; T137-M190 HydrophobicContact CG2-CB 3.95Å; T137-M190 HydrophobicContact CG2-CG 3.7Å
138	A	90.5	Very high	89.2	Confident	4 Å²	4	44 Å²	44	3%	0.033	24%	0.236	C	C	.	.	H	α-helix	trans	-60.5	-46.1	175.3	0	0	0	0	0	111.4	T134 E135 L141 A142 M190 V193 G194	T134-A138 WeakPolarHBondContact O-CB 3.49Å; T134-A138 PolarHBondContact O-N 3.36Å; E135-A138 PolarHBondContact O-N 3.22Å; A138-L141 PolarHBondContact O-N 3.08Å; A138-A142 WeakPolarHBondContact O-CB 3.27Å; A138-A142 PolarHBondContact O-N 3.43Å; A138-M190 HydrophobicContact CB-SD 4.47Å; A138-V193 HydrophobicContact CB-CB 4.11Å; A138-V193 HydrophobicContact CB-CG1 3.76Å; A138-G194 WeakPolarHBondContact O-CA 3.3Å
139	N	90.9	Very high	89.3	Confident	94 Å²	94	46.5 Å²	46.5	50%	0.503	24%	0.239	S	C	.	.	H	α-helix	trans	-64	-41.1	178	-72.4	-24.6	0	0	0	112.3	E135 A142 L143	E135-N139 WeakPolarHBondContact O-CB 3.47Å; E135-N139 VanDerWaalsContact O-CG 3.24Å; E135-N139 PolarHBondContact O-N 3.49Å; E135-N139 PolarHBondContact O-ND2 2.96Å; N139-A142 WeakPolarHBondContact O-CB 3.42Å; N139-A142 PolarHBondContact O-N 2.82Å; N139-L143 PolarHBondContact O-N 3.3Å; N139-L143 VanDerWaalsContact O-N 3.11Å
140	S	90.9	Very high	89.3	Confident	5 Å²	5	46.3 Å²	46.3	4%	0.035	24%	0.238	C	C	.	.	H	α-helix	trans	-61.3	-47.6	173.3	-73.8	0	0	0	0	111.8	L87 F91 D136 T137 A142 L143	L87-S140 WeakPolarHBondContact CD2-OG 3.19Å; F91-S140 WeakPolarHBondContact CD1-O 3.36Å; F91-S140 VanDerWaalsContact CD2-CB 3.5Å; F91-S140 WeakPolarHBondContact CE1-O 3.45Å; D136-S140 WeakPolarHBondContact O-CB 3.22Å; D136-S140 PolarHBondContact O-N 2.85Å; D136-S140 PolarHBondContact O-OG 3.08Å; D136-S140 VanDerWaalsContact O-OG 3.07Å; T137-S140 PolarHBondContact O-N 3.29Å; S140-A142 VanDerWaalsContact C-N 3.32Å; S140-A142 PolarHBondContact O-N 3.18Å; S140-L143 WeakPolarHBondContact O-CB 3.05Å; S140-L143 PolarHBondContact O-N 3.09Å
141	L	91	Very high	89.3	Confident	0 Å²	0	54.5 Å²	54.5	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-65.5	-35.5	177.5	-67.7	-174.2	0	0	0	112.4	F122 T137 A138 L143 L144 F166 M190 A191	F122-L141 HydrophobicContact CE2-CD2 4.12Å; F122-L141 HydrophobicContact CZ-CD2 3.95Å; T137-L141 WeakPolarHBondContact O-CG 3.45Å; T137-L141 PolarHBondContact O-N 2.95Å; A138-L141 PolarHBondContact O-N 3.08Å; L141-L143 VanDerWaalsContact C-N 3.26Å; L141-L143 PolarHBondContact O-N 3.15Å; L141-L144 HydrophobicContact CD2-CD1 3.99Å; L141-L144 WeakPolarHBondContact O-CB 3.39Å; L141-L144 PolarHBondContact O-N 3.27Å; L141-L144 VanDerWaalsContact O-N 3.15Å; L141-F166 HydrophobicContact CD1-CE2 4.31Å; L141-F166 HydrophobicContact CD2-CE2 3.74Å; L141-F166 HydrophobicContact CD2-CZ 3.6Å; L141-M190 HydrophobicContact CD1-CB 3.59Å; L141-A191 HydrophobicContact CD1-CB 4.37Å
142	A	90.4	Very high	89.4	Confident	24 Å²	24	48.7 Å²	48.7	20%	0.198	24%	0.239	C	C	.	.	H	α-helix	trans	-57.9	-39.7	173.4	0	0	0	0	0	111.8	A138 N139 S140 L144 G145 E146 G194	A138-A142 WeakPolarHBondContact O-CB 3.27Å; A138-A142 PolarHBondContact O-N 3.43Å; N139-A142 WeakPolarHBondContact O-CB 3.42Å; N139-A142 PolarHBondContact O-N 2.82Å; S140-A142 VanDerWaalsContact C-N 3.32Å; S140-A142 PolarHBondContact O-N 3.18Å; A142-L144 PolarHBondContact O-N 3.36Å; A142-G145 WeakPolarHBondContact O-CA 3.31Å; A142-G145 PolarHBondContact O-N 3.16Å; A142-E146 PolarHBondContact O-N 3.06Å; A142-G194 WeakPolarHBondContact CB-O 3.28Å
143	L	90.2	Very high	89.4	Confident	38 Å²	38	46.8 Å²	46.8	20%	0.199	23%	0.23	C	C	.	.	H	α-helix	trans	-60.6	-31.8	178.2	-171.9	69	0	0	0	112.4	F91 N139 S140 L141 G145 E146 L147	F91-L143 HydrophobicContact CB-CD2 3.89Å; F91-L143 HydrophobicContact CD1-CB 4.08Å; F91-L143 HydrophobicContact CD1-CD2 3.94Å; F91-L143 HydrophobicContact CD1-CG 4.47Å; F91-L143 HydrophobicContact CG-CD2 4.44Å; F91-L143 WeakPolarHBondContact O-CD2 3.37Å; N139-L143 PolarHBondContact O-N 3.3Å; N139-L143 VanDerWaalsContact O-N 3.11Å; S140-L143 WeakPolarHBondContact O-CB 3.05Å; S140-L143 PolarHBondContact O-N 3.09Å; L141-L143 VanDerWaalsContact C-N 3.26Å; L141-L143 PolarHBondContact O-N 3.15Å; L143-G145 PolarHBondContact O-N 3.4Å; L143-E146 HydrophobicContact CD1-CB 4.29Å; L143-E146 PolarHBondContact O-N 3.02Å; L143-E146 VanDerWaalsContact O-N 3.11Å; L143-L147 HydrophobicContact CG-CD1 4.4Å; L143-L147 HydrophobicContact CG-CG 4.32Å; L143-L147 VanDerWaalsContact O-CG 3.24Å; L143-L147 WeakPolarHBondContact O-CG 3.45Å; L143-L147 PolarHBondContact O-N 3.28Å
144	L	90.9	Very high	89.4	Confident	0 Å²	0	48.8 Å²	48.8	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-56.8	-36.9	172.9	-64.1	178.8	0	0	0	111.7	F91 L94 L141 A142 I159 I163 F166 L196	F91-L144 HydrophobicContact CE1-CD1 4.5Å; F91-L144 HydrophobicContact CE1-CD2 3.61Å; F91-L144 HydrophobicContact CE1-CG 3.75Å; F91-L144 HydrophobicContact CZ-CD2 4.15Å; F91-L144 HydrophobicContact CZ-CG 4.28Å; L94-L144 HydrophobicContact CD2-CD2 4.34Å; L141-L144 HydrophobicContact CD2-CD1 3.99Å; L141-L144 WeakPolarHBondContact O-CB 3.39Å; L141-L144 PolarHBondContact O-N 3.27Å; L141-L144 VanDerWaalsContact O-N 3.15Å; A142-L144 PolarHBondContact O-N 3.36Å; L144-I159 HydrophobicContact CB-CG2 4.26Å; L144-I159 WeakPolarHBondContact O-CG2 3.28Å; L144-I163 HydrophobicContact CD1-CG1 4.33Å; L144-F166 HydrophobicContact CD1-CE2 4.4Å; L144-F166 HydrophobicContact CD1-CZ 3.86Å; L144-L196 HydrophobicContact CB-CD1 4.38Å
145	G	89.5	Confident	89.5	Confident	2 Å²	2	46.7 Å²	46.7	2%	0.021	23%	0.227	C	C	.	.	H	α-helix	trans	-68.8	-41.6	175.4	0	0	0	0	0	113.2	A142 L143 L147 M148	A142-G145 WeakPolarHBondContact O-CA 3.31Å; A142-G145 PolarHBondContact O-N 3.16Å; L143-G145 PolarHBondContact O-N 3.4Å; G145-L147 VanDerWaalsContact C-N 3.31Å; G145-L147 PolarHBondContact O-N 3.03Å; G145-M148 VanDerWaalsContact O-CB 3.28Å; G145-M148 WeakPolarHBondContact O-CB 3.41Å; G145-M148 WeakPolarHBondContact O-CG 3.44Å; G145-M148 PolarHBondContact O-N 3.4Å
146	E	88.7	Confident	89.6	Confident	83 Å²	83	40.8 Å²	40.8	39%	0.388	20%	0.198	S	C	.	.	H	α-helix	trans	-64.3	-36.5	177.8	-67.4	-59.1	131.3	0	0	112.5	A142 L143 M148 K149	A142-E146 PolarHBondContact O-N 3.06Å; L143-E146 HydrophobicContact CD1-CB 4.29Å; L143-E146 PolarHBondContact O-N 3.02Å; L143-E146 VanDerWaalsContact O-N 3.11Å; E146-M148 PolarHBondContact O-N 3.29Å; E146-M148 VanDerWaalsContact O-N 3.12Å; E146-K149 WeakPolarHBondContact O-CB 3.43Å; E146-K149 WeakPolarHBondContact O-CG 3.38Å; E146-K149 PolarHBondContact O-N 3.44Å; E146-K149 VanDerWaalsContact O-N 3.1Å; E146-K149 IonicContact OE1-NZ 2.89Å; E146-K149 WeakPolarHBondContact OE2-CE 3.45Å; E146-K149 IonicContact OE2-NZ 2.88Å; E146-K149 PolarHBondContact OE2-NZ 3.39Å
147	L	90.4	Very high	89.7	Confident	8 Å²	8	38.8 Å²	38.8	4%	0.042	19%	0.188	C	C	.	.	G	3₁₀ helix	trans	-64	-15.2	178.1	-68.9	174.8	0	0	0	113.7	L94 A98 L143 G145 K149 V150 I159	L94-L147 HydrophobicContact CD2-CD1 3.47Å; L94-L147 VanDerWaalsContact CD2-CD1 3.47Å; L94-L147 HydrophobicContact CG-CD1 3.66Å; A98-L147 HydrophobicContact CB-CD2 3.24Å; L143-L147 HydrophobicContact CG-CD1 4.4Å; L143-L147 HydrophobicContact CG-CG 4.32Å; L143-L147 VanDerWaalsContact O-CG 3.24Å; L143-L147 WeakPolarHBondContact O-CG 3.45Å; L143-L147 PolarHBondContact O-N 3.28Å; G145-L147 VanDerWaalsContact C-N 3.31Å; G145-L147 PolarHBondContact O-N 3.03Å; L147-K149 PolarHBondContact O-N 2.9Å; L147-V150 HydrophobicContact CD2-CG2 4.47Å; L147-V150 WeakPolarHBondContact O-CB 3.22Å; L147-V150 WeakPolarHBondContact O-CG2 3.46Å; L147-V150 PolarHBondContact O-N 3.37Å; L147-I159 HydrophobicContact CB-CD1 3.65Å
148	M	90	Very high	89.8	Confident	2 Å²	2	40.2 Å²	40.2	1%	0.01	19%	0.194	C	C	.	.	G	3₁₀ helix	trans	-61.8	-22	172.3	-67.8	-63.8	-64.8	0	0	112.9	G145 E146 V150 R156 I159 M200 S203 L207 V217	G145-M148 VanDerWaalsContact O-CB 3.28Å; G145-M148 WeakPolarHBondContact O-CB 3.41Å; G145-M148 WeakPolarHBondContact O-CG 3.44Å; G145-M148 PolarHBondContact O-N 3.4Å; E146-M148 PolarHBondContact O-N 3.29Å; E146-M148 VanDerWaalsContact O-N 3.12Å; M148-V150 VanDerWaalsContact C-N 3.26Å; M148-V150 PolarHBondContact O-N 3Å; M148-R156 HydrophobicContact CE-CB 3.92Å; M148-R156 HydrophobicContact CE-CG 4.05Å; M148-R156 PolarHBondContact O-NE 3.2Å; M148-R156 PolarHBondContact O-NH2 3.21Å; M148-R156 HydrophobicContact SD-CB 4.18Å; M148-R156 HydrophobicContact SD-CG 4.24Å; M148-I159 HydrophobicContact CG-CG2 4.34Å; M148-I159 HydrophobicContact SD-CB 3.88Å; M148-I159 HydrophobicContact SD-CD1 3.92Å; M148-I159 HydrophobicContact SD-CG2 3.73Å; M148-M200 HydrophobicContact CG-CE 3.7Å; M148-M200 HydrophobicContact CG-SD 4.48Å; M148-M200 HydrophobicContact SD-CE 4.34Å; M148-S203 WeakPolarHBondContact CB-OG 3.47Å; M148-L207 HydrophobicContact CE-CD1 4.32Å; M148-V217 HydrophobicContact CE-CG2 3.57Å
149	K	87.6	Confident	89.9	Confident	114 Å²	114	40 Å²	40	50%	0.496	19%	0.193	S	C	.	.	G	3₁₀ helix	trans	-66.2	-26.7	176.9	-67.5	171.6	-179.4	168	0	112.8	E146 L147 R151 R156 L206	E146-K149 WeakPolarHBondContact O-CB 3.43Å; E146-K149 WeakPolarHBondContact O-CG 3.38Å; E146-K149 PolarHBondContact O-N 3.44Å; E146-K149 VanDerWaalsContact O-N 3.1Å; E146-K149 IonicContact OE1-NZ 2.89Å; E146-K149 WeakPolarHBondContact OE2-CE 3.45Å; E146-K149 IonicContact OE2-NZ 2.88Å; E146-K149 PolarHBondContact OE2-NZ 3.39Å; L147-K149 PolarHBondContact O-N 2.9Å; K149-R151 PolarHBondContact O-N 3.3Å; K149-R156 PolarHBondContact O-NH2 3.05Å; K149-L206 HydrophobicContact CG-CD1 3.99Å
150	V	87.8	Confident	90	Very high	18 Å²	18	35.6 Å²	35.6	11%	0.109	17%	0.169	C	C	.	.	S	Bend	trans	-60.4	133	179.6	-178.1	0	0	0	0	110.2	A98 I101 L147 M148 S152 L155 R156	A98-V150 HydrophobicContact CB-CG2 4.01Å; I101-V150 HydrophobicContact CB-CG1 4.22Å; I101-V150 HydrophobicContact CD1-CG1 4.27Å; I101-V150 HydrophobicContact CG2-CG1 3.93Å; L147-V150 HydrophobicContact CD2-CG2 4.47Å; L147-V150 WeakPolarHBondContact O-CB 3.22Å; L147-V150 WeakPolarHBondContact O-CG2 3.46Å; L147-V150 PolarHBondContact O-N 3.37Å; M148-V150 VanDerWaalsContact C-N 3.26Å; M148-V150 PolarHBondContact O-N 3Å; V150-S152 PolarHBondContact O-N 3.4Å; V150-L155 HydrophobicContact CB-CD2 3.94Å; V150-L155 HydrophobicContact CG1-CD2 3.88Å; V150-L155 HydrophobicContact CG2-CD2 4.23Å; V150-R156 VanDerWaalsContact O-CZ 3.27Å; V150-R156 PolarHBondContact O-NE 2.96Å; V150-R156 PolarHBondContact O-NH2 3.42Å; V150-R156 VanDerWaalsContact O-NH2 3.08Å
151	R	85.3	Confident	90.1	Very high	209 Å²	209	39.2 Å²	39.2	79%	0.789	18%	0.184	S	C	*	.	S	Bend	trans	-78.5	54.8	-176.4	-63.1	179.7	178.8	167	0.5	113	K149	K149-R151 PolarHBondContact O-N 3.3Å
152	S	87.8	Confident	90.1	Very high	16 Å²	16	39.2 Å²	39.2	11%	0.112	18%	0.184	C	C	.	.			trans	-132.8	114	176.3	176.1	0	0	0	0	111.2	V150 K154 L155 R156	V150-S152 PolarHBondContact O-N 3.4Å; S152-K154 PolarHBondContact O-N 2.97Å; S152-L155 PolarHBondContact O-N 3.49Å; S152-L155 PolarHBondContact OG-N 3.39Å; S152-R156 VanDerWaalsContact O-CG 3.31Å; S152-R156 WeakPolarHBondContact O-CG 3.44Å; S152-R156 PolarHBondContact O-N 3.06Å
153	S	87.5	Confident	90.1	Very high	52 Å²	52	38.1 Å²	38.1	36%	0.364	18%	0.175	S	C	.	.	H	α-helix	trans	-57.3	-47.5	177.8	178.6	0	0	0	0	111.8	L155 R156 I157 E213	S153-L155 VanDerWaalsContact C-N 3.35Å; S153-L155 PolarHBondContact O-N 3.46Å; S153-R156 PolarHBondContact O-N 2.88Å; S153-I157 VanDerWaalsContact O-CG1 3.32Å; S153-I157 WeakPolarHBondContact O-CG1 3.16Å; S153-I157 PolarHBondContact O-N 3.46Å; S153-E213 WeakPolarHBondContact CB-OE1 3.42Å; S153-E213 PolarHBondContact OG-OE1 2.92Å
154	K	89.2	Confident	90.1	Very high	101 Å²	101	36.8 Å²	36.8	44%	0.439	17%	0.168	S	C	.	.	H	α-helix	trans	-59.2	-45	179.7	-178.5	168.3	176.2	171.1	0	111.9	V108 E109 S152 Q158	V108-K154 HydrophobicContact CG1-CB 4.34Å; V108-K154 HydrophobicContact CG1-CD 4.39Å; V108-K154 HydrophobicContact CG1-CG 4.47Å; E109-K154 WeakPolarHBondContact OE1-CE 3.48Å; E109-K154 IonicContact OE1-NZ 3.58Å; E109-K154 PolarHBondContact OE1-NZ 2.88Å; E109-K154 WeakPolarHBondContact OE2-CE 3.47Å; E109-K154 IonicContact OE2-NZ 3.65Å; E109-K154 PolarHBondContact OE2-NZ 2.59Å; S152-K154 PolarHBondContact O-N 2.97Å; K154-Q158 VanDerWaalsContact O-CB 3.31Å; K154-Q158 WeakPolarHBondContact O-CB 3.43Å; K154-Q158 PolarHBondContact O-N 2.86Å
155	L	90.4	Very high	90	Very high	1 Å²	1	39.9 Å²	39.9	1%	0.005	19%	0.185	C	C	.	.	H	α-helix	trans	-64.5	-48.8	178.8	-167.1	76	0	0	0	111.2	I101 A111 I115 V150 S152 S153 I157 Q158 I159	I101-L155 HydrophobicContact CD1-CD1 4.44Å; I101-L155 HydrophobicContact CD1-CD2 3.82Å; A111-L155 HydrophobicContact CB-CD1 3.87Å; I115-L155 HydrophobicContact CD1-CD1 3.47Å; I115-L155 VanDerWaalsContact CD1-CD1 3.47Å; I115-L155 HydrophobicContact CD1-CG 4.09Å; V150-L155 HydrophobicContact CB-CD2 3.94Å; V150-L155 HydrophobicContact CG1-CD2 3.88Å; V150-L155 HydrophobicContact CG2-CD2 4.23Å; S152-L155 PolarHBondContact O-N 3.49Å; S152-L155 PolarHBondContact OG-N 3.39Å; S153-L155 VanDerWaalsContact C-N 3.35Å; S153-L155 PolarHBondContact O-N 3.46Å; L155-I157 PolarHBondContact O-N 2.92Å; L155-Q158 WeakPolarHBondContact O-CB 3.31Å; L155-Q158 PolarHBondContact O-N 2.88Å; L155-Q158 VanDerWaalsContact O-N 3.1Å; L155-I159 HydrophobicContact CG-CD1 4.3Å; L155-I159 WeakPolarHBondContact O-CG1 3.41Å; L155-I159 PolarHBondContact O-N 2.93Å
156	R	91.3	Very high	89.8	Confident	18 Å²	18	40 Å²	40	7%	0.068	19%	0.185	C	C	.	.	H	α-helix	trans	-56.8	-48.3	178.2	-72.2	171.3	178.9	173.5	0.5	112.2	M148 K149 V150 S152 S153 Q158 I159 C160	M148-R156 HydrophobicContact CE-CB 3.92Å; M148-R156 HydrophobicContact CE-CG 4.05Å; M148-R156 PolarHBondContact O-NE 3.2Å; M148-R156 PolarHBondContact O-NH2 3.21Å; M148-R156 HydrophobicContact SD-CB 4.18Å; M148-R156 HydrophobicContact SD-CG 4.24Å; K149-R156 PolarHBondContact O-NH2 3.05Å; V150-R156 VanDerWaalsContact O-CZ 3.27Å; V150-R156 PolarHBondContact O-NE 2.96Å; V150-R156 PolarHBondContact O-NH2 3.42Å; V150-R156 VanDerWaalsContact O-NH2 3.08Å; S152-R156 VanDerWaalsContact O-CG 3.31Å; S152-R156 WeakPolarHBondContact O-CG 3.44Å; S152-R156 PolarHBondContact O-N 3.06Å; S153-R156 PolarHBondContact O-N 2.88Å; R156-Q158 VanDerWaalsContact C-N 3.29Å; R156-Q158 PolarHBondContact O-N 3.25Å; R156-I159 WeakPolarHBondContact O-CB 3.37Å; R156-I159 PolarHBondContact O-N 3.14Å; R156-C160 PolarHBondContact O-N 2.83Å; R156-C160 PolarHBondContact O-SG 3.06Å
157	I	91.8	Very high	89.6	Confident	25 Å²	25	38.3 Å²	38.3	13%	0.128	18%	0.175	C	C	.	.	H	α-helix	trans	-62.3	-39.7	177.3	-67.3	169.3	0	0	0	110.6	S153 L155 C160 K161 I212 E213 W216	S153-I157 VanDerWaalsContact O-CG1 3.32Å; S153-I157 WeakPolarHBondContact O-CG1 3.16Å; S153-I157 PolarHBondContact O-N 3.46Å; L155-I157 PolarHBondContact O-N 2.92Å; I157-C160 PolarHBondContact O-N 3.12Å; I157-K161 HydrophobicContact CG2-CD 4.17Å; I157-K161 WeakPolarHBondContact O-CG 3.44Å; I157-K161 PolarHBondContact O-N 3.05Å; I157-I212 HydrophobicContact CD1-CG2 3.89Å; I157-E213 HydrophobicContact CD1-CG 4.47Å; I157-E213 HydrophobicContact CG1-CG 4.21Å; I157-W216 HydrophobicContact CG1-CG 4.47Å; I157-W216 HydrophobicContact CG2-CD2 4.27Å; I157-W216 HydrophobicContact CG2-CG 4.24Å
158	Q	93.1	Very high	89	Confident	31 Å²	31	43.3 Å²	43.3	15%	0.145	20%	0.198	C	C	.	.	H	α-helix	trans	-67.5	-37.3	178.9	-171.6	56.4	26.5	0	0	112.5	S112 I115 K116 K154 L155 R156 K161 C162	S112-Q158 WeakPolarHBondContact O-CG 3.42Å; I115-Q158 HydrophobicContact CB-CG 4.32Å; I115-Q158 HydrophobicContact CG2-CG 4.05Å; K116-Q158 VanDerWaalsContact CB-NE2 3.27Å; K154-Q158 VanDerWaalsContact O-CB 3.31Å; K154-Q158 WeakPolarHBondContact O-CB 3.43Å; K154-Q158 PolarHBondContact O-N 2.86Å; L155-Q158 WeakPolarHBondContact O-CB 3.31Å; L155-Q158 PolarHBondContact O-N 2.88Å; L155-Q158 VanDerWaalsContact O-N 3.1Å; R156-Q158 VanDerWaalsContact C-N 3.29Å; R156-Q158 PolarHBondContact O-N 3.25Å; Q158-K161 PolarHBondContact O-N 3.23Å; Q158-C162 WeakPolarHBondContact O-CB 3.4Å; Q158-C162 PolarHBondContact O-N 3.04Å
159	I	92.9	Very high	88	Confident	0 Å²	0	45.3 Å²	45.3	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-58.8	-50.8	170.5	-67.2	164.7	0	0	0	109.8	I115 L144 L147 M148 L155 R156 K161 C162 I163 M200	I115-I159 HydrophobicContact CD1-CD1 4.39Å; I115-I159 HydrophobicContact CD1-CG1 3.77Å; I115-I159 HydrophobicContact CG2-CG1 4.16Å; L144-I159 HydrophobicContact CB-CG2 4.26Å; L144-I159 WeakPolarHBondContact O-CG2 3.28Å; L147-I159 HydrophobicContact CB-CD1 3.65Å; M148-I159 HydrophobicContact CG-CG2 4.34Å; M148-I159 HydrophobicContact SD-CB 3.88Å; M148-I159 HydrophobicContact SD-CD1 3.92Å; M148-I159 HydrophobicContact SD-CG2 3.73Å; L155-I159 HydrophobicContact CG-CD1 4.3Å; L155-I159 WeakPolarHBondContact O-CG1 3.41Å; L155-I159 PolarHBondContact O-N 2.93Å; R156-I159 WeakPolarHBondContact O-CB 3.37Å; R156-I159 PolarHBondContact O-N 3.14Å; I159-K161 VanDerWaalsContact C-N 3.34Å; I159-K161 PolarHBondContact O-N 2.89Å; I159-C162 WeakPolarHBondContact O-CB 3.4Å; I159-C162 PolarHBondContact O-N 3.11Å; I159-I163 HydrophobicContact CG2-CD1 3.76Å; I159-I163 HydrophobicContact CG2-CG1 4.5Å; I159-I163 WeakPolarHBondContact O-CG1 3.35Å; I159-I163 PolarHBondContact O-N 3.27Å; I159-M200 HydrophobicContact CG2-CE 4.28Å
160	C	93.3	Very high	86.7	Confident	1 Å²	1	47.6 Å²	47.6	1%	0.007	23%	0.228	C	C	.	.	H	α-helix	trans	-60.6	-43.5	-179.9	-63.2	0	0	0	0	112.1	R156 I157 C162 I163 V164 W216 V220	R156-C160 PolarHBondContact O-N 2.83Å; R156-C160 PolarHBondContact O-SG 3.06Å; I157-C160 PolarHBondContact O-N 3.12Å; C160-C162 PolarHBondContact O-N 3.44Å; C160-I163 PolarHBondContact O-N 2.88Å; C160-V164 VanDerWaalsContact O-CG2 3.27Å; C160-V164 WeakPolarHBondContact O-CG2 3.1Å; C160-V164 PolarHBondContact O-N 2.95Å; C160-W216 HydrophobicContact CB-CB 3.77Å; C160-W216 HydrophobicContact CB-CE3 4.13Å; C160-W216 HydrophobicContact CB-CG 4.41Å; C160-V220 HydrophobicContact CB-CG2 3.62Å; C160-V220 WeakPolarHBondContact O-CG2 3.02Å
161	K	92.3	Very high	85.3	Confident	81 Å²	81	51.2 Å²	51.2	35%	0.352	25%	0.251	S	S	.	.	H	α-helix	trans	-57.8	-48.2	174.5	-75.8	172.8	-179.9	175.4	0	111.9	I157 Q158 I159 I163 V164 D165 W216	I157-K161 HydrophobicContact CG2-CD 4.17Å; I157-K161 WeakPolarHBondContact O-CG 3.44Å; I157-K161 PolarHBondContact O-N 3.05Å; Q158-K161 PolarHBondContact O-N 3.23Å; I159-K161 VanDerWaalsContact C-N 3.34Å; I159-K161 PolarHBondContact O-N 2.89Å; K161-I163 VanDerWaalsContact C-N 3.29Å; K161-I163 PolarHBondContact O-N 2.96Å; K161-V164 PolarHBondContact O-N 2.77Å; K161-D165 VanDerWaalsContact O-CG 3.27Å; K161-D165 PolarHBondContact O-N 3.22Å; K161-W216 HydrophobicContact CB-CZ3 4.46Å; K161-W216 HydrophobicContact CD-CH2 4.2Å; K161-W216 HydrophobicContact CD-CZ2 4.41Å; K161-W216 VanDerWaalsContact CE-CZ2 3.45Å; K161-W216 HydrophobicContact CG-CE3 4.05Å; K161-W216 HydrophobicContact CG-CH2 3.49Å; K161-W216 VanDerWaalsContact CG-CH2 3.49Å; K161-W216 HydrophobicContact CG-CZ2 4.05Å; K161-W216 HydrophobicContact CG-CZ3 3.48Å; K161-W216 VanDerWaalsContact CG-CZ3 3.48Å
162	C	91.5	Very high	84.2	Confident	0 Å²	0	43 Å²	43	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-56.4	-43.2	177.1	171.3	0	0	0	0	112.1	I115 C118 G119 Q158 I159 C160 D165 F166	I115-C162 HydrophobicContact CG2-CB 3.71Å; I115-C162 PolarHBondContact O-SG 3.31Å; C118-C162 VanDerWaalsContact C-SG 3.55Å; C118-C162 WeakPolarHBondContact CB-SG 3.4Å; G119-C162 PolarHBondContact N-SG 3.17Å; Q158-C162 WeakPolarHBondContact O-CB 3.4Å; Q158-C162 PolarHBondContact O-N 3.04Å; I159-C162 WeakPolarHBondContact O-CB 3.4Å; I159-C162 PolarHBondContact O-N 3.11Å; C160-C162 PolarHBondContact O-N 3.44Å; C162-D165 WeakPolarHBondContact O-CB 3.44Å; C162-D165 PolarHBondContact O-N 2.68Å; C162-F166 WeakPolarHBondContact O-CD1 3.48Å; C162-F166 VanDerWaalsContact O-CE1 3.29Å; C162-F166 WeakPolarHBondContact O-CE1 3.49Å; C162-F166 PolarHBondContact O-N 2.83Å
163	I	90.9	Very high	82.6	Confident	1 Å²	1	52 Å²	52	1%	0.005	26%	0.262	C	S	.	.	H	α-helix	trans	-70.4	-40	-179.6	-61.5	164.1	0	0	0	110.9	L144 I159 C160 K161 D165 F166 L196 M200 V220	L144-I163 HydrophobicContact CD1-CG1 4.33Å; I159-I163 HydrophobicContact CG2-CD1 3.76Å; I159-I163 HydrophobicContact CG2-CG1 4.5Å; I159-I163 WeakPolarHBondContact O-CG1 3.35Å; I159-I163 PolarHBondContact O-N 3.27Å; C160-I163 PolarHBondContact O-N 2.88Å; K161-I163 VanDerWaalsContact C-N 3.29Å; K161-I163 PolarHBondContact O-N 2.96Å; I163-D165 PolarHBondContact O-N 3.45Å; I163-F166 HydrophobicContact CG1-CE2 4.43Å; I163-F166 HydrophobicContact CG2-CD2 4.33Å; I163-F166 VanDerWaalsContact O-CB 3.27Å; I163-F166 WeakPolarHBondContact O-CB 3.44Å; I163-F166 WeakPolarHBondContact O-CG 2.9Å; I163-F166 PolarHBondContact O-N 2.91Å; I163-L196 HydrophobicContact CD1-CD1 4.1Å; I163-L196 HydrophobicContact CD1-CD2 3.96Å; I163-L196 HydrophobicContact CD1-CG 4.35Å; I163-L196 HydrophobicContact CG1-CD2 4.05Å; I163-L196 HydrophobicContact CG2-CD2 3.88Å; I163-M200 HydrophobicContact CD1-CE 3.43Å; I163-M200 VanDerWaalsContact CD1-CE 3.43Å; I163-M200 HydrophobicContact CD1-SD 4.06Å; I163-V220 HydrophobicContact CB-CG1 4.13Å; I163-V220 HydrophobicContact CB-CG2 4.2Å; I163-V220 HydrophobicContact CD1-CG1 4.25Å; I163-V220 HydrophobicContact CG2-CG1 3.56Å; I163-V220 HydrophobicContact CG2-CG2 4.41Å
164	V	90.6	Very high	81.4	Confident	9 Å²	9	56.8 Å²	56.8	6%	0.055	28%	0.276	C	S	.	.	H	α-helix	trans	-58.2	-41.3	173.3	171.6	0	0	0	0	110.3	C160 K161 F166 Y167 H168 K219 V220	C160-V164 VanDerWaalsContact O-CG2 3.27Å; C160-V164 WeakPolarHBondContact O-CG2 3.1Å; C160-V164 PolarHBondContact O-N 2.95Å; K161-V164 PolarHBondContact O-N 2.77Å; V164-F166 PolarHBondContact O-N 3.38Å; V164-F166 VanDerWaalsContact O-N 3.14Å; V164-Y167 PolarHBondContact O-N 3.42Å; V164-H168 PolarHBondContact O-CD2 3.4Å; V164-H168 PolarHBondContact O-N 3.49Å; V164-K219 HydrophobicContact CG2-CD 4.31Å; V164-K219 HydrophobicContact CG2-CG 4.18Å; V164-V220 HydrophobicContact CG2-CG2 3.93Å
165	D	87.9	Confident	80.2	Confident	65 Å²	65	59.6 Å²	59.6	35%	0.348	29%	0.291	S	S	.	.	H	α-helix	trans	-61.4	-21.5	177.9	-67.9	-24.3	0	0	0	112.7	K161 C162 I163 Y167 H168 A169	K161-D165 VanDerWaalsContact O-CG 3.27Å; K161-D165 PolarHBondContact O-N 3.22Å; C162-D165 WeakPolarHBondContact O-CB 3.44Å; C162-D165 PolarHBondContact O-N 2.68Å; I163-D165 PolarHBondContact O-N 3.45Å; D165-Y167 PolarHBondContact O-N 2.99Å; D165-Y167 VanDerWaalsContact O-N 3.15Å; D165-H168 PolarHBondContact O-N 3.14Å; D165-A169 WeakPolarHBondContact O-CA 3.35Å; D165-A169 WeakPolarHBondContact O-CB 3.38Å; D165-A169 PolarHBondContact O-N 3.01Å
166	F	85.8	Confident	79.4	Confident	4 Å²	4	60.3 Å²	60.3	2%	0.018	29%	0.294	C	S	.	.	H	α-helix	trans	-59.8	-29	174.5	-62.7	-6.7	0	0	0	112.8	C118 L141 L144 C162 I163 V164 K187	C118-F166 WeakPolarHBondContact O-CE1 3.31Å; L141-F166 HydrophobicContact CD1-CE2 4.31Å; L141-F166 HydrophobicContact CD2-CE2 3.74Å; L141-F166 HydrophobicContact CD2-CZ 3.6Å; L144-F166 HydrophobicContact CD1-CE2 4.4Å; L144-F166 HydrophobicContact CD1-CZ 3.86Å; C162-F166 WeakPolarHBondContact O-CD1 3.48Å; C162-F166 VanDerWaalsContact O-CE1 3.29Å; C162-F166 WeakPolarHBondContact O-CE1 3.49Å; C162-F166 PolarHBondContact O-N 2.83Å; I163-F166 HydrophobicContact CG1-CE2 4.43Å; I163-F166 HydrophobicContact CG2-CD2 4.33Å; I163-F166 VanDerWaalsContact O-CB 3.27Å; I163-F166 WeakPolarHBondContact O-CB 3.44Å; I163-F166 WeakPolarHBondContact O-CG 2.9Å; I163-F166 PolarHBondContact O-N 2.91Å; V164-F166 PolarHBondContact O-N 3.38Å; V164-F166 VanDerWaalsContact O-N 3.14Å; F166-K187 HydrophobicContact CD1-CD 4.11Å; F166-K187 HydrophobicContact CG-CD 4.36Å
167	Y	83.5	Confident	78.4	Confident	49 Å²	49	63.4 Å²	63.4	19%	0.192	32%	0.317	C	S	.	.	H	α-helix	trans	-93	-22.8	-178.9	-64.9	-93.8	0	0	0	112.7	V164 D165 I188 H223 L224	V164-Y167 PolarHBondContact O-N 3.42Å; D165-Y167 PolarHBondContact O-N 2.99Å; D165-Y167 VanDerWaalsContact O-N 3.15Å; Y167-I188 HydrophobicContact CD1-CD1 3.8Å; Y167-I188 HydrophobicContact CD1-CG1 4.2Å; Y167-I188 HydrophobicContact CE1-CD1 3.72Å; Y167-I188 HydrophobicContact CE1-CG1 3.79Å; Y167-I188 HydrophobicContact CE1-CG2 4.23Å; Y167-H223 HydrophobicContact CD1-CB 4.3Å; Y167-H223 HydrophobicContact CD2-CB 3.77Å; Y167-H223 HydrophobicContact CE1-CB 4.35Å; Y167-H223 HydrophobicContact CE2-CB 3.84Å; Y167-H223 HydrophobicContact CG-CB 4.01Å; Y167-L224 WeakPolarHBondContact OH-CD2 3.29Å
168	H	78.8	Confident	77.7	Confident	113 Å²	113	65.2 Å²	65.2	52%	0.523	34%	0.341	S	S	.	.	H	α-helix	trans	-122.5	4.5	-172	-57.8	-70.5	0	0	0	114.6	V164 D165 Q170 H223	V164-H168 PolarHBondContact O-CD2 3.4Å; V164-H168 PolarHBondContact O-N 3.49Å; D165-H168 PolarHBondContact O-N 3.14Å; H168-Q170 PolarHBondContact O-N 3.18Å; H168-Q170 VanDerWaalsContact O-N 3.16Å; H168-H223 AromaticContact CE1-CE1 3.82Å; H168-H223 AromaticContact NE2-CE1 3.05Å; H168-H223 PolarHBondContact NE2-CE1 2.91Å; H168-H223 AromaticContact NE2-ND1 3.73Å; H168-H223 AromaticContact NE2-NE2 3.26Å; H168-H223 PolarHBondContact NE2-NE2 3.34Å
169	A	68.4	Low	77.1	Confident	44 Å²	44	64.7 Å²	64.7	36%	0.364	34%	0.338	S	S	.	.	P	Polyproline II helix	trans	-57.5	121.1	-173.9	0	0	0	0	0	111.6	D165	D165-A169 WeakPolarHBondContact O-CA 3.35Å; D165-A169 WeakPolarHBondContact O-CB 3.38Å; D165-A169 PolarHBondContact O-N 3.01Å
170	Q	60.3	Low	76.7	Confident	162 Å²	162	70 Å²	70	76%	0.757	36%	0.363	S	S	*	.	P	Polyproline II helix	trans	-71.2	136.8	165.9	-67.1	-166.4	-6.8	0	0	109.5	H168	H168-Q170 PolarHBondContact O-N 3.18Å; H168-Q170 VanDerWaalsContact O-N 3.16Å
171	P	59.8	Low	76.3	Confident	94 Å²	94	73.5 Å²	73.5	61%	0.61	38%	0.379	S	S	*	.	P	Polyproline II helix	trans	-61.6	131.8	177.8	23.9	-31.4	0	0	0	109.5	K173	P171-K173 PolarHBondContact O-N 2.96Å
172	P	61.1	Low	76	Confident	35 Å²	35	70 Å²	70	23%	0.227	37%	0.365	C	S	.	.	P	Polyproline II helix	trans	-61.9	135.9	-179.9	19.1	-27.7	0	0	0	110.3	P121 K174 Q181	P121-P172 HydrophobicContact CG-CG 4.48Å; P172-K174 PolarHBondContact O-N 3.17Å; P172-Q181 VanDerWaalsContact CD-NE2 3.34Å; P172-Q181 VanDerWaalsContact CG-NE2 3.3Å
173	K	54.1	Low	75.4	Confident	206 Å²	206	72.3 Å²	72.3	90%	0.896	38%	0.381	S	S	*	.	S	Bend	trans	-66.3	-1.2	-172.2	-64.6	-179.8	178.7	178.5	0	115	P171	P171-K173 PolarHBondContact O-N 2.96Å
174	K	63.6	Low	74.8	Confident	153 Å²	153	76.1 Å²	76.1	67%	0.665	41%	0.407	S	S	*	.			trans	-122.3	121	-174	-69.7	-176.4	179.2	178.3	0	111.4	P172	P172-K174 PolarHBondContact O-N 3.17Å
175	H	63.5	Low	74.3	Confident	159 Å²	159	79.1 Å²	79.1	74%	0.736	43%	0.429	S	S	*	.			trans	-74.6	129.2	171.5	-174.6	66.7	0	0	0	109.9	P177	H175-P177 WeakPolarHBondContact O-CD 3.39Å
176	I	72.9	Confident	74.3	Confident	17 Å²	17	77 Å²	77	9%	0.087	42%	0.416	C	S	.	.			trans	-100.1	114	176	-55.8	171.9	0	0	0	108	I42 N80 L123 G178 Y179	I42-I176 HydrophobicContact CD1-CG2 4.46Å; I42-I176 HydrophobicContact CG2-CG2 4.36Å; N80-I176 HydrophobicContact CB-CD1 3.64Å; N80-I176 HydrophobicContact CB-CG1 4.43Å; L123-I176 HydrophobicContact CD1-CD1 3.66Å; L123-I176 HydrophobicContact CD2-CD1 4.4Å; I176-G178 PolarHBondContact O-N 2.95Å; I176-Y179 HydrophobicContact CG2-CD2 4.1Å; I176-Y179 PolarHBondContact O-N 3.33Å; I176-Y179 VanDerWaalsContact O-N 3.1Å
177	P	71.4	Confident	74.2	Confident	83 Å²	83	77.1 Å²	77.1	54%	0.539	42%	0.417	S	S	.	.	T	Hydrogen-bonded Turn	trans	-49.5	125	176.5	-28.5	32.3	0	0	0	112.8	I42 H175	I42-P177 HydrophobicContact CD1-CB 3.94Å; I42-P177 VanDerWaalsContact CD1-CD 3.46Å; I42-P177 HydrophobicContact CD1-CG 3.64Å; H175-P177 WeakPolarHBondContact O-CD 3.39Å
178	G	75.6	Confident	74.2	Confident	62 Å²	62	76.6 Å²	76.6	64%	0.639	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	84.2	1.5	178.1	0	0	0	0	0	116	I176	I176-G178 PolarHBondContact O-N 2.95Å
179	Y	81.8	Confident	74.6	Confident	20 Å²	20	76.3 Å²	76.3	8%	0.078	41%	0.414	C	S	.	.			trans	-126.7	138.6	175.3	-75.7	-91.1	0	0	0	111.4	F43 P83 R85 L123 K124 K125 I176	F43-Y179 AromaticContact CD2-CE2 3.95Å; F43-Y179 HydrophobicContact CD2-CE2 3.95Å; F43-Y179 HydrophobicContact CE2-CE2 4.39Å; P83-Y179 HydrophobicContact CB-CE1 3.9Å; P83-Y179 HydrophobicContact CG-CE1 3.99Å; R85-Y179 PolarHBondContact NH2-OH 3.18Å; L123-Y179 HydrophobicContact CB-CD1 3.69Å; L123-Y179 HydrophobicContact CB-CE1 4.41Å; L123-Y179 HydrophobicContact CB-CG 4.31Å; K124-Y179 WeakPolarHBondContact O-CA 3.29Å; K125-Y179 HydrophobicContact CD-CE1 4.08Å; K125-Y179 WeakPolarHBondContact CE-OH 3.49Å; K125-Y179 HydrophobicContact CG-CD1 3.8Å; K125-Y179 HydrophobicContact CG-CE1 3.56Å; K125-Y179 HydrophobicContact CG-CE2 4.41Å; K125-Y179 HydrophobicContact CG-CG 4.37Å; K125-Y179 PolarHBondContact NZ-OH 3.38Å; I176-Y179 HydrophobicContact CG2-CD2 4.1Å; I176-Y179 PolarHBondContact O-N 3.33Å; I176-Y179 VanDerWaalsContact O-N 3.1Å
180	Q	83.4	Confident	75.7	Confident	112 Å²	112	74.6 Å²	74.6	52%	0.523	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	152.4	171.8	-65.9	-179.2	-6.8	0	0	109.8	L123 K124	L123-Q180 CarbonylContact C-O 3.57Å; L123-Q180 WeakPolarHBondContact CA-O 3.36Å; K124-Q180 HydrophobicContact CG-CB 4Å; K124-Q180 WeakPolarHBondContact CG-O 3.45Å; K124-Q180 PolarHBondContact N-O 2.89Å; K124-Q180 PolarHBondContact O-N 3.15Å
181	Q	85.8	Confident	77	Confident	74 Å²	74	66.9 Å²	66.9	35%	0.346	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	140.8	173	-66.6	171.3	19.5	0	0	109.8	P121 L123 K124 P172	P121-Q181 HydrophobicContact CB-CB 4.04Å; P121-Q181 HydrophobicContact CB-CG 3.98Å; L123-Q181 HydrophobicContact CD2-CG 4.23Å; K124-Q181 WeakPolarHBondContact CE-O 3.49Å; P172-Q181 VanDerWaalsContact CD-NE2 3.34Å; P172-Q181 VanDerWaalsContact CG-NE2 3.3Å
182	V	85.3	Confident	78.4	Confident	9 Å²	9	63.5 Å²	63.5	6%	0.055	34%	0.339	C	S	.	.	P	Polyproline II helix	trans	-72.2	148.3	168.9	173.8	0	0	0	0	109.1	L84 F122 K124 E130 Y186	L84-V182 HydrophobicContact CD1-CG2 3.91Å; L84-V182 HydrophobicContact CD2-CG2 4.36Å; L84-V182 HydrophobicContact CG-CG2 4.22Å; F122-V182 HydrophobicContact CB-CB 4.35Å; F122-V182 HydrophobicContact CB-CG2 4.16Å; F122-V182 WeakPolarHBondContact O-CB 3.46Å; F122-V182 WeakPolarHBondContact O-CG2 3.44Å; F122-V182 PolarHBondContact O-N 3.47Å; K124-V182 HydrophobicContact CB-CG2 4.03Å; K124-V182 HydrophobicContact CD-CG2 4.15Å; K124-V182 HydrophobicContact CG-CG2 4.14Å; E130-V182 HydrophobicContact CG-CG1 4.48Å; E130-V182 HydrophobicContact CG-CG2 4.49Å; V182-Y186 VanDerWaalsContact CG1-CB 3.42Å; V182-Y186 HydrophobicContact CG1-CD1 3.14Å; V182-Y186 HydrophobicContact CG1-CD2 4.44Å; V182-Y186 HydrophobicContact CG1-CE1 3.93Å; V182-Y186 HydrophobicContact CG1-CG 3.42Å; V182-Y186 VanDerWaalsContact CG1-CG 3.42Å
183	S	79.3	Confident	79.7	Confident	47 Å²	47	66 Å²	66	33%	0.329	35%	0.353	S	S	.	.	P	Polyproline II helix	trans	-66.5	152.6	179.1	66.2	0	0	0	0	111.8	S185 Y186 K187	S183-S185 WeakPolarHBondContact CB-OG 3.48Å; S183-S185 PolarHBondContact O-N 3.4Å; S183-S185 PolarHBondContact OG-OG 3.04Å; S183-Y186 PolarHBondContact O-N 3.27Å; S183-Y186 VanDerWaalsContact O-N 3.17Å; S183-Y186 WeakPolarHBondContact OG-CB 3.45Å; S183-Y186 PolarHBondContact OG-N 3.44Å; S183-Y186 VanDerWaalsContact OG-N 3.12Å; S183-K187 PolarHBondContact O-N 3.42Å
184	S	77.1	Confident	81.3	Confident	81 Å²	81	56.9 Å²	56.9	57%	0.566	32%	0.318	S	S	*	.	H	α-helix	trans	-58.3	-37.4	170	50.2	0	0	0	0	111.6	Y186 K187 I188	S184-Y186 VanDerWaalsContact C-N 3.29Å; S184-Y186 PolarHBondContact O-N 3.49Å; S184-K187 PolarHBondContact O-N 2.94Å; S184-I188 WeakPolarHBondContact O-CG1 3.38Å; S184-I188 PolarHBondContact O-N 3.1Å; S184-I188 VanDerWaalsContact O-N 3.11Å
185	S	81.6	Confident	82.5	Confident	73 Å²	73	50.5 Å²	50.5	51%	0.51	30%	0.295	S	S	.	.	H	α-helix	trans	-59.7	-35.6	175.8	58	0	0	0	0	113.3	S183 K189	S183-S185 WeakPolarHBondContact CB-OG 3.48Å; S183-S185 PolarHBondContact O-N 3.4Å; S183-S185 PolarHBondContact OG-OG 3.04Å; S185-K189 WeakPolarHBondContact O-CB 3.15Å; S185-K189 PolarHBondContact O-N 3.35Å
186	Y	86.6	Confident	83.8	Confident	19 Å²	19	42.9 Å²	42.9	8%	0.075	26%	0.26	C	S	.	.	H	α-helix	trans	-67.6	-44.1	177.1	178	-88.8	0	0	0	111.5	L84 E130 T137 V182 S183 S184 I188 K189 M190	L84-Y186 HydrophobicContact CD2-CE1 4.21Å; E130-Y186 HydrophobicContact CB-CD2 3.92Å; E130-Y186 HydrophobicContact CB-CE2 3.52Å; E130-Y186 HydrophobicContact CG-CD2 3.9Å; E130-Y186 HydrophobicContact CG-CE2 3.84Å; E130-Y186 HydrophobicContact CG-CG 4.4Å; E130-Y186 WeakPolarHBondContact O-CE2 3.35Å; E130-Y186 PolarHBondContact O-OH 3.36Å; T137-Y186 HydrophobicContact CG2-CE1 4.03Å; V182-Y186 VanDerWaalsContact CG1-CB 3.42Å; V182-Y186 HydrophobicContact CG1-CD1 3.14Å; V182-Y186 HydrophobicContact CG1-CD2 4.44Å; V182-Y186 HydrophobicContact CG1-CE1 3.93Å; V182-Y186 HydrophobicContact CG1-CG 3.42Å; V182-Y186 VanDerWaalsContact CG1-CG 3.42Å; S183-Y186 PolarHBondContact O-N 3.27Å; S183-Y186 VanDerWaalsContact O-N 3.17Å; S183-Y186 WeakPolarHBondContact OG-CB 3.45Å; S183-Y186 PolarHBondContact OG-N 3.44Å; S183-Y186 VanDerWaalsContact OG-N 3.12Å; S184-Y186 VanDerWaalsContact C-N 3.29Å; S184-Y186 PolarHBondContact O-N 3.49Å; Y186-I188 VanDerWaalsContact C-N 3.34Å; Y186-I188 PolarHBondContact O-N 3.18Å; Y186-K189 WeakPolarHBondContact O-CB 3.36Å; Y186-K189 PolarHBondContact O-N 2.84Å; Y186-M190 HydrophobicContact CD1-CG 3.81Å; Y186-M190 HydrophobicContact CD2-CE 4.44Å; Y186-M190 HydrophobicContact CE1-CG 3.51Å; Y186-M190 HydrophobicContact CE1-SD 4.34Å; Y186-M190 HydrophobicContact CE2-CE 4.11Å; Y186-M190 HydrophobicContact CE2-CG 4.23Å; Y186-M190 HydrophobicContact CE2-SD 4.21Å; Y186-M190 HydrophobicContact CG-CG 4.38Å; Y186-M190 VanDerWaalsContact O-CG 3.3Å; Y186-M190 WeakPolarHBondContact O-CG 3.35Å; Y186-M190 PolarHBondContact O-N 3.38Å
187	K	83.5	Confident	84.8	Confident	8 Å²	8	42.1 Å²	42.1	4%	0.035	26%	0.256	C	S	.	.	H	α-helix	trans	-60.7	-43.6	175.9	-77.7	-167.8	171.2	-162.3	0	112.2	C118 G119 L120 F122 F166 S183 S184 K189 M190 A191	C118-K187 PolarHBondContact O-NZ 3.11Å; G119-K187 PolarHBondContact O-NZ 3.17Å; L120-K187 VanDerWaalsContact C-NZ 3.33Å; L120-K187 WeakPolarHBondContact O-CE 3.4Å; L120-K187 PolarHBondContact O-NZ 3.01Å; F122-K187 HydrophobicContact CD2-CG 4.18Å; F122-K187 HydrophobicContact CE2-CG 4.31Å; F166-K187 HydrophobicContact CD1-CD 4.11Å; F166-K187 HydrophobicContact CG-CD 4.36Å; S183-K187 PolarHBondContact O-N 3.42Å; S184-K187 PolarHBondContact O-N 2.94Å; K187-K189 VanDerWaalsContact C-N 3.32Å; K187-M190 PolarHBondContact O-N 3.34Å; K187-A191 WeakPolarHBondContact O-CB 3.41Å; K187-A191 PolarHBondContact O-N 2.95Å
188	I	84.5	Confident	85.7	Confident	38 Å²	38	43.1 Å²	43.1	20%	0.195	25%	0.252	C	S	.	.	H	α-helix	trans	-60.9	-45.4	176.2	-64.7	168.7	0	0	0	109.6	Y167 S184 Y186 M190 A191 E192	Y167-I188 HydrophobicContact CD1-CD1 3.8Å; Y167-I188 HydrophobicContact CD1-CG1 4.2Å; Y167-I188 HydrophobicContact CE1-CD1 3.72Å; Y167-I188 HydrophobicContact CE1-CG1 3.79Å; Y167-I188 HydrophobicContact CE1-CG2 4.23Å; S184-I188 WeakPolarHBondContact O-CG1 3.38Å; S184-I188 PolarHBondContact O-N 3.1Å; S184-I188 VanDerWaalsContact O-N 3.11Å; Y186-I188 VanDerWaalsContact C-N 3.34Å; Y186-I188 PolarHBondContact O-N 3.18Å; I188-M190 VanDerWaalsContact C-N 3.34Å; I188-M190 PolarHBondContact O-N 2.85Å; I188-A191 WeakPolarHBondContact O-CB 3.13Å; I188-A191 PolarHBondContact O-N 3.08Å; I188-E192 WeakPolarHBondContact O-CG 3.46Å; I188-E192 PolarHBondContact O-N 3.23Å
189	K	87.9	Confident	86.5	Confident	106 Å²	106	40.5 Å²	40.5	46%	0.461	23%	0.225	S	C	.	.	H	α-helix	trans	-60	-41.7	175.1	-166.1	75.8	-156.8	158.3	0	112.5	S185 Y186 K187 A191 E192 V193	S185-K189 WeakPolarHBondContact O-CB 3.15Å; S185-K189 PolarHBondContact O-N 3.35Å; Y186-K189 WeakPolarHBondContact O-CB 3.36Å; Y186-K189 PolarHBondContact O-N 2.84Å; K187-K189 VanDerWaalsContact C-N 3.32Å; K189-A191 VanDerWaalsContact C-N 3.33Å; K189-E192 WeakPolarHBondContact CD-OE2 3.29Å; K189-E192 WeakPolarHBondContact CE-OE2 3.41Å; K189-E192 IonicContact NZ-OE2 2.58Å; K189-E192 PolarHBondContact NZ-OE2 3.07Å; K189-E192 WeakPolarHBondContact O-CB 3.41Å; K189-E192 PolarHBondContact O-N 3.13Å; K189-V193 WeakPolarHBondContact O-CG2 3.48Å; K189-V193 PolarHBondContact O-N 2.9Å
190	M	90.9	Very high	87	Confident	8 Å²	8	39.6 Å²	39.6	4%	0.039	22%	0.221	C	C	.	.	H	α-helix	trans	-71	-30.8	178.6	-66.1	-53.4	98.1	0	0	111.9	T134 T137 A138 L141 Y186 K187 I188 E192 V193 G194	T134-M190 HydrophobicContact CG2-CE 3.84Å; T134-M190 HydrophobicContact CG2-SD 3.68Å; T137-M190 HydrophobicContact CG2-CB 3.95Å; T137-M190 HydrophobicContact CG2-CG 3.7Å; A138-M190 HydrophobicContact CB-SD 4.47Å; L141-M190 HydrophobicContact CD1-CB 3.59Å; Y186-M190 HydrophobicContact CD1-CG 3.81Å; Y186-M190 HydrophobicContact CD2-CE 4.44Å; Y186-M190 HydrophobicContact CE1-CG 3.51Å; Y186-M190 HydrophobicContact CE1-SD 4.34Å; Y186-M190 HydrophobicContact CE2-CE 4.11Å; Y186-M190 HydrophobicContact CE2-CG 4.23Å; Y186-M190 HydrophobicContact CE2-SD 4.21Å; Y186-M190 HydrophobicContact CG-CG 4.38Å; Y186-M190 VanDerWaalsContact O-CG 3.3Å; Y186-M190 WeakPolarHBondContact O-CG 3.35Å; Y186-M190 PolarHBondContact O-N 3.38Å; K187-M190 PolarHBondContact O-N 3.34Å; I188-M190 VanDerWaalsContact C-N 3.34Å; I188-M190 PolarHBondContact O-N 2.85Å; M190-E192 VanDerWaalsContact C-N 3.34Å; M190-V193 HydrophobicContact CE-CG2 4.42Å; M190-G194 PolarHBondContact O-N 2.79Å
191	A	87.9	Confident	87.4	Confident	1 Å²	1	34.3 Å²	34.3	1%	0.008	20%	0.196	C	C	.	.	H	α-helix	trans	-66.9	-35.3	171.1	0	0	0	0	0	112.2	L141 K187 I188 K189 G195 L196	L141-A191 HydrophobicContact CD1-CB 4.37Å; K187-A191 WeakPolarHBondContact O-CB 3.41Å; K187-A191 PolarHBondContact O-N 2.95Å; I188-A191 WeakPolarHBondContact O-CB 3.13Å; I188-A191 PolarHBondContact O-N 3.08Å; K189-A191 VanDerWaalsContact C-N 3.33Å; A191-G195 PolarHBondContact O-N 2.83Å; A191-L196 HydrophobicContact CB-CB 4.3Å; A191-L196 HydrophobicContact CB-CD2 3.96Å; A191-L196 WeakPolarHBondContact O-CB 3.13Å; A191-L196 PolarHBondContact O-N 3.14Å; A191-L196 VanDerWaalsContact O-N 3.12Å
192	E	89.1	Confident	87.6	Confident	23 Å²	23	34.3 Å²	34.3	11%	0.107	20%	0.196	C	C	.	.	H	α-helix	trans	-64	-54.2	171.2	-65.9	167.6	-173.7	0	0	111.3	I188 K189 M190 G194 G195 S227 A229 N230 L233	I188-E192 WeakPolarHBondContact O-CG 3.46Å; I188-E192 PolarHBondContact O-N 3.23Å; K189-E192 WeakPolarHBondContact CD-OE2 3.29Å; K189-E192 WeakPolarHBondContact CE-OE2 3.41Å; K189-E192 IonicContact NZ-OE2 2.58Å; K189-E192 PolarHBondContact NZ-OE2 3.07Å; K189-E192 WeakPolarHBondContact O-CB 3.41Å; K189-E192 PolarHBondContact O-N 3.13Å; M190-E192 VanDerWaalsContact C-N 3.34Å; E192-G194 VanDerWaalsContact C-N 3.33Å; E192-G194 PolarHBondContact O-N 3.49Å; E192-G195 PolarHBondContact O-N 3.1Å; E192-G195 VanDerWaalsContact O-N 3.13Å; E192-S227 VanDerWaalsContact CD-OG 3.29Å; E192-S227 WeakPolarHBondContact OE1-CB 3.17Å; E192-S227 PolarHBondContact OE1-OG 2.87Å; E192-A229 HydrophobicContact CB-CB 4.34Å; E192-A229 HydrophobicContact CG-CB 4.14Å; E192-N230 WeakPolarHBondContact CA-OD1 3.36Å; E192-L233 WeakPolarHBondContact O-CD1 3.3Å
193	V	89.1	Confident	87.7	Confident	86 Å²	86	34 Å²	34	52%	0.521	20%	0.195	S	C	.	.	H	α-helix	trans	-63.6	-40.2	-177.6	176.1	0	0	0	0	111.2	A138 K189 M190 G195	A138-V193 HydrophobicContact CB-CB 4.11Å; A138-V193 HydrophobicContact CB-CG1 3.76Å; K189-V193 WeakPolarHBondContact O-CG2 3.48Å; K189-V193 PolarHBondContact O-N 2.9Å; M190-V193 HydrophobicContact CE-CG2 4.42Å; V193-G195 PolarHBondContact O-N 3.39Å
194	G	86.4	Confident	88	Confident	15 Å²	15	32.1 Å²	32.1	16%	0.155	18%	0.181	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.1	-3.3	177.5	0	0	0	0	0	114.5	A138 A142 M190 E192 L196	A138-G194 WeakPolarHBondContact O-CA 3.3Å; A142-G194 WeakPolarHBondContact CB-O 3.28Å; M190-G194 PolarHBondContact O-N 2.79Å; E192-G194 VanDerWaalsContact C-N 3.33Å; E192-G194 PolarHBondContact O-N 3.49Å; G194-L196 VanDerWaalsContact C-N 3.28Å; G194-L196 PolarHBondContact O-N 3.13Å
195	G	89.2	Confident	88	Confident	19 Å²	19	33.7 Å²	33.7	20%	0.196	18%	0.179	C	C	.	.	T	Hydrogen-bonded Turn	trans	68.3	25.6	177.2	0	0	0	0	0	114.1	A191 E192 V193 A197 K198 A199	A191-G195 PolarHBondContact O-N 2.83Å; E192-G195 PolarHBondContact O-N 3.1Å; E192-G195 VanDerWaalsContact O-N 3.13Å; V193-G195 PolarHBondContact O-N 3.39Å; G195-A197 PolarHBondContact O-N 3.38Å; G195-K198 WeakPolarHBondContact O-CB 3.39Å; G195-K198 PolarHBondContact O-N 3.45Å; G195-A199 PolarHBondContact O-N 3.48Å
196	L	91.2	Very high	87.8	Confident	0 Å²	0	34.5 Å²	34.5	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-59.1	-36.4	-175.3	-174.3	59	0	0	0	112.3	L144 I163 A191 G194 K198 A199 M200	L144-L196 HydrophobicContact CB-CD1 4.38Å; I163-L196 HydrophobicContact CD1-CD1 4.1Å; I163-L196 HydrophobicContact CD1-CD2 3.96Å; I163-L196 HydrophobicContact CD1-CG 4.35Å; I163-L196 HydrophobicContact CG1-CD2 4.05Å; I163-L196 HydrophobicContact CG2-CD2 3.88Å; A191-L196 HydrophobicContact CB-CB 4.3Å; A191-L196 HydrophobicContact CB-CD2 3.96Å; A191-L196 WeakPolarHBondContact O-CB 3.13Å; A191-L196 PolarHBondContact O-N 3.14Å; A191-L196 VanDerWaalsContact O-N 3.12Å; G194-L196 VanDerWaalsContact C-N 3.28Å; G194-L196 PolarHBondContact O-N 3.13Å; L196-K198 VanDerWaalsContact C-N 3.32Å; L196-K198 PolarHBondContact O-N 2.77Å; L196-A199 PolarHBondContact O-N 3.3Å; L196-M200 HydrophobicContact CD1-CE 3.86Å; L196-M200 HydrophobicContact CG-CG 4.49Å; L196-M200 VanDerWaalsContact O-CG 3.32Å; L196-M200 WeakPolarHBondContact O-CG 3.41Å; L196-M200 PolarHBondContact O-N 2.94Å
197	A	92.4	Very high	87.5	Confident	0 Å²	0	33.8 Å²	33.8	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-60.6	-39.1	176.7	0	0	0	0	0	112.9	G195 M200 I201 L224 N230 M234	G195-A197 PolarHBondContact O-N 3.38Å; A197-M200 PolarHBondContact O-N 3.27Å; A197-I201 WeakPolarHBondContact O-CG1 3.29Å; A197-I201 PolarHBondContact O-N 3.39Å; A197-I201 VanDerWaalsContact O-N 3.09Å; A197-L224 HydrophobicContact CB-CB 4.42Å; A197-L224 HydrophobicContact CB-CD1 4.19Å; A197-N230 HydrophobicContact CB-CB 4.02Å; A197-M234 HydrophobicContact CB-CG 3.81Å; A197-M234 HydrophobicContact CB-SD 4.33Å
198	K	91.8	Very high	86.7	Confident	104 Å²	104	38.2 Å²	38.2	45%	0.452	20%	0.196	S	C	.	.	H	α-helix	trans	-64	-45.4	175.5	169.1	171.1	-178.2	-172.8	0	111.4	G195 L196 M200 I201 Q202 S237	G195-K198 WeakPolarHBondContact O-CB 3.39Å; G195-K198 PolarHBondContact O-N 3.45Å; L196-K198 VanDerWaalsContact C-N 3.32Å; L196-K198 PolarHBondContact O-N 2.77Å; K198-M200 VanDerWaalsContact C-N 3.35Å; K198-M200 PolarHBondContact O-N 2.92Å; K198-I201 PolarHBondContact O-N 3.29Å; K198-Q202 WeakPolarHBondContact O-CG 3.45Å; K198-Q202 PolarHBondContact O-N 3.1Å; K198-Q202 VanDerWaalsContact O-N 3.08Å; K198-S237 VanDerWaalsContact CG-OG 3.29Å; K198-S237 WeakPolarHBondContact CG-OG 3.31Å
199	A	91.4	Very high	86.1	Confident	8 Å²	8	44.5 Å²	44.5	7%	0.066	23%	0.228	C	C	.	.	H	α-helix	trans	-64.6	-38.3	178.8	0	0	0	0	0	112.4	G195 L196 Q202 S203	G195-A199 PolarHBondContact O-N 3.48Å; L196-A199 PolarHBondContact O-N 3.3Å; A199-Q202 PolarHBondContact O-N 3.1Å; A199-S203 PolarHBondContact O-N 3.26Å; A199-S203 PolarHBondContact O-OG 3.06Å
200	M	93.1	Very high	85.8	Confident	0 Å²	0	42.8 Å²	42.8	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-64.3	-41.7	175.4	-69	-67.9	130.4	0	0	112	M148 I159 I163 L196 A197 K198 Q202 S203 V204 V217 V220 L221 L224	M148-M200 HydrophobicContact CG-CE 3.7Å; M148-M200 HydrophobicContact CG-SD 4.48Å; M148-M200 HydrophobicContact SD-CE 4.34Å; I159-M200 HydrophobicContact CG2-CE 4.28Å; I163-M200 HydrophobicContact CD1-CE 3.43Å; I163-M200 VanDerWaalsContact CD1-CE 3.43Å; I163-M200 HydrophobicContact CD1-SD 4.06Å; L196-M200 HydrophobicContact CD1-CE 3.86Å; L196-M200 HydrophobicContact CG-CG 4.49Å; L196-M200 VanDerWaalsContact O-CG 3.32Å; L196-M200 WeakPolarHBondContact O-CG 3.41Å; L196-M200 PolarHBondContact O-N 2.94Å; A197-M200 PolarHBondContact O-N 3.27Å; K198-M200 VanDerWaalsContact C-N 3.35Å; K198-M200 PolarHBondContact O-N 2.92Å; M200-Q202 PolarHBondContact O-N 2.69Å; M200-S203 WeakPolarHBondContact O-CB 3.37Å; M200-S203 PolarHBondContact O-N 2.93Å; M200-S203 VanDerWaalsContact O-N 3.1Å; M200-V204 PolarHBondContact O-N 3.06Å; M200-V217 HydrophobicContact CB-CG1 4.49Å; M200-V220 HydrophobicContact CG-CG1 3.86Å; M200-V220 HydrophobicContact SD-CB 4.46Å; M200-V220 HydrophobicContact SD-CG1 3.88Å; M200-L221 HydrophobicContact CB-CD2 3.54Å; M200-L221 HydrophobicContact CB-CG 4.15Å; M200-L224 HydrophobicContact CG-CD1 4.11Å
201	I	92.4	Very high	85.6	Confident	1 Å²	1	45.2 Å²	45.2	1%	0.005	24%	0.235	C	C	.	.	H	α-helix	trans	-63.5	-40	175.2	-68.5	-65.6	0	0	0	112.1	A197 K198 S203 V204 L221 M234 A239 I243	A197-I201 WeakPolarHBondContact O-CG1 3.29Å; A197-I201 PolarHBondContact O-N 3.39Å; A197-I201 VanDerWaalsContact O-N 3.09Å; K198-I201 PolarHBondContact O-N 3.29Å; I201-S203 PolarHBondContact O-N 3.49Å; I201-V204 PolarHBondContact O-N 3.06Å; I201-L221 HydrophobicContact CD1-CD1 3.61Å; I201-L221 HydrophobicContact CD1-CD2 3.68Å; I201-L221 HydrophobicContact CD1-CG 4.28Å; I201-L221 HydrophobicContact CG1-CD2 3.86Å; I201-M234 HydrophobicContact CD1-CE 4.11Å; I201-M234 HydrophobicContact CD1-CG 4.49Å; I201-M234 HydrophobicContact CG1-CB 4.39Å; I201-M234 HydrophobicContact CG1-CG 4.02Å; I201-A239 HydrophobicContact CD1-CB 3.43Å; I201-A239 VanDerWaalsContact CD1-CB 3.43Å; I201-A239 HydrophobicContact CG1-CB 3.85Å; I201-A239 HydrophobicContact CG2-CB 4.23Å; I201-I243 HydrophobicContact CD1-CD1 3.95Å
202	Q	88.9	Confident	85.6	Confident	74 Å²	74	50.2 Å²	50.2	35%	0.346	26%	0.26	S	S	.	.	H	α-helix	trans	-62.9	-34	173.6	-69.6	176.2	-10.3	0	0	111.8	K198 A199 M200 V204 H205	K198-Q202 WeakPolarHBondContact O-CG 3.45Å; K198-Q202 PolarHBondContact O-N 3.1Å; K198-Q202 VanDerWaalsContact O-N 3.08Å; A199-Q202 PolarHBondContact O-N 3.1Å; M200-Q202 PolarHBondContact O-N 2.69Å; Q202-V204 VanDerWaalsContact C-N 3.34Å; Q202-V204 PolarHBondContact O-N 3.37Å; Q202-H205 PolarHBondContact O-N 3.4Å
203	S	87.6	Confident	85.6	Confident	4 Å²	4	49.9 Å²	49.9	3%	0.028	26%	0.258	C	S	.	.	H	α-helix	trans	-69.5	-28.1	178.1	-56.1	0	0	0	0	113.2	M148 A199 M200 I201 H205 L206 L207	M148-S203 WeakPolarHBondContact CB-OG 3.47Å; A199-S203 PolarHBondContact O-N 3.26Å; A199-S203 PolarHBondContact O-OG 3.06Å; M200-S203 WeakPolarHBondContact O-CB 3.37Å; M200-S203 PolarHBondContact O-N 2.93Å; M200-S203 VanDerWaalsContact O-N 3.1Å; I201-S203 PolarHBondContact O-N 3.49Å; S203-H205 VanDerWaalsContact C-N 3.27Å; S203-H205 PolarHBondContact O-N 3.39Å; S203-L206 PolarHBondContact O-N 2.83Å; S203-L206 VanDerWaalsContact O-N 3.13Å; S203-L207 VanDerWaalsContact O-CG 3.28Å; S203-L207 WeakPolarHBondContact O-CG 3.45Å; S203-L207 PolarHBondContact O-N 2.81Å
204	V	84.8	Confident	85.6	Confident	6 Å²	6	46.1 Å²	46.1	4%	0.036	24%	0.235	C	C	.	.	H	α-helix	trans	-57.6	-41.6	175.4	176.7	0	0	0	0	111.3	M200 I201 Q202 L206 L207 V217 L221	M200-V204 PolarHBondContact O-N 3.06Å; I201-V204 PolarHBondContact O-N 3.06Å; Q202-V204 VanDerWaalsContact C-N 3.34Å; Q202-V204 PolarHBondContact O-N 3.37Å; V204-L206 VanDerWaalsContact C-N 3.33Å; V204-L206 PolarHBondContact O-N 3.08Å; V204-L207 PolarHBondContact O-N 3.07Å; V204-V217 HydrophobicContact CG2-CG1 3.56Å; V204-L221 HydrophobicContact CG2-CD1 3.72Å
205	H	77.1	Confident	85.9	Confident	114 Å²	114	46.2 Å²	46.2	53%	0.528	23%	0.232	S	C	.	.	H	α-helix	trans	-67.9	-31.8	178.3	-179.9	54.5	0	0	0	112.8	Q202 S203 L207 E208	Q202-H205 PolarHBondContact O-N 3.4Å; S203-H205 VanDerWaalsContact C-N 3.27Å; S203-H205 PolarHBondContact O-N 3.39Å; H205-L207 PolarHBondContact O-N 2.7Å; H205-E208 IonicContact CE1-OE1 3.11Å; H205-E208 PolarHBondContact CE1-OE1 3.46Å; H205-E208 VanDerWaalsContact CE1-OE1 3.29Å; H205-E208 IonicContact ND1-OE1 3.54Å; H205-E208 PolarHBondContact ND1-OE1 3.28Å
206	L	78.9	Confident	86.1	Confident	91 Å²	91	48.3 Å²	48.3	48%	0.476	23%	0.234	S	C	.	.	H	α-helix	trans	-71	-13.2	177.7	-62.2	175.1	0	0	0	113.2	K149 S203 V204	K149-L206 HydrophobicContact CG-CD1 3.99Å; S203-L206 PolarHBondContact O-N 2.83Å; S203-L206 VanDerWaalsContact O-N 3.13Å; V204-L206 VanDerWaalsContact C-N 3.33Å; V204-L206 PolarHBondContact O-N 3.08Å
207	L	79.5	Confident	86.2	Confident	3 Å²	3	48.3 Å²	48.3	2%	0.016	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	-116.2	22.1	-168.5	-62	172.7	0	0	0	113.3	M148 S203 V204 H205 I209 Q210 E213 V217	M148-L207 HydrophobicContact CE-CD1 4.32Å; S203-L207 VanDerWaalsContact O-CG 3.28Å; S203-L207 WeakPolarHBondContact O-CG 3.45Å; S203-L207 PolarHBondContact O-N 2.81Å; V204-L207 PolarHBondContact O-N 3.07Å; H205-L207 PolarHBondContact O-N 2.7Å; L207-I209 PolarHBondContact O-N 3Å; L207-Q210 HydrophobicContact CB-CB 4.47Å; L207-Q210 HydrophobicContact CD2-CB 4.3Å; L207-Q210 PolarHBondContact O-N 3.21Å; L207-E213 HydrophobicContact CD1-CB 3.93Å; L207-E213 HydrophobicContact CD2-CB 3.98Å; L207-E213 HydrophobicContact CG-CB 4.47Å; L207-V217 HydrophobicContact CD1-CG2 3.68Å
208	E	66.9	Low	86.3	Confident	102 Å²	102	48.4 Å²	48.4	48%	0.477	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-50.2	-34.7	-175	-79.7	174	-167.3	0	0	114.2	H205	H205-E208 IonicContact CE1-OE1 3.11Å; H205-E208 PolarHBondContact CE1-OE1 3.46Å; H205-E208 VanDerWaalsContact CE1-OE1 3.29Å; H205-E208 IonicContact ND1-OE1 3.54Å; H205-E208 PolarHBondContact ND1-OE1 3.28Å
209	I	71.7	Confident	86.4	Confident	170 Å²	170	46.3 Å²	46.3	87%	0.872	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	-97	-10.6	-176.4	-53.3	172.7	0	0	0	112.3	L207	L207-I209 PolarHBondContact O-N 3Å
210	Q	82.5	Confident	86.5	Confident	70 Å²	70	46 Å²	46	33%	0.327	22%	0.222	S	C	.	.			trans	-106.3	82.6	-168.6	-76.8	-173.6	-22.1	0	0	112	L207 I212 E213 K214	L207-Q210 HydrophobicContact CB-CB 4.47Å; L207-Q210 HydrophobicContact CD2-CB 4.3Å; L207-Q210 PolarHBondContact O-N 3.21Å; Q210-I212 PolarHBondContact O-N 3.28Å; Q210-E213 HydrophobicContact CB-CB 4.22Å; Q210-E213 HydrophobicContact CB-CG 4.43Å; Q210-E213 WeakPolarHBondContact CB-OE2 3.31Å; Q210-E213 PolarHBondContact O-N 3.48Å; Q210-K214 WeakPolarHBondContact O-CB 3.39Å; Q210-K214 PolarHBondContact O-N 3.43Å
211	L	85.3	Confident	86.6	Confident	59 Å²	59	46 Å²	46	31%	0.309	22%	0.222	S	C	.	.	H	α-helix	trans	-56.8	-44.8	-173.6	-179.6	62	0	0	0	113.4	E213 K214 L215 D251 L256	L211-E213 PolarHBondContact O-N 2.89Å; L211-K214 PolarHBondContact O-N 3.2Å; L211-L215 HydrophobicContact CD1-CD1 4.39Å; L211-L215 HydrophobicContact CD1-CG 4.15Å; L211-L215 HydrophobicContact CG-CD1 4.26Å; L211-L215 HydrophobicContact CG-CG 4.43Å; L211-L215 VanDerWaalsContact O-CG 3.28Å; L211-L215 WeakPolarHBondContact O-CG 3.26Å; L211-L215 PolarHBondContact O-N 3Å; L211-D251 HydrophobicContact CD1-CB 4.13Å; L211-D251 HydrophobicContact CD2-CB 4.42Å; L211-L256 HydrophobicContact CD1-CD1 3.98Å
212	I	88.5	Confident	86.8	Confident	106 Å²	106	47 Å²	47	54%	0.544	23%	0.227	S	C	.	.	H	α-helix	trans	-63.7	-46.6	-175.5	-63.3	173	0	0	0	110.7	I157 Q210 L215 W216	I157-I212 HydrophobicContact CD1-CG2 3.89Å; Q210-I212 PolarHBondContact O-N 3.28Å; I212-L215 PolarHBondContact O-N 2.78Å; I212-W216 VanDerWaalsContact O-CD1 3.28Å; I212-W216 PolarHBondContact O-N 2.96Å; I212-W216 VanDerWaalsContact O-N 3.16Å
213	E	89.3	Confident	86.9	Confident	15 Å²	15	45 Å²	45	7%	0.07	22%	0.218	C	C	.	.	H	α-helix	trans	-65.3	-43.6	178	-65	86.9	154.4	0	0	110.7	S153 I157 L207 Q210 L211 L215 W216 V217	S153-E213 WeakPolarHBondContact CB-OE1 3.42Å; S153-E213 PolarHBondContact OG-OE1 2.92Å; I157-E213 HydrophobicContact CD1-CG 4.47Å; I157-E213 HydrophobicContact CG1-CG 4.21Å; L207-E213 HydrophobicContact CD1-CB 3.93Å; L207-E213 HydrophobicContact CD2-CB 3.98Å; L207-E213 HydrophobicContact CG-CB 4.47Å; Q210-E213 HydrophobicContact CB-CB 4.22Å; Q210-E213 HydrophobicContact CB-CG 4.43Å; Q210-E213 WeakPolarHBondContact CB-OE2 3.31Å; Q210-E213 PolarHBondContact O-N 3.48Å; L211-E213 PolarHBondContact O-N 2.89Å; E213-L215 VanDerWaalsContact C-N 3.33Å; E213-L215 PolarHBondContact O-N 3.12Å; E213-W216 WeakPolarHBondContact O-CB 3.26Å; E213-W216 PolarHBondContact O-N 2.95Å; E213-W216 VanDerWaalsContact O-N 3.13Å; E213-V217 WeakPolarHBondContact O-CG2 3.36Å; E213-V217 PolarHBondContact O-N 3.35Å
214	K	89.5	Confident	87.2	Confident	7 Å²	7	44.8 Å²	44.8	3%	0.03	22%	0.216	C	C	.	.	H	α-helix	trans	-57.4	-44.9	175.2	-173.5	174.2	-175.6	166.9	0	111.4	Q210 L211 W216 V217 L218 H246 D249 L256	Q210-K214 WeakPolarHBondContact O-CB 3.39Å; Q210-K214 PolarHBondContact O-N 3.43Å; L211-K214 PolarHBondContact O-N 3.2Å; K214-W216 VanDerWaalsContact C-N 3.32Å; K214-W216 PolarHBondContact O-N 3.05Å; K214-V217 PolarHBondContact O-N 3.49Å; K214-L218 HydrophobicContact CG-CD1 4.43Å; K214-L218 WeakPolarHBondContact O-CG 3.38Å; K214-L218 PolarHBondContact O-N 3.07Å; K214-H246 VanDerWaalsContact NZ-CB 3.32Å; K214-H246 VanDerWaalsContact NZ-CG 3.33Å; K214-D249 IonicContact NZ-OD2 2.68Å; K214-D249 PolarHBondContact NZ-OD2 2.66Å; K214-L256 HydrophobicContact CD-CD1 4.16Å
215	L	91.9	Very high	87.6	Confident	18 Å²	18	44.5 Å²	44.5	9%	0.094	22%	0.215	C	C	.	.	H	α-helix	trans	-60.7	-39.6	176.1	-72.5	178.8	0	0	0	112.4	L211 I212 E213 K219 Q255 L256 R259	L211-L215 HydrophobicContact CD1-CD1 4.39Å; L211-L215 HydrophobicContact CD1-CG 4.15Å; L211-L215 HydrophobicContact CG-CD1 4.26Å; L211-L215 HydrophobicContact CG-CG 4.43Å; L211-L215 VanDerWaalsContact O-CG 3.28Å; L211-L215 WeakPolarHBondContact O-CG 3.26Å; L211-L215 PolarHBondContact O-N 3Å; I212-L215 PolarHBondContact O-N 2.78Å; E213-L215 VanDerWaalsContact C-N 3.33Å; E213-L215 PolarHBondContact O-N 3.12Å; L215-K219 PolarHBondContact O-N 2.81Å; L215-Q255 HydrophobicContact CD2-CB 3.78Å; L215-L256 HydrophobicContact CD2-CB 3.77Å; L215-R259 PolarHBondContact O-NH1 3.33Å
216	W	93	Very high	88.3	Confident	62 Å²	62	42.4 Å²	42.4	24%	0.235	21%	0.21	C	C	.	.	H	α-helix	trans	-67.4	-40.6	175.3	-86.4	105.7	0	0	0	112.6	I157 C160 K161 I212 E213 K214 K219 V220	I157-W216 HydrophobicContact CG1-CG 4.47Å; I157-W216 HydrophobicContact CG2-CD2 4.27Å; I157-W216 HydrophobicContact CG2-CG 4.24Å; C160-W216 HydrophobicContact CB-CB 3.77Å; C160-W216 HydrophobicContact CB-CE3 4.13Å; C160-W216 HydrophobicContact CB-CG 4.41Å; K161-W216 HydrophobicContact CB-CZ3 4.46Å; K161-W216 HydrophobicContact CD-CH2 4.2Å; K161-W216 HydrophobicContact CD-CZ2 4.41Å; K161-W216 VanDerWaalsContact CE-CZ2 3.45Å; K161-W216 HydrophobicContact CG-CE3 4.05Å; K161-W216 HydrophobicContact CG-CH2 3.49Å; K161-W216 VanDerWaalsContact CG-CH2 3.49Å; K161-W216 HydrophobicContact CG-CZ2 4.05Å; K161-W216 HydrophobicContact CG-CZ3 3.48Å; K161-W216 VanDerWaalsContact CG-CZ3 3.48Å; I212-W216 VanDerWaalsContact O-CD1 3.28Å; I212-W216 PolarHBondContact O-N 2.96Å; I212-W216 VanDerWaalsContact O-N 3.16Å; E213-W216 WeakPolarHBondContact O-CB 3.26Å; E213-W216 PolarHBondContact O-N 2.95Å; E213-W216 VanDerWaalsContact O-N 3.13Å; K214-W216 VanDerWaalsContact C-N 3.32Å; K214-W216 PolarHBondContact O-N 3.05Å; W216-K219 HydrophobicContact CE3-CD 4.23Å; W216-K219 HydrophobicContact CZ3-CD 4.06Å; W216-K219 WeakPolarHBondContact O-CB 3.25Å; W216-K219 PolarHBondContact O-N 3.39Å; W216-V220 WeakPolarHBondContact O-CG2 3.42Å; W216-V220 PolarHBondContact O-N 3.1Å
217	V	93.4	Very high	88.9	Confident	0 Å²	0	38.9 Å²	38.9	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-64.2	-44.3	174.6	175.1	0	0	0	0	110.9	M148 M200 V204 L207 E213 K214 K219 V220 L221	M148-V217 HydrophobicContact CE-CG2 3.57Å; M200-V217 HydrophobicContact CB-CG1 4.49Å; V204-V217 HydrophobicContact CG2-CG1 3.56Å; L207-V217 HydrophobicContact CD1-CG2 3.68Å; E213-V217 WeakPolarHBondContact O-CG2 3.36Å; E213-V217 PolarHBondContact O-N 3.35Å; K214-V217 PolarHBondContact O-N 3.49Å; V217-K219 VanDerWaalsContact C-N 3.26Å; V217-K219 PolarHBondContact O-N 2.84Å; V217-V220 WeakPolarHBondContact O-CB 3.42Å; V217-V220 PolarHBondContact O-N 3.26Å; V217-V220 VanDerWaalsContact O-N 3.1Å; V217-L221 HydrophobicContact CG1-CD1 3.95Å; V217-L221 HydrophobicContact CG1-CG 4.31Å; V217-L221 WeakPolarHBondContact O-CG 3.49Å; V217-L221 PolarHBondContact O-N 3.15Å
218	L	93.9	Very high	89.5	Confident	2 Å²	2	45.3 Å²	45.3	1%	0.01	22%	0.223	C	C	.	.	H	α-helix	trans	-60	-37.5	174.3	-71.1	174.2	0	0	0	111.7	K214 V220 L221 Q222 L256 R259 I263	K214-L218 HydrophobicContact CG-CD1 4.43Å; K214-L218 WeakPolarHBondContact O-CG 3.38Å; K214-L218 PolarHBondContact O-N 3.07Å; L218-V220 VanDerWaalsContact C-N 3.33Å; L218-V220 PolarHBondContact O-N 3.01Å; L218-L221 HydrophobicContact CD2-CD1 4.43Å; L218-L221 PolarHBondContact O-N 3.47Å; L218-Q222 WeakPolarHBondContact O-CB 3.43Å; L218-Q222 PolarHBondContact O-N 3.34Å; L218-L256 HydrophobicContact CD1-CG 4Å; L218-R259 HydrophobicContact CB-CB 4.09Å; L218-I263 HydrophobicContact CD2-CD1 3.94Å
219	K	94.7	Very high	90.7	Very high	60 Å²	60	42.3 Å²	42.3	26%	0.261	22%	0.215	S	C	.	.	H	α-helix	trans	-62.7	-40.1	174.4	-167.5	175.9	179.9	178.2	0	112.3	V164 L215 W216 V217 H223	V164-K219 HydrophobicContact CG2-CD 4.31Å; V164-K219 HydrophobicContact CG2-CG 4.18Å; L215-K219 PolarHBondContact O-N 2.81Å; W216-K219 HydrophobicContact CE3-CD 4.23Å; W216-K219 HydrophobicContact CZ3-CD 4.06Å; W216-K219 WeakPolarHBondContact O-CB 3.25Å; W216-K219 PolarHBondContact O-N 3.39Å; V217-K219 VanDerWaalsContact C-N 3.26Å; V217-K219 PolarHBondContact O-N 2.84Å; K219-H223 PolarHBondContact O-CD2 3.01Å; K219-H223 PolarHBondContact O-N 2.86Å
220	V	94.1	Very high	91.7	Very high	1 Å²	1	34.2 Å²	34.2	1%	0.006	17%	0.174	C	C	.	.	H	α-helix	trans	-65.1	-46.5	174.7	170.3	0	0	0	0	110.8	C160 I163 V164 M200 W216 V217 L218 Q222 H223 L224	C160-V220 HydrophobicContact CB-CG2 3.62Å; C160-V220 WeakPolarHBondContact O-CG2 3.02Å; I163-V220 HydrophobicContact CB-CG1 4.13Å; I163-V220 HydrophobicContact CB-CG2 4.2Å; I163-V220 HydrophobicContact CD1-CG1 4.25Å; I163-V220 HydrophobicContact CG2-CG1 3.56Å; I163-V220 HydrophobicContact CG2-CG2 4.41Å; V164-V220 HydrophobicContact CG2-CG2 3.93Å; M200-V220 HydrophobicContact CG-CG1 3.86Å; M200-V220 HydrophobicContact SD-CB 4.46Å; M200-V220 HydrophobicContact SD-CG1 3.88Å; W216-V220 WeakPolarHBondContact O-CG2 3.42Å; W216-V220 PolarHBondContact O-N 3.1Å; V217-V220 WeakPolarHBondContact O-CB 3.42Å; V217-V220 PolarHBondContact O-N 3.26Å; V217-V220 VanDerWaalsContact O-N 3.1Å; L218-V220 VanDerWaalsContact C-N 3.33Å; L218-V220 PolarHBondContact O-N 3.01Å; V220-Q222 VanDerWaalsContact C-N 3.32Å; V220-Q222 PolarHBondContact O-N 2.95Å; V220-H223 PolarHBondContact O-N 3.3Å; V220-L224 HydrophobicContact CG1-CD1 3.58Å; V220-L224 HydrophobicContact CG1-CG 4.25Å; V220-L224 WeakPolarHBondContact O-CG 3.47Å; V220-L224 PolarHBondContact O-N 3.26Å
221	L	95.1	Very high	92.3	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-63.2	-36.8	179.4	-69.7	170.9	0	0	0	112.4	M200 I201 V204 V217 L218 H223 L224 S225 M234 I243 I263	M200-L221 HydrophobicContact CB-CD2 3.54Å; M200-L221 HydrophobicContact CB-CG 4.15Å; I201-L221 HydrophobicContact CD1-CD1 3.61Å; I201-L221 HydrophobicContact CD1-CD2 3.68Å; I201-L221 HydrophobicContact CD1-CG 4.28Å; I201-L221 HydrophobicContact CG1-CD2 3.86Å; V204-L221 HydrophobicContact CG2-CD1 3.72Å; V217-L221 HydrophobicContact CG1-CD1 3.95Å; V217-L221 HydrophobicContact CG1-CG 4.31Å; V217-L221 WeakPolarHBondContact O-CG 3.49Å; V217-L221 PolarHBondContact O-N 3.15Å; L218-L221 HydrophobicContact CD2-CD1 4.43Å; L218-L221 PolarHBondContact O-N 3.47Å; L221-H223 PolarHBondContact O-N 3.47Å; L221-L224 PolarHBondContact O-N 3.5Å; L221-S225 VanDerWaalsContact O-CB 3.26Å; L221-S225 WeakPolarHBondContact O-CB 3.47Å; L221-S225 PolarHBondContact O-N 3.34Å; L221-S225 PolarHBondContact O-OG 2.96Å; L221-M234 HydrophobicContact CB-CE 4.34Å; L221-M234 HydrophobicContact CD2-CE 4.09Å; L221-M234 HydrophobicContact CD2-SD 4.46Å; L221-I243 HydrophobicContact CD1-CD1 4.44Å; L221-I263 HydrophobicContact CB-CD1 3.7Å; L221-I263 HydrophobicContact CB-CG1 4.39Å
222	Q	95.3	Very high	92.7	Very high	23 Å²	23	30.5 Å²	30.5	11%	0.107	16%	0.159	C	C	.	.	H	α-helix	trans	-55.5	-49.9	172.5	-174.5	-176	32.1	0	0	110.6	L218 V220 S225 E262 I263	L218-Q222 WeakPolarHBondContact O-CB 3.43Å; L218-Q222 PolarHBondContact O-N 3.34Å; V220-Q222 VanDerWaalsContact C-N 3.32Å; V220-Q222 PolarHBondContact O-N 2.95Å; Q222-S225 PolarHBondContact O-N 3.33Å; Q222-S225 PolarHBondContact O-OG 2.95Å; Q222-E262 PolarHBondContact NE2-OE1 2.84Å; Q222-E262 PolarHBondContact NE2-OE2 3.46Å; Q222-I263 HydrophobicContact CB-CD1 4.49Å; Q222-I263 HydrophobicContact CB-CG1 4.2Å
223	H	93	Very high	92.9	Very high	31 Å²	31	27.7 Å²	27.7	14%	0.144	14%	0.144	C	C	.	.	H	α-helix	trans	-65.9	-41.7	176.1	-69.8	-53.3	0	0	0	113.2	Y167 H168 K219 V220 L221 S225 T226	Y167-H223 HydrophobicContact CD1-CB 4.3Å; Y167-H223 HydrophobicContact CD2-CB 3.77Å; Y167-H223 HydrophobicContact CE1-CB 4.35Å; Y167-H223 HydrophobicContact CE2-CB 3.84Å; Y167-H223 HydrophobicContact CG-CB 4.01Å; H168-H223 AromaticContact CE1-CE1 3.82Å; H168-H223 AromaticContact NE2-CE1 3.05Å; H168-H223 PolarHBondContact NE2-CE1 2.91Å; H168-H223 AromaticContact NE2-ND1 3.73Å; H168-H223 AromaticContact NE2-NE2 3.26Å; H168-H223 PolarHBondContact NE2-NE2 3.34Å; K219-H223 PolarHBondContact O-CD2 3.01Å; K219-H223 PolarHBondContact O-N 2.86Å; V220-H223 PolarHBondContact O-N 3.3Å; L221-H223 PolarHBondContact O-N 3.47Å; H223-S225 VanDerWaalsContact C-N 3.31Å; H223-S225 PolarHBondContact O-N 2.76Å; H223-T226 WeakPolarHBondContact O-CB 3.33Å; H223-T226 WeakPolarHBondContact O-CG2 3.37Å; H223-T226 PolarHBondContact O-N 2.66Å; H223-T226 PolarHBondContact O-OG1 2.76Å
224	L	92.7	Very high	93.2	Very high	0 Å²	0	27 Å²	27	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-64.8	-35.7	178.6	-69.8	167	0	0	0	112.2	Y167 A197 M200 V220 L221 T226 S227 N230	Y167-L224 WeakPolarHBondContact OH-CD2 3.29Å; A197-L224 HydrophobicContact CB-CB 4.42Å; A197-L224 HydrophobicContact CB-CD1 4.19Å; M200-L224 HydrophobicContact CG-CD1 4.11Å; V220-L224 HydrophobicContact CG1-CD1 3.58Å; V220-L224 HydrophobicContact CG1-CG 4.25Å; V220-L224 WeakPolarHBondContact O-CG 3.47Å; V220-L224 PolarHBondContact O-N 3.26Å; L221-L224 PolarHBondContact O-N 3.5Å; L224-T226 PolarHBondContact O-N 2.7Å; L224-T226 VanDerWaalsContact O-N 3.09Å; L224-S227 PolarHBondContact O-N 3.19Å; L224-N230 HydrophobicContact CB-CB 4.43Å; L224-N230 WeakPolarHBondContact O-CB 3.04Å; L224-N230 PolarHBondContact O-ND2 3.45Å
225	S	94.4	Very high	93.5	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	14%	0.14	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.1	-5.4	178	72.4	0	0	0	0	113.9	L221 Q222 H223 S227 C231 N266	L221-S225 VanDerWaalsContact O-CB 3.26Å; L221-S225 WeakPolarHBondContact O-CB 3.47Å; L221-S225 PolarHBondContact O-N 3.34Å; L221-S225 PolarHBondContact O-OG 2.96Å; Q222-S225 PolarHBondContact O-N 3.33Å; Q222-S225 PolarHBondContact O-OG 2.95Å; H223-S225 VanDerWaalsContact C-N 3.31Å; H223-S225 PolarHBondContact O-N 2.76Å; S225-S227 PolarHBondContact O-N 3.42Å; S225-C231 PolarHBondContact O-SG 3.32Å; S225-N266 PolarHBondContact OG-ND2 3.35Å
226	T	91.6	Very high	93.5	Very high	70 Å²	70	32.9 Å²	32.9	43%	0.429	17%	0.166	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.7	-21.7	171.9	63.8	0	0	0	0	112.8	H223 L224 K270	H223-T226 WeakPolarHBondContact O-CB 3.33Å; H223-T226 WeakPolarHBondContact O-CG2 3.37Å; H223-T226 PolarHBondContact O-N 2.66Å; H223-T226 PolarHBondContact O-OG1 2.76Å; L224-T226 PolarHBondContact O-N 2.7Å; L224-T226 VanDerWaalsContact O-N 3.09Å; T226-K270 PolarHBondContact O-NZ 3.41Å
227	S	90.9	Very high	93.5	Very high	18 Å²	18	30.6 Å²	30.6	13%	0.126	16%	0.16	C	C	.	.	S	Bend	trans	-101	133.5	179.4	170.7	0	0	0	0	112.5	E192 L224 S225 A229 N230 C231	E192-S227 VanDerWaalsContact CD-OG 3.29Å; E192-S227 WeakPolarHBondContact OE1-CB 3.17Å; E192-S227 PolarHBondContact OE1-OG 2.87Å; L224-S227 PolarHBondContact O-N 3.19Å; S225-S227 PolarHBondContact O-N 3.42Å; S227-A229 VanDerWaalsContact C-N 3.33Å; S227-A229 PolarHBondContact O-N 3.23Å; S227-A229 PolarHBondContact OG-N 2.84Å; S227-N230 PolarHBondContact O-N 3.48Å; S227-C231 PolarHBondContact O-N 2.69Å; S227-C231 PolarHBondContact O-SG 3.39Å
228	E	92.1	Very high	93.5	Very high	138 Å²	138	34.8 Å²	34.8	65%	0.645	18%	0.179	S	C	*	.	H	α-helix	trans	-58.9	-39.7	176	174.6	172.9	-166.5	0	0	112.8	N230 C231 T232 K270	E228-N230 PolarHBondContact O-N 3.1Å; E228-C231 PolarHBondContact O-N 2.96Å; E228-T232 PolarHBondContact O-N 2.92Å; E228-T232 PolarHBondContact O-OG1 3.38Å; E228-K270 HydrophobicContact CB-CB 4.49Å; E228-K270 WeakPolarHBondContact CG-O 3.49Å
229	A	91.9	Very high	93.6	Very high	38 Å²	38	34.7 Å²	34.7	31%	0.314	18%	0.179	S	C	.	.	H	α-helix	trans	-64.7	-42.8	178.9	0	0	0	0	0	111.7	E192 S227 T232 L233	E192-A229 HydrophobicContact CB-CB 4.34Å; E192-A229 HydrophobicContact CG-CB 4.14Å; S227-A229 VanDerWaalsContact C-N 3.33Å; S227-A229 PolarHBondContact O-N 3.23Å; S227-A229 PolarHBondContact OG-N 2.84Å; A229-T232 PolarHBondContact O-N 3.34Å; A229-L233 WeakPolarHBondContact O-CG 3.48Å; A229-L233 PolarHBondContact O-N 2.87Å
230	N	93.5	Very high	93.6	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-67.1	-41.3	175.1	-78.9	-30.6	0	0	0	111.9	E192 A197 L224 S227 E228 T232 L233 M234	E192-N230 WeakPolarHBondContact CA-OD1 3.36Å; A197-N230 HydrophobicContact CB-CB 4.02Å; L224-N230 HydrophobicContact CB-CB 4.43Å; L224-N230 WeakPolarHBondContact O-CB 3.04Å; L224-N230 PolarHBondContact O-ND2 3.45Å; S227-N230 PolarHBondContact O-N 3.48Å; E228-N230 PolarHBondContact O-N 3.1Å; N230-T232 VanDerWaalsContact C-N 3.29Å; N230-T232 PolarHBondContact O-N 2.89Å; N230-L233 WeakPolarHBondContact O-CB 3.23Å; N230-L233 PolarHBondContact O-N 3.18Å; N230-L233 VanDerWaalsContact O-N 3.12Å; N230-M234 WeakPolarHBondContact O-CB 3.41Å; N230-M234 VanDerWaalsContact O-CG 3.24Å; N230-M234 WeakPolarHBondContact O-CG 3.5Å; N230-M234 PolarHBondContact O-N 3.36Å
231	C	94.7	Very high	93.6	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-58	-43.9	175.7	-67.1	0	0	0	0	111	S225 S227 E228 L233 M234 V235 L267 K270 S271	S225-C231 PolarHBondContact O-SG 3.32Å; S227-C231 PolarHBondContact O-N 2.69Å; S227-C231 PolarHBondContact O-SG 3.39Å; E228-C231 PolarHBondContact O-N 2.96Å; C231-L233 VanDerWaalsContact C-N 3.32Å; C231-L233 PolarHBondContact O-N 3.37Å; C231-M234 WeakPolarHBondContact O-CB 3.39Å; C231-M234 PolarHBondContact O-N 2.74Å; C231-M234 VanDerWaalsContact O-N 3.12Å; C231-V235 WeakPolarHBondContact O-CG2 3.29Å; C231-V235 PolarHBondContact O-N 3.38Å; C231-L267 HydrophobicContact CB-CD2 3.75Å; C231-K270 HydrophobicContact CB-CB 4.45Å; C231-S271 WeakPolarHBondContact CB-OG 3.23Å
232	T	93.8	Very high	93.5	Very high	52 Å²	52	37.3 Å²	37.3	32%	0.319	19%	0.19	S	C	.	.	H	α-helix	trans	-59.2	-41.9	175.5	-56.9	0	0	0	0	112	E228 A229 N230 K236 S271	E228-T232 PolarHBondContact O-N 2.92Å; E228-T232 PolarHBondContact O-OG1 3.38Å; A229-T232 PolarHBondContact O-N 3.34Å; N230-T232 VanDerWaalsContact C-N 3.29Å; N230-T232 PolarHBondContact O-N 2.89Å; T232-K236 WeakPolarHBondContact O-CG 3.49Å; T232-K236 PolarHBondContact O-N 3.48Å; T232-S271 PolarHBondContact N-OG 3.1Å
233	L	92.9	Very high	93.5	Very high	46 Å²	46	36.4 Å²	36.4	24%	0.241	19%	0.186	C	C	.	.	H	α-helix	trans	-67.7	-36.4	176.2	-68.9	171.6	0	0	0	112.7	E192 A229 N230 C231 S237	E192-L233 WeakPolarHBondContact O-CD1 3.3Å; A229-L233 WeakPolarHBondContact O-CG 3.48Å; A229-L233 PolarHBondContact O-N 2.87Å; N230-L233 WeakPolarHBondContact O-CB 3.23Å; N230-L233 PolarHBondContact O-N 3.18Å; N230-L233 VanDerWaalsContact O-N 3.12Å; C231-L233 VanDerWaalsContact C-N 3.32Å; C231-L233 PolarHBondContact O-N 3.37Å; L233-S237 WeakPolarHBondContact O-CB 3.49Å; L233-S237 PolarHBondContact O-N 3.02Å; L233-S237 PolarHBondContact O-OG 3.35Å
234	M	95.1	Very high	93.6	Very high	0 Å²	0	35 Å²	35	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-65.2	-47.7	175.4	-72	170	67.2	0	0	110.7	A197 I201 L221 N230 C231 K236 S237 Q238 A239 I263 L267	A197-M234 HydrophobicContact CB-CG 3.81Å; A197-M234 HydrophobicContact CB-SD 4.33Å; I201-M234 HydrophobicContact CD1-CE 4.11Å; I201-M234 HydrophobicContact CD1-CG 4.49Å; I201-M234 HydrophobicContact CG1-CB 4.39Å; I201-M234 HydrophobicContact CG1-CG 4.02Å; L221-M234 HydrophobicContact CB-CE 4.34Å; L221-M234 HydrophobicContact CD2-CE 4.09Å; L221-M234 HydrophobicContact CD2-SD 4.46Å; N230-M234 WeakPolarHBondContact O-CB 3.41Å; N230-M234 VanDerWaalsContact O-CG 3.24Å; N230-M234 WeakPolarHBondContact O-CG 3.5Å; N230-M234 PolarHBondContact O-N 3.36Å; C231-M234 WeakPolarHBondContact O-CB 3.39Å; C231-M234 PolarHBondContact O-N 2.74Å; C231-M234 VanDerWaalsContact O-N 3.12Å; M234-K236 PolarHBondContact O-N 2.77Å; M234-S237 CarbonylContact O-C 3.6Å; M234-S237 WeakPolarHBondContact O-CA 3.32Å; M234-S237 WeakPolarHBondContact O-CB 3.46Å; M234-S237 PolarHBondContact O-N 3.11Å; M234-Q238 PolarHBondContact O-N 3.25Å; M234-A239 HydrophobicContact CB-CB 3.66Å; M234-A239 HydrophobicContact CE-CB 4.46Å; M234-A239 WeakPolarHBondContact O-CB 3.5Å; M234-A239 PolarHBondContact O-N 3.15Å; M234-I263 HydrophobicContact CE-CG2 3.57Å; M234-L267 HydrophobicContact CB-CD2 3.94Å; M234-L267 HydrophobicContact CE-CD2 4.1Å; M234-L267 HydrophobicContact SD-CD2 4.3Å
235	V	94.6	Very high	93.6	Very high	1 Å²	1	35.8 Å²	35.8	1%	0.006	19%	0.186	C	C	.	.	H	α-helix	trans	-59.4	-47.1	176	176.7	0	0	0	0	110.5	C231 S237 Q238 L267 E275 I276 Q279	C231-V235 WeakPolarHBondContact O-CG2 3.29Å; C231-V235 PolarHBondContact O-N 3.38Å; V235-S237 PolarHBondContact O-N 3.25Å; V235-Q238 PolarHBondContact O-N 3.16Å; V235-L267 HydrophobicContact CG2-CD2 4.18Å; V235-E275 HydrophobicContact CG1-CB 3.87Å; V235-E275 VanDerWaalsContact CG1-OE2 3.28Å; V235-E275 WeakPolarHBondContact CG1-OE2 3.47Å; V235-I276 HydrophobicContact CG1-CG1 4.27Å; V235-I276 HydrophobicContact CG2-CD1 3.99Å; V235-I276 HydrophobicContact CG2-CG1 3.7Å; V235-Q279 PolarHBondContact O-NE2 3.48Å
236	K	93.1	Very high	93.4	Very high	148 Å²	148	37.8 Å²	37.8	64%	0.643	20%	0.195	S	C	*	.	H	α-helix	trans	-56.8	-23.8	173.7	-74.4	177	-179.1	179.3	0	113.8	T232 M234	T232-K236 WeakPolarHBondContact O-CG 3.49Å; T232-K236 PolarHBondContact O-N 3.48Å; M234-K236 PolarHBondContact O-N 2.77Å
237	S	92.6	Very high	93.4	Very high	14 Å²	14	34.6 Å²	34.6	10%	0.098	18%	0.175	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96.6	14.6	178.8	-51.5	0	0	0	0	113.4	K198 L233 M234 V235 A239 R242	K198-S237 VanDerWaalsContact CG-OG 3.29Å; K198-S237 WeakPolarHBondContact CG-OG 3.31Å; L233-S237 WeakPolarHBondContact O-CB 3.49Å; L233-S237 PolarHBondContact O-N 3.02Å; L233-S237 PolarHBondContact O-OG 3.35Å; M234-S237 CarbonylContact O-C 3.6Å; M234-S237 WeakPolarHBondContact O-CA 3.32Å; M234-S237 WeakPolarHBondContact O-CB 3.46Å; M234-S237 PolarHBondContact O-N 3.11Å; V235-S237 PolarHBondContact O-N 3.25Å; S237-A239 VanDerWaalsContact C-N 3.28Å; S237-A239 PolarHBondContact O-N 3.13Å; S237-R242 PolarHBondContact O-NE 3.49Å
238	Q	94.3	Very high	93.3	Very high	88 Å²	88	37.1 Å²	37.1	41%	0.411	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	59.9	34.8	-178.7	-60.8	-70.9	-45.7	0	0	112.9	M234 V235 A240 S241 R242 Q279	M234-Q238 PolarHBondContact O-N 3.25Å; V235-Q238 PolarHBondContact O-N 3.16Å; Q238-A240 VanDerWaalsContact C-N 3.33Å; Q238-A240 PolarHBondContact O-N 3.23Å; Q238-S241 PolarHBondContact O-OG 3.41Å; Q238-R242 WeakPolarHBondContact O-CB 3.21Å; Q238-R242 WeakPolarHBondContact O-CD 3.46Å; Q238-R242 WeakPolarHBondContact O-CG 3.39Å; Q238-R242 PolarHBondContact O-N 3.47Å; Q238-Q279 VanDerWaalsContact CA-OE1 3.31Å; Q238-Q279 VanDerWaalsContact OE1-CG 3.32Å
239	A	94.8	Very high	93.2	Very high	0 Å²	0	33 Å²	33	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-61.3	-39.2	-176.4	0	0	0	0	0	113.2	I201 M234 S237 R242 I243 L267	I201-A239 HydrophobicContact CD1-CB 3.43Å; I201-A239 VanDerWaalsContact CD1-CB 3.43Å; I201-A239 HydrophobicContact CG1-CB 3.85Å; I201-A239 HydrophobicContact CG2-CB 4.23Å; M234-A239 HydrophobicContact CB-CB 3.66Å; M234-A239 HydrophobicContact CE-CB 4.46Å; M234-A239 WeakPolarHBondContact O-CB 3.5Å; M234-A239 PolarHBondContact O-N 3.15Å; S237-A239 VanDerWaalsContact C-N 3.28Å; S237-A239 PolarHBondContact O-N 3.13Å; A239-R242 PolarHBondContact O-N 3.31Å; A239-I243 HydrophobicContact CB-CD1 4.44Å; A239-I243 WeakPolarHBondContact O-CB 3.28Å; A239-I243 VanDerWaalsContact O-CG1 3.26Å; A239-I243 WeakPolarHBondContact O-CG1 2.94Å; A239-I243 PolarHBondContact O-N 2.68Å; A239-L267 HydrophobicContact CB-CD1 4.17Å
240	A	95.5	Very high	92.9	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-64.1	-49.2	-174	0	0	0	0	0	111	Q238 C244 L264 L267 I276 Q279 L280	Q238-A240 VanDerWaalsContact C-N 3.33Å; Q238-A240 PolarHBondContact O-N 3.23Å; A240-C244 WeakPolarHBondContact O-CB 3.31Å; A240-C244 PolarHBondContact O-N 3.42Å; A240-L264 HydrophobicContact CB-CD2 4.19Å; A240-L267 HydrophobicContact CB-CD1 4.28Å; A240-I276 HydrophobicContact CB-CG2 3.98Å; A240-Q279 HydrophobicContact CB-CB 4.17Å; A240-L280 HydrophobicContact CB-CD1 4.48Å; A240-L280 HydrophobicContact CB-CD2 3.93Å; A240-L280 HydrophobicContact CB-CG 4.02Å; A240-L280 WeakPolarHBondContact O-CD2 3.19Å
241	S	94.8	Very high	92.7	Very high	20 Å²	20	38 Å²	38	14%	0.14	20%	0.198	C	C	.	.	H	α-helix	trans	-64.6	-45.4	177.6	56.2	0	0	0	0	112.1	Q238 I243 C244 A245 Q279 C285	Q238-S241 PolarHBondContact O-OG 3.41Å; S241-I243 PolarHBondContact O-N 3.41Å; S241-C244 PolarHBondContact O-N 2.79Å; S241-A245 WeakPolarHBondContact O-CB 3.33Å; S241-A245 PolarHBondContact O-N 3.02Å; S241-Q279 WeakPolarHBondContact CB-O 3.42Å; S241-C285 VanDerWaalsContact CA-SG 3.58Å; S241-C285 PolarHBondContact O-SG 2.99Å
242	R	92.8	Very high	92.2	Very high	97 Å²	97	44.1 Å²	44.1	37%	0.366	24%	0.237	S	C	.	.	H	α-helix	trans	-62.1	-42.2	-179.4	-70.5	172.5	-177.2	-136.7	-2.5	113.2	S237 Q238 A239 H246	S237-R242 PolarHBondContact O-NE 3.49Å; Q238-R242 WeakPolarHBondContact O-CB 3.21Å; Q238-R242 WeakPolarHBondContact O-CD 3.46Å; Q238-R242 WeakPolarHBondContact O-CG 3.39Å; Q238-R242 PolarHBondContact O-N 3.47Å; A239-R242 PolarHBondContact O-N 3.31Å; R242-H246 PolarHBondContact O-CD2 2.73Å; R242-H246 VanDerWaalsContact O-CD2 3.29Å
243	I	94.4	Very high	91.7	Very high	4 Å²	4	44.2 Å²	44.2	2%	0.021	24%	0.24	C	C	.	.	H	α-helix	trans	-72.8	-41.9	179.2	-68	171.5	0	0	0	110	I201 L221 A239 S241 H246 L247 I263 L264	I201-I243 HydrophobicContact CD1-CD1 3.95Å; L221-I243 HydrophobicContact CD1-CD1 4.44Å; A239-I243 HydrophobicContact CB-CD1 4.44Å; A239-I243 WeakPolarHBondContact O-CB 3.28Å; A239-I243 VanDerWaalsContact O-CG1 3.26Å; A239-I243 WeakPolarHBondContact O-CG1 2.94Å; A239-I243 PolarHBondContact O-N 2.68Å; S241-I243 PolarHBondContact O-N 3.41Å; I243-H246 PolarHBondContact O-N 3.25Å; I243-L247 PolarHBondContact O-N 3.46Å; I243-I263 HydrophobicContact CD1-CB 4.37Å; I243-I263 HydrophobicContact CD1-CD1 4.36Å; I243-I263 HydrophobicContact CD1-CG2 3.57Å; I243-L264 HydrophobicContact CB-CD2 4.49Å; I243-L264 HydrophobicContact CG2-CD2 4.47Å; I243-L264 HydrophobicContact CG2-CG 4.28Å
244	C	95.5	Very high	91.3	Very high	0 Å²	0	47.7 Å²	47.7	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-66.2	-41.6	-177.8	-172.7	0	0	0	0	113.1	A240 S241 H246 L247 L264 L280 C285 A288	A240-C244 WeakPolarHBondContact O-CB 3.31Å; A240-C244 PolarHBondContact O-N 3.42Å; S241-C244 PolarHBondContact O-N 2.79Å; C244-H246 PolarHBondContact O-N 3.22Å; C244-H246 VanDerWaalsContact O-N 3.09Å; C244-L247 WeakPolarHBondContact O-CB 3.47Å; C244-L247 PolarHBondContact O-N 2.93Å; C244-L264 HydrophobicContact CB-CD1 4.11Å; C244-L264 HydrophobicContact CB-CD2 4.44Å; C244-L280 HydrophobicContact CB-CD2 3.52Å; C244-C285 HydrophobicContact CB-CB 4.15Å; C244-A288 WeakPolarHBondContact O-CB 3.24Å
245	A	92.1	Very high	91	Very high	17 Å²	17	51.5 Å²	51.5	14%	0.14	27%	0.273	C	S	.	.	H	α-helix	trans	-54.5	-31.8	177.8	0	0	0	0	0	113.2	S241 E284	S241-A245 WeakPolarHBondContact O-CB 3.33Å; S241-A245 PolarHBondContact O-N 3.02Å; A245-E284 HydrophobicContact CB-CG 3.78Å
246	H	90	Very high	90.9	Very high	42 Å²	42	51.5 Å²	51.5	19%	0.194	27%	0.273	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.5	9.3	-178.4	-71	-65.2	0	0	0	114.3	K214 R242 I243 C244 N248 D249 L256	K214-H246 VanDerWaalsContact NZ-CB 3.32Å; K214-H246 VanDerWaalsContact NZ-CG 3.33Å; R242-H246 PolarHBondContact O-CD2 2.73Å; R242-H246 VanDerWaalsContact O-CD2 3.29Å; I243-H246 PolarHBondContact O-N 3.25Å; C244-H246 PolarHBondContact O-N 3.22Å; C244-H246 VanDerWaalsContact O-N 3.09Å; H246-N248 PolarHBondContact O-N 2.89Å; H246-D249 WeakPolarHBondContact CB-OD2 3.39Å; H246-D249 IonicContact CG-OD2 2.75Å; H246-D249 IonicContact ND1-OD1 3.15Å; H246-D249 PolarHBondContact ND1-OD1 2.85Å; H246-D249 IonicContact ND1-OD2 3.98Å; H246-D249 PolarHBondContact ND1-OD2 3.12Å; H246-D249 VanDerWaalsContact ND1-OD2 3.11Å; H246-D249 WeakPolarHBondContact O-CB 3.24Å; H246-D249 PolarHBondContact O-N 3.46Å; H246-D249 VanDerWaalsContact O-N 3.12Å; H246-L256 VanDerWaalsContact O-CD2 3.31Å; H246-L256 WeakPolarHBondContact O-CD2 3.48Å
247	L	91.6	Very high	90.8	Very high	3 Å²	3	45.8 Å²	45.8	2%	0.016	25%	0.25	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.7	-28.1	-174.9	-165.7	71.8	0	0	0	113	I243 C244 L257 S260 A288 L289 V292 I312	I243-L247 PolarHBondContact O-N 3.46Å; C244-L247 WeakPolarHBondContact O-CB 3.47Å; C244-L247 PolarHBondContact O-N 2.93Å; L247-L257 HydrophobicContact CD1-CD1 3.69Å; L247-L257 HydrophobicContact CD2-CD1 4.1Å; L247-L257 HydrophobicContact CG-CD1 3.58Å; L247-S260 VanDerWaalsContact CD1-CB 3.42Å; L247-A288 HydrophobicContact CB-CB 4.4Å; L247-L289 HydrophobicContact CD2-CD2 3.7Å; L247-V292 HydrophobicContact CB-CG2 4.28Å; L247-V292 HydrophobicContact CD2-CB 4.23Å; L247-V292 HydrophobicContact CD2-CG1 4.12Å; L247-V292 HydrophobicContact CD2-CG2 4Å; L247-V292 HydrophobicContact CG-CG2 3.94Å; L247-I312 HydrophobicContact CD2-CD1 3.85Å
248	N	89.8	Confident	90.8	Very high	72 Å²	72	48.4 Å²	48.4	39%	0.385	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.7	11	-178.9	-163.3	44.3	0	0	0	113.4	H246 V292	H246-N248 PolarHBondContact O-N 2.89Å; N248-V292 HydrophobicContact CB-CG2 3.81Å
249	D	89.8	Confident	90.8	Very high	52 Å²	52	45.6 Å²	45.6	28%	0.278	25%	0.245	S	C	.	.	S	Bend	trans	-62.4	144	177.1	-76.5	-1.5	0	0	0	110.9	K214 H246 D251 L256	K214-D249 IonicContact NZ-OD2 2.68Å; K214-D249 PolarHBondContact NZ-OD2 2.66Å; H246-D249 WeakPolarHBondContact CB-OD2 3.39Å; H246-D249 IonicContact CG-OD2 2.75Å; H246-D249 IonicContact ND1-OD1 3.15Å; H246-D249 PolarHBondContact ND1-OD1 2.85Å; H246-D249 IonicContact ND1-OD2 3.98Å; H246-D249 PolarHBondContact ND1-OD2 3.12Å; H246-D249 VanDerWaalsContact ND1-OD2 3.11Å; H246-D249 WeakPolarHBondContact O-CB 3.24Å; H246-D249 PolarHBondContact O-N 3.46Å; H246-D249 VanDerWaalsContact O-N 3.12Å; D249-D251 PolarHBondContact O-N 3.17Å; D249-D251 VanDerWaalsContact O-N 3.17Å; D249-L256 HydrophobicContact CB-CD1 3.97Å; D249-L256 HydrophobicContact CB-CD2 4.46Å
250	P	86	Confident	90.8	Very high	119 Å²	119	45.8 Å²	45.8	77%	0.773	25%	0.246	S	C	*	.			trans	-67.3	116.1	-176.5	26.6	-33.8	0	0	0	111.9
251	D	88.1	Confident	90.7	Very high	24 Å²	24	46 Å²	46	13%	0.128	25%	0.248	C	C	.	.			trans	-137.5	107.5	175	176	18	0	0	0	110.9	L211 D249 S253 E254 Q255 L256	L211-D251 HydrophobicContact CD1-CB 4.13Å; L211-D251 HydrophobicContact CD2-CB 4.42Å; D249-D251 PolarHBondContact O-N 3.17Å; D249-D251 VanDerWaalsContact O-N 3.17Å; D251-S253 VanDerWaalsContact CG-OG 3.23Å; D251-S253 PolarHBondContact O-N 2.9Å; D251-S253 VanDerWaalsContact O-N 3.15Å; D251-S253 WeakPolarHBondContact OD1-CB 3.48Å; D251-S253 PolarHBondContact OD1-N 3.38Å; D251-S253 PolarHBondContact OD1-OG 3.38Å; D251-S253 PolarHBondContact OD2-OG 2.91Å; D251-E254 PolarHBondContact O-N 3.06Å; D251-E254 PolarHBondContact OD2-N 3.41Å; D251-Q255 PolarHBondContact OD2-N 3.26Å; D251-L256 HydrophobicContact CB-CB 3.84Å; D251-L256 WeakPolarHBondContact OD2-CB 3.31Å; D251-L256 PolarHBondContact OD2-N 3.3Å
252	P	83.9	Confident	90.7	Very high	127 Å²	127	48.1 Å²	48.1	83%	0.825	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.2	-18.1	176.2	-21.8	32.8	0	0	0	114.5
253	S	84.8	Confident	90.9	Very high	54 Å²	54	43.5 Å²	43.5	38%	0.378	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.3	-10	-179.2	76.9	0	0	0	0	114	D251 Q255	D251-S253 VanDerWaalsContact CG-OG 3.23Å; D251-S253 PolarHBondContact O-N 2.9Å; D251-S253 VanDerWaalsContact O-N 3.15Å; D251-S253 WeakPolarHBondContact OD1-CB 3.48Å; D251-S253 PolarHBondContact OD1-N 3.38Å; D251-S253 PolarHBondContact OD1-OG 3.38Å; D251-S253 PolarHBondContact OD2-OG 2.91Å; S253-Q255 PolarHBondContact O-N 3.4Å
254	E	84.2	Confident	91	Very high	119 Å²	119	43.4 Å²	43.4	56%	0.556	24%	0.237	S	C	*	.	S	Bend	trans	57.6	6	-176.1	-57.6	177.4	176.3	0	0	115.1	D251 L256 F258	D251-E254 PolarHBondContact O-N 3.06Å; D251-E254 PolarHBondContact OD2-N 3.41Å; E254-L256 VanDerWaalsContact C-N 3.3Å; E254-L256 PolarHBondContact O-N 3.26Å; E254-F258 PolarHBondContact O-N 2.99Å
255	Q	88.8	Confident	91	Very high	80 Å²	80	48.2 Å²	48.2	37%	0.374	26%	0.256	S	S	.	.	H	α-helix	trans	-69.4	-31	-179.5	-67.9	-174.9	22.2	0	0	112	L215 D251 S253 R259	L215-Q255 HydrophobicContact CD2-CB 3.78Å; D251-Q255 PolarHBondContact OD2-N 3.26Å; S253-Q255 PolarHBondContact O-N 3.4Å; Q255-R259 WeakPolarHBondContact O-CB 3.38Å; Q255-R259 WeakPolarHBondContact O-CG 3.37Å; Q255-R259 PolarHBondContact O-N 2.88Å
256	L	91.6	Very high	91.2	Very high	2 Å²	2	48.2 Å²	48.2	1%	0.01	25%	0.253	C	S	.	.	H	α-helix	trans	-60.9	-54.2	179.3	-175.4	149.9	0	0	0	110.2	L211 K214 L215 L218 H246 D249 D251 E254 S260	L211-L256 HydrophobicContact CD1-CD1 3.98Å; K214-L256 HydrophobicContact CD-CD1 4.16Å; L215-L256 HydrophobicContact CD2-CB 3.77Å; L218-L256 HydrophobicContact CD1-CG 4Å; H246-L256 VanDerWaalsContact O-CD2 3.31Å; H246-L256 WeakPolarHBondContact O-CD2 3.48Å; D249-L256 HydrophobicContact CB-CD1 3.97Å; D249-L256 HydrophobicContact CB-CD2 4.46Å; D251-L256 HydrophobicContact CB-CB 3.84Å; D251-L256 WeakPolarHBondContact OD2-CB 3.31Å; D251-L256 PolarHBondContact OD2-N 3.3Å; E254-L256 VanDerWaalsContact C-N 3.3Å; E254-L256 PolarHBondContact O-N 3.26Å; L256-S260 WeakPolarHBondContact O-CB 3.5Å; L256-S260 PolarHBondContact O-N 3.27Å; L256-S260 PolarHBondContact O-OG 3.3Å
257	L	92	Very high	91.5	Very high	28 Å²	28	46.2 Å²	46.2	15%	0.147	24%	0.244	C	C	.	.	H	α-helix	trans	-60.1	-50.5	-178	172.9	59	0	0	0	110	L247 S260 S261 V292 L296 L308	L247-L257 HydrophobicContact CD1-CD1 3.69Å; L247-L257 HydrophobicContact CD2-CD1 4.1Å; L247-L257 HydrophobicContact CG-CD1 3.58Å; L257-S260 PolarHBondContact O-N 3.26Å; L257-S261 WeakPolarHBondContact O-CB 3.27Å; L257-S261 PolarHBondContact O-N 3.47Å; L257-S261 PolarHBondContact O-OG 3.42Å; L257-S261 VanDerWaalsContact O-OG 3.05Å; L257-V292 HydrophobicContact CD1-CB 4.48Å; L257-V292 HydrophobicContact CD1-CG1 3.44Å; L257-V292 VanDerWaalsContact CD1-CG1 3.44Å; L257-V292 HydrophobicContact CD1-CG2 4.19Å; L257-V292 HydrophobicContact CD2-CG1 4.11Å; L257-V292 HydrophobicContact CG-CG1 4.43Å; L257-L296 HydrophobicContact CD2-CD1 4.26Å; L257-L296 HydrophobicContact CD2-CD2 4.13Å; L257-L296 HydrophobicContact CD2-CG 4.43Å; L257-L308 HydrophobicContact CD2-CD2 3.73Å; L257-L308 HydrophobicContact CG-CD2 3.75Å
258	F	91.8	Very high	91.6	Very high	68 Å²	68	46.5 Å²	46.5	30%	0.298	25%	0.246	S	C	.	.	H	α-helix	trans	-58.5	-54.1	-179.3	174.1	-120.7	0	0	0	113.8	E254 S260 S261 E262 Y304	E254-F258 PolarHBondContact O-N 2.99Å; F258-S260 VanDerWaalsContact C-N 3.27Å; F258-S260 PolarHBondContact O-N 3.44Å; F258-S261 PolarHBondContact O-N 2.97Å; F258-E262 PolarHBondContact O-N 3.27Å; F258-Y304 WeakPolarHBondContact CB-OH 3.46Å; F258-Y304 VanDerWaalsContact CD1-OH 3.31Å; F258-Y304 WeakPolarHBondContact CD1-OH 3.37Å; F258-Y304 HydrophobicContact CD2-CE1 4.27Å; F258-Y304 AromaticContact CD2-CE2 3.78Å; F258-Y304 HydrophobicContact CD2-CE2 3.78Å; F258-Y304 AromaticContact CD2-CZ 3.32Å; F258-Y304 WeakPolarHBondContact CD2-OH 3.24Å; F258-Y304 AromaticContact CE2-CE2 3.61Å; F258-Y304 HydrophobicContact CE2-CE2 3.61Å; F258-Y304 AromaticContact CE2-CZ 3.66Å; F258-Y304 VanDerWaalsContact CE2-OH 3.23Å; F258-Y304 WeakPolarHBondContact CE2-OH 3.41Å; F258-Y304 AromaticContact CG-CZ 3.76Å; F258-Y304 WeakPolarHBondContact CG-OH 3.41Å; F258-Y304 HydrophobicContact CZ-CE2 4.28Å
259	R	93.9	Very high	91.8	Very high	29 Å²	29	49.1 Å²	49.1	11%	0.109	26%	0.256	C	S	.	.	H	α-helix	trans	-63.7	-38.6	-177.3	-70.4	-178.1	179.3	140.1	20.2	111.1	L215 L218 Q255 E262 I263	L215-R259 PolarHBondContact O-NH1 3.33Å; L218-R259 HydrophobicContact CB-CB 4.09Å; Q255-R259 WeakPolarHBondContact O-CB 3.38Å; Q255-R259 WeakPolarHBondContact O-CG 3.37Å; Q255-R259 PolarHBondContact O-N 2.88Å; R259-E262 PolarHBondContact O-N 3.41Å; R259-I263 VanDerWaalsContact O-CD1 3.29Å; R259-I263 WeakPolarHBondContact O-CD1 3.32Å; R259-I263 WeakPolarHBondContact O-CG1 3.33Å; R259-I263 PolarHBondContact O-N 3.19Å
260	S	95.2	Very high	91.9	Very high	4 Å²	4	49.6 Å²	49.6	3%	0.028	26%	0.255	C	S	.	.	H	α-helix	trans	-63.5	-45.8	177.8	-60.5	0	0	0	0	111.4	L247 L256 L257 F258 E262 I263 L264	L247-S260 VanDerWaalsContact CD1-CB 3.42Å; L256-S260 WeakPolarHBondContact O-CB 3.5Å; L256-S260 PolarHBondContact O-N 3.27Å; L256-S260 PolarHBondContact O-OG 3.3Å; L257-S260 PolarHBondContact O-N 3.26Å; F258-S260 VanDerWaalsContact C-N 3.27Å; F258-S260 PolarHBondContact O-N 3.44Å; S260-E262 PolarHBondContact O-N 3.37Å; S260-I263 PolarHBondContact O-N 3.01Å; S260-L264 VanDerWaalsContact O-CG 3.32Å; S260-L264 WeakPolarHBondContact O-CG 3.45Å; S260-L264 PolarHBondContact O-N 3.22Å
261	S	94.4	Very high	92.2	Very high	6 Å²	6	45 Å²	45	4%	0.042	23%	0.226	C	C	.	.	H	α-helix	trans	-61.3	-43.4	176.2	-64.4	0	0	0	0	112.6	L257 F258 L264 W265 I312	L257-S261 WeakPolarHBondContact O-CB 3.27Å; L257-S261 PolarHBondContact O-N 3.47Å; L257-S261 PolarHBondContact O-OG 3.42Å; L257-S261 VanDerWaalsContact O-OG 3.05Å; F258-S261 PolarHBondContact O-N 2.97Å; S261-L264 PolarHBondContact O-N 3.44Å; S261-W265 WeakPolarHBondContact O-CB 2.96Å; S261-W265 PolarHBondContact O-N 3.02Å; S261-I312 WeakPolarHBondContact OG-CD1 3.47Å
262	E	95.1	Very high	92.3	Very high	64 Å²	64	45.9 Å²	45.9	30%	0.299	23%	0.234	S	C	.	.	H	α-helix	trans	-66	-39.2	177.3	-168.6	-177.2	141.2	0	0	112.1	Q222 F258 R259 S260 W265 N266	Q222-E262 PolarHBondContact NE2-OE1 2.84Å; Q222-E262 PolarHBondContact NE2-OE2 3.46Å; F258-E262 PolarHBondContact O-N 3.27Å; R259-E262 PolarHBondContact O-N 3.41Å; S260-E262 PolarHBondContact O-N 3.37Å; E262-W265 PolarHBondContact O-N 3.32Å; E262-N266 WeakPolarHBondContact O-CB 3.4Å; E262-N266 PolarHBondContact O-N 3.28Å; E262-N266 PolarHBondContact O-ND2 3.46Å
263	I	96.3	Very high	92.7	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-62.2	-48.1	174	-67	158.6	0	0	0	110.3	L218 L221 Q222 M234 I243 R259 S260 W265 N266 L267	L218-I263 HydrophobicContact CD2-CD1 3.94Å; L221-I263 HydrophobicContact CB-CD1 3.7Å; L221-I263 HydrophobicContact CB-CG1 4.39Å; Q222-I263 HydrophobicContact CB-CD1 4.49Å; Q222-I263 HydrophobicContact CB-CG1 4.2Å; M234-I263 HydrophobicContact CE-CG2 3.57Å; I243-I263 HydrophobicContact CD1-CB 4.37Å; I243-I263 HydrophobicContact CD1-CD1 4.36Å; I243-I263 HydrophobicContact CD1-CG2 3.57Å; R259-I263 VanDerWaalsContact O-CD1 3.29Å; R259-I263 WeakPolarHBondContact O-CD1 3.32Å; R259-I263 WeakPolarHBondContact O-CG1 3.33Å; R259-I263 PolarHBondContact O-N 3.19Å; S260-I263 PolarHBondContact O-N 3.01Å; I263-W265 VanDerWaalsContact C-N 3.27Å; I263-W265 PolarHBondContact O-N 2.89Å; I263-N266 PolarHBondContact O-N 3.07Å; I263-L267 HydrophobicContact CG2-CD1 4.22Å; I263-L267 HydrophobicContact CG2-CG 4.33Å; I263-L267 VanDerWaalsContact O-CG 3.3Å; I263-L267 WeakPolarHBondContact O-CG 3.2Å; I263-L267 PolarHBondContact O-N 3.12Å
264	L	96.4	Very high	93.1	Very high	1 Å²	1	49.5 Å²	49.5	1%	0.005	23%	0.232	C	C	.	.	H	α-helix	trans	-59.1	-40.5	178.1	-70.6	175	0	0	0	111.6	A240 I243 C244 S260 S261 L267 L268 L280 I315	A240-L264 HydrophobicContact CB-CD2 4.19Å; I243-L264 HydrophobicContact CB-CD2 4.49Å; I243-L264 HydrophobicContact CG2-CD2 4.47Å; I243-L264 HydrophobicContact CG2-CG 4.28Å; C244-L264 HydrophobicContact CB-CD1 4.11Å; C244-L264 HydrophobicContact CB-CD2 4.44Å; S260-L264 VanDerWaalsContact O-CG 3.32Å; S260-L264 WeakPolarHBondContact O-CG 3.45Å; S260-L264 PolarHBondContact O-N 3.22Å; S261-L264 PolarHBondContact O-N 3.44Å; L264-L267 PolarHBondContact O-N 2.94Å; L264-L268 WeakPolarHBondContact O-CG 3.35Å; L264-L268 PolarHBondContact O-N 2.98Å; L264-L280 HydrophobicContact CD2-CD2 4.27Å; L264-I315 HydrophobicContact CB-CD1 4.26Å
265	W	95.5	Very high	93.6	Very high	101 Å²	101	48.1 Å²	48.1	38%	0.383	23%	0.226	S	C	.	.	H	α-helix	trans	-61.7	-49.9	174.6	-172.2	-87.4	0	0	0	112.2	S261 E262 I263 L267 L268 E269 V314 I315	S261-W265 WeakPolarHBondContact O-CB 2.96Å; S261-W265 PolarHBondContact O-N 3.02Å; E262-W265 PolarHBondContact O-N 3.32Å; I263-W265 VanDerWaalsContact C-N 3.27Å; I263-W265 PolarHBondContact O-N 2.89Å; W265-L267 VanDerWaalsContact C-N 3.28Å; W265-L267 PolarHBondContact O-N 2.98Å; W265-L268 PolarHBondContact O-N 3.22Å; W265-L268 VanDerWaalsContact O-N 3.09Å; W265-E269 PolarHBondContact O-N 3.13Å; W265-V314 HydrophobicContact CH2-CG1 3.98Å; W265-V314 HydrophobicContact CZ3-CB 4.17Å; W265-V314 HydrophobicContact CZ3-CG1 3.7Å; W265-I315 HydrophobicContact CE3-CG1 4.37Å
266	N	96.1	Very high	93.9	Very high	17 Å²	17	44.3 Å²	44.3	9%	0.091	21%	0.208	C	C	.	.	H	α-helix	trans	-59.4	-39.1	178.2	-75.6	-26.6	0	0	0	112.1	S225 E262 I263 E269 K270	S225-N266 PolarHBondContact OG-ND2 3.35Å; E262-N266 WeakPolarHBondContact O-CB 3.4Å; E262-N266 PolarHBondContact O-N 3.28Å; E262-N266 PolarHBondContact O-ND2 3.46Å; I263-N266 PolarHBondContact O-N 3.07Å; N266-E269 PolarHBondContact O-N 2.87Å; N266-K270 WeakPolarHBondContact O-CB 3.29Å; N266-K270 PolarHBondContact O-N 2.63Å
267	L	96.1	Very high	94	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-61.3	-48.4	174.1	-67.2	179	0	0	0	110.8	C231 M234 V235 A239 A240 I263 L264 W265 E269 K270 S271 I276	C231-L267 HydrophobicContact CB-CD2 3.75Å; M234-L267 HydrophobicContact CB-CD2 3.94Å; M234-L267 HydrophobicContact CE-CD2 4.1Å; M234-L267 HydrophobicContact SD-CD2 4.3Å; V235-L267 HydrophobicContact CG2-CD2 4.18Å; A239-L267 HydrophobicContact CB-CD1 4.17Å; A240-L267 HydrophobicContact CB-CD1 4.28Å; I263-L267 HydrophobicContact CG2-CD1 4.22Å; I263-L267 HydrophobicContact CG2-CG 4.33Å; I263-L267 VanDerWaalsContact O-CG 3.3Å; I263-L267 WeakPolarHBondContact O-CG 3.2Å; I263-L267 PolarHBondContact O-N 3.12Å; L264-L267 PolarHBondContact O-N 2.94Å; W265-L267 VanDerWaalsContact C-N 3.28Å; W265-L267 PolarHBondContact O-N 2.98Å; L267-E269 VanDerWaalsContact C-N 3.27Å; L267-E269 PolarHBondContact O-N 3.33Å; L267-K270 PolarHBondContact O-N 3.08Å; L267-S271 WeakPolarHBondContact O-CB 3.23Å; L267-S271 PolarHBondContact O-N 2.88Å; L267-S271 VanDerWaalsContact O-N 3.16Å; L267-I276 HydrophobicContact CB-CD1 3.86Å; L267-I276 WeakPolarHBondContact O-CD1 3.21Å
268	L	93.8	Very high	94.1	Very high	10 Å²	10	51.2 Å²	51.2	5%	0.052	24%	0.24	C	C	.	.	H	α-helix	trans	-63	-30.3	179.7	-76.3	168.2	0	0	0	113.5	L264 W265 K273 I276 I315 I318	L264-L268 WeakPolarHBondContact O-CG 3.35Å; L264-L268 PolarHBondContact O-N 2.98Å; W265-L268 PolarHBondContact O-N 3.22Å; W265-L268 VanDerWaalsContact O-N 3.09Å; L268-K273 WeakPolarHBondContact O-CE 3.3Å; L268-I276 HydrophobicContact CD2-CB 4.17Å; L268-I276 HydrophobicContact CD2-CG2 3.55Å; L268-I276 HydrophobicContact CG-CG2 4.07Å; L268-I315 HydrophobicContact CD1-CB 4.48Å; L268-I315 HydrophobicContact CD1-CG1 3.92Å; L268-I315 HydrophobicContact CD1-CG2 4.27Å; L268-I318 HydrophobicContact CD1-CD1 4.31Å; L268-I318 HydrophobicContact CD2-CG2 4.24Å
269	E	93.5	Very high	94.3	Very high	127 Å²	127	48.7 Å²	48.7	59%	0.593	23%	0.229	S	C	*	.	H	α-helix	trans	-81.7	-38.2	179.6	-172.6	178.6	-168.7	0	0	112.8	W265 N266 L267	W265-E269 PolarHBondContact O-N 3.13Å; N266-E269 PolarHBondContact O-N 2.87Å; L267-E269 VanDerWaalsContact C-N 3.27Å; L267-E269 PolarHBondContact O-N 3.33Å
270	K	92.5	Very high	94.4	Very high	61 Å²	61	47.4 Å²	47.4	27%	0.265	22%	0.224	S	C	.	.	H	α-helix	trans	-115.1	17.3	-166	-59.3	175.6	-179.1	171.1	0	114.3	T226 E228 C231 N266 L267	T226-K270 PolarHBondContact O-NZ 3.41Å; E228-K270 HydrophobicContact CB-CB 4.49Å; E228-K270 WeakPolarHBondContact CG-O 3.49Å; C231-K270 HydrophobicContact CB-CB 4.45Å; N266-K270 WeakPolarHBondContact O-CB 3.29Å; N266-K270 PolarHBondContact O-N 2.63Å; L267-K270 PolarHBondContact O-N 3.08Å
271	S	91.6	Very high	94.4	Very high	22 Å²	22	48.1 Å²	48.1	15%	0.154	23%	0.229	C	C	.	.	S	Bend	trans	-149.5	179.2	178.2	-72.6	0	0	0	0	111.3	C231 T232 L267 K273	C231-S271 WeakPolarHBondContact CB-OG 3.23Å; T232-S271 PolarHBondContact N-OG 3.1Å; L267-S271 WeakPolarHBondContact O-CB 3.23Å; L267-S271 PolarHBondContact O-N 2.88Å; L267-S271 VanDerWaalsContact O-N 3.16Å; S271-K273 PolarHBondContact O-N 3.3Å; S271-K273 VanDerWaalsContact O-N 3.14Å
272	S	91.9	Very high	94.4	Very high	44 Å²	44	50 Å²	50	31%	0.308	24%	0.239	S	C	.	.			trans	-61.8	117.5	177.6	168.5	0	0	0	0	110.5	E274 E275 I276	S272-E274 VanDerWaalsContact C-N 3.27Å; S272-E274 PolarHBondContact O-N 2.91Å; S272-E274 PolarHBondContact OG-N 3.34Å; S272-E274 PolarHBondContact OG-OE2 3Å; S272-E275 PolarHBondContact OG-N 3.46Å; S272-I276 WeakPolarHBondContact O-CD1 3.37Å; S272-I276 WeakPolarHBondContact O-CG1 3.45Å; S272-I276 PolarHBondContact O-N 3.29Å
273	K	92.1	Very high	94.4	Very high	115 Å²	115	51 Å²	51	50%	0.5	25%	0.246	S	C	.	.	H	α-helix	trans	-63.5	-37.6	177.2	-69	-178.9	-179.9	179	0	110.8	L268 S271 I276 I277	L268-K273 WeakPolarHBondContact O-CE 3.3Å; S271-K273 PolarHBondContact O-N 3.3Å; S271-K273 VanDerWaalsContact O-N 3.14Å; K273-I276 PolarHBondContact O-N 3.32Å; K273-I277 HydrophobicContact CB-CD1 4.47Å; K273-I277 WeakPolarHBondContact O-CB 3.34Å; K273-I277 WeakPolarHBondContact O-CD1 3.35Å; K273-I277 WeakPolarHBondContact O-CG1 3.4Å; K273-I277 PolarHBondContact O-N 2.94Å
274	E	92.6	Very high	94.4	Very high	141 Å²	141	57 Å²	57	66%	0.659	27%	0.274	S	S	*	.	H	α-helix	trans	-61.8	-48.7	-179.2	-59.2	73.4	-158.1	0	0	111.4	S272 I276 I277 Q278	S272-E274 VanDerWaalsContact C-N 3.27Å; S272-E274 PolarHBondContact O-N 2.91Å; S272-E274 PolarHBondContact OG-N 3.34Å; S272-E274 PolarHBondContact OG-OE2 3Å; E274-I276 PolarHBondContact O-N 2.97Å; E274-I277 PolarHBondContact O-N 3.34Å; E274-Q278 WeakPolarHBondContact O-CB 3.41Å; E274-Q278 PolarHBondContact O-N 2.81Å
275	E	93.7	Very high	94.4	Very high	90 Å²	90	56.9 Å²	56.9	42%	0.421	27%	0.273	S	S	.	.	H	α-helix	trans	-62.4	-42.3	177.3	-71.6	-173.3	-173.8	0	0	111.7	V235 S272 Q278 Q279	V235-E275 HydrophobicContact CG1-CB 3.87Å; V235-E275 VanDerWaalsContact CG1-OE2 3.28Å; V235-E275 WeakPolarHBondContact CG1-OE2 3.47Å; S272-E275 PolarHBondContact OG-N 3.46Å; E275-Q278 PolarHBondContact O-N 2.89Å; E275-Q279 WeakPolarHBondContact O-CG 3.46Å; E275-Q279 PolarHBondContact O-N 3.28Å
276	I	94.9	Very high	94.5	Very high	0 Å²	0	52.1 Å²	52.1	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-67.3	-44.5	-179.5	-66.3	163.8	0	0	0	111.1	V235 A240 L267 L268 S272 K273 E274 Q278 Q279 L280	V235-I276 HydrophobicContact CG1-CG1 4.27Å; V235-I276 HydrophobicContact CG2-CD1 3.99Å; V235-I276 HydrophobicContact CG2-CG1 3.7Å; A240-I276 HydrophobicContact CB-CG2 3.98Å; L267-I276 HydrophobicContact CB-CD1 3.86Å; L267-I276 WeakPolarHBondContact O-CD1 3.21Å; L268-I276 HydrophobicContact CD2-CB 4.17Å; L268-I276 HydrophobicContact CD2-CG2 3.55Å; L268-I276 HydrophobicContact CG-CG2 4.07Å; S272-I276 WeakPolarHBondContact O-CD1 3.37Å; S272-I276 WeakPolarHBondContact O-CG1 3.45Å; S272-I276 PolarHBondContact O-N 3.29Å; K273-I276 PolarHBondContact O-N 3.32Å; E274-I276 PolarHBondContact O-N 2.97Å; I276-Q278 VanDerWaalsContact C-N 3.26Å; I276-Q278 PolarHBondContact O-N 3.22Å; I276-Q279 PolarHBondContact O-N 2.86Å; I276-Q279 VanDerWaalsContact O-N 3.14Å; I276-L280 HydrophobicContact CG2-CD1 3.65Å; I276-L280 HydrophobicContact CG2-CG 4.22Å; I276-L280 WeakPolarHBondContact O-CG 3.43Å; I276-L280 PolarHBondContact O-N 3.48Å
277	I	94.7	Very high	94.5	Very high	25 Å²	25	54.6 Å²	54.6	13%	0.128	27%	0.268	C	S	.	.	H	α-helix	trans	-58.2	-43.9	175.6	-71.6	165.4	0	0	0	109.5	K273 E274 Q279 L280 S281 I318 N322	K273-I277 HydrophobicContact CB-CD1 4.47Å; K273-I277 WeakPolarHBondContact O-CB 3.34Å; K273-I277 WeakPolarHBondContact O-CD1 3.35Å; K273-I277 WeakPolarHBondContact O-CG1 3.4Å; K273-I277 PolarHBondContact O-N 2.94Å; E274-I277 PolarHBondContact O-N 3.34Å; I277-Q279 VanDerWaalsContact C-N 3.33Å; I277-Q279 PolarHBondContact O-N 3.44Å; I277-L280 PolarHBondContact O-N 3.31Å; I277-S281 VanDerWaalsContact O-CB 3.24Å; I277-S281 WeakPolarHBondContact O-CB 3.28Å; I277-S281 PolarHBondContact O-N 2.8Å; I277-S281 PolarHBondContact O-OG 3.46Å; I277-I318 HydrophobicContact CD1-CG2 3.75Å; I277-I318 HydrophobicContact CG1-CG2 3.9Å; I277-N322 HydrophobicContact CG2-CB 3.51Å
278	Q	94.1	Very high	94.5	Very high	151 Å²	151	55 Å²	55	71%	0.706	27%	0.271	S	S	*	.	H	α-helix	trans	-60.5	-41.1	176.6	-170.4	178.2	14.9	0	0	112.3	E274 E275 I276	E274-Q278 WeakPolarHBondContact O-CB 3.41Å; E274-Q278 PolarHBondContact O-N 2.81Å; E275-Q278 PolarHBondContact O-N 2.89Å; I276-Q278 VanDerWaalsContact C-N 3.26Å; I276-Q278 PolarHBondContact O-N 3.22Å
279	Q	95.2	Very high	94.7	Very high	15 Å²	15	54.5 Å²	54.5	7%	0.07	27%	0.269	C	S	.	.	H	α-helix	trans	-65.2	-41.8	176.1	-68.3	-175.6	20.3	0	0	112.5	V235 Q238 A240 S241 E275 I276 I277 N282	V235-Q279 PolarHBondContact O-NE2 3.48Å; Q238-Q279 VanDerWaalsContact CA-OE1 3.31Å; Q238-Q279 VanDerWaalsContact OE1-CG 3.32Å; A240-Q279 HydrophobicContact CB-CB 4.17Å; S241-Q279 WeakPolarHBondContact CB-O 3.42Å; E275-Q279 WeakPolarHBondContact O-CG 3.46Å; E275-Q279 PolarHBondContact O-N 3.28Å; I276-Q279 PolarHBondContact O-N 2.86Å; I276-Q279 VanDerWaalsContact O-N 3.14Å; I277-Q279 VanDerWaalsContact C-N 3.33Å; I277-Q279 PolarHBondContact O-N 3.44Å; Q279-N282 PolarHBondContact O-ND2 3.38Å
280	L	96.1	Very high	94.9	Very high	1 Å²	1	49.8 Å²	49.8	1%	0.005	25%	0.246	C	C	.	.	H	α-helix	trans	-80	-17.8	-177.2	-65.1	174.5	0	0	0	113.3	A240 C244 L264 I276 I277 N282 C285 I319	A240-L280 HydrophobicContact CB-CD1 4.48Å; A240-L280 HydrophobicContact CB-CD2 3.93Å; A240-L280 HydrophobicContact CB-CG 4.02Å; A240-L280 WeakPolarHBondContact O-CD2 3.19Å; C244-L280 HydrophobicContact CB-CD2 3.52Å; L264-L280 HydrophobicContact CD2-CD2 4.27Å; I276-L280 HydrophobicContact CG2-CD1 3.65Å; I276-L280 HydrophobicContact CG2-CG 4.22Å; I276-L280 WeakPolarHBondContact O-CG 3.43Å; I276-L280 PolarHBondContact O-N 3.48Å; I277-L280 PolarHBondContact O-N 3.31Å; L280-N282 PolarHBondContact O-N 3.37Å; L280-C285 WeakPolarHBondContact O-CB 3.48Å; L280-I319 HydrophobicContact CB-CD1 3.73Å; L280-I319 HydrophobicContact CB-CG1 3.86Å; L280-I319 HydrophobicContact CD1-CD1 3.92Å; L280-I319 HydrophobicContact CD1-CG1 4.08Å; L280-I319 HydrophobicContact CG-CD1 4.38Å
281	S	95.3	Very high	95	Very high	19 Å²	19	49.6 Å²	49.6	13%	0.133	25%	0.247	C	C	.	.			trans	-76.8	54.9	179.3	-61.8	0	0	0	0	112.4	I277 N322	I277-S281 VanDerWaalsContact O-CB 3.24Å; I277-S281 WeakPolarHBondContact O-CB 3.28Å; I277-S281 PolarHBondContact O-N 2.8Å; I277-S281 PolarHBondContact O-OG 3.46Å; S281-N322 WeakPolarHBondContact CB-ND2 3.44Å; S281-N322 PolarHBondContact OG-ND2 2.89Å
282	N	94.9	Very high	95.2	Very high	45 Å²	45	48.8 Å²	48.8	24%	0.241	24%	0.24	C	C	.	.	S	Bend	trans	-135	160.7	174.7	72.9	72.2	0	0	0	110.8	Q279 L280 E284 C285 L286	Q279-N282 PolarHBondContact O-ND2 3.38Å; L280-N282 PolarHBondContact O-N 3.37Å; N282-E284 PolarHBondContact O-N 2.92Å; N282-E284 WeakPolarHBondContact OD1-CB 3.34Å; N282-E284 PolarHBondContact OD1-N 3.3Å; N282-E284 VanDerWaalsContact OD1-N 3.12Å; N282-C285 PolarHBondContact ND2-SG 3.4Å; N282-C285 PolarHBondContact O-N 2.77Å; N282-C285 PolarHBondContact OD1-N 2.94Å; N282-C285 PolarHBondContact OD1-SG 3.25Å; N282-L286 PolarHBondContact O-N 3.17Å; N282-L286 VanDerWaalsContact O-N 3.15Å
283	L	95.6	Very high	95.4	Very high	87 Å²	87	46.7 Å²	46.7	46%	0.455	23%	0.226	S	C	.	.	H	α-helix	trans	-63.1	-40.3	-172.4	-170.1	70.7	0	0	0	112.9	L287 P326 E329 C330	L283-L287 HydrophobicContact CD1-CD1 4.49Å; L283-L287 HydrophobicContact CD2-CD1 4.45Å; L283-L287 HydrophobicContact CG-CD1 3.93Å; L283-L287 HydrophobicContact CG-CG 4.4Å; L283-L287 WeakPolarHBondContact O-CB 3.41Å; L283-L287 WeakPolarHBondContact O-CG 3.44Å; L283-L287 PolarHBondContact O-N 2.95Å; L283-P326 HydrophobicContact CB-CG 4.44Å; L283-P326 HydrophobicContact CD1-CB 4.48Å; L283-E329 HydrophobicContact CD1-CB 4.34Å; L283-C330 HydrophobicContact CD1-CB 3.82Å
284	E	95.3	Very high	95.5	Very high	124 Å²	124	43.5 Å²	43.5	58%	0.579	21%	0.212	S	C	*	.	H	α-helix	trans	-64.1	-47.6	-177.7	-174.6	178	-160.7	0	0	111.5	A245 N282 L287 A288	A245-E284 HydrophobicContact CB-CG 3.78Å; N282-E284 PolarHBondContact O-N 2.92Å; N282-E284 WeakPolarHBondContact OD1-CB 3.34Å; N282-E284 PolarHBondContact OD1-N 3.3Å; N282-E284 VanDerWaalsContact OD1-N 3.12Å; E284-L287 PolarHBondContact O-N 2.92Å; E284-A288 PolarHBondContact O-N 3.08Å
285	C	96.6	Very high	95.5	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-63.7	-44.9	178	-71.4	0	0	0	0	112.4	S241 C244 L280 N282 A288 L289	S241-C285 VanDerWaalsContact CA-SG 3.58Å; S241-C285 PolarHBondContact O-SG 2.99Å; C244-C285 HydrophobicContact CB-CB 4.15Å; L280-C285 WeakPolarHBondContact O-CB 3.48Å; N282-C285 PolarHBondContact ND2-SG 3.4Å; N282-C285 PolarHBondContact O-N 2.77Å; N282-C285 PolarHBondContact OD1-N 2.94Å; N282-C285 PolarHBondContact OD1-SG 3.25Å; C285-A288 PolarHBondContact O-N 3.37Å; C285-L289 WeakPolarHBondContact O-CG 3.45Å; C285-L289 PolarHBondContact O-N 3.37Å
286	L	97	Very high	95.4	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-68.7	-34.6	179.7	-71.5	179.2	0	0	0	112.5	N282 L289 K290 I319 A325 P326 M327 C330	N282-L286 PolarHBondContact O-N 3.17Å; N282-L286 VanDerWaalsContact O-N 3.15Å; L286-L289 HydrophobicContact CD2-CD1 4.27Å; L286-K290 WeakPolarHBondContact O-CB 3.23Å; L286-K290 PolarHBondContact O-N 3.46Å; L286-I319 HydrophobicContact CD2-CD1 4.42Å; L286-I319 HydrophobicContact CD2-CG2 3.96Å; L286-A325 HydrophobicContact CD1-CB 4.31Å; L286-P326 HydrophobicContact CD1-CG 3.9Å; L286-M327 HydrophobicContact CD1-CG 4.37Å; L286-M327 HydrophobicContact CD1-SD 3.81Å; L286-M327 HydrophobicContact CD2-SD 3.65Å; L286-M327 HydrophobicContact CG-SD 4.35Å; L286-C330 HydrophobicContact CB-CB 4.35Å
287	L	97.1	Very high	95.2	Very high	69 Å²	69	36.4 Å²	36.4	36%	0.361	18%	0.181	S	C	.	.	H	α-helix	trans	-64.3	-42.8	172	-75.8	171	0	0	0	111.6	L283 E284 K290 E291 C330	L283-L287 HydrophobicContact CD1-CD1 4.49Å; L283-L287 HydrophobicContact CD2-CD1 4.45Å; L283-L287 HydrophobicContact CG-CD1 3.93Å; L283-L287 HydrophobicContact CG-CG 4.4Å; L283-L287 WeakPolarHBondContact O-CB 3.41Å; L283-L287 WeakPolarHBondContact O-CG 3.44Å; L283-L287 PolarHBondContact O-N 2.95Å; E284-L287 PolarHBondContact O-N 2.92Å; L287-K290 PolarHBondContact O-N 2.91Å; L287-E291 PolarHBondContact O-N 3.43Å; L287-C330 HydrophobicContact CD2-CB 3.78Å; L287-C330 HydrophobicContact CG-CB 3.98Å
288	A	96.6	Very high	95	Very high	8 Å²	8	37.3 Å²	37.3	7%	0.066	19%	0.188	C	C	.	.	H	α-helix	trans	-61.8	-47.6	176	0	0	0	0	0	111.6	C244 L247 E284 C285 K290 E291 V292	C244-A288 WeakPolarHBondContact O-CB 3.24Å; L247-A288 HydrophobicContact CB-CB 4.4Å; E284-A288 PolarHBondContact O-N 3.08Å; C285-A288 PolarHBondContact O-N 3.37Å; A288-K290 PolarHBondContact O-N 3.22Å; A288-E291 PolarHBondContact O-N 3.19Å; A288-V292 WeakPolarHBondContact O-CB 3.45Å; A288-V292 VanDerWaalsContact O-CG2 3.26Å; A288-V292 WeakPolarHBondContact O-CG2 3.41Å; A288-V292 PolarHBondContact O-N 3.07Å
289	L	97.3	Very high	94.6	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-60.6	-42.9	176.1	-73.4	166.6	0	0	0	112.3	L247 C285 L286 F293 I312 I319 F332	L247-L289 HydrophobicContact CD2-CD2 3.7Å; C285-L289 WeakPolarHBondContact O-CG 3.45Å; C285-L289 PolarHBondContact O-N 3.37Å; L286-L289 HydrophobicContact CD2-CD1 4.27Å; L289-F293 VanDerWaalsContact O-CB 3.23Å; L289-F293 WeakPolarHBondContact O-CB 3.38Å; L289-F293 PolarHBondContact O-N 3.48Å; L289-I312 HydrophobicContact CD2-CD1 4.11Å; L289-I312 HydrophobicContact CD2-CG2 4.02Å; L289-I319 HydrophobicContact CD1-CD1 3.54Å; L289-F332 HydrophobicContact CB-CE1 4.12Å
290	K	97	Very high	93.9	Very high	28 Å²	28	37.5 Å²	37.5	12%	0.122	19%	0.191	C	C	.	.	H	α-helix	trans	-59.2	-52	177.8	177.5	-167.9	175.5	-166.5	0	111.7	L286 L287 A288 F293 K294 C330 F332 D335	L286-K290 WeakPolarHBondContact O-CB 3.23Å; L286-K290 PolarHBondContact O-N 3.46Å; L287-K290 PolarHBondContact O-N 2.91Å; A288-K290 PolarHBondContact O-N 3.22Å; K290-F293 PolarHBondContact O-N 3.17Å; K290-K294 WeakPolarHBondContact O-CB 3.45Å; K290-K294 PolarHBondContact O-N 2.7Å; K290-C330 WeakPolarHBondContact CD-O 3.43Å; K290-C330 PolarHBondContact NZ-O 2.95Å; K290-F332 HydrophobicContact CB-CB 4.09Å; K290-F332 HydrophobicContact CB-CD1 3.8Å; K290-F332 HydrophobicContact CB-CD2 3.92Å; K290-F332 HydrophobicContact CB-CE1 4.13Å; K290-F332 HydrophobicContact CB-CE2 4.27Å; K290-F332 HydrophobicContact CB-CG 3.69Å; K290-F332 HydrophobicContact CB-CZ 4.37Å; K290-F332 HydrophobicContact CD-CB 4.1Å; K290-F332 HydrophobicContact CD-CG 4.47Å; K290-F332 HydrophobicContact CG-CB 4.03Å; K290-F332 HydrophobicContact CG-CD1 4.47Å; K290-F332 HydrophobicContact CG-CD2 3.74Å; K290-F332 HydrophobicContact CG-CE2 4.31Å; K290-F332 HydrophobicContact CG-CG 3.85Å; K290-D335 WeakPolarHBondContact CE-OD2 3.49Å; K290-D335 IonicContact NZ-OD2 3.02Å
291	E	95.8	Very high	93.1	Very high	58 Å²	58	45 Å²	45	27%	0.271	23%	0.226	S	C	.	.	H	α-helix	trans	-67.8	-38.2	-177	-67.8	-54.7	137.7	0	0	111.7	L287 A288 K294 N295	L287-E291 PolarHBondContact O-N 3.43Å; A288-E291 PolarHBondContact O-N 3.19Å; E291-K294 PolarHBondContact O-N 3Å; E291-K294 IonicContact OE2-NZ 2.77Å; E291-N295 WeakPolarHBondContact O-CB 3.3Å; E291-N295 VanDerWaalsContact O-CG 3.3Å; E291-N295 PolarHBondContact O-N 3.11Å; E291-N295 PolarHBondContact O-ND2 2.95Å; E291-N295 VanDerWaalsContact O-ND2 3.16Å
292	V	95.2	Very high	92.7	Very high	4 Å²	4	46.3 Å²	46.3	2%	0.024	24%	0.236	C	C	.	.	H	α-helix	trans	-61.2	-51.3	172.5	166.3	0	0	0	0	110.9	L247 N248 L257 A288 K294 N295 L296 I312	L247-V292 HydrophobicContact CB-CG2 4.28Å; L247-V292 HydrophobicContact CD2-CB 4.23Å; L247-V292 HydrophobicContact CD2-CG1 4.12Å; L247-V292 HydrophobicContact CD2-CG2 4Å; L247-V292 HydrophobicContact CG-CG2 3.94Å; N248-V292 HydrophobicContact CB-CG2 3.81Å; L257-V292 HydrophobicContact CD1-CB 4.48Å; L257-V292 HydrophobicContact CD1-CG1 3.44Å; L257-V292 VanDerWaalsContact CD1-CG1 3.44Å; L257-V292 HydrophobicContact CD1-CG2 4.19Å; L257-V292 HydrophobicContact CD2-CG1 4.11Å; L257-V292 HydrophobicContact CG-CG1 4.43Å; A288-V292 WeakPolarHBondContact O-CB 3.45Å; A288-V292 VanDerWaalsContact O-CG2 3.26Å; A288-V292 WeakPolarHBondContact O-CG2 3.41Å; A288-V292 PolarHBondContact O-N 3.07Å; V292-K294 VanDerWaalsContact C-N 3.34Å; V292-K294 PolarHBondContact O-N 2.74Å; V292-N295 PolarHBondContact O-N 3.25Å; V292-L296 HydrophobicContact CG1-CD1 3.79Å; V292-L296 HydrophobicContact CG1-CG 4.39Å; V292-L296 WeakPolarHBondContact O-CB 3.38Å; V292-L296 WeakPolarHBondContact O-CG 3.2Å; V292-L296 PolarHBondContact O-N 3.11Å; V292-I312 HydrophobicContact CG1-CD1 4.44Å; V292-I312 HydrophobicContact CG1-CG1 4.13Å
293	F	96.3	Very high	92.4	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-58.6	-47.4	179.2	-179.7	-101.9	0	0	0	111.1	L289 K290 N295 L296 F297 R309 I312 L313 F332 L336 F339 L366	L289-F293 VanDerWaalsContact O-CB 3.23Å; L289-F293 WeakPolarHBondContact O-CB 3.38Å; L289-F293 PolarHBondContact O-N 3.48Å; K290-F293 PolarHBondContact O-N 3.17Å; F293-N295 PolarHBondContact O-N 3.29Å; F293-L296 PolarHBondContact O-N 2.93Å; F293-F297 AromaticContact CE1-CD2 3.93Å; F293-F297 HydrophobicContact CE1-CD2 3.93Å; F293-F297 HydrophobicContact CE1-CG 4.5Å; F293-F297 HydrophobicContact CE2-CD2 4.33Å; F293-F297 AromaticContact CZ-CD2 3.64Å; F293-F297 HydrophobicContact CZ-CD2 3.64Å; F293-F297 HydrophobicContact CZ-CE2 4.16Å; F293-F297 WeakPolarHBondContact O-CB 3.34Å; F293-F297 PolarHBondContact O-N 3.49Å; F293-R309 HydrophobicContact CD2-CG 3.96Å; F293-R309 HydrophobicContact CE2-CG 3.62Å; F293-R309 HydrophobicContact CZ-CG 4.45Å; F293-I312 HydrophobicContact CB-CG2 3.91Å; F293-I312 HydrophobicContact CD2-CG2 4.26Å; F293-L313 HydrophobicContact CD2-CB 4.27Å; F293-L313 HydrophobicContact CE2-CB 3.73Å; F293-L313 HydrophobicContact CE2-CD1 4.31Å; F293-L313 HydrophobicContact CE2-CD2 4.17Å; F293-L313 HydrophobicContact CE2-CG 4.3Å; F293-L313 HydrophobicContact CZ-CB 4.46Å; F293-L313 HydrophobicContact CZ-CD1 4.3Å; F293-L313 HydrophobicContact CZ-CD2 4.17Å; F293-F332 HydrophobicContact CB-CE2 4.2Å; F293-F332 HydrophobicContact CB-CZ 3.89Å; F293-F332 AromaticContact CD1-CE2 3.77Å; F293-F332 HydrophobicContact CD1-CE2 3.77Å; F293-F332 HydrophobicContact CD1-CZ 4.16Å; F293-F332 HydrophobicContact CG-CE2 4.2Å; F293-F332 HydrophobicContact CG-CZ 4.11Å; F293-L336 HydrophobicContact CD1-CD2 4.35Å; F293-L336 HydrophobicContact CE1-CD2 3.87Å; F293-L336 HydrophobicContact CZ-CD2 4.33Å; F293-F339 HydrophobicContact CD1-CD2 4.37Å; F293-F339 HydrophobicContact CD1-CE2 4.34Å; F293-F339 AromaticContact CE1-CD2 3.76Å; F293-F339 HydrophobicContact CE1-CD2 3.76Å; F293-F339 HydrophobicContact CE1-CE2 4.15Å; F293-L366 HydrophobicContact CE2-CD1 4.25Å; F293-L366 HydrophobicContact CZ-CD1 4.15Å
294	K	94.5	Very high	92	Very high	48 Å²	48	49.3 Å²	49.3	21%	0.209	24%	0.243	C	C	.	.	H	α-helix	trans	-60.5	-42.5	178.1	179.8	179.2	172.6	-170.6	0	112.4	K290 E291 V292 T298 F339	K290-K294 WeakPolarHBondContact O-CB 3.45Å; K290-K294 PolarHBondContact O-N 2.7Å; E291-K294 PolarHBondContact O-N 3Å; E291-K294 IonicContact OE2-NZ 2.77Å; V292-K294 VanDerWaalsContact C-N 3.34Å; V292-K294 PolarHBondContact O-N 2.74Å; K294-T298 WeakPolarHBondContact O-CB 3.41Å; K294-T298 WeakPolarHBondContact O-CG2 3.46Å; K294-T298 PolarHBondContact O-N 3.39Å; K294-T298 PolarHBondContact O-OG1 3.5Å; K294-F339 HydrophobicContact CG-CZ 4.37Å
295	N	92.1	Very high	91.8	Very high	56 Å²	56	44.5 Å²	44.5	30%	0.299	22%	0.221	S	C	.	.	H	α-helix	trans	-64.7	-48.9	176.1	-79.5	-37.1	0	0	0	111.4	E291 V292 F293 F297 T298 K299	E291-N295 WeakPolarHBondContact O-CB 3.3Å; E291-N295 VanDerWaalsContact O-CG 3.3Å; E291-N295 PolarHBondContact O-N 3.11Å; E291-N295 PolarHBondContact O-ND2 2.95Å; E291-N295 VanDerWaalsContact O-ND2 3.16Å; V292-N295 PolarHBondContact O-N 3.25Å; F293-N295 PolarHBondContact O-N 3.29Å; N295-F297 VanDerWaalsContact C-N 3.31Å; N295-F297 PolarHBondContact O-N 3.2Å; N295-T298 PolarHBondContact O-N 2.96Å; N295-K299 WeakPolarHBondContact O-CB 3.39Å; N295-K299 PolarHBondContact O-N 2.96Å
296	L	92.4	Very high	91.5	Very high	20 Å²	20	47 Å²	47	11%	0.105	23%	0.23	C	C	.	.	H	α-helix	trans	-62.3	-38.3	177.5	-68.2	171.1	0	0	0	111.9	L257 V292 F293 G300 D305 L308 R309 I312	L257-L296 HydrophobicContact CD2-CD1 4.26Å; L257-L296 HydrophobicContact CD2-CD2 4.13Å; L257-L296 HydrophobicContact CD2-CG 4.43Å; V292-L296 HydrophobicContact CG1-CD1 3.79Å; V292-L296 HydrophobicContact CG1-CG 4.39Å; V292-L296 WeakPolarHBondContact O-CB 3.38Å; V292-L296 WeakPolarHBondContact O-CG 3.2Å; V292-L296 PolarHBondContact O-N 3.11Å; F293-L296 PolarHBondContact O-N 2.93Å; L296-G300 WeakPolarHBondContact O-CA 3.28Å; L296-G300 PolarHBondContact O-N 3.14Å; L296-D305 HydrophobicContact CD2-CB 4.2Å; L296-L308 HydrophobicContact CD1-CB 4.4Å; L296-L308 HydrophobicContact CD1-CD2 4.48Å; L296-L308 HydrophobicContact CD1-CG 4.09Å; L296-R309 HydrophobicContact CB-CB 3.9Å; L296-R309 HydrophobicContact CB-CG 4.28Å; L296-R309 HydrophobicContact CD1-CB 4.34Å; L296-I312 HydrophobicContact CD1-CG1 4.32Å
297	F	91.2	Very high	91.3	Very high	7 Å²	7	51.3 Å²	51.3	3%	0.031	25%	0.25	C	S	.	.	H	α-helix	trans	-68.9	-39.4	179.8	-163.4	-85.2	0	0	0	112.7	F293 N295 R309 F339 F342 L355 L357 L366 L370	F293-F297 AromaticContact CE1-CD2 3.93Å; F293-F297 HydrophobicContact CE1-CD2 3.93Å; F293-F297 HydrophobicContact CE1-CG 4.5Å; F293-F297 HydrophobicContact CE2-CD2 4.33Å; F293-F297 AromaticContact CZ-CD2 3.64Å; F293-F297 HydrophobicContact CZ-CD2 3.64Å; F293-F297 HydrophobicContact CZ-CE2 4.16Å; F293-F297 WeakPolarHBondContact O-CB 3.34Å; F293-F297 PolarHBondContact O-N 3.49Å; N295-F297 VanDerWaalsContact C-N 3.31Å; N295-F297 PolarHBondContact O-N 3.2Å; F297-R309 HydrophobicContact CD2-CG 4.38Å; F297-F339 AromaticContact CD1-CD1 3.61Å; F297-F339 HydrophobicContact CD1-CD1 3.61Å; F297-F339 AromaticContact CD1-CE1 3.69Å; F297-F339 HydrophobicContact CD1-CE1 3.69Å; F297-F339 HydrophobicContact CD1-CG 4.07Å; F297-F339 HydrophobicContact CD1-CZ 4.19Å; F297-F339 HydrophobicContact CE1-CB 4.03Å; F297-F339 AromaticContact CE1-CD1 3.28Å; F297-F339 HydrophobicContact CE1-CD1 3.28Å; F297-F339 AromaticContact CE1-CE1 3.84Å; F297-F339 HydrophobicContact CE1-CE1 3.84Å; F297-F339 AromaticContact CE1-CG 3.74Å; F297-F339 HydrophobicContact CE1-CG 3.74Å; F297-F339 HydrophobicContact CE2-CB 4.05Å; F297-F339 HydrophobicContact CE2-CG 4.26Å; F297-F339 HydrophobicContact CG-CD1 4.41Å; F297-F339 HydrophobicContact CG-CE1 4.48Å; F297-F339 HydrophobicContact CG-CG 4.47Å; F297-F339 HydrophobicContact CZ-CB 3.69Å; F297-F339 AromaticContact CZ-CD1 3.9Å; F297-F339 HydrophobicContact CZ-CD1 3.9Å; F297-F339 AromaticContact CZ-CG 3.89Å; F297-F339 HydrophobicContact CZ-CG 3.89Å; F297-F342 HydrophobicContact CE1-CE1 4.05Å; F297-F342 HydrophobicContact CE1-CZ 4.25Å; F297-F342 AromaticContact CZ-CE1 3.9Å; F297-F342 HydrophobicContact CZ-CE1 3.9Å; F297-F342 HydrophobicContact CZ-CZ 4.35Å; F297-L355 HydrophobicContact CD1-CD2 3.47Å; F297-L355 VanDerWaalsContact CD1-CD2 3.47Å; F297-L355 HydrophobicContact CE1-CD2 3.18Å; F297-L355 HydrophobicContact CZ-CD2 4.34Å; F297-L357 HydrophobicContact CZ-CD2 4.44Å; F297-L366 HydrophobicContact CD2-CD1 4.24Å; F297-L366 HydrophobicContact CD2-CD2 3.84Å; F297-L366 HydrophobicContact CE2-CD1 3.93Å; F297-L366 HydrophobicContact CE2-CD2 3.19Å; F297-L366 HydrophobicContact CE2-CG 3.96Å; F297-L366 HydrophobicContact CZ-CD2 3.92Å; F297-L370 HydrophobicContact CE2-CD1 4.16Å; F297-L370 HydrophobicContact CZ-CD1 4.43Å
298	T	89.1	Confident	91.1	Very high	44 Å²	44	48.5 Å²	48.5	27%	0.27	24%	0.236	S	C	.	.	H	α-helix	trans	-92.6	-30.6	-173.9	55.7	0	0	0	0	114	K294 N295	K294-T298 WeakPolarHBondContact O-CB 3.41Å; K294-T298 WeakPolarHBondContact O-CG2 3.46Å; K294-T298 PolarHBondContact O-N 3.39Å; K294-T298 PolarHBondContact O-OG1 3.5Å; N295-T298 PolarHBondContact O-N 2.96Å
299	K	85.6	Confident	91.1	Very high	152 Å²	152	48.5 Å²	48.5	66%	0.661	23%	0.234	S	C	*	.	H	α-helix	trans	-116.1	-21.6	-174.7	-60.1	174.7	-176.2	163.9	0	113.6	N295 Q301	N295-K299 WeakPolarHBondContact O-CB 3.39Å; N295-K299 PolarHBondContact O-N 2.96Å; K299-Q301 PolarHBondContact O-N 3.37Å
300	G	81.9	Confident	91	Very high	18 Å²	18	49.1 Å²	49.1	19%	0.186	24%	0.237	C	C	.	.			trans	-66.2	123.7	-178.8	0	0	0	0	0	111.3	L296 D305	L296-G300 WeakPolarHBondContact O-CA 3.28Å; L296-G300 PolarHBondContact O-N 3.14Å; G300-D305 WeakPolarHBondContact CA-OD2 3.43Å
301	Q	79.2	Confident	90.9	Very high	157 Å²	157	50.3 Å²	50.3	73%	0.734	25%	0.245	S	C	*	.			trans	-125.3	-18.1	-178.8	-67.1	-171	5.5	0	0	112.6	K299 D305 R306	K299-Q301 PolarHBondContact O-N 3.37Å; Q301-D305 PolarHBondContact N-OD2 3.09Å; Q301-D305 VanDerWaalsContact N-OD2 3.07Å; Q301-R306 VanDerWaalsContact O-CZ 3.24Å; Q301-R306 PolarHBondContact O-NH1 3.48Å; Q301-R306 PolarHBondContact O-NH2 3.44Å; Q301-R306 VanDerWaalsContact O-NH2 3.08Å
302	S	87.1	Confident	90.9	Very high	48 Å²	48	47.6 Å²	47.6	34%	0.336	23%	0.232	S	C	.	.	S	Bend	trans	-73.2	156.3	177.5	94.4	0	0	0	0	110.5	Y304 D305 R306	S302-Y304 PolarHBondContact O-N 3.44Å; S302-Y304 PolarHBondContact OG-N 3.09Å; S302-D305 WeakPolarHBondContact CB-OD2 3.34Å; S302-D305 PolarHBondContact N-OD2 2.9Å; S302-D305 PolarHBondContact O-N 2.83Å; S302-D305 PolarHBondContact OG-N 2.89Å; S302-D305 PolarHBondContact OG-OD1 3.09Å; S302-D305 PolarHBondContact OG-OD2 3.2Å; S302-R306 WeakPolarHBondContact O-CG 3.31Å; S302-R306 PolarHBondContact O-N 2.84Å; S302-R306 PolarHBondContact O-NH1 3.49Å
303	H	87.1	Confident	91.1	Very high	109 Å²	109	47.4 Å²	47.4	51%	0.505	23%	0.231	S	C	.	.	H	α-helix	trans	-55.2	-41.4	171.3	166.8	-80.1	0	0	0	110.8	R306 Q307 E362	H303-R306 PolarHBondContact O-N 2.89Å; H303-Q307 PolarHBondContact O-N 3.27Å; H303-E362 IonicContact CD2-OE1 2.65Å; H303-E362 PolarHBondContact CD2-OE1 2.99Å; H303-E362 IonicContact NE2-OE1 2.61Å; H303-E362 PolarHBondContact NE2-OE1 2.94Å; H303-E362 VanDerWaalsContact NE2-OE1 3.15Å
304	Y	87.6	Confident	91.1	Very high	86 Å²	86	49.1 Å²	49.1	34%	0.337	24%	0.241	S	C	.	.	H	α-helix	trans	-67.2	-40.6	-178.4	179.9	-93.6	0	0	0	112.8	F258 S302 R306 Q307 L308	F258-Y304 WeakPolarHBondContact CB-OH 3.46Å; F258-Y304 VanDerWaalsContact CD1-OH 3.31Å; F258-Y304 WeakPolarHBondContact CD1-OH 3.37Å; F258-Y304 HydrophobicContact CD2-CE1 4.27Å; F258-Y304 AromaticContact CD2-CE2 3.78Å; F258-Y304 HydrophobicContact CD2-CE2 3.78Å; F258-Y304 AromaticContact CD2-CZ 3.32Å; F258-Y304 WeakPolarHBondContact CD2-OH 3.24Å; F258-Y304 AromaticContact CE2-CE2 3.61Å; F258-Y304 HydrophobicContact CE2-CE2 3.61Å; F258-Y304 AromaticContact CE2-CZ 3.66Å; F258-Y304 VanDerWaalsContact CE2-OH 3.23Å; F258-Y304 WeakPolarHBondContact CE2-OH 3.41Å; F258-Y304 AromaticContact CG-CZ 3.76Å; F258-Y304 WeakPolarHBondContact CG-OH 3.41Å; F258-Y304 HydrophobicContact CZ-CE2 4.28Å; S302-Y304 PolarHBondContact O-N 3.44Å; S302-Y304 PolarHBondContact OG-N 3.09Å; Y304-R306 VanDerWaalsContact C-N 3.26Å; Y304-R306 PolarHBondContact O-N 3.49Å; Y304-Q307 PolarHBondContact O-N 3.03Å; Y304-L308 HydrophobicContact CE1-CD2 4.22Å; Y304-L308 WeakPolarHBondContact O-CB 3.49Å; Y304-L308 PolarHBondContact O-N 3.42Å
305	D	90.4	Very high	91.2	Very high	23 Å²	23	46.9 Å²	46.9	12%	0.123	23%	0.232	C	C	.	.	H	α-helix	trans	-61.5	-40.2	176.6	-49.6	-15.4	0	0	0	110.3	L296 G300 Q301 S302 L308 R309	L296-D305 HydrophobicContact CD2-CB 4.2Å; G300-D305 WeakPolarHBondContact CA-OD2 3.43Å; Q301-D305 PolarHBondContact N-OD2 3.09Å; Q301-D305 VanDerWaalsContact N-OD2 3.07Å; S302-D305 WeakPolarHBondContact CB-OD2 3.34Å; S302-D305 PolarHBondContact N-OD2 2.9Å; S302-D305 PolarHBondContact O-N 2.83Å; S302-D305 PolarHBondContact OG-N 2.89Å; S302-D305 PolarHBondContact OG-OD1 3.09Å; S302-D305 PolarHBondContact OG-OD2 3.2Å; D305-L308 PolarHBondContact O-N 3.49Å; D305-R309 VanDerWaalsContact O-CB 3.23Å; D305-R309 WeakPolarHBondContact O-CB 3.35Å; D305-R309 PolarHBondContact O-N 2.98Å
306	R	91.8	Very high	91.4	Very high	52 Å²	52	44.2 Å²	44.2	20%	0.196	22%	0.218	C	C	.	.	H	α-helix	trans	-67.1	-39.1	177.7	-65.8	-175.5	-173.1	83.6	6.1	112.1	Q301 S302 H303 Y304 R309 N310 E362 D363	Q301-R306 VanDerWaalsContact O-CZ 3.24Å; Q301-R306 PolarHBondContact O-NH1 3.48Å; Q301-R306 PolarHBondContact O-NH2 3.44Å; Q301-R306 VanDerWaalsContact O-NH2 3.08Å; S302-R306 WeakPolarHBondContact O-CG 3.31Å; S302-R306 PolarHBondContact O-N 2.84Å; S302-R306 PolarHBondContact O-NH1 3.49Å; H303-R306 PolarHBondContact O-N 2.89Å; Y304-R306 VanDerWaalsContact C-N 3.26Å; Y304-R306 PolarHBondContact O-N 3.49Å; R306-R309 WeakPolarHBondContact O-CB 3.49Å; R306-N310 PolarHBondContact O-N 3.29Å; R306-N310 PolarHBondContact O-OD1 2.95Å; R306-E362 HydrophobicContact CB-CB 3.54Å; R306-E362 HydrophobicContact CB-CG 3.95Å; R306-E362 HydrophobicContact CG-CB 4.48Å; R306-D363 IonicContact NE-OD1 3.15Å; R306-D363 IonicContact NE-OD2 3.05Å
307	Q	93.1	Very high	91.6	Very high	91 Å²	91	43.7 Å²	43.7	43%	0.425	22%	0.215	S	C	.	.	H	α-helix	trans	-64.5	-50.1	174.7	-176	174.8	-3.1	0	0	110.6	H303 Y304 R309 N310 D311	H303-Q307 PolarHBondContact O-N 3.27Å; Y304-Q307 PolarHBondContact O-N 3.03Å; Q307-R309 VanDerWaalsContact C-N 3.31Å; Q307-R309 PolarHBondContact O-N 2.9Å; Q307-N310 WeakPolarHBondContact O-CA 3.32Å; Q307-N310 WeakPolarHBondContact O-CB 3.31Å; Q307-N310 PolarHBondContact O-N 2.88Å; Q307-D311 PolarHBondContact O-N 2.83Å
308	L	92.9	Very high	91.8	Very high	10 Å²	10	45.3 Å²	45.3	5%	0.052	22%	0.224	C	C	.	.	H	α-helix	trans	-61.1	-39.9	179.8	-170.4	56	0	0	0	112.1	L257 L296 Y304 D305 N310 D311 I312	L257-L308 HydrophobicContact CD2-CD2 3.73Å; L257-L308 HydrophobicContact CG-CD2 3.75Å; L296-L308 HydrophobicContact CD1-CB 4.4Å; L296-L308 HydrophobicContact CD1-CD2 4.48Å; L296-L308 HydrophobicContact CD1-CG 4.09Å; Y304-L308 HydrophobicContact CE1-CD2 4.22Å; Y304-L308 WeakPolarHBondContact O-CB 3.49Å; Y304-L308 PolarHBondContact O-N 3.42Å; D305-L308 PolarHBondContact O-N 3.49Å; L308-N310 VanDerWaalsContact C-N 3.28Å; L308-N310 PolarHBondContact O-N 3.15Å; L308-D311 PolarHBondContact O-N 3.45Å; L308-I312 VanDerWaalsContact O-CG1 3.3Å; L308-I312 WeakPolarHBondContact O-CG1 3.5Å; L308-I312 PolarHBondContact O-N 2.89Å
309	R	94.7	Very high	92.1	Very high	8 Å²	8	43.2 Å²	43.2	3%	0.03	21%	0.211	C	C	.	.	H	α-helix	trans	-54.6	-45.3	171.6	177.5	-163.9	67.4	-168.1	-4.4	111.6	F293 L296 F297 D305 R306 Q307 L313 E362 D363 L366	F293-R309 HydrophobicContact CD2-CG 3.96Å; F293-R309 HydrophobicContact CE2-CG 3.62Å; F293-R309 HydrophobicContact CZ-CG 4.45Å; L296-R309 HydrophobicContact CB-CB 3.9Å; L296-R309 HydrophobicContact CB-CG 4.28Å; L296-R309 HydrophobicContact CD1-CB 4.34Å; F297-R309 HydrophobicContact CD2-CG 4.38Å; D305-R309 VanDerWaalsContact O-CB 3.23Å; D305-R309 WeakPolarHBondContact O-CB 3.35Å; D305-R309 PolarHBondContact O-N 2.98Å; R306-R309 WeakPolarHBondContact O-CB 3.49Å; Q307-R309 VanDerWaalsContact C-N 3.31Å; Q307-R309 PolarHBondContact O-N 2.9Å; R309-L313 PolarHBondContact O-N 3.48Å; R309-L313 VanDerWaalsContact O-N 3.08Å; R309-E362 PolarHBondContact NH2-O 3.42Å; R309-E362 VanDerWaalsContact NH2-O 3.09Å; R309-D363 IonicContact CZ-OD1 3.48Å; R309-D363 VanDerWaalsContact CZ-OD1 3.25Å; R309-D363 IonicContact NH1-OD1 2.87Å; R309-D363 PolarHBondContact NH1-OD1 2.86Å; R309-D363 IonicContact NH2-OD1 3.29Å; R309-D363 PolarHBondContact NH2-OD1 3.22Å; R309-L366 HydrophobicContact CG-CD1 4.41Å; R309-L366 VanDerWaalsContact NH1-CD2 3.32Å
310	N	95.9	Very high	92.5	Very high	13 Å²	13	36.6 Å²	36.6	7%	0.07	18%	0.184	C	C	.	.	H	α-helix	trans	-68.3	-41.1	179.8	-66	-0.5	0	0	0	110.7	R306 Q307 L308 I312 L313 V314 E362 L366 L369	R306-N310 PolarHBondContact O-N 3.29Å; R306-N310 PolarHBondContact O-OD1 2.95Å; Q307-N310 WeakPolarHBondContact O-CA 3.32Å; Q307-N310 WeakPolarHBondContact O-CB 3.31Å; Q307-N310 PolarHBondContact O-N 2.88Å; L308-N310 VanDerWaalsContact C-N 3.28Å; L308-N310 PolarHBondContact O-N 3.15Å; N310-I312 VanDerWaalsContact C-N 3.35Å; N310-I312 PolarHBondContact O-N 3.16Å; N310-L313 WeakPolarHBondContact O-CB 3.34Å; N310-L313 PolarHBondContact O-N 3.23Å; N310-L313 VanDerWaalsContact O-N 3.13Å; N310-V314 WeakPolarHBondContact O-CG2 3.28Å; N310-V314 PolarHBondContact O-N 3.16Å; N310-E362 PolarHBondContact ND2-O 3.37Å; N310-L366 WeakPolarHBondContact OD1-CB 3.48Å; N310-L369 HydrophobicContact CB-CD1 3.84Å
311	D	95.4	Very high	93	Very high	53 Å²	53	41.3 Å²	41.3	28%	0.283	20%	0.202	S	C	.	.	H	α-helix	trans	-60.3	-43.8	176.1	-61.8	-23.8	0	0	0	111.4	Q307 L308 L313 V314 I315	Q307-D311 PolarHBondContact O-N 2.83Å; L308-D311 PolarHBondContact O-N 3.45Å; D311-L313 VanDerWaalsContact C-N 3.32Å; D311-L313 PolarHBondContact O-N 3.43Å; D311-V314 PolarHBondContact O-N 3.03Å; D311-I315 WeakPolarHBondContact O-CG1 3.42Å; D311-I315 PolarHBondContact O-N 3.21Å
312	I	96.6	Very high	93.6	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-61.2	-40.1	174.3	-66.5	-57.3	0	0	0	111.6	L247 S261 L289 V292 F293 L296 L308 N310 I315 T316	L247-I312 HydrophobicContact CD2-CD1 3.85Å; S261-I312 WeakPolarHBondContact OG-CD1 3.47Å; L289-I312 HydrophobicContact CD2-CD1 4.11Å; L289-I312 HydrophobicContact CD2-CG2 4.02Å; V292-I312 HydrophobicContact CG1-CD1 4.44Å; V292-I312 HydrophobicContact CG1-CG1 4.13Å; F293-I312 HydrophobicContact CB-CG2 3.91Å; F293-I312 HydrophobicContact CD2-CG2 4.26Å; L296-I312 HydrophobicContact CD1-CG1 4.32Å; L308-I312 VanDerWaalsContact O-CG1 3.3Å; L308-I312 WeakPolarHBondContact O-CG1 3.5Å; L308-I312 PolarHBondContact O-N 2.89Å; N310-I312 VanDerWaalsContact C-N 3.35Å; N310-I312 PolarHBondContact O-N 3.16Å; I312-I315 PolarHBondContact O-N 2.92Å; I312-T316 WeakPolarHBondContact O-CB 3.42Å; I312-T316 PolarHBondContact O-N 2.92Å; I312-T316 PolarHBondContact O-OG1 3.18Å
313	L	97.6	Very high	93.5	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-67	-37.1	176.4	-175.9	56.2	0	0	0	112.1	F293 R309 N310 D311 T316 T317 L336 L366 L369 L370 I373	F293-L313 HydrophobicContact CD2-CB 4.27Å; F293-L313 HydrophobicContact CE2-CB 3.73Å; F293-L313 HydrophobicContact CE2-CD1 4.31Å; F293-L313 HydrophobicContact CE2-CD2 4.17Å; F293-L313 HydrophobicContact CE2-CG 4.3Å; F293-L313 HydrophobicContact CZ-CB 4.46Å; F293-L313 HydrophobicContact CZ-CD1 4.3Å; F293-L313 HydrophobicContact CZ-CD2 4.17Å; R309-L313 PolarHBondContact O-N 3.48Å; R309-L313 VanDerWaalsContact O-N 3.08Å; N310-L313 WeakPolarHBondContact O-CB 3.34Å; N310-L313 PolarHBondContact O-N 3.23Å; N310-L313 VanDerWaalsContact O-N 3.13Å; D311-L313 VanDerWaalsContact C-N 3.32Å; D311-L313 PolarHBondContact O-N 3.43Å; L313-T316 PolarHBondContact O-N 2.75Å; L313-T317 WeakPolarHBondContact O-CB 3.34Å; L313-T317 PolarHBondContact O-N 2.82Å; L313-T317 PolarHBondContact O-OG1 2.82Å; L313-L336 HydrophobicContact CD1-CD2 3.62Å; L313-L366 HydrophobicContact CD2-CD1 3.76Å; L313-L369 HydrophobicContact CD2-CB 3.47Å; L313-L369 VanDerWaalsContact CD2-CB 3.47Å; L313-L369 HydrophobicContact CD2-CD1 4.42Å; L313-L369 HydrophobicContact CG-CB 4.07Å; L313-L370 HydrophobicContact CD2-CD2 4.01Å; L313-L370 HydrophobicContact CD2-CG 4.05Å; L313-I373 HydrophobicContact CD1-CD1 3.81Å; L313-I373 HydrophobicContact CD1-CG2 4.33Å
314	V	97	Very high	93.6	Very high	36 Å²	36	37.4 Å²	37.4	22%	0.218	21%	0.206	C	C	.	.	H	α-helix	trans	-63.6	-48.7	174.3	173.2	0	0	0	0	110.5	W265 N310 D311 T316 T317 I318 L369	W265-V314 HydrophobicContact CH2-CG1 3.98Å; W265-V314 HydrophobicContact CZ3-CB 4.17Å; W265-V314 HydrophobicContact CZ3-CG1 3.7Å; N310-V314 WeakPolarHBondContact O-CG2 3.28Å; N310-V314 PolarHBondContact O-N 3.16Å; D311-V314 PolarHBondContact O-N 3.03Å; V314-T316 VanDerWaalsContact C-N 3.3Å; V314-T316 PolarHBondContact O-N 3.34Å; V314-T317 WeakPolarHBondContact O-CB 3.37Å; V314-T317 PolarHBondContact O-N 3.26Å; V314-T317 VanDerWaalsContact O-N 3.13Å; V314-I318 HydrophobicContact CG1-CD1 4.11Å; V314-I318 WeakPolarHBondContact O-CG1 3.2Å; V314-I318 PolarHBondContact O-N 3.44Å; V314-L369 HydrophobicContact CG2-CD1 3.93Å; V314-L369 HydrophobicContact CG2-CD2 3.72Å; V314-L369 HydrophobicContact CG2-CG 4.5Å
315	I	95.9	Very high	93.9	Very high	2 Å²	2	33.9 Å²	33.9	1%	0.01	19%	0.194	C	C	.	.	H	α-helix	trans	-56.4	-47.3	175.4	-67.8	170	0	0	0	110.2	L264 W265 L268 D311 I312 T317 I318 I319	L264-I315 HydrophobicContact CB-CD1 4.26Å; W265-I315 HydrophobicContact CE3-CG1 4.37Å; L268-I315 HydrophobicContact CD1-CB 4.48Å; L268-I315 HydrophobicContact CD1-CG1 3.92Å; L268-I315 HydrophobicContact CD1-CG2 4.27Å; D311-I315 WeakPolarHBondContact O-CG1 3.42Å; D311-I315 PolarHBondContact O-N 3.21Å; I312-I315 PolarHBondContact O-N 2.92Å; I315-T317 VanDerWaalsContact C-N 3.32Å; I315-T317 PolarHBondContact O-N 2.64Å; I315-I318 PolarHBondContact O-N 3.3Å; I315-I319 HydrophobicContact CG2-CD1 3.87Å; I315-I319 WeakPolarHBondContact O-CG1 3.49Å; I315-I319 PolarHBondContact O-N 3.22Å
316	T	96.9	Very high	94.1	Very high	0 Å²	0	34 Å²	34	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-59.6	-42.6	177.2	-57.8	0	0	0	0	111.7	I312 L313 V314 I318 I319 A320 M327 F332 L336 I373	I312-T316 WeakPolarHBondContact O-CB 3.42Å; I312-T316 PolarHBondContact O-N 2.92Å; I312-T316 PolarHBondContact O-OG1 3.18Å; L313-T316 PolarHBondContact O-N 2.75Å; V314-T316 VanDerWaalsContact C-N 3.3Å; V314-T316 PolarHBondContact O-N 3.34Å; T316-I318 VanDerWaalsContact C-N 3.31Å; T316-I318 PolarHBondContact O-N 3.17Å; T316-I319 PolarHBondContact O-N 3.21Å; T316-A320 WeakPolarHBondContact O-CB 3.49Å; T316-A320 PolarHBondContact O-N 2.8Å; T316-M327 HydrophobicContact CG2-CE 3.69Å; T316-M327 HydrophobicContact CG2-SD 4.41Å; T316-F332 HydrophobicContact CG2-CD1 3.88Å; T316-F332 HydrophobicContact CG2-CE1 3.31Å; T316-F332 HydrophobicContact CG2-CZ 3.83Å; T316-L336 HydrophobicContact CG2-CD1 4.41Å; T316-I373 HydrophobicContact CG2-CD1 3.96Å
317	T	96.3	Very high	94.3	Very high	8 Å²	8	31.9 Å²	31.9	5%	0.049	19%	0.189	C	C	.	.	H	α-helix	trans	-63.3	-38	178.8	-56	0	0	0	0	111.4	L313 V314 I315 Q321 I373 I376	L313-T317 WeakPolarHBondContact O-CB 3.34Å; L313-T317 PolarHBondContact O-N 2.82Å; L313-T317 PolarHBondContact O-OG1 2.82Å; V314-T317 WeakPolarHBondContact O-CB 3.37Å; V314-T317 PolarHBondContact O-N 3.26Å; V314-T317 VanDerWaalsContact O-N 3.13Å; I315-T317 VanDerWaalsContact C-N 3.32Å; I315-T317 PolarHBondContact O-N 2.64Å; T317-Q321 WeakPolarHBondContact O-CG 3.49Å; T317-Q321 PolarHBondContact O-N 2.97Å; T317-I373 HydrophobicContact CG2-CB 4.45Å; T317-I376 HydrophobicContact CG2-CG1 3.99Å
318	I	95.1	Very high	94.4	Very high	41 Å²	41	29.9 Å²	29.9	21%	0.21	18%	0.181	C	C	.	.	H	α-helix	trans	-65.8	-43.9	175.7	-66.1	165.4	0	0	0	110.5	L268 I277 V314 I315 T316 Q321	L268-I318 HydrophobicContact CD1-CD1 4.31Å; L268-I318 HydrophobicContact CD2-CG2 4.24Å; I277-I318 HydrophobicContact CD1-CG2 3.75Å; I277-I318 HydrophobicContact CG1-CG2 3.9Å; V314-I318 HydrophobicContact CG1-CD1 4.11Å; V314-I318 WeakPolarHBondContact O-CG1 3.2Å; V314-I318 PolarHBondContact O-N 3.44Å; I315-I318 PolarHBondContact O-N 3.3Å; T316-I318 VanDerWaalsContact C-N 3.31Å; T316-I318 PolarHBondContact O-N 3.17Å; I318-Q321 WeakPolarHBondContact O-CB 3.37Å; I318-Q321 PolarHBondContact O-N 2.91Å
319	I	95.1	Very high	94.4	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-64.5	-43.1	178.3	-60.2	159.7	0	0	0	110.8	L280 L286 L289 I315 T316 Q321 N322 A325	L280-I319 HydrophobicContact CB-CD1 3.73Å; L280-I319 HydrophobicContact CB-CG1 3.86Å; L280-I319 HydrophobicContact CD1-CD1 3.92Å; L280-I319 HydrophobicContact CD1-CG1 4.08Å; L280-I319 HydrophobicContact CG-CD1 4.38Å; L286-I319 HydrophobicContact CD2-CD1 4.42Å; L286-I319 HydrophobicContact CD2-CG2 3.96Å; L289-I319 HydrophobicContact CD1-CD1 3.54Å; I315-I319 HydrophobicContact CG2-CD1 3.87Å; I315-I319 WeakPolarHBondContact O-CG1 3.49Å; I315-I319 PolarHBondContact O-N 3.22Å; T316-I319 PolarHBondContact O-N 3.21Å; I319-Q321 PolarHBondContact O-N 3.39Å; I319-Q321 VanDerWaalsContact O-N 3.1Å; I319-N322 WeakPolarHBondContact O-CB 3.4Å; I319-N322 PolarHBondContact O-N 3.08Å; I319-A325 HydrophobicContact CG2-CB 3.99Å
320	A	94.9	Very high	94.4	Very high	13 Å²	13	36.1 Å²	36.1	11%	0.107	21%	0.21	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-13	-178.5	0	0	0	0	0	114.1	T316 N322 M327 I376 L377	T316-A320 WeakPolarHBondContact O-CB 3.49Å; T316-A320 PolarHBondContact O-N 2.8Å; A320-N322 PolarHBondContact O-N 3.36Å; A320-M327 HydrophobicContact CB-CE 4.21Å; A320-M327 HydrophobicContact CB-CG 4.13Å; A320-M327 HydrophobicContact CB-SD 4.25Å; A320-I376 HydrophobicContact CB-CG2 3.98Å; A320-I376 WeakPolarHBondContact O-CG2 3.5Å; A320-L377 HydrophobicContact CB-CD2 4.46Å
321	Q	92.4	Very high	94.4	Very high	118 Å²	118	36.5 Å²	36.5	55%	0.551	22%	0.217	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68.4	-20.5	171.4	-68.5	175.6	15	0	0	112.6	T317 I318 I319 P323 I376	T317-Q321 WeakPolarHBondContact O-CG 3.49Å; T317-Q321 PolarHBondContact O-N 2.97Å; I318-Q321 WeakPolarHBondContact O-CB 3.37Å; I318-Q321 PolarHBondContact O-N 2.91Å; I319-Q321 PolarHBondContact O-N 3.39Å; I319-Q321 VanDerWaalsContact O-N 3.1Å; Q321-P323 WeakPolarHBondContact O-CD 3.29Å; Q321-I376 HydrophobicContact CG-CD1 4.15Å; Q321-I376 HydrophobicContact CG-CG2 4.08Å
322	N	91.6	Very high	94.5	Very high	51 Å²	51	34 Å²	34	27%	0.273	20%	0.204	S	C	.	.	S	Bend	trans	-82.7	117.5	173.6	178.7	17.6	0	0	0	110.3	I277 S281 I319 A320 G324 A325	I277-N322 HydrophobicContact CG2-CB 3.51Å; S281-N322 WeakPolarHBondContact CB-ND2 3.44Å; S281-N322 PolarHBondContact OG-ND2 2.89Å; I319-N322 WeakPolarHBondContact O-CB 3.4Å; I319-N322 PolarHBondContact O-N 3.08Å; A320-N322 PolarHBondContact O-N 3.36Å; N322-G324 PolarHBondContact O-N 3.17Å; N322-G324 VanDerWaalsContact O-N 3.08Å; N322-G324 PolarHBondContact OD1-N 3.09Å; N322-G324 VanDerWaalsContact OD1-N 3.1Å; N322-A325 WeakPolarHBondContact O-CB 3.25Å; N322-A325 PolarHBondContact O-N 3.01Å
323	P	86	Confident	94.5	Very high	124 Å²	124	34 Å²	34	81%	0.805	20%	0.204	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.3	-21.7	176.9	-23.3	34.2	0	0	0	114	Q321 A325	Q321-P323 WeakPolarHBondContact O-CD 3.29Å; P323-A325 VanDerWaalsContact C-N 3.32Å
324	G	87.8	Confident	94.4	Very high	57 Å²	57	42.1 Å²	42.1	59%	0.588	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81.2	-2.1	177	0	0	0	0	0	115.2	N322	N322-G324 PolarHBondContact O-N 3.17Å; N322-G324 VanDerWaalsContact O-N 3.08Å; N322-G324 PolarHBondContact OD1-N 3.09Å; N322-G324 VanDerWaalsContact OD1-N 3.1Å
325	A	94	Very high	94.3	Very high	11 Å²	11	41.3 Å²	41.3	9%	0.091	23%	0.229	C	C	.	.	S	Bend	trans	-77.9	124.4	179.3	0	0	0	0	0	110.9	L286 I319 N322 P323 M327	L286-A325 HydrophobicContact CD1-CB 4.31Å; I319-A325 HydrophobicContact CG2-CB 3.99Å; N322-A325 WeakPolarHBondContact O-CB 3.25Å; N322-A325 PolarHBondContact O-N 3.01Å; P323-A325 VanDerWaalsContact C-N 3.32Å; A325-M327 HydrophobicContact CB-CG 4.23Å; A325-M327 PolarHBondContact O-N 3.36Å
326	P	94.8	Very high	94.4	Very high	25 Å²	25	41.2 Å²	41.2	16%	0.162	23%	0.229	C	C	.	.			trans	-77.6	58.9	-174.8	30.1	-33.8	0	0	0	113.4	L283 L286 I328 E329 C330	L283-P326 HydrophobicContact CB-CG 4.44Å; L283-P326 HydrophobicContact CD1-CB 4.48Å; L286-P326 HydrophobicContact CD1-CG 3.9Å; P326-I328 VanDerWaalsContact C-N 3.34Å; P326-I328 PolarHBondContact O-N 3.43Å; P326-E329 WeakPolarHBondContact CA-OE2 3.49Å; P326-E329 HydrophobicContact CB-CB 4.23Å; P326-E329 WeakPolarHBondContact CB-OE2 3.43Å; P326-C330 PolarHBondContact O-N 2.9Å; P326-C330 PolarHBondContact O-SG 3.12Å
327	M	96.1	Very high	94.4	Very high	9 Å²	9	41.4 Å²	41.4	4%	0.044	23%	0.229	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.7	-31.9	-175.6	-71.3	-63.1	-63.7	0	0	112.9	L286 T316 A320 A325 C330 F332 T333 L336 L377	L286-M327 HydrophobicContact CD1-CG 4.37Å; L286-M327 HydrophobicContact CD1-SD 3.81Å; L286-M327 HydrophobicContact CD2-SD 3.65Å; L286-M327 HydrophobicContact CG-SD 4.35Å; T316-M327 HydrophobicContact CG2-CE 3.69Å; T316-M327 HydrophobicContact CG2-SD 4.41Å; A320-M327 HydrophobicContact CB-CE 4.21Å; A320-M327 HydrophobicContact CB-CG 4.13Å; A320-M327 HydrophobicContact CB-SD 4.25Å; A325-M327 HydrophobicContact CB-CG 4.23Å; A325-M327 PolarHBondContact O-N 3.36Å; M327-C330 PolarHBondContact O-SG 3.44Å; M327-F332 HydrophobicContact CE-CB 4.25Å; M327-F332 HydrophobicContact CE-CD1 3.94Å; M327-F332 HydrophobicContact CE-CG 4.2Å; M327-F332 PolarHBondContact O-N 2.95Å; M327-T333 WeakPolarHBondContact CB-OG1 3.36Å; M327-T333 PolarHBondContact O-N 2.97Å; M327-T333 VanDerWaalsContact O-N 3.11Å; M327-T333 PolarHBondContact O-OG1 3.27Å; M327-L336 HydrophobicContact CE-CD1 3.9Å; M327-L377 HydrophobicContact CB-CD2 4.41Å; M327-L377 HydrophobicContact CE-CD2 4.39Å
328	I	94.7	Very high	94.3	Very high	49 Å²	49	42 Å²	42	25%	0.251	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.9	-44.8	-179.4	-61.8	174.6	0	0	0	110.2	P326 C330 G331 T333 T382 T383 L386	P326-I328 VanDerWaalsContact C-N 3.34Å; P326-I328 PolarHBondContact O-N 3.43Å; I328-C330 VanDerWaalsContact C-N 3.34Å; I328-C330 PolarHBondContact O-N 2.9Å; I328-G331 VanDerWaalsContact O-CA 3.32Å; I328-G331 WeakPolarHBondContact O-CA 3.3Å; I328-G331 PolarHBondContact O-N 3.21Å; I328-T333 HydrophobicContact CG1-CG2 4.48Å; I328-T382 WeakPolarHBondContact CD1-OG1 3.4Å; I328-T383 HydrophobicContact CD1-CG2 3.67Å; I328-T383 HydrophobicContact CG1-CG2 4.12Å; I328-L386 HydrophobicContact CG2-CD1 4.3Å
329	E	94.3	Very high	94.3	Very high	142 Å²	142	40.1 Å²	40.1	66%	0.664	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.9	-38	-177.1	-63.1	82.4	173.2	0	0	111.8	L283 P326 G331	L283-E329 HydrophobicContact CD1-CB 4.34Å; P326-E329 WeakPolarHBondContact CA-OE2 3.49Å; P326-E329 HydrophobicContact CB-CB 4.23Å; P326-E329 WeakPolarHBondContact CB-OE2 3.43Å; E329-G331 PolarHBondContact O-N 3.11Å
330	C	94.9	Very high	94.3	Very high	6 Å²	6	40.2 Å²	40.2	4%	0.041	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.7	-8.3	172.5	67.9	0	0	0	0	113.2	L283 L286 L287 K290 P326 M327 I328 F332	L283-C330 HydrophobicContact CD1-CB 3.82Å; L286-C330 HydrophobicContact CB-CB 4.35Å; L287-C330 HydrophobicContact CD2-CB 3.78Å; L287-C330 HydrophobicContact CG-CB 3.98Å; K290-C330 WeakPolarHBondContact CD-O 3.43Å; K290-C330 PolarHBondContact NZ-O 2.95Å; P326-C330 PolarHBondContact O-N 2.9Å; P326-C330 PolarHBondContact O-SG 3.12Å; M327-C330 PolarHBondContact O-SG 3.44Å; I328-C330 VanDerWaalsContact C-N 3.34Å; I328-C330 PolarHBondContact O-N 2.9Å; C330-F332 PolarHBondContact O-N 3.45Å; C330-F332 WeakPolarHBondContact SG-CB 3.48Å
331	G	95.3	Very high	94.3	Very high	21 Å²	21	40 Å²	40	22%	0.216	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	73	10.5	-177.8	0	0	0	0	0	114.4	I328 E329 R334 D335	I328-G331 VanDerWaalsContact O-CA 3.32Å; I328-G331 WeakPolarHBondContact O-CA 3.3Å; I328-G331 PolarHBondContact O-N 3.21Å; E329-G331 PolarHBondContact O-N 3.11Å; G331-R334 PolarHBondContact O-N 3.32Å; G331-D335 PolarHBondContact O-N 2.95Å
332	F	96.7	Very high	94.2	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-70	-38.1	-178.1	-161.9	179.2	0	0	0	111.2	L289 K290 F293 T316 M327 C330 R334 D335 L336	L289-F332 HydrophobicContact CB-CE1 4.12Å; K290-F332 HydrophobicContact CB-CB 4.09Å; K290-F332 HydrophobicContact CB-CD1 3.8Å; K290-F332 HydrophobicContact CB-CD2 3.92Å; K290-F332 HydrophobicContact CB-CE1 4.13Å; K290-F332 HydrophobicContact CB-CE2 4.27Å; K290-F332 HydrophobicContact CB-CG 3.69Å; K290-F332 HydrophobicContact CB-CZ 4.37Å; K290-F332 HydrophobicContact CD-CB 4.1Å; K290-F332 HydrophobicContact CD-CG 4.47Å; K290-F332 HydrophobicContact CG-CB 4.03Å; K290-F332 HydrophobicContact CG-CD1 4.47Å; K290-F332 HydrophobicContact CG-CD2 3.74Å; K290-F332 HydrophobicContact CG-CE2 4.31Å; K290-F332 HydrophobicContact CG-CG 3.85Å; F293-F332 HydrophobicContact CB-CE2 4.2Å; F293-F332 HydrophobicContact CB-CZ 3.89Å; F293-F332 AromaticContact CD1-CE2 3.77Å; F293-F332 HydrophobicContact CD1-CE2 3.77Å; F293-F332 HydrophobicContact CD1-CZ 4.16Å; F293-F332 HydrophobicContact CG-CE2 4.2Å; F293-F332 HydrophobicContact CG-CZ 4.11Å; T316-F332 HydrophobicContact CG2-CD1 3.88Å; T316-F332 HydrophobicContact CG2-CE1 3.31Å; T316-F332 HydrophobicContact CG2-CZ 3.83Å; M327-F332 HydrophobicContact CE-CB 4.25Å; M327-F332 HydrophobicContact CE-CD1 3.94Å; M327-F332 HydrophobicContact CE-CG 4.2Å; M327-F332 PolarHBondContact O-N 2.95Å; C330-F332 PolarHBondContact O-N 3.45Å; C330-F332 WeakPolarHBondContact SG-CB 3.48Å; F332-R334 VanDerWaalsContact C-N 3.28Å; F332-R334 PolarHBondContact O-N 3.18Å; F332-D335 PolarHBondContact O-N 3.18Å; F332-D335 VanDerWaalsContact O-N 3.12Å; F332-L336 HydrophobicContact CD2-CD1 3.77Å; F332-L336 HydrophobicContact CD2-CD2 4.2Å; F332-L336 HydrophobicContact CD2-CG 3.62Å; F332-L336 HydrophobicContact CE2-CD1 3.94Å; F332-L336 HydrophobicContact CE2-CD2 3.68Å; F332-L336 HydrophobicContact CE2-CG 3.64Å; F332-L336 HydrophobicContact CG-CD1 4.1Å; F332-L336 HydrophobicContact CG-CG 4.43Å; F332-L336 HydrophobicContact CZ-CD1 4.43Å; F332-L336 HydrophobicContact CZ-CD2 4.3Å; F332-L336 HydrophobicContact CZ-CG 4.49Å; F332-L336 WeakPolarHBondContact O-CG 3.46Å; F332-L336 PolarHBondContact O-N 3.35Å
333	T	96.8	Very high	94.1	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-52.6	-45	174.1	-61.8	0	0	0	0	112.3	M327 I328 D335 L336 I337 L377 T383 L386	M327-T333 WeakPolarHBondContact CB-OG1 3.36Å; M327-T333 PolarHBondContact O-N 2.97Å; M327-T333 VanDerWaalsContact O-N 3.11Å; M327-T333 PolarHBondContact O-OG1 3.27Å; I328-T333 HydrophobicContact CG1-CG2 4.48Å; T333-D335 PolarHBondContact O-N 3.3Å; T333-L336 PolarHBondContact O-N 3.48Å; T333-I337 HydrophobicContact CG2-CD1 3.71Å; T333-I337 HydrophobicContact CG2-CG1 4.48Å; T333-I337 VanDerWaalsContact O-CG1 3.27Å; T333-I337 WeakPolarHBondContact O-CG1 3.48Å; T333-I337 PolarHBondContact O-N 3.37Å; T333-L377 HydrophobicContact CG2-CD1 4.16Å; T333-L377 HydrophobicContact CG2-CD2 4.32Å; T333-T383 HydrophobicContact CG2-CG2 4.09Å; T333-L386 HydrophobicContact CG2-CD1 3.78Å
334	R	95.7	Very high	94.2	Very high	172 Å²	172	30.8 Å²	30.8	65%	0.649	17%	0.167	S	C	*	.	H	α-helix	trans	-63.6	-42.5	179.5	-173.9	179.7	-176.5	179.6	3.6	112.2	G331 F332 L338	G331-R334 PolarHBondContact O-N 3.32Å; F332-R334 VanDerWaalsContact C-N 3.28Å; F332-R334 PolarHBondContact O-N 3.18Å; R334-L338 WeakPolarHBondContact O-CB 3.32Å; R334-L338 PolarHBondContact O-N 2.88Å; R334-L338 VanDerWaalsContact O-N 3.08Å
335	D	95.6	Very high	94.3	Very high	18 Å²	18	29 Å²	29	10%	0.096	15%	0.145	C	C	.	.	H	α-helix	trans	-67.2	-42.8	178.3	-73.7	-10.1	0	0	0	110.9	K290 G331 F332 T333 I337 L338 F339	K290-D335 WeakPolarHBondContact CE-OD2 3.49Å; K290-D335 IonicContact NZ-OD2 3.02Å; G331-D335 PolarHBondContact O-N 2.95Å; F332-D335 PolarHBondContact O-N 3.18Å; F332-D335 VanDerWaalsContact O-N 3.12Å; T333-D335 PolarHBondContact O-N 3.3Å; D335-I337 PolarHBondContact O-N 2.97Å; D335-L338 WeakPolarHBondContact O-CB 3.17Å; D335-L338 PolarHBondContact O-N 3.27Å; D335-F339 HydrophobicContact CB-CD2 4.37Å; D335-F339 HydrophobicContact CB-CE2 4Å; D335-F339 WeakPolarHBondContact O-CB 3.45Å; D335-F339 WeakPolarHBondContact O-CD2 3.42Å; D335-F339 VanDerWaalsContact O-CG 3.25Å; D335-F339 WeakPolarHBondContact O-CG 3.15Å; D335-F339 PolarHBondContact O-N 2.88Å
336	L	97	Very high	93.9	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-62	-43.3	177.1	-70.4	166.3	0	0	0	112.3	F293 L313 T316 M327 F332 T333 F339 A340 L370 I373 L377	F293-L336 HydrophobicContact CD1-CD2 4.35Å; F293-L336 HydrophobicContact CE1-CD2 3.87Å; F293-L336 HydrophobicContact CZ-CD2 4.33Å; L313-L336 HydrophobicContact CD1-CD2 3.62Å; T316-L336 HydrophobicContact CG2-CD1 4.41Å; M327-L336 HydrophobicContact CE-CD1 3.9Å; F332-L336 HydrophobicContact CD2-CD1 3.77Å; F332-L336 HydrophobicContact CD2-CD2 4.2Å; F332-L336 HydrophobicContact CD2-CG 3.62Å; F332-L336 HydrophobicContact CE2-CD1 3.94Å; F332-L336 HydrophobicContact CE2-CD2 3.68Å; F332-L336 HydrophobicContact CE2-CG 3.64Å; F332-L336 HydrophobicContact CG-CD1 4.1Å; F332-L336 HydrophobicContact CG-CG 4.43Å; F332-L336 HydrophobicContact CZ-CD1 4.43Å; F332-L336 HydrophobicContact CZ-CD2 4.3Å; F332-L336 HydrophobicContact CZ-CG 4.49Å; F332-L336 WeakPolarHBondContact O-CG 3.46Å; F332-L336 PolarHBondContact O-N 3.35Å; T333-L336 PolarHBondContact O-N 3.48Å; L336-F339 PolarHBondContact O-N 2.94Å; L336-A340 VanDerWaalsContact O-CB 3.32Å; L336-A340 WeakPolarHBondContact O-CB 3.4Å; L336-A340 PolarHBondContact O-N 3.28Å; L336-L370 HydrophobicContact CD2-CD2 4.34Å; L336-I373 HydrophobicContact CD1-CD1 3.55Å; L336-I373 HydrophobicContact CD1-CG1 4.36Å; L336-I373 HydrophobicContact CD2-CD1 4.37Å; L336-L377 HydrophobicContact CD1-CD1 4.32Å
337	I	96.8	Very high	93.4	Very high	4 Å²	4	39.6 Å²	39.6	2%	0.021	19%	0.192	C	C	.	.	H	α-helix	trans	-63	-42.9	175.8	-69.2	164.9	0	0	0	111	T333 D335 A340 T341 I374 L386 L387 V392	T333-I337 HydrophobicContact CG2-CD1 3.71Å; T333-I337 HydrophobicContact CG2-CG1 4.48Å; T333-I337 VanDerWaalsContact O-CG1 3.27Å; T333-I337 WeakPolarHBondContact O-CG1 3.48Å; T333-I337 PolarHBondContact O-N 3.37Å; D335-I337 PolarHBondContact O-N 2.97Å; I337-A340 PolarHBondContact O-N 3Å; I337-T341 WeakPolarHBondContact O-CG2 3.44Å; I337-T341 PolarHBondContact O-N 3.42Å; I337-T341 PolarHBondContact O-OG1 2.96Å; I337-I374 HydrophobicContact CB-CD1 4.39Å; I337-I374 HydrophobicContact CG1-CD1 3.61Å; I337-L386 HydrophobicContact CD1-CB 3.63Å; I337-L387 HydrophobicContact CD1-CD2 3.74Å; I337-L387 HydrophobicContact CD1-CG 4.27Å; I337-L387 HydrophobicContact CG1-CD2 4Å; I337-V392 HydrophobicContact CG2-CG2 3.76Å
338	L	95.3	Very high	92.7	Very high	22 Å²	22	48 Å²	48	12%	0.115	23%	0.231	C	C	.	.	H	α-helix	trans	-60.3	-47.9	175.2	175.9	67.2	0	0	0	111.1	R334 D335 A340 T341 F342 N349 L351 V352	R334-L338 WeakPolarHBondContact O-CB 3.32Å; R334-L338 PolarHBondContact O-N 2.88Å; R334-L338 VanDerWaalsContact O-N 3.08Å; D335-L338 WeakPolarHBondContact O-CB 3.17Å; D335-L338 PolarHBondContact O-N 3.27Å; L338-A340 VanDerWaalsContact C-N 3.3Å; L338-A340 PolarHBondContact O-N 3.34Å; L338-T341 PolarHBondContact O-N 2.81Å; L338-T341 PolarHBondContact O-OG1 3.14Å; L338-F342 WeakPolarHBondContact O-CB 3.41Å; L338-F342 PolarHBondContact O-N 3.45Å; L338-N349 HydrophobicContact CD1-CB 4.25Å; L338-N349 HydrophobicContact CD2-CB 4.07Å; L338-N349 VanDerWaalsContact CD2-ND2 3.32Å; L338-N349 WeakPolarHBondContact CD2-ND2 3.47Å; L338-L351 HydrophobicContact CD2-CB 4.49Å; L338-L351 HydrophobicContact CD2-CD1 4.42Å; L338-V352 HydrophobicContact CD1-CG1 4.49Å; L338-V352 HydrophobicContact CD1-CG2 4.1Å; L338-V352 HydrophobicContact CD2-CG1 4.15Å; L338-V352 HydrophobicContact CG-CG1 4.04Å
339	F	94.9	Very high	92.3	Very high	0 Å²	0	48.1 Å²	48.1	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-67.7	-28.3	178.8	-64.5	-42.5	0	0	0	113.2	F293 K294 F297 D335 L336 T341 F342 V352 L370	F293-F339 HydrophobicContact CD1-CD2 4.37Å; F293-F339 HydrophobicContact CD1-CE2 4.34Å; F293-F339 AromaticContact CE1-CD2 3.76Å; F293-F339 HydrophobicContact CE1-CD2 3.76Å; F293-F339 HydrophobicContact CE1-CE2 4.15Å; K294-F339 HydrophobicContact CG-CZ 4.37Å; F297-F339 AromaticContact CD1-CD1 3.61Å; F297-F339 HydrophobicContact CD1-CD1 3.61Å; F297-F339 AromaticContact CD1-CE1 3.69Å; F297-F339 HydrophobicContact CD1-CE1 3.69Å; F297-F339 HydrophobicContact CD1-CG 4.07Å; F297-F339 HydrophobicContact CD1-CZ 4.19Å; F297-F339 HydrophobicContact CE1-CB 4.03Å; F297-F339 AromaticContact CE1-CD1 3.28Å; F297-F339 HydrophobicContact CE1-CD1 3.28Å; F297-F339 AromaticContact CE1-CE1 3.84Å; F297-F339 HydrophobicContact CE1-CE1 3.84Å; F297-F339 AromaticContact CE1-CG 3.74Å; F297-F339 HydrophobicContact CE1-CG 3.74Å; F297-F339 HydrophobicContact CE2-CB 4.05Å; F297-F339 HydrophobicContact CE2-CG 4.26Å; F297-F339 HydrophobicContact CG-CD1 4.41Å; F297-F339 HydrophobicContact CG-CE1 4.48Å; F297-F339 HydrophobicContact CG-CG 4.47Å; F297-F339 HydrophobicContact CZ-CB 3.69Å; F297-F339 AromaticContact CZ-CD1 3.9Å; F297-F339 HydrophobicContact CZ-CD1 3.9Å; F297-F339 AromaticContact CZ-CG 3.89Å; F297-F339 HydrophobicContact CZ-CG 3.89Å; D335-F339 HydrophobicContact CB-CD2 4.37Å; D335-F339 HydrophobicContact CB-CE2 4Å; D335-F339 WeakPolarHBondContact O-CB 3.45Å; D335-F339 WeakPolarHBondContact O-CD2 3.42Å; D335-F339 VanDerWaalsContact O-CG 3.25Å; D335-F339 WeakPolarHBondContact O-CG 3.15Å; D335-F339 PolarHBondContact O-N 2.88Å; L336-F339 PolarHBondContact O-N 2.94Å; F339-T341 VanDerWaalsContact C-N 3.31Å; F339-T341 PolarHBondContact O-N 3.42Å; F339-F342 WeakPolarHBondContact O-CD1 3.44Å; F339-F342 VanDerWaalsContact O-CE1 3.24Å; F339-F342 WeakPolarHBondContact O-CE1 3.27Å; F339-V352 HydrophobicContact CD1-CG1 3.93Å; F339-V352 HydrophobicContact CE1-CG1 3.98Å; F339-L370 HydrophobicContact CB-CD1 4.44Å; F339-L370 HydrophobicContact CB-CD2 4.25Å; F339-L370 WeakPolarHBondContact O-CD1 3.36Å
340	A	95.1	Very high	91.9	Very high	3 Å²	3	46.4 Å²	46.4	3%	0.025	23%	0.233	C	C	.	.	H	α-helix	trans	-70.8	-24.9	174.5	0	0	0	0	0	113.2	L336 I337 L338 K367 L370 I374	L336-A340 VanDerWaalsContact O-CB 3.32Å; L336-A340 WeakPolarHBondContact O-CB 3.4Å; L336-A340 PolarHBondContact O-N 3.28Å; I337-A340 PolarHBondContact O-N 3Å; L338-A340 VanDerWaalsContact C-N 3.3Å; L338-A340 PolarHBondContact O-N 3.34Å; A340-K367 PolarHBondContact O-NZ 3.13Å; A340-L370 HydrophobicContact CB-CB 4.09Å; A340-I374 HydrophobicContact CB-CD1 4.22Å; A340-I374 HydrophobicContact CB-CG1 4.07Å
341	T	94.3	Very high	91.4	Very high	8 Å²	8	48.7 Å²	48.7	5%	0.049	25%	0.245	C	C	.	.	H	α-helix	trans	-119.5	-14.7	-167.1	57.5	0	0	0	0	115.4	I337 L338 F339 N343 E344 V345 G390 V392 A395	I337-T341 WeakPolarHBondContact O-CG2 3.44Å; I337-T341 PolarHBondContact O-N 3.42Å; I337-T341 PolarHBondContact O-OG1 2.96Å; L338-T341 PolarHBondContact O-N 2.81Å; L338-T341 PolarHBondContact O-OG1 3.14Å; F339-T341 VanDerWaalsContact C-N 3.31Å; F339-T341 PolarHBondContact O-N 3.42Å; T341-N343 PolarHBondContact O-N 3.03Å; T341-N343 VanDerWaalsContact O-N 3.14Å; T341-E344 PolarHBondContact O-N 3.14Å; T341-E344 VanDerWaalsContact O-N 3.08Å; T341-V345 PolarHBondContact O-N 3.14Å; T341-G390 PolarHBondContact OG1-O 2.8Å; T341-V392 HydrophobicContact CG2-CG2 3.94Å; T341-A395 HydrophobicContact CG2-CB 3.67Å
342	F	91.4	Very high	91	Very high	18 Å²	18	48 Å²	48	8%	0.079	24%	0.237	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62	-25.2	-170.4	78	-76.2	0	0	0	115.6	F297 L338 F339 V352 L355 L357	F297-F342 HydrophobicContact CE1-CE1 4.05Å; F297-F342 HydrophobicContact CE1-CZ 4.25Å; F297-F342 AromaticContact CZ-CE1 3.9Å; F297-F342 HydrophobicContact CZ-CE1 3.9Å; F297-F342 HydrophobicContact CZ-CZ 4.35Å; L338-F342 WeakPolarHBondContact O-CB 3.41Å; L338-F342 PolarHBondContact O-N 3.45Å; F339-F342 WeakPolarHBondContact O-CD1 3.44Å; F339-F342 VanDerWaalsContact O-CE1 3.24Å; F339-F342 WeakPolarHBondContact O-CE1 3.27Å; F342-V352 HydrophobicContact CB-CB 3.79Å; F342-V352 HydrophobicContact CB-CG1 3.86Å; F342-V352 HydrophobicContact CB-CG2 3.88Å; F342-V352 HydrophobicContact CD1-CG1 4.4Å; F342-V352 HydrophobicContact CD2-CB 3.79Å; F342-V352 HydrophobicContact CD2-CG1 4.12Å; F342-V352 HydrophobicContact CG-CB 3.92Å; F342-V352 HydrophobicContact CG-CG1 3.87Å; F342-L355 HydrophobicContact CE2-CB 4.08Å; F342-L355 HydrophobicContact CE2-CD2 3.94Å; F342-L355 HydrophobicContact CE2-CG 4.17Å; F342-L355 HydrophobicContact CZ-CD2 3.8Å; F342-L355 HydrophobicContact CZ-CG 4.33Å; F342-L357 HydrophobicContact CZ-CD2 4.14Å; F342-L357 HydrophobicContact CZ-CG 4Å
343	N	88.1	Confident	90.2	Very high	43 Å²	43	56.4 Å²	56.4	23%	0.23	27%	0.273	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.4	-34.5	178.3	-83.6	2.1	0	0	0	111.5	T341 L357 I409	T341-N343 PolarHBondContact O-N 3.03Å; T341-N343 VanDerWaalsContact O-N 3.14Å; N343-L357 VanDerWaalsContact ND2-CD1 3.25Å; N343-L357 WeakPolarHBondContact ND2-CD1 3.36Å; N343-I409 HydrophobicContact CB-CD1 4.08Å
344	E	89.7	Confident	89.4	Confident	38 Å²	38	61.9 Å²	61.9	18%	0.178	31%	0.311	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.4	-35.4	-173.9	-61.6	72.4	-148.6	0	0	111.2	T341 K367 A395 T398 Y399	T341-E344 PolarHBondContact O-N 3.14Å; T341-E344 VanDerWaalsContact O-N 3.08Å; E344-K367 VanDerWaalsContact OE1-CE 3.24Å; E344-K367 WeakPolarHBondContact OE1-CE 3.33Å; E344-K367 IonicContact OE1-NZ 2.75Å; E344-K367 PolarHBondContact OE1-NZ 3.48Å; E344-K367 IonicContact OE2-NZ 2.84Å; E344-K367 PolarHBondContact OE2-NZ 3.25Å; E344-A395 HydrophobicContact CB-CB 3.9Å; E344-A395 HydrophobicContact CG-CB 4.43Å; E344-T398 HydrophobicContact CB-CG2 3.85Å; E344-T398 HydrophobicContact CG-CG2 4.22Å; E344-T398 WeakPolarHBondContact CG-OG1 3.38Å; E344-Y399 HydrophobicContact CG-CE2 3.79Å; E344-Y399 PolarHBondContact OE1-OH 3.09Å
345	V	89.3	Confident	88.8	Confident	21 Å²	21	55.2 Å²	55.2	13%	0.127	29%	0.288	C	S	.	.	S	Bend	trans	-113	118.4	-176.2	-178.7	0	0	0	0	109.3	T341 S347 K391 L394 A395	T341-V345 PolarHBondContact O-N 3.14Å; V345-S347 PolarHBondContact O-N 3.35Å; V345-K391 HydrophobicContact CG1-CB 4.23Å; V345-K391 HydrophobicContact CG1-CD 3.93Å; V345-K391 HydrophobicContact CG2-CB 4.2Å; V345-L394 HydrophobicContact CG2-CD2 4.45Å; V345-A395 HydrophobicContact CG2-CB 3.81Å
346	K	84.8	Confident	88.1	Confident	213 Å²	213	63.3 Å²	63.3	93%	0.926	32%	0.322	S	S	*	.			trans	-58.2	116.4	175.4	-69.4	-175.9	-179.5	178.3	0	110.1
347	S	84.3	Confident	87.5	Confident	45 Å²	45	64.5 Å²	64.5	32%	0.315	33%	0.329	S	S	.	.			trans	-109.6	139.9	176.2	-176.2	0	0	0	0	110.9	V345 N349	V345-S347 PolarHBondContact O-N 3.35Å; S347-N349 VanDerWaalsContact C-N 3.26Å; S347-N349 VanDerWaalsContact OG-CB 3.3Å; S347-N349 WeakPolarHBondContact OG-CB 3.4Å; S347-N349 PolarHBondContact OG-N 3.48Å; S347-N349 VanDerWaalsContact OG-N 3.14Å
348	Q	82.8	Confident	86.7	Confident	186 Å²	186	66.3 Å²	66.3	87%	0.869	34%	0.342	S	S	*	.			trans	-85.5	-2.4	170.5	-63.2	-173.5	3.6	0	0	112.2	P350	Q348-P350 WeakPolarHBondContact O-CD 3.42Å
349	N	85.3	Confident	86	Confident	50 Å²	50	68.8 Å²	68.8	27%	0.267	36%	0.355	S	S	.	.			trans	-63.9	124.1	-177.4	-170.4	-41.3	0	0	0	110.4	L338 S347 L351 V352 K353	L338-N349 HydrophobicContact CD1-CB 4.25Å; L338-N349 HydrophobicContact CD2-CB 4.07Å; L338-N349 VanDerWaalsContact CD2-ND2 3.32Å; L338-N349 WeakPolarHBondContact CD2-ND2 3.47Å; S347-N349 VanDerWaalsContact C-N 3.26Å; S347-N349 VanDerWaalsContact OG-CB 3.3Å; S347-N349 WeakPolarHBondContact OG-CB 3.4Å; S347-N349 PolarHBondContact OG-N 3.48Å; S347-N349 VanDerWaalsContact OG-N 3.14Å; N349-L351 PolarHBondContact O-N 3.02Å; N349-L351 VanDerWaalsContact O-N 3.09Å; N349-L351 VanDerWaalsContact OD1-CB 3.31Å; N349-L351 WeakPolarHBondContact OD1-CB 3.44Å; N349-L351 WeakPolarHBondContact OD1-CG 3.15Å; N349-L351 PolarHBondContact OD1-N 3.2Å; N349-V352 HydrophobicContact CB-CG2 4.23Å; N349-V352 PolarHBondContact O-N 3.2Å; N349-V352 VanDerWaalsContact O-N 3.14Å; N349-K353 PolarHBondContact O-N 3.39Å
350	P	85.1	Confident	85.7	Confident	107 Å²	107	70.1 Å²	70.1	70%	0.695	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54	-29.6	179.4	-27.1	34.8	0	0	0	114.3	Q348 V352	Q348-P350 WeakPolarHBondContact O-CD 3.42Å; P350-V352 PolarHBondContact O-N 2.97Å
351	L	85.7	Confident	85.4	Confident	53 Å²	53	77 Å²	77	28%	0.277	39%	0.391	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-29.6	-179.3	-66.9	175.7	0	0	0	113.5	L338 N349	L338-L351 HydrophobicContact CD2-CB 4.49Å; L338-L351 HydrophobicContact CD2-CD1 4.42Å; N349-L351 PolarHBondContact O-N 3.02Å; N349-L351 VanDerWaalsContact O-N 3.09Å; N349-L351 VanDerWaalsContact OD1-CB 3.31Å; N349-L351 WeakPolarHBondContact OD1-CB 3.44Å; N349-L351 WeakPolarHBondContact OD1-CG 3.15Å; N349-L351 PolarHBondContact OD1-N 3.2Å
352	V	86.3	Confident	85.4	Confident	8 Å²	8	77.9 Å²	77.9	5%	0.048	39%	0.394	C	S	.	.	T	Hydrogen-bonded Turn	trans	-118.1	-7.7	-173.9	-63	0	0	0	0	113.6	L338 F339 F342 N349 P350 S354 L355	L338-V352 HydrophobicContact CD1-CG1 4.49Å; L338-V352 HydrophobicContact CD1-CG2 4.1Å; L338-V352 HydrophobicContact CD2-CG1 4.15Å; L338-V352 HydrophobicContact CG-CG1 4.04Å; F339-V352 HydrophobicContact CD1-CG1 3.93Å; F339-V352 HydrophobicContact CE1-CG1 3.98Å; F342-V352 HydrophobicContact CB-CB 3.79Å; F342-V352 HydrophobicContact CB-CG1 3.86Å; F342-V352 HydrophobicContact CB-CG2 3.88Å; F342-V352 HydrophobicContact CD1-CG1 4.4Å; F342-V352 HydrophobicContact CD2-CB 3.79Å; F342-V352 HydrophobicContact CD2-CG1 4.12Å; F342-V352 HydrophobicContact CG-CB 3.92Å; F342-V352 HydrophobicContact CG-CG1 3.87Å; N349-V352 HydrophobicContact CB-CG2 4.23Å; N349-V352 PolarHBondContact O-N 3.2Å; N349-V352 VanDerWaalsContact O-N 3.14Å; P350-V352 PolarHBondContact O-N 2.97Å; V352-S354 VanDerWaalsContact C-N 3.26Å; V352-S354 PolarHBondContact O-N 3.35Å; V352-L355 PolarHBondContact O-N 3.44Å; V352-L355 VanDerWaalsContact O-N 3.1Å
353	K	80.9	Confident	85.4	Confident	175 Å²	175	77.3 Å²	77.3	76%	0.761	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.9	-33.6	-173.4	-172.5	176.3	179.3	-179.8	0	114	N349	N349-K353 PolarHBondContact O-N 3.39Å
354	S	78.6	Confident	85.5	Confident	115 Å²	115	75.6 Å²	75.6	80%	0.804	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.7	4.7	178.6	57.3	0	0	0	0	113.5	V352	V352-S354 VanDerWaalsContact C-N 3.26Å; V352-S354 PolarHBondContact O-N 3.35Å
355	L	83.9	Confident	85.7	Confident	33 Å²	33	75.7 Å²	75.7	17%	0.173	38%	0.383	C	S	.	.			trans	-87.8	138.7	-174	-164.7	72.3	0	0	0	110.7	F297 F342 V352	F297-L355 HydrophobicContact CD1-CD2 3.47Å; F297-L355 VanDerWaalsContact CD1-CD2 3.47Å; F297-L355 HydrophobicContact CE1-CD2 3.18Å; F297-L355 HydrophobicContact CZ-CD2 4.34Å; F342-L355 HydrophobicContact CE2-CB 4.08Å; F342-L355 HydrophobicContact CE2-CD2 3.94Å; F342-L355 HydrophobicContact CE2-CG 4.17Å; F342-L355 HydrophobicContact CZ-CD2 3.8Å; F342-L355 HydrophobicContact CZ-CG 4.33Å; V352-L355 PolarHBondContact O-N 3.44Å; V352-L355 VanDerWaalsContact O-N 3.1Å
356	K	80.3	Confident	86	Confident	187 Å²	187	74.7 Å²	74.7	81%	0.813	38%	0.377	S	S	*	.			trans	-138	133.2	172.7	-67.8	-175.5	178.4	-178	0	109.1
357	L	83.8	Confident	86.4	Confident	25 Å²	25	64.5 Å²	64.5	13%	0.131	33%	0.333	C	S	.	.			trans	-73.3	143.4	167.8	-60.9	-174.2	0	0	0	109.7	F297 F342 N343 D363 L366	F297-L357 HydrophobicContact CZ-CD2 4.44Å; F342-L357 HydrophobicContact CZ-CD2 4.14Å; F342-L357 HydrophobicContact CZ-CG 4Å; N343-L357 VanDerWaalsContact ND2-CD1 3.25Å; N343-L357 WeakPolarHBondContact ND2-CD1 3.36Å; L357-D363 HydrophobicContact CB-CB 4.4Å; L357-L366 HydrophobicContact CD2-CD2 4.04Å
358	S	81.4	Confident	86.9	Confident	42 Å²	42	63.5 Å²	63.5	29%	0.294	32%	0.323	S	S	.	.			trans	-88.3	169.4	171.4	72.3	0	0	0	0	110.9	S360 D363 W411	S358-S360 PolarHBondContact O-N 3.43Å; S358-S360 WeakPolarHBondContact OG-CB 3.33Å; S358-S360 PolarHBondContact OG-N 2.92Å; S358-D363 WeakPolarHBondContact CA-OD2 3.35Å; S358-D363 WeakPolarHBondContact CB-OD2 3.29Å; S358-D363 PolarHBondContact N-OD2 2.89Å; S358-D363 WeakPolarHBondContact O-CB 3.42Å; S358-D363 PolarHBondContact OG-OD2 3.34Å; S358-W411 WeakPolarHBondContact O-CH2 3.49Å
359	N	80.3	Confident	87.6	Confident	75 Å²	75	56.1 Å²	56.1	40%	0.401	29%	0.289	S	S	.	.	S	Bend	trans	-83.6	26	171	-167.6	21	0	0	0	112.3	E410 Q415	N359-E410 PolarHBondContact ND2-O 3.1Å; N359-E410 PolarHBondContact OD1-O 3.28Å; N359-Q415 PolarHBondContact OD1-OE1 3.38Å; N359-Q415 VanDerWaalsContact OD1-OE1 3.08Å
360	S	88.3	Confident	88.2	Confident	27 Å²	27	53.7 Å²	53.7	19%	0.189	28%	0.276	C	S	.	.	S	Bend	trans	-73	156.4	175.3	93	0	0	0	0	110.6	S358 E362 D363 F364	S358-S360 PolarHBondContact O-N 3.43Å; S358-S360 WeakPolarHBondContact OG-CB 3.33Å; S358-S360 PolarHBondContact OG-N 2.92Å; S360-E362 VanDerWaalsContact C-N 3.25Å; S360-E362 WeakPolarHBondContact CB-OE2 3.48Å; S360-E362 PolarHBondContact O-N 2.99Å; S360-E362 PolarHBondContact OG-N 3.14Å; S360-E362 PolarHBondContact OG-OE2 3.11Å; S360-D363 PolarHBondContact O-N 3.01Å; S360-D363 PolarHBondContact OG-N 2.84Å; S360-F364 PolarHBondContact O-N 3.33Å; S360-F364 VanDerWaalsContact O-N 3.12Å
361	Y	90	Very high	88.7	Confident	147 Å²	147	48.8 Å²	48.8	58%	0.576	24%	0.244	S	C	*	.	H	α-helix	trans	-61.6	-37.6	177	-177.9	-99.3	0	0	0	111.4	D363 F364 E365	Y361-D363 PolarHBondContact O-N 3.32Å; Y361-F364 HydrophobicContact CD2-CD1 4.39Å; Y361-F364 HydrophobicContact CE2-CD1 4.4Å; Y361-F364 WeakPolarHBondContact O-CB 3.38Å; Y361-F364 PolarHBondContact O-N 2.92Å; Y361-E365 HydrophobicContact CD1-CG 3.97Å; Y361-E365 HydrophobicContact CE1-CG 3.51Å; Y361-E365 HydrophobicContact CE2-CG 4.44Å; Y361-E365 VanDerWaalsContact CZ-OE1 3.22Å; Y361-E365 WeakPolarHBondContact O-CG 3.43Å; Y361-E365 PolarHBondContact O-N 3.22Å; Y361-E365 PolarHBondContact OH-OE1 2.73Å; Y361-E365 VanDerWaalsContact OH-OE1 3.07Å
362	E	92.8	Very high	89.2	Confident	27 Å²	27	50 Å²	50	13%	0.126	25%	0.251	C	S	.	.	H	α-helix	trans	-68.1	-35.5	-179.3	-52.6	70.5	-147.1	0	0	112.3	H303 R306 R309 N310 S360 L366	H303-E362 IonicContact CD2-OE1 2.65Å; H303-E362 PolarHBondContact CD2-OE1 2.99Å; H303-E362 IonicContact NE2-OE1 2.61Å; H303-E362 PolarHBondContact NE2-OE1 2.94Å; H303-E362 VanDerWaalsContact NE2-OE1 3.15Å; R306-E362 HydrophobicContact CB-CB 3.54Å; R306-E362 HydrophobicContact CB-CG 3.95Å; R306-E362 HydrophobicContact CG-CB 4.48Å; R309-E362 PolarHBondContact NH2-O 3.42Å; R309-E362 VanDerWaalsContact NH2-O 3.09Å; N310-E362 PolarHBondContact ND2-O 3.37Å; S360-E362 VanDerWaalsContact C-N 3.25Å; S360-E362 WeakPolarHBondContact CB-OE2 3.48Å; S360-E362 PolarHBondContact O-N 2.99Å; S360-E362 PolarHBondContact OG-N 3.14Å; S360-E362 PolarHBondContact OG-OE2 3.11Å; E362-L366 WeakPolarHBondContact O-CB 3.39Å; E362-L366 PolarHBondContact O-N 3Å
363	D	91.3	Very high	89.7	Confident	6 Å²	6	49.7 Å²	49.7	3%	0.032	25%	0.249	C	C	.	.	H	α-helix	trans	-73.2	-31.9	175.2	-75.7	-12.9	0	0	0	112	R306 R309 L357 S358 S360 Y361 K367 W411	R306-D363 IonicContact NE-OD1 3.15Å; R306-D363 IonicContact NE-OD2 3.05Å; R309-D363 IonicContact CZ-OD1 3.48Å; R309-D363 VanDerWaalsContact CZ-OD1 3.25Å; R309-D363 IonicContact NH1-OD1 2.87Å; R309-D363 PolarHBondContact NH1-OD1 2.86Å; R309-D363 IonicContact NH2-OD1 3.29Å; R309-D363 PolarHBondContact NH2-OD1 3.22Å; L357-D363 HydrophobicContact CB-CB 4.4Å; S358-D363 WeakPolarHBondContact CA-OD2 3.35Å; S358-D363 WeakPolarHBondContact CB-OD2 3.29Å; S358-D363 PolarHBondContact N-OD2 2.89Å; S358-D363 WeakPolarHBondContact O-CB 3.42Å; S358-D363 PolarHBondContact OG-OD2 3.34Å; S360-D363 PolarHBondContact O-N 3.01Å; S360-D363 PolarHBondContact OG-N 2.84Å; Y361-D363 PolarHBondContact O-N 3.32Å; D363-K367 PolarHBondContact O-N 3.49Å; D363-K367 VanDerWaalsContact O-N 3.15Å; D363-W411 HydrophobicContact CB-CH2 4.26Å
364	F	91.5	Very high	90.5	Very high	7 Å²	7	41.5 Å²	41.5	3%	0.031	21%	0.213	C	C	.	.	H	α-helix	trans	-64.1	-49	169.7	169	-109.6	0	0	0	111.5	S360 Y361 L366 K367 K368 W411 Q415 E418 L419	S360-F364 PolarHBondContact O-N 3.33Å; S360-F364 VanDerWaalsContact O-N 3.12Å; Y361-F364 HydrophobicContact CD2-CD1 4.39Å; Y361-F364 HydrophobicContact CE2-CD1 4.4Å; Y361-F364 WeakPolarHBondContact O-CB 3.38Å; Y361-F364 PolarHBondContact O-N 2.92Å; F364-L366 VanDerWaalsContact C-N 3.34Å; F364-L366 PolarHBondContact O-N 3.28Å; F364-K367 PolarHBondContact O-N 2.88Å; F364-K368 HydrophobicContact CE1-CD 4.13Å; F364-K368 VanDerWaalsContact CE1-CE 3.43Å; F364-K368 HydrophobicContact CE2-CD 4.41Å; F364-K368 HydrophobicContact CZ-CD 3.93Å; F364-K368 PolarHBondContact O-N 3.27Å; F364-W411 HydrophobicContact CB-CE3 4.33Å; F364-W411 HydrophobicContact CB-CH2 4.09Å; F364-W411 HydrophobicContact CB-CZ3 3.63Å; F364-W411 HydrophobicContact CD2-CE3 4.44Å; F364-W411 HydrophobicContact CD2-CZ3 4.45Å; F364-Q415 HydrophobicContact CD1-CG 4.39Å; F364-Q415 HydrophobicContact CD2-CB 3.76Å; F364-Q415 HydrophobicContact CD2-CG 3.78Å; F364-Q415 HydrophobicContact CE1-CG 4.36Å; F364-Q415 HydrophobicContact CE2-CB 3.58Å; F364-Q415 HydrophobicContact CE2-CG 3.75Å; F364-Q415 WeakPolarHBondContact CE2-O 3.48Å; F364-Q415 HydrophobicContact CG-CG 4.09Å; F364-Q415 HydrophobicContact CZ-CB 4.24Å; F364-Q415 HydrophobicContact CZ-CG 4.04Å; F364-E418 HydrophobicContact CE2-CB 4.39Å; F364-E418 HydrophobicContact CZ-CB 4.01Å; F364-E418 HydrophobicContact CZ-CG 4Å; F364-L419 HydrophobicContact CD2-CD1 4.3Å; F364-L419 HydrophobicContact CD2-CD2 4.19Å; F364-L419 HydrophobicContact CD2-CG 4.1Å; F364-L419 HydrophobicContact CE2-CD1 4.48Å; F364-L419 HydrophobicContact CE2-CD2 4.07Å; F364-L419 HydrophobicContact CE2-CG 3.85Å
365	E	93.3	Very high	91.4	Very high	40 Å²	40	37.3 Å²	37.3	19%	0.187	18%	0.183	C	C	.	.	H	α-helix	trans	-60.8	-42.1	175.4	-71.5	-54.1	138.3	0	0	112.1	Y361 K367 K368 L369	Y361-E365 HydrophobicContact CD1-CG 3.97Å; Y361-E365 HydrophobicContact CE1-CG 3.51Å; Y361-E365 HydrophobicContact CE2-CG 4.44Å; Y361-E365 VanDerWaalsContact CZ-OE1 3.22Å; Y361-E365 WeakPolarHBondContact O-CG 3.43Å; Y361-E365 PolarHBondContact O-N 3.22Å; Y361-E365 PolarHBondContact OH-OE1 2.73Å; Y361-E365 VanDerWaalsContact OH-OE1 3.07Å; E365-K367 VanDerWaalsContact C-N 3.29Å; E365-K367 PolarHBondContact O-N 3.31Å; E365-K368 WeakPolarHBondContact O-CB 3.14Å; E365-K368 PolarHBondContact O-N 3.2Å; E365-K368 VanDerWaalsContact O-N 3.17Å; E365-K368 WeakPolarHBondContact OE1-CE 3.34Å; E365-K368 IonicContact OE1-NZ 3.74Å; E365-K368 PolarHBondContact OE1-NZ 3.35Å; E365-K368 WeakPolarHBondContact OE2-CE 3.21Å; E365-K368 IonicContact OE2-NZ 3.63Å; E365-K368 PolarHBondContact OE2-NZ 2.84Å; E365-L369 WeakPolarHBondContact O-CG 3.47Å; E365-L369 PolarHBondContact O-N 3.32Å
366	L	95.1	Very high	92	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-53.9	-46.8	174.5	174.4	67.7	0	0	0	111.5	F293 F297 R309 N310 L313 L357 E362 F364 K368 L369 L370	F293-L366 HydrophobicContact CE2-CD1 4.25Å; F293-L366 HydrophobicContact CZ-CD1 4.15Å; F297-L366 HydrophobicContact CD2-CD1 4.24Å; F297-L366 HydrophobicContact CD2-CD2 3.84Å; F297-L366 HydrophobicContact CE2-CD1 3.93Å; F297-L366 HydrophobicContact CE2-CD2 3.19Å; F297-L366 HydrophobicContact CE2-CG 3.96Å; F297-L366 HydrophobicContact CZ-CD2 3.92Å; R309-L366 HydrophobicContact CG-CD1 4.41Å; R309-L366 VanDerWaalsContact NH1-CD2 3.32Å; N310-L366 WeakPolarHBondContact OD1-CB 3.48Å; L313-L366 HydrophobicContact CD2-CD1 3.76Å; L357-L366 HydrophobicContact CD2-CD2 4.04Å; E362-L366 WeakPolarHBondContact O-CB 3.39Å; E362-L366 PolarHBondContact O-N 3Å; F364-L366 VanDerWaalsContact C-N 3.34Å; F364-L366 PolarHBondContact O-N 3.28Å; L366-K368 VanDerWaalsContact C-N 3.3Å; L366-K368 PolarHBondContact O-N 3.32Å; L366-L369 PolarHBondContact O-N 2.93Å; L366-L370 HydrophobicContact CD1-CD1 4.23Å; L366-L370 HydrophobicContact CD1-CG 4.22Å; L366-L370 HydrophobicContact CD2-CD1 4.45Å; L366-L370 HydrophobicContact CG-CD1 3.95Å; L366-L370 HydrophobicContact CG-CG 4.36Å; L366-L370 WeakPolarHBondContact O-CB 3.34Å; L366-L370 WeakPolarHBondContact O-CG 3.44Å; L366-L370 PolarHBondContact O-N 3.45Å
367	K	94	Very high	92.7	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-63.6	-38.3	-177.9	-168.7	64.8	170.7	-175.9	0	111.5	A340 E344 D363 F364 E365 L370 F371 Y399 L419	A340-K367 PolarHBondContact O-NZ 3.13Å; E344-K367 VanDerWaalsContact OE1-CE 3.24Å; E344-K367 WeakPolarHBondContact OE1-CE 3.33Å; E344-K367 IonicContact OE1-NZ 2.75Å; E344-K367 PolarHBondContact OE1-NZ 3.48Å; E344-K367 IonicContact OE2-NZ 2.84Å; E344-K367 PolarHBondContact OE2-NZ 3.25Å; D363-K367 PolarHBondContact O-N 3.49Å; D363-K367 VanDerWaalsContact O-N 3.15Å; F364-K367 PolarHBondContact O-N 2.88Å; E365-K367 VanDerWaalsContact C-N 3.29Å; E365-K367 PolarHBondContact O-N 3.31Å; K367-L370 PolarHBondContact O-N 3.27Å; K367-F371 HydrophobicContact CD-CE1 4.36Å; K367-F371 HydrophobicContact CD-CZ 4.23Å; K367-F371 HydrophobicContact CG-CE2 4.21Å; K367-F371 HydrophobicContact CG-CZ 4.18Å; K367-F371 WeakPolarHBondContact O-CG 3.27Å; K367-F371 PolarHBondContact O-N 2.96Å; K367-F371 VanDerWaalsContact O-N 3.12Å; K367-Y399 WeakPolarHBondContact CE-OH 3.28Å; K367-L419 HydrophobicContact CB-CD2 3.92Å; K367-L419 HydrophobicContact CG-CD1 4.27Å; K367-L419 HydrophobicContact CG-CD2 3.81Å
368	K	94.8	Very high	93.2	Very high	23 Å²	23	27.2 Å²	27.2	10%	0.1	14%	0.138	C	C	.	.	H	α-helix	trans	-63.9	-45.5	172.9	-67.1	-172.2	-70.8	172.7	0	112.2	F364 E365 L366 L370 F371 N372 E418 L419 H422	F364-K368 HydrophobicContact CE1-CD 4.13Å; F364-K368 VanDerWaalsContact CE1-CE 3.43Å; F364-K368 HydrophobicContact CE2-CD 4.41Å; F364-K368 HydrophobicContact CZ-CD 3.93Å; F364-K368 PolarHBondContact O-N 3.27Å; E365-K368 WeakPolarHBondContact O-CB 3.14Å; E365-K368 PolarHBondContact O-N 3.2Å; E365-K368 VanDerWaalsContact O-N 3.17Å; E365-K368 WeakPolarHBondContact OE1-CE 3.34Å; E365-K368 IonicContact OE1-NZ 3.74Å; E365-K368 PolarHBondContact OE1-NZ 3.35Å; E365-K368 WeakPolarHBondContact OE2-CE 3.21Å; E365-K368 IonicContact OE2-NZ 3.63Å; E365-K368 PolarHBondContact OE2-NZ 2.84Å; L366-K368 VanDerWaalsContact C-N 3.3Å; L366-K368 PolarHBondContact O-N 3.32Å; K368-L370 VanDerWaalsContact C-N 3.31Å; K368-L370 PolarHBondContact O-N 3.21Å; K368-F371 PolarHBondContact O-N 3.14Å; K368-N372 PolarHBondContact O-N 3.23Å; K368-E418 HydrophobicContact CD-CG 4.29Å; K368-E418 VanDerWaalsContact CD-OE1 3.29Å; K368-E418 WeakPolarHBondContact CD-OE1 3.3Å; K368-E418 IonicContact NZ-OE1 2.67Å; K368-E418 PolarHBondContact NZ-OE1 3.41Å; K368-L419 HydrophobicContact CG-CD2 3.77Å; K368-H422 WeakPolarHBondContact CD-CE1 3.47Å
369	L	96.9	Very high	93.8	Very high	31 Å²	31	32.7 Å²	32.7	16%	0.162	16%	0.156	C	C	.	.	H	α-helix	trans	-62.2	-38.8	177.2	-69.5	172.8	0	0	0	112.1	N310 L313 V314 E365 L366 N372 I373	N310-L369 HydrophobicContact CB-CD1 3.84Å; L313-L369 HydrophobicContact CD2-CB 3.47Å; L313-L369 VanDerWaalsContact CD2-CB 3.47Å; L313-L369 HydrophobicContact CD2-CD1 4.42Å; L313-L369 HydrophobicContact CG-CB 4.07Å; V314-L369 HydrophobicContact CG2-CD1 3.93Å; V314-L369 HydrophobicContact CG2-CD2 3.72Å; V314-L369 HydrophobicContact CG2-CG 4.5Å; E365-L369 WeakPolarHBondContact O-CG 3.47Å; E365-L369 PolarHBondContact O-N 3.32Å; L366-L369 PolarHBondContact O-N 2.93Å; L369-N372 PolarHBondContact O-N 3.06Å; L369-I373 PolarHBondContact O-N 3.37Å
370	L	97.5	Very high	94.3	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-62.7	-41.1	174.4	-76.1	171.2	0	0	0	111.9	F297 L313 L336 F339 A340 L366 K367 K368 N372 I373 I374	F297-L370 HydrophobicContact CE2-CD1 4.16Å; F297-L370 HydrophobicContact CZ-CD1 4.43Å; L313-L370 HydrophobicContact CD2-CD2 4.01Å; L313-L370 HydrophobicContact CD2-CG 4.05Å; L336-L370 HydrophobicContact CD2-CD2 4.34Å; F339-L370 HydrophobicContact CB-CD1 4.44Å; F339-L370 HydrophobicContact CB-CD2 4.25Å; F339-L370 WeakPolarHBondContact O-CD1 3.36Å; A340-L370 HydrophobicContact CB-CB 4.09Å; L366-L370 HydrophobicContact CD1-CD1 4.23Å; L366-L370 HydrophobicContact CD1-CG 4.22Å; L366-L370 HydrophobicContact CD2-CD1 4.45Å; L366-L370 HydrophobicContact CG-CD1 3.95Å; L366-L370 HydrophobicContact CG-CG 4.36Å; L366-L370 WeakPolarHBondContact O-CB 3.34Å; L366-L370 WeakPolarHBondContact O-CG 3.44Å; L366-L370 PolarHBondContact O-N 3.45Å; K367-L370 PolarHBondContact O-N 3.27Å; K368-L370 VanDerWaalsContact C-N 3.31Å; K368-L370 PolarHBondContact O-N 3.21Å; L370-N372 VanDerWaalsContact C-N 3.35Å; L370-I373 VanDerWaalsContact O-CG2 3.25Å; L370-I373 WeakPolarHBondContact O-CG2 3.47Å; L370-I374 VanDerWaalsContact O-CG1 3.3Å; L370-I374 WeakPolarHBondContact O-CG1 2.91Å; L370-I374 PolarHBondContact O-N 3.35Å
371	F	96.8	Very high	94.3	Very high	4 Å²	4	36.6 Å²	36.6	2%	0.018	18%	0.175	C	C	.	.	H	α-helix	trans	-66.5	-36.7	173.6	-68.9	-20.9	0	0	0	112.9	K367 K368 I374 V375 L396 Y399 L419 H422 A423 T426	K367-F371 HydrophobicContact CD-CE1 4.36Å; K367-F371 HydrophobicContact CD-CZ 4.23Å; K367-F371 HydrophobicContact CG-CE2 4.21Å; K367-F371 HydrophobicContact CG-CZ 4.18Å; K367-F371 WeakPolarHBondContact O-CG 3.27Å; K367-F371 PolarHBondContact O-N 2.96Å; K367-F371 VanDerWaalsContact O-N 3.12Å; K368-F371 PolarHBondContact O-N 3.14Å; F371-I374 PolarHBondContact O-N 2.83Å; F371-V375 PolarHBondContact O-N 3.5Å; F371-L396 HydrophobicContact CD1-CD2 3.88Å; F371-L396 HydrophobicContact CE1-CD2 3.76Å; F371-L396 HydrophobicContact CG-CD2 4.44Å; F371-L396 HydrophobicContact CZ-CD2 4.21Å; F371-Y399 HydrophobicContact CE2-CE2 4.28Å; F371-Y399 HydrophobicContact CZ-CD2 4.1Å; F371-Y399 AromaticContact CZ-CE2 3.58Å; F371-Y399 HydrophobicContact CZ-CE2 3.58Å; F371-Y399 AromaticContact CZ-CZ 4Å; F371-L419 HydrophobicContact CE2-CD2 4.32Å; F371-H422 HydrophobicContact CB-CB 4.45Å; F371-H422 HydrophobicContact CD2-CB 3.76Å; F371-A423 HydrophobicContact CE2-CB 4.17Å; F371-T426 PolarHBondContact O-OG1 3.19Å; F371-T426 VanDerWaalsContact O-OG1 3.13Å
372	N	96.4	Very high	94.4	Very high	79 Å²	79	34 Å²	34	42%	0.422	18%	0.175	S	C	.	.	H	α-helix	trans	-66.4	-45.7	177.6	-173	24	0	0	0	112.1	K368 L369 L370 I374 V375 I376	K368-N372 PolarHBondContact O-N 3.23Å; L369-N372 PolarHBondContact O-N 3.06Å; L370-N372 VanDerWaalsContact C-N 3.35Å; N372-I374 PolarHBondContact O-N 3.34Å; N372-V375 WeakPolarHBondContact O-CB 3.49Å; N372-V375 PolarHBondContact O-N 3.33Å; N372-I376 PolarHBondContact O-N 2.98Å
373	I	96.8	Very high	94.5	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-64.1	-31.3	179.5	-165.9	161.6	0	0	0	111.9	L313 T316 T317 L336 L369 L370 V375 I376 L377	L313-I373 HydrophobicContact CD1-CD1 3.81Å; L313-I373 HydrophobicContact CD1-CG2 4.33Å; T316-I373 HydrophobicContact CG2-CD1 3.96Å; T317-I373 HydrophobicContact CG2-CB 4.45Å; L336-I373 HydrophobicContact CD1-CD1 3.55Å; L336-I373 HydrophobicContact CD1-CG1 4.36Å; L336-I373 HydrophobicContact CD2-CD1 4.37Å; L369-I373 PolarHBondContact O-N 3.37Å; L370-I373 VanDerWaalsContact O-CG2 3.25Å; L370-I373 WeakPolarHBondContact O-CG2 3.47Å; I373-V375 VanDerWaalsContact C-N 3.29Å; I373-V375 PolarHBondContact O-N 2.92Å; I373-I376 WeakPolarHBondContact O-CB 3.47Å; I373-I376 PolarHBondContact O-N 2.95Å; I373-I376 VanDerWaalsContact O-N 3.09Å; I373-L377 HydrophobicContact CG1-CD1 3.97Å; I373-L377 HydrophobicContact CG1-CG 4.13Å; I373-L377 VanDerWaalsContact O-CG 3.25Å; I373-L377 WeakPolarHBondContact O-CG 3.43Å; I373-L377 PolarHBondContact O-N 3.24Å
374	I	97.7	Very high	94.6	Very high	3 Å²	3	34.6 Å²	34.6	2%	0.015	18%	0.178	C	C	.	.	H	α-helix	trans	-59.3	-39.9	172.4	-66.5	-62.2	0	0	0	111.7	I337 A340 L370 F371 N372 I376 L377 C378 L387 V392 T426 V430	I337-I374 HydrophobicContact CB-CD1 4.39Å; I337-I374 HydrophobicContact CG1-CD1 3.61Å; A340-I374 HydrophobicContact CB-CD1 4.22Å; A340-I374 HydrophobicContact CB-CG1 4.07Å; L370-I374 VanDerWaalsContact O-CG1 3.3Å; L370-I374 WeakPolarHBondContact O-CG1 2.91Å; L370-I374 PolarHBondContact O-N 3.35Å; F371-I374 PolarHBondContact O-N 2.83Å; N372-I374 PolarHBondContact O-N 3.34Å; I374-I376 VanDerWaalsContact C-N 3.27Å; I374-I376 PolarHBondContact O-N 3.45Å; I374-L377 PolarHBondContact O-N 2.96Å; I374-C378 WeakPolarHBondContact O-CB 3.4Å; I374-C378 PolarHBondContact O-N 2.96Å; I374-L387 HydrophobicContact CD1-CD2 4.19Å; I374-L387 HydrophobicContact CG2-CD2 4.17Å; I374-V392 HydrophobicContact CG2-CG1 4.07Å; I374-T426 HydrophobicContact CB-CG2 4.13Å; I374-T426 HydrophobicContact CG2-CG2 3.77Å; I374-V430 HydrophobicContact CG2-CG2 3.72Å
375	V	96.6	Very high	94.9	Very high	28 Å²	28	39.5 Å²	39.5	17%	0.17	20%	0.201	C	C	.	.	H	α-helix	trans	-64.9	-31.9	176	177.1	0	0	0	0	111.9	F371 N372 I373 C378 T426	F371-V375 PolarHBondContact O-N 3.5Å; N372-V375 WeakPolarHBondContact O-CB 3.49Å; N372-V375 PolarHBondContact O-N 3.33Å; I373-V375 VanDerWaalsContact C-N 3.29Å; I373-V375 PolarHBondContact O-N 2.92Å; V375-C378 PolarHBondContact O-SG 3.28Å; V375-T426 HydrophobicContact CG2-CG2 3.86Å
376	I	96.1	Very high	95	Very high	19 Å²	19	39.4 Å²	39.4	10%	0.097	20%	0.202	C	C	.	.	H	α-helix	trans	-73.4	-48	175.1	-59.3	-54	0	0	0	110.4	T317 A320 Q321 N372 I373 I374 C378 K379	T317-I376 HydrophobicContact CG2-CG1 3.99Å; A320-I376 HydrophobicContact CB-CG2 3.98Å; A320-I376 WeakPolarHBondContact O-CG2 3.5Å; Q321-I376 HydrophobicContact CG-CD1 4.15Å; Q321-I376 HydrophobicContact CG-CG2 4.08Å; N372-I376 PolarHBondContact O-N 2.98Å; I373-I376 WeakPolarHBondContact O-CB 3.47Å; I373-I376 PolarHBondContact O-N 2.95Å; I373-I376 VanDerWaalsContact O-N 3.09Å; I374-I376 VanDerWaalsContact C-N 3.27Å; I374-I376 PolarHBondContact O-N 3.45Å; I376-C378 PolarHBondContact O-N 3.11Å; I376-K379 WeakPolarHBondContact O-CB 3.44Å; I376-K379 PolarHBondContact O-N 3.24Å
377	L	95	Very high	95.1	Very high	9 Å²	9	39.4 Å²	39.4	5%	0.047	20%	0.202	C	C	.	.	H	α-helix	trans	-64.9	-37.4	-176.5	-67.2	168.7	0	0	0	112.4	A320 M327 T333 L336 I373 I374 K379 D380 T383	A320-L377 HydrophobicContact CB-CD2 4.46Å; M327-L377 HydrophobicContact CB-CD2 4.41Å; M327-L377 HydrophobicContact CE-CD2 4.39Å; T333-L377 HydrophobicContact CG2-CD1 4.16Å; T333-L377 HydrophobicContact CG2-CD2 4.32Å; L336-L377 HydrophobicContact CD1-CD1 4.32Å; I373-L377 HydrophobicContact CG1-CD1 3.97Å; I373-L377 HydrophobicContact CG1-CG 4.13Å; I373-L377 VanDerWaalsContact O-CG 3.25Å; I373-L377 WeakPolarHBondContact O-CG 3.43Å; I373-L377 PolarHBondContact O-N 3.24Å; I374-L377 PolarHBondContact O-N 2.96Å; L377-K379 PolarHBondContact O-N 2.72Å; L377-K379 VanDerWaalsContact O-N 3.09Å; L377-D380 PolarHBondContact O-N 3.25Å; L377-D380 VanDerWaalsContact O-N 3.1Å; L377-T383 HydrophobicContact CB-CG2 4.5Å; L377-T383 WeakPolarHBondContact O-CG2 3.42Å; L377-T383 PolarHBondContact O-OG1 3.43Å
378	C	94.7	Very high	95.3	Very high	5 Å²	5	41.5 Å²	41.5	3%	0.034	21%	0.213	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.2	-11.1	-178.2	76.6	0	0	0	0	114.3	I374 V375 I376 D380 L387 V430 L433	I374-C378 WeakPolarHBondContact O-CB 3.4Å; I374-C378 PolarHBondContact O-N 2.96Å; V375-C378 PolarHBondContact O-SG 3.28Å; I376-C378 PolarHBondContact O-N 3.11Å; C378-D380 PolarHBondContact O-N 3Å; C378-L387 HydrophobicContact CB-CD1 3.78Å; C378-V430 HydrophobicContact CB-CG2 3.99Å; C378-L433 HydrophobicContact CB-CD1 4.01Å; C378-L433 WeakPolarHBondContact O-CD1 3.49Å
379	K	93.2	Very high	95.3	Very high	156 Å²	156	45.4 Å²	45.4	68%	0.678	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	-69	-23.5	173.2	-64.4	179.6	-179.9	179.7	0	112.6	I376 L377	I376-K379 WeakPolarHBondContact O-CB 3.44Å; I376-K379 PolarHBondContact O-N 3.24Å; L377-K379 PolarHBondContact O-N 2.72Å; L377-K379 VanDerWaalsContact O-N 3.09Å
380	D	90.7	Very high	95.2	Very high	68 Å²	68	44.7 Å²	44.7	36%	0.364	23%	0.234	S	C	.	.	S	Bend	trans	-91.8	112.3	171.8	179.7	-2.6	0	0	0	109.4	L377 C378 T382 T383	L377-D380 PolarHBondContact O-N 3.25Å; L377-D380 VanDerWaalsContact O-N 3.1Å; C378-D380 PolarHBondContact O-N 3Å; D380-T382 PolarHBondContact O-N 3.17Å; D380-T382 VanDerWaalsContact O-N 3.11Å; D380-T382 WeakPolarHBondContact OD1-CB 3.45Å; D380-T382 WeakPolarHBondContact OD1-CG2 3.38Å; D380-T382 PolarHBondContact OD1-N 3.49Å; D380-T382 PolarHBondContact OD1-OG1 2.94Å; D380-T382 PolarHBondContact OD2-OG1 3.18Å; D380-T383 HydrophobicContact CB-CG2 4.11Å; D380-T383 WeakPolarHBondContact O-CB 3.43Å; D380-T383 PolarHBondContact O-N 2.71Å; D380-T383 PolarHBondContact O-OG1 3.1Å
381	L	89.8	Confident	95.1	Very high	116 Å²	116	50.3 Å²	50.3	61%	0.607	26%	0.259	S	S	*	.	G	3₁₀ helix	trans	-59.8	-22.9	-177.9	-62.1	177.2	0	0	0	112.8	T383 I384 L433	L381-T383 PolarHBondContact O-N 2.96Å; L381-I384 HydrophobicContact CB-CD1 4.15Å; L381-I384 HydrophobicContact CD2-CD1 3.71Å; L381-I384 WeakPolarHBondContact O-CB 3.46Å; L381-I384 VanDerWaalsContact O-CG1 3.27Å; L381-I384 WeakPolarHBondContact O-CG1 3.49Å; L381-I384 PolarHBondContact O-N 3.48Å; L381-L433 HydrophobicContact CD2-CD2 4.24Å
382	T	91.3	Very high	95.1	Very high	94 Å²	94	50.3 Å²	50.3	58%	0.577	26%	0.259	S	S	*	.	G	3₁₀ helix	trans	-68.9	-15.8	176.7	66.7	0	0	0	0	112.7	I328 D380	I328-T382 WeakPolarHBondContact CD1-OG1 3.4Å; D380-T382 PolarHBondContact O-N 3.17Å; D380-T382 VanDerWaalsContact O-N 3.11Å; D380-T382 WeakPolarHBondContact OD1-CB 3.45Å; D380-T382 WeakPolarHBondContact OD1-CG2 3.38Å; D380-T382 PolarHBondContact OD1-N 3.49Å; D380-T382 PolarHBondContact OD1-OG1 2.94Å; D380-T382 PolarHBondContact OD2-OG1 3.18Å
383	T	94.1	Very high	95.2	Very high	2 Å²	2	46.7 Å²	46.7	1%	0.012	24%	0.239	C	C	.	.	G	3₁₀ helix	trans	-80.3	-13.4	174.9	68.8	0	0	0	0	113.9	I328 T333 L377 D380 L381 Q385 L386 L387	I328-T383 HydrophobicContact CD1-CG2 3.67Å; I328-T383 HydrophobicContact CG1-CG2 4.12Å; T333-T383 HydrophobicContact CG2-CG2 4.09Å; L377-T383 HydrophobicContact CB-CG2 4.5Å; L377-T383 WeakPolarHBondContact O-CG2 3.42Å; L377-T383 PolarHBondContact O-OG1 3.43Å; D380-T383 HydrophobicContact CB-CG2 4.11Å; D380-T383 WeakPolarHBondContact O-CB 3.43Å; D380-T383 PolarHBondContact O-N 2.71Å; D380-T383 PolarHBondContact O-OG1 3.1Å; L381-T383 PolarHBondContact O-N 2.96Å; T383-Q385 PolarHBondContact O-N 2.89Å; T383-L386 WeakPolarHBondContact O-CA 3.38Å; T383-L386 WeakPolarHBondContact O-CB 3.28Å; T383-L386 PolarHBondContact O-N 2.88Å; T383-L387 WeakPolarHBondContact O-CG 3.37Å; T383-L387 PolarHBondContact O-N 3.43Å
384	I	95.1	Very high	95.2	Very high	43 Å²	43	49.8 Å²	49.8	22%	0.221	26%	0.256	C	S	.	.	H	α-helix	trans	-52.5	-49.9	-173.2	-75	174.8	0	0	0	111.7	L381 L386 L387 I388 L434	L381-I384 HydrophobicContact CB-CD1 4.15Å; L381-I384 HydrophobicContact CD2-CD1 3.71Å; L381-I384 WeakPolarHBondContact O-CB 3.46Å; L381-I384 VanDerWaalsContact O-CG1 3.27Å; L381-I384 WeakPolarHBondContact O-CG1 3.49Å; L381-I384 PolarHBondContact O-N 3.48Å; I384-L386 VanDerWaalsContact C-N 3.27Å; I384-L386 PolarHBondContact O-N 3.43Å; I384-L387 WeakPolarHBondContact O-CB 3.44Å; I384-L387 PolarHBondContact O-N 3.43Å; I384-I388 HydrophobicContact CG2-CD1 3.9Å; I384-I388 WeakPolarHBondContact O-CG1 3.5Å; I384-I388 PolarHBondContact O-N 2.94Å; I384-L434 HydrophobicContact CG2-CD2 3.75Å
385	Q	96.1	Very high	95.1	Very high	109 Å²	109	49.7 Å²	49.7	51%	0.509	26%	0.256	S	S	.	.	H	α-helix	trans	-60.8	-36.9	179.9	-172.5	60.5	46.6	0	0	112.4	T383 L387 I388 D389	T383-Q385 PolarHBondContact O-N 2.89Å; Q385-L387 VanDerWaalsContact C-N 3.33Å; Q385-I388 PolarHBondContact O-N 3.41Å; Q385-D389 PolarHBondContact NE2-OD1 3.37Å; Q385-D389 WeakPolarHBondContact O-CB 3.3Å; Q385-D389 VanDerWaalsContact O-CG 3.23Å; Q385-D389 PolarHBondContact O-N 3.2Å
386	L	96.6	Very high	95.1	Very high	39 Å²	39	48.6 Å²	48.6	20%	0.204	25%	0.249	C	C	.	.	H	α-helix	trans	-68.4	-34.8	177.7	-61.3	175.5	0	0	0	111.6	I328 T333 I337 T383 I384 G390	I328-L386 HydrophobicContact CG2-CD1 4.3Å; T333-L386 HydrophobicContact CG2-CD1 3.78Å; I337-L386 HydrophobicContact CD1-CB 3.63Å; T383-L386 WeakPolarHBondContact O-CA 3.38Å; T383-L386 WeakPolarHBondContact O-CB 3.28Å; T383-L386 PolarHBondContact O-N 2.88Å; I384-L386 VanDerWaalsContact C-N 3.27Å; I384-L386 PolarHBondContact O-N 3.43Å; L386-G390 PolarHBondContact O-N 2.92Å
387	L	97.3	Very high	95	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-68.7	-39.1	175.5	-62	170.3	0	0	0	111.6	I337 I374 C378 T383 I384 Q385 K391 V392 V430 L434	I337-L387 HydrophobicContact CD1-CD2 3.74Å; I337-L387 HydrophobicContact CD1-CG 4.27Å; I337-L387 HydrophobicContact CG1-CD2 4Å; I374-L387 HydrophobicContact CD1-CD2 4.19Å; I374-L387 HydrophobicContact CG2-CD2 4.17Å; C378-L387 HydrophobicContact CB-CD1 3.78Å; T383-L387 WeakPolarHBondContact O-CG 3.37Å; T383-L387 PolarHBondContact O-N 3.43Å; I384-L387 WeakPolarHBondContact O-CB 3.44Å; I384-L387 PolarHBondContact O-N 3.43Å; Q385-L387 VanDerWaalsContact C-N 3.33Å; L387-K391 PolarHBondContact O-N 2.86Å; L387-V392 HydrophobicContact CB-CG2 4.26Å; L387-V392 HydrophobicContact CD2-CG2 3.85Å; L387-V392 WeakPolarHBondContact O-CG2 3.38Å; L387-V392 PolarHBondContact O-N 3.42Å; L387-V430 HydrophobicContact CD1-CG1 4.31Å; L387-L434 HydrophobicContact CB-CD1 3.85Å
388	I	96.9	Very high	94.9	Very high	44 Å²	44	49.3 Å²	49.3	23%	0.226	25%	0.254	C	S	.	.	H	α-helix	trans	-62.3	-54	173.7	-65.5	171.2	0	0	0	110.2	I384 Q385 G390 K391 L434 E437	I384-I388 HydrophobicContact CG2-CD1 3.9Å; I384-I388 WeakPolarHBondContact O-CG1 3.5Å; I384-I388 PolarHBondContact O-N 2.94Å; Q385-I388 PolarHBondContact O-N 3.41Å; I388-G390 PolarHBondContact O-N 3.29Å; I388-K391 WeakPolarHBondContact O-CA 3.27Å; I388-K391 PolarHBondContact O-N 2.95Å; I388-L434 HydrophobicContact CD1-CD2 3.91Å; I388-L434 HydrophobicContact CG1-CD2 3.49Å; I388-L434 VanDerWaalsContact CG1-CD2 3.49Å; I388-E437 WeakPolarHBondContact CD1-OE1 3.45Å; I388-E437 HydrophobicContact CG1-CG 4.29Å; I388-E437 WeakPolarHBondContact CG1-OE1 3.44Å; I388-E437 HydrophobicContact CG2-CG 4.34Å; I388-E437 VanDerWaalsContact CG2-OE1 3.27Å; I388-E437 WeakPolarHBondContact CG2-OE1 3.45Å
389	D	94.9	Very high	94.7	Very high	105 Å²	105	49.4 Å²	49.4	56%	0.561	25%	0.254	S	S	*	.	H	α-helix	trans	-59.6	-37.1	179.8	-71.5	-7.1	0	0	0	111.7	Q385 K391	Q385-D389 PolarHBondContact NE2-OD1 3.37Å; Q385-D389 WeakPolarHBondContact O-CB 3.3Å; Q385-D389 VanDerWaalsContact O-CG 3.23Å; Q385-D389 PolarHBondContact O-N 3.2Å; D389-K391 PolarHBondContact O-N 3.16Å
390	G	94.8	Very high	94.6	Very high	15 Å²	15	42.2 Å²	42.2	16%	0.155	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.4	-8	174.6	0	0	0	0	0	114.7	T341 L386 I388 V392	T341-G390 PolarHBondContact OG1-O 2.8Å; L386-G390 PolarHBondContact O-N 2.92Å; I388-G390 PolarHBondContact O-N 3.29Å; G390-V392 PolarHBondContact O-N 3.41Å
391	K	96.5	Very high	94.4	Very high	119 Å²	119	42.5 Å²	42.5	52%	0.517	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	51.7	41.9	-177	-56.7	-175.9	-179.2	-179.2	0	112.5	V345 L387 I388 D389 I393 L394 A395	V345-K391 HydrophobicContact CG1-CB 4.23Å; V345-K391 HydrophobicContact CG1-CD 3.93Å; V345-K391 HydrophobicContact CG2-CB 4.2Å; L387-K391 PolarHBondContact O-N 2.86Å; I388-K391 WeakPolarHBondContact O-CA 3.27Å; I388-K391 PolarHBondContact O-N 2.95Å; D389-K391 PolarHBondContact O-N 3.16Å; K391-I393 VanDerWaalsContact C-N 3.32Å; K391-I393 PolarHBondContact O-N 3.27Å; K391-L394 HydrophobicContact CB-CB 4.25Å; K391-L394 HydrophobicContact CD-CD2 4.33Å; K391-L394 WeakPolarHBondContact O-CB 3.49Å; K391-L394 PolarHBondContact O-N 3.34Å; K391-L394 VanDerWaalsContact O-N 3.16Å; K391-A395 PolarHBondContact O-N 3.04Å
392	V	97.4	Very high	94.1	Very high	3 Å²	3	43 Å²	43	2%	0.018	22%	0.218	C	C	.	.	H	α-helix	trans	-58.1	-43.4	-173.6	171.3	0	0	0	0	111.8	I337 T341 I374 L387 G390 L394 A395 L396 V430	I337-V392 HydrophobicContact CG2-CG2 3.76Å; T341-V392 HydrophobicContact CG2-CG2 3.94Å; I374-V392 HydrophobicContact CG2-CG1 4.07Å; L387-V392 HydrophobicContact CB-CG2 4.26Å; L387-V392 HydrophobicContact CD2-CG2 3.85Å; L387-V392 WeakPolarHBondContact O-CG2 3.38Å; L387-V392 PolarHBondContact O-N 3.42Å; G390-V392 PolarHBondContact O-N 3.41Å; V392-L394 PolarHBondContact O-N 2.88Å; V392-A395 WeakPolarHBondContact O-CB 3.5Å; V392-A395 PolarHBondContact O-N 3.31Å; V392-L396 HydrophobicContact CG1-CD1 3.68Å; V392-L396 HydrophobicContact CG1-CG 4.26Å; V392-L396 VanDerWaalsContact O-CG 3.3Å; V392-L396 WeakPolarHBondContact O-CG 3.35Å; V392-L396 PolarHBondContact O-N 3.19Å; V392-V430 HydrophobicContact CG1-CG1 4.26Å
393	I	97.8	Very high	93.2	Very high	3 Å²	3	40.8 Å²	40.8	2%	0.015	21%	0.205	C	C	.	.	H	α-helix	trans	-58.9	-47.3	177.9	-62.8	-60.1	0	0	0	111.7	K391 A395 L396 F397 L427 V430 A431 L434 E437 C441	K391-I393 VanDerWaalsContact C-N 3.32Å; K391-I393 PolarHBondContact O-N 3.27Å; I393-A395 VanDerWaalsContact C-N 3.33Å; I393-A395 PolarHBondContact O-N 3.2Å; I393-L396 PolarHBondContact O-N 2.72Å; I393-F397 HydrophobicContact CG2-CD2 3.58Å; I393-F397 HydrophobicContact CG2-CE2 3.53Å; I393-F397 VanDerWaalsContact O-CD2 3.29Å; I393-F397 WeakPolarHBondContact O-CD2 3.43Å; I393-F397 PolarHBondContact O-N 2.83Å; I393-L427 HydrophobicContact CD1-CD2 3.86Å; I393-L427 HydrophobicContact CG2-CD2 4.48Å; I393-V430 HydrophobicContact CD1-CB 4.41Å; I393-V430 HydrophobicContact CD1-CG1 3.93Å; I393-A431 HydrophobicContact CD1-CB 4.09Å; I393-L434 HydrophobicContact CD1-CB 4.23Å; I393-L434 HydrophobicContact CD1-CD1 4.21Å; I393-L434 HydrophobicContact CG1-CB 3.95Å; I393-L434 HydrophobicContact CG1-CD1 3.84Å; I393-E437 HydrophobicContact CB-CB 4.27Å; I393-E437 HydrophobicContact CG1-CB 4.09Å; I393-C441 HydrophobicContact CG2-CB 4.33Å
394	L	96.1	Very high	91.9	Very high	65 Å²	65	47 Å²	47	34%	0.34	23%	0.234	S	C	.	.	H	α-helix	trans	-61.3	-43.1	177.9	178.7	62.9	0	0	0	111.5	V345 K391 V392 F397 T398	V345-L394 HydrophobicContact CG2-CD2 4.45Å; K391-L394 HydrophobicContact CB-CB 4.25Å; K391-L394 HydrophobicContact CD-CD2 4.33Å; K391-L394 WeakPolarHBondContact O-CB 3.49Å; K391-L394 PolarHBondContact O-N 3.34Å; K391-L394 VanDerWaalsContact O-N 3.16Å; V392-L394 PolarHBondContact O-N 2.88Å; L394-F397 PolarHBondContact O-N 2.77Å; L394-T398 WeakPolarHBondContact O-CG2 3.26Å; L394-T398 PolarHBondContact O-N 2.93Å
395	A	95.3	Very high	90	Very high	2 Å²	2	56.8 Å²	56.8	2%	0.017	27%	0.268	C	S	.	.	H	α-helix	trans	-61	-48.9	178.4	0	0	0	0	0	111.5	T341 E344 V345 K391 V392 I393 F397 T398	T341-A395 HydrophobicContact CG2-CB 3.67Å; E344-A395 HydrophobicContact CB-CB 3.9Å; E344-A395 HydrophobicContact CG-CB 4.43Å; V345-A395 HydrophobicContact CG2-CB 3.81Å; K391-A395 PolarHBondContact O-N 3.04Å; V392-A395 WeakPolarHBondContact O-CB 3.5Å; V392-A395 PolarHBondContact O-N 3.31Å; I393-A395 VanDerWaalsContact C-N 3.33Å; I393-A395 PolarHBondContact O-N 3.2Å; A395-F397 PolarHBondContact O-N 2.77Å; A395-T398 WeakPolarHBondContact O-CB 3.45Å; A395-T398 WeakPolarHBondContact O-CG2 3.49Å; A395-T398 PolarHBondContact O-N 3.37Å; A395-T398 VanDerWaalsContact O-N 3.13Å; A395-T398 PolarHBondContact O-OG1 3.08Å
396	L	96.7	Very high	87.9	Confident	4 Å²	4	55.3 Å²	55.3	2%	0.021	26%	0.264	C	S	.	.	H	α-helix	trans	-64.8	-39.4	-179.4	-65.1	167.6	0	0	0	111.8	F371 V392 I393 T398 Y399 A423 T426 L427	F371-L396 HydrophobicContact CD1-CD2 3.88Å; F371-L396 HydrophobicContact CE1-CD2 3.76Å; F371-L396 HydrophobicContact CG-CD2 4.44Å; F371-L396 HydrophobicContact CZ-CD2 4.21Å; V392-L396 HydrophobicContact CG1-CD1 3.68Å; V392-L396 HydrophobicContact CG1-CG 4.26Å; V392-L396 VanDerWaalsContact O-CG 3.3Å; V392-L396 WeakPolarHBondContact O-CG 3.35Å; V392-L396 PolarHBondContact O-N 3.19Å; I393-L396 PolarHBondContact O-N 2.72Å; L396-T398 PolarHBondContact O-N 2.89Å; L396-T398 VanDerWaalsContact O-N 3.08Å; L396-Y399 WeakPolarHBondContact O-CB 3.36Å; L396-Y399 PolarHBondContact O-N 3.42Å; L396-A423 HydrophobicContact CD2-CB 4.04Å; L396-T426 HydrophobicContact CD1-CG2 3.74Å; L396-T426 HydrophobicContact CD2-CG2 4.12Å; L396-L427 HydrophobicContact CB-CD1 3.89Å; L396-L427 HydrophobicContact CB-CD2 3.78Å; L396-L427 HydrophobicContact CB-CG 3.6Å; L396-L427 HydrophobicContact CD1-CD2 3.87Å; L396-L427 HydrophobicContact CD1-CG 3.85Å; L396-L427 HydrophobicContact CG-CD2 4.48Å; L396-L427 HydrophobicContact CG-CG 4.33Å
397	F	95.3	Very high	85.9	Confident	2 Å²	2	63.3 Å²	63.3	1%	0.009	30%	0.297	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.4	-9	175.6	-84.6	-54.6	0	0	0	114.6	I393 L394 A395 Y399 V400 L427 Y438 C441 G443 R446 I447	I393-F397 HydrophobicContact CG2-CD2 3.58Å; I393-F397 HydrophobicContact CG2-CE2 3.53Å; I393-F397 VanDerWaalsContact O-CD2 3.29Å; I393-F397 WeakPolarHBondContact O-CD2 3.43Å; I393-F397 PolarHBondContact O-N 2.83Å; L394-F397 PolarHBondContact O-N 2.77Å; A395-F397 PolarHBondContact O-N 2.77Å; F397-Y399 PolarHBondContact O-N 3.44Å; F397-V400 HydrophobicContact CD1-CB 4.01Å; F397-V400 HydrophobicContact CD1-CG2 4.12Å; F397-L427 HydrophobicContact CD1-CD1 4.04Å; F397-L427 HydrophobicContact CD2-CD2 4.46Å; F397-L427 HydrophobicContact CE1-CD1 4.01Å; F397-L427 HydrophobicContact CE2-CD2 4.28Å; F397-L427 HydrophobicContact CG-CD1 4.44Å; F397-L427 HydrophobicContact CZ-CD1 4.42Å; F397-L427 HydrophobicContact CZ-CD2 4.41Å; F397-Y438 AromaticContact CE2-CD2 3.82Å; F397-Y438 HydrophobicContact CE2-CD2 3.82Å; F397-Y438 HydrophobicContact CE2-CE2 4.24Å; F397-Y438 AromaticContact CZ-CD2 3.67Å; F397-Y438 HydrophobicContact CZ-CD2 3.67Å; F397-Y438 AromaticContact CZ-CE2 3.62Å; F397-Y438 HydrophobicContact CZ-CE2 3.62Å; F397-C441 HydrophobicContact CD2-CB 3.84Å; F397-C441 HydrophobicContact CE2-CB 4.13Å; F397-G443 VanDerWaalsContact CZ-CA 3.46Å; F397-R446 HydrophobicContact CD1-CB 4.25Å; F397-R446 HydrophobicContact CE1-CB 4.27Å; F397-I447 HydrophobicContact CE1-CD1 4.43Å; F397-I447 HydrophobicContact CE1-CG1 4.04Å; F397-I447 HydrophobicContact CZ-CD1 4.48Å
398	T	92.3	Very high	83.7	Confident	42 Å²	42	70.7 Å²	70.7	26%	0.258	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70	-20.4	169.7	69.6	0	0	0	0	113	E344 L394 A395 L396 K401 Y416	E344-T398 HydrophobicContact CB-CG2 3.85Å; E344-T398 HydrophobicContact CG-CG2 4.22Å; E344-T398 WeakPolarHBondContact CG-OG1 3.38Å; L394-T398 WeakPolarHBondContact O-CG2 3.26Å; L394-T398 PolarHBondContact O-N 2.93Å; A395-T398 WeakPolarHBondContact O-CB 3.45Å; A395-T398 WeakPolarHBondContact O-CG2 3.49Å; A395-T398 PolarHBondContact O-N 3.37Å; A395-T398 VanDerWaalsContact O-N 3.13Å; A395-T398 PolarHBondContact O-OG1 3.08Å; L396-T398 PolarHBondContact O-N 2.89Å; L396-T398 VanDerWaalsContact O-N 3.08Å; T398-K401 VanDerWaalsContact O-CE 3.26Å; T398-K401 WeakPolarHBondContact O-CE 3.42Å; T398-Y416 PolarHBondContact O-OH 3.15Å
399	Y	91.1	Very high	81.8	Confident	7 Å²	7	71.3 Å²	71.3	3%	0.027	34%	0.338	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.9	-25.4	176.8	-67.2	-86.6	0	0	0	113.2	E344 K367 F371 L396 F397 K401 Y416 L419 Q420 A423	E344-Y399 HydrophobicContact CG-CE2 3.79Å; E344-Y399 PolarHBondContact OE1-OH 3.09Å; K367-Y399 WeakPolarHBondContact CE-OH 3.28Å; F371-Y399 HydrophobicContact CE2-CE2 4.28Å; F371-Y399 HydrophobicContact CZ-CD2 4.1Å; F371-Y399 AromaticContact CZ-CE2 3.58Å; F371-Y399 HydrophobicContact CZ-CE2 3.58Å; F371-Y399 AromaticContact CZ-CZ 4Å; L396-Y399 WeakPolarHBondContact O-CB 3.36Å; L396-Y399 PolarHBondContact O-N 3.42Å; F397-Y399 PolarHBondContact O-N 3.44Å; Y399-K401 VanDerWaalsContact C-N 3.28Å; Y399-K401 PolarHBondContact O-N 3.29Å; Y399-Y416 HydrophobicContact CD1-CD2 4.28Å; Y399-Y416 AromaticContact CD1-CE2 3.78Å; Y399-Y416 HydrophobicContact CD1-CE2 3.78Å; Y399-Y416 HydrophobicContact CE1-CD2 4.41Å; Y399-Y416 HydrophobicContact CE1-CE2 4.16Å; Y399-L419 HydrophobicContact CD1-CB 4.04Å; Y399-L419 HydrophobicContact CE1-CB 3.8Å; Y399-L419 HydrophobicContact CE1-CD1 4.03Å; Y399-Q420 WeakPolarHBondContact O-CG 3.18Å; Y399-Q420 PolarHBondContact O-NE2 2.95Å; Y399-A423 HydrophobicContact CD2-CB 4.07Å; Y399-A423 HydrophobicContact CG-CB 4.01Å
400	V	91	Very high	80.5	Confident	4 Å²	4	74.2 Å²	74.2	2%	0.024	35%	0.348	C	S	.	.	S	Bend	trans	-84.9	70.5	-178.2	-167.5	0	0	0	0	110.5	F397 I424 L427 F450	F397-V400 HydrophobicContact CD1-CB 4.01Å; F397-V400 HydrophobicContact CD1-CG2 4.12Å; V400-I424 HydrophobicContact CB-CG1 4.47Å; V400-I424 HydrophobicContact CG1-CD1 4.48Å; V400-I424 HydrophobicContact CG1-CG1 4.24Å; V400-I424 HydrophobicContact CG2-CD1 4.5Å; V400-I424 HydrophobicContact CG2-CG1 3.6Å; V400-L427 HydrophobicContact CG2-CD1 3.51Å; V400-F450 HydrophobicContact CG1-CB 3.88Å; V400-F450 HydrophobicContact CG1-CD1 3.83Å; V400-F450 HydrophobicContact CG1-CD2 4.18Å; V400-F450 HydrophobicContact CG1-CE1 4.46Å; V400-F450 HydrophobicContact CG1-CG 3.67Å
401	K	86.9	Confident	79.8	Confident	75 Å²	75	74.8 Å²	74.8	33%	0.326	35%	0.346	S	S	.	.	S	Bend	trans	-157.9	164.6	175.4	60.2	179.6	-175.8	174.3	0	110.3	T398 Y399 Q420	T398-K401 VanDerWaalsContact O-CE 3.26Å; T398-K401 WeakPolarHBondContact O-CE 3.42Å; Y399-K401 VanDerWaalsContact C-N 3.28Å; Y399-K401 PolarHBondContact O-N 3.29Å; K401-Q420 PolarHBondContact O-NE2 3.39Å
402	K	81.8	Confident	79.2	Confident	126 Å²	126	71.7 Å²	71.7	55%	0.548	34%	0.339	S	S	.	.			trans	-52.7	133.5	169.9	176.9	172.1	-178.5	179.8	0	109.6	E404 W453	K402-E404 PolarHBondContact O-N 3.35Å; K402-W453 HydrophobicContact CB-CG 4.16Å; K402-W453 HydrophobicContact CG-CG 4.4Å
403	P	72.9	Confident	78.4	Confident	47 Å²	47	74 Å²	74	31%	0.305	36%	0.359	S	S	.	.			trans	-61.4	103.1	173.8	-20	30.7	0	0	0	109.9	Y416 W453	P403-Y416 HydrophobicContact CB-CD1 4.2Å; P403-Y416 HydrophobicContact CB-CE1 4.12Å; P403-Y416 HydrophobicContact CG-CD1 4.29Å; P403-Y416 HydrophobicContact CG-CE1 4.18Å; P403-W453 HydrophobicContact CG-CH2 4.25Å; P403-W453 HydrophobicContact CG-CZ2 3.95Å
404	E	67.2	Low	77.7	Confident	132 Å²	132	75.4 Å²	75.4	62%	0.617	37%	0.371	S	S	*	.			trans	-84.3	155.7	164.6	-67.7	176	172.1	0	0	108.1	K402 L406	K402-E404 PolarHBondContact O-N 3.35Å; E404-L406 PolarHBondContact O-N 3.02Å
405	R	55.2	Low	77.3	Confident	249 Å²	249	73.7 Å²	73.7	94%	0.94	36%	0.361	S	S	*	.			trans	-63.4	87.7	167.8	-75.2	-175.3	179.5	177	0.3	108.1	K407	R405-K407 PolarHBondContact O-N 3.39Å
406	L	52.6	Low	76.9	Confident	78 Å²	78	74.3 Å²	74.3	41%	0.408	36%	0.363	S	S	.	.			trans	-65.5	129.4	-177.7	-71.5	168.4	0	0	0	108.8	E404 I408 Y416	E404-L406 PolarHBondContact O-N 3.02Å; L406-I408 VanDerWaalsContact C-N 3.35Å; L406-I408 PolarHBondContact O-N 3.48Å; L406-Y416 HydrophobicContact CD1-CD2 4.03Å; L406-Y416 HydrophobicContact CD1-CE2 3.44Å; L406-Y416 VanDerWaalsContact CD1-CE2 3.44Å
407	K	53.5	Low	76.5	Confident	207 Å²	207	74.6 Å²	74.6	90%	0.9	36%	0.364	S	S	*	.	S	Bend	trans	-85.4	6.6	-179.3	-83.9	-173.6	174.9	179.9	0	114.6	R405	R405-K407 PolarHBondContact O-N 3.39Å
408	I	51.5	Low	76.2	Confident	156 Å²	156	76 Å²	76	80%	0.8	37%	0.371	S	S	*	.	S	Bend	trans	-133	-11.4	-165.8	-57.8	-177.6	0	0	0	116	L406	L406-I408 VanDerWaalsContact C-N 3.35Å; L406-I408 PolarHBondContact O-N 3.48Å
409	I	56.3	Low	76.1	Confident	56 Å²	56	74 Å²	74	29%	0.287	36%	0.358	S	S	.	.			trans	-145.8	123.6	166.8	-52.1	177.2	0	0	0	109.4	N343 W411	N343-I409 HydrophobicContact CB-CD1 4.08Å; I409-W411 HydrophobicContact CG2-CD2 4.21Å; I409-W411 HydrophobicContact CG2-CG 4.1Å; I409-W411 HydrophobicContact CG2-CZ2 4.41Å; I409-W411 PolarHBondContact O-N 3.16Å
410	E	68.8	Low	76.2	Confident	167 Å²	167	73.7 Å²	73.7	78%	0.78	36%	0.357	S	S	*	.			trans	-77.8	38.7	-174.3	-62.7	-179	162.6	0	0	113.5	N359 S412	N359-E410 PolarHBondContact ND2-O 3.1Å; N359-E410 PolarHBondContact OD1-O 3.28Å; E410-S412 PolarHBondContact O-N 3.36Å
411	W	80.6	Confident	76.3	Confident	27 Å²	27	73.5 Å²	73.5	10%	0.102	36%	0.356	C	S	.	.			trans	-60.5	139	169.7	-63	123	0	0	0	109.2	S358 D363 F364 I409 Q415 L419	S358-W411 WeakPolarHBondContact O-CH2 3.49Å; D363-W411 HydrophobicContact CB-CH2 4.26Å; F364-W411 HydrophobicContact CB-CE3 4.33Å; F364-W411 HydrophobicContact CB-CH2 4.09Å; F364-W411 HydrophobicContact CB-CZ3 3.63Å; F364-W411 HydrophobicContact CD2-CE3 4.44Å; F364-W411 HydrophobicContact CD2-CZ3 4.45Å; I409-W411 HydrophobicContact CG2-CD2 4.21Å; I409-W411 HydrophobicContact CG2-CG 4.1Å; I409-W411 HydrophobicContact CG2-CZ2 4.41Å; I409-W411 PolarHBondContact O-N 3.16Å; W411-Q415 HydrophobicContact CB-CB 4.26Å; W411-L419 HydrophobicContact CD2-CD1 4.16Å; W411-L419 HydrophobicContact CG-CD1 4.23Å; W411-L419 HydrophobicContact CZ2-CD1 4.38Å
412	S	82.6	Confident	76.7	Confident	54 Å²	54	71 Å²	71	38%	0.378	35%	0.346	S	S	.	.			trans	-61.1	156.5	168	67.3	0	0	0	0	110.3	E410 A414 Q415 Y416	E410-S412 PolarHBondContact O-N 3.36Å; S412-A414 PolarHBondContact O-N 2.75Å; S412-Q415 PolarHBondContact O-N 3.23Å; S412-Q415 VanDerWaalsContact O-N 3.14Å; S412-Q415 WeakPolarHBondContact OG-CB 3.31Å; S412-Q415 VanDerWaalsContact OG-CD 3.32Å; S412-Q415 VanDerWaalsContact OG-CG 3.3Å; S412-Q415 WeakPolarHBondContact OG-CG 3.28Å; S412-Q415 PolarHBondContact OG-N 3.34Å; S412-Q415 PolarHBondContact OG-OE1 2.81Å; S412-Y416 PolarHBondContact O-N 3.21Å
413	A	81.8	Confident	77.4	Confident	52 Å²	52	65 Å²	65	43%	0.43	32%	0.319	S	S	.	.	H	α-helix	trans	-54.3	-41.9	178.7	0	0	0	0	0	112.1	Y416 E417 F461	A413-Y416 PolarHBondContact O-N 3.05Å; A413-E417 WeakPolarHBondContact O-CG 3.34Å; A413-E417 PolarHBondContact O-N 2.94Å; A413-F461 HydrophobicContact CB-CB 4.32Å; A413-F461 HydrophobicContact CB-CD2 3.86Å; A413-F461 HydrophobicContact CB-CE2 4.43Å; A413-F461 HydrophobicContact CB-CG 4.13Å
414	A	83.3	Confident	78.5	Confident	32 Å²	32	62.9 Å²	62.9	26%	0.264	31%	0.305	S	S	.	.	H	α-helix	trans	-65	-43.6	177.8	0	0	0	0	0	112.8	S412 E417 E418	S412-A414 PolarHBondContact O-N 2.75Å; A414-E417 PolarHBondContact O-N 3.43Å; A414-E418 PolarHBondContact O-N 2.88Å
415	Q	86.8	Confident	79.9	Confident	29 Å²	29	57.2 Å²	57.2	14%	0.136	28%	0.281	C	S	.	.	H	α-helix	trans	-64.2	-41.7	175.4	-75	165.2	-45.6	0	0	111.5	N359 F364 W411 S412 E418 L419	N359-Q415 PolarHBondContact OD1-OE1 3.38Å; N359-Q415 VanDerWaalsContact OD1-OE1 3.08Å; F364-Q415 HydrophobicContact CD1-CG 4.39Å; F364-Q415 HydrophobicContact CD2-CB 3.76Å; F364-Q415 HydrophobicContact CD2-CG 3.78Å; F364-Q415 HydrophobicContact CE1-CG 4.36Å; F364-Q415 HydrophobicContact CE2-CB 3.58Å; F364-Q415 HydrophobicContact CE2-CG 3.75Å; F364-Q415 WeakPolarHBondContact CE2-O 3.48Å; F364-Q415 HydrophobicContact CG-CG 4.09Å; F364-Q415 HydrophobicContact CZ-CB 4.24Å; F364-Q415 HydrophobicContact CZ-CG 4.04Å; W411-Q415 HydrophobicContact CB-CB 4.26Å; S412-Q415 PolarHBondContact O-N 3.23Å; S412-Q415 VanDerWaalsContact O-N 3.14Å; S412-Q415 WeakPolarHBondContact OG-CB 3.31Å; S412-Q415 VanDerWaalsContact OG-CD 3.32Å; S412-Q415 VanDerWaalsContact OG-CG 3.3Å; S412-Q415 WeakPolarHBondContact OG-CG 3.28Å; S412-Q415 PolarHBondContact OG-N 3.34Å; S412-Q415 PolarHBondContact OG-OE1 2.81Å; Q415-E418 PolarHBondContact O-N 3.44Å; Q415-L419 WeakPolarHBondContact O-CG 3.3Å; Q415-L419 PolarHBondContact O-N 3.48Å
416	Y	86.9	Confident	81.9	Confident	15 Å²	15	45.6 Å²	45.6	6%	0.059	24%	0.238	C	C	.	.	H	α-helix	trans	-62.6	-46	178.1	-178.1	-96.9	0	0	0	111.8	T398 Y399 P403 L406 S412 A413 E418 L419 Q420	T398-Y416 PolarHBondContact O-OH 3.15Å; Y399-Y416 HydrophobicContact CD1-CD2 4.28Å; Y399-Y416 AromaticContact CD1-CE2 3.78Å; Y399-Y416 HydrophobicContact CD1-CE2 3.78Å; Y399-Y416 HydrophobicContact CE1-CD2 4.41Å; Y399-Y416 HydrophobicContact CE1-CE2 4.16Å; P403-Y416 HydrophobicContact CB-CD1 4.2Å; P403-Y416 HydrophobicContact CB-CE1 4.12Å; P403-Y416 HydrophobicContact CG-CD1 4.29Å; P403-Y416 HydrophobicContact CG-CE1 4.18Å; L406-Y416 HydrophobicContact CD1-CD2 4.03Å; L406-Y416 HydrophobicContact CD1-CE2 3.44Å; L406-Y416 VanDerWaalsContact CD1-CE2 3.44Å; S412-Y416 PolarHBondContact O-N 3.21Å; A413-Y416 PolarHBondContact O-N 3.05Å; Y416-E418 VanDerWaalsContact C-N 3.28Å; Y416-E418 PolarHBondContact O-N 3.17Å; Y416-L419 PolarHBondContact O-N 3.35Å; Y416-Q420 WeakPolarHBondContact O-CB 3.39Å; Y416-Q420 PolarHBondContact O-N 3.41Å
417	E	87.7	Confident	84	Confident	9 Å²	9	41.9 Å²	41.9	4%	0.042	22%	0.218	C	C	.	.	H	α-helix	trans	-63.3	-33.4	176.6	-70.8	174.5	170.2	0	0	111.8	A413 A414 Q420 L421 C460 F461 L462	A413-E417 WeakPolarHBondContact O-CG 3.34Å; A413-E417 PolarHBondContact O-N 2.94Å; A414-E417 PolarHBondContact O-N 3.43Å; E417-Q420 WeakPolarHBondContact O-CB 3.47Å; E417-Q420 PolarHBondContact O-N 3.38Å; E417-L421 WeakPolarHBondContact O-CG 3.31Å; E417-L421 PolarHBondContact O-N 2.96Å; E417-L421 VanDerWaalsContact O-N 3.12Å; E417-C460 PolarHBondContact OE2-SG 3.48Å; E417-F461 WeakPolarHBondContact OE2-CA 3.45Å; E417-F461 PolarHBondContact OE2-N 3.19Å; E417-L462 HydrophobicContact CB-CD1 3.14Å; E417-L462 HydrophobicContact CG-CD1 4.22Å; E417-L462 WeakPolarHBondContact OE2-CD1 3.47Å; E417-L462 PolarHBondContact OE2-N 3.01Å; E417-L462 VanDerWaalsContact OE2-N 3.1Å
418	E	89.6	Confident	86.1	Confident	33 Å²	33	32.7 Å²	32.7	15%	0.154	18%	0.18	C	C	.	.	H	α-helix	trans	-71.1	-41.3	173.1	-173.4	173	153.9	0	0	112.7	F364 K368 A414 Q415 Y416 Q420 L421 H422 S466	F364-E418 HydrophobicContact CE2-CB 4.39Å; F364-E418 HydrophobicContact CZ-CB 4.01Å; F364-E418 HydrophobicContact CZ-CG 4Å; K368-E418 HydrophobicContact CD-CG 4.29Å; K368-E418 VanDerWaalsContact CD-OE1 3.29Å; K368-E418 WeakPolarHBondContact CD-OE1 3.3Å; K368-E418 IonicContact NZ-OE1 2.67Å; K368-E418 PolarHBondContact NZ-OE1 3.41Å; A414-E418 PolarHBondContact O-N 2.88Å; Q415-E418 PolarHBondContact O-N 3.44Å; Y416-E418 VanDerWaalsContact C-N 3.28Å; Y416-E418 PolarHBondContact O-N 3.17Å; E418-Q420 VanDerWaalsContact C-N 3.26Å; E418-Q420 PolarHBondContact O-N 2.96Å; E418-L421 WeakPolarHBondContact O-CB 3.38Å; E418-L421 PolarHBondContact O-N 3.44Å; E418-H422 PolarHBondContact O-N 3.2Å; E418-H422 VanDerWaalsContact O-N 3.09Å; E418-H422 PolarHBondContact O-ND1 2.98Å; E418-H422 IonicContact OE1-CE1 2.7Å; E418-S466 WeakPolarHBondContact OE2-CB 3.33Å
419	L	91.1	Very high	88.3	Confident	0 Å²	0	27.5 Å²	27.5	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-63.5	-35.3	172.6	-71.4	178	0	0	0	111.6	F364 K367 K368 F371 Y399 W411 Q415 Y416 H422 A423	F364-L419 HydrophobicContact CD2-CD1 4.3Å; F364-L419 HydrophobicContact CD2-CD2 4.19Å; F364-L419 HydrophobicContact CD2-CG 4.1Å; F364-L419 HydrophobicContact CE2-CD1 4.48Å; F364-L419 HydrophobicContact CE2-CD2 4.07Å; F364-L419 HydrophobicContact CE2-CG 3.85Å; K367-L419 HydrophobicContact CB-CD2 3.92Å; K367-L419 HydrophobicContact CG-CD1 4.27Å; K367-L419 HydrophobicContact CG-CD2 3.81Å; K368-L419 HydrophobicContact CG-CD2 3.77Å; F371-L419 HydrophobicContact CE2-CD2 4.32Å; Y399-L419 HydrophobicContact CD1-CB 4.04Å; Y399-L419 HydrophobicContact CE1-CB 3.8Å; Y399-L419 HydrophobicContact CE1-CD1 4.03Å; W411-L419 HydrophobicContact CD2-CD1 4.16Å; W411-L419 HydrophobicContact CG-CD1 4.23Å; W411-L419 HydrophobicContact CZ2-CD1 4.38Å; Q415-L419 WeakPolarHBondContact O-CG 3.3Å; Q415-L419 PolarHBondContact O-N 3.48Å; Y416-L419 PolarHBondContact O-N 3.35Å; L419-H422 PolarHBondContact O-N 3Å; L419-A423 WeakPolarHBondContact O-CB 3.28Å; L419-A423 PolarHBondContact O-N 2.71Å
420	Q	91.8	Very high	90.2	Very high	0 Å²	0	24.9 Å²	24.9	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-60.6	-44.2	173.8	173	176.1	87	0	0	111.5	Y399 K401 Y416 E417 E418 A423 I424 F450	Y399-Q420 WeakPolarHBondContact O-CG 3.18Å; Y399-Q420 PolarHBondContact O-NE2 2.95Å; K401-Q420 PolarHBondContact O-NE2 3.39Å; Y416-Q420 WeakPolarHBondContact O-CB 3.39Å; Y416-Q420 PolarHBondContact O-N 3.41Å; E417-Q420 WeakPolarHBondContact O-CB 3.47Å; E417-Q420 PolarHBondContact O-N 3.38Å; E418-Q420 VanDerWaalsContact C-N 3.26Å; E418-Q420 PolarHBondContact O-N 2.96Å; Q420-A423 PolarHBondContact O-N 3.49Å; Q420-I424 HydrophobicContact CG-CD1 3.95Å; Q420-I424 VanDerWaalsContact O-CG1 3.27Å; Q420-I424 WeakPolarHBondContact O-CG1 3.18Å; Q420-I424 PolarHBondContact O-N 3.06Å; Q420-F450 VanDerWaalsContact CD-CE2 3.5Å; Q420-F450 HydrophobicContact CG-CE2 4.31Å; Q420-F450 HydrophobicContact CG-CZ 3.88Å; Q420-F450 VanDerWaalsContact NE2-CE2 3.3Å
421	L	93.6	Very high	91.6	Very high	0 Å²	0	16.9 Å²	16.9	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-61.7	-44.7	174.5	-70.4	165.8	0	0	0	112.3	E417 E418 A423 I424 A425 L462 H468 A478 Q479 Y482	E417-L421 WeakPolarHBondContact O-CG 3.31Å; E417-L421 PolarHBondContact O-N 2.96Å; E417-L421 VanDerWaalsContact O-N 3.12Å; E418-L421 WeakPolarHBondContact O-CB 3.38Å; E418-L421 PolarHBondContact O-N 3.44Å; L421-A423 VanDerWaalsContact C-N 3.34Å; L421-A423 PolarHBondContact O-N 3.44Å; L421-I424 PolarHBondContact O-N 3.02Å; L421-A425 WeakPolarHBondContact O-CB 3.44Å; L421-A425 PolarHBondContact O-N 3.45Å; L421-L462 HydrophobicContact CD1-CD1 4.43Å; L421-L462 HydrophobicContact CD1-CD2 3.6Å; L421-H468 HydrophobicContact CB-CB 3.82Å; L421-H468 HydrophobicContact CD1-CB 4.46Å; L421-A478 HydrophobicContact CD1-CB 4.13Å; L421-A478 VanDerWaalsContact CD2-C 3.46Å; L421-A478 HydrophobicContact CD2-CB 3.79Å; L421-Q479 HydrophobicContact CD2-CB 4.43Å; L421-Q479 HydrophobicContact CD2-CG 3.97Å; L421-Q479 HydrophobicContact CG-CG 4.45Å; L421-Y482 HydrophobicContact CD2-CD2 3.85Å
422	H	94.9	Very high	92.4	Very high	23 Å²	23	16.8 Å²	16.8	11%	0.106	11%	0.11	C	C	.	.	H	α-helix	trans	-62.6	-41.4	175.8	-72.1	76.8	0	0	0	111.5	K368 F371 E418 L419 A425 T426 H468	K368-H422 WeakPolarHBondContact CD-CE1 3.47Å; F371-H422 HydrophobicContact CB-CB 4.45Å; F371-H422 HydrophobicContact CD2-CB 3.76Å; E418-H422 PolarHBondContact O-N 3.2Å; E418-H422 VanDerWaalsContact O-N 3.09Å; E418-H422 PolarHBondContact O-ND1 2.98Å; E418-H422 IonicContact OE1-CE1 2.7Å; L419-H422 PolarHBondContact O-N 3Å; H422-A425 PolarHBondContact O-N 2.66Å; H422-T426 WeakPolarHBondContact O-CB 3.45Å; H422-T426 PolarHBondContact O-N 3.23Å; H422-T426 PolarHBondContact O-OG1 3.02Å; H422-T426 VanDerWaalsContact O-OG1 3.04Å; H422-H468 AromaticContact CD2-CD2 3.47Å; H422-H468 PolarHBondContact CD2-CD2 3.45Å; H422-H468 VanDerWaalsContact CD2-CD2 3.47Å; H422-H468 AromaticContact CD2-NE2 3.81Å; H422-H468 AromaticContact CE1-CD2 3.67Å; H422-H468 AromaticContact CG-CD2 3.66Å; H422-H468 AromaticContact ND1-CD2 3.78Å; H422-H468 AromaticContact NE2-CD2 3.48Å; H422-H468 PolarHBondContact NE2-CD2 3.48Å
423	A	96.2	Very high	93	Very high	0 Å²	0	17.3 Å²	17.3	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-64.1	-42.8	179.7	0	0	0	0	0	112.3	F371 L396 Y399 L419 Q420 L421 T426 L427	F371-A423 HydrophobicContact CE2-CB 4.17Å; L396-A423 HydrophobicContact CD2-CB 4.04Å; Y399-A423 HydrophobicContact CD2-CB 4.07Å; Y399-A423 HydrophobicContact CG-CB 4.01Å; L419-A423 WeakPolarHBondContact O-CB 3.28Å; L419-A423 PolarHBondContact O-N 2.71Å; Q420-A423 PolarHBondContact O-N 3.49Å; L421-A423 VanDerWaalsContact C-N 3.34Å; L421-A423 PolarHBondContact O-N 3.44Å; A423-T426 PolarHBondContact O-N 3.16Å; A423-L427 WeakPolarHBondContact O-CB 3.5Å; A423-L427 WeakPolarHBondContact O-CG 3.38Å; A423-L427 PolarHBondContact O-N 2.88Å
424	I	96.4	Very high	93.8	Very high	1 Å²	1	15 Å²	15	1%	0.005	9%	0.088	C	C	.	.	H	α-helix	trans	-68.1	-39.2	176.6	-59.7	161.9	0	0	0	110.7	V400 Q420 L421 L427 S428 F450 Y482 L486	V400-I424 HydrophobicContact CB-CG1 4.47Å; V400-I424 HydrophobicContact CG1-CD1 4.48Å; V400-I424 HydrophobicContact CG1-CG1 4.24Å; V400-I424 HydrophobicContact CG2-CD1 4.5Å; V400-I424 HydrophobicContact CG2-CG1 3.6Å; Q420-I424 HydrophobicContact CG-CD1 3.95Å; Q420-I424 VanDerWaalsContact O-CG1 3.27Å; Q420-I424 WeakPolarHBondContact O-CG1 3.18Å; Q420-I424 PolarHBondContact O-N 3.06Å; L421-I424 PolarHBondContact O-N 3.02Å; I424-L427 PolarHBondContact O-N 3.18Å; I424-S428 PolarHBondContact O-N 3.08Å; I424-S428 PolarHBondContact O-OG 3.13Å; I424-F450 HydrophobicContact CD1-CD1 4.13Å; I424-F450 HydrophobicContact CD1-CE1 3.35Å; I424-F450 HydrophobicContact CD1-CZ 3.81Å; I424-Y482 VanDerWaalsContact CG2-C 3.43Å; I424-Y482 VanDerWaalsContact CG2-O 3.28Å; I424-Y482 WeakPolarHBondContact CG2-O 3.45Å; I424-L486 HydrophobicContact CG2-CB 4.36Å; I424-L486 HydrophobicContact CG2-CD2 4.36Å
425	A	96.1	Very high	94.4	Very high	13 Å²	13	15.7 Å²	15.7	11%	0.107	9%	0.087	C	C	.	.	H	α-helix	trans	-61.1	-45	174.2	0	0	0	0	0	111.5	L421 H422 S428 Y482	L421-A425 WeakPolarHBondContact O-CB 3.44Å; L421-A425 PolarHBondContact O-N 3.45Å; H422-A425 PolarHBondContact O-N 2.66Å; A425-S428 WeakPolarHBondContact O-CB 3.5Å; A425-S428 PolarHBondContact O-N 3.44Å; A425-Y482 HydrophobicContact CB-CD1 3.7Å; A425-Y482 HydrophobicContact CB-CE1 3.75Å
426	T	97.5	Very high	94.9	Very high	5 Å²	5	21.5 Å²	21.5	3%	0.031	11%	0.114	C	C	.	.	H	α-helix	trans	-65	-41.6	175.3	-59.3	0	0	0	0	111.8	F371 I374 V375 L396 H422 A423 S428 S429 V430	F371-T426 PolarHBondContact O-OG1 3.19Å; F371-T426 VanDerWaalsContact O-OG1 3.13Å; I374-T426 HydrophobicContact CB-CG2 4.13Å; I374-T426 HydrophobicContact CG2-CG2 3.77Å; V375-T426 HydrophobicContact CG2-CG2 3.86Å; L396-T426 HydrophobicContact CD1-CG2 3.74Å; L396-T426 HydrophobicContact CD2-CG2 4.12Å; H422-T426 WeakPolarHBondContact O-CB 3.45Å; H422-T426 PolarHBondContact O-N 3.23Å; H422-T426 PolarHBondContact O-OG1 3.02Å; H422-T426 VanDerWaalsContact O-OG1 3.04Å; A423-T426 PolarHBondContact O-N 3.16Å; T426-S428 PolarHBondContact O-N 2.86Å; T426-S429 PolarHBondContact O-N 3.46Å; T426-S429 VanDerWaalsContact O-N 3.07Å; T426-V430 HydrophobicContact CG2-CG2 4.04Å; T426-V430 WeakPolarHBondContact O-CG2 3.35Å; T426-V430 PolarHBondContact O-N 3.33Å
427	L	97.9	Very high	95.4	Very high	0 Å²	0	23 Å²	23	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-57.2	-39.3	173.8	-81.9	165.9	0	0	0	111.6	I393 L396 F397 V400 A423 I424 S429 V430 A431 L486	I393-L427 HydrophobicContact CD1-CD2 3.86Å; I393-L427 HydrophobicContact CG2-CD2 4.48Å; L396-L427 HydrophobicContact CB-CD1 3.89Å; L396-L427 HydrophobicContact CB-CD2 3.78Å; L396-L427 HydrophobicContact CB-CG 3.6Å; L396-L427 HydrophobicContact CD1-CD2 3.87Å; L396-L427 HydrophobicContact CD1-CG 3.85Å; L396-L427 HydrophobicContact CG-CD2 4.48Å; L396-L427 HydrophobicContact CG-CG 4.33Å; F397-L427 HydrophobicContact CD1-CD1 4.04Å; F397-L427 HydrophobicContact CD2-CD2 4.46Å; F397-L427 HydrophobicContact CE1-CD1 4.01Å; F397-L427 HydrophobicContact CE2-CD2 4.28Å; F397-L427 HydrophobicContact CG-CD1 4.44Å; F397-L427 HydrophobicContact CZ-CD1 4.42Å; F397-L427 HydrophobicContact CZ-CD2 4.41Å; V400-L427 HydrophobicContact CG2-CD1 3.51Å; A423-L427 WeakPolarHBondContact O-CB 3.5Å; A423-L427 WeakPolarHBondContact O-CG 3.38Å; A423-L427 PolarHBondContact O-N 2.88Å; I424-L427 PolarHBondContact O-N 3.18Å; L427-S429 PolarHBondContact O-N 3.29Å; L427-S429 VanDerWaalsContact O-N 3.1Å; L427-V430 PolarHBondContact O-N 3.17Å; L427-A431 HydrophobicContact CD2-CB 4.49Å; L427-A431 WeakPolarHBondContact O-CB 3.07Å; L427-A431 PolarHBondContact O-N 2.87Å; L427-L486 HydrophobicContact CB-CD1 4.16Å; L427-L486 HydrophobicContact CB-CD2 3.77Å; L427-L486 HydrophobicContact CD1-CD2 4.27Å
428	S	97.1	Very high	95.9	Very high	15 Å²	15	22.6 Å²	22.6	11%	0.105	12%	0.12	C	C	.	.	H	α-helix	trans	-60.5	-22.1	179.3	-54.5	0	0	0	0	113.2	I424 A425 T426 L486	I424-S428 PolarHBondContact O-N 3.08Å; I424-S428 PolarHBondContact O-OG 3.13Å; A425-S428 WeakPolarHBondContact O-CB 3.5Å; A425-S428 PolarHBondContact O-N 3.44Å; T426-S428 PolarHBondContact O-N 2.86Å; S428-L486 WeakPolarHBondContact OG-CA 3.21Å; S428-L486 WeakPolarHBondContact OG-CB 3.31Å; S428-L486 PolarHBondContact OG-N 2.88Å
429	S	96.6	Very high	96.3	Very high	47 Å²	47	23.4 Å²	23.4	33%	0.329	12%	0.124	S	C	.	.	H	α-helix	trans	-97.2	-35.2	176.4	-56.9	0	0	0	0	113.1	T426 L427	T426-S429 PolarHBondContact O-N 3.46Å; T426-S429 VanDerWaalsContact O-N 3.07Å; L427-S429 PolarHBondContact O-N 3.29Å; L427-S429 VanDerWaalsContact O-N 3.1Å
430	V	97.3	Very high	96.5	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-93.5	-37.5	-171.8	-178.9	0	0	0	0	112.8	I374 C378 L387 V392 I393 T426 L427 L433 L434	I374-V430 HydrophobicContact CG2-CG2 3.72Å; C378-V430 HydrophobicContact CB-CG2 3.99Å; L387-V430 HydrophobicContact CD1-CG1 4.31Å; V392-V430 HydrophobicContact CG1-CG1 4.26Å; I393-V430 HydrophobicContact CD1-CB 4.41Å; I393-V430 HydrophobicContact CD1-CG1 3.93Å; T426-V430 HydrophobicContact CG2-CG2 4.04Å; T426-V430 WeakPolarHBondContact O-CG2 3.35Å; T426-V430 PolarHBondContact O-N 3.33Å; L427-V430 PolarHBondContact O-N 3.17Å; V430-L433 PolarHBondContact O-N 3.34Å; V430-L433 VanDerWaalsContact O-N 3.11Å; V430-L434 HydrophobicContact CG1-CD1 3.57Å; V430-L434 HydrophobicContact CG1-CG 4.26Å; V430-L434 PolarHBondContact O-N 2.97Å
431	A	97.4	Very high	96.7	Very high	0 Å²	0	29 Å²	29	0%	0	16%	0.164	C	C	.	.	G	3₁₀ helix	trans	-60	-39.3	-178	0	0	0	0	0	113.8	I393 L427 L433 L434 Y438 L486 M490	I393-A431 HydrophobicContact CD1-CB 4.09Å; L427-A431 HydrophobicContact CD2-CB 4.49Å; L427-A431 WeakPolarHBondContact O-CB 3.07Å; L427-A431 PolarHBondContact O-N 2.87Å; A431-L433 PolarHBondContact O-N 2.88Å; A431-L433 VanDerWaalsContact O-N 3.14Å; A431-L434 CarbonylContact O-C 3.49Å; A431-L434 PolarHBondContact O-N 3.28Å; A431-Y438 HydrophobicContact CB-CD2 3.77Å; A431-Y438 HydrophobicContact CB-CE2 4.39Å; A431-Y438 HydrophobicContact CB-CG 4.44Å; A431-L486 HydrophobicContact CB-CD1 3.99Å; A431-M490 HydrophobicContact CB-SD 3.74Å
432	P	97.1	Very high	96.8	Very high	24 Å²	24	35 Å²	35	16%	0.156	19%	0.191	C	C	.	.	G	3₁₀ helix	trans	-61.9	-21.2	176.3	-24.8	35.7	0	0	0	114.6	A489 M490 L493	P432-A489 HydrophobicContact CG-CB 3.9Å; P432-M490 HydrophobicContact CG-SD 4.07Å; P432-L493 HydrophobicContact CB-CD1 3.77Å; P432-L493 HydrophobicContact CB-CD2 3.96Å; P432-L493 HydrophobicContact CB-CG 4.21Å
433	L	96.9	Very high	96.9	Very high	66 Å²	66	33.9 Å²	33.9	35%	0.346	19%	0.186	S	C	.	.	G	3₁₀ helix	trans	-91	-15.2	177.1	-57.4	172.4	0	0	0	112.7	C378 L381 V430 A431	C378-L433 HydrophobicContact CB-CD1 4.01Å; C378-L433 WeakPolarHBondContact O-CD1 3.49Å; L381-L433 HydrophobicContact CD2-CD2 4.24Å; V430-L433 PolarHBondContact O-N 3.34Å; V430-L433 VanDerWaalsContact O-N 3.11Å; A431-L433 PolarHBondContact O-N 2.88Å; A431-L433 VanDerWaalsContact O-N 3.14Å
434	L	97.1	Very high	96.9	Very high	3 Å²	3	34 Å²	34	2%	0.016	19%	0.187	C	C	.	.			trans	-131	55	-170.9	-61.1	-177.7	0	0	0	110.6	I384 L387 I388 I393 V430 A431 E436 E437 Y438	I384-L434 HydrophobicContact CG2-CD2 3.75Å; L387-L434 HydrophobicContact CB-CD1 3.85Å; I388-L434 HydrophobicContact CD1-CD2 3.91Å; I388-L434 HydrophobicContact CG1-CD2 3.49Å; I388-L434 VanDerWaalsContact CG1-CD2 3.49Å; I393-L434 HydrophobicContact CD1-CB 4.23Å; I393-L434 HydrophobicContact CD1-CD1 4.21Å; I393-L434 HydrophobicContact CG1-CB 3.95Å; I393-L434 HydrophobicContact CG1-CD1 3.84Å; V430-L434 HydrophobicContact CG1-CD1 3.57Å; V430-L434 HydrophobicContact CG1-CG 4.26Å; V430-L434 PolarHBondContact O-N 2.97Å; A431-L434 CarbonylContact O-C 3.49Å; A431-L434 PolarHBondContact O-N 3.28Å; L434-E436 PolarHBondContact O-N 3.02Å; L434-E437 HydrophobicContact CB-CB 4.34Å; L434-E437 PolarHBondContact O-N 3.4Å; L434-Y438 VanDerWaalsContact O-CB 3.31Å; L434-Y438 WeakPolarHBondContact O-CB 3.42Å; L434-Y438 PolarHBondContact O-N 3.36Å
435	I	97	Very high	96.9	Very high	46 Å²	46	35 Å²	35	24%	0.236	20%	0.195	C	C	.	.	H	α-helix	trans	-62.1	-41.7	-172.7	-59.2	171.9	0	0	0	111.2	E437 Y438 M439 M490 L493 V498	I435-E437 PolarHBondContact O-N 3.48Å; I435-Y438 WeakPolarHBondContact O-CB 3.35Å; I435-Y438 PolarHBondContact O-N 2.93Å; I435-M439 HydrophobicContact CG2-CG 4.34Å; I435-M439 WeakPolarHBondContact O-CG 3.36Å; I435-M439 PolarHBondContact O-N 3.42Å; I435-M490 HydrophobicContact CG1-CE 4.5Å; I435-L493 HydrophobicContact CD1-CD1 3.87Å; I435-L493 HydrophobicContact CG1-CD1 4.05Å; I435-V498 HydrophobicContact CG2-CG2 3.74Å
436	E	96.8	Very high	96.9	Very high	151 Å²	151	38.4 Å²	38.4	71%	0.706	21%	0.205	S	C	*	.	H	α-helix	trans	-63.4	-43.6	-178.5	-63.6	-173.1	-177.3	0	0	111.8	L434 M439 S440	L434-E436 PolarHBondContact O-N 3.02Å; E436-M439 PolarHBondContact O-N 3.41Å; E436-S440 VanDerWaalsContact O-CB 3.23Å; E436-S440 WeakPolarHBondContact O-CB 3.31Å; E436-S440 PolarHBondContact O-N 2.96Å; E436-S440 PolarHBondContact O-OG 3.49Å
437	E	97.4	Very high	96.8	Very high	48 Å²	48	38.2 Å²	38.2	22%	0.224	20%	0.204	C	C	.	.	H	α-helix	trans	-69.3	-38.7	178.6	-71.3	67.3	-165.1	0	0	110.8	I388 I393 L434 I435 C441	I388-E437 WeakPolarHBondContact CD1-OE1 3.45Å; I388-E437 HydrophobicContact CG1-CG 4.29Å; I388-E437 WeakPolarHBondContact CG1-OE1 3.44Å; I388-E437 HydrophobicContact CG2-CG 4.34Å; I388-E437 VanDerWaalsContact CG2-OE1 3.27Å; I388-E437 WeakPolarHBondContact CG2-OE1 3.45Å; I393-E437 HydrophobicContact CB-CB 4.27Å; I393-E437 HydrophobicContact CG1-CB 4.09Å; L434-E437 HydrophobicContact CB-CB 4.34Å; L434-E437 PolarHBondContact O-N 3.4Å; I435-E437 PolarHBondContact O-N 3.48Å; E437-C441 WeakPolarHBondContact O-CB 3.1Å; E437-C441 PolarHBondContact O-N 3.46Å; E437-C441 PolarHBondContact O-SG 2.98Å
438	Y	97.8	Very high	96.7	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-60.3	-50.2	173	171.3	-88.8	0	0	0	111.5	F397 A431 L434 I435 C441 Q442 G443 N444 I447 M490	F397-Y438 AromaticContact CE2-CD2 3.82Å; F397-Y438 HydrophobicContact CE2-CD2 3.82Å; F397-Y438 HydrophobicContact CE2-CE2 4.24Å; F397-Y438 AromaticContact CZ-CD2 3.67Å; F397-Y438 HydrophobicContact CZ-CD2 3.67Å; F397-Y438 AromaticContact CZ-CE2 3.62Å; F397-Y438 HydrophobicContact CZ-CE2 3.62Å; A431-Y438 HydrophobicContact CB-CD2 3.77Å; A431-Y438 HydrophobicContact CB-CE2 4.39Å; A431-Y438 HydrophobicContact CB-CG 4.44Å; L434-Y438 VanDerWaalsContact O-CB 3.31Å; L434-Y438 WeakPolarHBondContact O-CB 3.42Å; L434-Y438 PolarHBondContact O-N 3.36Å; I435-Y438 WeakPolarHBondContact O-CB 3.35Å; I435-Y438 PolarHBondContact O-N 2.93Å; Y438-C441 PolarHBondContact O-N 2.84Å; Y438-Q442 PolarHBondContact O-N 3.17Å; Y438-G443 WeakPolarHBondContact O-CA 3.23Å; Y438-G443 PolarHBondContact O-N 3.47Å; Y438-N444 VanDerWaalsContact CE1-OD1 3.3Å; Y438-N444 WeakPolarHBondContact CE1-OD1 3.16Å; Y438-N444 PolarHBondContact OH-N 2.95Å; Y438-N444 PolarHBondContact OH-OD1 3.09Å; Y438-I447 HydrophobicContact CE2-CD1 3.77Å; Y438-I447 VanDerWaalsContact OH-CD1 3.25Å; Y438-I447 WeakPolarHBondContact OH-CD1 3.41Å; Y438-M490 HydrophobicContact CD1-CE 3.76Å; Y438-M490 HydrophobicContact CD2-CE 4.4Å; Y438-M490 HydrophobicContact CE1-CE 3.87Å; Y438-M490 HydrophobicContact CE2-CE 4.45Å; Y438-M490 HydrophobicContact CE2-CG 4.29Å; Y438-M490 HydrophobicContact CE2-SD 4.39Å; Y438-M490 HydrophobicContact CG-CE 4.05Å
439	M	97.4	Very high	96.6	Very high	50 Å²	50	40.6 Å²	40.6	25%	0.246	22%	0.223	C	C	.	.	H	α-helix	trans	-68.1	-39.2	179	-69	-54.4	-75.3	0	0	111.9	I435 E436 C441 Q442 I497 V498 D501	I435-M439 HydrophobicContact CG2-CG 4.34Å; I435-M439 WeakPolarHBondContact O-CG 3.36Å; I435-M439 PolarHBondContact O-N 3.42Å; E436-M439 PolarHBondContact O-N 3.41Å; M439-C441 PolarHBondContact O-N 3.42Å; M439-Q442 WeakPolarHBondContact O-CA 3.4Å; M439-Q442 PolarHBondContact O-N 2.93Å; M439-I497 HydrophobicContact CE-CG2 4.45Å; M439-V498 HydrophobicContact CG-CG2 4.16Å; M439-V498 HydrophobicContact SD-CG2 3.92Å; M439-D501 HydrophobicContact CE-CB 4.1Å
440	S	96.4	Very high	96.4	Very high	102 Å²	102	38.5 Å²	38.5	71%	0.713	21%	0.208	S	C	*	.	H	α-helix	trans	-60.2	-30.7	173.8	-63.6	0	0	0	0	112.7	E436 Q442	E436-S440 VanDerWaalsContact O-CB 3.23Å; E436-S440 WeakPolarHBondContact O-CB 3.31Å; E436-S440 PolarHBondContact O-N 2.96Å; E436-S440 PolarHBondContact O-OG 3.49Å; S440-Q442 VanDerWaalsContact C-N 3.26Å; S440-Q442 PolarHBondContact O-N 3.47Å
441	C	95.1	Very high	96.3	Very high	16 Å²	16	38.5 Å²	38.5	11%	0.108	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.2	2.8	174.2	-69.7	0	0	0	0	113.9	I393 F397 E437 Y438 M439 G443 R446	I393-C441 HydrophobicContact CG2-CB 4.33Å; F397-C441 HydrophobicContact CD2-CB 3.84Å; F397-C441 HydrophobicContact CE2-CB 4.13Å; E437-C441 WeakPolarHBondContact O-CB 3.1Å; E437-C441 PolarHBondContact O-N 3.46Å; E437-C441 PolarHBondContact O-SG 2.98Å; Y438-C441 PolarHBondContact O-N 2.84Å; M439-C441 PolarHBondContact O-N 3.42Å; C441-G443 VanDerWaalsContact C-N 3.34Å; C441-R446 PolarHBondContact O-NE 3.1Å; C441-R446 PolarHBondContact O-NH2 3.24Å
442	Q	95.9	Very high	96	Very high	125 Å²	125	43.5 Å²	43.5	58%	0.584	23%	0.231	S	C	*	.	T	Hydrogen-bonded Turn	trans	57.5	44.3	-170.5	-54.9	178.3	-17.8	0	0	112	Y438 M439 S440 N444 A445 R446	Y438-Q442 PolarHBondContact O-N 3.17Å; M439-Q442 WeakPolarHBondContact O-CA 3.4Å; M439-Q442 PolarHBondContact O-N 2.93Å; S440-Q442 VanDerWaalsContact C-N 3.26Å; S440-Q442 PolarHBondContact O-N 3.47Å; Q442-N444 PolarHBondContact O-N 2.73Å; Q442-A445 HydrophobicContact CB-CB 4.02Å; Q442-A445 WeakPolarHBondContact O-CB 3.49Å; Q442-A445 PolarHBondContact O-N 2.94Å; Q442-A445 VanDerWaalsContact O-N 3.13Å; Q442-R446 PolarHBondContact O-N 3.03Å; Q442-R446 VanDerWaalsContact O-N 3.08Å
443	G	96.4	Very high	95.6	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-52.1	-51.4	-173	0	0	0	0	0	113.7	F397 Y438 C441 A445 R446 I447	F397-G443 VanDerWaalsContact CZ-CA 3.46Å; Y438-G443 WeakPolarHBondContact O-CA 3.23Å; Y438-G443 PolarHBondContact O-N 3.47Å; C441-G443 VanDerWaalsContact C-N 3.34Å; G443-A445 VanDerWaalsContact C-N 3.34Å; G443-A445 PolarHBondContact O-N 3.06Å; G443-R446 PolarHBondContact O-N 3.24Å; G443-I447 VanDerWaalsContact O-CG1 3.3Å; G443-I447 WeakPolarHBondContact O-CG1 3.28Å; G443-I447 PolarHBondContact O-N 2.64Å
444	N	97.2	Very high	95.2	Very high	1 Å²	1	41 Å²	41	1%	0.005	22%	0.216	C	C	.	.	H	α-helix	trans	-54.7	-48	177.2	-72.7	-13.4	0	0	0	112	Y438 Q442 R446 I447 L448 V498 D501 L502	Y438-N444 VanDerWaalsContact CE1-OD1 3.3Å; Y438-N444 WeakPolarHBondContact CE1-OD1 3.16Å; Y438-N444 PolarHBondContact OH-N 2.95Å; Y438-N444 PolarHBondContact OH-OD1 3.09Å; Q442-N444 PolarHBondContact O-N 2.73Å; N444-R446 PolarHBondContact O-N 3.07Å; N444-I447 PolarHBondContact O-N 2.76Å; N444-L448 VanDerWaalsContact O-CG 3.28Å; N444-L448 WeakPolarHBondContact O-CG 3.42Å; N444-L448 PolarHBondContact O-N 3.17Å; N444-V498 PolarHBondContact ND2-O 3.33Å; N444-V498 VanDerWaalsContact ND2-O 3.12Å; N444-D501 WeakPolarHBondContact CB-OD2 3.27Å; N444-D501 PolarHBondContact ND2-OD2 2.96Å; N444-L502 HydrophobicContact CB-CD2 3.78Å; N444-L502 HydrophobicContact CB-CG 4.3Å; N444-L502 VanDerWaalsContact CG-CD2 3.45Å; N444-L502 WeakPolarHBondContact OD1-CD2 3.36Å
445	A	96.3	Very high	94.6	Very high	23 Å²	23	43.8 Å²	43.8	19%	0.19	23%	0.229	C	C	.	.	H	α-helix	trans	-56.9	-47.4	178.4	0	0	0	0	0	112.4	Q442 G443 A449	Q442-A445 HydrophobicContact CB-CB 4.02Å; Q442-A445 WeakPolarHBondContact O-CB 3.49Å; Q442-A445 PolarHBondContact O-N 2.94Å; Q442-A445 VanDerWaalsContact O-N 3.13Å; G443-A445 VanDerWaalsContact C-N 3.34Å; G443-A445 PolarHBondContact O-N 3.06Å; A445-A449 WeakPolarHBondContact O-CB 3.4Å; A445-A449 PolarHBondContact O-N 3.05Å; A445-A449 VanDerWaalsContact O-N 3.09Å
446	R	95.6	Very high	93.7	Very high	85 Å²	85	46.5 Å²	46.5	32%	0.321	24%	0.24	S	C	.	.	H	α-helix	trans	-67.8	-40.4	-177.2	-66.9	-175.5	-170.3	-151.5	5.1	111.8	F397 C441 Q442 G443 N444 F450	F397-R446 HydrophobicContact CD1-CB 4.25Å; F397-R446 HydrophobicContact CE1-CB 4.27Å; C441-R446 PolarHBondContact O-NE 3.1Å; C441-R446 PolarHBondContact O-NH2 3.24Å; Q442-R446 PolarHBondContact O-N 3.03Å; Q442-R446 VanDerWaalsContact O-N 3.08Å; G443-R446 PolarHBondContact O-N 3.24Å; N444-R446 PolarHBondContact O-N 3.07Å; R446-F450 WeakPolarHBondContact O-CB 3.4Å; R446-F450 PolarHBondContact O-N 3.32Å
447	I	96.4	Very high	91.8	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-66.9	-46.4	179.7	-70.8	177.1	0	0	0	111	F397 Y438 G443 N444 F450 L451 T483 L486 L487	F397-I447 HydrophobicContact CE1-CD1 4.43Å; F397-I447 HydrophobicContact CE1-CG1 4.04Å; F397-I447 HydrophobicContact CZ-CD1 4.48Å; Y438-I447 HydrophobicContact CE2-CD1 3.77Å; Y438-I447 VanDerWaalsContact OH-CD1 3.25Å; Y438-I447 WeakPolarHBondContact OH-CD1 3.41Å; G443-I447 VanDerWaalsContact O-CG1 3.3Å; G443-I447 WeakPolarHBondContact O-CG1 3.28Å; G443-I447 PolarHBondContact O-N 2.64Å; N444-I447 PolarHBondContact O-N 2.76Å; I447-F450 WeakPolarHBondContact O-CB 3.27Å; I447-F450 PolarHBondContact O-N 3.47Å; I447-L451 WeakPolarHBondContact O-CB 3.36Å; I447-L451 PolarHBondContact O-N 2.68Å; I447-T483 HydrophobicContact CG2-CG2 3.6Å; I447-L486 HydrophobicContact CD1-CD2 3.3Å; I447-L486 HydrophobicContact CD1-CG 3.6Å; I447-L486 HydrophobicContact CG1-CD2 3.99Å; I447-L487 HydrophobicContact CG2-CD1 3.94Å; I447-L487 HydrophobicContact CG2-CD2 3.58Å; I447-L487 HydrophobicContact CG2-CG 3.53Å
448	L	95.8	Very high	89.9	Confident	12 Å²	12	50.2 Å²	50.2	6%	0.063	26%	0.261	C	S	.	.	H	α-helix	trans	-65.1	-41.3	179.4	-63.6	176.9	0	0	0	111.6	N444 F450 L451 E452 L487 L502 R505 V507 Q510	N444-L448 VanDerWaalsContact O-CG 3.28Å; N444-L448 WeakPolarHBondContact O-CG 3.42Å; N444-L448 PolarHBondContact O-N 3.17Å; L448-F450 VanDerWaalsContact C-N 3.3Å; L448-F450 PolarHBondContact O-N 3.31Å; L448-L451 WeakPolarHBondContact O-CB 3.23Å; L448-L451 PolarHBondContact O-N 3.17Å; L448-E452 WeakPolarHBondContact O-CB 3.44Å; L448-E452 PolarHBondContact O-N 3.49Å; L448-L487 HydrophobicContact CD2-CD1 4.45Å; L448-L487 HydrophobicContact CD2-CD2 4.49Å; L448-L502 HydrophobicContact CD1-CD2 4.23Å; L448-L502 HydrophobicContact CD2-CD2 4.4Å; L448-L502 HydrophobicContact CG-CD2 4.41Å; L448-R505 HydrophobicContact CD1-CB 3.48Å; L448-R505 VanDerWaalsContact CD1-CB 3.48Å; L448-R505 HydrophobicContact CD1-CG 4.38Å; L448-V507 HydrophobicContact CD1-CB 4.45Å; L448-V507 HydrophobicContact CD2-CB 3.95Å; L448-V507 HydrophobicContact CD2-CG2 3.65Å; L448-Q510 PolarHBondContact O-NE2 3.27Å
449	A	94	Very high	88.2	Confident	54 Å²	54	54.4 Å²	54.4	45%	0.446	29%	0.29	S	S	.	.	H	α-helix	trans	-64.1	-35.2	173.2	0	0	0	0	0	112.5	A445 W453	A445-A449 WeakPolarHBondContact O-CB 3.4Å; A445-A449 PolarHBondContact O-N 3.05Å; A445-A449 VanDerWaalsContact O-N 3.09Å; A449-W453 PolarHBondContact O-N 3.45Å; A449-W453 VanDerWaalsContact O-N 3.1Å
450	F	93.7	Very high	86.6	Confident	2 Å²	2	52.5 Å²	52.5	1%	0.009	28%	0.281	C	S	.	.	H	α-helix	trans	-71.1	-37.5	175.8	-174	-104.8	0	0	0	112	V400 Q420 I424 R446 I447 L448 W453 C454 Q479 T483	V400-F450 HydrophobicContact CG1-CB 3.88Å; V400-F450 HydrophobicContact CG1-CD1 3.83Å; V400-F450 HydrophobicContact CG1-CD2 4.18Å; V400-F450 HydrophobicContact CG1-CE1 4.46Å; V400-F450 HydrophobicContact CG1-CG 3.67Å; Q420-F450 VanDerWaalsContact CD-CE2 3.5Å; Q420-F450 HydrophobicContact CG-CE2 4.31Å; Q420-F450 HydrophobicContact CG-CZ 3.88Å; Q420-F450 VanDerWaalsContact NE2-CE2 3.3Å; I424-F450 HydrophobicContact CD1-CD1 4.13Å; I424-F450 HydrophobicContact CD1-CE1 3.35Å; I424-F450 HydrophobicContact CD1-CZ 3.81Å; R446-F450 WeakPolarHBondContact O-CB 3.4Å; R446-F450 PolarHBondContact O-N 3.32Å; I447-F450 WeakPolarHBondContact O-CB 3.27Å; I447-F450 PolarHBondContact O-N 3.47Å; L448-F450 VanDerWaalsContact C-N 3.3Å; L448-F450 PolarHBondContact O-N 3.31Å; F450-W453 AromaticContact CD2-CE3 3.88Å; F450-W453 HydrophobicContact CD2-CE3 3.88Å; F450-W453 HydrophobicContact CD2-CZ3 4.35Å; F450-W453 HydrophobicContact CE2-CD2 4.47Å; F450-W453 AromaticContact CE2-CE3 3.42Å; F450-W453 HydrophobicContact CE2-CE3 3.42Å; F450-W453 VanDerWaalsContact CE2-CE3 3.42Å; F450-W453 HydrophobicContact CE2-CH2 4.48Å; F450-W453 AromaticContact CE2-CZ3 3.44Å; F450-W453 HydrophobicContact CE2-CZ3 3.44Å; F450-W453 VanDerWaalsContact CE2-CZ3 3.44Å; F450-W453 AromaticContact CZ-CE3 3.84Å; F450-W453 HydrophobicContact CZ-CE3 3.84Å; F450-W453 AromaticContact CZ-CZ3 3.55Å; F450-W453 HydrophobicContact CZ-CZ3 3.55Å; F450-W453 WeakPolarHBondContact O-CB 3.49Å; F450-W453 PolarHBondContact O-N 2.96Å; F450-C454 PolarHBondContact O-N 2.9Å; F450-C454 PolarHBondContact O-SG 3.47Å; F450-Q479 HydrophobicContact CE1-CB 4Å; F450-Q479 HydrophobicContact CZ-CB 4.02Å; F450-Q479 HydrophobicContact CZ-CG 4.15Å; F450-T483 HydrophobicContact CD1-CG2 4.13Å; F450-T483 VanDerWaalsContact CD1-OG1 3.26Å; F450-T483 WeakPolarHBondContact CD1-OG1 3.44Å; F450-T483 VanDerWaalsContact CE1-OG1 3.31Å; F450-T483 WeakPolarHBondContact CE1-OG1 3.49Å
451	L	93.7	Very high	84.8	Confident	0 Å²	0	53.5 Å²	53.5	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-64.5	-43.1	174.2	-169.5	63	0	0	0	111.1	I447 L448 W453 C454 E455 M480 T483 L484 L487 Q510 L511 I514	I447-L451 WeakPolarHBondContact O-CB 3.36Å; I447-L451 PolarHBondContact O-N 2.68Å; L448-L451 WeakPolarHBondContact O-CB 3.23Å; L448-L451 PolarHBondContact O-N 3.17Å; L451-W453 VanDerWaalsContact C-N 3.29Å; L451-W453 PolarHBondContact O-N 3.32Å; L451-C454 WeakPolarHBondContact O-CA 3.32Å; L451-C454 VanDerWaalsContact O-CB 3.28Å; L451-C454 WeakPolarHBondContact O-CB 3.39Å; L451-C454 PolarHBondContact O-N 2.99Å; L451-E455 PolarHBondContact O-N 2.95Å; L451-E455 VanDerWaalsContact O-N 3.15Å; L451-M480 HydrophobicContact CD1-CG 3.73Å; L451-M480 HydrophobicContact CD1-SD 3.98Å; L451-T483 HydrophobicContact CB-CG2 4.17Å; L451-T483 HydrophobicContact CD1-CG2 4.14Å; L451-L484 HydrophobicContact CD1-CD2 4.37Å; L451-L484 HydrophobicContact CD1-CG 4.43Å; L451-L484 HydrophobicContact CD2-CD2 4.27Å; L451-L487 HydrophobicContact CD2-CD1 4.04Å; L451-Q510 HydrophobicContact CD2-CG 4.4Å; L451-L511 HydrophobicContact CD2-CD2 4.34Å; L451-I514 HydrophobicContact CD1-CD1 3.83Å; L451-I514 HydrophobicContact CD2-CD1 3.43Å; L451-I514 VanDerWaalsContact CD2-CD1 3.43Å; L451-I514 HydrophobicContact CG-CD1 3.51Å
452	E	91.8	Very high	83.2	Confident	105 Å²	105	53.1 Å²	53.1	49%	0.491	27%	0.27	S	S	.	.	H	α-helix	trans	-58.3	-42.8	173.2	-176.6	-176.6	-175	0	0	110.7	L448 C454 E455 H456 Q510	L448-E452 WeakPolarHBondContact O-CB 3.44Å; L448-E452 PolarHBondContact O-N 3.49Å; E452-C454 VanDerWaalsContact C-N 3.27Å; E452-C454 PolarHBondContact O-N 3.44Å; E452-E455 PolarHBondContact O-N 3.3Å; E452-H456 PolarHBondContact O-ND1 3.15Å; E452-Q510 VanDerWaalsContact N-NE2 3.17Å
453	W	89.4	Confident	81.5	Confident	28 Å²	28	53.2 Å²	53.2	11%	0.106	27%	0.27	C	S	.	.	H	α-helix	trans	-62.6	-31.8	173.5	170.6	75.4	0	0	0	113.5	K402 P403 A449 F450 L451 E455 K476 Q479	K402-W453 HydrophobicContact CB-CG 4.16Å; K402-W453 HydrophobicContact CG-CG 4.4Å; P403-W453 HydrophobicContact CG-CH2 4.25Å; P403-W453 HydrophobicContact CG-CZ2 3.95Å; A449-W453 PolarHBondContact O-N 3.45Å; A449-W453 VanDerWaalsContact O-N 3.1Å; F450-W453 AromaticContact CD2-CE3 3.88Å; F450-W453 HydrophobicContact CD2-CE3 3.88Å; F450-W453 HydrophobicContact CD2-CZ3 4.35Å; F450-W453 HydrophobicContact CE2-CD2 4.47Å; F450-W453 AromaticContact CE2-CE3 3.42Å; F450-W453 HydrophobicContact CE2-CE3 3.42Å; F450-W453 VanDerWaalsContact CE2-CE3 3.42Å; F450-W453 HydrophobicContact CE2-CH2 4.48Å; F450-W453 AromaticContact CE2-CZ3 3.44Å; F450-W453 HydrophobicContact CE2-CZ3 3.44Å; F450-W453 VanDerWaalsContact CE2-CZ3 3.44Å; F450-W453 AromaticContact CZ-CE3 3.84Å; F450-W453 HydrophobicContact CZ-CE3 3.84Å; F450-W453 AromaticContact CZ-CZ3 3.55Å; F450-W453 HydrophobicContact CZ-CZ3 3.55Å; F450-W453 WeakPolarHBondContact O-CB 3.49Å; F450-W453 PolarHBondContact O-N 2.96Å; L451-W453 VanDerWaalsContact C-N 3.29Å; L451-W453 PolarHBondContact O-N 3.32Å; W453-E455 VanDerWaalsContact C-N 3.34Å; W453-K476 HydrophobicContact CD2-CD 4.24Å; W453-K476 HydrophobicContact CE3-CD 4.18Å; W453-K476 HydrophobicContact CH2-CD 3.84Å; W453-K476 HydrophobicContact CH2-CG 4.31Å; W453-K476 HydrophobicContact CZ2-CD 3.88Å; W453-K476 VanDerWaalsContact CZ2-CE 3.45Å; W453-K476 HydrophobicContact CZ3-CD 3.98Å; W453-K476 PolarHBondContact O-NZ 3.34Å; W453-Q479 HydrophobicContact CZ3-CB 4.49Å; W453-Q479 HydrophobicContact CZ3-CG 4.3Å
454	C	88.8	Confident	79.8	Confident	10 Å²	10	54 Å²	54	7%	0.068	28%	0.278	C	S	.	.	H	α-helix	trans	-68.1	-33.2	176.5	-65.6	0	0	0	0	112.4	F450 L451 E452 K476 M480	F450-C454 PolarHBondContact O-N 2.9Å; F450-C454 PolarHBondContact O-SG 3.47Å; L451-C454 WeakPolarHBondContact O-CA 3.32Å; L451-C454 VanDerWaalsContact O-CB 3.28Å; L451-C454 WeakPolarHBondContact O-CB 3.39Å; L451-C454 PolarHBondContact O-N 2.99Å; E452-C454 VanDerWaalsContact C-N 3.27Å; E452-C454 PolarHBondContact O-N 3.44Å; C454-K476 HydrophobicContact CB-CB 4.3Å; C454-M480 HydrophobicContact CB-CB 4.09Å; C454-M480 HydrophobicContact CB-SD 4.3Å
455	E	83.3	Confident	78.3	Confident	61 Å²	61	61 Å²	61	29%	0.285	32%	0.316	S	S	.	.	H	α-helix	trans	-68.1	-34.2	179.3	-68.6	169.8	-141.8	0	0	112.8	L451 E452 W453 Q510 I514	L451-E455 PolarHBondContact O-N 2.95Å; L451-E455 VanDerWaalsContact O-N 3.15Å; E452-E455 PolarHBondContact O-N 3.3Å; W453-E455 VanDerWaalsContact C-N 3.34Å; E455-Q510 WeakPolarHBondContact OE1-CG 3.28Å; E455-Q510 PolarHBondContact OE1-NE2 3.05Å; E455-Q510 VanDerWaalsContact OE1-NE2 3.11Å; E455-I514 HydrophobicContact CG-CD1 4.41Å; E455-I514 HydrophobicContact CG-CG1 3.75Å; E455-I514 WeakPolarHBondContact OE1-CD1 3.47Å; E455-I514 WeakPolarHBondContact OE1-CG1 3.46Å
456	H	77.6	Confident	77.3	Confident	104 Å²	104	60.8 Å²	60.8	48%	0.481	31%	0.313	S	S	.	.	S	Bend	trans	-75.3	128	-175.9	-70.1	80.8	0	0	0	112.8	E452 N458 K476	E452-H456 PolarHBondContact O-ND1 3.15Å; H456-N458 PolarHBondContact O-N 2.85Å; H456-K476 PolarHBondContact O-NZ 2.87Å
457	E	58.5	Low	76.4	Confident	178 Å²	178	65 Å²	65	83%	0.832	33%	0.334	S	S	*	.			trans	-59.4	98.2	176.8	-74.4	-174.5	170.7	0	0	111.7
458	N	57.7	Low	75.8	Confident	99 Å²	99	66.4 Å²	66.4	53%	0.529	34%	0.34	S	S	.	.			trans	-138	136.2	160.5	-69.7	-80.6	0	0	0	106.9	H456 C460	H456-N458 PolarHBondContact O-N 2.85Å; N458-C460 PolarHBondContact O-N 2.9Å
459	S	60.8	Low	75.1	Confident	88 Å²	88	65.8 Å²	65.8	62%	0.615	34%	0.337	S	S	*	.			trans	-56.1	122.4	176.9	54.6	0	0	0	0	110.6
460	C	63.4	Low	74.5	Confident	9 Å²	9	66.7 Å²	66.7	6%	0.061	34%	0.337	C	S	.	.			trans	-78.4	141.6	170.6	-169.4	0	0	0	0	109.6	E417 N458 L462 N475 K476	E417-C460 PolarHBondContact OE2-SG 3.48Å; N458-C460 PolarHBondContact O-N 2.9Å; C460-L462 VanDerWaalsContact C-N 3.34Å; C460-N475 WeakPolarHBondContact CB-O 3.45Å; C460-N475 PolarHBondContact SG-O 2.97Å; C460-N475 VanDerWaalsContact SG-O 3.35Å; C460-K476 HydrophobicContact CB-CG 4.29Å
461	F	59.5	Low	73.5	Confident	123 Å²	123	67.7 Å²	67.7	54%	0.539	35%	0.348	S	S	.	.			trans	-88.3	-3.8	-179	-62.7	-81.7	0	0	0	112.7	A413 E417 H463	A413-F461 HydrophobicContact CB-CB 4.32Å; A413-F461 HydrophobicContact CB-CD2 3.86Å; A413-F461 HydrophobicContact CB-CE2 4.43Å; A413-F461 HydrophobicContact CB-CG 4.13Å; E417-F461 WeakPolarHBondContact OE2-CA 3.45Å; E417-F461 PolarHBondContact OE2-N 3.19Å; F461-H463 PolarHBondContact O-ND1 3.34Å
462	L	60.5	Low	72.3	Confident	9 Å²	9	67.7 Å²	67.7	5%	0.047	35%	0.348	C	S	.	.			trans	-62.2	139	172.4	-107.3	90.2	0	0	0	112.5	E417 L421 C460 G469	E417-L462 HydrophobicContact CB-CD1 3.14Å; E417-L462 HydrophobicContact CG-CD1 4.22Å; E417-L462 WeakPolarHBondContact OE2-CD1 3.47Å; E417-L462 PolarHBondContact OE2-N 3.01Å; E417-L462 VanDerWaalsContact OE2-N 3.1Å; L421-L462 HydrophobicContact CD1-CD1 4.43Å; L421-L462 HydrophobicContact CD1-CD2 3.6Å; C460-L462 VanDerWaalsContact C-N 3.34Å; L462-G469 VanDerWaalsContact CD2-CA 3.46Å
463	H	60.5	Low	71.5	Confident	126 Å²	126	71.8 Å²	71.8	58%	0.583	36%	0.359	S	S	*	.			trans	-89.7	-8.4	175	-68.1	66.1	0	0	0	112.7	F461 N465	F461-H463 PolarHBondContact O-ND1 3.34Å; H463-N465 VanDerWaalsContact C-N 3.34Å
464	G	61.2	Low	70.6	Confident	16 Å²	16	72.8 Å²	72.8	17%	0.165	38%	0.378	C	S	.	.	S	Bend	trans	80.1	6.4	177.4	0	0	0	0	0	115.9	G469	G464-G469 WeakPolarHBondContact CA-O 3.39Å
465	N	65.8	Low	70.3	Confident	150 Å²	150	74.1 Å²	74.1	80%	0.802	38%	0.384	S	S	*	.			trans	-94.4	-6.4	-174.7	-63.2	-20.2	0	0	0	114.1	H463	H463-N465 VanDerWaalsContact C-N 3.34Å
466	S	75.2	Confident	70.5	Confident	18 Å²	18	71.7 Å²	71.7	13%	0.126	37%	0.373	C	S	.	.	S	Bend	trans	-83.9	154	177	60.3	0	0	0	0	111	E418 H468 G469 T470	E418-S466 WeakPolarHBondContact OE2-CB 3.33Å; S466-H468 VanDerWaalsContact C-N 3.34Å; S466-H468 PolarHBondContact O-N 2.91Å; S466-G469 WeakPolarHBondContact O-CA 3.09Å; S466-G469 PolarHBondContact O-N 3.45Å; S466-G469 WeakPolarHBondContact OG-CA 3.19Å; S466-G469 PolarHBondContact OG-N 3.13Å; S466-T470 PolarHBondContact O-N 3.5Å
467	F	77.6	Confident	70.9	Confident	173 Å²	173	67.4 Å²	67.4	76%	0.759	35%	0.353	S	S	*	.	G	3₁₀ helix	trans	-51.5	-49.4	-175.7	-179.7	-102.7	0	0	0	112.7	T470	F467-T470 PolarHBondContact O-OG1 2.87Å
468	H	84	Confident	72.4	Confident	29 Å²	29	59 Å²	59	13%	0.134	31%	0.313	C	S	.	.	G	3₁₀ helix	trans	-83.4	-10.1	175.3	-62.1	-48	0	0	0	114.1	L421 H422 S466 Y482	L421-H468 HydrophobicContact CB-CB 3.82Å; L421-H468 HydrophobicContact CD1-CB 4.46Å; H422-H468 AromaticContact CD2-CD2 3.47Å; H422-H468 PolarHBondContact CD2-CD2 3.45Å; H422-H468 VanDerWaalsContact CD2-CD2 3.47Å; H422-H468 AromaticContact CD2-NE2 3.81Å; H422-H468 AromaticContact CE1-CD2 3.67Å; H422-H468 AromaticContact CG-CD2 3.66Å; H422-H468 AromaticContact ND1-CD2 3.78Å; H422-H468 AromaticContact NE2-CD2 3.48Å; H422-H468 PolarHBondContact NE2-CD2 3.48Å; S466-H468 VanDerWaalsContact C-N 3.34Å; S466-H468 PolarHBondContact O-N 2.91Å; H468-Y482 HydrophobicContact CB-CE2 3.77Å; H468-Y482 AromaticContact CG-CZ 3.84Å; H468-Y482 AromaticContact ND1-CE1 3.67Å; H468-Y482 AromaticContact ND1-CZ 3.22Å; H468-Y482 PolarHBondContact ND1-OH 2.99Å; H468-Y482 VanDerWaalsContact O-CE2 3.3Å; H468-Y482 WeakPolarHBondContact O-CE2 3.4Å
469	G	80.2	Confident	74	Confident	0 Å²	0	54.2 Å²	54.2	0%	0	29%	0.288	C	S	.	.	G	3₁₀ helix	trans	-88.9	-5	-175.1	0	0	0	0	0	115.3	L462 G464 S466 G471 G472	L462-G469 VanDerWaalsContact CD2-CA 3.46Å; G464-G469 WeakPolarHBondContact CA-O 3.39Å; S466-G469 WeakPolarHBondContact O-CA 3.09Å; S466-G469 PolarHBondContact O-N 3.45Å; S466-G469 WeakPolarHBondContact OG-CA 3.19Å; S466-G469 PolarHBondContact OG-N 3.13Å; G469-G471 PolarHBondContact O-N 3.42Å; G469-G472 PolarHBondContact O-N 3.09Å
470	T	81.2	Confident	75.5	Confident	73 Å²	73	50.4 Å²	50.4	45%	0.448	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	-50.1	128.2	-179.8	-49.1	0	0	0	0	110.9	S466 F467 G472 I529	S466-T470 PolarHBondContact O-N 3.5Å; F467-T470 PolarHBondContact O-OG1 2.87Å; T470-G472 VanDerWaalsContact C-N 3.31Å; T470-G472 PolarHBondContact O-N 3.32Å; T470-I529 HydrophobicContact CG2-CD1 4.11Å; T470-I529 WeakPolarHBondContact O-CD1 3.26Å
471	G	72.4	Confident	76.9	Confident	22 Å²	22	52.1 Å²	52.1	23%	0.227	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	83.9	-11	-177.3	0	0	0	0	0	116.3	G469 R473 N475	G469-G471 PolarHBondContact O-N 3.42Å; G471-R473 VanDerWaalsContact C-N 3.3Å; G471-R473 PolarHBondContact O-N 3.05Å; G471-N475 PolarHBondContact O-ND2 3.1Å; G471-N475 PolarHBondContact O-OD1 3.11Å
472	G	68.6	Low	78.5	Confident	0 Å²	0	47 Å²	47	0%	0	24%	0.242	C	C	.	.			trans	-84.2	11.5	-177.7	0	0	0	0	0	115.4	G469 T470 G474 N475	G469-G472 PolarHBondContact O-N 3.09Å; T470-G472 VanDerWaalsContact C-N 3.31Å; T470-G472 PolarHBondContact O-N 3.32Å; G472-G474 PolarHBondContact O-N 3.26Å; G472-G474 VanDerWaalsContact O-N 3.13Å; G472-N475 CarbonylContact C-O 3.44Å
473	R	74.6	Confident	80.2	Confident	191 Å²	191	46.6 Å²	46.6	72%	0.721	24%	0.241	S	C	*	.	S	Bend	trans	-73.8	108.3	-177.6	-171.9	177.6	180	-178.9	-0	110.1	G471 N475	G471-R473 VanDerWaalsContact C-N 3.3Å; G471-R473 PolarHBondContact O-N 3.05Å; R473-N475 PolarHBondContact O-N 3.43Å
474	G	72.1	Confident	82	Confident	50 Å²	50	40.6 Å²	40.6	52%	0.515	21%	0.213	S	C	.	.	S	Bend	trans	77.2	2.4	179.5	0	0	0	0	0	115.1	G472	G472-G474 PolarHBondContact O-N 3.26Å; G472-G474 VanDerWaalsContact O-N 3.13Å
475	N	81.8	Confident	83.6	Confident	38 Å²	38	43.7 Å²	43.7	20%	0.203	22%	0.219	C	C	.	.	S	Bend	trans	-140.6	174.7	177.5	69.7	52.3	0	0	0	110.5	C460 G471 G472 R473 Y477	C460-N475 WeakPolarHBondContact CB-O 3.45Å; C460-N475 PolarHBondContact SG-O 2.97Å; C460-N475 VanDerWaalsContact SG-O 3.35Å; G471-N475 PolarHBondContact O-ND2 3.1Å; G471-N475 PolarHBondContact O-OD1 3.11Å; G472-N475 CarbonylContact C-O 3.44Å; R473-N475 PolarHBondContact O-N 3.43Å; N475-Y477 HydrophobicContact CB-CG 4.45Å; N475-Y477 WeakPolarHBondContact OD1-CB 3.37Å; N475-Y477 VanDerWaalsContact OD1-CG 3.27Å; N475-Y477 PolarHBondContact OD1-N 3.48Å
476	K	86.5	Confident	85.1	Confident	10 Å²	10	36.6 Å²	36.6	4%	0.043	18%	0.182	C	C	.	.	S	Bend	trans	-105.8	22.3	-180	-60.3	171.1	-170.1	158.9	0	113.5	W453 C454 H456 C460 A478 Q479 M480	W453-K476 HydrophobicContact CD2-CD 4.24Å; W453-K476 HydrophobicContact CE3-CD 4.18Å; W453-K476 HydrophobicContact CH2-CD 3.84Å; W453-K476 HydrophobicContact CH2-CG 4.31Å; W453-K476 HydrophobicContact CZ2-CD 3.88Å; W453-K476 VanDerWaalsContact CZ2-CE 3.45Å; W453-K476 HydrophobicContact CZ3-CD 3.98Å; W453-K476 PolarHBondContact O-NZ 3.34Å; C454-K476 HydrophobicContact CB-CB 4.3Å; H456-K476 PolarHBondContact O-NZ 2.87Å; C460-K476 HydrophobicContact CB-CG 4.29Å; K476-A478 VanDerWaalsContact C-N 3.29Å; K476-A478 PolarHBondContact O-N 3.25Å; K476-Q479 VanDerWaalsContact CA-OE1 3.28Å; K476-Q479 PolarHBondContact O-N 2.89Å; K476-Q479 PolarHBondContact O-OE1 3.48Å; K476-M480 PolarHBondContact O-N 3.47Å
477	Y	87.7	Confident	86.2	Confident	14 Å²	14	35.7 Å²	35.7	6%	0.055	18%	0.176	C	C	.	.	H	α-helix	trans	-64.8	-33.8	-176.3	-67.4	-15.2	0	0	0	112.7	N475 M480 R481 M518 R521 I533	N475-Y477 HydrophobicContact CB-CG 4.45Å; N475-Y477 WeakPolarHBondContact OD1-CB 3.37Å; N475-Y477 VanDerWaalsContact OD1-CG 3.27Å; N475-Y477 PolarHBondContact OD1-N 3.48Å; Y477-M480 HydrophobicContact CD1-CE 4.03Å; Y477-M480 HydrophobicContact CE1-CE 4.28Å; Y477-M480 PolarHBondContact O-N 3.29Å; Y477-R481 WeakPolarHBondContact O-CB 3.41Å; Y477-R481 PolarHBondContact O-N 2.93Å; Y477-M518 HydrophobicContact CD1-CE 3.6Å; Y477-M518 HydrophobicContact CD1-SD 4.3Å; Y477-M518 HydrophobicContact CD2-CE 4.31Å; Y477-M518 HydrophobicContact CE1-CE 3.34Å; Y477-M518 HydrophobicContact CE1-SD 3.48Å; Y477-M518 WeakPolarHBondContact CE1-SD 3.5Å; Y477-M518 HydrophobicContact CE2-CE 4.09Å; Y477-M518 HydrophobicContact CG-CE 4.07Å; Y477-M518 PolarHBondContact OH-SD 2.84Å; Y477-R521 WeakPolarHBondContact OH-CD 3.07Å; Y477-R521 PolarHBondContact OH-NE 3.29Å; Y477-R521 PolarHBondContact OH-NH1 2.84Å; Y477-I533 HydrophobicContact CD1-CD1 4.4Å; Y477-I533 HydrophobicContact CG-CD1 4.21Å
478	A	89.6	Confident	87.1	Confident	0 Å²	0	30.8 Å²	30.8	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-59.3	-48.4	173	0	0	0	0	0	110.8	L421 K476 M480 R481 Y482	L421-A478 HydrophobicContact CD1-CB 4.13Å; L421-A478 VanDerWaalsContact CD2-C 3.46Å; L421-A478 HydrophobicContact CD2-CB 3.79Å; K476-A478 VanDerWaalsContact C-N 3.29Å; K476-A478 PolarHBondContact O-N 3.25Å; A478-M480 PolarHBondContact O-N 3.48Å; A478-R481 PolarHBondContact O-N 3.45Å; A478-Y482 VanDerWaalsContact O-CD2 3.31Å; A478-Y482 WeakPolarHBondContact O-CD2 3.45Å; A478-Y482 PolarHBondContact O-N 2.9Å; A478-Y482 VanDerWaalsContact O-N 3.09Å
479	Q	91	Very high	87.8	Confident	0 Å²	0	30.7 Å²	30.7	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-63	-45.4	178.4	-68.1	82.5	-7.1	0	0	111.1	L421 F450 W453 K476 R481 Y482 T483	L421-Q479 HydrophobicContact CD2-CB 4.43Å; L421-Q479 HydrophobicContact CD2-CG 3.97Å; L421-Q479 HydrophobicContact CG-CG 4.45Å; F450-Q479 HydrophobicContact CE1-CB 4Å; F450-Q479 HydrophobicContact CZ-CB 4.02Å; F450-Q479 HydrophobicContact CZ-CG 4.15Å; W453-Q479 HydrophobicContact CZ3-CB 4.49Å; W453-Q479 HydrophobicContact CZ3-CG 4.3Å; K476-Q479 VanDerWaalsContact CA-OE1 3.28Å; K476-Q479 PolarHBondContact O-N 2.89Å; K476-Q479 PolarHBondContact O-OE1 3.48Å; Q479-R481 PolarHBondContact O-N 2.91Å; Q479-Y482 PolarHBondContact O-N 3.28Å; Q479-T483 WeakPolarHBondContact O-CB 3.14Å; Q479-T483 PolarHBondContact O-N 3.18Å; Q479-T483 PolarHBondContact O-OG1 3.31Å
480	M	92.7	Very high	88.6	Confident	7 Å²	7	30.7 Å²	30.7	3%	0.034	16%	0.156	C	C	.	.	H	α-helix	trans	-59.2	-47.1	176.8	-173.9	140.5	71.7	0	0	111.8	L451 C454 K476 Y477 A478 Y482 T483 L484 I514 M518 I533	L451-M480 HydrophobicContact CD1-CG 3.73Å; L451-M480 HydrophobicContact CD1-SD 3.98Å; C454-M480 HydrophobicContact CB-CB 4.09Å; C454-M480 HydrophobicContact CB-SD 4.3Å; K476-M480 PolarHBondContact O-N 3.47Å; Y477-M480 HydrophobicContact CD1-CE 4.03Å; Y477-M480 HydrophobicContact CE1-CE 4.28Å; Y477-M480 PolarHBondContact O-N 3.29Å; A478-M480 PolarHBondContact O-N 3.48Å; M480-Y482 PolarHBondContact O-N 2.9Å; M480-T483 WeakPolarHBondContact O-CB 3.34Å; M480-T483 PolarHBondContact O-N 2.93Å; M480-L484 HydrophobicContact CG-CD1 4.14Å; M480-L484 HydrophobicContact CG-CG 4.47Å; M480-L484 WeakPolarHBondContact O-CG 3.31Å; M480-L484 PolarHBondContact O-N 2.76Å; M480-I514 HydrophobicContact CE-CG2 4.02Å; M480-I514 HydrophobicContact SD-CD1 4.3Å; M480-I514 HydrophobicContact SD-CG1 4.36Å; M480-I514 HydrophobicContact SD-CG2 3.77Å; M480-M518 HydrophobicContact CE-CE 3.72Å; M480-M518 HydrophobicContact CE-SD 4.05Å; M480-I533 HydrophobicContact CB-CD1 4.37Å; M480-I533 HydrophobicContact CE-CD1 4.28Å; M480-I533 HydrophobicContact CE-CG2 4.22Å; M480-I533 HydrophobicContact CG-CD1 4.4Å; M480-I533 HydrophobicContact CG-CG2 4.36Å
481	R	92.1	Very high	89.4	Confident	45 Å²	45	27.3 Å²	27.3	17%	0.17	14%	0.136	C	C	.	.	H	α-helix	trans	-56.9	-49.8	177.9	179	-173.1	176.3	-177.3	7.1	112.2	Y477 A478 Q479 T483 L484 R485 E532 I533	Y477-R481 WeakPolarHBondContact O-CB 3.41Å; Y477-R481 PolarHBondContact O-N 2.93Å; A478-R481 PolarHBondContact O-N 3.45Å; Q479-R481 PolarHBondContact O-N 2.91Å; R481-T483 VanDerWaalsContact C-N 3.31Å; R481-T483 PolarHBondContact O-N 2.95Å; R481-L484 PolarHBondContact O-N 3.23Å; R481-R485 PolarHBondContact O-N 3.5Å; R481-E532 IonicContact CZ-OE1 3.96Å; R481-E532 IonicContact CZ-OE2 2.81Å; R481-E532 IonicContact NE-OE1 2.59Å; R481-E532 PolarHBondContact NE-OE1 3.1Å; R481-E532 IonicContact NE-OE2 2.77Å; R481-E532 PolarHBondContact NE-OE2 3.41Å; R481-E532 IonicContact NH1-OE2 3.25Å; R481-E532 IonicContact NH2-OE1 3.8Å; R481-E532 PolarHBondContact NH2-OE1 3.46Å; R481-E532 IonicContact NH2-OE2 3.81Å; R481-E532 PolarHBondContact NH2-OE2 3.45Å; R481-I533 HydrophobicContact CB-CD1 4.41Å; R481-I533 HydrophobicContact CB-CG1 4.12Å
482	Y	94.1	Very high	90.4	Very high	15 Å²	15	31.8 Å²	31.8	6%	0.059	15%	0.146	C	C	.	.	H	α-helix	trans	-69.1	-31.7	179.1	-81.1	-79.8	0	0	0	112.4	L421 I424 A425 H468 A478 Q479 M480 R485 L486	L421-Y482 HydrophobicContact CD2-CD2 3.85Å; I424-Y482 VanDerWaalsContact CG2-C 3.43Å; I424-Y482 VanDerWaalsContact CG2-O 3.28Å; I424-Y482 WeakPolarHBondContact CG2-O 3.45Å; A425-Y482 HydrophobicContact CB-CD1 3.7Å; A425-Y482 HydrophobicContact CB-CE1 3.75Å; H468-Y482 HydrophobicContact CB-CE2 3.77Å; H468-Y482 AromaticContact CG-CZ 3.84Å; H468-Y482 AromaticContact ND1-CE1 3.67Å; H468-Y482 AromaticContact ND1-CZ 3.22Å; H468-Y482 PolarHBondContact ND1-OH 2.99Å; H468-Y482 VanDerWaalsContact O-CE2 3.3Å; H468-Y482 WeakPolarHBondContact O-CE2 3.4Å; A478-Y482 VanDerWaalsContact O-CD2 3.31Å; A478-Y482 WeakPolarHBondContact O-CD2 3.45Å; A478-Y482 PolarHBondContact O-N 2.9Å; A478-Y482 VanDerWaalsContact O-N 3.09Å; Q479-Y482 PolarHBondContact O-N 3.28Å; M480-Y482 PolarHBondContact O-N 2.9Å; Y482-R485 PolarHBondContact O-N 2.81Å; Y482-L486 PolarHBondContact O-N 2.79Å
483	T	96.3	Very high	91.7	Very high	1 Å²	1	34.9 Å²	34.9	1%	0.006	16%	0.163	C	C	.	.	H	α-helix	trans	-66.5	-44.2	174.9	-54.8	0	0	0	0	111.3	I447 F450 L451 Q479 M480 R481 R485 L486 L487	I447-T483 HydrophobicContact CG2-CG2 3.6Å; F450-T483 HydrophobicContact CD1-CG2 4.13Å; F450-T483 VanDerWaalsContact CD1-OG1 3.26Å; F450-T483 WeakPolarHBondContact CD1-OG1 3.44Å; F450-T483 VanDerWaalsContact CE1-OG1 3.31Å; F450-T483 WeakPolarHBondContact CE1-OG1 3.49Å; L451-T483 HydrophobicContact CB-CG2 4.17Å; L451-T483 HydrophobicContact CD1-CG2 4.14Å; Q479-T483 WeakPolarHBondContact O-CB 3.14Å; Q479-T483 PolarHBondContact O-N 3.18Å; Q479-T483 PolarHBondContact O-OG1 3.31Å; M480-T483 WeakPolarHBondContact O-CB 3.34Å; M480-T483 PolarHBondContact O-N 2.93Å; R481-T483 VanDerWaalsContact C-N 3.31Å; R481-T483 PolarHBondContact O-N 2.95Å; T483-R485 VanDerWaalsContact C-N 3.35Å; T483-L486 PolarHBondContact O-N 3.08Å; T483-L487 PolarHBondContact O-N 3.01Å
484	L	96.7	Very high	92.6	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-64.6	-38.4	173.4	-68.7	174	0	0	0	111.5	L451 M480 R481 L486 L487 R488 L511 I533 D536 I540	L451-L484 HydrophobicContact CD1-CD2 4.37Å; L451-L484 HydrophobicContact CD1-CG 4.43Å; L451-L484 HydrophobicContact CD2-CD2 4.27Å; M480-L484 HydrophobicContact CG-CD1 4.14Å; M480-L484 HydrophobicContact CG-CG 4.47Å; M480-L484 WeakPolarHBondContact O-CG 3.31Å; M480-L484 PolarHBondContact O-N 2.76Å; R481-L484 PolarHBondContact O-N 3.23Å; L484-L486 VanDerWaalsContact C-N 3.31Å; L484-L486 PolarHBondContact O-N 3.14Å; L484-L487 HydrophobicContact CD2-CD1 4.25Å; L484-L487 PolarHBondContact O-N 3.3Å; L484-R488 WeakPolarHBondContact O-CB 3.27Å; L484-R488 PolarHBondContact O-N 3.09Å; L484-L511 HydrophobicContact CD2-CD2 3.38Å; L484-I533 HydrophobicContact CD1-CB 4.3Å; L484-I533 HydrophobicContact CD1-CG1 4.46Å; L484-I533 HydrophobicContact CD1-CG2 3.7Å; L484-D536 HydrophobicContact CB-CB 4.16Å; L484-D536 HydrophobicContact CD1-CB 4.48Å; L484-I540 HydrophobicContact CB-CD1 4.11Å; L484-I540 HydrophobicContact CD2-CD1 3.75Å; L484-I540 WeakPolarHBondContact O-CD1 3.46Å
485	R	96.1	Very high	93.8	Very high	81 Å²	81	32.5 Å²	32.5	31%	0.306	15%	0.148	S	C	.	.	H	α-helix	trans	-60.4	-40.3	174	-178.7	170.2	-75.3	178	-0.8	112.4	R481 Y482 T483 A489 E532	R481-R485 PolarHBondContact O-N 3.5Å; Y482-R485 PolarHBondContact O-N 2.81Å; T483-R485 VanDerWaalsContact C-N 3.35Å; R485-A489 WeakPolarHBondContact O-CB 3.3Å; R485-A489 PolarHBondContact O-N 2.84Å; R485-E532 IonicContact NH2-OE1 3.86Å; R485-E532 PolarHBondContact NH2-OE1 2.89Å
486	L	97.4	Very high	94.4	Very high	1 Å²	1	34 Å²	34	1%	0.005	15%	0.153	C	C	.	.	H	α-helix	trans	-65.5	-49.5	173.6	173.7	55	0	0	0	111.4	I424 L427 S428 A431 I447 Y482 T483 L484 R488 A489 M490	I424-L486 HydrophobicContact CG2-CB 4.36Å; I424-L486 HydrophobicContact CG2-CD2 4.36Å; L427-L486 HydrophobicContact CB-CD1 4.16Å; L427-L486 HydrophobicContact CB-CD2 3.77Å; L427-L486 HydrophobicContact CD1-CD2 4.27Å; S428-L486 WeakPolarHBondContact OG-CA 3.21Å; S428-L486 WeakPolarHBondContact OG-CB 3.31Å; S428-L486 PolarHBondContact OG-N 2.88Å; A431-L486 HydrophobicContact CB-CD1 3.99Å; I447-L486 HydrophobicContact CD1-CD2 3.3Å; I447-L486 HydrophobicContact CD1-CG 3.6Å; I447-L486 HydrophobicContact CG1-CD2 3.99Å; Y482-L486 PolarHBondContact O-N 2.79Å; T483-L486 PolarHBondContact O-N 3.08Å; L484-L486 VanDerWaalsContact C-N 3.31Å; L484-L486 PolarHBondContact O-N 3.14Å; L486-R488 VanDerWaalsContact C-N 3.28Å; L486-R488 PolarHBondContact O-N 3.37Å; L486-A489 WeakPolarHBondContact O-CB 3.35Å; L486-A489 PolarHBondContact O-N 2.64Å; L486-A489 VanDerWaalsContact O-N 3.13Å; L486-M490 HydrophobicContact CD1-CG 4.11Å; L486-M490 HydrophobicContact CD1-SD 4.43Å; L486-M490 WeakPolarHBondContact O-CG 3.41Å; L486-M490 PolarHBondContact O-N 3.01Å
487	L	97.9	Very high	94.8	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-54.6	-46.9	175.9	-80.3	172.2	0	0	0	111.5	I447 L448 L451 T483 L484 A489 M490 V491 L502 I540	I447-L487 HydrophobicContact CG2-CD1 3.94Å; I447-L487 HydrophobicContact CG2-CD2 3.58Å; I447-L487 HydrophobicContact CG2-CG 3.53Å; L448-L487 HydrophobicContact CD2-CD1 4.45Å; L448-L487 HydrophobicContact CD2-CD2 4.49Å; L451-L487 HydrophobicContact CD2-CD1 4.04Å; T483-L487 PolarHBondContact O-N 3.01Å; L484-L487 HydrophobicContact CD2-CD1 4.25Å; L484-L487 PolarHBondContact O-N 3.3Å; L487-A489 VanDerWaalsContact C-N 3.35Å; L487-A489 PolarHBondContact O-N 3.41Å; L487-M490 PolarHBondContact O-N 2.95Å; L487-M490 VanDerWaalsContact O-N 3.14Å; L487-V491 WeakPolarHBondContact O-CG2 3.48Å; L487-V491 PolarHBondContact O-N 3.48Å; L487-L502 HydrophobicContact CD2-CD1 4.43Å; L487-L502 HydrophobicContact CD2-CD2 3.79Å; L487-I540 HydrophobicContact CB-CD1 3.91Å
488	R	97.3	Very high	95.2	Very high	69 Å²	69	38.7 Å²	38.7	26%	0.26	18%	0.179	S	C	.	.	H	α-helix	trans	-58.9	-46.3	177.6	-166.2	178.9	74.7	165.4	10.1	111.3	L484 L486 M490 V491 Y492 D536 I540	L484-R488 WeakPolarHBondContact O-CB 3.27Å; L484-R488 PolarHBondContact O-N 3.09Å; L486-R488 VanDerWaalsContact C-N 3.28Å; L486-R488 PolarHBondContact O-N 3.37Å; R488-M490 VanDerWaalsContact C-N 3.27Å; R488-M490 PolarHBondContact O-N 3.4Å; R488-V491 PolarHBondContact O-N 2.93Å; R488-Y492 HydrophobicContact CG-CD2 3.56Å; R488-Y492 HydrophobicContact CG-CE2 3.31Å; R488-Y492 WeakPolarHBondContact O-CD2 3.32Å; R488-Y492 PolarHBondContact O-N 3.38Å; R488-D536 IonicContact CZ-OD1 2.69Å; R488-D536 IonicContact NE-OD1 3.59Å; R488-D536 IonicContact NH1-OD1 3.83Å; R488-D536 PolarHBondContact NH1-OD1 3.5Å; R488-I540 HydrophobicContact CB-CD1 4.12Å; R488-I540 HydrophobicContact CB-CG1 3.69Å; R488-I540 HydrophobicContact CG-CG1 4.04Å
489	A	97.2	Very high	95.6	Very high	28 Å²	28	38.8 Å²	38.8	23%	0.231	18%	0.179	C	C	.	.	H	α-helix	trans	-61.1	-35	176.8	0	0	0	0	0	112.8	P432 R485 L486 L487	P432-A489 HydrophobicContact CG-CB 3.9Å; R485-A489 WeakPolarHBondContact O-CB 3.3Å; R485-A489 PolarHBondContact O-N 2.84Å; L486-A489 WeakPolarHBondContact O-CB 3.35Å; L486-A489 PolarHBondContact O-N 2.64Å; L486-A489 VanDerWaalsContact O-N 3.13Å; L487-A489 VanDerWaalsContact C-N 3.35Å; L487-A489 PolarHBondContact O-N 3.41Å
490	M	97.8	Very high	95.8	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-74.9	-41.1	176.4	-63	-53.2	-59.8	0	0	112.6	A431 P432 I435 Y438 L486 L487 R488 L493 V498	A431-M490 HydrophobicContact CB-SD 3.74Å; P432-M490 HydrophobicContact CG-SD 4.07Å; I435-M490 HydrophobicContact CG1-CE 4.5Å; Y438-M490 HydrophobicContact CD1-CE 3.76Å; Y438-M490 HydrophobicContact CD2-CE 4.4Å; Y438-M490 HydrophobicContact CE1-CE 3.87Å; Y438-M490 HydrophobicContact CE2-CE 4.45Å; Y438-M490 HydrophobicContact CE2-CG 4.29Å; Y438-M490 HydrophobicContact CE2-SD 4.39Å; Y438-M490 HydrophobicContact CG-CE 4.05Å; L486-M490 HydrophobicContact CD1-CG 4.11Å; L486-M490 HydrophobicContact CD1-SD 4.43Å; L486-M490 WeakPolarHBondContact O-CG 3.41Å; L486-M490 PolarHBondContact O-N 3.01Å; L487-M490 PolarHBondContact O-N 2.95Å; L487-M490 VanDerWaalsContact O-N 3.14Å; R488-M490 VanDerWaalsContact C-N 3.27Å; R488-M490 PolarHBondContact O-N 3.4Å; M490-L493 HydrophobicContact CE-CD1 3.88Å; M490-L493 WeakPolarHBondContact O-CB 3.32Å; M490-L493 PolarHBondContact O-N 3.39Å; M490-L493 HydrophobicContact SD-CD1 4.19Å; M490-V498 HydrophobicContact CB-CG1 4.28Å; M490-V498 HydrophobicContact CE-CG1 4.4Å; M490-V498 HydrophobicContact CE-CG2 4.48Å
491	V	96.9	Very high	96.1	Very high	2 Å²	2	42.5 Å²	42.5	1%	0.012	20%	0.201	C	C	.	.	H	α-helix	trans	-66.7	-39.7	-179.3	169	0	0	0	0	112	L487 R488 L493 E494 N499 L502 I540 L544	L487-V491 WeakPolarHBondContact O-CG2 3.48Å; L487-V491 PolarHBondContact O-N 3.48Å; R488-V491 PolarHBondContact O-N 2.93Å; V491-L493 PolarHBondContact O-N 3.18Å; V491-L493 VanDerWaalsContact O-N 3.13Å; V491-E494 PolarHBondContact O-N 2.94Å; V491-N499 WeakPolarHBondContact CA-OD1 3.25Å; V491-L502 HydrophobicContact CG2-CD1 3.76Å; V491-I540 HydrophobicContact CG2-CG2 4.04Å; V491-L544 HydrophobicContact CG1-CD2 4Å; V491-L544 HydrophobicContact CG1-CG 3.93Å; V491-L544 HydrophobicContact CG2-CD2 3.7Å; V491-L544 HydrophobicContact CG2-CG 3.99Å
492	Y	95.1	Very high	96.3	Very high	115 Å²	115	40.3 Å²	40.3	45%	0.451	19%	0.193	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.4	-1.1	177.6	-80.5	-62.2	0	0	0	114.7	R488	R488-Y492 HydrophobicContact CG-CD2 3.56Å; R488-Y492 HydrophobicContact CG-CE2 3.31Å; R488-Y492 WeakPolarHBondContact O-CD2 3.32Å; R488-Y492 PolarHBondContact O-N 3.38Å
493	L	95	Very high	96.4	Very high	65 Å²	65	40.1 Å²	40.1	34%	0.34	19%	0.193	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.5	-14.9	167.4	-66.8	167	0	0	0	112.3	P432 I435 M490 V491 D495	P432-L493 HydrophobicContact CB-CD1 3.77Å; P432-L493 HydrophobicContact CB-CD2 3.96Å; P432-L493 HydrophobicContact CB-CG 4.21Å; I435-L493 HydrophobicContact CD1-CD1 3.87Å; I435-L493 HydrophobicContact CG1-CD1 4.05Å; M490-L493 HydrophobicContact CE-CD1 3.88Å; M490-L493 WeakPolarHBondContact O-CB 3.32Å; M490-L493 PolarHBondContact O-N 3.39Å; M490-L493 HydrophobicContact SD-CD1 4.19Å; V491-L493 PolarHBondContact O-N 3.18Å; V491-L493 VanDerWaalsContact O-N 3.13Å; L493-D495 HydrophobicContact CB-CB 4.44Å; L493-D495 PolarHBondContact O-N 3.14Å; L493-D495 VanDerWaalsContact O-N 3.13Å
494	E	94.1	Very high	96.4	Very high	147 Å²	147	47.3 Å²	47.3	69%	0.687	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	56.1	26	-174.9	-60.4	174.7	-169	0	0	112.6	V491 E496	V491-E494 PolarHBondContact O-N 2.94Å; E494-E496 PolarHBondContact O-N 3.09Å
495	D	96.1	Very high	96.3	Very high	44 Å²	44	52.7 Å²	52.7	24%	0.235	25%	0.247	C	C	.	.			trans	-78	114.4	175.4	-175.2	-77.2	0	0	0	110.3	L493 I497 V498 N499	L493-D495 HydrophobicContact CB-CB 4.44Å; L493-D495 PolarHBondContact O-N 3.14Å; L493-D495 VanDerWaalsContact O-N 3.13Å; D495-I497 VanDerWaalsContact C-N 3.31Å; D495-I497 PolarHBondContact O-N 3.38Å; D495-I497 WeakPolarHBondContact OD1-CA 3.39Å; D495-I497 WeakPolarHBondContact OD1-CB 3.46Å; D495-I497 PolarHBondContact OD1-N 3.23Å; D495-V498 HydrophobicContact CB-CB 4.24Å; D495-V498 HydrophobicContact CB-CG2 4.15Å; D495-V498 PolarHBondContact O-N 3.43Å; D495-V498 WeakPolarHBondContact OD1-CG2 3.47Å; D495-V498 PolarHBondContact OD1-N 2.8Å; D495-N499 WeakPolarHBondContact O-CB 3.01Å; D495-N499 PolarHBondContact O-N 3.49Å
496	E	94.1	Very high	96.3	Very high	69 Å²	69	49.9 Å²	49.9	32%	0.322	24%	0.244	S	C	.	.	H	α-helix	trans	-67.3	-27.3	-175.1	-76.9	-54.3	132.9	0	0	114.4	E494 T500 Y548 R551	E494-E496 PolarHBondContact O-N 3.09Å; E496-T500 WeakPolarHBondContact O-CB 3.5Å; E496-T500 PolarHBondContact O-N 3.14Å; E496-T500 PolarHBondContact O-OG1 2.84Å; E496-Y548 VanDerWaalsContact OE1-CE2 3.31Å; E496-Y548 WeakPolarHBondContact OE1-CE2 3.37Å; E496-Y548 PolarHBondContact OE1-OH 2.89Å; E496-Y548 PolarHBondContact OE2-OH 3.33Å; E496-R551 IonicContact OE2-CZ 2.64Å; E496-R551 IonicContact OE2-NH1 3.48Å; E496-R551 IonicContact OE2-NH2 3.85Å; E496-R551 PolarHBondContact OE2-NH2 2.98Å
497	I	95.8	Very high	96.3	Very high	123 Å²	123	49.9 Å²	49.9	63%	0.631	24%	0.244	S	C	*	.	H	α-helix	trans	-70	-46.7	178.1	-59.5	174	0	0	0	108.8	M439 D495 D501	M439-I497 HydrophobicContact CE-CG2 4.45Å; D495-I497 VanDerWaalsContact C-N 3.31Å; D495-I497 PolarHBondContact O-N 3.38Å; D495-I497 WeakPolarHBondContact OD1-CA 3.39Å; D495-I497 WeakPolarHBondContact OD1-CB 3.46Å; D495-I497 PolarHBondContact OD1-N 3.23Å; I497-D501 WeakPolarHBondContact O-CB 3.32Å; I497-D501 PolarHBondContact O-N 3.48Å; I497-D501 VanDerWaalsContact O-N 3.14Å
498	V	96.9	Very high	96.3	Very high	0 Å²	0	50 Å²	50	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-63	-49.2	177.1	176.6	0	0	0	0	110.8	I435 M439 N444 M490 D495 D501 L502	I435-V498 HydrophobicContact CG2-CG2 3.74Å; M439-V498 HydrophobicContact CG-CG2 4.16Å; M439-V498 HydrophobicContact SD-CG2 3.92Å; N444-V498 PolarHBondContact ND2-O 3.33Å; N444-V498 VanDerWaalsContact ND2-O 3.12Å; M490-V498 HydrophobicContact CB-CG1 4.28Å; M490-V498 HydrophobicContact CE-CG1 4.4Å; M490-V498 HydrophobicContact CE-CG2 4.48Å; D495-V498 HydrophobicContact CB-CB 4.24Å; D495-V498 HydrophobicContact CB-CG2 4.15Å; D495-V498 PolarHBondContact O-N 3.43Å; D495-V498 WeakPolarHBondContact OD1-CG2 3.47Å; D495-V498 PolarHBondContact OD1-N 2.8Å; V498-D501 PolarHBondContact O-N 3.32Å; V498-L502 HydrophobicContact CG1-CD1 4.17Å; V498-L502 WeakPolarHBondContact O-CB 3.3Å; V498-L502 WeakPolarHBondContact O-CG 3.47Å; V498-L502 PolarHBondContact O-N 3.46Å
499	N	96.8	Very high	96.3	Very high	3 Å²	3	51.5 Å²	51.5	2%	0.016	25%	0.254	C	S	.	.	H	α-helix	trans	-68.9	-38.5	-175.6	-74.3	-17.5	0	0	0	112.5	V491 D495 L502 C503 L544	V491-N499 WeakPolarHBondContact CA-OD1 3.25Å; D495-N499 WeakPolarHBondContact O-CB 3.01Å; D495-N499 PolarHBondContact O-N 3.49Å; N499-L502 PolarHBondContact O-N 2.85Å; N499-C503 PolarHBondContact O-N 3.25Å; N499-C503 PolarHBondContact O-SG 2.74Å; N499-C503 VanDerWaalsContact O-SG 3.4Å; N499-L544 HydrophobicContact CB-CD2 4.07Å
500	T	96.1	Very high	96.2	Very high	52 Å²	52	51.8 Å²	51.8	32%	0.319	25%	0.251	S	S	.	.	H	α-helix	trans	-66	-46.7	175.9	-59.9	0	0	0	0	111.2	E496 L502 C503 E504 R551	E496-T500 WeakPolarHBondContact O-CB 3.5Å; E496-T500 PolarHBondContact O-N 3.14Å; E496-T500 PolarHBondContact O-OG1 2.84Å; T500-L502 VanDerWaalsContact C-N 3.31Å; T500-L502 PolarHBondContact O-N 3.04Å; T500-C503 PolarHBondContact O-N 3.31Å; T500-E504 HydrophobicContact CG2-CG 4.38Å; T500-E504 WeakPolarHBondContact O-CG 3.21Å; T500-E504 PolarHBondContact O-N 3.34Å; T500-R551 PolarHBondContact OG1-NH2 3.41Å
501	D	97.4	Very high	96.2	Very high	32 Å²	32	51.8 Å²	51.8	17%	0.171	25%	0.251	C	S	.	.	H	α-helix	trans	-62.1	-37	176.4	173.3	88.4	0	0	0	111.9	M439 N444 I497 V498 R505	M439-D501 HydrophobicContact CE-CB 4.1Å; N444-D501 WeakPolarHBondContact CB-OD2 3.27Å; N444-D501 PolarHBondContact ND2-OD2 2.96Å; I497-D501 WeakPolarHBondContact O-CB 3.32Å; I497-D501 PolarHBondContact O-N 3.48Å; I497-D501 VanDerWaalsContact O-N 3.14Å; V498-D501 PolarHBondContact O-N 3.32Å; D501-R505 WeakPolarHBondContact O-CB 3.34Å; D501-R505 WeakPolarHBondContact O-CD 3.5Å; D501-R505 WeakPolarHBondContact O-CG 3.25Å; D501-R505 PolarHBondContact O-N 2.97Å; D501-R505 VanDerWaalsContact O-N 3.17Å; D501-R505 IonicContact OD1-CZ 2.77Å; D501-R505 IonicContact OD1-NE 2.88Å; D501-R505 PolarHBondContact OD1-NE 3.45Å; D501-R505 IonicContact OD1-NH2 3.8Å; D501-R505 PolarHBondContact OD1-NH2 2.61Å; D501-R505 IonicContact OD2-CZ 3.77Å; D501-R505 IonicContact OD2-NE 3.89Å; D501-R505 PolarHBondContact OD2-NE 3.23Å; D501-R505 IonicContact OD2-NH2 2.66Å
502	L	97.3	Very high	96.2	Very high	0 Å²	0	51.8 Å²	51.8	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-61.3	-47.7	172.5	-81.1	173.5	0	0	0	112.3	N444 L448 L487 V491 V498 N499 T500 R505 G506 V507	N444-L502 HydrophobicContact CB-CD2 3.78Å; N444-L502 HydrophobicContact CB-CG 4.3Å; N444-L502 VanDerWaalsContact CG-CD2 3.45Å; N444-L502 WeakPolarHBondContact OD1-CD2 3.36Å; L448-L502 HydrophobicContact CD1-CD2 4.23Å; L448-L502 HydrophobicContact CD2-CD2 4.4Å; L448-L502 HydrophobicContact CG-CD2 4.41Å; L487-L502 HydrophobicContact CD2-CD1 4.43Å; L487-L502 HydrophobicContact CD2-CD2 3.79Å; V491-L502 HydrophobicContact CG2-CD1 3.76Å; V498-L502 HydrophobicContact CG1-CD1 4.17Å; V498-L502 WeakPolarHBondContact O-CB 3.3Å; V498-L502 WeakPolarHBondContact O-CG 3.47Å; V498-L502 PolarHBondContact O-N 3.46Å; N499-L502 PolarHBondContact O-N 2.85Å; T500-L502 VanDerWaalsContact C-N 3.31Å; T500-L502 PolarHBondContact O-N 3.04Å; L502-R505 PolarHBondContact O-N 3.49Å; L502-G506 PolarHBondContact O-N 3.19Å; L502-V507 HydrophobicContact CB-CB 4.45Å; L502-V507 HydrophobicContact CB-CG1 3.97Å; L502-V507 WeakPolarHBondContact O-CB 3.42Å; L502-V507 WeakPolarHBondContact O-CG1 3.36Å; L502-V507 PolarHBondContact O-N 3.38Å
503	C	96.7	Very high	96.1	Very high	10 Å²	10	47.5 Å²	47.5	7%	0.068	24%	0.242	C	C	.	.	H	α-helix	trans	-64.1	-44.1	179.3	-74.6	0	0	0	0	112.1	N499 T500 R505 G506 R551	N499-C503 PolarHBondContact O-N 3.25Å; N499-C503 PolarHBondContact O-SG 2.74Å; N499-C503 VanDerWaalsContact O-SG 3.4Å; T500-C503 PolarHBondContact O-N 3.31Å; C503-R505 PolarHBondContact O-N 2.71Å; C503-G506 PolarHBondContact O-N 2.95Å; C503-R551 VanDerWaalsContact SG-CD 3.59Å
504	E	95.8	Very high	96	Very high	152 Å²	152	44.5 Å²	44.5	71%	0.71	23%	0.226	S	C	*	.	H	α-helix	trans	-60.3	-31.2	176.6	-73.5	-179.1	172.7	0	0	112.5	T500 G506	T500-E504 HydrophobicContact CG2-CG 4.38Å; T500-E504 WeakPolarHBondContact O-CG 3.21Å; T500-E504 PolarHBondContact O-N 3.34Å; E504-G506 VanDerWaalsContact C-N 3.26Å; E504-G506 PolarHBondContact O-N 3.31Å
505	R	95.7	Very high	95.9	Very high	113 Å²	113	37.6 Å²	37.6	43%	0.426	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81	0.2	174.9	-67.5	169.9	-170.8	-79.9	-6.8	114.3	L448 D501 L502 C503	L448-R505 HydrophobicContact CD1-CB 3.48Å; L448-R505 VanDerWaalsContact CD1-CB 3.48Å; L448-R505 HydrophobicContact CD1-CG 4.38Å; D501-R505 WeakPolarHBondContact O-CB 3.34Å; D501-R505 WeakPolarHBondContact O-CD 3.5Å; D501-R505 WeakPolarHBondContact O-CG 3.25Å; D501-R505 PolarHBondContact O-N 2.97Å; D501-R505 VanDerWaalsContact O-N 3.17Å; D501-R505 IonicContact OD1-CZ 2.77Å; D501-R505 IonicContact OD1-NE 2.88Å; D501-R505 PolarHBondContact OD1-NE 3.45Å; D501-R505 IonicContact OD1-NH2 3.8Å; D501-R505 PolarHBondContact OD1-NH2 2.61Å; D501-R505 IonicContact OD2-CZ 3.77Å; D501-R505 IonicContact OD2-NE 3.89Å; D501-R505 PolarHBondContact OD2-NE 3.23Å; D501-R505 IonicContact OD2-NH2 2.66Å; L502-R505 PolarHBondContact O-N 3.49Å; C503-R505 PolarHBondContact O-N 2.71Å
506	G	95.8	Very high	95.7	Very high	23 Å²	23	38.7 Å²	38.7	24%	0.237	20%	0.196	C	C	.	.	T	Hydrogen-bonded Turn	trans	83.6	23.4	173.6	0	0	0	0	0	115.5	L502 C503 E504 I508 H509 Q510	L502-G506 PolarHBondContact O-N 3.19Å; C503-G506 PolarHBondContact O-N 2.95Å; E504-G506 VanDerWaalsContact C-N 3.26Å; E504-G506 PolarHBondContact O-N 3.31Å; G506-I508 PolarHBondContact O-N 3.27Å; G506-I508 VanDerWaalsContact O-N 3.16Å; G506-H509 PolarHBondContact O-N 3.08Å; G506-Q510 PolarHBondContact O-N 2.9Å; G506-Q510 VanDerWaalsContact O-N 3.15Å
507	V	97.6	Very high	95.4	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-53.7	-37.1	180	70	0	0	0	0	113	L448 L502 H509 Q510 L511 L544	L448-V507 HydrophobicContact CD1-CB 4.45Å; L448-V507 HydrophobicContact CD2-CB 3.95Å; L448-V507 HydrophobicContact CD2-CG2 3.65Å; L502-V507 HydrophobicContact CB-CB 4.45Å; L502-V507 HydrophobicContact CB-CG1 3.97Å; L502-V507 WeakPolarHBondContact O-CB 3.42Å; L502-V507 WeakPolarHBondContact O-CG1 3.36Å; L502-V507 PolarHBondContact O-N 3.38Å; V507-H509 PolarHBondContact O-N 3.48Å; V507-Q510 PolarHBondContact O-N 2.77Å; V507-L511 HydrophobicContact CG2-CD1 3.88Å; V507-L511 HydrophobicContact CG2-CG 4.08Å; V507-L511 WeakPolarHBondContact O-CB 3.38Å; V507-L511 VanDerWaalsContact O-CG 3.29Å; V507-L511 WeakPolarHBondContact O-CG 3.39Å; V507-L511 PolarHBondContact O-N 3.49Å; V507-L544 HydrophobicContact CG1-CD1 3.43Å; V507-L544 VanDerWaalsContact CG1-CD1 3.43Å; V507-L544 HydrophobicContact CG2-CD1 4.48Å
508	I	97.6	Very high	94.9	Very high	2 Å²	2	33.4 Å²	33.4	1%	0.01	17%	0.174	C	C	.	.	H	α-helix	trans	-60.5	-51	-177.8	-67.3	175.8	0	0	0	110.4	G506 Q510 L511 I512 L541 L544 R551 M554 F555	G506-I508 PolarHBondContact O-N 3.27Å; G506-I508 VanDerWaalsContact O-N 3.16Å; I508-Q510 VanDerWaalsContact C-N 3.34Å; I508-Q510 PolarHBondContact O-N 2.78Å; I508-L511 PolarHBondContact O-N 2.98Å; I508-I512 HydrophobicContact CG2-CD1 3.96Å; I508-I512 VanDerWaalsContact O-CG1 3.31Å; I508-I512 WeakPolarHBondContact O-CG1 3.31Å; I508-I512 PolarHBondContact O-N 3.13Å; I508-L541 HydrophobicContact CB-CD2 4.13Å; I508-L541 HydrophobicContact CG1-CD2 4.16Å; I508-L541 HydrophobicContact CG2-CD2 3.89Å; I508-L544 HydrophobicContact CG1-CD1 4.38Å; I508-R551 HydrophobicContact CD1-CB 4.03Å; I508-M554 HydrophobicContact CD1-CB 3.98Å; I508-M554 HydrophobicContact CD1-SD 4.29Å; I508-M554 HydrophobicContact CG2-CB 4.37Å; I508-F555 HydrophobicContact CG2-CB 4.42Å
509	H	96.6	Very high	94.2	Very high	101 Å²	101	34.7 Å²	34.7	47%	0.468	19%	0.185	S	C	.	.	H	α-helix	trans	-66	-38.4	179.9	-62.4	93.5	0	0	0	111.6	G506 V507 I512 G513	G506-H509 PolarHBondContact O-N 3.08Å; V507-H509 PolarHBondContact O-N 3.48Å; H509-I512 PolarHBondContact O-N 3.48Å; H509-G513 PolarHBondContact O-N 3.47Å
510	Q	96.1	Very high	93.3	Very high	35 Å²	35	38.7 Å²	38.7	16%	0.164	21%	0.213	C	C	.	.	H	α-helix	trans	-62.2	-47	176.2	-171.6	175.4	14.4	0	0	111.6	L448 L451 E452 E455 G506 V507 I508 I512 G513 I514	L448-Q510 PolarHBondContact O-NE2 3.27Å; L451-Q510 HydrophobicContact CD2-CG 4.4Å; E452-Q510 VanDerWaalsContact N-NE2 3.17Å; E455-Q510 WeakPolarHBondContact OE1-CG 3.28Å; E455-Q510 PolarHBondContact OE1-NE2 3.05Å; E455-Q510 VanDerWaalsContact OE1-NE2 3.11Å; G506-Q510 PolarHBondContact O-N 2.9Å; G506-Q510 VanDerWaalsContact O-N 3.15Å; V507-Q510 PolarHBondContact O-N 2.77Å; I508-Q510 VanDerWaalsContact C-N 3.34Å; I508-Q510 PolarHBondContact O-N 2.78Å; Q510-I512 PolarHBondContact O-N 3.02Å; Q510-G513 WeakPolarHBondContact O-CA 3.46Å; Q510-G513 PolarHBondContact O-N 2.74Å; Q510-G513 VanDerWaalsContact O-N 3.12Å; Q510-I514 HydrophobicContact CG-CD1 4.21Å; Q510-I514 WeakPolarHBondContact O-CG1 3.39Å; Q510-I514 PolarHBondContact O-N 2.89Å
511	L	97.3	Very high	92	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-63.8	-39	178.3	-69.2	175.8	0	0	0	112.4	L451 L484 V507 I508 G513 I514 F515 A537 I540 L541	L451-L511 HydrophobicContact CD2-CD2 4.34Å; L484-L511 HydrophobicContact CD2-CD2 3.38Å; V507-L511 HydrophobicContact CG2-CD1 3.88Å; V507-L511 HydrophobicContact CG2-CG 4.08Å; V507-L511 WeakPolarHBondContact O-CB 3.38Å; V507-L511 VanDerWaalsContact O-CG 3.29Å; V507-L511 WeakPolarHBondContact O-CG 3.39Å; V507-L511 PolarHBondContact O-N 3.49Å; I508-L511 PolarHBondContact O-N 2.98Å; L511-G513 VanDerWaalsContact C-N 3.33Å; L511-I514 HydrophobicContact CD2-CD1 4.34Å; L511-I514 PolarHBondContact O-N 2.97Å; L511-F515 WeakPolarHBondContact O-CB 3.36Å; L511-F515 PolarHBondContact O-N 3.27Å; L511-A537 HydrophobicContact CD2-CB 4.29Å; L511-I540 HydrophobicContact CD1-CB 3.89Å; L511-I540 HydrophobicContact CD1-CG2 3.48Å; L511-I540 VanDerWaalsContact CD1-CG2 3.48Å; L511-L541 HydrophobicContact CB-CD1 4.06Å; L511-L541 HydrophobicContact CB-CD2 4.06Å; L511-L541 HydrophobicContact CB-CG 4.07Å; L511-L541 HydrophobicContact CD1-CD2 4.03Å; L511-L541 HydrophobicContact CD1-CG 3.95Å
512	I	96.4	Very high	89.8	Confident	1 Å²	1	44.2 Å²	44.2	1%	0.005	24%	0.24	C	C	.	.	H	α-helix	trans	-61.5	-43	172.4	-67.8	166.8	0	0	0	110.4	I508 H509 Q510 F515 K516 L541 F555 E558 I562	I508-I512 HydrophobicContact CG2-CD1 3.96Å; I508-I512 VanDerWaalsContact O-CG1 3.31Å; I508-I512 WeakPolarHBondContact O-CG1 3.31Å; I508-I512 PolarHBondContact O-N 3.13Å; H509-I512 PolarHBondContact O-N 3.48Å; Q510-I512 PolarHBondContact O-N 3.02Å; I512-F515 WeakPolarHBondContact O-CB 3.33Å; I512-F515 PolarHBondContact O-N 3.21Å; I512-K516 HydrophobicContact CG2-CD 4.17Å; I512-K516 WeakPolarHBondContact O-CG 3.24Å; I512-K516 PolarHBondContact O-N 2.93Å; I512-L541 HydrophobicContact CG1-CD1 4.28Å; I512-F555 HydrophobicContact CD1-CD2 4.06Å; I512-E558 HydrophobicContact CG2-CB 4.07Å; I512-I562 HydrophobicContact CG1-CD1 4.22Å; I512-I562 HydrophobicContact CG2-CG2 4.35Å
513	G	94	Very high	87.4	Confident	26 Å²	26	51.9 Å²	51.9	27%	0.268	28%	0.281	S	S	.	.	H	α-helix	trans	-61.2	-45.5	176.5	0	0	0	0	0	113.4	H509 Q510 L511 F515 K516 T517	H509-G513 PolarHBondContact O-N 3.47Å; Q510-G513 WeakPolarHBondContact O-CA 3.46Å; Q510-G513 PolarHBondContact O-N 2.74Å; Q510-G513 VanDerWaalsContact O-N 3.12Å; L511-G513 VanDerWaalsContact C-N 3.33Å; G513-F515 VanDerWaalsContact C-N 3.34Å; G513-F515 PolarHBondContact O-N 2.99Å; G513-K516 PolarHBondContact O-N 3.34Å; G513-T517 WeakPolarHBondContact O-CB 3.42Å; G513-T517 PolarHBondContact O-N 3.27Å; G513-T517 PolarHBondContact O-OG1 3.35Å
514	I	92.1	Very high	85.5	Confident	2 Å²	2	56.9 Å²	56.9	1%	0.01	30%	0.304	C	S	.	.	H	α-helix	trans	-59.2	-48	174.2	-67.5	164.4	0	0	0	110	L451 E455 M480 Q510 L511 K516 T517 M518 I533	L451-I514 HydrophobicContact CD1-CD1 3.83Å; L451-I514 HydrophobicContact CD2-CD1 3.43Å; L451-I514 VanDerWaalsContact CD2-CD1 3.43Å; L451-I514 HydrophobicContact CG-CD1 3.51Å; E455-I514 HydrophobicContact CG-CD1 4.41Å; E455-I514 HydrophobicContact CG-CG1 3.75Å; E455-I514 WeakPolarHBondContact OE1-CD1 3.47Å; E455-I514 WeakPolarHBondContact OE1-CG1 3.46Å; M480-I514 HydrophobicContact CE-CG2 4.02Å; M480-I514 HydrophobicContact SD-CD1 4.3Å; M480-I514 HydrophobicContact SD-CG1 4.36Å; M480-I514 HydrophobicContact SD-CG2 3.77Å; Q510-I514 HydrophobicContact CG-CD1 4.21Å; Q510-I514 WeakPolarHBondContact O-CG1 3.39Å; Q510-I514 PolarHBondContact O-N 2.89Å; L511-I514 HydrophobicContact CD2-CD1 4.34Å; L511-I514 PolarHBondContact O-N 2.97Å; I514-K516 PolarHBondContact O-N 3.01Å; I514-T517 PolarHBondContact O-N 3.46Å; I514-M518 HydrophobicContact CG2-CG 4.33Å; I514-M518 VanDerWaalsContact O-CG 3.28Å; I514-M518 WeakPolarHBondContact O-CG 3.47Å; I514-M518 PolarHBondContact O-N 3.15Å; I514-I533 HydrophobicContact CG2-CG2 4.19Å
515	F	92.8	Very high	83.7	Confident	1 Å²	1	59.3 Å²	59.3	0%	0.004	31%	0.312	C	S	.	.	H	α-helix	trans	-57.2	-49.6	179.8	-166.8	-73.6	0	0	0	111.5	L511 I512 G513 T517 M518 A519 Q534 L538 I562 V566 L583	L511-F515 WeakPolarHBondContact O-CB 3.36Å; L511-F515 PolarHBondContact O-N 3.27Å; I512-F515 WeakPolarHBondContact O-CB 3.33Å; I512-F515 PolarHBondContact O-N 3.21Å; G513-F515 VanDerWaalsContact C-N 3.34Å; G513-F515 PolarHBondContact O-N 2.99Å; F515-T517 VanDerWaalsContact C-N 3.32Å; F515-T517 PolarHBondContact O-N 3.11Å; F515-M518 PolarHBondContact O-N 2.88Å; F515-A519 HydrophobicContact CD1-CB 4.32Å; F515-A519 HydrophobicContact CE1-CB 4.16Å; F515-A519 WeakPolarHBondContact O-CB 3.43Å; F515-A519 PolarHBondContact O-N 3.3Å; F515-Q534 HydrophobicContact CD2-CB 3.98Å; F515-Q534 HydrophobicContact CD2-CG 3.96Å; F515-Q534 HydrophobicContact CE2-CB 3.49Å; F515-Q534 VanDerWaalsContact CE2-CB 3.49Å; F515-Q534 HydrophobicContact CE2-CG 3.71Å; F515-Q534 HydrophobicContact CG-CG 4.49Å; F515-Q534 HydrophobicContact CZ-CB 4.09Å; F515-Q534 HydrophobicContact CZ-CG 4Å; F515-L538 HydrophobicContact CD2-CD2 4.29Å; F515-L538 HydrophobicContact CD2-CG 4.13Å; F515-L538 HydrophobicContact CE2-CD1 3.82Å; F515-L538 HydrophobicContact CE2-CD2 4.21Å; F515-L538 HydrophobicContact CE2-CG 3.81Å; F515-L538 HydrophobicContact CZ-CD1 4.49Å; F515-I562 HydrophobicContact CB-CD1 4.07Å; F515-I562 HydrophobicContact CD1-CB 3.62Å; F515-I562 HydrophobicContact CD1-CD1 4.18Å; F515-I562 HydrophobicContact CD1-CG1 4.46Å; F515-I562 HydrophobicContact CD1-CG2 3.76Å; F515-I562 HydrophobicContact CD2-CD1 4.27Å; F515-I562 HydrophobicContact CE1-CB 3.96Å; F515-I562 HydrophobicContact CE1-CG2 4.49Å; F515-I562 HydrophobicContact CG-CB 4.24Å; F515-I562 HydrophobicContact CG-CD1 3.89Å; F515-I562 HydrophobicContact CG-CG2 4.39Å; F515-V566 HydrophobicContact CE1-CG2 3.92Å; F515-V566 HydrophobicContact CE2-CG2 4.33Å; F515-V566 HydrophobicContact CZ-CG2 3.33Å; F515-L583 HydrophobicContact CE2-CD1 4.2Å; F515-L583 HydrophobicContact CZ-CD1 4.42Å
516	K	91	Very high	82.2	Confident	68 Å²	68	58.1 Å²	58.1	30%	0.296	31%	0.311	S	S	.	.	H	α-helix	trans	-58.8	-43	178.1	-74.1	174.6	176.4	-179.8	0	111.8	I512 G513 I514 M518 A519 S520 E558 I562	I512-K516 HydrophobicContact CG2-CD 4.17Å; I512-K516 WeakPolarHBondContact O-CG 3.24Å; I512-K516 PolarHBondContact O-N 2.93Å; G513-K516 PolarHBondContact O-N 3.34Å; I514-K516 PolarHBondContact O-N 3.01Å; K516-M518 VanDerWaalsContact C-N 3.33Å; K516-M518 PolarHBondContact O-N 2.82Å; K516-A519 PolarHBondContact O-N 3.12Å; K516-S520 VanDerWaalsContact O-CB 3.31Å; K516-S520 WeakPolarHBondContact O-CB 3.37Å; K516-S520 PolarHBondContact O-N 3.44Å; K516-S520 PolarHBondContact O-OG 3.49Å; K516-E558 IonicContact NZ-OE1 2.77Å; K516-E558 IonicContact NZ-OE2 3.15Å; K516-E558 PolarHBondContact NZ-OE2 2.59Å; K516-I562 HydrophobicContact CD-CG2 4.49Å; K516-I562 HydrophobicContact CG-CG2 3.66Å
517	T	88.1	Confident	81.4	Confident	65 Å²	65	59.9 Å²	59.9	40%	0.399	32%	0.315	S	S	.	.	H	α-helix	trans	-63.5	-40	178.9	-58	0	0	0	0	111.6	G513 I514 F515 R521	G513-T517 WeakPolarHBondContact O-CB 3.42Å; G513-T517 PolarHBondContact O-N 3.27Å; G513-T517 PolarHBondContact O-OG1 3.35Å; I514-T517 PolarHBondContact O-N 3.46Å; F515-T517 VanDerWaalsContact C-N 3.32Å; F515-T517 PolarHBondContact O-N 3.11Å; T517-R521 WeakPolarHBondContact O-CG 3.32Å
518	M	85.3	Confident	80.8	Confident	15 Å²	15	61.9 Å²	61.9	7%	0.074	33%	0.332	C	S	.	.	H	α-helix	trans	-72.8	-37	177.5	-64	-61.4	-109.9	0	0	112.2	Y477 M480 I514 F515 K516 A530 I533 Q534	Y477-M518 HydrophobicContact CD1-CE 3.6Å; Y477-M518 HydrophobicContact CD1-SD 4.3Å; Y477-M518 HydrophobicContact CD2-CE 4.31Å; Y477-M518 HydrophobicContact CE1-CE 3.34Å; Y477-M518 HydrophobicContact CE1-SD 3.48Å; Y477-M518 WeakPolarHBondContact CE1-SD 3.5Å; Y477-M518 HydrophobicContact CE2-CE 4.09Å; Y477-M518 HydrophobicContact CG-CE 4.07Å; Y477-M518 PolarHBondContact OH-SD 2.84Å; M480-M518 HydrophobicContact CE-CE 3.72Å; M480-M518 HydrophobicContact CE-SD 4.05Å; I514-M518 HydrophobicContact CG2-CG 4.33Å; I514-M518 VanDerWaalsContact O-CG 3.28Å; I514-M518 WeakPolarHBondContact O-CG 3.47Å; I514-M518 PolarHBondContact O-N 3.15Å; F515-M518 PolarHBondContact O-N 2.88Å; K516-M518 VanDerWaalsContact C-N 3.33Å; K516-M518 PolarHBondContact O-N 2.82Å; M518-A530 HydrophobicContact CE-CB 4.28Å; M518-I533 HydrophobicContact CE-CB 4.08Å; M518-I533 HydrophobicContact CE-CD1 3.48Å; M518-I533 VanDerWaalsContact CE-CD1 3.48Å; M518-I533 HydrophobicContact CE-CG1 4.38Å; M518-I533 HydrophobicContact CE-CG2 3.8Å; M518-I533 HydrophobicContact CG-CG2 4.32Å; M518-Q534 HydrophobicContact CB-CG 4.1Å
519	A	82.4	Confident	80.4	Confident	28 Å²	28	62.4 Å²	62.4	23%	0.231	34%	0.335	C	S	.	.	H	α-helix	trans	-72.1	-27.7	179.2	0	0	0	0	0	113.7	F515 K516 R521	F515-A519 HydrophobicContact CD1-CB 4.32Å; F515-A519 HydrophobicContact CE1-CB 4.16Å; F515-A519 WeakPolarHBondContact O-CB 3.43Å; F515-A519 PolarHBondContact O-N 3.3Å; K516-A519 PolarHBondContact O-N 3.12Å; A519-R521 PolarHBondContact O-N 3.41Å
520	S	77.3	Confident	80	Confident	87 Å²	87	58.4 Å²	58.4	61%	0.608	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.2	-0.5	-172.3	-57.2	0	0	0	0	114.8	K516 P522	K516-S520 VanDerWaalsContact O-CB 3.31Å; K516-S520 WeakPolarHBondContact O-CB 3.37Å; K516-S520 PolarHBondContact O-N 3.44Å; K516-S520 PolarHBondContact O-OG 3.49Å; S520-P522 WeakPolarHBondContact O-CD 3.38Å; S520-P522 WeakPolarHBondContact O-CG 3.36Å
521	R	69.4	Low	79.7	Confident	84 Å²	84	57.1 Å²	57.1	32%	0.317	31%	0.313	S	S	.	.			trans	-84.4	101.9	-177.5	-68.6	179.2	-174.9	-139.1	0.8	110.7	Y477 T517 A519 E524	Y477-R521 WeakPolarHBondContact OH-CD 3.07Å; Y477-R521 PolarHBondContact OH-NE 3.29Å; Y477-R521 PolarHBondContact OH-NH1 2.84Å; T517-R521 WeakPolarHBondContact O-CG 3.32Å; A519-R521 PolarHBondContact O-N 3.41Å; R521-E524 IonicContact NH1-OE2 2.82Å
522	P	50.9	Low	79.5	Confident	116 Å²	116	59.3 Å²	59.3	75%	0.753	32%	0.323	S	S	*	.			trans	-86.3	-18	-171.3	-3.5	24.7	0	0	0	113.3	S520	S520-P522 WeakPolarHBondContact O-CD 3.38Å; S520-P522 WeakPolarHBondContact O-CG 3.36Å
523	D	45.9	Very low	79.3	Confident	161 Å²	161	59.3 Å²	59.3	86%	0.861	32%	0.323	S	S	*	.	S	Bend	trans	-104.8	-4	-165.3	-71.4	-35	0	0	0	114.5
524	E	57.4	Low	79.3	Confident	114 Å²	114	58.8 Å²	58.8	53%	0.533	31%	0.314	S	S	.	.	S	Bend	trans	-97.6	134.5	176.1	-69.4	-179.3	164.2	0	0	109.9	R521 E526	R521-E524 IonicContact NH1-OE2 2.82Å; E524-E526 PolarHBondContact O-N 3.39Å
525	K	58.4	Low	79.5	Confident	203 Å²	203	58.8 Å²	58.8	88%	0.883	31%	0.314	S	S	*	.			trans	-52.8	130.4	170.7	-71.9	179.5	178.6	177.6	0	108.2	D527	K525-D527 PolarHBondContact O-N 3.09Å
526	E	64.7	Low	79.7	Confident	88 Å²	88	59 Å²	59	41%	0.411	32%	0.315	S	S	.	.			trans	-48.8	114.5	177.7	-66.2	177.1	-176.2	0	0	110.6	E524 K573 L578 Y580	E524-E526 PolarHBondContact O-N 3.39Å; E526-K573 VanDerWaalsContact OE1-CE 3.27Å; E526-K573 WeakPolarHBondContact OE1-CE 3.49Å; E526-K573 IonicContact OE1-NZ 2.68Å; E526-K573 PolarHBondContact OE1-NZ 3.15Å; E526-K573 IonicContact OE2-NZ 3.91Å; E526-L578 HydrophobicContact CB-CD1 4.18Å; E526-Y580 PolarHBondContact OE1-OH 2.89Å; E526-Y580 VanDerWaalsContact OE2-CE2 3.27Å; E526-Y580 WeakPolarHBondContact OE2-CE2 2.99Å; E526-Y580 PolarHBondContact OE2-OH 3.37Å
527	D	77.6	Confident	80	Confident	61 Å²	61	55.8 Å²	55.8	33%	0.326	30%	0.301	S	S	.	.			trans	-100.5	131.7	-175.9	-173	-4.7	0	0	0	109.3	K525 I529 A530 L531	K525-D527 PolarHBondContact O-N 3.09Å; D527-I529 PolarHBondContact O-N 3.28Å; D527-I529 PolarHBondContact OD1-N 3.04Å; D527-A530 HydrophobicContact CB-CB 4.28Å; D527-A530 PolarHBondContact O-N 3.46Å; D527-A530 VanDerWaalsContact O-N 3.12Å; D527-L531 PolarHBondContact O-N 2.93Å
528	A	86.4	Confident	80.4	Confident	42 Å²	42	52.7 Å²	52.7	35%	0.347	28%	0.282	S	S	.	.	H	α-helix	trans	-56.4	-30.8	175.2	0	0	0	0	0	111.9	L531 E532 L578	A528-L531 PolarHBondContact O-N 2.8Å; A528-E532 PolarHBondContact O-N 2.86Å; A528-L578 WeakPolarHBondContact CA-O 3.45Å; A528-L578 VanDerWaalsContact CB-O 3.31Å; A528-L578 WeakPolarHBondContact CB-O 3.36Å
529	I	87.4	Confident	81	Confident	13 Å²	13	53.4 Å²	53.4	7%	0.067	29%	0.286	C	S	.	.	H	α-helix	trans	-73	-36.8	179.9	-66	172.6	0	0	0	111.5	T470 D527 L531 E532 I533	T470-I529 HydrophobicContact CG2-CD1 4.11Å; T470-I529 WeakPolarHBondContact O-CD1 3.26Å; D527-I529 PolarHBondContact O-N 3.28Å; D527-I529 PolarHBondContact OD1-N 3.04Å; I529-L531 VanDerWaalsContact C-N 3.34Å; I529-E532 PolarHBondContact O-N 3.36Å; I529-I533 HydrophobicContact CG2-CD1 4.13Å; I529-I533 WeakPolarHBondContact O-CG1 3.25Å; I529-I533 PolarHBondContact O-N 3.31Å
530	A	88.3	Confident	81.8	Confident	17 Å²	17	52.1 Å²	52.1	14%	0.14	28%	0.275	C	S	.	.	H	α-helix	trans	-64.4	-41.8	174.3	0	0	0	0	0	111	M518 D527 E532 I533 Q534	M518-A530 HydrophobicContact CE-CB 4.28Å; D527-A530 HydrophobicContact CB-CB 4.28Å; D527-A530 PolarHBondContact O-N 3.46Å; D527-A530 VanDerWaalsContact O-N 3.12Å; A530-E532 VanDerWaalsContact C-N 3.34Å; A530-E532 PolarHBondContact O-N 2.8Å; A530-I533 PolarHBondContact O-N 3.06Å; A530-Q534 WeakPolarHBondContact O-CB 3.16Å; A530-Q534 WeakPolarHBondContact O-CG 3.24Å; A530-Q534 PolarHBondContact O-N 3.14Å
531	L	90.8	Very high	82.7	Confident	8 Å²	8	48 Å²	48	4%	0.042	25%	0.246	C	C	.	.	H	α-helix	trans	-64.4	-37	174.9	-63.8	174.7	0	0	0	112.2	D527 A528 I529 S535 L578 Y580 L583	D527-L531 PolarHBondContact O-N 2.93Å; A528-L531 PolarHBondContact O-N 2.8Å; I529-L531 VanDerWaalsContact C-N 3.34Å; L531-S535 WeakPolarHBondContact O-CB 3.48Å; L531-S535 PolarHBondContact O-N 3.39Å; L531-S535 PolarHBondContact O-OG 3.49Å; L531-L578 HydrophobicContact CD1-CB 3.85Å; L531-Y580 HydrophobicContact CD1-CD1 4.47Å; L531-Y580 HydrophobicContact CD1-CD2 3.71Å; L531-Y580 HydrophobicContact CD1-CE1 4.38Å; L531-Y580 HydrophobicContact CD1-CE2 3.62Å; L531-Y580 HydrophobicContact CD1-CG 4.17Å; L531-Y580 HydrophobicContact CD2-CD1 4.12Å; L531-Y580 HydrophobicContact CD2-CE1 3.7Å; L531-Y580 HydrophobicContact CD2-CE2 4.34Å; L531-L583 HydrophobicContact CD2-CD2 3.74Å
532	E	92.4	Very high	84.1	Confident	46 Å²	46	44 Å²	44	22%	0.215	23%	0.232	C	C	.	.	H	α-helix	trans	-64.7	-46.1	174.2	-175.5	176.9	172.3	0	0	111.6	R481 R485 A528 I529 A530 Q534 S535 D536	R481-E532 IonicContact CZ-OE1 3.96Å; R481-E532 IonicContact CZ-OE2 2.81Å; R481-E532 IonicContact NE-OE1 2.59Å; R481-E532 PolarHBondContact NE-OE1 3.1Å; R481-E532 IonicContact NE-OE2 2.77Å; R481-E532 PolarHBondContact NE-OE2 3.41Å; R481-E532 IonicContact NH1-OE2 3.25Å; R481-E532 IonicContact NH2-OE1 3.8Å; R481-E532 PolarHBondContact NH2-OE1 3.46Å; R481-E532 IonicContact NH2-OE2 3.81Å; R481-E532 PolarHBondContact NH2-OE2 3.45Å; R485-E532 IonicContact NH2-OE1 3.86Å; R485-E532 PolarHBondContact NH2-OE1 2.89Å; A528-E532 PolarHBondContact O-N 2.86Å; I529-E532 PolarHBondContact O-N 3.36Å; A530-E532 VanDerWaalsContact C-N 3.34Å; A530-E532 PolarHBondContact O-N 2.8Å; E532-Q534 VanDerWaalsContact C-N 3.32Å; E532-Q534 PolarHBondContact O-N 3.19Å; E532-S535 PolarHBondContact O-N 3.38Å; E532-S535 VanDerWaalsContact O-N 3.17Å; E532-D536 WeakPolarHBondContact O-CB 3.45Å; E532-D536 PolarHBondContact O-N 3.33Å
533	I	93.1	Very high	86.3	Confident	0 Å²	0	39.3 Å²	39.3	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-58.6	-44.9	176	-74.1	168.6	0	0	0	111.1	Y477 M480 R481 L484 I514 M518 I529 A530 D536 A537	Y477-I533 HydrophobicContact CD1-CD1 4.4Å; Y477-I533 HydrophobicContact CG-CD1 4.21Å; M480-I533 HydrophobicContact CB-CD1 4.37Å; M480-I533 HydrophobicContact CE-CD1 4.28Å; M480-I533 HydrophobicContact CE-CG2 4.22Å; M480-I533 HydrophobicContact CG-CD1 4.4Å; M480-I533 HydrophobicContact CG-CG2 4.36Å; R481-I533 HydrophobicContact CB-CD1 4.41Å; R481-I533 HydrophobicContact CB-CG1 4.12Å; L484-I533 HydrophobicContact CD1-CB 4.3Å; L484-I533 HydrophobicContact CD1-CG1 4.46Å; L484-I533 HydrophobicContact CD1-CG2 3.7Å; I514-I533 HydrophobicContact CG2-CG2 4.19Å; M518-I533 HydrophobicContact CE-CB 4.08Å; M518-I533 HydrophobicContact CE-CD1 3.48Å; M518-I533 VanDerWaalsContact CE-CD1 3.48Å; M518-I533 HydrophobicContact CE-CG1 4.38Å; M518-I533 HydrophobicContact CE-CG2 3.8Å; M518-I533 HydrophobicContact CG-CG2 4.32Å; I529-I533 HydrophobicContact CG2-CD1 4.13Å; I529-I533 WeakPolarHBondContact O-CG1 3.25Å; I529-I533 PolarHBondContact O-N 3.31Å; A530-I533 PolarHBondContact O-N 3.06Å; I533-D536 PolarHBondContact O-N 3.2Å; I533-A537 WeakPolarHBondContact O-CB 3.44Å; I533-A537 PolarHBondContact O-N 3.13Å
534	Q	94.1	Very high	88.7	Confident	15 Å²	15	31.7 Å²	31.7	7%	0.07	16%	0.164	C	C	.	.	H	α-helix	trans	-61.8	-42.8	175.8	-77.8	179.5	-35.6	0	0	112.1	F515 M518 A530 E532 A537 L538 L583	F515-Q534 HydrophobicContact CD2-CB 3.98Å; F515-Q534 HydrophobicContact CD2-CG 3.96Å; F515-Q534 HydrophobicContact CE2-CB 3.49Å; F515-Q534 VanDerWaalsContact CE2-CB 3.49Å; F515-Q534 HydrophobicContact CE2-CG 3.71Å; F515-Q534 HydrophobicContact CG-CG 4.49Å; F515-Q534 HydrophobicContact CZ-CB 4.09Å; F515-Q534 HydrophobicContact CZ-CG 4Å; M518-Q534 HydrophobicContact CB-CG 4.1Å; A530-Q534 WeakPolarHBondContact O-CB 3.16Å; A530-Q534 WeakPolarHBondContact O-CG 3.24Å; A530-Q534 PolarHBondContact O-N 3.14Å; E532-Q534 VanDerWaalsContact C-N 3.32Å; E532-Q534 PolarHBondContact O-N 3.19Å; Q534-A537 PolarHBondContact O-N 3.25Å; Q534-L538 WeakPolarHBondContact O-CG 3.5Å; Q534-L538 PolarHBondContact O-N 3.17Å; Q534-L538 VanDerWaalsContact O-N 3.14Å; Q534-L583 HydrophobicContact CB-CD1 3.72Å
535	S	95.6	Very high	90.6	Very high	3 Å²	3	26.2 Å²	26.2	2%	0.021	14%	0.138	C	C	.	.	H	α-helix	trans	-64.6	-46.4	178	-56.1	0	0	0	0	111.2	L531 E532 A537 L538 L539 L583	L531-S535 WeakPolarHBondContact O-CB 3.48Å; L531-S535 PolarHBondContact O-N 3.39Å; L531-S535 PolarHBondContact O-OG 3.49Å; E532-S535 PolarHBondContact O-N 3.38Å; E532-S535 VanDerWaalsContact O-N 3.17Å; S535-A537 PolarHBondContact O-N 3.5Å; S535-L538 PolarHBondContact O-N 3.4Å; S535-L539 WeakPolarHBondContact O-CG 3.21Å; S535-L539 PolarHBondContact O-N 3.07Å; S535-L583 VanDerWaalsContact OG-CA 3.23Å; S535-L583 WeakPolarHBondContact OG-CA 3.33Å; S535-L583 PolarHBondContact OG-N 3.1Å
536	D	96.3	Very high	92.2	Very high	5 Å²	5	20.1 Å²	20.1	3%	0.027	11%	0.113	C	C	.	.	H	α-helix	trans	-63.6	-40.1	178.6	-79.6	-14.6	0	0	0	111.9	L484 R488 E532 I533 L538 L539 I540	L484-D536 HydrophobicContact CB-CB 4.16Å; L484-D536 HydrophobicContact CD1-CB 4.48Å; R488-D536 IonicContact CZ-OD1 2.69Å; R488-D536 IonicContact NE-OD1 3.59Å; R488-D536 IonicContact NH1-OD1 3.83Å; R488-D536 PolarHBondContact NH1-OD1 3.5Å; E532-D536 WeakPolarHBondContact O-CB 3.45Å; E532-D536 PolarHBondContact O-N 3.33Å; I533-D536 PolarHBondContact O-N 3.2Å; D536-L538 PolarHBondContact O-N 3.41Å; D536-L539 PolarHBondContact O-N 3.31Å; D536-I540 VanDerWaalsContact O-CD1 3.32Å; D536-I540 WeakPolarHBondContact O-CD1 3.24Å; D536-I540 WeakPolarHBondContact O-CG1 3.11Å; D536-I540 PolarHBondContact O-N 2.77Å
537	A	97.3	Very high	93.5	Very high	0 Å²	0	23.5 Å²	23.5	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-59.5	-45.3	174.5	0	0	0	0	0	111.8	L511 I533 Q534 S535 I540 L541	L511-A537 HydrophobicContact CD2-CB 4.29Å; I533-A537 WeakPolarHBondContact O-CB 3.44Å; I533-A537 PolarHBondContact O-N 3.13Å; Q534-A537 PolarHBondContact O-N 3.25Å; S535-A537 PolarHBondContact O-N 3.5Å; A537-I540 PolarHBondContact O-N 3.03Å; A537-L541 WeakPolarHBondContact O-CD1 3.38Å; A537-L541 VanDerWaalsContact O-CG 3.24Å; A537-L541 WeakPolarHBondContact O-CG 3.3Å; A537-L541 PolarHBondContact O-N 3.5Å
538	L	97.6	Very high	94.3	Very high	0 Å²	0	24.8 Å²	24.8	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-64.2	-43.4	176.9	-72.4	-179.2	0	0	0	112.3	F515 Q534 S535 D536 I540 L541 S542 I562 I563 L583 T587 S590	F515-L538 HydrophobicContact CD2-CD2 4.29Å; F515-L538 HydrophobicContact CD2-CG 4.13Å; F515-L538 HydrophobicContact CE2-CD1 3.82Å; F515-L538 HydrophobicContact CE2-CD2 4.21Å; F515-L538 HydrophobicContact CE2-CG 3.81Å; F515-L538 HydrophobicContact CZ-CD1 4.49Å; Q534-L538 WeakPolarHBondContact O-CG 3.5Å; Q534-L538 PolarHBondContact O-N 3.17Å; Q534-L538 VanDerWaalsContact O-N 3.14Å; S535-L538 PolarHBondContact O-N 3.4Å; D536-L538 PolarHBondContact O-N 3.41Å; L538-I540 VanDerWaalsContact C-N 3.33Å; L538-I540 PolarHBondContact O-N 3.08Å; L538-L541 HydrophobicContact CD2-CD1 4.45Å; L538-L541 WeakPolarHBondContact O-CB 3.47Å; L538-L541 PolarHBondContact O-N 2.7Å; L538-S542 PolarHBondContact O-N 2.97Å; L538-S542 PolarHBondContact O-OG 3.46Å; L538-I562 HydrophobicContact CD2-CD1 3.95Å; L538-I563 HydrophobicContact CD1-CD1 4.48Å; L538-I563 HydrophobicContact CD2-CD1 3.78Å; L538-L583 HydrophobicContact CD1-CD1 3.91Å; L538-T587 WeakPolarHBondContact CD1-OG1 3.42Å; L538-S590 WeakPolarHBondContact CB-OG 3.32Å; L538-S590 PolarHBondContact O-OG 3.44Å
539	L	97.6	Very high	94.7	Very high	30 Å²	30	26.7 Å²	26.7	16%	0.157	13%	0.133	C	C	.	.	H	α-helix	trans	-63.8	-36.9	177.5	-70.2	172.6	0	0	0	112.7	S535 D536 G543	S535-L539 WeakPolarHBondContact O-CG 3.21Å; S535-L539 PolarHBondContact O-N 3.07Å; D536-L539 PolarHBondContact O-N 3.31Å; L539-G543 PolarHBondContact O-N 3.49Å; L539-G543 VanDerWaalsContact O-N 3.12Å
540	I	98.2	Very high	95	Very high	1 Å²	1	33.1 Å²	33.1	1%	0.005	16%	0.163	C	C	.	.	H	α-helix	trans	-66.4	-44.4	174	-64.9	158.8	0	0	0	110.1	L484 L487 R488 V491 L511 D536 A537 L538 S542 G543 L544	L484-I540 HydrophobicContact CB-CD1 4.11Å; L484-I540 HydrophobicContact CD2-CD1 3.75Å; L484-I540 WeakPolarHBondContact O-CD1 3.46Å; L487-I540 HydrophobicContact CB-CD1 3.91Å; R488-I540 HydrophobicContact CB-CD1 4.12Å; R488-I540 HydrophobicContact CB-CG1 3.69Å; R488-I540 HydrophobicContact CG-CG1 4.04Å; V491-I540 HydrophobicContact CG2-CG2 4.04Å; L511-I540 HydrophobicContact CD1-CB 3.89Å; L511-I540 HydrophobicContact CD1-CG2 3.48Å; L511-I540 VanDerWaalsContact CD1-CG2 3.48Å; D536-I540 VanDerWaalsContact O-CD1 3.32Å; D536-I540 WeakPolarHBondContact O-CD1 3.24Å; D536-I540 WeakPolarHBondContact O-CG1 3.11Å; D536-I540 PolarHBondContact O-N 2.77Å; A537-I540 PolarHBondContact O-N 3.03Å; L538-I540 VanDerWaalsContact C-N 3.33Å; L538-I540 PolarHBondContact O-N 3.08Å; I540-S542 VanDerWaalsContact C-N 3.32Å; I540-S542 PolarHBondContact O-N 3.1Å; I540-G543 PolarHBondContact O-N 3.43Å; I540-L544 HydrophobicContact CG2-CD1 3.97Å; I540-L544 HydrophobicContact CG2-CG 4.42Å; I540-L544 WeakPolarHBondContact O-CG 3.27Å; I540-L544 PolarHBondContact O-N 3.35Å
541	L	98.1	Very high	95.4	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-60.4	-42.5	176.9	-72.2	165.7	0	0	0	111.4	I508 L511 I512 A537 L538 L544 C545 F555 I562 C594	I508-L541 HydrophobicContact CB-CD2 4.13Å; I508-L541 HydrophobicContact CG1-CD2 4.16Å; I508-L541 HydrophobicContact CG2-CD2 3.89Å; L511-L541 HydrophobicContact CB-CD1 4.06Å; L511-L541 HydrophobicContact CB-CD2 4.06Å; L511-L541 HydrophobicContact CB-CG 4.07Å; L511-L541 HydrophobicContact CD1-CD2 4.03Å; L511-L541 HydrophobicContact CD1-CG 3.95Å; I512-L541 HydrophobicContact CG1-CD1 4.28Å; A537-L541 WeakPolarHBondContact O-CD1 3.38Å; A537-L541 VanDerWaalsContact O-CG 3.24Å; A537-L541 WeakPolarHBondContact O-CG 3.3Å; A537-L541 PolarHBondContact O-N 3.5Å; L538-L541 HydrophobicContact CD2-CD1 4.45Å; L538-L541 WeakPolarHBondContact O-CB 3.47Å; L538-L541 PolarHBondContact O-N 2.7Å; L541-L544 PolarHBondContact O-N 3.5Å; L541-C545 WeakPolarHBondContact O-CB 3.32Å; L541-C545 PolarHBondContact O-N 3.1Å; L541-C545 PolarHBondContact O-SG 3.25Å; L541-F555 HydrophobicContact CD1-CE2 4.11Å; L541-F555 HydrophobicContact CD2-CD2 4.41Å; L541-I562 HydrophobicContact CD1-CD1 4.49Å; L541-C594 VanDerWaalsContact C-SG 3.58Å; L541-C594 PolarHBondContact O-SG 3.24Å
542	S	97.4	Very high	95.6	Very high	1 Å²	1	33.8 Å²	33.8	1%	0.007	16%	0.161	C	C	.	.	H	α-helix	trans	-55.7	-56.8	174.1	-65.1	0	0	0	0	111.7	L538 I540 L544 C545 E546 D589 S590 C593	L538-S542 PolarHBondContact O-N 2.97Å; L538-S542 PolarHBondContact O-OG 3.46Å; I540-S542 VanDerWaalsContact C-N 3.32Å; I540-S542 PolarHBondContact O-N 3.1Å; S542-L544 VanDerWaalsContact C-N 3.27Å; S542-L544 PolarHBondContact O-N 2.83Å; S542-C545 PolarHBondContact O-N 3.18Å; S542-C545 VanDerWaalsContact O-N 3.1Å; S542-E546 WeakPolarHBondContact O-CB 3.25Å; S542-E546 PolarHBondContact O-N 2.88Å; S542-D589 WeakPolarHBondContact CB-OD2 3.36Å; S542-D589 PolarHBondContact OG-OD2 3.15Å; S542-S590 WeakPolarHBondContact OG-CA 3.36Å; S542-S590 PolarHBondContact OG-N 3.33Å; S542-S590 PolarHBondContact OG-OG 3.48Å; S542-C593 WeakPolarHBondContact O-CB 3.27Å
543	G	96.9	Very high	95.8	Very high	18 Å²	18	37 Å²	37	19%	0.186	18%	0.177	C	C	.	.	H	α-helix	trans	-62.9	-31	-177.7	0	0	0	0	0	113.6	L539 I540	L539-G543 PolarHBondContact O-N 3.49Å; L539-G543 VanDerWaalsContact O-N 3.12Å; I540-G543 PolarHBondContact O-N 3.43Å
544	L	97.3	Very high	95.9	Very high	0 Å²	0	41 Å²	41	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-71.8	-39.1	174.3	-71.8	172.8	0	0	0	112.5	V491 N499 V507 I508 I540 L541 S542 R551	V491-L544 HydrophobicContact CG1-CD2 4Å; V491-L544 HydrophobicContact CG1-CG 3.93Å; V491-L544 HydrophobicContact CG2-CD2 3.7Å; V491-L544 HydrophobicContact CG2-CG 3.99Å; N499-L544 HydrophobicContact CB-CD2 4.07Å; V507-L544 HydrophobicContact CG1-CD1 3.43Å; V507-L544 VanDerWaalsContact CG1-CD1 3.43Å; V507-L544 HydrophobicContact CG2-CD1 4.48Å; I508-L544 HydrophobicContact CG1-CD1 4.38Å; I540-L544 HydrophobicContact CG2-CD1 3.97Å; I540-L544 HydrophobicContact CG2-CG 4.42Å; I540-L544 WeakPolarHBondContact O-CG 3.27Å; I540-L544 PolarHBondContact O-N 3.35Å; L541-L544 PolarHBondContact O-N 3.5Å; S542-L544 VanDerWaalsContact C-N 3.27Å; S542-L544 PolarHBondContact O-N 2.83Å; L544-R551 WeakPolarHBondContact O-CD 2.89Å; L544-R551 PolarHBondContact O-NH1 2.83Å; L544-R551 VanDerWaalsContact O-NH1 3.11Å
545	C	96.5	Very high	96.1	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-89.3	-19.4	-172.4	-63.2	0	0	0	0	114	L541 S542 H547 Y548 K552 C594	L541-C545 WeakPolarHBondContact O-CB 3.32Å; L541-C545 PolarHBondContact O-N 3.1Å; L541-C545 PolarHBondContact O-SG 3.25Å; S542-C545 PolarHBondContact O-N 3.18Å; S542-C545 VanDerWaalsContact O-N 3.1Å; C545-H547 PolarHBondContact O-N 2.84Å; C545-Y548 PolarHBondContact O-N 2.82Å; C545-Y548 VanDerWaalsContact O-N 3.08Å; C545-K552 HydrophobicContact CB-CG 4.08Å; C545-K552 VanDerWaalsContact O-CE 3.23Å; C545-K552 WeakPolarHBondContact O-CE 3.36Å; C545-C594 HydrophobicContact CB-CB 4.16Å
546	E	93.4	Very high	96.1	Very high	74 Å²	74	41 Å²	41	35%	0.346	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.8	129.5	179.9	-164.3	172.9	-172.2	0	0	110.3	S542 Y548 C593	S542-E546 WeakPolarHBondContact O-CB 3.25Å; S542-E546 PolarHBondContact O-N 2.88Å; E546-Y548 WeakPolarHBondContact O-CD2 3.31Å; E546-Y548 PolarHBondContact O-N 3.32Å; E546-C593 HydrophobicContact CB-CB 4.25Å
547	H	90.9	Very high	96.1	Very high	160 Å²	160	44.2 Å²	44.2	74%	0.741	22%	0.22	S	C	*	.	T	Hydrogen-bonded Turn	trans	62.9	-5.3	-176.1	-47.6	-52.6	0	0	0	118.3	C545	C545-H547 PolarHBondContact O-N 2.84Å
548	Y	94	Very high	96	Very high	88 Å²	88	48.9 Å²	48.9	35%	0.345	24%	0.242	S	C	.	.			trans	-112.6	99.7	-175.1	-67.8	-75.1	0	0	0	114.1	E496 C545 E546 Q550 R551 K552	E496-Y548 VanDerWaalsContact OE1-CE2 3.31Å; E496-Y548 WeakPolarHBondContact OE1-CE2 3.37Å; E496-Y548 PolarHBondContact OE1-OH 2.89Å; E496-Y548 PolarHBondContact OE2-OH 3.33Å; C545-Y548 PolarHBondContact O-N 2.82Å; C545-Y548 VanDerWaalsContact O-N 3.08Å; E546-Y548 WeakPolarHBondContact O-CD2 3.31Å; E546-Y548 PolarHBondContact O-N 3.32Å; Y548-Q550 VanDerWaalsContact C-N 3.34Å; Y548-Q550 PolarHBondContact O-N 2.89Å; Y548-R551 VanDerWaalsContact CE2-NH1 3.28Å; Y548-R551 PolarHBondContact O-N 3.12Å; Y548-R551 VanDerWaalsContact O-N 3.09Å; Y548-K552 WeakPolarHBondContact O-CG 3.45Å; Y548-K552 PolarHBondContact O-N 2.81Å; Y548-K552 VanDerWaalsContact O-N 3.1Å
549	I	94.7	Very high	96	Very high	81 Å²	81	48.9 Å²	48.9	42%	0.415	24%	0.242	S	C	.	.	H	α-helix	trans	-56.5	-41.4	-178	-169.3	60.8	0	0	0	113.8	R551 K552 E553 G597 C598	I549-R551 VanDerWaalsContact C-N 3.29Å; I549-R551 PolarHBondContact O-N 3.44Å; I549-K552 WeakPolarHBondContact O-CB 3.4Å; I549-K552 PolarHBondContact O-N 3.09Å; I549-K552 VanDerWaalsContact O-N 3.15Å; I549-E553 WeakPolarHBondContact O-CG 3.35Å; I549-E553 PolarHBondContact O-N 2.88Å; I549-G597 WeakPolarHBondContact CD1-O 3.25Å; I549-C598 HydrophobicContact CD1-CB 3.69Å
550	Q	94.5	Very high	96	Very high	149 Å²	149	47.5 Å²	47.5	70%	0.696	24%	0.235	S	C	*	.	H	α-helix	trans	-62.8	-36.1	179.7	-65.8	170.7	-3.9	0	0	112.1	Y548 E553 M554	Y548-Q550 VanDerWaalsContact C-N 3.34Å; Y548-Q550 PolarHBondContact O-N 2.89Å; Q550-E553 PolarHBondContact O-N 3.27Å; Q550-M554 WeakPolarHBondContact O-CG 3.41Å; Q550-M554 PolarHBondContact O-N 3.25Å
551	R	95.9	Very high	95.9	Very high	17 Å²	17	50.5 Å²	50.5	6%	0.064	25%	0.251	C	S	.	.	H	α-helix	trans	-74.2	-34.6	177.8	-60.7	177.6	-171.1	163.1	6.2	110.7	E496 T500 C503 I508 L544 Y548 I549 M554 F555	E496-R551 IonicContact OE2-CZ 2.64Å; E496-R551 IonicContact OE2-NH1 3.48Å; E496-R551 IonicContact OE2-NH2 3.85Å; E496-R551 PolarHBondContact OE2-NH2 2.98Å; T500-R551 PolarHBondContact OG1-NH2 3.41Å; C503-R551 VanDerWaalsContact SG-CD 3.59Å; I508-R551 HydrophobicContact CD1-CB 4.03Å; L544-R551 WeakPolarHBondContact O-CD 2.89Å; L544-R551 PolarHBondContact O-NH1 2.83Å; L544-R551 VanDerWaalsContact O-NH1 3.11Å; Y548-R551 VanDerWaalsContact CE2-NH1 3.28Å; Y548-R551 PolarHBondContact O-N 3.12Å; Y548-R551 VanDerWaalsContact O-N 3.09Å; I549-R551 VanDerWaalsContact C-N 3.29Å; I549-R551 PolarHBondContact O-N 3.44Å; R551-M554 WeakPolarHBondContact O-CB 3.49Å; R551-M554 PolarHBondContact O-N 3.25Å; R551-F555 PolarHBondContact O-N 3.47Å
552	K	96.6	Very high	95.8	Very high	22 Å²	22	50.7 Å²	50.7	10%	0.096	25%	0.252	C	S	.	.	H	α-helix	trans	-64.1	-36.8	169.5	-60.4	-175	-166.8	-141.5	0	112.7	C545 Y548 I549 F555 G556 C593 C594 L596 C598	C545-K552 HydrophobicContact CB-CG 4.08Å; C545-K552 VanDerWaalsContact O-CE 3.23Å; C545-K552 WeakPolarHBondContact O-CE 3.36Å; Y548-K552 WeakPolarHBondContact O-CG 3.45Å; Y548-K552 PolarHBondContact O-N 2.81Å; Y548-K552 VanDerWaalsContact O-N 3.1Å; I549-K552 WeakPolarHBondContact O-CB 3.4Å; I549-K552 PolarHBondContact O-N 3.09Å; I549-K552 VanDerWaalsContact O-N 3.15Å; K552-F555 WeakPolarHBondContact O-CB 3.47Å; K552-F555 PolarHBondContact O-N 3.25Å; K552-G556 PolarHBondContact O-N 3.45Å; K552-C593 WeakPolarHBondContact CE-O 3.49Å; K552-C593 PolarHBondContact NZ-O 3.4Å; K552-C594 WeakPolarHBondContact CB-O 3.47Å; K552-C594 WeakPolarHBondContact CG-O 3.2Å; K552-L596 PolarHBondContact NZ-O 3.26Å; K552-C598 HydrophobicContact CB-CB 3.81Å; K552-C598 HydrophobicContact CD-CB 4.1Å
553	E	95.6	Very high	95.7	Very high	114 Å²	114	50.7 Å²	50.7	53%	0.533	25%	0.252	S	S	.	.	H	α-helix	trans	-65.9	-39.2	172.8	-71.7	175.6	169.5	0	0	111.6	I549 Q550 F555 G556	I549-E553 WeakPolarHBondContact O-CG 3.35Å; I549-E553 PolarHBondContact O-N 2.88Å; Q550-E553 PolarHBondContact O-N 3.27Å; E553-F555 VanDerWaalsContact C-N 3.34Å; E553-G556 WeakPolarHBondContact O-CA 3.21Å; E553-G556 PolarHBondContact O-N 2.95Å
554	M	96.3	Very high	95.7	Very high	84 Å²	84	50 Å²	50	41%	0.414	24%	0.244	S	C	.	.	H	α-helix	trans	-64.2	-35.5	172.3	-71.9	-178.8	158.7	0	0	112.9	I508 Q550 R551 G556	I508-M554 HydrophobicContact CD1-CB 3.98Å; I508-M554 HydrophobicContact CD1-SD 4.29Å; I508-M554 HydrophobicContact CG2-CB 4.37Å; Q550-M554 WeakPolarHBondContact O-CG 3.41Å; Q550-M554 PolarHBondContact O-N 3.25Å; R551-M554 WeakPolarHBondContact O-CB 3.49Å; R551-M554 PolarHBondContact O-N 3.25Å; M554-G556 VanDerWaalsContact C-N 3.3Å
555	F	97.1	Very high	95.5	Very high	1 Å²	1	54.7 Å²	54.7	0%	0.004	27%	0.266	C	S	.	.	H	α-helix	trans	-60.1	-43.8	172.9	-178.2	-102.3	0	0	0	110.9	I508 I512 L541 R551 K552 E553 G559 V560 I563 C594 I595	I508-F555 HydrophobicContact CG2-CB 4.42Å; I512-F555 HydrophobicContact CD1-CD2 4.06Å; L541-F555 HydrophobicContact CD1-CE2 4.11Å; L541-F555 HydrophobicContact CD2-CD2 4.41Å; R551-F555 PolarHBondContact O-N 3.47Å; K552-F555 WeakPolarHBondContact O-CB 3.47Å; K552-F555 PolarHBondContact O-N 3.25Å; E553-F555 VanDerWaalsContact C-N 3.34Å; F555-G559 VanDerWaalsContact CE1-CA 3.42Å; F555-G559 WeakPolarHBondContact CZ-O 3.47Å; F555-G559 WeakPolarHBondContact O-CA 3.46Å; F555-G559 PolarHBondContact O-N 3.12Å; F555-V560 HydrophobicContact CE1-CG2 4.38Å; F555-I563 HydrophobicContact CE1-CG1 4.39Å; F555-I563 HydrophobicContact CZ-CD1 4.42Å; F555-I563 HydrophobicContact CZ-CG1 3.88Å; F555-C594 HydrophobicContact CD1-CB 3.75Å; F555-C594 HydrophobicContact CD2-CB 4.09Å; F555-C594 HydrophobicContact CE1-CB 3.82Å; F555-C594 HydrophobicContact CE2-CB 4.17Å; F555-C594 HydrophobicContact CG-CB 3.87Å; F555-C594 HydrophobicContact CZ-CB 4.02Å; F555-I595 HydrophobicContact CE1-CD1 4.44Å; F555-I595 HydrophobicContact CE1-CG1 4Å
556	G	95.4	Very high	95.2	Very high	17 Å²	17	55.2 Å²	55.2	18%	0.175	27%	0.268	C	S	.	.	H	α-helix	trans	56.3	-162.8	163.7	0	0	0	0	0	115.3	K552 E553 M554 E558 G559 V560	K552-G556 PolarHBondContact O-N 3.45Å; E553-G556 WeakPolarHBondContact O-CA 3.21Å; E553-G556 PolarHBondContact O-N 2.95Å; M554-G556 VanDerWaalsContact C-N 3.3Å; G556-E558 VanDerWaalsContact C-N 3.3Å; G556-E558 PolarHBondContact O-N 3.06Å; G556-G559 PolarHBondContact O-N 3.47Å; G556-V560 WeakPolarHBondContact O-CG2 3.43Å; G556-V560 PolarHBondContact O-N 3.12Å
557	T	96.3	Very high	95.2	Very high	72 Å²	72	52.2 Å²	52.2	44%	0.442	26%	0.255	S	S	.	.	H	α-helix	trans	-67	-32.6	-177.4	56.7	0	0	0	0	112.5	V560 D561 Y604	T557-V560 PolarHBondContact O-N 2.84Å; T557-D561 VanDerWaalsContact O-CG 3.27Å; T557-D561 PolarHBondContact O-N 2.98Å; T557-Y604 HydrophobicContact CG2-CD1 3.87Å; T557-Y604 HydrophobicContact CG2-CD2 3.89Å; T557-Y604 HydrophobicContact CG2-CE1 4.07Å; T557-Y604 HydrophobicContact CG2-CE2 4.07Å; T557-Y604 HydrophobicContact CG2-CG 3.79Å
558	E	96.1	Very high	95.3	Very high	98 Å²	98	51.3 Å²	51.3	46%	0.458	25%	0.248	S	C	.	.	H	α-helix	trans	-65.6	-39.6	178.1	-66.5	-159.2	177	0	0	112.6	I512 K516 G556 D561 I562	I512-E558 HydrophobicContact CG2-CB 4.07Å; K516-E558 IonicContact NZ-OE1 2.77Å; K516-E558 IonicContact NZ-OE2 3.15Å; K516-E558 PolarHBondContact NZ-OE2 2.59Å; G556-E558 VanDerWaalsContact C-N 3.3Å; G556-E558 PolarHBondContact O-N 3.06Å; E558-D561 PolarHBondContact O-N 2.8Å; E558-I562 PolarHBondContact O-N 3.17Å
559	G	96.6	Very high	94.9	Very high	0 Å²	0	49 Å²	49	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-64	-42.7	172.2	0	0	0	0	0	111.5	F555 G556 D561 I562 I563	F555-G559 VanDerWaalsContact CE1-CA 3.42Å; F555-G559 WeakPolarHBondContact CZ-O 3.47Å; F555-G559 WeakPolarHBondContact O-CA 3.46Å; F555-G559 PolarHBondContact O-N 3.12Å; G556-G559 PolarHBondContact O-N 3.47Å; G559-D561 VanDerWaalsContact C-N 3.3Å; G559-D561 PolarHBondContact O-N 3.44Å; G559-I562 WeakPolarHBondContact O-CG1 3.24Å; G559-I562 PolarHBondContact O-N 3.21Å; G559-I563 WeakPolarHBondContact O-CG1 3.49Å; G559-I563 PolarHBondContact O-N 3.35Å
560	V	97.5	Very high	94.5	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-61.7	-39.5	175.6	176.7	0	0	0	0	111.6	F555 G556 T557 I562 I563 L564 I595 Y604 F605	F555-V560 HydrophobicContact CE1-CG2 4.38Å; G556-V560 WeakPolarHBondContact O-CG2 3.43Å; G556-V560 PolarHBondContact O-N 3.12Å; T557-V560 PolarHBondContact O-N 2.84Å; V560-I562 PolarHBondContact O-N 3.44Å; V560-I563 WeakPolarHBondContact O-CB 3.37Å; V560-I563 PolarHBondContact O-N 2.93Å; V560-L564 HydrophobicContact CG1-CD1 3.8Å; V560-L564 HydrophobicContact CG1-CG 4.22Å; V560-L564 VanDerWaalsContact O-CG 3.28Å; V560-L564 WeakPolarHBondContact O-CG 3.44Å; V560-L564 PolarHBondContact O-N 3.24Å; V560-I595 HydrophobicContact CG2-CD1 3.98Å; V560-I595 HydrophobicContact CG2-CG1 4.14Å; V560-Y604 HydrophobicContact CB-CD1 3.72Å; V560-Y604 HydrophobicContact CB-CE1 4.03Å; V560-Y604 HydrophobicContact CG1-CD1 3.57Å; V560-Y604 HydrophobicContact CG1-CE1 3.96Å; V560-Y604 HydrophobicContact CG2-CD1 4.27Å; V560-F605 HydrophobicContact CG1-CB 3.97Å; V560-F605 HydrophobicContact CG1-CD2 3.94Å; V560-F605 HydrophobicContact CG1-CG 4.47Å
561	D	96.5	Very high	94	Very high	64 Å²	64	44.4 Å²	44.4	34%	0.342	23%	0.228	S	C	.	.	H	α-helix	trans	-62.5	-38	178.7	-71.7	-28	0	0	0	112.7	T557 E558 G559 L564 H565 Y604	T557-D561 VanDerWaalsContact O-CG 3.27Å; T557-D561 PolarHBondContact O-N 2.98Å; E558-D561 PolarHBondContact O-N 2.8Å; G559-D561 VanDerWaalsContact C-N 3.3Å; G559-D561 PolarHBondContact O-N 3.44Å; D561-L564 PolarHBondContact O-N 3.33Å; D561-H565 WeakPolarHBondContact O-CB 3.39Å; D561-H565 PolarHBondContact O-N 3.3Å; D561-Y604 WeakPolarHBondContact OD1-CE1 3.35Å; D561-Y604 PolarHBondContact OD1-OH 2.75Å; D561-Y604 PolarHBondContact OD2-OH 2.89Å
562	I	95.9	Very high	93.5	Very high	5 Å²	5	51.2 Å²	51.2	3%	0.026	26%	0.258	C	S	.	.	H	α-helix	trans	-68.5	-37.7	176.5	62	164.5	0	0	0	112	I512 F515 K516 L538 L541 E558 G559 V560 H565 V566	I512-I562 HydrophobicContact CG1-CD1 4.22Å; I512-I562 HydrophobicContact CG2-CG2 4.35Å; F515-I562 HydrophobicContact CB-CD1 4.07Å; F515-I562 HydrophobicContact CD1-CB 3.62Å; F515-I562 HydrophobicContact CD1-CD1 4.18Å; F515-I562 HydrophobicContact CD1-CG1 4.46Å; F515-I562 HydrophobicContact CD1-CG2 3.76Å; F515-I562 HydrophobicContact CD2-CD1 4.27Å; F515-I562 HydrophobicContact CE1-CB 3.96Å; F515-I562 HydrophobicContact CE1-CG2 4.49Å; F515-I562 HydrophobicContact CG-CB 4.24Å; F515-I562 HydrophobicContact CG-CD1 3.89Å; F515-I562 HydrophobicContact CG-CG2 4.39Å; K516-I562 HydrophobicContact CD-CG2 4.49Å; K516-I562 HydrophobicContact CG-CG2 3.66Å; L538-I562 HydrophobicContact CD2-CD1 3.95Å; L541-I562 HydrophobicContact CD1-CD1 4.49Å; E558-I562 PolarHBondContact O-N 3.17Å; G559-I562 WeakPolarHBondContact O-CG1 3.24Å; G559-I562 PolarHBondContact O-N 3.21Å; V560-I562 PolarHBondContact O-N 3.44Å; I562-H565 WeakPolarHBondContact O-CB 3.39Å; I562-H565 PolarHBondContact O-N 3.36Å; I562-V566 PolarHBondContact O-N 2.65Å
563	I	96.8	Very high	93	Very high	0 Å²	0	53.3 Å²	53.3	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-61.9	-48.9	175	-65.7	-62.5	0	0	0	110	L538 F555 G559 V560 H565 V566 M567 T587 I591 I595 F605	L538-I563 HydrophobicContact CD1-CD1 4.48Å; L538-I563 HydrophobicContact CD2-CD1 3.78Å; F555-I563 HydrophobicContact CE1-CG1 4.39Å; F555-I563 HydrophobicContact CZ-CD1 4.42Å; F555-I563 HydrophobicContact CZ-CG1 3.88Å; G559-I563 WeakPolarHBondContact O-CG1 3.49Å; G559-I563 PolarHBondContact O-N 3.35Å; V560-I563 WeakPolarHBondContact O-CB 3.37Å; V560-I563 PolarHBondContact O-N 2.93Å; I563-H565 VanDerWaalsContact C-N 3.27Å; I563-H565 PolarHBondContact O-N 2.71Å; I563-V566 PolarHBondContact O-N 3.01Å; I563-M567 HydrophobicContact CG2-SD 3.97Å; I563-M567 WeakPolarHBondContact O-CG 3.42Å; I563-M567 PolarHBondContact O-N 3.34Å; I563-T587 HydrophobicContact CB-CG2 4.42Å; I563-T587 HydrophobicContact CD1-CG2 3.9Å; I563-T587 HydrophobicContact CG2-CG2 3.8Å; I563-I591 HydrophobicContact CG2-CD1 3.82Å; I563-I591 HydrophobicContact CG2-CG1 3.49Å; I563-I591 VanDerWaalsContact CG2-CG1 3.49Å; I563-I595 HydrophobicContact CG1-CD1 4.35Å; I563-I595 HydrophobicContact CG2-CD1 4.29Å; I563-F605 HydrophobicContact CG2-CE2 4.12Å
564	L	95.7	Very high	92.4	Very high	5 Å²	5	48.9 Å²	48.9	3%	0.026	25%	0.247	C	C	.	.	H	α-helix	trans	-61.9	-35.7	178.2	-68.4	167.6	0	0	0	112.2	V560 D561 M567 K568 F605 K608 G610 L613	V560-L564 HydrophobicContact CG1-CD1 3.8Å; V560-L564 HydrophobicContact CG1-CG 4.22Å; V560-L564 VanDerWaalsContact O-CG 3.28Å; V560-L564 WeakPolarHBondContact O-CG 3.44Å; V560-L564 PolarHBondContact O-N 3.24Å; D561-L564 PolarHBondContact O-N 3.33Å; L564-M567 PolarHBondContact O-N 3.18Å; L564-K568 VanDerWaalsContact O-CG 3.27Å; L564-K568 WeakPolarHBondContact O-CG 3.33Å; L564-K568 PolarHBondContact O-N 3.13Å; L564-F605 HydrophobicContact CD2-CD2 3.89Å; L564-F605 HydrophobicContact CD2-CE2 3.77Å; L564-F605 HydrophobicContact CG-CD2 4.3Å; L564-F605 HydrophobicContact CG-CE2 4.4Å; L564-K608 HydrophobicContact CD1-CB 3.41Å; L564-K608 VanDerWaalsContact CD1-CB 3.41Å; L564-K608 HydrophobicContact CD1-CG 4.01Å; L564-G610 VanDerWaalsContact CD2-CA 3.49Å; L564-L613 HydrophobicContact CD2-CD1 3.9Å
565	H	92.4	Very high	91.7	Very high	98 Å²	98	53 Å²	53	45%	0.454	27%	0.265	S	S	.	.	H	α-helix	trans	-60.2	-48	175	179.1	86.1	0	0	0	111.4	D561 I562 I563 K568	D561-H565 WeakPolarHBondContact O-CB 3.39Å; D561-H565 PolarHBondContact O-N 3.3Å; I562-H565 WeakPolarHBondContact O-CB 3.39Å; I562-H565 PolarHBondContact O-N 3.36Å; I563-H565 VanDerWaalsContact C-N 3.27Å; I563-H565 PolarHBondContact O-N 2.71Å; H565-K568 PolarHBondContact O-N 2.89Å
566	V	92.1	Very high	91.1	Very high	10 Å²	10	55.7 Å²	55.7	6%	0.061	28%	0.284	C	S	.	.	H	α-helix	trans	-64.1	-44.6	178.3	-179.7	0	0	0	0	111.4	F515 I562 I563 K568 T569 L583 T587	F515-V566 HydrophobicContact CE1-CG2 3.92Å; F515-V566 HydrophobicContact CE2-CG2 4.33Å; F515-V566 HydrophobicContact CZ-CG2 3.33Å; I562-V566 PolarHBondContact O-N 2.65Å; I563-V566 PolarHBondContact O-N 3.01Å; V566-K568 PolarHBondContact O-N 3.46Å; V566-K568 VanDerWaalsContact O-N 3.17Å; V566-T569 WeakPolarHBondContact O-CB 3.13Å; V566-T569 PolarHBondContact O-N 3.1Å; V566-T569 PolarHBondContact O-OG1 2.89Å; V566-L583 HydrophobicContact CG1-CD2 3.93Å; V566-L583 HydrophobicContact CG1-CG 3.83Å; V566-L583 HydrophobicContact CG2-CD1 4.48Å; V566-L583 HydrophobicContact CG2-CD2 4.33Å; V566-L583 HydrophobicContact CG2-CG 4.46Å; V566-T587 HydrophobicContact CB-CG2 4.22Å; V566-T587 HydrophobicContact CG1-CG2 4.34Å; V566-T587 WeakPolarHBondContact CG1-OG1 3.4Å
567	M	93.1	Very high	90.5	Very high	11 Å²	11	58.4 Å²	58.4	5%	0.054	31%	0.312	C	S	.	.	H	α-helix	trans	-62.5	-23.8	-178.9	-68.6	178.6	78.3	0	0	113.5	I563 L564 T569 T587 I591 F605 L613 L614 I617	I563-M567 HydrophobicContact CG2-SD 3.97Å; I563-M567 WeakPolarHBondContact O-CG 3.42Å; I563-M567 PolarHBondContact O-N 3.34Å; L564-M567 PolarHBondContact O-N 3.18Å; M567-T569 VanDerWaalsContact C-N 3.26Å; M567-T569 PolarHBondContact O-N 3.36Å; M567-T587 HydrophobicContact CG-CG2 4Å; M567-I591 HydrophobicContact CE-CD1 4.27Å; M567-I591 HydrophobicContact SD-CD1 3.74Å; M567-F605 HydrophobicContact CE-CZ 4.22Å; M567-F605 HydrophobicContact SD-CE2 3.93Å; M567-F605 HydrophobicContact SD-CZ 3.95Å; M567-L613 HydrophobicContact CB-CB 4.05Å; M567-L613 HydrophobicContact CB-CD1 3.99Å; M567-L613 HydrophobicContact CE-CB 3.72Å; M567-L614 HydrophobicContact CE-CB 3.81Å; M567-L614 HydrophobicContact CE-CD1 4.06Å; M567-L614 VanDerWaalsContact CE-N 3.33Å; M567-I617 HydrophobicContact CB-CD1 4.29Å; M567-I617 HydrophobicContact CE-CD1 3.96Å; M567-I617 HydrophobicContact CG-CD1 4.26Å
568	K	91.4	Very high	89.9	Confident	141 Å²	141	58 Å²	58	61%	0.613	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.3	-5.9	174.6	-73	169.8	-175.8	175.8	0	113.9	L564 H565 V566 L613	L564-K568 VanDerWaalsContact O-CG 3.27Å; L564-K568 WeakPolarHBondContact O-CG 3.33Å; L564-K568 PolarHBondContact O-N 3.13Å; H565-K568 PolarHBondContact O-N 2.89Å; V566-K568 PolarHBondContact O-N 3.46Å; V566-K568 VanDerWaalsContact O-N 3.17Å; K568-L613 HydrophobicContact CG-CD1 3.84Å; K568-L613 HydrophobicContact CG-CD2 3.93Å
569	T	87	Confident	89.6	Confident	39 Å²	39	54.5 Å²	54.5	24%	0.239	30%	0.298	C	S	.	.	S	Bend	trans	-62	139.7	179.5	-59.1	0	0	0	0	111.3	V566 M567 P571 K573 Y580	V566-T569 WeakPolarHBondContact O-CB 3.13Å; V566-T569 PolarHBondContact O-N 3.1Å; V566-T569 PolarHBondContact O-OG1 2.89Å; M567-T569 VanDerWaalsContact C-N 3.26Å; M567-T569 PolarHBondContact O-N 3.36Å; T569-P571 VanDerWaalsContact O-CD 3.31Å; T569-P571 WeakPolarHBondContact O-CD 3.05Å; T569-K573 HydrophobicContact CG2-CB 4.4Å; T569-K573 HydrophobicContact CG2-CD 3.7Å; T569-Y580 HydrophobicContact CG2-CD1 3.98Å; T569-Y580 HydrophobicContact CG2-CE1 3.65Å
570	D	85	Confident	89.3	Confident	76 Å²	76	55.5 Å²	55.5	41%	0.406	30%	0.301	S	S	.	.			trans	-56	120.7	179.3	-177.5	-5.5	0	0	0	111.1	K572 K573	D570-K572 PolarHBondContact O-N 3.42Å; D570-K572 WeakPolarHBondContact OD1-CG 3.32Å; D570-K572 PolarHBondContact OD1-N 3.12Å; D570-K573 HydrophobicContact CB-CG 4.41Å; D570-K573 WeakPolarHBondContact O-CB 3.29Å; D570-K573 PolarHBondContact O-N 3.24Å
571	P	84.6	Confident	89	Confident	59 Å²	59	58.2 Å²	58.2	38%	0.383	32%	0.316	S	S	.	.	G	3₁₀ helix	trans	-52.3	-25.1	177	-31.4	37.7	0	0	0	115.3	T569 K573 L574 L620	T569-P571 VanDerWaalsContact O-CD 3.31Å; T569-P571 WeakPolarHBondContact O-CD 3.05Å; P571-K573 PolarHBondContact O-N 3.41Å; P571-L574 VanDerWaalsContact O-CB 3.31Å; P571-L574 WeakPolarHBondContact O-CB 3.36Å; P571-L574 WeakPolarHBondContact O-CG 3.47Å; P571-L574 PolarHBondContact O-N 3.49Å; P571-L620 HydrophobicContact CB-CD1 3.71Å; P571-L620 HydrophobicContact CB-CD2 3.89Å; P571-L620 HydrophobicContact CB-CG 4.46Å; P571-L620 HydrophobicContact CG-CD1 4.09Å; P571-L620 HydrophobicContact CG-CD2 4.2Å
572	K	85.8	Confident	88.8	Confident	160 Å²	160	59.1 Å²	59.1	70%	0.696	32%	0.324	S	S	*	.	G	3₁₀ helix	trans	-62.1	-28.4	176.2	-67	177.4	-176.2	172	0	112.5	D570 L574 Q575	D570-K572 PolarHBondContact O-N 3.42Å; D570-K572 WeakPolarHBondContact OD1-CG 3.32Å; D570-K572 PolarHBondContact OD1-N 3.12Å; K572-L574 PolarHBondContact O-N 2.88Å; K572-Q575 PolarHBondContact O-N 3.01Å
573	K	85.6	Confident	88.7	Confident	66 Å²	66	59 Å²	59	29%	0.287	32%	0.323	S	S	.	.	G	3₁₀ helix	trans	-67.3	-19.8	178.9	-64.7	-172.7	-175.8	180	0	113.1	E526 T569 D570 P571 Q575 S576 Y580	E526-K573 VanDerWaalsContact OE1-CE 3.27Å; E526-K573 WeakPolarHBondContact OE1-CE 3.49Å; E526-K573 IonicContact OE1-NZ 2.68Å; E526-K573 PolarHBondContact OE1-NZ 3.15Å; E526-K573 IonicContact OE2-NZ 3.91Å; T569-K573 HydrophobicContact CG2-CB 4.4Å; T569-K573 HydrophobicContact CG2-CD 3.7Å; D570-K573 HydrophobicContact CB-CG 4.41Å; D570-K573 WeakPolarHBondContact O-CB 3.29Å; D570-K573 PolarHBondContact O-N 3.24Å; P571-K573 PolarHBondContact O-N 3.41Å; K573-Q575 PolarHBondContact O-N 2.96Å; K573-Q575 VanDerWaalsContact O-N 3.13Å; K573-S576 VanDerWaalsContact O-CB 3.25Å; K573-S576 WeakPolarHBondContact O-CB 3.17Å; K573-S576 PolarHBondContact O-N 3.43Å; K573-S576 PolarHBondContact O-OG 3.49Å; K573-Y580 HydrophobicContact CB-CD1 4.41Å; K573-Y580 HydrophobicContact CB-CD2 3.77Å; K573-Y580 HydrophobicContact CB-CE2 3.85Å; K573-Y580 HydrophobicContact CB-CG 4.04Å; K573-Y580 HydrophobicContact CD-CE1 4.13Å; K573-Y580 HydrophobicContact CD-CE2 3.89Å; K573-Y580 HydrophobicContact CG-CE2 4.37Å
574	L	82.9	Confident	88.6	Confident	21 Å²	21	59.6 Å²	59.6	11%	0.11	33%	0.326	C	S	.	.	G	3₁₀ helix	trans	-59.8	-23.2	173.3	-62.6	172.7	0	0	0	112.7	P571 K572 N581 L584 L620	P571-L574 VanDerWaalsContact O-CB 3.31Å; P571-L574 WeakPolarHBondContact O-CB 3.36Å; P571-L574 WeakPolarHBondContact O-CG 3.47Å; P571-L574 PolarHBondContact O-N 3.49Å; K572-L574 PolarHBondContact O-N 2.88Å; L574-N581 PolarHBondContact O-ND2 3.14Å; L574-N581 PolarHBondContact O-OD1 3.23Å; L574-L584 HydrophobicContact CD1-CD2 4.23Å; L574-L584 HydrophobicContact CD2-CB 4.3Å; L574-L584 HydrophobicContact CD2-CD2 3.83Å; L574-L620 HydrophobicContact CD1-CD1 4.13Å
575	Q	81.9	Confident	88.5	Confident	169 Å²	169	63.1 Å²	63.1	79%	0.79	34%	0.341	S	S	*	.	G	3₁₀ helix	trans	-94.7	-0.7	178.3	-61.7	-179.5	-6.3	0	0	113.7	K572 K573 G577	K572-Q575 PolarHBondContact O-N 3.01Å; K573-Q575 PolarHBondContact O-N 2.96Å; K573-Q575 VanDerWaalsContact O-N 3.13Å; Q575-G577 VanDerWaalsContact C-N 3.28Å; Q575-G577 PolarHBondContact O-N 2.93Å
576	S	84.1	Confident	88.7	Confident	58 Å²	58	58.6 Å²	58.6	41%	0.406	32%	0.321	S	S	.	.	S	Bend	trans	-70.2	-20	-175.5	63.8	0	0	0	0	114.6	K573 L578	K573-S576 VanDerWaalsContact O-CB 3.25Å; K573-S576 WeakPolarHBondContact O-CB 3.17Å; K573-S576 PolarHBondContact O-N 3.43Å; K573-S576 PolarHBondContact O-OG 3.49Å; S576-L578 PolarHBondContact O-N 2.61Å; S576-L578 PolarHBondContact OG-N 2.87Å
577	G	82.7	Confident	88.9	Confident	74 Å²	74	58.1 Å²	58.1	76%	0.763	32%	0.318	S	S	*	.	S	Bend	trans	76.4	-1.2	-173.3	0	0	0	0	0	115	Q575 G579	Q575-G577 VanDerWaalsContact C-N 3.28Å; Q575-G577 PolarHBondContact O-N 2.93Å; G577-G579 VanDerWaalsContact C-N 3.35Å; G577-G579 PolarHBondContact O-N 3.25Å
578	L	85.2	Confident	89.1	Confident	64 Å²	64	57.6 Å²	57.6	34%	0.335	32%	0.315	S	S	.	.	S	Bend	trans	-76.8	-13.9	-176.5	-68.2	173.3	0	0	0	114.9	E526 A528 L531 S576 Y580	E526-L578 HydrophobicContact CB-CD1 4.18Å; A528-L578 WeakPolarHBondContact CA-O 3.45Å; A528-L578 VanDerWaalsContact CB-O 3.31Å; A528-L578 WeakPolarHBondContact CB-O 3.36Å; L531-L578 HydrophobicContact CD1-CB 3.85Å; S576-L578 PolarHBondContact O-N 2.61Å; S576-L578 PolarHBondContact OG-N 2.87Å; L578-Y580 HydrophobicContact CB-CD2 4.42Å
579	G	88.1	Confident	89.4	Confident	25 Å²	25	53.2 Å²	53.2	26%	0.258	30%	0.299	S	S	.	.	S	Bend	trans	120.1	0.1	179.9	0	0	0	0	0	115.6	G577 N581 V582 L583	G577-G579 VanDerWaalsContact C-N 3.35Å; G577-G579 PolarHBondContact O-N 3.25Å; G579-N581 PolarHBondContact O-N 3.41Å; G579-V582 WeakPolarHBondContact O-CB 3.21Å; G579-V582 PolarHBondContact O-N 2.98Å; G579-L583 PolarHBondContact O-N 2.98Å; G579-L583 VanDerWaalsContact O-N 3.17Å
580	Y	90.2	Very high	89.8	Confident	20 Å²	20	51.4 Å²	51.4	8%	0.078	29%	0.287	C	S	.	.	H	α-helix	trans	-54.3	-28.4	178.6	-80.5	-77.2	0	0	0	115.2	E526 L531 T569 K573 L578 L583 L584	E526-Y580 PolarHBondContact OE1-OH 2.89Å; E526-Y580 VanDerWaalsContact OE2-CE2 3.27Å; E526-Y580 WeakPolarHBondContact OE2-CE2 2.99Å; E526-Y580 PolarHBondContact OE2-OH 3.37Å; L531-Y580 HydrophobicContact CD1-CD1 4.47Å; L531-Y580 HydrophobicContact CD1-CD2 3.71Å; L531-Y580 HydrophobicContact CD1-CE1 4.38Å; L531-Y580 HydrophobicContact CD1-CE2 3.62Å; L531-Y580 HydrophobicContact CD1-CG 4.17Å; L531-Y580 HydrophobicContact CD2-CD1 4.12Å; L531-Y580 HydrophobicContact CD2-CE1 3.7Å; L531-Y580 HydrophobicContact CD2-CE2 4.34Å; T569-Y580 HydrophobicContact CG2-CD1 3.98Å; T569-Y580 HydrophobicContact CG2-CE1 3.65Å; K573-Y580 HydrophobicContact CB-CD1 4.41Å; K573-Y580 HydrophobicContact CB-CD2 3.77Å; K573-Y580 HydrophobicContact CB-CE2 3.85Å; K573-Y580 HydrophobicContact CB-CG 4.04Å; K573-Y580 HydrophobicContact CD-CE1 4.13Å; K573-Y580 HydrophobicContact CD-CE2 3.89Å; K573-Y580 HydrophobicContact CG-CE2 4.37Å; L578-Y580 HydrophobicContact CB-CD2 4.42Å; Y580-L583 HydrophobicContact CD1-CD2 4.43Å; Y580-L583 PolarHBondContact O-N 3.3Å; Y580-L584 WeakPolarHBondContact O-CB 3.23Å; Y580-L584 PolarHBondContact O-N 3.39Å
581	N	91.1	Very high	90.4	Very high	58 Å²	58	47.8 Å²	47.8	31%	0.31	27%	0.268	S	S	.	.	H	α-helix	trans	-65	-40.6	174.2	-68	-46.9	0	0	0	111.7	L574 G579 L584 F585 F625	L574-N581 PolarHBondContact O-ND2 3.14Å; L574-N581 PolarHBondContact O-OD1 3.23Å; G579-N581 PolarHBondContact O-N 3.41Å; N581-L584 PolarHBondContact O-N 3.13Å; N581-F585 WeakPolarHBondContact O-CD2 3.35Å; N581-F585 PolarHBondContact O-N 3.26Å; N581-F625 HydrophobicContact CB-CZ 4.25Å
582	V	93.1	Very high	91	Very high	83 Å²	83	48.7 Å²	48.7	50%	0.503	26%	0.264	S	S	.	.	H	α-helix	trans	-68.3	-42.6	177.9	-177.7	0	0	0	0	109.8	G579 L584 F585 S586	G579-V582 WeakPolarHBondContact O-CB 3.21Å; G579-V582 PolarHBondContact O-N 2.98Å; V582-L584 PolarHBondContact O-N 3.43Å; V582-F585 PolarHBondContact O-N 3.29Å; V582-S586 WeakPolarHBondContact O-CB 3.26Å; V582-S586 PolarHBondContact O-N 3.03Å; V582-S586 PolarHBondContact O-OG 2.94Å
583	L	94.6	Very high	91.5	Very high	3 Å²	3	41.2 Å²	41.2	2%	0.016	23%	0.232	C	C	.	.	H	α-helix	trans	-61.1	-44	175.6	-179.2	60.9	0	0	0	111.7	F515 L531 Q534 S535 L538 V566 G579 Y580 S586 T587	F515-L583 HydrophobicContact CE2-CD1 4.2Å; F515-L583 HydrophobicContact CZ-CD1 4.42Å; L531-L583 HydrophobicContact CD2-CD2 3.74Å; Q534-L583 HydrophobicContact CB-CD1 3.72Å; S535-L583 VanDerWaalsContact OG-CA 3.23Å; S535-L583 WeakPolarHBondContact OG-CA 3.33Å; S535-L583 PolarHBondContact OG-N 3.1Å; L538-L583 HydrophobicContact CD1-CD1 3.91Å; V566-L583 HydrophobicContact CG1-CD2 3.93Å; V566-L583 HydrophobicContact CG1-CG 3.83Å; V566-L583 HydrophobicContact CG2-CD1 4.48Å; V566-L583 HydrophobicContact CG2-CD2 4.33Å; V566-L583 HydrophobicContact CG2-CG 4.46Å; G579-L583 PolarHBondContact O-N 2.98Å; G579-L583 VanDerWaalsContact O-N 3.17Å; Y580-L583 HydrophobicContact CD1-CD2 4.43Å; Y580-L583 PolarHBondContact O-N 3.3Å; L583-S586 PolarHBondContact O-N 3.36Å; L583-T587 WeakPolarHBondContact O-CB 3.41Å; L583-T587 PolarHBondContact O-N 3.45Å; L583-T587 PolarHBondContact O-OG1 3.38Å
584	L	93.9	Very high	92.1	Very high	12 Å²	12	38.1 Å²	38.1	6%	0.063	22%	0.218	C	C	.	.	H	α-helix	trans	-64.5	-41.6	176.2	179.1	59.1	0	0	0	111.9	L574 Y580 N581 V582 T587 L588 I617 F625	L574-L584 HydrophobicContact CD1-CD2 4.23Å; L574-L584 HydrophobicContact CD2-CB 4.3Å; L574-L584 HydrophobicContact CD2-CD2 3.83Å; Y580-L584 WeakPolarHBondContact O-CB 3.23Å; Y580-L584 PolarHBondContact O-N 3.39Å; N581-L584 PolarHBondContact O-N 3.13Å; V582-L584 PolarHBondContact O-N 3.43Å; L584-T587 WeakPolarHBondContact O-CB 3.33Å; L584-T587 PolarHBondContact O-N 3.01Å; L584-L588 HydrophobicContact CD1-CD1 4.48Å; L584-L588 HydrophobicContact CD1-CG 4.23Å; L584-L588 HydrophobicContact CG-CD1 4.34Å; L584-L588 WeakPolarHBondContact O-CG 3.47Å; L584-L588 PolarHBondContact O-N 3.04Å; L584-I617 HydrophobicContact CD1-CD1 4.04Å; L584-I617 HydrophobicContact CD2-CG2 4.1Å; L584-F625 HydrophobicContact CB-CE1 4.33Å; L584-F625 HydrophobicContact CB-CZ 4.41Å; L584-F625 HydrophobicContact CD2-CD1 4.21Å; L584-F625 HydrophobicContact CD2-CD2 4.21Å; L584-F625 HydrophobicContact CD2-CE1 3.92Å; L584-F625 HydrophobicContact CD2-CE2 3.94Å; L584-F625 HydrophobicContact CD2-CG 4.35Å; L584-F625 HydrophobicContact CD2-CZ 3.8Å; L584-F625 HydrophobicContact CG-CD1 4.38Å; L584-F625 HydrophobicContact CG-CE1 4Å; L584-F625 HydrophobicContact CG-CZ 4.27Å
585	F	94.4	Very high	92.7	Very high	78 Å²	78	37.1 Å²	37.1	34%	0.342	21%	0.213	S	C	.	.	H	α-helix	trans	-58.7	-48.2	173.3	-89.3	-62.4	0	0	0	111.8	N581 V582 T587 L588 D589 K624 F625 L628	N581-F585 WeakPolarHBondContact O-CD2 3.35Å; N581-F585 PolarHBondContact O-N 3.26Å; V582-F585 PolarHBondContact O-N 3.29Å; F585-T587 PolarHBondContact O-N 3.01Å; F585-L588 PolarHBondContact O-N 3.26Å; F585-D589 VanDerWaalsContact O-CB 3.3Å; F585-D589 WeakPolarHBondContact O-CB 3.18Å; F585-D589 PolarHBondContact O-N 3.41Å; F585-K624 HydrophobicContact CZ-CB 4.08Å; F585-F625 HydrophobicContact CD1-CD1 4.01Å; F585-F625 AromaticContact CD1-CE1 3.82Å; F585-F625 HydrophobicContact CD1-CE1 3.82Å; F585-F625 HydrophobicContact CD2-CD1 4.39Å; F585-F625 AromaticContact CD2-CE1 3.46Å; F585-F625 HydrophobicContact CD2-CE1 3.46Å; F585-F625 VanDerWaalsContact CD2-CE1 3.46Å; F585-F625 HydrophobicContact CD2-CZ 4.06Å; F585-F625 AromaticContact CE1-CD1 3.66Å; F585-F625 HydrophobicContact CE1-CD1 3.66Å; F585-F625 AromaticContact CE1-CE1 3.7Å; F585-F625 HydrophobicContact CE1-CE1 3.7Å; F585-F625 HydrophobicContact CE2-CD1 4.07Å; F585-F625 AromaticContact CE2-CE1 3.32Å; F585-F625 HydrophobicContact CE2-CE1 3.32Å; F585-F625 AromaticContact CE2-CZ 3.78Å; F585-F625 HydrophobicContact CE2-CZ 3.78Å; F585-F625 HydrophobicContact CG-CD1 4.35Å; F585-F625 AromaticContact CG-CE1 3.7Å; F585-F625 HydrophobicContact CG-CE1 3.7Å; F585-F625 AromaticContact CZ-CD1 3.69Å; F585-F625 HydrophobicContact CZ-CD1 3.69Å; F585-F625 AromaticContact CZ-CE1 3.46Å; F585-F625 HydrophobicContact CZ-CE1 3.46Å; F585-F625 VanDerWaalsContact CZ-CE1 3.46Å; F585-F625 HydrophobicContact CZ-CZ 4.2Å; F585-L628 HydrophobicContact CD1-CD2 4.08Å; F585-L628 HydrophobicContact CE1-CD2 4.44Å
586	S	96.3	Very high	93.4	Very high	3 Å²	3	29.2 Å²	29.2	2%	0.021	18%	0.176	C	C	.	.	H	α-helix	trans	-61.4	-34.9	177.7	-47.4	0	0	0	0	111.2	V582 L583 S590	V582-S586 WeakPolarHBondContact O-CB 3.26Å; V582-S586 PolarHBondContact O-N 3.03Å; V582-S586 PolarHBondContact O-OG 2.94Å; L583-S586 PolarHBondContact O-N 3.36Å; S586-S590 WeakPolarHBondContact O-CB 3.15Å; S586-S590 PolarHBondContact O-N 3.46Å; S586-S590 PolarHBondContact O-OG 2.81Å
587	T	96.9	Very high	93.8	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-67.9	-45.5	175.7	-56.8	0	0	0	0	112.1	L538 I563 V566 M567 L583 L584 F585 D589 S590 I591	L538-T587 WeakPolarHBondContact CD1-OG1 3.42Å; I563-T587 HydrophobicContact CB-CG2 4.42Å; I563-T587 HydrophobicContact CD1-CG2 3.9Å; I563-T587 HydrophobicContact CG2-CG2 3.8Å; V566-T587 HydrophobicContact CB-CG2 4.22Å; V566-T587 HydrophobicContact CG1-CG2 4.34Å; V566-T587 WeakPolarHBondContact CG1-OG1 3.4Å; M567-T587 HydrophobicContact CG-CG2 4Å; L583-T587 WeakPolarHBondContact O-CB 3.41Å; L583-T587 PolarHBondContact O-N 3.45Å; L583-T587 PolarHBondContact O-OG1 3.38Å; L584-T587 WeakPolarHBondContact O-CB 3.33Å; L584-T587 PolarHBondContact O-N 3.01Å; F585-T587 PolarHBondContact O-N 3.01Å; T587-D589 VanDerWaalsContact C-N 3.33Å; T587-S590 PolarHBondContact O-N 2.9Å; T587-I591 HydrophobicContact CG2-CD1 4.49Å; T587-I591 WeakPolarHBondContact O-CG1 3.37Å; T587-I591 PolarHBondContact O-N 3.3Å
588	L	96.6	Very high	94.4	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-65.3	-40.3	177.4	-68.5	174.7	0	0	0	111.3	L584 F585 I591 W592 L614 F625 L628 I629 I632	L584-L588 HydrophobicContact CD1-CD1 4.48Å; L584-L588 HydrophobicContact CD1-CG 4.23Å; L584-L588 HydrophobicContact CG-CD1 4.34Å; L584-L588 WeakPolarHBondContact O-CG 3.47Å; L584-L588 PolarHBondContact O-N 3.04Å; F585-L588 PolarHBondContact O-N 3.26Å; L588-I591 HydrophobicContact CD2-CD1 4.17Å; L588-I591 WeakPolarHBondContact O-CB 3.42Å; L588-I591 PolarHBondContact O-N 2.87Å; L588-W592 PolarHBondContact O-N 3.27Å; L588-W592 VanDerWaalsContact O-N 3.1Å; L588-L614 HydrophobicContact CD2-CD1 3.58Å; L588-F625 HydrophobicContact CD1-CB 4.43Å; L588-F625 HydrophobicContact CD1-CD1 3.84Å; L588-L628 HydrophobicContact CB-CD2 3.53Å; L588-L628 HydrophobicContact CB-CG 4.11Å; L588-L628 HydrophobicContact CD1-CD2 3.93Å; L588-L628 HydrophobicContact CD1-CG 4.41Å; L588-L628 HydrophobicContact CG-CD2 4.4Å; L588-I629 HydrophobicContact CD1-CD1 4.33Å; L588-I629 HydrophobicContact CD1-CG1 3.84Å; L588-I629 HydrophobicContact CD2-CG1 3.88Å; L588-I632 HydrophobicContact CB-CD1 3.9Å; L588-I632 HydrophobicContact CD2-CD1 3.95Å; L588-I632 HydrophobicContact CG-CD1 4.5Å; L588-I632 VanDerWaalsContact O-CD1 3.29Å; L588-I632 WeakPolarHBondContact O-CD1 3.4Å
589	D	96.4	Very high	94.7	Very high	50 Å²	50	29.1 Å²	29.1	27%	0.267	16%	0.157	S	C	.	.	H	α-helix	trans	-62	-44.1	173	-178.4	75.6	0	0	0	111.7	S542 F585 T587 I591 W592 C593	S542-D589 WeakPolarHBondContact CB-OD2 3.36Å; S542-D589 PolarHBondContact OG-OD2 3.15Å; F585-D589 VanDerWaalsContact O-CB 3.3Å; F585-D589 WeakPolarHBondContact O-CB 3.18Å; F585-D589 PolarHBondContact O-N 3.41Å; T587-D589 VanDerWaalsContact C-N 3.33Å; D589-I591 VanDerWaalsContact C-N 3.34Å; D589-I591 PolarHBondContact O-N 3.17Å; D589-W592 WeakPolarHBondContact O-CA 3.4Å; D589-W592 WeakPolarHBondContact O-CB 3.35Å; D589-W592 PolarHBondContact O-N 3.21Å; D589-W592 VanDerWaalsContact O-N 3.08Å; D589-C593 PolarHBondContact O-N 3.37Å; D589-C593 PolarHBondContact O-SG 3.29Å
590	S	97.2	Very high	95	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-66.7	-31	174.1	-63.2	0	0	0	0	113.5	L538 S542 S586 T587 W592 C594	L538-S590 WeakPolarHBondContact CB-OG 3.32Å; L538-S590 PolarHBondContact O-OG 3.44Å; S542-S590 WeakPolarHBondContact OG-CA 3.36Å; S542-S590 PolarHBondContact OG-N 3.33Å; S542-S590 PolarHBondContact OG-OG 3.48Å; S586-S590 WeakPolarHBondContact O-CB 3.15Å; S586-S590 PolarHBondContact O-N 3.46Å; S586-S590 PolarHBondContact O-OG 2.81Å; T587-S590 PolarHBondContact O-N 2.9Å; S590-W592 VanDerWaalsContact C-N 3.29Å; S590-C594 WeakPolarHBondContact O-CA 3.49Å; S590-C594 WeakPolarHBondContact O-CB 3.36Å; S590-C594 PolarHBondContact O-N 3.42Å
591	I	97.8	Very high	95.3	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	17%	0.166	C	C	.	.	I	π-helix	trans	-60.4	-46.1	169.7	-70.2	160.4	0	0	0	109.5	I563 M567 T587 L588 D589 I595 L596 F605 I632 F636	I563-I591 HydrophobicContact CG2-CD1 3.82Å; I563-I591 HydrophobicContact CG2-CG1 3.49Å; I563-I591 VanDerWaalsContact CG2-CG1 3.49Å; M567-I591 HydrophobicContact CE-CD1 4.27Å; M567-I591 HydrophobicContact SD-CD1 3.74Å; T587-I591 HydrophobicContact CG2-CD1 4.49Å; T587-I591 WeakPolarHBondContact O-CG1 3.37Å; T587-I591 PolarHBondContact O-N 3.3Å; L588-I591 HydrophobicContact CD2-CD1 4.17Å; L588-I591 WeakPolarHBondContact O-CB 3.42Å; L588-I591 PolarHBondContact O-N 2.87Å; D589-I591 VanDerWaalsContact C-N 3.34Å; D589-I591 PolarHBondContact O-N 3.17Å; I591-I595 HydrophobicContact CG1-CD1 4.17Å; I591-I595 WeakPolarHBondContact O-CB 3.3Å; I591-I595 PolarHBondContact O-N 2.71Å; I591-L596 PolarHBondContact O-N 2.91Å; I591-L596 VanDerWaalsContact O-N 3.1Å; I591-F605 HydrophobicContact CD1-CE2 4.48Å; I591-F605 HydrophobicContact CD1-CZ 4.28Å; I591-F605 HydrophobicContact CG1-CE2 4.48Å; I591-I632 HydrophobicContact CB-CD1 4.44Å; I591-I632 HydrophobicContact CG2-CD1 4.41Å; I591-I632 HydrophobicContact CG2-CG2 3.69Å; I591-F636 HydrophobicContact CG2-CE2 3.6Å; I591-F636 HydrophobicContact CG2-CZ 4.09Å
592	W	96.1	Very high	95.6	Very high	78 Å²	78	28.2 Å²	28.2	30%	0.295	15%	0.153	S	C	.	.	I	π-helix	trans	-62.3	-52.4	178.9	-163.8	-65.6	0	0	0	112	L588 D589 S590 L596 L628 I632 E635	L588-W592 PolarHBondContact O-N 3.27Å; L588-W592 VanDerWaalsContact O-N 3.1Å; D589-W592 WeakPolarHBondContact O-CA 3.4Å; D589-W592 WeakPolarHBondContact O-CB 3.35Å; D589-W592 PolarHBondContact O-N 3.21Å; D589-W592 VanDerWaalsContact O-N 3.08Å; S590-W592 VanDerWaalsContact C-N 3.29Å; W592-L596 HydrophobicContact CB-CD1 4.43Å; W592-L596 HydrophobicContact CD2-CD1 4.26Å; W592-L596 HydrophobicContact CG-CD1 4.22Å; W592-L596 WeakPolarHBondContact O-CB 3.34Å; W592-L628 HydrophobicContact CE3-CD1 4.06Å; W592-L628 HydrophobicContact CZ3-CD1 4.34Å; W592-I632 HydrophobicContact CD2-CG1 4.38Å; W592-I632 HydrophobicContact CE3-CB 4.37Å; W592-I632 HydrophobicContact CE3-CD1 4.47Å; W592-I632 HydrophobicContact CE3-CG1 3.4Å; W592-I632 VanDerWaalsContact CE3-CG1 3.4Å; W592-I632 HydrophobicContact CZ3-CG1 3.96Å; W592-I632 VanDerWaalsContact CZ3-N 3.29Å; W592-E635 HydrophobicContact CZ2-CG 4.45Å; W592-E635 WeakPolarHBondContact CZ2-OE1 3.28Å
593	C	96.7	Very high	95.7	Very high	4 Å²	4	26 Å²	26	3%	0.027	14%	0.138	C	C	.	.	I	π-helix	trans	-81.5	-38.3	-171.1	-63.7	0	0	0	0	112.7	S542 E546 K552 D589	S542-C593 WeakPolarHBondContact O-CB 3.27Å; E546-C593 HydrophobicContact CB-CB 4.25Å; K552-C593 WeakPolarHBondContact CE-O 3.49Å; K552-C593 PolarHBondContact NZ-O 3.4Å; D589-C593 PolarHBondContact O-N 3.37Å; D589-C593 PolarHBondContact O-SG 3.29Å
594	C	97.6	Very high	95.9	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	15%	0.146	C	C	.	.	I	π-helix	trans	-97.8	-27.5	-171.9	-51.9	0	0	0	0	114.5	L541 C545 K552 F555 S590	L541-C594 VanDerWaalsContact C-SG 3.58Å; L541-C594 PolarHBondContact O-SG 3.24Å; C545-C594 HydrophobicContact CB-CB 4.16Å; K552-C594 WeakPolarHBondContact CB-O 3.47Å; K552-C594 WeakPolarHBondContact CG-O 3.2Å; F555-C594 HydrophobicContact CD1-CB 3.75Å; F555-C594 HydrophobicContact CD2-CB 4.09Å; F555-C594 HydrophobicContact CE1-CB 3.82Å; F555-C594 HydrophobicContact CE2-CB 4.17Å; F555-C594 HydrophobicContact CG-CB 3.87Å; F555-C594 HydrophobicContact CZ-CB 4.02Å; S590-C594 WeakPolarHBondContact O-CA 3.49Å; S590-C594 WeakPolarHBondContact O-CB 3.36Å; S590-C594 PolarHBondContact O-N 3.42Å
595	I	96.9	Very high	96.1	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	14%	0.143	C	C	.	.	I	π-helix	trans	-105	-51.5	-173.2	-57.6	178.2	0	0	0	111.5	F555 V560 I563 I591 C598 E602 F605 F636	F555-I595 HydrophobicContact CE1-CD1 4.44Å; F555-I595 HydrophobicContact CE1-CG1 4Å; V560-I595 HydrophobicContact CG2-CD1 3.98Å; V560-I595 HydrophobicContact CG2-CG1 4.14Å; I563-I595 HydrophobicContact CG1-CD1 4.35Å; I563-I595 HydrophobicContact CG2-CD1 4.29Å; I591-I595 HydrophobicContact CG1-CD1 4.17Å; I591-I595 WeakPolarHBondContact O-CB 3.3Å; I591-I595 PolarHBondContact O-N 2.71Å; I595-C598 WeakPolarHBondContact O-CB 3.47Å; I595-C598 PolarHBondContact O-N 3.44Å; I595-C598 VanDerWaalsContact O-N 3.12Å; I595-E602 HydrophobicContact CG2-CG 4.23Å; I595-F605 HydrophobicContact CD1-CD2 3.97Å; I595-F605 HydrophobicContact CD1-CE2 4.41Å; I595-F605 HydrophobicContact CG2-CB 4.25Å; I595-F636 HydrophobicContact CG2-CE1 4.43Å; I595-F636 HydrophobicContact CG2-CZ 4.04Å
596	L	95.3	Very high	96.2	Very high	3 Å²	3	23.6 Å²	23.6	2%	0.016	13%	0.126	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.6	140.2	-175.9	-69.1	177.2	0	0	0	112.2	K552 I591 W592 C598 E602 I632 E635 F636	K552-L596 PolarHBondContact NZ-O 3.26Å; I591-L596 PolarHBondContact O-N 2.91Å; I591-L596 VanDerWaalsContact O-N 3.1Å; W592-L596 HydrophobicContact CB-CD1 4.43Å; W592-L596 HydrophobicContact CD2-CD1 4.26Å; W592-L596 HydrophobicContact CG-CD1 4.22Å; W592-L596 WeakPolarHBondContact O-CB 3.34Å; L596-C598 PolarHBondContact O-N 2.81Å; L596-E602 WeakPolarHBondContact CA-OE1 3.39Å; L596-I632 HydrophobicContact CD1-CG2 4.37Å; L596-E635 HydrophobicContact CD1-CB 3.78Å; L596-E635 HydrophobicContact CD1-CG 4.49Å; L596-E635 WeakPolarHBondContact CD1-OE2 3.35Å; L596-E635 HydrophobicContact CD2-CB 4.23Å; L596-F636 HydrophobicContact CD2-CB 4.23Å; L596-F636 HydrophobicContact CD2-CD1 3.73Å; L596-F636 HydrophobicContact CD2-CD2 3.41Å; L596-F636 VanDerWaalsContact CD2-CD2 3.41Å; L596-F636 HydrophobicContact CD2-CE1 3.85Å; L596-F636 HydrophobicContact CD2-CE2 3.53Å; L596-F636 HydrophobicContact CD2-CG 3.5Å; L596-F636 VanDerWaalsContact CD2-CG 3.5Å; L596-F636 HydrophobicContact CD2-CZ 3.74Å; L596-F636 HydrophobicContact CG-CD2 4.45Å; L596-F636 HydrophobicContact CG-CE2 4.26Å
597	G	92	Very high	96.2	Very high	51 Å²	51	29.9 Å²	29.9	53%	0.526	16%	0.155	S	C	.	.	T	Hydrogen-bonded Turn	trans	79.4	-7.2	-175.8	0	0	0	0	0	114.5	I549 E602	I549-G597 WeakPolarHBondContact CD1-O 3.25Å; G597-E602 PolarHBondContact N-OE1 3.04Å
598	C	95.2	Very high	96.2	Very high	2 Å²	2	34.5 Å²	34.5	1%	0.014	18%	0.175	C	C	.	.			trans	-105.1	91.9	172.4	-175.3	0	0	0	0	110.1	I549 K552 I595 L596 S600 S601 E602	I549-C598 HydrophobicContact CD1-CB 3.69Å; K552-C598 HydrophobicContact CB-CB 3.81Å; K552-C598 HydrophobicContact CD-CB 4.1Å; I595-C598 WeakPolarHBondContact O-CB 3.47Å; I595-C598 PolarHBondContact O-N 3.44Å; I595-C598 VanDerWaalsContact O-N 3.12Å; L596-C598 PolarHBondContact O-N 2.81Å; C598-S600 PolarHBondContact O-N 3.34Å; C598-S600 VanDerWaalsContact O-N 3.08Å; C598-S600 PolarHBondContact SG-OG 3.22Å; C598-S600 VanDerWaalsContact SG-OG 3.37Å; C598-S601 PolarHBondContact O-N 2.91Å; C598-E602 PolarHBondContact O-N 3.41Å
599	Y	93.1	Very high	96.1	Very high	141 Å²	141	40.2 Å²	40.2	55%	0.553	20%	0.202	S	C	*	.	H	α-helix	trans	-53	-35.7	-172.4	-73.7	-64.7	0	0	0	114.3	D603 N639	Y599-D603 WeakPolarHBondContact O-CB 3.39Å; Y599-D603 PolarHBondContact O-N 3.49Å; Y599-N639 HydrophobicContact CE1-CB 4.45Å
600	S	94.4	Very high	96.1	Very high	74 Å²	74	37.9 Å²	37.9	52%	0.517	19%	0.19	S	C	.	.	H	α-helix	trans	-65	-40.6	176.1	50.2	0	0	0	0	112.8	C598 Y604	C598-S600 PolarHBondContact O-N 3.34Å; C598-S600 VanDerWaalsContact O-N 3.08Å; C598-S600 PolarHBondContact SG-OG 3.22Å; C598-S600 VanDerWaalsContact SG-OG 3.37Å; S600-Y604 WeakPolarHBondContact O-CB 3.37Å; S600-Y604 PolarHBondContact O-N 3.37Å; S600-Y604 VanDerWaalsContact O-N 3.17Å
601	S	96.1	Very high	96	Very high	3 Å²	3	38 Å²	38	2%	0.021	19%	0.19	C	C	.	.	H	α-helix	trans	-75.3	-38.5	178.4	-63.1	0	0	0	0	111.3	C598 F605	C598-S601 PolarHBondContact O-N 2.91Å; S601-F605 VanDerWaalsContact O-CB 3.31Å; S601-F605 WeakPolarHBondContact O-CB 3.48Å; S601-F605 PolarHBondContact O-N 3.45Å
602	E	96.6	Very high	95.9	Very high	7 Å²	7	40.2 Å²	40.2	3%	0.033	20%	0.2	C	C	.	.	H	α-helix	trans	-61.2	-49.1	173.2	-68.4	-177.7	175.9	0	0	111.7	I595 L596 G597 C598 Y604 F605 L606 F636 N639	I595-E602 HydrophobicContact CG2-CG 4.23Å; L596-E602 WeakPolarHBondContact CA-OE1 3.39Å; G597-E602 PolarHBondContact N-OE1 3.04Å; C598-E602 PolarHBondContact O-N 3.41Å; E602-Y604 VanDerWaalsContact C-N 3.32Å; E602-Y604 PolarHBondContact O-N 2.83Å; E602-F605 WeakPolarHBondContact O-CB 3.44Å; E602-F605 PolarHBondContact O-N 3.21Å; E602-F605 VanDerWaalsContact O-N 3.15Å; E602-L606 VanDerWaalsContact O-CG 3.29Å; E602-L606 WeakPolarHBondContact O-CG 3.5Å; E602-L606 PolarHBondContact O-N 3.16Å; E602-F636 HydrophobicContact CB-CE1 4.02Å; E602-F636 HydrophobicContact CG-CD1 4.31Å; E602-F636 HydrophobicContact CG-CE1 3.82Å; E602-N639 WeakPolarHBondContact OE2-CB 3.34Å; E602-N639 PolarHBondContact OE2-ND2 2.92Å
603	D	96.2	Very high	95.9	Very high	36 Å²	36	37.9 Å²	37.9	19%	0.193	19%	0.193	C	C	.	.	H	α-helix	trans	-59.3	-45.5	179.4	-77.1	-10.4	0	0	0	110.8	Y599 F605 L606 E607 N639 K641	Y599-D603 WeakPolarHBondContact O-CB 3.39Å; Y599-D603 PolarHBondContact O-N 3.49Å; D603-F605 PolarHBondContact O-N 3.44Å; D603-L606 PolarHBondContact O-N 3.03Å; D603-E607 WeakPolarHBondContact O-CB 3.39Å; D603-E607 VanDerWaalsContact O-CG 3.3Å; D603-E607 WeakPolarHBondContact O-CG 3.49Å; D603-E607 PolarHBondContact O-N 2.87Å; D603-N639 PolarHBondContact OD1-ND2 3.45Å; D603-N639 VanDerWaalsContact OD1-ND2 3.11Å; D603-K641 WeakPolarHBondContact OD1-CD 3.3Å; D603-K641 IonicContact OD1-NZ 3.9Å; D603-K641 PolarHBondContact OD1-NZ 3.12Å; D603-K641 IonicContact OD2-NZ 2.64Å; D603-K641 PolarHBondContact OD2-NZ 3.41Å
604	Y	97.8	Very high	95.8	Very high	43 Å²	43	37.7 Å²	37.7	17%	0.169	19%	0.192	C	C	.	.	H	α-helix	trans	-64.4	-39.8	176	-175.3	-104	0	0	0	112.2	T557 V560 D561 S600 E602 L606 E607 K608	T557-Y604 HydrophobicContact CG2-CD1 3.87Å; T557-Y604 HydrophobicContact CG2-CD2 3.89Å; T557-Y604 HydrophobicContact CG2-CE1 4.07Å; T557-Y604 HydrophobicContact CG2-CE2 4.07Å; T557-Y604 HydrophobicContact CG2-CG 3.79Å; V560-Y604 HydrophobicContact CB-CD1 3.72Å; V560-Y604 HydrophobicContact CB-CE1 4.03Å; V560-Y604 HydrophobicContact CG1-CD1 3.57Å; V560-Y604 HydrophobicContact CG1-CE1 3.96Å; V560-Y604 HydrophobicContact CG2-CD1 4.27Å; D561-Y604 WeakPolarHBondContact OD1-CE1 3.35Å; D561-Y604 PolarHBondContact OD1-OH 2.75Å; D561-Y604 PolarHBondContact OD2-OH 2.89Å; S600-Y604 WeakPolarHBondContact O-CB 3.37Å; S600-Y604 PolarHBondContact O-N 3.37Å; S600-Y604 VanDerWaalsContact O-N 3.17Å; E602-Y604 VanDerWaalsContact C-N 3.32Å; E602-Y604 PolarHBondContact O-N 2.83Å; Y604-L606 VanDerWaalsContact C-N 3.34Å; Y604-L606 PolarHBondContact O-N 3.08Å; Y604-E607 PolarHBondContact O-N 3.43Å; Y604-K608 HydrophobicContact CD1-CG 4.4Å; Y604-K608 HydrophobicContact CD2-CG 4.48Å; Y604-K608 HydrophobicContact CE1-CG 4.06Å; Y604-K608 HydrophobicContact CE2-CD 4.49Å; Y604-K608 VanDerWaalsContact CE2-CE 3.42Å; Y604-K608 HydrophobicContact CE2-CG 4.16Å; Y604-K608 VanDerWaalsContact CZ-CE 3.43Å; Y604-K608 WeakPolarHBondContact O-CB 3.38Å; Y604-K608 VanDerWaalsContact O-CG 3.28Å; Y604-K608 WeakPolarHBondContact O-CG 3.41Å; Y604-K608 PolarHBondContact O-N 3.13Å; Y604-K608 VanDerWaalsContact OH-CE 3.23Å; Y604-K608 WeakPolarHBondContact OH-CE 3.22Å
605	F	97.9	Very high	95.8	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-61.8	-41.1	174.4	-177.3	-98.4	0	0	0	111.8	V560 I563 L564 M567 I591 I595 S601 E602 D603 K608 G610 I611 F636	V560-F605 HydrophobicContact CG1-CB 3.97Å; V560-F605 HydrophobicContact CG1-CD2 3.94Å; V560-F605 HydrophobicContact CG1-CG 4.47Å; I563-F605 HydrophobicContact CG2-CE2 4.12Å; L564-F605 HydrophobicContact CD2-CD2 3.89Å; L564-F605 HydrophobicContact CD2-CE2 3.77Å; L564-F605 HydrophobicContact CG-CD2 4.3Å; L564-F605 HydrophobicContact CG-CE2 4.4Å; M567-F605 HydrophobicContact CE-CZ 4.22Å; M567-F605 HydrophobicContact SD-CE2 3.93Å; M567-F605 HydrophobicContact SD-CZ 3.95Å; I591-F605 HydrophobicContact CD1-CE2 4.48Å; I591-F605 HydrophobicContact CD1-CZ 4.28Å; I591-F605 HydrophobicContact CG1-CE2 4.48Å; I595-F605 HydrophobicContact CD1-CD2 3.97Å; I595-F605 HydrophobicContact CD1-CE2 4.41Å; I595-F605 HydrophobicContact CG2-CB 4.25Å; S601-F605 VanDerWaalsContact O-CB 3.31Å; S601-F605 WeakPolarHBondContact O-CB 3.48Å; S601-F605 PolarHBondContact O-N 3.45Å; E602-F605 WeakPolarHBondContact O-CB 3.44Å; E602-F605 PolarHBondContact O-N 3.21Å; E602-F605 VanDerWaalsContact O-N 3.15Å; D603-F605 PolarHBondContact O-N 3.44Å; F605-K608 PolarHBondContact O-N 3.31Å; F605-G610 VanDerWaalsContact CE1-CA 3.48Å; F605-G610 VanDerWaalsContact CZ-CA 3.4Å; F605-G610 WeakPolarHBondContact CZ-O 3.33Å; F605-G610 WeakPolarHBondContact O-CA 3.23Å; F605-G610 PolarHBondContact O-N 2.91Å; F605-I611 HydrophobicContact CE1-CD1 4.37Å; F605-I611 HydrophobicContact CE1-CG1 4.3Å; F605-F636 AromaticContact CD1-CE1 3.98Å; F605-F636 HydrophobicContact CD1-CE1 3.98Å; F605-F636 HydrophobicContact CD1-CE2 4.23Å; F605-F636 AromaticContact CD1-CZ 3.52Å; F605-F636 HydrophobicContact CD1-CZ 3.52Å; F605-F636 AromaticContact CE1-CE2 4Å; F605-F636 HydrophobicContact CE1-CE2 4Å; F605-F636 AromaticContact CE1-CZ 3.76Å; F605-F636 HydrophobicContact CE1-CZ 3.76Å; F605-F636 HydrophobicContact CG-CZ 4.28Å
606	L	96.8	Very high	95.6	Very high	1 Å²	1	41.2 Å²	41.2	1%	0.005	21%	0.211	C	C	.	.	H	α-helix	trans	-65.2	-46.9	175.4	-69.5	173.7	0	0	0	112	E602 D603 Y604 K608 E609 I611 K641 H645	E602-L606 VanDerWaalsContact O-CG 3.29Å; E602-L606 WeakPolarHBondContact O-CG 3.5Å; E602-L606 PolarHBondContact O-N 3.16Å; D603-L606 PolarHBondContact O-N 3.03Å; Y604-L606 VanDerWaalsContact C-N 3.34Å; Y604-L606 PolarHBondContact O-N 3.08Å; L606-K608 PolarHBondContact O-N 3.39Å; L606-E609 PolarHBondContact O-N 2.83Å; L606-E609 VanDerWaalsContact O-N 3.08Å; L606-I611 HydrophobicContact CD2-CB 4.19Å; L606-I611 HydrophobicContact CD2-CG1 3.37Å; L606-K641 HydrophobicContact CD1-CB 3.89Å; L606-H645 HydrophobicContact CD2-CB 4.26Å; L606-H645 PolarHBondContact O-CE1 3.46Å; L606-H645 VanDerWaalsContact O-CE1 3.23Å; L606-H645 PolarHBondContact O-ND1 3.4Å
607	E	96.1	Very high	95.5	Very high	134 Å²	134	41.9 Å²	41.9	63%	0.626	21%	0.214	S	C	*	.	H	α-helix	trans	-59.5	-31.4	177.4	-76.2	177.7	-174.8	0	0	112.6	D603 Y604 E609	D603-E607 WeakPolarHBondContact O-CB 3.39Å; D603-E607 VanDerWaalsContact O-CG 3.3Å; D603-E607 WeakPolarHBondContact O-CG 3.49Å; D603-E607 PolarHBondContact O-N 2.87Å; Y604-E607 PolarHBondContact O-N 3.43Å; E607-E609 VanDerWaalsContact C-N 3.3Å; E607-E609 PolarHBondContact O-N 3.03Å
608	K	96.6	Very high	95.7	Very high	97 Å²	97	39.5 Å²	39.5	42%	0.422	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92	19.8	177.9	-63	-65.6	-177	175	0	114.2	L564 Y604 F605 L606 G610	L564-K608 HydrophobicContact CD1-CB 3.41Å; L564-K608 VanDerWaalsContact CD1-CB 3.41Å; L564-K608 HydrophobicContact CD1-CG 4.01Å; Y604-K608 HydrophobicContact CD1-CG 4.4Å; Y604-K608 HydrophobicContact CD2-CG 4.48Å; Y604-K608 HydrophobicContact CE1-CG 4.06Å; Y604-K608 HydrophobicContact CE2-CD 4.49Å; Y604-K608 VanDerWaalsContact CE2-CE 3.42Å; Y604-K608 HydrophobicContact CE2-CG 4.16Å; Y604-K608 VanDerWaalsContact CZ-CE 3.43Å; Y604-K608 WeakPolarHBondContact O-CB 3.38Å; Y604-K608 VanDerWaalsContact O-CG 3.28Å; Y604-K608 WeakPolarHBondContact O-CG 3.41Å; Y604-K608 PolarHBondContact O-N 3.13Å; Y604-K608 VanDerWaalsContact OH-CE 3.23Å; Y604-K608 WeakPolarHBondContact OH-CE 3.22Å; F605-K608 PolarHBondContact O-N 3.31Å; L606-K608 PolarHBondContact O-N 3.39Å; K608-G610 PolarHBondContact O-N 2.96Å
609	E	94.8	Very high	95.6	Very high	121 Å²	121	41.2 Å²	41.2	57%	0.565	20%	0.203	S	C	*	.	T	Hydrogen-bonded Turn	trans	62	24.6	177.4	-52.5	178.4	162.1	0	0	113.5	L606 E607 I611 F612 L613	L606-E609 PolarHBondContact O-N 2.83Å; L606-E609 VanDerWaalsContact O-N 3.08Å; E607-E609 VanDerWaalsContact C-N 3.3Å; E607-E609 PolarHBondContact O-N 3.03Å; E609-I611 VanDerWaalsContact C-N 3.32Å; E609-I611 PolarHBondContact O-N 3.39Å; E609-F612 HydrophobicContact CB-CB 4.19Å; E609-F612 HydrophobicContact CB-CD2 4.42Å; E609-F612 HydrophobicContact CB-CG 4.21Å; E609-F612 WeakPolarHBondContact O-CA 3.46Å; E609-F612 VanDerWaalsContact O-CB 3.31Å; E609-F612 WeakPolarHBondContact O-CB 3.49Å; E609-F612 PolarHBondContact O-N 3.2Å; E609-L613 PolarHBondContact O-N 3Å
610	G	96.1	Very high	95.4	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-59.2	-40	-177.9	0	0	0	0	0	113.5	L564 F605 K608 F612 L613 L614	L564-G610 VanDerWaalsContact CD2-CA 3.49Å; F605-G610 VanDerWaalsContact CE1-CA 3.48Å; F605-G610 VanDerWaalsContact CZ-CA 3.4Å; F605-G610 WeakPolarHBondContact CZ-O 3.33Å; F605-G610 WeakPolarHBondContact O-CA 3.23Å; F605-G610 PolarHBondContact O-N 2.91Å; K608-G610 PolarHBondContact O-N 2.96Å; G610-F612 PolarHBondContact O-N 3.13Å; G610-L613 PolarHBondContact O-N 3.16Å; G610-L614 PolarHBondContact O-N 3.03Å
611	I	95.9	Very high	95	Very high	2 Å²	2	37.5 Å²	37.5	1%	0.01	18%	0.184	C	C	.	.	H	α-helix	trans	-62.4	-31.3	173.5	-76.4	-64.5	0	0	0	112.2	F605 L606 E609 L614 L615 F636 V646	F605-I611 HydrophobicContact CE1-CD1 4.37Å; F605-I611 HydrophobicContact CE1-CG1 4.3Å; L606-I611 HydrophobicContact CD2-CB 4.19Å; L606-I611 HydrophobicContact CD2-CG1 3.37Å; E609-I611 VanDerWaalsContact C-N 3.32Å; E609-I611 PolarHBondContact O-N 3.39Å; I611-L614 HydrophobicContact CD1-CD2 4.14Å; I611-L614 PolarHBondContact O-N 3.14Å; I611-L615 HydrophobicContact CG2-CD1 3.98Å; I611-L615 HydrophobicContact CG2-CG 4.46Å; I611-L615 WeakPolarHBondContact O-CB 3.38Å; I611-L615 WeakPolarHBondContact O-CG 3.4Å; I611-L615 PolarHBondContact O-N 3.4Å; I611-F636 HydrophobicContact CD1-CB 4.25Å; I611-F636 HydrophobicContact CD1-CD2 3.86Å; I611-F636 HydrophobicContact CD1-CE2 4.34Å; I611-F636 HydrophobicContact CD1-CG 3.98Å; I611-V646 HydrophobicContact CG2-CG2 3.73Å
612	F	96	Very high	94.5	Very high	48 Å²	48	40 Å²	40	21%	0.211	20%	0.195	C	C	.	.	H	α-helix	trans	-70.2	-42.8	-179.6	-70.5	29.6	0	0	0	109.5	E609 G610 L614 L615 D616 H645 A648 W649	E609-F612 HydrophobicContact CB-CB 4.19Å; E609-F612 HydrophobicContact CB-CD2 4.42Å; E609-F612 HydrophobicContact CB-CG 4.21Å; E609-F612 WeakPolarHBondContact O-CA 3.46Å; E609-F612 VanDerWaalsContact O-CB 3.31Å; E609-F612 WeakPolarHBondContact O-CB 3.49Å; E609-F612 PolarHBondContact O-N 3.2Å; G610-F612 PolarHBondContact O-N 3.13Å; F612-L614 VanDerWaalsContact C-N 3.32Å; F612-L614 PolarHBondContact O-N 3.39Å; F612-L615 PolarHBondContact O-N 3.05Å; F612-D616 VanDerWaalsContact O-CG 3.25Å; F612-D616 PolarHBondContact O-N 2.96Å; F612-H645 HydrophobicContact CE1-CB 4.06Å; F612-H645 WeakPolarHBondContact CE1-O 3.42Å; F612-A648 HydrophobicContact CZ-CB 3.96Å; F612-W649 HydrophobicContact CD1-CB 4.29Å; F612-W649 HydrophobicContact CE1-CB 4.39Å; F612-W649 HydrophobicContact CG-CB 4.44Å; F612-W649 AromaticContact CG-CD1 3.78Å; F612-W649 PolarHBondContact O-NE1 3.41Å
613	L	95.6	Very high	93.8	Very high	28 Å²	28	45.9 Å²	45.9	15%	0.147	22%	0.22	C	C	.	.	H	α-helix	trans	-62	-40.2	173.6	-61.8	171.4	0	0	0	111.6	L564 M567 K568 E609 G610 L615 D616 I617	L564-L613 HydrophobicContact CD2-CD1 3.9Å; M567-L613 HydrophobicContact CB-CB 4.05Å; M567-L613 HydrophobicContact CB-CD1 3.99Å; M567-L613 HydrophobicContact CE-CB 3.72Å; K568-L613 HydrophobicContact CG-CD1 3.84Å; K568-L613 HydrophobicContact CG-CD2 3.93Å; E609-L613 PolarHBondContact O-N 3Å; G610-L613 PolarHBondContact O-N 3.16Å; L613-L615 PolarHBondContact O-N 3.31Å; L613-D616 PolarHBondContact O-N 2.74Å; L613-I617 VanDerWaalsContact O-CG1 3.29Å; L613-I617 WeakPolarHBondContact O-CG1 3.37Å; L613-I617 PolarHBondContact O-N 2.92Å
614	L	95.8	Very high	93.2	Very high	1 Å²	1	52.1 Å²	52.1	1%	0.005	25%	0.246	C	C	.	.	H	α-helix	trans	-62.1	-43.9	177.2	-169.2	66.4	0	0	0	111.6	M567 L588 G610 I611 F612 I617 L618 I629 I632 M633	M567-L614 HydrophobicContact CE-CB 3.81Å; M567-L614 HydrophobicContact CE-CD1 4.06Å; M567-L614 VanDerWaalsContact CE-N 3.33Å; L588-L614 HydrophobicContact CD2-CD1 3.58Å; G610-L614 PolarHBondContact O-N 3.03Å; I611-L614 HydrophobicContact CD1-CD2 4.14Å; I611-L614 PolarHBondContact O-N 3.14Å; F612-L614 VanDerWaalsContact C-N 3.32Å; F612-L614 PolarHBondContact O-N 3.39Å; L614-I617 PolarHBondContact O-N 3Å; L614-L618 WeakPolarHBondContact O-CB 3.41Å; L614-L618 PolarHBondContact O-N 3.46Å; L614-I629 HydrophobicContact CD1-CB 4.29Å; L614-I629 HydrophobicContact CD1-CG1 3.91Å; L614-I629 HydrophobicContact CD1-CG2 3.72Å; L614-I629 HydrophobicContact CD2-CG2 4.13Å; L614-I629 HydrophobicContact CG-CG2 3.61Å; L614-I632 HydrophobicContact CD2-CB 4.44Å; L614-I632 HydrophobicContact CD2-CG2 3.78Å; L614-M633 HydrophobicContact CD2-CG 3.89Å
615	L	95.7	Very high	92.8	Very high	0 Å²	0	50.2 Å²	50.2	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-67.3	-35.4	175.5	-73.3	170.1	0	0	0	112.5	I611 F612 L613 L618 A619 M633 V646 W649 A657	I611-L615 HydrophobicContact CG2-CD1 3.98Å; I611-L615 HydrophobicContact CG2-CG 4.46Å; I611-L615 WeakPolarHBondContact O-CB 3.38Å; I611-L615 WeakPolarHBondContact O-CG 3.4Å; I611-L615 PolarHBondContact O-N 3.4Å; F612-L615 PolarHBondContact O-N 3.05Å; L613-L615 PolarHBondContact O-N 3.31Å; L615-L618 HydrophobicContact CD2-CD2 4.25Å; L615-L618 PolarHBondContact O-N 2.86Å; L615-A619 WeakPolarHBondContact O-CB 3.3Å; L615-A619 PolarHBondContact O-N 3.35Å; L615-M633 HydrophobicContact CD2-CE 3.62Å; L615-M633 HydrophobicContact CD2-SD 3.85Å; L615-M633 HydrophobicContact CG-CE 4.47Å; L615-V646 HydrophobicContact CD1-CG1 4.43Å; L615-W649 HydrophobicContact CB-CD2 3.77Å; L615-W649 HydrophobicContact CB-CE3 4.37Å; L615-W649 HydrophobicContact CB-CG 4.03Å; L615-W649 HydrophobicContact CB-CZ2 3.95Å; L615-W649 HydrophobicContact CD1-CB 3.58Å; L615-W649 HydrophobicContact CD1-CD2 3.75Å; L615-W649 HydrophobicContact CD1-CE3 4.16Å; L615-W649 HydrophobicContact CD1-CG 3.5Å; L615-W649 VanDerWaalsContact CD1-CG 3.5Å; L615-W649 HydrophobicContact CG-CD2 4.36Å; L615-W649 HydrophobicContact CG-CG 4.42Å; L615-A657 HydrophobicContact CD1-CB 4.08Å; L615-A657 HydrophobicContact CD2-CB 4.3Å
616	D	94.1	Very high	92.5	Very high	74 Å²	74	50.6 Å²	50.6	40%	0.396	24%	0.241	S	C	.	.	H	α-helix	trans	-63.7	-41.1	174.1	-74.1	-19.2	0	0	0	111.7	F612 L613 A619 W649	F612-D616 VanDerWaalsContact O-CG 3.25Å; F612-D616 PolarHBondContact O-N 2.96Å; L613-D616 PolarHBondContact O-N 2.74Å; D616-A619 WeakPolarHBondContact O-CB 3.41Å; D616-A619 PolarHBondContact O-N 2.85Å; D616-W649 WeakPolarHBondContact OD1-CZ2 3.38Å; D616-W649 PolarHBondContact OD1-NE1 3.14Å
617	I	93.2	Very high	92.1	Very high	17 Å²	17	53.8 Å²	53.8	9%	0.087	26%	0.258	C	S	.	.	H	α-helix	trans	-66.9	-43.4	174.1	-62.7	162.1	0	0	0	110.1	M567 L584 L613 L614 A619 L620 I629	M567-I617 HydrophobicContact CB-CD1 4.29Å; M567-I617 HydrophobicContact CE-CD1 3.96Å; M567-I617 HydrophobicContact CG-CD1 4.26Å; L584-I617 HydrophobicContact CD1-CD1 4.04Å; L584-I617 HydrophobicContact CD2-CG2 4.1Å; L613-I617 VanDerWaalsContact O-CG1 3.29Å; L613-I617 WeakPolarHBondContact O-CG1 3.37Å; L613-I617 PolarHBondContact O-N 2.92Å; L614-I617 PolarHBondContact O-N 3Å; I617-A619 PolarHBondContact O-N 3.45Å; I617-L620 HydrophobicContact CG2-CD1 4.43Å; I617-L620 WeakPolarHBondContact O-CB 3.16Å; I617-L620 WeakPolarHBondContact O-CG 3.42Å; I617-L620 PolarHBondContact O-N 3.34Å; I617-I629 HydrophobicContact CB-CD1 4.21Å; I617-I629 HydrophobicContact CG2-CD1 3.61Å
618	L	94.8	Very high	92	Very high	1 Å²	1	49.6 Å²	49.6	1%	0.005	24%	0.239	C	C	.	.	H	α-helix	trans	-59.6	-36.5	175.2	-174.2	62.9	0	0	0	111.8	L614 L615 L620 K621 C626 I629 L630 M633 L660 L661 L664	L614-L618 WeakPolarHBondContact O-CB 3.41Å; L614-L618 PolarHBondContact O-N 3.46Å; L615-L618 HydrophobicContact CD2-CD2 4.25Å; L615-L618 PolarHBondContact O-N 2.86Å; L618-L620 PolarHBondContact O-N 3.47Å; L618-K621 PolarHBondContact O-N 3.27Å; L618-C626 HydrophobicContact CD1-CB 4.22Å; L618-I629 HydrophobicContact CB-CG2 4.02Å; L618-I629 HydrophobicContact CD1-CB 4.31Å; L618-I629 HydrophobicContact CD1-CG2 4.06Å; L618-I629 HydrophobicContact CD2-CG2 4.34Å; L618-I629 HydrophobicContact CG-CG2 4.35Å; L618-L630 HydrophobicContact CD1-CG 4.24Å; L618-L630 HydrophobicContact CD2-CD2 3.96Å; L618-M633 HydrophobicContact CD2-SD 3.94Å; L618-L660 HydrophobicContact CB-CD2 4.39Å; L618-L660 HydrophobicContact CD2-CD2 4.17Å; L618-L660 HydrophobicContact CG-CD2 4.21Å; L618-L661 HydrophobicContact CD2-CD2 4.23Å; L618-L664 HydrophobicContact CD1-CD1 3.78Å; L618-L664 HydrophobicContact CD2-CD1 4.01Å; L618-L664 HydrophobicContact CG-CD1 3.78Å
619	A	93.6	Very high	91.9	Very high	37 Å²	37	45 Å²	45	31%	0.306	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.3	-13.5	177.6	0	0	0	0	0	113.8	L615 D616 I617 K621 W649 L660	L615-A619 WeakPolarHBondContact O-CB 3.3Å; L615-A619 PolarHBondContact O-N 3.35Å; D616-A619 WeakPolarHBondContact O-CB 3.41Å; D616-A619 PolarHBondContact O-N 2.85Å; I617-A619 PolarHBondContact O-N 3.45Å; A619-K621 PolarHBondContact O-N 3.46Å; A619-W649 HydrophobicContact CB-CH2 4.31Å; A619-W649 HydrophobicContact CB-CZ2 4.41Å; A619-L660 HydrophobicContact CB-CD1 4.28Å; A619-L660 HydrophobicContact CB-CD2 4.03Å
620	L	90.3	Very high	92	Very high	61 Å²	61	39.2 Å²	39.2	32%	0.319	19%	0.193	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.5	-16.9	168.9	-54.8	173	0	0	0	112.4	P571 L574 I617 L618 Q622	P571-L620 HydrophobicContact CB-CD1 3.71Å; P571-L620 HydrophobicContact CB-CD2 3.89Å; P571-L620 HydrophobicContact CB-CG 4.46Å; P571-L620 HydrophobicContact CG-CD1 4.09Å; P571-L620 HydrophobicContact CG-CD2 4.2Å; L574-L620 HydrophobicContact CD1-CD1 4.13Å; I617-L620 HydrophobicContact CG2-CD1 4.43Å; I617-L620 WeakPolarHBondContact O-CB 3.16Å; I617-L620 WeakPolarHBondContact O-CG 3.42Å; I617-L620 PolarHBondContact O-N 3.34Å; L618-L620 PolarHBondContact O-N 3.47Å; L620-Q622 HydrophobicContact CB-CG 4.18Å; L620-Q622 PolarHBondContact O-N 3.15Å
621	K	85.8	Confident	91.9	Very high	77 Å²	77	39.5 Å²	39.5	34%	0.335	20%	0.196	S	C	.	.			trans	56.3	33.6	176.4	-50.5	-174.3	179.9	-175.9	0	114.2	L618 A619 K623 L664 K667	L618-K621 PolarHBondContact O-N 3.27Å; A619-K621 PolarHBondContact O-N 3.46Å; K621-K623 PolarHBondContact O-N 3.46Å; K621-L664 HydrophobicContact CB-CD2 4.24Å; K621-L664 HydrophobicContact CD-CD2 4.3Å; K621-L664 HydrophobicContact CG-CD2 3.92Å; K621-K667 PolarHBondContact O-NZ 3.46Å
622	Q	84.8	Confident	91.9	Very high	56 Å²	56	39.4 Å²	39.4	26%	0.262	20%	0.195	S	C	.	.			trans	-81.5	112.2	176	-65	-172.5	10.9	0	0	110.1	L620 K624 F625 C626	L620-Q622 HydrophobicContact CB-CG 4.18Å; L620-Q622 PolarHBondContact O-N 3.15Å; Q622-K624 PolarHBondContact O-N 3.33Å; Q622-F625 HydrophobicContact CB-CD2 4Å; Q622-F625 PolarHBondContact O-N 3.08Å; Q622-F625 VanDerWaalsContact OE1-CE2 3.24Å; Q622-C626 PolarHBondContact O-N 3.2Å; Q622-C626 PolarHBondContact O-SG 2.83Å
623	K	82.4	Confident	91.9	Very high	129 Å²	129	37.2 Å²	37.2	56%	0.561	19%	0.186	S	C	*	.	H	α-helix	trans	-51	-38.1	-172.4	-170.3	167.7	-173.9	159.3	0	113.7	K621 F625 C626 E671	K621-K623 PolarHBondContact O-N 3.46Å; K623-F625 VanDerWaalsContact C-N 3.27Å; K623-F625 PolarHBondContact O-N 2.77Å; K623-C626 PolarHBondContact O-N 2.6Å; K623-E671 IonicContact NZ-OE2 3.74Å; K623-E671 PolarHBondContact NZ-OE2 2.82Å
624	K	83.6	Confident	91.9	Very high	167 Å²	167	37.8 Å²	37.8	73%	0.726	19%	0.19	S	C	*	.	H	α-helix	trans	-58.8	-32.6	-179.8	-62.3	-174	179.6	-175.8	0	113.9	F585 Q622	F585-K624 HydrophobicContact CZ-CB 4.08Å; Q622-K624 PolarHBondContact O-N 3.33Å
625	F	88.7	Confident	91.8	Very high	4 Å²	4	41.1 Å²	41.1	2%	0.018	21%	0.205	C	C	.	.	H	α-helix	trans	-102.9	-25.5	-177.2	-59.7	-65.2	0	0	0	113	N581 L584 F585 L588 Q622 K623 N627 L628 I629	N581-F625 HydrophobicContact CB-CZ 4.25Å; L584-F625 HydrophobicContact CB-CE1 4.33Å; L584-F625 HydrophobicContact CB-CZ 4.41Å; L584-F625 HydrophobicContact CD2-CD1 4.21Å; L584-F625 HydrophobicContact CD2-CD2 4.21Å; L584-F625 HydrophobicContact CD2-CE1 3.92Å; L584-F625 HydrophobicContact CD2-CE2 3.94Å; L584-F625 HydrophobicContact CD2-CG 4.35Å; L584-F625 HydrophobicContact CD2-CZ 3.8Å; L584-F625 HydrophobicContact CG-CD1 4.38Å; L584-F625 HydrophobicContact CG-CE1 4Å; L584-F625 HydrophobicContact CG-CZ 4.27Å; F585-F625 HydrophobicContact CD1-CD1 4.01Å; F585-F625 AromaticContact CD1-CE1 3.82Å; F585-F625 HydrophobicContact CD1-CE1 3.82Å; F585-F625 HydrophobicContact CD2-CD1 4.39Å; F585-F625 AromaticContact CD2-CE1 3.46Å; F585-F625 HydrophobicContact CD2-CE1 3.46Å; F585-F625 VanDerWaalsContact CD2-CE1 3.46Å; F585-F625 HydrophobicContact CD2-CZ 4.06Å; F585-F625 AromaticContact CE1-CD1 3.66Å; F585-F625 HydrophobicContact CE1-CD1 3.66Å; F585-F625 AromaticContact CE1-CE1 3.7Å; F585-F625 HydrophobicContact CE1-CE1 3.7Å; F585-F625 HydrophobicContact CE2-CD1 4.07Å; F585-F625 AromaticContact CE2-CE1 3.32Å; F585-F625 HydrophobicContact CE2-CE1 3.32Å; F585-F625 AromaticContact CE2-CZ 3.78Å; F585-F625 HydrophobicContact CE2-CZ 3.78Å; F585-F625 HydrophobicContact CG-CD1 4.35Å; F585-F625 AromaticContact CG-CE1 3.7Å; F585-F625 HydrophobicContact CG-CE1 3.7Å; F585-F625 AromaticContact CZ-CD1 3.69Å; F585-F625 HydrophobicContact CZ-CD1 3.69Å; F585-F625 AromaticContact CZ-CE1 3.46Å; F585-F625 HydrophobicContact CZ-CE1 3.46Å; F585-F625 VanDerWaalsContact CZ-CE1 3.46Å; F585-F625 HydrophobicContact CZ-CZ 4.2Å; L588-F625 HydrophobicContact CD1-CB 4.43Å; L588-F625 HydrophobicContact CD1-CD1 3.84Å; Q622-F625 HydrophobicContact CB-CD2 4Å; Q622-F625 PolarHBondContact O-N 3.08Å; Q622-F625 VanDerWaalsContact OE1-CE2 3.24Å; K623-F625 VanDerWaalsContact C-N 3.27Å; K623-F625 PolarHBondContact O-N 2.77Å; F625-N627 VanDerWaalsContact C-N 3.29Å; F625-N627 PolarHBondContact O-N 2.68Å; F625-L628 PolarHBondContact O-N 3.26Å; F625-I629 HydrophobicContact CB-CD1 3.85Å; F625-I629 HydrophobicContact CB-CG1 4.46Å; F625-I629 WeakPolarHBondContact O-CB 3.43Å; F625-I629 VanDerWaalsContact O-CG1 3.3Å; F625-I629 WeakPolarHBondContact O-CG1 3.4Å; F625-I629 PolarHBondContact O-N 3.35Å
626	C	91.3	Very high	91.8	Very high	8 Å²	8	41.1 Å²	41.1	5%	0.054	21%	0.205	C	C	.	.	H	α-helix	trans	-53.8	-45.1	-176.2	-69.4	0	0	0	0	112.7	L618 Q622 K623 L630	L618-C626 HydrophobicContact CD1-CB 4.22Å; Q622-C626 PolarHBondContact O-N 3.2Å; Q622-C626 PolarHBondContact O-SG 2.83Å; K623-C626 PolarHBondContact O-N 2.6Å; C626-L630 VanDerWaalsContact O-CB 3.28Å; C626-L630 WeakPolarHBondContact O-CB 3.39Å; C626-L630 WeakPolarHBondContact O-CD1 3.09Å; C626-L630 WeakPolarHBondContact O-CG 3.26Å; C626-L630 PolarHBondContact O-N 3.12Å
627	N	90.1	Very high	91.7	Very high	67 Å²	67	38.4 Å²	38.4	36%	0.358	19%	0.192	S	C	.	.	H	α-helix	trans	-63.8	-45.4	-176.9	-168.9	52	0	0	0	112.4	F625 G631 I718 K721	F625-N627 VanDerWaalsContact C-N 3.29Å; F625-N627 PolarHBondContact O-N 2.68Å; N627-G631 PolarHBondContact O-N 3.36Å; N627-G631 VanDerWaalsContact O-N 3.07Å; N627-I718 HydrophobicContact CB-CG2 4.11Å; N627-K721 WeakPolarHBondContact O-CD 3.32Å; N627-K721 WeakPolarHBondContact OD1-CE 3.38Å; N627-K721 PolarHBondContact OD1-NZ 3.43Å
628	L	92.6	Very high	91.7	Very high	46 Å²	46	42.1 Å²	42.1	24%	0.241	21%	0.212	C	C	.	.	H	α-helix	trans	-67.7	-47.9	179.4	-179.1	59.1	0	0	0	111.2	F585 L588 W592 F625 L630 G631 I632	F585-L628 HydrophobicContact CD1-CD2 4.08Å; F585-L628 HydrophobicContact CE1-CD2 4.44Å; L588-L628 HydrophobicContact CB-CD2 3.53Å; L588-L628 HydrophobicContact CB-CG 4.11Å; L588-L628 HydrophobicContact CD1-CD2 3.93Å; L588-L628 HydrophobicContact CD1-CG 4.41Å; L588-L628 HydrophobicContact CG-CD2 4.4Å; W592-L628 HydrophobicContact CE3-CD1 4.06Å; W592-L628 HydrophobicContact CZ3-CD1 4.34Å; F625-L628 PolarHBondContact O-N 3.26Å; L628-L630 VanDerWaalsContact C-N 3.32Å; L628-L630 PolarHBondContact O-N 3.4Å; L628-G631 PolarHBondContact O-N 3.39Å; L628-G631 VanDerWaalsContact O-N 3.08Å; L628-I632 HydrophobicContact CG-CD1 4.22Å; L628-I632 WeakPolarHBondContact O-CG1 2.99Å; L628-I632 PolarHBondContact O-N 3.37Å
629	I	95.9	Very high	91.6	Very high	1 Å²	1	42.2 Å²	42.2	1%	0.005	21%	0.213	C	C	.	.	H	α-helix	trans	-58.9	-44.6	178.3	-68.1	169.4	0	0	0	111.1	L588 L614 I617 L618 F625 G631 I632 M633	L588-I629 HydrophobicContact CD1-CD1 4.33Å; L588-I629 HydrophobicContact CD1-CG1 3.84Å; L588-I629 HydrophobicContact CD2-CG1 3.88Å; L614-I629 HydrophobicContact CD1-CB 4.29Å; L614-I629 HydrophobicContact CD1-CG1 3.91Å; L614-I629 HydrophobicContact CD1-CG2 3.72Å; L614-I629 HydrophobicContact CD2-CG2 4.13Å; L614-I629 HydrophobicContact CG-CG2 3.61Å; I617-I629 HydrophobicContact CB-CD1 4.21Å; I617-I629 HydrophobicContact CG2-CD1 3.61Å; L618-I629 HydrophobicContact CB-CG2 4.02Å; L618-I629 HydrophobicContact CD1-CB 4.31Å; L618-I629 HydrophobicContact CD1-CG2 4.06Å; L618-I629 HydrophobicContact CD2-CG2 4.34Å; L618-I629 HydrophobicContact CG-CG2 4.35Å; F625-I629 HydrophobicContact CB-CD1 3.85Å; F625-I629 HydrophobicContact CB-CG1 4.46Å; F625-I629 WeakPolarHBondContact O-CB 3.43Å; F625-I629 VanDerWaalsContact O-CG1 3.3Å; F625-I629 WeakPolarHBondContact O-CG1 3.4Å; F625-I629 PolarHBondContact O-N 3.35Å; I629-G631 VanDerWaalsContact C-N 3.29Å; I629-G631 PolarHBondContact O-N 3.25Å; I629-I632 WeakPolarHBondContact O-CB 3.33Å; I629-I632 PolarHBondContact O-N 2.88Å; I629-M633 HydrophobicContact CG2-CG 4.46Å; I629-M633 HydrophobicContact CG2-SD 4.43Å; I629-M633 WeakPolarHBondContact O-CG 3.41Å; I629-M633 PolarHBondContact O-N 2.75Å
630	L	95.4	Very high	91.5	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-66	-34	178	-72.4	169.1	0	0	0	111.8	L618 C626 L628 M633 V634 L661 I718 K721 I722	L618-L630 HydrophobicContact CD1-CG 4.24Å; L618-L630 HydrophobicContact CD2-CD2 3.96Å; C626-L630 VanDerWaalsContact O-CB 3.28Å; C626-L630 WeakPolarHBondContact O-CB 3.39Å; C626-L630 WeakPolarHBondContact O-CD1 3.09Å; C626-L630 WeakPolarHBondContact O-CG 3.26Å; C626-L630 PolarHBondContact O-N 3.12Å; L628-L630 VanDerWaalsContact C-N 3.32Å; L628-L630 PolarHBondContact O-N 3.4Å; L630-M633 HydrophobicContact CD2-SD 4.34Å; L630-M633 PolarHBondContact O-N 3.09Å; L630-V634 WeakPolarHBondContact O-CG2 3.16Å; L630-V634 PolarHBondContact O-N 3.26Å; L630-L661 HydrophobicContact CD2-CD2 3.44Å; L630-L661 VanDerWaalsContact CD2-CD2 3.44Å; L630-I718 HydrophobicContact CD1-CB 3.73Å; L630-I718 HydrophobicContact CD1-CD1 4.15Å; L630-I718 HydrophobicContact CD1-CG1 4.41Å; L630-I718 HydrophobicContact CD1-CG2 4.14Å; L630-K721 HydrophobicContact CB-CB 3.77Å; L630-K721 HydrophobicContact CB-CD 4.05Å; L630-I722 HydrophobicContact CD1-CD1 4.38Å; L630-I722 HydrophobicContact CD1-CG1 3.84Å; L630-I722 HydrophobicContact CD2-CG1 4.25Å
631	G	94.6	Very high	91.6	Very high	6 Å²	6	47.7 Å²	47.7	6%	0.062	24%	0.239	C	C	.	.	H	α-helix	trans	-62.4	-47.7	172	0	0	0	0	0	111.7	N627 L628 I629 M633 V634 E635	N627-G631 PolarHBondContact O-N 3.36Å; N627-G631 VanDerWaalsContact O-N 3.07Å; L628-G631 PolarHBondContact O-N 3.39Å; L628-G631 VanDerWaalsContact O-N 3.08Å; I629-G631 VanDerWaalsContact C-N 3.29Å; I629-G631 PolarHBondContact O-N 3.25Å; G631-M633 VanDerWaalsContact C-N 3.25Å; G631-M633 PolarHBondContact O-N 2.9Å; G631-V634 WeakPolarHBondContact O-CB 3.34Å; G631-V634 PolarHBondContact O-N 3.01Å; G631-E635 PolarHBondContact O-N 3.47Å
632	I	95.9	Very high	92	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-56.7	-42.3	175.7	-67.9	168.8	0	0	0	110.6	L588 I591 W592 L596 L614 L628 I629 V634 E635 F636	L588-I632 HydrophobicContact CB-CD1 3.9Å; L588-I632 HydrophobicContact CD2-CD1 3.95Å; L588-I632 HydrophobicContact CG-CD1 4.5Å; L588-I632 VanDerWaalsContact O-CD1 3.29Å; L588-I632 WeakPolarHBondContact O-CD1 3.4Å; I591-I632 HydrophobicContact CB-CD1 4.44Å; I591-I632 HydrophobicContact CG2-CD1 4.41Å; I591-I632 HydrophobicContact CG2-CG2 3.69Å; W592-I632 HydrophobicContact CD2-CG1 4.38Å; W592-I632 HydrophobicContact CE3-CB 4.37Å; W592-I632 HydrophobicContact CE3-CD1 4.47Å; W592-I632 HydrophobicContact CE3-CG1 3.4Å; W592-I632 VanDerWaalsContact CE3-CG1 3.4Å; W592-I632 HydrophobicContact CZ3-CG1 3.96Å; W592-I632 VanDerWaalsContact CZ3-N 3.29Å; L596-I632 HydrophobicContact CD1-CG2 4.37Å; L614-I632 HydrophobicContact CD2-CB 4.44Å; L614-I632 HydrophobicContact CD2-CG2 3.78Å; L628-I632 HydrophobicContact CG-CD1 4.22Å; L628-I632 WeakPolarHBondContact O-CG1 2.99Å; L628-I632 PolarHBondContact O-N 3.37Å; I629-I632 WeakPolarHBondContact O-CB 3.33Å; I629-I632 PolarHBondContact O-N 2.88Å; I632-V634 PolarHBondContact O-N 2.82Å; I632-E635 PolarHBondContact O-N 2.83Å; I632-F636 HydrophobicContact CG2-CD2 3.53Å; I632-F636 HydrophobicContact CG2-CE2 3.62Å; I632-F636 WeakPolarHBondContact O-CD2 3.4Å; I632-F636 PolarHBondContact O-N 2.67Å
633	M	95.9	Very high	92.3	Very high	2 Å²	2	43.2 Å²	43.2	1%	0.01	22%	0.223	C	C	.	.	H	α-helix	trans	-65.1	-36.1	178	-74.2	-173.5	71.5	0	0	113.3	L614 L615 L618 I629 L630 G631 E635 C637 V646 V725	L614-M633 HydrophobicContact CD2-CG 3.89Å; L615-M633 HydrophobicContact CD2-CE 3.62Å; L615-M633 HydrophobicContact CD2-SD 3.85Å; L615-M633 HydrophobicContact CG-CE 4.47Å; L618-M633 HydrophobicContact CD2-SD 3.94Å; I629-M633 HydrophobicContact CG2-CG 4.46Å; I629-M633 HydrophobicContact CG2-SD 4.43Å; I629-M633 WeakPolarHBondContact O-CG 3.41Å; I629-M633 PolarHBondContact O-N 2.75Å; L630-M633 HydrophobicContact CD2-SD 4.34Å; L630-M633 PolarHBondContact O-N 3.09Å; G631-M633 VanDerWaalsContact C-N 3.25Å; G631-M633 PolarHBondContact O-N 2.9Å; M633-E635 VanDerWaalsContact C-N 3.32Å; M633-C637 WeakPolarHBondContact O-CB 3.35Å; M633-C637 PolarHBondContact O-N 2.9Å; M633-C637 VanDerWaalsContact O-N 3.12Å; M633-C637 PolarHBondContact O-SG 3.2Å; M633-V646 HydrophobicContact CE-CG1 4.44Å; M633-V646 HydrophobicContact CE-CG2 4.49Å; M633-V725 HydrophobicContact CB-CG2 3.79Å; M633-V725 HydrophobicContact CE-CG1 3.89Å
634	V	94.8	Very high	92.8	Very high	39 Å²	39	40.3 Å²	40.3	24%	0.236	22%	0.223	C	C	.	.	H	α-helix	trans	-60.5	-45.7	177.7	169.4	0	0	0	0	110.2	L630 G631 I632 C637 K721 A724 V725	L630-V634 WeakPolarHBondContact O-CG2 3.16Å; L630-V634 PolarHBondContact O-N 3.26Å; G631-V634 WeakPolarHBondContact O-CB 3.34Å; G631-V634 PolarHBondContact O-N 3.01Å; I632-V634 PolarHBondContact O-N 2.82Å; V634-C637 WeakPolarHBondContact O-CB 3.37Å; V634-C637 PolarHBondContact O-N 3.49Å; V634-K721 HydrophobicContact CG2-CB 4.27Å; V634-A724 HydrophobicContact CG1-CB 4.18Å; V634-A724 HydrophobicContact CG2-CB 3.77Å; V634-V725 HydrophobicContact CG2-CG2 3.68Å
635	E	94.2	Very high	93.3	Very high	71 Å²	71	35 Å²	35	33%	0.332	20%	0.201	S	C	.	.	H	α-helix	trans	-72.5	-42.1	-179.8	-68.1	-166.6	-173	0	0	112.6	W592 L596 G631 I632 M633 C637 D638	W592-E635 HydrophobicContact CZ2-CG 4.45Å; W592-E635 WeakPolarHBondContact CZ2-OE1 3.28Å; L596-E635 HydrophobicContact CD1-CB 3.78Å; L596-E635 HydrophobicContact CD1-CG 4.49Å; L596-E635 WeakPolarHBondContact CD1-OE2 3.35Å; L596-E635 HydrophobicContact CD2-CB 4.23Å; G631-E635 PolarHBondContact O-N 3.47Å; I632-E635 PolarHBondContact O-N 2.83Å; M633-E635 VanDerWaalsContact C-N 3.32Å; E635-C637 PolarHBondContact O-N 2.87Å; E635-C637 VanDerWaalsContact O-N 3.15Å; E635-D638 VanDerWaalsContact O-CB 3.31Å; E635-D638 WeakPolarHBondContact O-CB 3.31Å; E635-D638 PolarHBondContact O-N 2.98Å
636	F	95	Very high	93.6	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-57.8	-31.8	174.2	-97.2	-64	0	0	0	112.7	I591 I595 L596 E602 F605 I611 I632 D638 N639 T642	I591-F636 HydrophobicContact CG2-CE2 3.6Å; I591-F636 HydrophobicContact CG2-CZ 4.09Å; I595-F636 HydrophobicContact CG2-CE1 4.43Å; I595-F636 HydrophobicContact CG2-CZ 4.04Å; L596-F636 HydrophobicContact CD2-CB 4.23Å; L596-F636 HydrophobicContact CD2-CD1 3.73Å; L596-F636 HydrophobicContact CD2-CD2 3.41Å; L596-F636 VanDerWaalsContact CD2-CD2 3.41Å; L596-F636 HydrophobicContact CD2-CE1 3.85Å; L596-F636 HydrophobicContact CD2-CE2 3.53Å; L596-F636 HydrophobicContact CD2-CG 3.5Å; L596-F636 VanDerWaalsContact CD2-CG 3.5Å; L596-F636 HydrophobicContact CD2-CZ 3.74Å; L596-F636 HydrophobicContact CG-CD2 4.45Å; L596-F636 HydrophobicContact CG-CE2 4.26Å; E602-F636 HydrophobicContact CB-CE1 4.02Å; E602-F636 HydrophobicContact CG-CD1 4.31Å; E602-F636 HydrophobicContact CG-CE1 3.82Å; F605-F636 AromaticContact CD1-CE1 3.98Å; F605-F636 HydrophobicContact CD1-CE1 3.98Å; F605-F636 HydrophobicContact CD1-CE2 4.23Å; F605-F636 AromaticContact CD1-CZ 3.52Å; F605-F636 HydrophobicContact CD1-CZ 3.52Å; F605-F636 AromaticContact CE1-CE2 4Å; F605-F636 HydrophobicContact CE1-CE2 4Å; F605-F636 AromaticContact CE1-CZ 3.76Å; F605-F636 HydrophobicContact CE1-CZ 3.76Å; F605-F636 HydrophobicContact CG-CZ 4.28Å; I611-F636 HydrophobicContact CD1-CB 4.25Å; I611-F636 HydrophobicContact CD1-CD2 3.86Å; I611-F636 HydrophobicContact CD1-CE2 4.34Å; I611-F636 HydrophobicContact CD1-CG 3.98Å; I632-F636 HydrophobicContact CG2-CD2 3.53Å; I632-F636 HydrophobicContact CG2-CE2 3.62Å; I632-F636 WeakPolarHBondContact O-CD2 3.4Å; I632-F636 PolarHBondContact O-N 2.67Å; F636-D638 PolarHBondContact O-N 3.05Å; F636-N639 WeakPolarHBondContact O-CB 3.45Å; F636-N639 PolarHBondContact O-N 3.38Å; F636-T642 HydrophobicContact CB-CG2 4.05Å; F636-T642 VanDerWaalsContact O-CB 3.23Å; F636-T642 WeakPolarHBondContact O-CB 3.2Å; F636-T642 PolarHBondContact O-OG1 3.07Å
637	C	93.3	Very high	93.6	Very high	17 Å²	17	36.3 Å²	36.3	12%	0.115	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.8	-8.6	177.3	-80.2	0	0	0	0	113.8	M633 V634 E635 N639 K728	M633-C637 WeakPolarHBondContact O-CB 3.35Å; M633-C637 PolarHBondContact O-N 2.9Å; M633-C637 VanDerWaalsContact O-N 3.12Å; M633-C637 PolarHBondContact O-SG 3.2Å; V634-C637 WeakPolarHBondContact O-CB 3.37Å; V634-C637 PolarHBondContact O-N 3.49Å; E635-C637 PolarHBondContact O-N 2.87Å; E635-C637 VanDerWaalsContact O-N 3.15Å; C637-N639 VanDerWaalsContact C-N 3.29Å; C637-K728 HydrophobicContact CB-CB 3.61Å; C637-K728 HydrophobicContact CB-CD 4.35Å; C637-K728 HydrophobicContact CB-CG 3.82Å
638	D	91.9	Very high	93.8	Very high	95 Å²	95	35.6 Å²	35.6	51%	0.508	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.4	-21.5	168	-67.4	-27.1	0	0	0	112.2	E635 F636 K728	E635-D638 VanDerWaalsContact O-CB 3.31Å; E635-D638 WeakPolarHBondContact O-CB 3.31Å; E635-D638 PolarHBondContact O-N 2.98Å; F636-D638 PolarHBondContact O-N 3.05Å; D638-K728 IonicContact OD1-NZ 2.82Å; D638-K728 PolarHBondContact OD1-NZ 3.22Å
639	N	93.1	Very high	93.9	Very high	4 Å²	4	33.6 Å²	33.6	2%	0.021	20%	0.2	C	C	.	.	S	Bend	trans	-77.2	121.4	167.5	-174.2	-36.2	0	0	0	110	Y599 E602 D603 F636 C637 K641 T642	Y599-N639 HydrophobicContact CE1-CB 4.45Å; E602-N639 WeakPolarHBondContact OE2-CB 3.34Å; E602-N639 PolarHBondContact OE2-ND2 2.92Å; D603-N639 PolarHBondContact OD1-ND2 3.45Å; D603-N639 VanDerWaalsContact OD1-ND2 3.11Å; F636-N639 WeakPolarHBondContact O-CB 3.45Å; F636-N639 PolarHBondContact O-N 3.38Å; C637-N639 VanDerWaalsContact C-N 3.29Å; N639-K641 PolarHBondContact O-N 2.96Å; N639-K641 VanDerWaalsContact O-N 3.09Å; N639-K641 WeakPolarHBondContact OD1-CB 3.47Å; N639-K641 PolarHBondContact OD1-N 3.23Å; N639-T642 WeakPolarHBondContact O-CB 3.16Å; N639-T642 PolarHBondContact O-N 3.34Å; N639-T642 PolarHBondContact O-OG1 2.93Å
640	P	91.2	Very high	93.9	Very high	114 Å²	114	39.1 Å²	39.1	74%	0.74	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.2	-21.7	-174.9	25.7	-35.2	0	0	0	113.7
641	K	92.9	Very high	93.7	Very high	99 Å²	99	39.8 Å²	39.8	43%	0.43	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.5	-28.2	178	-63.1	178.6	-173.8	168.4	0	112	D603 L606 N639 S643 A644 H645	D603-K641 WeakPolarHBondContact OD1-CD 3.3Å; D603-K641 IonicContact OD1-NZ 3.9Å; D603-K641 PolarHBondContact OD1-NZ 3.12Å; D603-K641 IonicContact OD2-NZ 2.64Å; D603-K641 PolarHBondContact OD2-NZ 3.41Å; L606-K641 HydrophobicContact CD1-CB 3.89Å; N639-K641 PolarHBondContact O-N 2.96Å; N639-K641 VanDerWaalsContact O-N 3.09Å; N639-K641 WeakPolarHBondContact OD1-CB 3.47Å; N639-K641 PolarHBondContact OD1-N 3.23Å; K641-S643 VanDerWaalsContact C-N 3.32Å; K641-S643 PolarHBondContact O-N 3.48Å; K641-A644 PolarHBondContact O-N 2.92Å; K641-H645 PolarHBondContact O-CD2 2.92Å
642	T	94.2	Very high	93.4	Very high	1 Å²	1	48.6 Å²	48.6	1%	0.006	26%	0.264	C	S	.	.	H	α-helix	trans	-55.8	-42.4	-173.7	-63.1	0	0	0	0	113	F636 N639 A644 H645 V646	F636-T642 HydrophobicContact CB-CG2 4.05Å; F636-T642 VanDerWaalsContact O-CB 3.23Å; F636-T642 WeakPolarHBondContact O-CB 3.2Å; F636-T642 PolarHBondContact O-OG1 3.07Å; N639-T642 WeakPolarHBondContact O-CB 3.16Å; N639-T642 PolarHBondContact O-N 3.34Å; N639-T642 PolarHBondContact O-OG1 2.93Å; T642-A644 VanDerWaalsContact C-N 3.29Å; T642-A644 PolarHBondContact O-N 3.34Å; T642-H645 PolarHBondContact O-N 3.05Å; T642-V646 HydrophobicContact CG2-CG2 3.81Å; T642-V646 WeakPolarHBondContact O-CG2 3.46Å; T642-V646 PolarHBondContact O-N 3.18Å
643	S	91.8	Very high	93	Very high	38 Å²	38	58.6 Å²	58.6	27%	0.266	31%	0.308	S	S	.	.	H	α-helix	trans	-56.8	-41.1	-177.5	178.9	0	0	0	0	112.6	K641 H645 V646 N647	K641-S643 VanDerWaalsContact C-N 3.32Å; K641-S643 PolarHBondContact O-N 3.48Å; S643-H645 PolarHBondContact O-N 3.09Å; S643-V646 PolarHBondContact O-N 3.01Å; S643-N647 VanDerWaalsContact O-CB 3.31Å; S643-N647 WeakPolarHBondContact O-CB 3.38Å; S643-N647 PolarHBondContact O-N 3.47Å; S643-N647 PolarHBondContact O-ND2 3.09Å; S643-N647 PolarHBondContact OG-ND2 3.37Å
644	A	92.1	Very high	92.6	Very high	67 Å²	67	64.8 Å²	64.8	55%	0.554	34%	0.341	S	S	*	.	H	α-helix	trans	-63.7	-41.7	177.7	0	0	0	0	0	111.9	K641 T642 A648	K641-A644 PolarHBondContact O-N 2.92Å; T642-A644 VanDerWaalsContact C-N 3.29Å; T642-A644 PolarHBondContact O-N 3.34Å; A644-A648 VanDerWaalsContact O-CB 3.3Å; A644-A648 WeakPolarHBondContact O-CB 3.05Å; A644-A648 PolarHBondContact O-N 3.02Å
645	H	94.5	Very high	92.5	Very high	55 Å²	55	64.4 Å²	64.4	26%	0.255	34%	0.337	S	S	.	.	H	α-helix	trans	-67.5	-46.5	177.4	-73	-93.8	0	0	0	111.8	L606 F612 K641 T642 S643 N647 A648 W649	L606-H645 HydrophobicContact CD2-CB 4.26Å; L606-H645 PolarHBondContact O-CE1 3.46Å; L606-H645 VanDerWaalsContact O-CE1 3.23Å; L606-H645 PolarHBondContact O-ND1 3.4Å; F612-H645 HydrophobicContact CE1-CB 4.06Å; F612-H645 WeakPolarHBondContact CE1-O 3.42Å; K641-H645 PolarHBondContact O-CD2 2.92Å; T642-H645 PolarHBondContact O-N 3.05Å; S643-H645 PolarHBondContact O-N 3.09Å; H645-N647 VanDerWaalsContact C-N 3.32Å; H645-N647 PolarHBondContact O-N 3.43Å; H645-A648 PolarHBondContact O-N 3.29Å; H645-A648 VanDerWaalsContact O-N 3.13Å; H645-W649 PolarHBondContact O-N 3.44Å; H645-W649 VanDerWaalsContact O-N 3.14Å
646	V	94.6	Very high	92.6	Very high	1 Å²	1	61.2 Å²	61.2	1%	0.006	32%	0.323	C	S	.	.	H	α-helix	trans	-60.7	-42.4	178.5	176.3	0	0	0	0	111.1	I611 L615 M633 T642 S643 A648 W649 A657 L729	I611-V646 HydrophobicContact CG2-CG2 3.73Å; L615-V646 HydrophobicContact CD1-CG1 4.43Å; M633-V646 HydrophobicContact CE-CG1 4.44Å; M633-V646 HydrophobicContact CE-CG2 4.49Å; T642-V646 HydrophobicContact CG2-CG2 3.81Å; T642-V646 WeakPolarHBondContact O-CG2 3.46Å; T642-V646 PolarHBondContact O-N 3.18Å; S643-V646 PolarHBondContact O-N 3.01Å; V646-A648 VanDerWaalsContact C-N 3.31Å; V646-A648 PolarHBondContact O-N 3.46Å; V646-W649 PolarHBondContact O-N 3.2Å; V646-A657 HydrophobicContact CG1-CB 3.59Å; V646-A657 WeakPolarHBondContact O-CB 3.46Å; V646-L729 HydrophobicContact CB-CD2 3.81Å; V646-L729 HydrophobicContact CG1-CD1 3.67Å; V646-L729 HydrophobicContact CG1-CD2 3.77Å; V646-L729 HydrophobicContact CG1-CG 4.36Å; V646-L729 HydrophobicContact CG2-CD2 4.43Å
647	N	92.1	Very high	92.6	Very high	39 Å²	39	61.3 Å²	61.3	21%	0.209	32%	0.324	C	S	.	.	H	α-helix	trans	-70.9	-24.4	177.6	-77	-36.5	0	0	0	113.5	S643 H645 R650	S643-N647 VanDerWaalsContact O-CB 3.31Å; S643-N647 WeakPolarHBondContact O-CB 3.38Å; S643-N647 PolarHBondContact O-N 3.47Å; S643-N647 PolarHBondContact O-ND2 3.09Å; S643-N647 PolarHBondContact OG-ND2 3.37Å; H645-N647 VanDerWaalsContact C-N 3.32Å; H645-N647 PolarHBondContact O-N 3.43Å; N647-R650 PolarHBondContact O-NH1 3.29Å
648	A	93.7	Very high	92.6	Very high	53 Å²	53	60.6 Å²	60.6	44%	0.438	32%	0.319	S	S	.	.	H	α-helix	trans	-78.4	-25.5	175.5	0	0	0	0	0	113.3	F612 A644 H645 V646 R650	F612-A648 HydrophobicContact CZ-CB 3.96Å; A644-A648 VanDerWaalsContact O-CB 3.3Å; A644-A648 WeakPolarHBondContact O-CB 3.05Å; A644-A648 PolarHBondContact O-N 3.02Å; H645-A648 PolarHBondContact O-N 3.29Å; H645-A648 VanDerWaalsContact O-N 3.13Å; V646-A648 VanDerWaalsContact C-N 3.31Å; V646-A648 PolarHBondContact O-N 3.46Å; A648-R650 PolarHBondContact O-NH1 2.87Å
649	W	95.8	Very high	92.8	Very high	3 Å²	3	56.2 Å²	56.2	1%	0.011	30%	0.296	C	S	.	.			trans	-59.7	139.2	-177.3	178.3	81.8	0	0	0	113.1	F612 L615 D616 A619 H645 V646 G651 L655 A657 L660	F612-W649 HydrophobicContact CD1-CB 4.29Å; F612-W649 HydrophobicContact CE1-CB 4.39Å; F612-W649 HydrophobicContact CG-CB 4.44Å; F612-W649 AromaticContact CG-CD1 3.78Å; F612-W649 PolarHBondContact O-NE1 3.41Å; L615-W649 HydrophobicContact CB-CD2 3.77Å; L615-W649 HydrophobicContact CB-CE3 4.37Å; L615-W649 HydrophobicContact CB-CG 4.03Å; L615-W649 HydrophobicContact CB-CZ2 3.95Å; L615-W649 HydrophobicContact CD1-CB 3.58Å; L615-W649 HydrophobicContact CD1-CD2 3.75Å; L615-W649 HydrophobicContact CD1-CE3 4.16Å; L615-W649 HydrophobicContact CD1-CG 3.5Å; L615-W649 VanDerWaalsContact CD1-CG 3.5Å; L615-W649 HydrophobicContact CG-CD2 4.36Å; L615-W649 HydrophobicContact CG-CG 4.42Å; D616-W649 WeakPolarHBondContact OD1-CZ2 3.38Å; D616-W649 PolarHBondContact OD1-NE1 3.14Å; A619-W649 HydrophobicContact CB-CH2 4.31Å; A619-W649 HydrophobicContact CB-CZ2 4.41Å; H645-W649 PolarHBondContact O-N 3.44Å; H645-W649 VanDerWaalsContact O-N 3.14Å; V646-W649 PolarHBondContact O-N 3.2Å; W649-G651 VanDerWaalsContact CZ2-CA 3.46Å; W649-L655 HydrophobicContact CH2-CD2 4.43Å; W649-L655 HydrophobicContact CZ3-CG 4.45Å; W649-L655 WeakPolarHBondContact CZ3-O 3.46Å; W649-A657 HydrophobicContact CE3-CB 3.98Å; W649-L660 HydrophobicContact CH2-CD2 3.87Å; W649-L660 HydrophobicContact CZ3-CB 4.34Å; W649-L660 HydrophobicContact CZ3-CD2 4.15Å
650	R	94.4	Very high	92.9	Very high	118 Å²	118	56 Å²	56	45%	0.445	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	112.4	176	-64	-65.4	179	-83.8	-1.9	109.7	N647 A648	N647-R650 PolarHBondContact O-NH1 3.29Å; A648-R650 PolarHBondContact O-NH1 2.87Å
651	G	91.2	Very high	93.1	Very high	13 Å²	13	50.6 Å²	50.6	13%	0.134	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	-170.6	175.2	0	0	0	0	0	113.5	W649 K653 D654 L655	W649-G651 VanDerWaalsContact CZ2-CA 3.46Å; G651-K653 PolarHBondContact O-N 3.4Å; G651-D654 PolarHBondContact O-N 3.39Å; G651-D654 VanDerWaalsContact O-N 3.14Å; G651-L655 PolarHBondContact N-O 2.91Å; G651-L655 PolarHBondContact O-N 2.75Å
652	K	88.5	Confident	93.3	Very high	191 Å²	191	45.9 Å²	45.9	83%	0.83	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.3	131.8	177.4	-65.6	-179.2	-177.7	174.2	0	111.2
653	K	87.9	Confident	93.3	Very high	210 Å²	210	49 Å²	49	91%	0.913	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.6	39.8	-175.5	-51.2	179.4	178	-178.7	0	113.3	G651 L655	G651-K653 PolarHBondContact O-N 3.4Å; K653-L655 PolarHBondContact O-N 2.99Å
654	D	87.8	Confident	93.5	Very high	133 Å²	133	47.4 Å²	47.4	71%	0.711	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	55.9	33	179.7	-61	-40	0	0	0	113.8	G651 T656	G651-D654 PolarHBondContact O-N 3.39Å; G651-D654 VanDerWaalsContact O-N 3.14Å; D654-T656 PolarHBondContact O-N 3.33Å
655	L	93.1	Very high	93.7	Very high	30 Å²	30	44.2 Å²	44.2	16%	0.157	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.4	122.4	176.8	-177.8	67.3	0	0	0	109.9	W649 G651 K653 L660 K663	W649-L655 HydrophobicContact CH2-CD2 4.43Å; W649-L655 HydrophobicContact CZ3-CG 4.45Å; W649-L655 WeakPolarHBondContact CZ3-O 3.46Å; G651-L655 PolarHBondContact N-O 2.91Å; G651-L655 PolarHBondContact O-N 2.75Å; K653-L655 PolarHBondContact O-N 2.99Å; L655-L660 HydrophobicContact CD2-CB 3.96Å; L655-L660 HydrophobicContact CD2-CD1 4.01Å; L655-L660 HydrophobicContact CD2-CG 4.49Å; L655-L660 HydrophobicContact CG-CB 4.24Å; L655-K663 HydrophobicContact CD1-CD 4.12Å
656	T	95	Very high	93.8	Very high	5 Å²	5	44.2 Å²	44.2	3%	0.031	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83	156.8	174.6	64.3	0	0	0	0	111.4	D654 A658 S659 L660 P735	D654-T656 PolarHBondContact O-N 3.33Å; T656-A658 VanDerWaalsContact C-N 3.31Å; T656-A658 PolarHBondContact O-N 3.47Å; T656-S659 PolarHBondContact O-N 3.2Å; T656-S659 WeakPolarHBondContact OG1-CB 3.4Å; T656-S659 PolarHBondContact OG1-N 2.99Å; T656-L660 PolarHBondContact O-N 2.93Å; T656-P735 WeakPolarHBondContact CB-O 3.11Å; T656-P735 HydrophobicContact CG2-CG 4.4Å; T656-P735 WeakPolarHBondContact CG2-O 3.24Å; T656-P735 PolarHBondContact OG1-O 3.42Å
657	A	94.8	Very high	93.8	Very high	2 Å²	2	48.1 Å²	48.1	2%	0.017	23%	0.229	C	C	.	.	H	α-helix	trans	-59	-43.7	179.6	0	0	0	0	0	111.5	L615 V646 W649 S659 L660 L661	L615-A657 HydrophobicContact CD1-CB 4.08Å; L615-A657 HydrophobicContact CD2-CB 4.3Å; V646-A657 HydrophobicContact CG1-CB 3.59Å; V646-A657 WeakPolarHBondContact O-CB 3.46Å; W649-A657 HydrophobicContact CE3-CB 3.98Å; A657-S659 PolarHBondContact O-N 3.01Å; A657-L660 WeakPolarHBondContact O-CB 3.49Å; A657-L660 PolarHBondContact O-N 3.04Å; A657-L660 VanDerWaalsContact O-N 3.17Å; A657-L661 WeakPolarHBondContact O-CG 2.74Å; A657-L661 PolarHBondContact O-N 3.38Å
658	A	94.9	Very high	93.9	Very high	1 Å²	1	47.1 Å²	47.1	1%	0.008	22%	0.223	C	C	.	.	H	α-helix	trans	-57.9	-48	175.1	0	0	0	0	0	112.5	T656 L660 L661 I662 L726 L734 L737	T656-A658 VanDerWaalsContact C-N 3.31Å; T656-A658 PolarHBondContact O-N 3.47Å; A658-L660 VanDerWaalsContact C-N 3.31Å; A658-L660 PolarHBondContact O-N 3.19Å; A658-L661 PolarHBondContact O-N 3.36Å; A658-I662 WeakPolarHBondContact O-CD1 3.49Å; A658-I662 VanDerWaalsContact O-CG1 3.24Å; A658-I662 WeakPolarHBondContact O-CG1 3.37Å; A658-I662 PolarHBondContact O-N 3.08Å; A658-L726 HydrophobicContact CB-CD2 4.31Å; A658-L734 HydrophobicContact CB-CB 3.96Å; A658-L734 HydrophobicContact CB-CD1 4.16Å; A658-L734 HydrophobicContact CB-CD2 3.98Å; A658-L734 HydrophobicContact CB-CG 4.25Å; A658-L737 HydrophobicContact CB-CD2 3.86Å
659	S	94.8	Very high	94	Very high	4 Å²	4	45 Å²	45	3%	0.028	20%	0.204	C	C	.	.	H	α-helix	trans	-64.8	-34.8	177	-173.1	0	0	0	0	112	T656 A657 K663 D741	T656-S659 PolarHBondContact O-N 3.2Å; T656-S659 WeakPolarHBondContact OG1-CB 3.4Å; T656-S659 PolarHBondContact OG1-N 2.99Å; A657-S659 PolarHBondContact O-N 3.01Å; S659-K663 WeakPolarHBondContact O-CB 3.36Å; S659-K663 WeakPolarHBondContact O-CD 3.41Å; S659-K663 WeakPolarHBondContact O-CG 3.34Å; S659-K663 PolarHBondContact O-N 3.05Å; S659-K663 WeakPolarHBondContact OG-CE 3.29Å; S659-K663 PolarHBondContact OG-NZ 3.07Å; S659-D741 PolarHBondContact OG-OD2 2.71Å; S659-D741 VanDerWaalsContact OG-OD2 3.08Å
660	L	95.7	Very high	93.9	Very high	0 Å²	0	53.3 Å²	53.3	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-62.1	-50.3	173.4	173.8	62.7	0	0	0	111.4	L618 A619 W649 L655 T656 A657 A658 I662 K663 L664	L618-L660 HydrophobicContact CB-CD2 4.39Å; L618-L660 HydrophobicContact CD2-CD2 4.17Å; L618-L660 HydrophobicContact CG-CD2 4.21Å; A619-L660 HydrophobicContact CB-CD1 4.28Å; A619-L660 HydrophobicContact CB-CD2 4.03Å; W649-L660 HydrophobicContact CH2-CD2 3.87Å; W649-L660 HydrophobicContact CZ3-CB 4.34Å; W649-L660 HydrophobicContact CZ3-CD2 4.15Å; L655-L660 HydrophobicContact CD2-CB 3.96Å; L655-L660 HydrophobicContact CD2-CD1 4.01Å; L655-L660 HydrophobicContact CD2-CG 4.49Å; L655-L660 HydrophobicContact CG-CB 4.24Å; T656-L660 PolarHBondContact O-N 2.93Å; A657-L660 WeakPolarHBondContact O-CB 3.49Å; A657-L660 PolarHBondContact O-N 3.04Å; A657-L660 VanDerWaalsContact O-N 3.17Å; A658-L660 VanDerWaalsContact C-N 3.31Å; A658-L660 PolarHBondContact O-N 3.19Å; L660-I662 PolarHBondContact O-N 3.27Å; L660-K663 PolarHBondContact O-N 3.34Å; L660-L664 HydrophobicContact CD1-CD1 4.45Å; L660-L664 HydrophobicContact CD1-CG 4.39Å; L660-L664 HydrophobicContact CG-CD1 4.36Å; L660-L664 WeakPolarHBondContact O-CG 3.36Å; L660-L664 PolarHBondContact O-N 3.25Å
661	L	96.1	Very high	93.8	Very high	0 Å²	0	52 Å²	52	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-59.3	-45.4	179.5	-70.3	174	0	0	0	111.6	L618 L630 A657 A658 K663 L664 W665 I722 V725 L726 L729	L618-L661 HydrophobicContact CD2-CD2 4.23Å; L630-L661 HydrophobicContact CD2-CD2 3.44Å; L630-L661 VanDerWaalsContact CD2-CD2 3.44Å; A657-L661 WeakPolarHBondContact O-CG 2.74Å; A657-L661 PolarHBondContact O-N 3.38Å; A658-L661 PolarHBondContact O-N 3.36Å; L661-K663 VanDerWaalsContact C-N 3.33Å; L661-K663 PolarHBondContact O-N 3.15Å; L661-L664 WeakPolarHBondContact O-CB 3.31Å; L661-L664 PolarHBondContact O-N 3.27Å; L661-W665 PolarHBondContact O-N 3.2Å; L661-I722 HydrophobicContact CB-CG2 4.15Å; L661-I722 HydrophobicContact CD2-CG1 4.45Å; L661-V725 HydrophobicContact CD1-CB 4.32Å; L661-V725 HydrophobicContact CD1-CG1 3.63Å; L661-L726 HydrophobicContact CB-CD1 4.43Å; L661-L726 HydrophobicContact CB-CD2 4.43Å; L661-L726 HydrophobicContact CB-CG 4.46Å; L661-L726 HydrophobicContact CD1-CD2 3.89Å; L661-L726 HydrophobicContact CD1-CG 4.05Å; L661-L729 HydrophobicContact CD1-CD1 4.42Å
662	I	96.3	Very high	93.9	Very high	0 Å²	0	53.3 Å²	53.3	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-64.4	-37.7	176.8	-65.4	164	0	0	0	111.5	A658 L660 W665 R666 L726 L737 D741 T744 L745 I748	A658-I662 WeakPolarHBondContact O-CD1 3.49Å; A658-I662 VanDerWaalsContact O-CG1 3.24Å; A658-I662 WeakPolarHBondContact O-CG1 3.37Å; A658-I662 PolarHBondContact O-N 3.08Å; L660-I662 PolarHBondContact O-N 3.27Å; I662-W665 WeakPolarHBondContact O-CB 3.15Å; I662-W665 PolarHBondContact O-N 3.36Å; I662-R666 PolarHBondContact O-N 2.76Å; I662-R666 VanDerWaalsContact O-N 3.07Å; I662-L726 HydrophobicContact CG1-CD1 4.29Å; I662-L737 HydrophobicContact CD1-CD1 4.15Å; I662-L737 HydrophobicContact CD1-CD2 3.66Å; I662-D741 HydrophobicContact CD1-CB 4.02Å; I662-D741 HydrophobicContact CG2-CB 4.1Å; I662-T744 HydrophobicContact CG2-CG2 3.78Å; I662-L745 HydrophobicContact CD1-CB 4.42Å; I662-L745 HydrophobicContact CD1-CD1 4.03Å; I662-L745 HydrophobicContact CG1-CD1 4.41Å; I662-I748 HydrophobicContact CG1-CD1 3.99Å
663	K	95	Very high	94.2	Very high	66 Å²	66	45.8 Å²	45.8	29%	0.287	22%	0.219	S	C	.	.	H	α-helix	trans	-68.2	-33.5	174.5	-76.6	166.5	-177.4	154.1	0	112.7	L655 S659 L660 L661 K667	L655-K663 HydrophobicContact CD1-CD 4.12Å; S659-K663 WeakPolarHBondContact O-CB 3.36Å; S659-K663 WeakPolarHBondContact O-CD 3.41Å; S659-K663 WeakPolarHBondContact O-CG 3.34Å; S659-K663 PolarHBondContact O-N 3.05Å; S659-K663 WeakPolarHBondContact OG-CE 3.29Å; S659-K663 PolarHBondContact OG-NZ 3.07Å; L660-K663 PolarHBondContact O-N 3.34Å; L661-K663 VanDerWaalsContact C-N 3.33Å; L661-K663 PolarHBondContact O-N 3.15Å; K663-K667 PolarHBondContact O-N 3.15Å
664	L	96.2	Very high	94.5	Very high	5 Å²	5	36.4 Å²	36.4	3%	0.026	18%	0.18	C	C	.	.	H	α-helix	trans	-67.2	-42.1	173.2	-73.5	173.2	0	0	0	110.8	L618 K621 L660 L661 R666 K667 E668 I718 I722	L618-L664 HydrophobicContact CD1-CD1 3.78Å; L618-L664 HydrophobicContact CD2-CD1 4.01Å; L618-L664 HydrophobicContact CG-CD1 3.78Å; K621-L664 HydrophobicContact CB-CD2 4.24Å; K621-L664 HydrophobicContact CD-CD2 4.3Å; K621-L664 HydrophobicContact CG-CD2 3.92Å; L660-L664 HydrophobicContact CD1-CD1 4.45Å; L660-L664 HydrophobicContact CD1-CG 4.39Å; L660-L664 HydrophobicContact CG-CD1 4.36Å; L660-L664 WeakPolarHBondContact O-CG 3.36Å; L660-L664 PolarHBondContact O-N 3.25Å; L661-L664 WeakPolarHBondContact O-CB 3.31Å; L661-L664 PolarHBondContact O-N 3.27Å; L664-R666 PolarHBondContact O-N 3.05Å; L664-K667 WeakPolarHBondContact O-CB 3.23Å; L664-K667 PolarHBondContact O-N 2.87Å; L664-E668 PolarHBondContact O-N 3.5Å; L664-I718 HydrophobicContact CB-CD1 4.35Å; L664-I722 HydrophobicContact CB-CD1 3.97Å
665	W	96.2	Very high	94.8	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-55.1	-52.5	173.4	-179.1	-79.1	0	0	0	112.3	L661 I662 K667 E668 E669 L689 R719 I722 T744 I747 I748 Y751	L661-W665 PolarHBondContact O-N 3.2Å; I662-W665 WeakPolarHBondContact O-CB 3.15Å; I662-W665 PolarHBondContact O-N 3.36Å; W665-K667 PolarHBondContact O-N 3.15Å; W665-E668 WeakPolarHBondContact O-CB 3.28Å; W665-E668 PolarHBondContact O-N 3.21Å; W665-E668 VanDerWaalsContact O-N 3.09Å; W665-E669 PolarHBondContact NE1-OE1 3.39Å; W665-E669 PolarHBondContact O-N 3.17Å; W665-L689 HydrophobicContact CZ2-CD2 4.12Å; W665-R719 HydrophobicContact CD2-CG 4.25Å; W665-R719 HydrophobicContact CE3-CB 3.84Å; W665-R719 HydrophobicContact CE3-CG 3.98Å; W665-R719 HydrophobicContact CH2-CB 3.77Å; W665-R719 HydrophobicContact CH2-CG 4.23Å; W665-R719 HydrophobicContact CZ2-CB 4.42Å; W665-R719 HydrophobicContact CZ2-CG 4.41Å; W665-R719 HydrophobicContact CZ3-CB 3.43Å; W665-R719 VanDerWaalsContact CZ3-CB 3.43Å; W665-R719 HydrophobicContact CZ3-CG 4.01Å; W665-R719 VanDerWaalsContact CZ3-O 3.28Å; W665-R719 WeakPolarHBondContact CZ3-O 3.47Å; W665-I722 HydrophobicContact CB-CD1 4.14Å; W665-I722 HydrophobicContact CE3-CB 4.09Å; W665-I722 HydrophobicContact CE3-CD1 4.41Å; W665-I722 HydrophobicContact CE3-CG2 3.93Å; W665-T744 HydrophobicContact CG-CG2 4.37Å; W665-I747 HydrophobicContact CZ2-CG2 4.47Å; W665-I748 HydrophobicContact CB-CD1 4Å; W665-I748 HydrophobicContact CD2-CD1 3.87Å; W665-I748 HydrophobicContact CD2-CG1 3.6Å; W665-I748 HydrophobicContact CE3-CD1 4.04Å; W665-I748 HydrophobicContact CE3-CG1 3.8Å; W665-I748 HydrophobicContact CE3-CG2 4.35Å; W665-I748 HydrophobicContact CG-CD1 3.84Å; W665-I748 HydrophobicContact CG-CG1 3.97Å; W665-I748 HydrophobicContact CH2-CG1 4.15Å; W665-I748 HydrophobicContact CH2-CG2 4.41Å; W665-I748 HydrophobicContact CZ2-CG1 4.07Å; W665-I748 HydrophobicContact CZ3-CB 4.46Å; W665-I748 HydrophobicContact CZ3-CG1 4.03Å; W665-I748 HydrophobicContact CZ3-CG2 4.02Å; W665-Y751 AromaticContact CH2-CD2 3.31Å; W665-Y751 HydrophobicContact CH2-CD2 3.31Å; W665-Y751 AromaticContact CH2-CE2 3.89Å; W665-Y751 HydrophobicContact CH2-CE2 3.89Å; W665-Y751 AromaticContact CH2-CG 3.73Å; W665-Y751 HydrophobicContact CH2-CG 3.73Å; W665-Y751 HydrophobicContact CZ2-CD2 4.04Å; W665-Y751 HydrophobicContact CZ3-CD2 4.26Å; W665-Y751 HydrophobicContact CZ3-CG 4.43Å
666	R	95.9	Very high	94.8	Very high	55 Å²	55	37 Å²	37	21%	0.208	17%	0.173	C	C	.	.	H	α-helix	trans	-58.7	-37	178.7	-71.5	-172.7	-84.2	158.1	-17.2	112.6	I662 L664 K670 E740 D741 T744	I662-R666 PolarHBondContact O-N 2.76Å; I662-R666 VanDerWaalsContact O-N 3.07Å; L664-R666 PolarHBondContact O-N 3.05Å; R666-K670 WeakPolarHBondContact O-CB 2.74Å; R666-K670 PolarHBondContact O-N 2.94Å; R666-E740 IonicContact CZ-OE1 3.85Å; R666-E740 IonicContact CZ-OE2 2.76Å; R666-E740 IonicContact NH1-OE1 3.78Å; R666-E740 PolarHBondContact NH1-OE1 3.33Å; R666-E740 IonicContact NH1-OE2 3.48Å; R666-E740 PolarHBondContact NH1-OE2 2.68Å; R666-E740 IonicContact NH2-OE2 3.56Å; R666-D741 IonicContact CZ-OD1 3.02Å; R666-D741 IonicContact NH2-OD1 2.78Å; R666-D741 PolarHBondContact NH2-OD1 3.09Å; R666-T744 WeakPolarHBondContact CD-OG1 3.43Å; R666-T744 HydrophobicContact CG-CG2 3.79Å
667	K	94.8	Very high	94.7	Very high	83 Å²	83	39 Å²	39	36%	0.361	18%	0.184	S	C	.	.	H	α-helix	trans	-65.6	-46	175.6	-173.9	-173.5	174.4	-163.4	0	110.8	K621 K663 L664 W665 K670 E671	K621-K667 PolarHBondContact O-NZ 3.46Å; K663-K667 PolarHBondContact O-N 3.15Å; L664-K667 WeakPolarHBondContact O-CB 3.23Å; L664-K667 PolarHBondContact O-N 2.87Å; W665-K667 PolarHBondContact O-N 3.15Å; K667-K670 PolarHBondContact O-N 3.02Å; K667-E671 WeakPolarHBondContact CE-OE1 3.38Å; K667-E671 IonicContact NZ-OE1 3.34Å; K667-E671 WeakPolarHBondContact O-CG 3.34Å; K667-E671 PolarHBondContact O-N 3.01Å
668	E	94.6	Very high	94.3	Very high	17 Å²	17	48.2 Å²	48.2	8%	0.079	22%	0.224	C	C	.	.	H	α-helix	trans	-62.1	-46.7	178.5	-167.8	70.2	-177.3	0	0	111.7	L664 W665 K670 E671 L672 N717 I718 R719	L664-E668 PolarHBondContact O-N 3.5Å; W665-E668 WeakPolarHBondContact O-CB 3.28Å; W665-E668 PolarHBondContact O-N 3.21Å; W665-E668 VanDerWaalsContact O-N 3.09Å; E668-K670 VanDerWaalsContact C-N 3.26Å; E668-K670 PolarHBondContact O-N 3.28Å; E668-E671 PolarHBondContact O-N 3.11Å; E668-E671 VanDerWaalsContact O-N 3.08Å; E668-L672 HydrophobicContact CG-CD1 3.95Å; E668-L672 HydrophobicContact CG-CG 4.42Å; E668-L672 WeakPolarHBondContact O-CB 3.39Å; E668-L672 WeakPolarHBondContact O-CG 3.38Å; E668-L672 PolarHBondContact O-N 2.94Å; E668-N717 HydrophobicContact CG-CB 4.46Å; E668-N717 WeakPolarHBondContact OE1-CB 3.41Å; E668-I718 HydrophobicContact CB-CD1 4.25Å; E668-I718 HydrophobicContact CB-CG1 4.07Å; E668-I718 HydrophobicContact CG-CD1 4.42Å; E668-I718 HydrophobicContact CG-CG1 3.8Å; E668-R719 HydrophobicContact CG-CG 4.11Å
669	E	94.8	Very high	93.9	Very high	8 Å²	8	51.1 Å²	51.1	4%	0.037	24%	0.239	C	C	.	.	H	α-helix	trans	-57.1	-40.8	176	-77	-165.8	155.3	0	0	112.6	W665 L672 G673 V674 R676	W665-E669 PolarHBondContact NE1-OE1 3.39Å; W665-E669 PolarHBondContact O-N 3.17Å; E669-L672 PolarHBondContact O-N 3.33Å; E669-G673 PolarHBondContact O-N 3.34Å; E669-G673 VanDerWaalsContact O-N 3.09Å; E669-V674 HydrophobicContact CB-CB 4.09Å; E669-V674 HydrophobicContact CB-CG2 4.24Å; E669-V674 HydrophobicContact CG-CB 4.38Å; E669-V674 HydrophobicContact CG-CG2 4.3Å; E669-V674 PolarHBondContact O-N 2.92Å; E669-R676 VanDerWaalsContact CD-NH2 3.34Å; E669-R676 IonicContact OE1-CZ 2.74Å; E669-R676 IonicContact OE1-NE 2.7Å; E669-R676 IonicContact OE1-NH2 3.89Å; E669-R676 PolarHBondContact OE1-NH2 2.91Å; E669-R676 IonicContact OE2-CZ 2.91Å; E669-R676 IonicContact OE2-NE 2.66Å; E669-R676 PolarHBondContact OE2-NE 3.24Å; E669-R676 IonicContact OE2-NH2 2.73Å; E669-R676 PolarHBondContact OE2-NH2 2.98Å
670	K	93.8	Very high	93.6	Very high	178 Å²	178	51.8 Å²	51.8	77%	0.774	25%	0.246	S	C	*	.	H	α-helix	trans	-66.1	-38.8	176.8	-174.7	177.3	179.3	177.3	0	112.1	R666 K667 E668 G673	R666-K670 WeakPolarHBondContact O-CB 2.74Å; R666-K670 PolarHBondContact O-N 2.94Å; K667-K670 PolarHBondContact O-N 3.02Å; E668-K670 VanDerWaalsContact C-N 3.26Å; E668-K670 PolarHBondContact O-N 3.28Å; K670-G673 PolarHBondContact O-N 3.37Å
671	E	93.4	Very high	93.5	Very high	91 Å²	91	53.4 Å²	53.4	43%	0.425	25%	0.254	S	S	.	.	H	α-helix	trans	-68.3	-36.3	175.6	-72.5	-178.2	-162.8	0	0	112	K623 K667 E668 G673	K623-E671 IonicContact NZ-OE2 3.74Å; K623-E671 PolarHBondContact NZ-OE2 2.82Å; K667-E671 WeakPolarHBondContact CE-OE1 3.38Å; K667-E671 IonicContact NZ-OE1 3.34Å; K667-E671 WeakPolarHBondContact O-CG 3.34Å; K667-E671 PolarHBondContact O-N 3.01Å; E668-E671 PolarHBondContact O-N 3.11Å; E668-E671 VanDerWaalsContact O-N 3.08Å; E671-G673 VanDerWaalsContact C-N 3.26Å; E671-G673 PolarHBondContact O-N 2.61Å
672	L	93.2	Very high	93.4	Very high	41 Å²	41	54 Å²	54	22%	0.215	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.8	-2.3	176.9	-65.6	174.2	0	0	0	113.8	E668 E669 V674 T691 S692 N717	E668-L672 HydrophobicContact CG-CD1 3.95Å; E668-L672 HydrophobicContact CG-CG 4.42Å; E668-L672 WeakPolarHBondContact O-CB 3.39Å; E668-L672 WeakPolarHBondContact O-CG 3.38Å; E668-L672 PolarHBondContact O-N 2.94Å; E669-L672 PolarHBondContact O-N 3.33Å; L672-V674 HydrophobicContact CB-CG2 4.19Å; L672-V674 PolarHBondContact O-N 2.97Å; L672-T691 HydrophobicContact CB-CG2 3.85Å; L672-T691 HydrophobicContact CD1-CG2 4.3Å; L672-T691 HydrophobicContact CG-CG2 4.48Å; L672-T691 WeakPolarHBondContact O-CA 3.28Å; L672-T691 VanDerWaalsContact O-CB 3.32Å; L672-T691 WeakPolarHBondContact O-CB 3.16Å; L672-S692 PolarHBondContact O-N 3.13Å; L672-S692 PolarHBondContact O-OG 3.43Å; L672-N717 HydrophobicContact CD1-CB 4.21Å
673	G	94.3	Very high	93.2	Very high	32 Å²	32	58.3 Å²	58.3	33%	0.33	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	72.4	23.6	177.8	0	0	0	0	0	114.9	E669 K670 E671 K675	E669-G673 PolarHBondContact O-N 3.34Å; E669-G673 VanDerWaalsContact O-N 3.09Å; K670-G673 PolarHBondContact O-N 3.37Å; E671-G673 VanDerWaalsContact C-N 3.26Å; E671-G673 PolarHBondContact O-N 2.61Å; G673-K675 PolarHBondContact O-N 3.33Å
674	V	95	Very high	93	Very high	14 Å²	14	58.6 Å²	58.6	9%	0.085	29%	0.288	C	S	.	.			trans	-68.5	130.3	179.8	-176.4	0	0	0	0	110.4	E669 L672 R676 T691	E669-V674 HydrophobicContact CB-CB 4.09Å; E669-V674 HydrophobicContact CB-CG2 4.24Å; E669-V674 HydrophobicContact CG-CB 4.38Å; E669-V674 HydrophobicContact CG-CG2 4.3Å; E669-V674 PolarHBondContact O-N 2.92Å; L672-V674 HydrophobicContact CB-CG2 4.19Å; L672-V674 PolarHBondContact O-N 2.97Å; V674-R676 VanDerWaalsContact CG1-CZ 3.46Å; V674-T691 HydrophobicContact CG2-CG2 4.23Å
675	K	92.8	Very high	92.8	Very high	118 Å²	118	60 Å²	60	51%	0.513	30%	0.297	S	S	.	.			trans	-75.5	127	-177.1	-68.1	171.6	-176.8	156.5	0	111.6	G673 E695	G673-K675 PolarHBondContact O-N 3.33Å; K675-E695 WeakPolarHBondContact CE-OE1 3.44Å; K675-E695 IonicContact NZ-OE1 3.71Å; K675-E695 PolarHBondContact NZ-OE1 2.95Å; K675-E695 IonicContact NZ-OE2 3.53Å; K675-E695 PolarHBondContact NZ-OE2 2.93Å
676	R	93.6	Very high	92.4	Very high	56 Å²	56	65.8 Å²	65.8	21%	0.211	32%	0.322	C	S	.	.	B	Isolated β-bridge	trans	-136.3	152.8	178.3	-62.6	-72	171	-112.9	12.6	109.7	E669 V674 P688	E669-R676 VanDerWaalsContact CD-NH2 3.34Å; E669-R676 IonicContact OE1-CZ 2.74Å; E669-R676 IonicContact OE1-NE 2.7Å; E669-R676 IonicContact OE1-NH2 3.89Å; E669-R676 PolarHBondContact OE1-NH2 2.91Å; E669-R676 IonicContact OE2-CZ 2.91Å; E669-R676 IonicContact OE2-NE 2.66Å; E669-R676 PolarHBondContact OE2-NE 3.24Å; E669-R676 IonicContact OE2-NH2 2.73Å; E669-R676 PolarHBondContact OE2-NH2 2.98Å; V674-R676 VanDerWaalsContact CG1-CZ 3.46Å; R676-P688 VanDerWaalsContact CZ-O 3.28Å; R676-P688 PolarHBondContact NH1-O 3.16Å; R676-P688 PolarHBondContact NH2-O 3.37Å
677	D	91.8	Very high	92.1	Very high	49 Å²	49	67.4 Å²	67.4	26%	0.262	33%	0.331	S	S	.	.			trans	-79.6	-177.8	172.2	89.5	-20.9	0	0	0	111.7	N679 G680 M681 V683	D677-N679 PolarHBondContact O-N 3.36Å; D677-N679 VanDerWaalsContact O-N 3.16Å; D677-N679 VanDerWaalsContact OD1-C 3.3Å; D677-N679 WeakPolarHBondContact OD1-CA 3.29Å; D677-N679 PolarHBondContact OD1-N 3.39Å; D677-G680 PolarHBondContact O-N 3.01Å; D677-G680 VanDerWaalsContact O-N 3.16Å; D677-G680 PolarHBondContact OD1-N 3.43Å; D677-M681 PolarHBondContact N-O 3.33Å; D677-M681 WeakPolarHBondContact OD1-CB 3.15Å; D677-M681 PolarHBondContact OD1-N 3.42Å; D677-M681 WeakPolarHBondContact OD2-CE 3.44Å; D677-V683 HydrophobicContact CB-CG2 3.95Å
678	K	87.9	Confident	92	Very high	195 Å²	195	63.8 Å²	63.8	85%	0.848	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.3	-20.3	178.8	62.5	177.5	-179.1	179.9	0	114.6
679	N	86.8	Confident	91.9	Very high	62 Å²	62	63 Å²	63	33%	0.332	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.8	4.4	-178.4	-63.7	-25.5	0	0	0	112.2	D677 M681 I804	D677-N679 PolarHBondContact O-N 3.36Å; D677-N679 VanDerWaalsContact O-N 3.16Å; D677-N679 VanDerWaalsContact OD1-C 3.3Å; D677-N679 WeakPolarHBondContact OD1-CA 3.29Å; D677-N679 PolarHBondContact OD1-N 3.39Å; N679-M681 HydrophobicContact CB-CG 4.25Å; N679-I804 HydrophobicContact CB-CD1 3.65Å
680	G	88.4	Confident	91.7	Very high	17 Å²	17	63.8 Å²	63.8	18%	0.175	32%	0.315	C	S	.	.	S	Bend	trans	81	13.1	-177.4	0	0	0	0	0	114.9	D677	D677-G680 PolarHBondContact O-N 3.01Å; D677-G680 VanDerWaalsContact O-N 3.16Å; D677-G680 PolarHBondContact OD1-N 3.43Å
681	M	93.2	Very high	91.7	Very high	34 Å²	34	55.5 Å²	55.5	17%	0.167	28%	0.279	C	S	.	.			trans	-78.6	160.5	179.6	-57.3	-162.9	-69	0	0	113	D677 N679 V683 V743 Q800 I804	D677-M681 PolarHBondContact N-O 3.33Å; D677-M681 WeakPolarHBondContact OD1-CB 3.15Å; D677-M681 PolarHBondContact OD1-N 3.42Å; D677-M681 WeakPolarHBondContact OD2-CE 3.44Å; N679-M681 HydrophobicContact CB-CG 4.25Å; M681-V683 PolarHBondContact O-N 3.02Å; M681-V743 HydrophobicContact CG-CG1 4.17Å; M681-Q800 HydrophobicContact CG-CB 3.98Å; M681-Q800 HydrophobicContact SD-CB 3.86Å; M681-I804 HydrophobicContact CE-CD1 4.22Å; M681-I804 HydrophobicContact CG-CD1 3.72Å; M681-I804 HydrophobicContact SD-CD1 3.42Å; M681-I804 WeakPolarHBondContact SD-CD1 3.48Å
682	I	93.9	Very high	91.5	Very high	13 Å²	13	53.6 Å²	53.6	7%	0.067	28%	0.276	C	S	.	.	B	Isolated β-bridge	trans	-65.8	125.1	171.6	-63.6	172.2	0	0	0	109.5	D684 T685 P688 I747 F754 V796	I682-D684 VanDerWaalsContact CG2-O 3.25Å; I682-D684 WeakPolarHBondContact CG2-O 3.33Å; I682-T685 HydrophobicContact CG2-CG2 4.44Å; I682-P688 HydrophobicContact CD1-CB 4.03Å; I682-P688 HydrophobicContact CG1-CB 4.33Å; I682-P688 HydrophobicContact CG2-CB 4.07Å; I682-P688 HydrophobicContact CG2-CG 4.39Å; I682-I747 HydrophobicContact CD1-CG1 4.29Å; I682-I747 HydrophobicContact CG1-CD1 4.1Å; I682-I747 HydrophobicContact CG1-CG1 4.16Å; I682-F754 HydrophobicContact CD1-CE2 4.23Å; I682-F754 HydrophobicContact CD1-CZ 3.77Å; I682-V796 HydrophobicContact CD1-CB 3.92Å; I682-V796 HydrophobicContact CD1-CG1 3.5Å; I682-V796 VanDerWaalsContact CD1-CG1 3.5Å
683	V	90.8	Very high	91.3	Very high	91 Å²	91	56.9 Å²	56.9	55%	0.552	29%	0.289	S	S	*	.	S	Bend	trans	-91.6	-47.8	174.8	178.7	0	0	0	0	111	D677 M681	D677-V683 HydrophobicContact CB-CG2 3.95Å; M681-V683 PolarHBondContact O-N 3.02Å
684	D	91.5	Very high	91	Very high	71 Å²	71	55.8 Å²	55.8	38%	0.38	28%	0.275	S	S	.	.			trans	-104	109.4	177.9	-170.7	-21.6	0	0	0	109.9	I682 K686 K687 P688	I682-D684 VanDerWaalsContact CG2-O 3.25Å; I682-D684 WeakPolarHBondContact CG2-O 3.33Å; D684-K686 VanDerWaalsContact C-N 3.27Å; D684-K686 PolarHBondContact O-N 2.96Å; D684-K686 WeakPolarHBondContact OD1-CA 3.37Å; D684-K686 WeakPolarHBondContact OD1-CB 3.42Å; D684-K686 PolarHBondContact OD1-N 3.25Å; D684-K687 HydrophobicContact CB-CB 4.3Å; D684-K687 CarbonylContact O-C 3.59Å; D684-K687 PolarHBondContact O-N 3.47Å; D684-K687 PolarHBondContact OD1-N 3.34Å; D684-K687 VanDerWaalsContact OD1-N 3.11Å; D684-P688 WeakPolarHBondContact O-CA 3.26Å
685	T	91.3	Very high	90.7	Very high	34 Å²	34	59.9 Å²	59.9	21%	0.209	29%	0.293	C	S	.	.	S	Bend	trans	-73	-17.6	179.9	53.8	0	0	0	0	113.5	I682 K794 A797	I682-T685 HydrophobicContact CG2-CG2 4.44Å; T685-K794 HydrophobicContact CG2-CG 4.07Å; T685-A797 HydrophobicContact CG2-CB 4.24Å
686	K	88.2	Confident	90.4	Very high	122 Å²	122	61.7 Å²	61.7	53%	0.53	30%	0.304	S	S	.	.	S	Bend	trans	-86.5	-28.6	173.4	-67.4	-177.4	171.3	-173.6	0	112.3	D684 E790	D684-K686 VanDerWaalsContact C-N 3.27Å; D684-K686 PolarHBondContact O-N 2.96Å; D684-K686 WeakPolarHBondContact OD1-CA 3.37Å; D684-K686 WeakPolarHBondContact OD1-CB 3.42Å; D684-K686 PolarHBondContact OD1-N 3.25Å; K686-E790 WeakPolarHBondContact CE-OE1 3.29Å; K686-E790 WeakPolarHBondContact CE-OE2 3.49Å; K686-E790 HydrophobicContact CG-CG 3.82Å; K686-E790 IonicContact NZ-OE2 3.57Å
687	K	89.9	Confident	89.9	Confident	90 Å²	90	62.9 Å²	62.9	39%	0.391	31%	0.312	S	S	.	.	S	Bend	trans	-129.1	63.1	-177.3	-68	-172.1	177.4	-166.3	0	112.5	D684 L689 F690	D684-K687 HydrophobicContact CB-CB 4.3Å; D684-K687 CarbonylContact O-C 3.59Å; D684-K687 PolarHBondContact O-N 3.47Å; D684-K687 PolarHBondContact OD1-N 3.34Å; D684-K687 VanDerWaalsContact OD1-N 3.11Å; K687-L689 PolarHBondContact O-N 3.25Å; K687-F690 HydrophobicContact CB-CB 3.76Å; K687-F690 HydrophobicContact CB-CD2 4.41Å; K687-F690 HydrophobicContact CB-CG 4.13Å; K687-F690 HydrophobicContact CD-CB 4.46Å; K687-F690 HydrophobicContact CD-CD1 4.06Å; K687-F690 HydrophobicContact CD-CD2 4.09Å; K687-F690 HydrophobicContact CD-CE1 4.29Å; K687-F690 HydrophobicContact CD-CE2 4.32Å; K687-F690 HydrophobicContact CD-CG 3.96Å; K687-F690 HydrophobicContact CD-CZ 4.42Å; K687-F690 HydrophobicContact CG-CB 4.47Å; K687-F690 HydrophobicContact CG-CD2 4.26Å; K687-F690 HydrophobicContact CG-CG 4.32Å
688	P	92.3	Very high	89.1	Confident	6 Å²	6	69.5 Å²	69.5	4%	0.039	34%	0.338	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.6	-28.8	-169.8	-22.7	37	0	0	0	115	R676 I682 D684 F754	R676-P688 VanDerWaalsContact CZ-O 3.28Å; R676-P688 PolarHBondContact NH1-O 3.16Å; R676-P688 PolarHBondContact NH2-O 3.37Å; I682-P688 HydrophobicContact CD1-CB 4.03Å; I682-P688 HydrophobicContact CG1-CB 4.33Å; I682-P688 HydrophobicContact CG2-CB 4.07Å; I682-P688 HydrophobicContact CG2-CG 4.39Å; D684-P688 WeakPolarHBondContact O-CA 3.26Å; P688-F754 HydrophobicContact CB-CD1 4.07Å; P688-F754 HydrophobicContact CB-CD2 4.23Å; P688-F754 HydrophobicContact CB-CE1 4.15Å; P688-F754 HydrophobicContact CB-CE2 4.31Å; P688-F754 HydrophobicContact CB-CG 4.1Å; P688-F754 HydrophobicContact CB-CZ 4.26Å; P688-F754 HydrophobicContact CG-CD1 3.69Å; P688-F754 HydrophobicContact CG-CE1 3.82Å; P688-F754 HydrophobicContact CG-CG 4.17Å; P688-F754 HydrophobicContact CG-CZ 4.38Å
689	L	93.7	Very high	88.8	Confident	0 Å²	0	62.9 Å²	62.9	0%	0	31%	0.311	C	S	.	.	T	Hydrogen-bonded Turn	trans	-116.5	8	-174.5	-64.1	180	0	0	0	113.8	W665 K687 R719 I747 Y751 F754 K755 E758	W665-L689 HydrophobicContact CZ2-CD2 4.12Å; K687-L689 PolarHBondContact O-N 3.25Å; L689-R719 PolarHBondContact O-NH1 3.23Å; L689-I747 HydrophobicContact CD2-CG2 3.68Å; L689-Y751 HydrophobicContact CD1-CD2 3.38Å; L689-Y751 HydrophobicContact CD1-CE2 3.79Å; L689-Y751 HydrophobicContact CD1-CG 4.46Å; L689-F754 HydrophobicContact CD1-CB 3.53Å; L689-F754 HydrophobicContact CD1-CD2 3.96Å; L689-F754 HydrophobicContact CD1-CG 4.23Å; L689-F754 HydrophobicContact CD2-CD2 4.44Å; L689-F754 HydrophobicContact CG-CB 3.92Å; L689-F754 HydrophobicContact CG-CD2 3.98Å; L689-F754 HydrophobicContact CG-CG 4.31Å; L689-K755 HydrophobicContact CD1-CG 4.27Å; L689-E758 WeakPolarHBondContact CB-OE1 3.36Å
690	F	90.7	Very high	88.5	Confident	25 Å²	25	65.7 Å²	65.7	11%	0.11	32%	0.324	C	S	.	.			trans	-67	130.8	-170.4	-149.8	-101.8	0	0	0	110.6	K687 Q694 E695 E758	K687-F690 HydrophobicContact CB-CB 3.76Å; K687-F690 HydrophobicContact CB-CD2 4.41Å; K687-F690 HydrophobicContact CB-CG 4.13Å; K687-F690 HydrophobicContact CD-CB 4.46Å; K687-F690 HydrophobicContact CD-CD1 4.06Å; K687-F690 HydrophobicContact CD-CD2 4.09Å; K687-F690 HydrophobicContact CD-CE1 4.29Å; K687-F690 HydrophobicContact CD-CE2 4.32Å; K687-F690 HydrophobicContact CD-CG 3.96Å; K687-F690 HydrophobicContact CD-CZ 4.42Å; K687-F690 HydrophobicContact CG-CB 4.47Å; K687-F690 HydrophobicContact CG-CD2 4.26Å; K687-F690 HydrophobicContact CG-CG 4.32Å; F690-Q694 HydrophobicContact CD1-CB 3.99Å; F690-Q694 HydrophobicContact CD2-CB 4.29Å; F690-Q694 VanDerWaalsContact CE1-C 3.44Å; F690-Q694 HydrophobicContact CE1-CB 3.62Å; F690-Q694 WeakPolarHBondContact CE1-O 3.32Å; F690-Q694 HydrophobicContact CE2-CB 3.95Å; F690-Q694 HydrophobicContact CG-CB 4.31Å; F690-Q694 HydrophobicContact CZ-CB 3.6Å; F690-Q694 WeakPolarHBondContact CZ-O 3.14Å; F690-E695 HydrophobicContact CD1-CG 3.59Å; F690-E695 HydrophobicContact CE1-CB 4.38Å; F690-E695 HydrophobicContact CE1-CG 3.65Å; F690-E758 HydrophobicContact CD2-CG 4.41Å; F690-E758 PolarHBondContact N-OE1 3.11Å
691	T	92.6	Very high	88.2	Confident	4 Å²	4	67.3 Å²	67.3	3%	0.025	33%	0.332	C	S	.	.			trans	-93	161.5	-174	64.1	0	0	0	0	111.5	L672 V674 F693 Q694 E695	L672-T691 HydrophobicContact CB-CG2 3.85Å; L672-T691 HydrophobicContact CD1-CG2 4.3Å; L672-T691 HydrophobicContact CG-CG2 4.48Å; L672-T691 WeakPolarHBondContact O-CA 3.28Å; L672-T691 VanDerWaalsContact O-CB 3.32Å; L672-T691 WeakPolarHBondContact O-CB 3.16Å; V674-T691 HydrophobicContact CG2-CG2 4.23Å; T691-F693 PolarHBondContact O-N 3.35Å; T691-Q694 PolarHBondContact O-N 3.35Å; T691-Q694 WeakPolarHBondContact OG1-CB 3.32Å; T691-Q694 VanDerWaalsContact OG1-CG 3.31Å; T691-Q694 WeakPolarHBondContact OG1-CG 3.37Å; T691-Q694 PolarHBondContact OG1-N 3.44Å; T691-Q694 PolarHBondContact OG1-OE1 3.08Å; T691-E695 PolarHBondContact O-N 3.28Å; T691-E695 VanDerWaalsContact O-N 3.17Å
692	S	90.8	Very high	87.5	Confident	52 Å²	52	68.9 Å²	68.9	36%	0.364	34%	0.34	S	S	.	.	H	α-helix	trans	-62	-33.9	174.4	57.4	0	0	0	0	112	L672 E695 E696	L672-S692 PolarHBondContact O-N 3.13Å; L672-S692 PolarHBondContact O-OG 3.43Å; S692-E695 WeakPolarHBondContact O-CB 3.49Å; S692-E695 PolarHBondContact O-N 3.38Å; S692-E696 PolarHBondContact O-N 2.85Å; S692-E696 VanDerWaalsContact O-N 3.16Å
693	F	88.4	Confident	87	Confident	109 Å²	109	72.4 Å²	72.4	48%	0.478	36%	0.364	S	S	.	.	H	α-helix	trans	-63.5	-44.5	175.7	179.9	-101.7	0	0	0	112.2	T691 E695 E696 Q697 V709	T691-F693 PolarHBondContact O-N 3.35Å; F693-E695 PolarHBondContact O-N 3.49Å; F693-E696 PolarHBondContact O-N 3.48Å; F693-Q697 HydrophobicContact CD1-CG 4.38Å; F693-Q697 VanDerWaalsContact CE1-CD 3.45Å; F693-Q697 HydrophobicContact CE1-CG 4.03Å; F693-Q697 HydrophobicContact CE2-CG 4.33Å; F693-Q697 VanDerWaalsContact CZ-CD 3.47Å; F693-Q697 HydrophobicContact CZ-CG 4.04Å; F693-Q697 PolarHBondContact O-N 3.12Å; F693-V709 HydrophobicContact CD1-CG1 4.5Å; F693-V709 HydrophobicContact CE1-CG1 4.36Å
694	Q	88.6	Confident	86.3	Confident	10 Å²	10	73.1 Å²	73.1	5%	0.047	38%	0.379	C	S	.	.	H	α-helix	trans	-65.4	-24.9	174.8	-73.4	169.1	-65.8	0	0	112.8	F690 T691 V709 E758	F690-Q694 HydrophobicContact CD1-CB 3.99Å; F690-Q694 HydrophobicContact CD2-CB 4.29Å; F690-Q694 VanDerWaalsContact CE1-C 3.44Å; F690-Q694 HydrophobicContact CE1-CB 3.62Å; F690-Q694 WeakPolarHBondContact CE1-O 3.32Å; F690-Q694 HydrophobicContact CE2-CB 3.95Å; F690-Q694 HydrophobicContact CG-CB 4.31Å; F690-Q694 HydrophobicContact CZ-CB 3.6Å; F690-Q694 WeakPolarHBondContact CZ-O 3.14Å; T691-Q694 PolarHBondContact O-N 3.35Å; T691-Q694 WeakPolarHBondContact OG1-CB 3.32Å; T691-Q694 VanDerWaalsContact OG1-CG 3.31Å; T691-Q694 WeakPolarHBondContact OG1-CG 3.37Å; T691-Q694 PolarHBondContact OG1-N 3.44Å; T691-Q694 PolarHBondContact OG1-OE1 3.08Å; Q694-V709 HydrophobicContact CG-CG1 3.67Å; Q694-E758 PolarHBondContact NE2-OE2 2.94Å
695	E	87.1	Confident	86	Confident	99 Å²	99	77.3 Å²	77.3	46%	0.463	40%	0.402	S	S	.	.	H	α-helix	trans	-73.9	-36.1	173.1	-68.8	-171.9	170.6	0	0	112.7	K675 F690 T691 S692 F693	K675-E695 WeakPolarHBondContact CE-OE1 3.44Å; K675-E695 IonicContact NZ-OE1 3.71Å; K675-E695 PolarHBondContact NZ-OE1 2.95Å; K675-E695 IonicContact NZ-OE2 3.53Å; K675-E695 PolarHBondContact NZ-OE2 2.93Å; F690-E695 HydrophobicContact CD1-CG 3.59Å; F690-E695 HydrophobicContact CE1-CB 4.38Å; F690-E695 HydrophobicContact CE1-CG 3.65Å; T691-E695 PolarHBondContact O-N 3.28Å; T691-E695 VanDerWaalsContact O-N 3.17Å; S692-E695 WeakPolarHBondContact O-CB 3.49Å; S692-E695 PolarHBondContact O-N 3.38Å; F693-E695 PolarHBondContact O-N 3.49Å
696	E	86.9	Confident	85.7	Confident	156 Å²	156	78.7 Å²	78.7	73%	0.729	41%	0.412	S	S	*	.	H	α-helix	trans	-75.7	-34.6	179.1	-70.6	176.6	-174	0	0	112.2	S692 F693 K698	S692-E696 PolarHBondContact O-N 2.85Å; S692-E696 VanDerWaalsContact O-N 3.16Å; F693-E696 PolarHBondContact O-N 3.48Å; E696-K698 PolarHBondContact O-N 2.85Å
697	Q	82.6	Confident	85.6	Confident	81 Å²	81	76.3 Å²	76.3	38%	0.379	41%	0.409	S	S	.	.	S	Bend	trans	-73.8	124.4	177.5	-70.4	-151.7	-23.4	0	0	111.6	F693 I699	F693-Q697 HydrophobicContact CD1-CG 4.38Å; F693-Q697 VanDerWaalsContact CE1-CD 3.45Å; F693-Q697 HydrophobicContact CE1-CG 4.03Å; F693-Q697 HydrophobicContact CE2-CG 4.33Å; F693-Q697 VanDerWaalsContact CZ-CD 3.47Å; F693-Q697 HydrophobicContact CZ-CG 4.04Å; F693-Q697 PolarHBondContact O-N 3.12Å; Q697-I699 PolarHBondContact O-N 3.35Å
698	K	76.2	Confident	85.5	Confident	188 Å²	188	73 Å²	73	82%	0.817	40%	0.397	S	S	*	.	P	Polyproline II helix	trans	-73.3	126.7	165.2	-69.8	-176.7	-179.3	179	0	108.4	E696 M700	E696-K698 PolarHBondContact O-N 2.85Å; K698-M700 PolarHBondContact O-N 3.12Å
699	I	80.2	Confident	85.4	Confident	56 Å²	56	74.2 Å²	74.2	29%	0.287	40%	0.404	S	S	.	.	P	Polyproline II helix	trans	-56.1	127.1	168.6	-62.6	164.6	0	0	0	107	Q697 E762 E765 E766 L769	Q697-I699 PolarHBondContact O-N 3.35Å; I699-E762 HydrophobicContact CD1-CG 4.36Å; I699-E765 HydrophobicContact CB-CB 4.3Å; I699-E765 HydrophobicContact CD1-CB 3.72Å; I699-E765 HydrophobicContact CD1-CG 3.76Å; I699-E765 HydrophobicContact CG2-CB 4.02Å; I699-E766 HydrophobicContact CG2-CG 3.83Å; I699-L769 WeakPolarHBondContact O-CD1 3.35Å
700	M	81.4	Confident	85.2	Confident	121 Å²	121	74.2 Å²	74.2	60%	0.596	41%	0.405	S	S	*	.			trans	-127.6	141.1	177.3	64.7	-177.4	72	0	0	107.9	K698 L702	K698-M700 PolarHBondContact O-N 3.12Å; M700-L702 HydrophobicContact CG-CD2 4.18Å; M700-L702 HydrophobicContact CG-CG 4.44Å; M700-L702 PolarHBondContact O-N 3.17Å
701	P	81.4	Confident	85.1	Confident	52 Å²	52	76.1 Å²	76.1	34%	0.338	42%	0.418	S	S	.	.			trans	-61.3	125.3	176.5	-18.7	30.6	0	0	0	110.4	L769 E770	P701-L769 HydrophobicContact CG-CB 4.11Å; P701-E770 HydrophobicContact CB-CG 3.75Å; P701-E770 VanDerWaalsContact CB-OE1 3.22Å; P701-E770 WeakPolarHBondContact CB-OE1 3.34Å; P701-E770 HydrophobicContact CG-CG 3.56Å
702	L	79.4	Confident	85	Confident	66 Å²	66	79.9 Å²	79.9	35%	0.346	44%	0.437	S	S	.	.			trans	-108.9	152	179.7	-68.9	171.7	0	0	0	110.7	M700 C706	M700-L702 HydrophobicContact CG-CD2 4.18Å; M700-L702 HydrophobicContact CG-CG 4.44Å; M700-L702 PolarHBondContact O-N 3.17Å; L702-C706 HydrophobicContact CB-CB 4.11Å
703	P	82.2	Confident	85	Confident	87 Å²	87	78.1 Å²	78.1	57%	0.565	42%	0.423	S	S	*	.			trans	-57.6	148.6	170.1	-21.7	32.4	0	0	0	111.5	N705 C706	P703-N705 PolarHBondContact O-N 3.4Å; P703-C706 WeakPolarHBondContact O-CB 3.39Å; P703-C706 PolarHBondContact O-N 3.43Å
704	A	77.4	Confident	85.1	Confident	106 Å²	106	75 Å²	75	88%	0.876	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.1	-19	-177.7	0	0	0	0	0	115.4
705	N	84.7	Confident	85	Confident	159 Å²	159	78.2 Å²	78.2	85%	0.85	44%	0.441	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.3	-3.5	178.6	-63.2	-12.2	0	0	0	113.3	P703	P703-N705 PolarHBondContact O-N 3.4Å
706	C	84.3	Confident	85	Confident	63 Å²	63	80 Å²	80	43%	0.426	45%	0.45	S	S	.	.	S	Bend	trans	-97.4	130.4	-179.9	-68.8	0	0	0	0	110.1	L702 P703	L702-C706 HydrophobicContact CB-CB 4.11Å; P703-C706 WeakPolarHBondContact O-CB 3.39Å; P703-C706 PolarHBondContact O-N 3.43Å
707	P	87.2	Confident	85.1	Confident	73 Å²	73	72.8 Å²	72.8	47%	0.474	42%	0.416	S	S	.	.	P	Polyproline II helix	trans	-65.5	140.7	173.9	28.6	-33.6	0	0	0	110.2	V711 M712	P707-V711 HydrophobicContact CB-CB 4.15Å; P707-V711 HydrophobicContact CB-CG1 3.86Å; P707-M712 HydrophobicContact CB-CG 4.14Å; P707-M712 HydrophobicContact CG-CG 3.95Å; P707-M712 HydrophobicContact CG-SD 4.47Å
708	S	87.9	Confident	85.6	Confident	19 Å²	19	69.7 Å²	69.7	13%	0.133	40%	0.402	C	S	.	.	P	Polyproline II helix	trans	-72.8	167.1	174.5	81.4	0	0	0	0	111.6	A710 V711 M712 E762	S708-A710 VanDerWaalsContact C-N 3.32Å; S708-A710 PolarHBondContact O-N 2.97Å; S708-V711 WeakPolarHBondContact O-CB 3.4Å; S708-V711 PolarHBondContact O-N 2.99Å; S708-M712 PolarHBondContact O-N 2.88Å; S708-E762 WeakPolarHBondContact CB-OE2 3.44Å; S708-E762 PolarHBondContact OG-OE2 3.34Å
709	V	88.9	Confident	86.5	Confident	32 Å²	32	60.7 Å²	60.7	19%	0.194	36%	0.363	C	S	.	.	H	α-helix	trans	-61.4	-40.9	-178.3	-173.4	0	0	0	0	111.1	F693 Q694 V711 M712 D713	F693-V709 HydrophobicContact CD1-CG1 4.5Å; F693-V709 HydrophobicContact CE1-CG1 4.36Å; Q694-V709 HydrophobicContact CG-CG1 3.67Å; V709-V711 VanDerWaalsContact C-N 3.3Å; V709-V711 PolarHBondContact O-N 2.8Å; V709-M712 PolarHBondContact O-N 3.43Å; V709-D713 PolarHBondContact O-N 3.33Å
710	A	89.9	Confident	87.2	Confident	1 Å²	1	59.1 Å²	59.1	1%	0.008	36%	0.358	C	S	.	.	H	α-helix	trans	-61.2	-36	174.1	0	0	0	0	0	112.9	S708 V714 E758 I759 E762	S708-A710 VanDerWaalsContact C-N 3.32Å; S708-A710 PolarHBondContact O-N 2.97Å; A710-V714 WeakPolarHBondContact O-CG2 3.4Å; A710-V714 PolarHBondContact O-N 2.96Å; A710-E758 HydrophobicContact CB-CB 3.86Å; A710-I759 HydrophobicContact CB-CG1 3.78Å; A710-E762 VanDerWaalsContact CB-OE1 3.31Å; A710-E762 WeakPolarHBondContact CB-OE1 3.41Å; A710-E762 WeakPolarHBondContact CB-OE2 3.43Å; A710-E762 PolarHBondContact N-OE1 3.05Å; A710-E762 PolarHBondContact N-OE2 2.96Å
711	V	90.1	Very high	87.9	Confident	65 Å²	65	55.5 Å²	55.5	39%	0.394	34%	0.339	S	S	.	.	H	α-helix	trans	-71.1	-44	176.3	175.6	0	0	0	0	111	P707 S708 V709 D713 V714 A715 I759	P707-V711 HydrophobicContact CB-CB 4.15Å; P707-V711 HydrophobicContact CB-CG1 3.86Å; S708-V711 WeakPolarHBondContact O-CB 3.4Å; S708-V711 PolarHBondContact O-N 2.99Å; V709-V711 VanDerWaalsContact C-N 3.3Å; V709-V711 PolarHBondContact O-N 2.8Å; V711-D713 VanDerWaalsContact C-N 3.3Å; V711-D713 PolarHBondContact O-N 3.33Å; V711-V714 PolarHBondContact O-N 3.03Å; V711-A715 PolarHBondContact O-N 2.68Å; V711-I759 HydrophobicContact CG2-CD1 3.88Å; V711-I759 HydrophobicContact CG2-CG1 4.24Å
712	M	89.8	Confident	88.6	Confident	83 Å²	83	53 Å²	53	41%	0.409	32%	0.323	S	S	.	.	H	α-helix	trans	-59.1	-42.4	175.8	-71.3	-171.1	61.1	0	0	111.6	P707 S708 V709 V714 A715 E716	P707-M712 HydrophobicContact CB-CG 4.14Å; P707-M712 HydrophobicContact CG-CG 3.95Å; P707-M712 HydrophobicContact CG-SD 4.47Å; S708-M712 PolarHBondContact O-N 2.88Å; V709-M712 PolarHBondContact O-N 3.43Å; M712-V714 VanDerWaalsContact C-N 3.27Å; M712-V714 PolarHBondContact O-N 3.02Å; M712-A715 PolarHBondContact O-N 3.4Å; M712-E716 WeakPolarHBondContact CE-OE1 3.39Å; M712-E716 WeakPolarHBondContact O-CG 3.46Å; M712-E716 PolarHBondContact O-N 3.47Å; M712-E716 VanDerWaalsContact O-N 3.09Å
713	D	90.4	Very high	89.4	Confident	14 Å²	14	52.7 Å²	52.7	8%	0.075	32%	0.317	C	S	.	.	H	α-helix	trans	-58.4	-36.1	177.3	171.8	81.6	0	0	0	112.8	V709 V711 A715 N717 R719 K755	V709-D713 PolarHBondContact O-N 3.33Å; V711-D713 VanDerWaalsContact C-N 3.3Å; V711-D713 PolarHBondContact O-N 3.33Å; D713-A715 VanDerWaalsContact C-N 3.3Å; D713-A715 PolarHBondContact O-N 3.35Å; D713-N717 VanDerWaalsContact CG-ND2 3.28Å; D713-N717 PolarHBondContact O-ND2 2.95Å; D713-N717 PolarHBondContact OD1-ND2 3.34Å; D713-N717 PolarHBondContact OD2-ND2 2.67Å; D713-R719 IonicContact OD1-NH2 2.83Å; D713-R719 PolarHBondContact OD1-NH2 2.87Å; D713-R719 IonicContact OD2-CZ 2.79Å; D713-R719 IonicContact OD2-NH2 3.47Å; D713-R719 PolarHBondContact OD2-NH2 2.84Å; D713-K755 VanDerWaalsContact OD2-CE 3.26Å; D713-K755 WeakPolarHBondContact OD2-CE 3.34Å; D713-K755 IonicContact OD2-NZ 2.93Å; D713-K755 PolarHBondContact OD2-NZ 2.75Å
714	V	91	Very high	90	Very high	45 Å²	45	50 Å²	50	27%	0.273	30%	0.302	S	S	.	.	H	α-helix	trans	-63.6	-37	176.7	175.6	0	0	0	0	111.6	A710 V711 M712 A720 K755	A710-V714 WeakPolarHBondContact O-CG2 3.4Å; A710-V714 PolarHBondContact O-N 2.96Å; V711-V714 PolarHBondContact O-N 3.03Å; M712-V714 VanDerWaalsContact C-N 3.27Å; M712-V714 PolarHBondContact O-N 3.02Å; V714-A720 HydrophobicContact CG1-CB 3.87Å; V714-K755 HydrophobicContact CG2-CB 4.37Å; V714-K755 HydrophobicContact CG2-CD 3.84Å; V714-K755 HydrophobicContact CG2-CG 4Å
715	A	85.9	Confident	90.9	Very high	76 Å²	76	44.9 Å²	44.9	63%	0.628	26%	0.26	S	S	*	.	H	α-helix	trans	-78.1	-33.6	-177.8	0	0	0	0	0	113.1	V711 M712 D713	V711-A715 PolarHBondContact O-N 2.68Å; M712-A715 PolarHBondContact O-N 3.4Å; D713-A715 VanDerWaalsContact C-N 3.3Å; D713-A715 PolarHBondContact O-N 3.35Å
716	E	86.3	Confident	91.4	Very high	138 Å²	138	37.3 Å²	37.3	65%	0.645	22%	0.22	S	C	*	.	H	α-helix	trans	-84.8	-20.7	-168.8	-71.9	-178.3	178.7	0	0	114.8	M712	M712-E716 WeakPolarHBondContact CE-OE1 3.39Å; M712-E716 WeakPolarHBondContact O-CG 3.46Å; M712-E716 PolarHBondContact O-N 3.47Å; M712-E716 VanDerWaalsContact O-N 3.09Å
717	N	89.8	Confident	91.8	Very high	4 Å²	4	36.2 Å²	36.2	2%	0.021	22%	0.219	C	C	.	.	S	Bend	trans	-114.3	172	-174.5	72.8	49.8	0	0	0	113.6	E668 L672 D713 R719	E668-N717 HydrophobicContact CG-CB 4.46Å; E668-N717 WeakPolarHBondContact OE1-CB 3.41Å; L672-N717 HydrophobicContact CD1-CB 4.21Å; D713-N717 VanDerWaalsContact CG-ND2 3.28Å; D713-N717 PolarHBondContact O-ND2 2.95Å; D713-N717 PolarHBondContact OD1-ND2 3.34Å; D713-N717 PolarHBondContact OD2-ND2 2.67Å; N717-R719 PolarHBondContact ND2-NE 3.4Å; N717-R719 VanDerWaalsContact ND2-NE 3.15Å; N717-R719 PolarHBondContact ND2-NH2 3.46Å; N717-R719 WeakPolarHBondContact OD1-CB 3.5Å; N717-R719 WeakPolarHBondContact OD1-CG 3.05Å; N717-R719 PolarHBondContact OD1-N 3.4Å
718	I	94	Very high	92	Very high	15 Å²	15	37.9 Å²	37.9	8%	0.077	22%	0.219	C	C	.	.	S	Bend	trans	-84.4	-7.5	-178.6	65.5	173.7	0	0	0	113.8	N627 L630 L664 E668 A720 K721 I722	N627-I718 HydrophobicContact CB-CG2 4.11Å; L630-I718 HydrophobicContact CD1-CB 3.73Å; L630-I718 HydrophobicContact CD1-CD1 4.15Å; L630-I718 HydrophobicContact CD1-CG1 4.41Å; L630-I718 HydrophobicContact CD1-CG2 4.14Å; L664-I718 HydrophobicContact CB-CD1 4.35Å; E668-I718 HydrophobicContact CB-CD1 4.25Å; E668-I718 HydrophobicContact CB-CG1 4.07Å; E668-I718 HydrophobicContact CG-CD1 4.42Å; E668-I718 HydrophobicContact CG-CG1 3.8Å; I718-A720 PolarHBondContact O-N 2.9Å; I718-K721 PolarHBondContact O-N 3.42Å; I718-I722 HydrophobicContact CD1-CD1 3.91Å; I718-I722 HydrophobicContact CG1-CD1 3.94Å; I718-I722 WeakPolarHBondContact O-CG1 3.45Å; I718-I722 PolarHBondContact O-N 3.42Å
719	R	95.3	Very high	92.1	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-62.2	-46.5	-172.1	-63.7	-172	-74.3	-178.4	-7.7	111.4	W665 E668 L689 D713 N717 K721 I722 Y723 Y751	W665-R719 HydrophobicContact CD2-CG 4.25Å; W665-R719 HydrophobicContact CE3-CB 3.84Å; W665-R719 HydrophobicContact CE3-CG 3.98Å; W665-R719 HydrophobicContact CH2-CB 3.77Å; W665-R719 HydrophobicContact CH2-CG 4.23Å; W665-R719 HydrophobicContact CZ2-CB 4.42Å; W665-R719 HydrophobicContact CZ2-CG 4.41Å; W665-R719 HydrophobicContact CZ3-CB 3.43Å; W665-R719 VanDerWaalsContact CZ3-CB 3.43Å; W665-R719 HydrophobicContact CZ3-CG 4.01Å; W665-R719 VanDerWaalsContact CZ3-O 3.28Å; W665-R719 WeakPolarHBondContact CZ3-O 3.47Å; E668-R719 HydrophobicContact CG-CG 4.11Å; L689-R719 PolarHBondContact O-NH1 3.23Å; D713-R719 IonicContact OD1-NH2 2.83Å; D713-R719 PolarHBondContact OD1-NH2 2.87Å; D713-R719 IonicContact OD2-CZ 2.79Å; D713-R719 IonicContact OD2-NH2 3.47Å; D713-R719 PolarHBondContact OD2-NH2 2.84Å; N717-R719 PolarHBondContact ND2-NE 3.4Å; N717-R719 VanDerWaalsContact ND2-NE 3.15Å; N717-R719 PolarHBondContact ND2-NH2 3.46Å; N717-R719 WeakPolarHBondContact OD1-CB 3.5Å; N717-R719 WeakPolarHBondContact OD1-CG 3.05Å; N717-R719 PolarHBondContact OD1-N 3.4Å; R719-K721 VanDerWaalsContact C-N 3.26Å; R719-K721 PolarHBondContact O-N 2.73Å; R719-I722 PolarHBondContact O-N 2.9Å; R719-Y723 WeakPolarHBondContact O-CB 3.4Å; R719-Y723 PolarHBondContact O-N 3.27Å; R719-Y751 HydrophobicContact CB-CE2 3.9Å
720	A	94.9	Very high	92	Very high	23 Å²	23	39 Å²	39	19%	0.19	22%	0.222	C	C	.	.	H	α-helix	trans	-58.2	-38.5	177.9	0	0	0	0	0	112.7	V714 I718 Y723 A724 Y751	V714-A720 HydrophobicContact CG1-CB 3.87Å; I718-A720 PolarHBondContact O-N 2.9Å; A720-Y723 PolarHBondContact O-N 3.3Å; A720-A724 WeakPolarHBondContact O-CB 3.45Å; A720-A724 PolarHBondContact O-N 2.85Å; A720-Y751 HydrophobicContact CB-CE1 3.91Å
721	K	95.3	Very high	91.8	Very high	45 Å²	45	40.3 Å²	40.3	20%	0.196	23%	0.228	C	C	.	.	H	α-helix	trans	-70.9	-42.6	178.4	-55.6	-179.4	178.2	71.5	0	111.5	N627 L630 V634 I718 R719 Y723 A724 V725	N627-K721 WeakPolarHBondContact O-CD 3.32Å; N627-K721 WeakPolarHBondContact OD1-CE 3.38Å; N627-K721 PolarHBondContact OD1-NZ 3.43Å; L630-K721 HydrophobicContact CB-CB 3.77Å; L630-K721 HydrophobicContact CB-CD 4.05Å; V634-K721 HydrophobicContact CG2-CB 4.27Å; I718-K721 PolarHBondContact O-N 3.42Å; R719-K721 VanDerWaalsContact C-N 3.26Å; R719-K721 PolarHBondContact O-N 2.73Å; K721-Y723 VanDerWaalsContact C-N 3.33Å; K721-Y723 PolarHBondContact O-N 2.83Å; K721-A724 PolarHBondContact O-N 2.94Å; K721-V725 WeakPolarHBondContact O-CG2 3.43Å; K721-V725 PolarHBondContact O-N 3.1Å
722	I	96.4	Very high	91.3	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-59.8	-45.9	174.1	-67.8	170.5	0	0	0	110.7	L630 L661 L664 W665 I718 R719 V725 L726 I748	L630-I722 HydrophobicContact CD1-CD1 4.38Å; L630-I722 HydrophobicContact CD1-CG1 3.84Å; L630-I722 HydrophobicContact CD2-CG1 4.25Å; L661-I722 HydrophobicContact CB-CG2 4.15Å; L661-I722 HydrophobicContact CD2-CG1 4.45Å; L664-I722 HydrophobicContact CB-CD1 3.97Å; W665-I722 HydrophobicContact CB-CD1 4.14Å; W665-I722 HydrophobicContact CE3-CB 4.09Å; W665-I722 HydrophobicContact CE3-CD1 4.41Å; W665-I722 HydrophobicContact CE3-CG2 3.93Å; I718-I722 HydrophobicContact CD1-CD1 3.91Å; I718-I722 HydrophobicContact CG1-CD1 3.94Å; I718-I722 WeakPolarHBondContact O-CG1 3.45Å; I718-I722 PolarHBondContact O-N 3.42Å; R719-I722 PolarHBondContact O-N 2.9Å; I722-V725 PolarHBondContact O-N 2.88Å; I722-L726 HydrophobicContact CG2-CD1 3.82Å; I722-L726 HydrophobicContact CG2-CG 4.5Å; I722-L726 WeakPolarHBondContact O-CB 3.39Å; I722-L726 WeakPolarHBondContact O-CG 3.4Å; I722-L726 PolarHBondContact O-N 3.2Å; I722-I748 HydrophobicContact CG2-CD1 4.4Å
723	Y	96.3	Very high	90.8	Very high	58 Å²	58	46.9 Å²	46.9	23%	0.227	26%	0.257	C	S	.	.	H	α-helix	trans	-57.3	-49.2	175.6	167.7	-101.4	0	0	0	111.4	R719 A720 K721 V725 L726 G727 F731 I748 Y751 L752	R719-Y723 WeakPolarHBondContact O-CB 3.4Å; R719-Y723 PolarHBondContact O-N 3.27Å; A720-Y723 PolarHBondContact O-N 3.3Å; K721-Y723 VanDerWaalsContact C-N 3.33Å; K721-Y723 PolarHBondContact O-N 2.83Å; Y723-V725 PolarHBondContact O-N 3.27Å; Y723-L726 PolarHBondContact O-N 3.09Å; Y723-G727 PolarHBondContact O-N 3.22Å; Y723-F731 AromaticContact CD2-CZ 3.99Å; Y723-F731 HydrophobicContact CD2-CZ 3.99Å; Y723-F731 HydrophobicContact CE2-CE2 4.31Å; Y723-F731 HydrophobicContact CE2-CZ 4.04Å; Y723-I748 HydrophobicContact CD2-CG2 4.23Å; Y723-I748 WeakPolarHBondContact CD2-O 3.34Å; Y723-I748 WeakPolarHBondContact CE2-O 3.31Å; Y723-Y751 HydrophobicContact CD1-CD1 4.13Å; Y723-Y751 HydrophobicContact CD2-CD1 4.44Å; Y723-Y751 AromaticContact CG-CD1 3.88Å; Y723-Y751 HydrophobicContact CG-CD1 3.88Å; Y723-Y751 HydrophobicContact CG-CG 4.4Å; Y723-L752 HydrophobicContact CD1-CD1 4.41Å; Y723-L752 HydrophobicContact CD1-CG 4.19Å; Y723-L752 HydrophobicContact CE1-CD1 3.47Å; Y723-L752 VanDerWaalsContact CE1-CD1 3.47Å; Y723-L752 HydrophobicContact CE1-CD2 4.49Å; Y723-L752 HydrophobicContact CE1-CG 3.58Å
724	A	94.9	Very high	90.7	Very high	30 Å²	30	47 Å²	47	25%	0.248	26%	0.258	C	S	.	.	H	α-helix	trans	-61.4	-45.5	-180	0	0	0	0	0	112.3	V634 A720 K721 G727 K728	V634-A724 HydrophobicContact CG1-CB 4.18Å; V634-A724 HydrophobicContact CG2-CB 3.77Å; A720-A724 WeakPolarHBondContact O-CB 3.45Å; A720-A724 PolarHBondContact O-N 2.85Å; K721-A724 PolarHBondContact O-N 2.94Å; A724-G727 PolarHBondContact O-N 3.4Å; A724-K728 VanDerWaalsContact O-CG 3.29Å; A724-K728 WeakPolarHBondContact O-CG 3.45Å; A724-K728 PolarHBondContact O-N 3.39Å; A724-K728 VanDerWaalsContact O-N 3.1Å
725	V	95.2	Very high	90.5	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-61.4	-49.4	176.6	174.5	0	0	0	0	111	M633 V634 L661 K721 I722 Y723 G727 K728 L729	M633-V725 HydrophobicContact CB-CG2 3.79Å; M633-V725 HydrophobicContact CE-CG1 3.89Å; V634-V725 HydrophobicContact CG2-CG2 3.68Å; L661-V725 HydrophobicContact CD1-CB 4.32Å; L661-V725 HydrophobicContact CD1-CG1 3.63Å; K721-V725 WeakPolarHBondContact O-CG2 3.43Å; K721-V725 PolarHBondContact O-N 3.1Å; I722-V725 PolarHBondContact O-N 2.88Å; Y723-V725 PolarHBondContact O-N 3.27Å; V725-G727 VanDerWaalsContact C-N 3.3Å; V725-G727 PolarHBondContact O-N 2.81Å; V725-K728 PolarHBondContact O-N 3.42Å; V725-K728 VanDerWaalsContact O-N 3.16Å; V725-L729 HydrophobicContact CG1-CD1 4.03Å; V725-L729 HydrophobicContact CG1-CG 4.46Å; V725-L729 WeakPolarHBondContact O-CG 3.33Å; V725-L729 PolarHBondContact O-N 3.11Å; V725-L729 VanDerWaalsContact O-N 3.08Å
726	L	95.1	Very high	90.4	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-64	-35.6	179.5	-73.3	170.7	0	0	0	112.4	A658 L661 I662 I722 Y723 K728 L729 D730 F731 L734 L745 I748	A658-L726 HydrophobicContact CB-CD2 4.31Å; L661-L726 HydrophobicContact CB-CD1 4.43Å; L661-L726 HydrophobicContact CB-CD2 4.43Å; L661-L726 HydrophobicContact CB-CG 4.46Å; L661-L726 HydrophobicContact CD1-CD2 3.89Å; L661-L726 HydrophobicContact CD1-CG 4.05Å; I662-L726 HydrophobicContact CG1-CD1 4.29Å; I722-L726 HydrophobicContact CG2-CD1 3.82Å; I722-L726 HydrophobicContact CG2-CG 4.5Å; I722-L726 WeakPolarHBondContact O-CB 3.39Å; I722-L726 WeakPolarHBondContact O-CG 3.4Å; I722-L726 PolarHBondContact O-N 3.2Å; Y723-L726 PolarHBondContact O-N 3.09Å; L726-K728 VanDerWaalsContact C-N 3.3Å; L726-K728 PolarHBondContact O-N 3.28Å; L726-L729 PolarHBondContact O-N 3.21Å; L726-D730 PolarHBondContact O-N 3.43Å; L726-F731 HydrophobicContact CB-CD1 4.37Å; L726-F731 HydrophobicContact CB-CE1 3.7Å; L726-F731 HydrophobicContact CB-CZ 3.99Å; L726-L734 HydrophobicContact CD2-CD1 3.97Å; L726-L734 HydrophobicContact CD2-CD2 4.45Å; L726-L745 HydrophobicContact CD1-CD1 4.24Å; L726-I748 HydrophobicContact CD1-CD1 3.93Å; L726-I748 HydrophobicContact CD1-CG2 3.93Å
727	G	92.7	Very high	90.6	Very high	39 Å²	39	40.9 Å²	40.9	40%	0.402	23%	0.234	S	C	.	.	H	α-helix	trans	-62.4	-35.5	174	0	0	0	0	0	113.1	Y723 A724 V725 F731	Y723-G727 PolarHBondContact O-N 3.22Å; A724-G727 PolarHBondContact O-N 3.4Å; V725-G727 VanDerWaalsContact C-N 3.3Å; V725-G727 PolarHBondContact O-N 2.81Å; G727-F731 VanDerWaalsContact CA-CE2 3.47Å
728	K	91.4	Very high	90.6	Very high	108 Å²	108	43.1 Å²	43.1	47%	0.47	25%	0.25	S	S	.	.	H	α-helix	trans	-76.7	-25.3	175.6	-64	-82.7	-179.8	160.8	0	113.3	C637 D638 A724 V725 L726 D730	C637-K728 HydrophobicContact CB-CB 3.61Å; C637-K728 HydrophobicContact CB-CD 4.35Å; C637-K728 HydrophobicContact CB-CG 3.82Å; D638-K728 IonicContact OD1-NZ 2.82Å; D638-K728 PolarHBondContact OD1-NZ 3.22Å; A724-K728 VanDerWaalsContact O-CG 3.29Å; A724-K728 WeakPolarHBondContact O-CG 3.45Å; A724-K728 PolarHBondContact O-N 3.39Å; A724-K728 VanDerWaalsContact O-N 3.1Å; V725-K728 PolarHBondContact O-N 3.42Å; V725-K728 VanDerWaalsContact O-N 3.16Å; L726-K728 VanDerWaalsContact C-N 3.3Å; L726-K728 PolarHBondContact O-N 3.28Å; K728-D730 VanDerWaalsContact C-N 3.29Å
729	L	89.4	Confident	90.4	Very high	5 Å²	5	44.2 Å²	44.2	3%	0.026	26%	0.262	C	S	.	.	H	α-helix	trans	-81.9	-6.8	176.7	-66.8	175.3	0	0	0	114	V646 L661 V725 L726 L734	V646-L729 HydrophobicContact CB-CD2 3.81Å; V646-L729 HydrophobicContact CG1-CD1 3.67Å; V646-L729 HydrophobicContact CG1-CD2 3.77Å; V646-L729 HydrophobicContact CG1-CG 4.36Å; V646-L729 HydrophobicContact CG2-CD2 4.43Å; L661-L729 HydrophobicContact CD1-CD1 4.42Å; V725-L729 HydrophobicContact CG1-CD1 4.03Å; V725-L729 HydrophobicContact CG1-CG 4.46Å; V725-L729 WeakPolarHBondContact O-CG 3.33Å; V725-L729 PolarHBondContact O-N 3.11Å; V725-L729 VanDerWaalsContact O-N 3.08Å; L726-L729 PolarHBondContact O-N 3.21Å; L729-L734 HydrophobicContact CB-CD2 4.07Å
730	D	87.5	Confident	90.2	Very high	70 Å²	70	48.9 Å²	48.9	37%	0.374	28%	0.283	S	S	.	.			trans	68	117.3	-170.2	177.9	22.4	0	0	0	113.2	L726 K728 E732 N733 L734	L726-D730 PolarHBondContact O-N 3.43Å; K728-D730 VanDerWaalsContact C-N 3.29Å; D730-E732 PolarHBondContact O-N 2.98Å; D730-E732 PolarHBondContact OD1-N 3.31Å; D730-N733 PolarHBondContact OD2-ND2 3.08Å; D730-L734 WeakPolarHBondContact O-CD2 3.45Å; D730-L734 WeakPolarHBondContact O-CG 3.28Å
731	F	85.9	Confident	90.1	Very high	29 Å²	29	47.8 Å²	47.8	13%	0.127	27%	0.274	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-20.8	-177	-75.9	-77.8	0	0	0	113.4	Y723 L726 G727 L745 I748 H749	Y723-F731 AromaticContact CD2-CZ 3.99Å; Y723-F731 HydrophobicContact CD2-CZ 3.99Å; Y723-F731 HydrophobicContact CE2-CE2 4.31Å; Y723-F731 HydrophobicContact CE2-CZ 4.04Å; L726-F731 HydrophobicContact CB-CD1 4.37Å; L726-F731 HydrophobicContact CB-CE1 3.7Å; L726-F731 HydrophobicContact CB-CZ 3.99Å; G727-F731 VanDerWaalsContact CA-CE2 3.47Å; F731-L745 HydrophobicContact CD1-CD1 3.69Å; F731-L745 HydrophobicContact CD1-CG 4.18Å; F731-L745 HydrophobicContact CE1-CD1 4Å; F731-I748 HydrophobicContact CE1-CG2 4.09Å; F731-I748 HydrophobicContact CZ-CG2 4.42Å; F731-H749 HydrophobicContact CD1-CB 4.09Å; F731-H749 AromaticContact CD2-CD2 3.44Å; F731-H749 VanDerWaalsContact CD2-CD2 3.44Å; F731-H749 WeakPolarHBondContact CD2-CD2 3.41Å; F731-H749 AromaticContact CD2-NE2 3.98Å; F731-H749 HydrophobicContact CE1-CB 4.13Å; F731-H749 AromaticContact CE2-CD2 3.7Å; F731-H749 HydrophobicContact CG-CB 4.4Å; F731-H749 AromaticContact CG-CD2 3.79Å; F731-H749 HydrophobicContact CZ-CB 4.45Å
732	E	79.5	Confident	89.9	Confident	169 Å²	169	49.5 Å²	49.5	79%	0.79	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.4	-32	-173	-61.9	-172.4	173.2	0	0	113.2	D730	D730-E732 PolarHBondContact O-N 2.98Å; D730-E732 PolarHBondContact OD1-N 3.31Å
733	N	79.7	Confident	89.8	Confident	117 Å²	117	49.6 Å²	49.6	63%	0.626	28%	0.283	S	S	*	.	S	Bend	trans	-111	36.3	-166.5	-68.6	-60	0	0	0	113.9	D730	D730-N733 PolarHBondContact OD2-ND2 3.08Å
734	L	88.4	Confident	89.7	Confident	17 Å²	17	47 Å²	47	9%	0.089	27%	0.273	C	S	.	.			trans	-87.3	121	-175.4	-60.8	176.9	0	0	0	112.8	A658 L726 L729 D730 L737 L745	A658-L734 HydrophobicContact CB-CB 3.96Å; A658-L734 HydrophobicContact CB-CD1 4.16Å; A658-L734 HydrophobicContact CB-CD2 3.98Å; A658-L734 HydrophobicContact CB-CG 4.25Å; L726-L734 HydrophobicContact CD2-CD1 3.97Å; L726-L734 HydrophobicContact CD2-CD2 4.45Å; L729-L734 HydrophobicContact CB-CD2 4.07Å; D730-L734 WeakPolarHBondContact O-CD2 3.45Å; D730-L734 WeakPolarHBondContact O-CG 3.28Å; L734-L737 HydrophobicContact CB-CD1 3.71Å; L734-L737 HydrophobicContact CB-CG 4.16Å; L734-L737 HydrophobicContact CD1-CD1 4.18Å; L734-L745 HydrophobicContact CD1-CD1 3.93Å; L734-L745 HydrophobicContact CD1-CD2 3.97Å
735	P	86.4	Confident	89.7	Confident	41 Å²	41	46.1 Å²	46.1	27%	0.266	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.8	149.3	-176.1	31	-35	0	0	0	113.3	T656 L737	T656-P735 WeakPolarHBondContact CB-O 3.11Å; T656-P735 HydrophobicContact CG2-CG 4.4Å; T656-P735 WeakPolarHBondContact CG2-O 3.24Å; T656-P735 PolarHBondContact OG1-O 3.42Å; P735-L737 PolarHBondContact O-N 3.49Å
736	G	84.6	Confident	89.7	Confident	64 Å²	64	47.4 Å²	47.4	66%	0.66	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.5	22.8	164.7	0	0	0	0	0	115.6
737	L	90.7	Very high	89.7	Confident	24 Å²	24	47.4 Å²	47.4	13%	0.126	27%	0.273	C	S	.	.			trans	-78.5	137.5	178.4	-61.5	-170.5	0	0	0	111.8	A658 I662 L734 P735 D741 F742 L745	A658-L737 HydrophobicContact CB-CD2 3.86Å; I662-L737 HydrophobicContact CD1-CD1 4.15Å; I662-L737 HydrophobicContact CD1-CD2 3.66Å; L734-L737 HydrophobicContact CB-CD1 3.71Å; L734-L737 HydrophobicContact CB-CG 4.16Å; L734-L737 HydrophobicContact CD1-CD1 4.18Å; P735-L737 PolarHBondContact O-N 3.49Å; L737-D741 HydrophobicContact CB-CB 4.13Å; L737-D741 HydrophobicContact CD2-CB 4.11Å; L737-F742 HydrophobicContact CB-CD2 3.95Å; L737-F742 HydrophobicContact CB-CE1 4.34Å; L737-F742 HydrophobicContact CB-CE2 3.59Å; L737-F742 HydrophobicContact CB-CG 4.46Å; L737-F742 HydrophobicContact CB-CZ 3.81Å; L737-F742 HydrophobicContact CD1-CD1 4.18Å; L737-F742 HydrophobicContact CD1-CE1 3.9Å; L737-F742 HydrophobicContact CD1-CZ 4.13Å; L737-F742 HydrophobicContact CG-CZ 4.48Å; L737-L745 HydrophobicContact CD1-CD2 3.87Å
738	S	89.9	Confident	89.9	Confident	52 Å²	52	45.6 Å²	45.6	36%	0.364	25%	0.253	S	S	.	.			trans	-83.9	165.6	169.7	64.1	0	0	0	0	111.7	E740 D741 F742	S738-E740 PolarHBondContact O-N 3.17Å; S738-D741 PolarHBondContact N-OD2 3.48Å; S738-D741 VanDerWaalsContact N-OD2 3.11Å; S738-D741 WeakPolarHBondContact O-CA 3.41Å; S738-D741 WeakPolarHBondContact O-CB 3.37Å; S738-D741 PolarHBondContact O-N 2.82Å; S738-D741 PolarHBondContact OG-N 3.1Å; S738-D741 PolarHBondContact OG-OD2 3.44Å; S738-F742 VanDerWaalsContact O-CD2 3.29Å; S738-F742 WeakPolarHBondContact O-CD2 3.09Å; S738-F742 PolarHBondContact O-N 3Å
739	A	88	Confident	90	Very high	38 Å²	38	44.6 Å²	44.6	31%	0.314	25%	0.25	S	S	.	.	H	α-helix	trans	-55.6	-39.8	174.9	0	0	0	0	0	112.4	F742 V743 Q807	A739-F742 PolarHBondContact O-N 2.98Å; A739-V743 WeakPolarHBondContact O-CG2 3.36Å; A739-V743 PolarHBondContact O-N 3.22Å; A739-Q807 HydrophobicContact CB-CB 4.23Å; A739-Q807 HydrophobicContact CB-CG 3.79Å
740	E	91	Very high	90.3	Very high	97 Å²	97	48.3 Å²	48.3	45%	0.453	26%	0.264	S	S	.	.	H	α-helix	trans	-65.3	-37.3	174.8	-167.8	-170.2	-172.7	0	0	112.4	R666 S738 V743 T744	R666-E740 IonicContact CZ-OE1 3.85Å; R666-E740 IonicContact CZ-OE2 2.76Å; R666-E740 IonicContact NH1-OE1 3.78Å; R666-E740 PolarHBondContact NH1-OE1 3.33Å; R666-E740 IonicContact NH1-OE2 3.48Å; R666-E740 PolarHBondContact NH1-OE2 2.68Å; R666-E740 IonicContact NH2-OE2 3.56Å; S738-E740 PolarHBondContact O-N 3.17Å; E740-V743 PolarHBondContact O-N 3.4Å; E740-T744 PolarHBondContact O-N 3.26Å; E740-T744 VanDerWaalsContact O-N 3.15Å; E740-T744 PolarHBondContact O-OG1 3.33Å
741	D	93.3	Very high	90.7	Very high	1 Å²	1	45 Å²	45	1%	0.005	25%	0.246	C	C	.	.	H	α-helix	trans	-65.5	-42	175.5	-66.4	-40.6	0	0	0	110.8	S659 I662 R666 L737 S738 T744 L745	S659-D741 PolarHBondContact OG-OD2 2.71Å; S659-D741 VanDerWaalsContact OG-OD2 3.08Å; I662-D741 HydrophobicContact CD1-CB 4.02Å; I662-D741 HydrophobicContact CG2-CB 4.1Å; R666-D741 IonicContact CZ-OD1 3.02Å; R666-D741 IonicContact NH2-OD1 2.78Å; R666-D741 PolarHBondContact NH2-OD1 3.09Å; L737-D741 HydrophobicContact CB-CB 4.13Å; L737-D741 HydrophobicContact CD2-CB 4.11Å; S738-D741 PolarHBondContact N-OD2 3.48Å; S738-D741 VanDerWaalsContact N-OD2 3.11Å; S738-D741 WeakPolarHBondContact O-CA 3.41Å; S738-D741 WeakPolarHBondContact O-CB 3.37Å; S738-D741 PolarHBondContact O-N 2.82Å; S738-D741 PolarHBondContact OG-N 3.1Å; S738-D741 PolarHBondContact OG-OD2 3.44Å; D741-T744 PolarHBondContact O-N 3.32Å; D741-L745 WeakPolarHBondContact O-CB 3.32Å; D741-L745 PolarHBondContact O-N 3.05Å
742	F	91.8	Very high	91.1	Very high	80 Å²	80	47.2 Å²	47.2	35%	0.351	26%	0.259	S	S	.	.	H	α-helix	trans	-63.9	-41.3	175.8	-82.3	-67.4	0	0	0	113.2	L737 S738 A739 T744 L745 C746 M803	L737-F742 HydrophobicContact CB-CD2 3.95Å; L737-F742 HydrophobicContact CB-CE1 4.34Å; L737-F742 HydrophobicContact CB-CE2 3.59Å; L737-F742 HydrophobicContact CB-CG 4.46Å; L737-F742 HydrophobicContact CB-CZ 3.81Å; L737-F742 HydrophobicContact CD1-CD1 4.18Å; L737-F742 HydrophobicContact CD1-CE1 3.9Å; L737-F742 HydrophobicContact CD1-CZ 4.13Å; L737-F742 HydrophobicContact CG-CZ 4.48Å; S738-F742 VanDerWaalsContact O-CD2 3.29Å; S738-F742 WeakPolarHBondContact O-CD2 3.09Å; S738-F742 PolarHBondContact O-N 3Å; A739-F742 PolarHBondContact O-N 2.98Å; F742-T744 PolarHBondContact O-N 3.49Å; F742-L745 HydrophobicContact CD1-CD2 4.26Å; F742-L745 WeakPolarHBondContact O-CB 3.38Å; F742-L745 PolarHBondContact O-N 2.65Å; F742-L745 VanDerWaalsContact O-N 3.12Å; F742-C746 PolarHBondContact O-N 3.13Å; F742-C746 VanDerWaalsContact O-N 3.09Å; F742-C746 PolarHBondContact O-SG 3.25Å; F742-C746 VanDerWaalsContact O-SG 3.36Å; F742-M803 HydrophobicContact CB-CE 3.4Å; F742-M803 VanDerWaalsContact CB-CE 3.4Å; F742-M803 HydrophobicContact CB-SD 4.35Å; F742-M803 HydrophobicContact CD1-CE 4.03Å; F742-M803 HydrophobicContact CG-CE 3.81Å
743	V	93.6	Very high	91.8	Very high	3 Å²	3	41.5 Å²	41.5	2%	0.018	23%	0.234	C	C	.	.	H	α-helix	trans	-56.6	-43.8	174.1	167.4	0	0	0	0	110.4	M681 A739 E740 Q800 I804	M681-V743 HydrophobicContact CG-CG1 4.17Å; A739-V743 WeakPolarHBondContact O-CG2 3.36Å; A739-V743 PolarHBondContact O-N 3.22Å; E740-V743 PolarHBondContact O-N 3.4Å; V743-Q800 HydrophobicContact CG1-CB 4.36Å; V743-Q800 HydrophobicContact CG1-CG 3.97Å; V743-Q800 PolarHBondContact O-NE2 3.31Å; V743-I804 HydrophobicContact CG2-CD1 4.2Å; V743-I804 HydrophobicContact CG2-CG1 3.95Å
744	T	95.5	Very high	92.5	Very high	3 Å²	3	36.3 Å²	36.3	2%	0.018	21%	0.206	C	C	.	.	H	α-helix	trans	-69.2	-39.5	176.8	-48.6	0	0	0	0	111.4	I662 W665 R666 E740 D741 F742 C746 I747 I748	I662-T744 HydrophobicContact CG2-CG2 3.78Å; W665-T744 HydrophobicContact CG-CG2 4.37Å; R666-T744 WeakPolarHBondContact CD-OG1 3.43Å; R666-T744 HydrophobicContact CG-CG2 3.79Å; E740-T744 PolarHBondContact O-N 3.26Å; E740-T744 VanDerWaalsContact O-N 3.15Å; E740-T744 PolarHBondContact O-OG1 3.33Å; D741-T744 PolarHBondContact O-N 3.32Å; F742-T744 PolarHBondContact O-N 3.49Å; T744-C746 VanDerWaalsContact C-N 3.27Å; T744-C746 PolarHBondContact O-N 3Å; T744-I747 WeakPolarHBondContact O-CA 3.45Å; T744-I747 VanDerWaalsContact O-CB 3.29Å; T744-I747 WeakPolarHBondContact O-CB 3.41Å; T744-I747 PolarHBondContact O-N 3.42Å; T744-I748 HydrophobicContact CG2-CD1 4.21Å; T744-I748 HydrophobicContact CG2-CG1 4.4Å; T744-I748 PolarHBondContact O-N 3.34Å; T744-I748 VanDerWaalsContact O-N 3.07Å
745	L	95.1	Very high	92.8	Very high	12 Å²	12	35.8 Å²	35.8	6%	0.063	20%	0.203	C	C	.	.	H	α-helix	trans	-58.9	-37.4	-179.5	-169.1	67.2	0	0	0	112.2	I662 L726 F731 L734 L737 D741 F742 I747 I748 H749	I662-L745 HydrophobicContact CD1-CB 4.42Å; I662-L745 HydrophobicContact CD1-CD1 4.03Å; I662-L745 HydrophobicContact CG1-CD1 4.41Å; L726-L745 HydrophobicContact CD1-CD1 4.24Å; F731-L745 HydrophobicContact CD1-CD1 3.69Å; F731-L745 HydrophobicContact CD1-CG 4.18Å; F731-L745 HydrophobicContact CE1-CD1 4Å; L734-L745 HydrophobicContact CD1-CD1 3.93Å; L734-L745 HydrophobicContact CD1-CD2 3.97Å; L737-L745 HydrophobicContact CD1-CD2 3.87Å; D741-L745 WeakPolarHBondContact O-CB 3.32Å; D741-L745 PolarHBondContact O-N 3.05Å; F742-L745 HydrophobicContact CD1-CD2 4.26Å; F742-L745 WeakPolarHBondContact O-CB 3.38Å; F742-L745 PolarHBondContact O-N 2.65Å; F742-L745 VanDerWaalsContact O-N 3.12Å; L745-I747 PolarHBondContact O-N 3.16Å; L745-I748 PolarHBondContact O-N 2.81Å; L745-I748 VanDerWaalsContact O-N 3.16Å; L745-H749 WeakPolarHBondContact O-CB 3.27Å; L745-H749 PolarHBondContact O-N 3.2Å
746	C	93.8	Very high	93.1	Very high	26 Å²	26	37.8 Å²	37.8	18%	0.176	21%	0.21	C	C	.	.	H	α-helix	trans	-57.8	-34.4	173.8	-65.1	0	0	0	0	112.6	F742 T744 V796 Q800 M803	F742-C746 PolarHBondContact O-N 3.13Å; F742-C746 VanDerWaalsContact O-N 3.09Å; F742-C746 PolarHBondContact O-SG 3.25Å; F742-C746 VanDerWaalsContact O-SG 3.36Å; T744-C746 VanDerWaalsContact C-N 3.27Å; T744-C746 PolarHBondContact O-N 3Å; C746-V796 HydrophobicContact CB-CG1 3.97Å; C746-Q800 HydrophobicContact CB-CG 4.31Å; C746-M803 VanDerWaalsContact SG-SD 3.69Å
747	I	95.6	Very high	93.5	Very high	1 Å²	1	34.9 Å²	34.9	1%	0.005	18%	0.181	C	C	.	.	H	α-helix	trans	-72.1	-48.7	175.4	-52.8	178.5	0	0	0	109.8	W665 I682 L689 T744 L745 H749 R750 Y751 F754 Q800	W665-I747 HydrophobicContact CZ2-CG2 4.47Å; I682-I747 HydrophobicContact CD1-CG1 4.29Å; I682-I747 HydrophobicContact CG1-CD1 4.1Å; I682-I747 HydrophobicContact CG1-CG1 4.16Å; L689-I747 HydrophobicContact CD2-CG2 3.68Å; T744-I747 WeakPolarHBondContact O-CA 3.45Å; T744-I747 VanDerWaalsContact O-CB 3.29Å; T744-I747 WeakPolarHBondContact O-CB 3.41Å; T744-I747 PolarHBondContact O-N 3.42Å; L745-I747 PolarHBondContact O-N 3.16Å; I747-H749 VanDerWaalsContact C-N 3.34Å; I747-H749 PolarHBondContact O-N 3.37Å; I747-R750 CarbonylContact O-C 3.6Å; I747-R750 PolarHBondContact O-N 3.2Å; I747-R750 VanDerWaalsContact O-N 3.15Å; I747-Y751 PolarHBondContact O-N 2.55Å; I747-F754 HydrophobicContact CG2-CD2 4.34Å; I747-F754 HydrophobicContact CG2-CE2 3.94Å; I747-Q800 VanDerWaalsContact CG1-NE2 3.27Å
748	I	96.2	Very high	93.5	Very high	0 Å²	0	34 Å²	34	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-60.3	-45.7	-178.3	-58.1	176	0	0	0	110.3	I662 W665 I722 Y723 L726 F731 T744 L745 R750 Y751	I662-I748 HydrophobicContact CG1-CD1 3.99Å; W665-I748 HydrophobicContact CB-CD1 4Å; W665-I748 HydrophobicContact CD2-CD1 3.87Å; W665-I748 HydrophobicContact CD2-CG1 3.6Å; W665-I748 HydrophobicContact CE3-CD1 4.04Å; W665-I748 HydrophobicContact CE3-CG1 3.8Å; W665-I748 HydrophobicContact CE3-CG2 4.35Å; W665-I748 HydrophobicContact CG-CD1 3.84Å; W665-I748 HydrophobicContact CG-CG1 3.97Å; W665-I748 HydrophobicContact CH2-CG1 4.15Å; W665-I748 HydrophobicContact CH2-CG2 4.41Å; W665-I748 HydrophobicContact CZ2-CG1 4.07Å; W665-I748 HydrophobicContact CZ3-CB 4.46Å; W665-I748 HydrophobicContact CZ3-CG1 4.03Å; W665-I748 HydrophobicContact CZ3-CG2 4.02Å; I722-I748 HydrophobicContact CG2-CD1 4.4Å; Y723-I748 HydrophobicContact CD2-CG2 4.23Å; Y723-I748 WeakPolarHBondContact CD2-O 3.34Å; Y723-I748 WeakPolarHBondContact CE2-O 3.31Å; L726-I748 HydrophobicContact CD1-CD1 3.93Å; L726-I748 HydrophobicContact CD1-CG2 3.93Å; F731-I748 HydrophobicContact CE1-CG2 4.09Å; F731-I748 HydrophobicContact CZ-CG2 4.42Å; T744-I748 HydrophobicContact CG2-CD1 4.21Å; T744-I748 HydrophobicContact CG2-CG1 4.4Å; T744-I748 PolarHBondContact O-N 3.34Å; T744-I748 VanDerWaalsContact O-N 3.07Å; L745-I748 PolarHBondContact O-N 2.81Å; L745-I748 VanDerWaalsContact O-N 3.16Å; I748-R750 PolarHBondContact O-N 3.47Å; I748-R750 VanDerWaalsContact O-N 3.08Å; I748-Y751 WeakPolarHBondContact O-CB 3.47Å; I748-Y751 PolarHBondContact O-N 2.91Å
749	H	95.1	Very high	93.6	Very high	87 Å²	87	34 Å²	34	40%	0.403	17%	0.172	S	C	.	.	H	α-helix	trans	-56.7	-29.1	-179.7	-174	-157.8	0	0	0	112.6	F731 L745 I747	F731-H749 HydrophobicContact CD1-CB 4.09Å; F731-H749 AromaticContact CD2-CD2 3.44Å; F731-H749 VanDerWaalsContact CD2-CD2 3.44Å; F731-H749 WeakPolarHBondContact CD2-CD2 3.41Å; F731-H749 AromaticContact CD2-NE2 3.98Å; F731-H749 HydrophobicContact CE1-CB 4.13Å; F731-H749 AromaticContact CE2-CD2 3.7Å; F731-H749 HydrophobicContact CG-CB 4.4Å; F731-H749 AromaticContact CG-CD2 3.79Å; F731-H749 HydrophobicContact CZ-CB 4.45Å; L745-H749 WeakPolarHBondContact O-CB 3.27Å; L745-H749 PolarHBondContact O-N 3.2Å; I747-H749 VanDerWaalsContact C-N 3.34Å; I747-H749 PolarHBondContact O-N 3.37Å
750	R	95.1	Very high	93.8	Very high	83 Å²	83	36.4 Å²	36.4	31%	0.313	17%	0.172	S	C	.	.	T	Hydrogen-bonded Turn	trans	-104.7	17.8	178.3	-62.1	-64.9	179	-175.6	-3.6	113.7	I747 I748 L752 D753 F754 I792 V796	I747-R750 CarbonylContact O-C 3.6Å; I747-R750 PolarHBondContact O-N 3.2Å; I747-R750 VanDerWaalsContact O-N 3.15Å; I748-R750 PolarHBondContact O-N 3.47Å; I748-R750 VanDerWaalsContact O-N 3.08Å; R750-L752 PolarHBondContact O-N 3.32Å; R750-D753 HydrophobicContact CB-CB 4.47Å; R750-D753 WeakPolarHBondContact CD-OD2 3.31Å; R750-D753 IonicContact CZ-OD2 2.77Å; R750-D753 IonicContact NE-OD2 2.72Å; R750-D753 IonicContact NH1-OD2 3.77Å; R750-D753 PolarHBondContact NH1-OD2 2.88Å; R750-D753 WeakPolarHBondContact O-CB 3.4Å; R750-D753 PolarHBondContact O-N 2.67Å; R750-F754 HydrophobicContact CB-CD2 4.23Å; R750-F754 HydrophobicContact CB-CE1 4.39Å; R750-F754 HydrophobicContact CB-CE2 3.73Å; R750-F754 HydrophobicContact CB-CZ 3.84Å; R750-F754 WeakPolarHBondContact O-CD2 3.27Å; R750-F754 WeakPolarHBondContact O-CG 3.42Å; R750-F754 PolarHBondContact O-N 2.89Å; R750-I792 HydrophobicContact CB-CG2 4.4Å; R750-I792 HydrophobicContact CG-CG2 4.37Å; R750-V796 HydrophobicContact CB-CG2 4.23Å; R750-V796 HydrophobicContact CG-CG2 3.76Å
751	Y	95.4	Very high	93.8	Very high	0 Å²	0	34 Å²	34	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-55.2	-51.4	-175.4	172.3	-113.7	0	0	0	113.5	W665 L689 R719 A720 Y723 I747 I748 F754 K755	W665-Y751 AromaticContact CH2-CD2 3.31Å; W665-Y751 HydrophobicContact CH2-CD2 3.31Å; W665-Y751 AromaticContact CH2-CE2 3.89Å; W665-Y751 HydrophobicContact CH2-CE2 3.89Å; W665-Y751 AromaticContact CH2-CG 3.73Å; W665-Y751 HydrophobicContact CH2-CG 3.73Å; W665-Y751 HydrophobicContact CZ2-CD2 4.04Å; W665-Y751 HydrophobicContact CZ3-CD2 4.26Å; W665-Y751 HydrophobicContact CZ3-CG 4.43Å; L689-Y751 HydrophobicContact CD1-CD2 3.38Å; L689-Y751 HydrophobicContact CD1-CE2 3.79Å; L689-Y751 HydrophobicContact CD1-CG 4.46Å; R719-Y751 HydrophobicContact CB-CE2 3.9Å; A720-Y751 HydrophobicContact CB-CE1 3.91Å; Y723-Y751 HydrophobicContact CD1-CD1 4.13Å; Y723-Y751 HydrophobicContact CD2-CD1 4.44Å; Y723-Y751 AromaticContact CG-CD1 3.88Å; Y723-Y751 HydrophobicContact CG-CD1 3.88Å; Y723-Y751 HydrophobicContact CG-CG 4.4Å; I747-Y751 PolarHBondContact O-N 2.55Å; I748-Y751 WeakPolarHBondContact O-CB 3.47Å; I748-Y751 PolarHBondContact O-N 2.91Å; Y751-F754 PolarHBondContact O-N 2.93Å; Y751-K755 HydrophobicContact CD2-CG 4.23Å; Y751-K755 HydrophobicContact CE1-CG 4.37Å; Y751-K755 HydrophobicContact CE2-CD 4.34Å; Y751-K755 HydrophobicContact CE2-CG 3.8Å; Y751-K755 PolarHBondContact O-N 2.58Å
752	L	93.7	Very high	93.6	Very high	76 Å²	76	34.5 Å²	34.5	40%	0.398	17%	0.165	S	C	.	.	H	α-helix	trans	-66.2	-38.4	180	-71	-177.4	0	0	0	111.9	Y723 R750 F754 K755 I756	Y723-L752 HydrophobicContact CD1-CD1 4.41Å; Y723-L752 HydrophobicContact CD1-CG 4.19Å; Y723-L752 HydrophobicContact CE1-CD1 3.47Å; Y723-L752 VanDerWaalsContact CE1-CD1 3.47Å; Y723-L752 HydrophobicContact CE1-CD2 4.49Å; Y723-L752 HydrophobicContact CE1-CG 3.58Å; R750-L752 PolarHBondContact O-N 3.32Å; L752-F754 VanDerWaalsContact C-N 3.27Å; L752-F754 PolarHBondContact O-N 3.06Å; L752-K755 PolarHBondContact O-N 2.93Å; L752-I756 WeakPolarHBondContact O-CB 3.47Å; L752-I756 VanDerWaalsContact O-CG1 3.27Å; L752-I756 WeakPolarHBondContact O-CG1 3.49Å; L752-I756 PolarHBondContact O-N 3.38Å
753	D	94.4	Very high	93.5	Very high	50 Å²	50	33.4 Å²	33.4	27%	0.267	16%	0.162	S	C	.	.	H	α-helix	trans	-57.4	-43.2	175.5	-65.5	-38.3	0	0	0	110.8	R750 G757 I792	R750-D753 HydrophobicContact CB-CB 4.47Å; R750-D753 WeakPolarHBondContact CD-OD2 3.31Å; R750-D753 IonicContact CZ-OD2 2.77Å; R750-D753 IonicContact NE-OD2 2.72Å; R750-D753 IonicContact NH1-OD2 3.77Å; R750-D753 PolarHBondContact NH1-OD2 2.88Å; R750-D753 WeakPolarHBondContact O-CB 3.4Å; R750-D753 PolarHBondContact O-N 2.67Å; D753-G757 PolarHBondContact O-N 3.12Å; D753-G757 VanDerWaalsContact O-N 3.08Å; D753-I792 HydrophobicContact CB-CD1 4.02Å; D753-I792 HydrophobicContact CB-CG2 4.19Å
754	F	94.9	Very high	93.3	Very high	8 Å²	8	34 Å²	34	4%	0.035	17%	0.167	C	C	.	.	H	α-helix	trans	-67.9	-40.8	176.4	-62.9	-37.7	0	0	0	113.2	I682 P688 L689 I747 R750 Y751 L752 G757 E758 I792 V796	I682-F754 HydrophobicContact CD1-CE2 4.23Å; I682-F754 HydrophobicContact CD1-CZ 3.77Å; P688-F754 HydrophobicContact CB-CD1 4.07Å; P688-F754 HydrophobicContact CB-CD2 4.23Å; P688-F754 HydrophobicContact CB-CE1 4.15Å; P688-F754 HydrophobicContact CB-CE2 4.31Å; P688-F754 HydrophobicContact CB-CG 4.1Å; P688-F754 HydrophobicContact CB-CZ 4.26Å; P688-F754 HydrophobicContact CG-CD1 3.69Å; P688-F754 HydrophobicContact CG-CE1 3.82Å; P688-F754 HydrophobicContact CG-CG 4.17Å; P688-F754 HydrophobicContact CG-CZ 4.38Å; L689-F754 HydrophobicContact CD1-CB 3.53Å; L689-F754 HydrophobicContact CD1-CD2 3.96Å; L689-F754 HydrophobicContact CD1-CG 4.23Å; L689-F754 HydrophobicContact CD2-CD2 4.44Å; L689-F754 HydrophobicContact CG-CB 3.92Å; L689-F754 HydrophobicContact CG-CD2 3.98Å; L689-F754 HydrophobicContact CG-CG 4.31Å; I747-F754 HydrophobicContact CG2-CD2 4.34Å; I747-F754 HydrophobicContact CG2-CE2 3.94Å; R750-F754 HydrophobicContact CB-CD2 4.23Å; R750-F754 HydrophobicContact CB-CE1 4.39Å; R750-F754 HydrophobicContact CB-CE2 3.73Å; R750-F754 HydrophobicContact CB-CZ 3.84Å; R750-F754 WeakPolarHBondContact O-CD2 3.27Å; R750-F754 WeakPolarHBondContact O-CG 3.42Å; R750-F754 PolarHBondContact O-N 2.89Å; Y751-F754 PolarHBondContact O-N 2.93Å; L752-F754 VanDerWaalsContact C-N 3.27Å; L752-F754 PolarHBondContact O-N 3.06Å; F754-G757 PolarHBondContact O-N 3.23Å; F754-E758 PolarHBondContact O-N 2.99Å; F754-I792 HydrophobicContact CD1-CG2 4.48Å; F754-I792 HydrophobicContact CE1-CG2 3.91Å; F754-V796 HydrophobicContact CZ-CB 4.16Å; F754-V796 HydrophobicContact CZ-CG1 4.36Å; F754-V796 HydrophobicContact CZ-CG2 3.87Å
755	K	94.2	Very high	93	Very high	5 Å²	5	37.5 Å²	37.5	2%	0.022	18%	0.183	C	C	.	.	H	α-helix	trans	-67.8	-39	178.3	-73.1	-72	155.1	-169.7	0	112.5	L689 D713 V714 Y751 L752 G757 E758 I759	L689-K755 HydrophobicContact CD1-CG 4.27Å; D713-K755 VanDerWaalsContact OD2-CE 3.26Å; D713-K755 WeakPolarHBondContact OD2-CE 3.34Å; D713-K755 IonicContact OD2-NZ 2.93Å; D713-K755 PolarHBondContact OD2-NZ 2.75Å; V714-K755 HydrophobicContact CG2-CB 4.37Å; V714-K755 HydrophobicContact CG2-CD 3.84Å; V714-K755 HydrophobicContact CG2-CG 4Å; Y751-K755 HydrophobicContact CD2-CG 4.23Å; Y751-K755 HydrophobicContact CE1-CG 4.37Å; Y751-K755 HydrophobicContact CE2-CD 4.34Å; Y751-K755 HydrophobicContact CE2-CG 3.8Å; Y751-K755 PolarHBondContact O-N 2.58Å; L752-K755 PolarHBondContact O-N 2.93Å; K755-G757 VanDerWaalsContact C-N 3.27Å; K755-G757 PolarHBondContact O-N 3.43Å; K755-E758 IonicContact NZ-OE1 3.86Å; K755-E758 IonicContact NZ-OE2 3.83Å; K755-E758 PolarHBondContact NZ-OE2 3.44Å; K755-E758 PolarHBondContact O-N 3.3Å; K755-I759 WeakPolarHBondContact O-CG1 3.45Å; K755-I759 PolarHBondContact O-N 3.25Å
756	I	92.7	Very high	92.8	Very high	83 Å²	83	38.9 Å²	38.9	43%	0.426	19%	0.189	S	C	.	.	H	α-helix	trans	-59.7	-42.2	171	-69.1	166.7	0	0	0	110.1	L752 E758 I759 W760	L752-I756 WeakPolarHBondContact O-CB 3.47Å; L752-I756 VanDerWaalsContact O-CG1 3.27Å; L752-I756 WeakPolarHBondContact O-CG1 3.49Å; L752-I756 PolarHBondContact O-N 3.38Å; I756-E758 PolarHBondContact O-N 3.19Å; I756-I759 PolarHBondContact O-N 3.2Å; I756-W760 PolarHBondContact O-N 3.1Å
757	G	93	Very high	92.6	Very high	4 Å²	4	39.1 Å²	39.1	4%	0.041	19%	0.188	C	C	.	.	H	α-helix	trans	-60.8	-40.7	173.9	0	0	0	0	0	114.1	D753 F754 K755 W760 N761	D753-G757 PolarHBondContact O-N 3.12Å; D753-G757 VanDerWaalsContact O-N 3.08Å; F754-G757 PolarHBondContact O-N 3.23Å; K755-G757 VanDerWaalsContact C-N 3.27Å; K755-G757 PolarHBondContact O-N 3.43Å; G757-W760 PolarHBondContact O-N 3.13Å; G757-N761 VanDerWaalsContact O-CG 3.28Å; G757-N761 PolarHBondContact O-N 2.84Å; G757-N761 PolarHBondContact O-ND2 3.26Å; G757-N761 VanDerWaalsContact O-ND2 3.14Å
758	E	92.3	Very high	92.2	Very high	5 Å²	5	45.3 Å²	45.3	2%	0.023	22%	0.215	C	C	.	.	H	α-helix	trans	-60.7	-45	173.9	-72	179.7	-171.9	0	0	112	L689 F690 Q694 A710 F754 K755 I756 W760 N761 E762	L689-E758 WeakPolarHBondContact CB-OE1 3.36Å; F690-E758 HydrophobicContact CD2-CG 4.41Å; F690-E758 PolarHBondContact N-OE1 3.11Å; Q694-E758 PolarHBondContact NE2-OE2 2.94Å; A710-E758 HydrophobicContact CB-CB 3.86Å; F754-E758 PolarHBondContact O-N 2.99Å; K755-E758 IonicContact NZ-OE1 3.86Å; K755-E758 IonicContact NZ-OE2 3.83Å; K755-E758 PolarHBondContact NZ-OE2 3.44Å; K755-E758 PolarHBondContact O-N 3.3Å; I756-E758 PolarHBondContact O-N 3.19Å; E758-W760 PolarHBondContact O-N 3.43Å; E758-N761 WeakPolarHBondContact O-CB 3.5Å; E758-N761 PolarHBondContact O-N 2.97Å; E758-N761 VanDerWaalsContact O-N 3.16Å; E758-E762 WeakPolarHBondContact O-CG 3.33Å; E758-E762 PolarHBondContact O-N 3.26Å
759	I	91.5	Very high	91.9	Very high	53 Å²	53	49.7 Å²	49.7	27%	0.272	24%	0.238	S	C	.	.	H	α-helix	trans	-61	-44.9	177.7	-64.5	165.3	0	0	0	110.9	A710 V711 K755 I756 N761 E762 I763	A710-I759 HydrophobicContact CB-CG1 3.78Å; V711-I759 HydrophobicContact CG2-CD1 3.88Å; V711-I759 HydrophobicContact CG2-CG1 4.24Å; K755-I759 WeakPolarHBondContact O-CG1 3.45Å; K755-I759 PolarHBondContact O-N 3.25Å; I756-I759 PolarHBondContact O-N 3.2Å; I759-N761 VanDerWaalsContact C-N 3.28Å; I759-N761 PolarHBondContact O-N 3.27Å; I759-E762 WeakPolarHBondContact O-CB 3.41Å; I759-E762 PolarHBondContact O-N 3.34Å; I759-I763 HydrophobicContact CG2-CD1 4.03Å; I759-I763 WeakPolarHBondContact O-CG1 3.44Å; I759-I763 PolarHBondContact O-N 3.12Å
760	W	92.1	Very high	91.6	Very high	87 Å²	87	50.5 Å²	50.5	33%	0.33	24%	0.242	S	C	.	.	H	α-helix	trans	-63.9	-34.3	176.7	-77.2	113.6	0	0	0	112.9	I756 G757 E758 I763 C764 L782 I785	I756-W760 PolarHBondContact O-N 3.1Å; G757-W760 PolarHBondContact O-N 3.13Å; E758-W760 PolarHBondContact O-N 3.43Å; W760-I763 HydrophobicContact CD2-CD1 4.48Å; W760-I763 HydrophobicContact CE3-CD1 3.94Å; W760-I763 HydrophobicContact CZ3-CD1 4.16Å; W760-C764 PolarHBondContact O-N 3.2Å; W760-C764 PolarHBondContact O-SG 3.43Å; W760-L782 HydrophobicContact CE3-CD1 3.76Å; W760-L782 HydrophobicContact CZ3-CD1 4.1Å; W760-I785 HydrophobicContact CB-CG2 4.19Å; W760-I785 VanDerWaalsContact CD1-CG2 3.5Å; W760-I785 HydrophobicContact CD2-CG2 3.71Å; W760-I785 HydrophobicContact CE3-CG2 4.44Å; W760-I785 HydrophobicContact CG-CG2 3.54Å; W760-I785 HydrophobicContact CH2-CD1 3.98Å; W760-I785 HydrophobicContact CZ2-CD1 3.95Å; W760-I785 HydrophobicContact CZ3-CD1 4.26Å
761	N	90.3	Very high	91.3	Very high	47 Å²	47	54.9 Å²	54.9	25%	0.251	27%	0.266	S	S	.	.	H	α-helix	trans	-67.6	-38.9	173.5	-72	-35	0	0	0	111.9	G757 E758 I759 C764 E765	G757-N761 VanDerWaalsContact O-CG 3.28Å; G757-N761 PolarHBondContact O-N 2.84Å; G757-N761 PolarHBondContact O-ND2 3.26Å; G757-N761 VanDerWaalsContact O-ND2 3.14Å; E758-N761 WeakPolarHBondContact O-CB 3.5Å; E758-N761 PolarHBondContact O-N 2.97Å; E758-N761 VanDerWaalsContact O-N 3.16Å; I759-N761 VanDerWaalsContact C-N 3.28Å; I759-N761 PolarHBondContact O-N 3.27Å; N761-C764 WeakPolarHBondContact O-CB 3.24Å; N761-C764 PolarHBondContact O-N 3.39Å; N761-E765 WeakPolarHBondContact O-CG 3.44Å; N761-E765 PolarHBondContact O-N 3.01Å; N761-E765 VanDerWaalsContact O-N 3.11Å
762	E	90.1	Very high	90.8	Very high	11 Å²	11	59.6 Å²	59.6	5%	0.051	29%	0.291	C	S	.	.	H	α-helix	trans	-60.5	-49.6	173.7	-70.8	171.1	167.2	0	0	110.8	I699 S708 A710 E758 I759 C764 E765 E766	I699-E762 HydrophobicContact CD1-CG 4.36Å; S708-E762 WeakPolarHBondContact CB-OE2 3.44Å; S708-E762 PolarHBondContact OG-OE2 3.34Å; A710-E762 VanDerWaalsContact CB-OE1 3.31Å; A710-E762 WeakPolarHBondContact CB-OE1 3.41Å; A710-E762 WeakPolarHBondContact CB-OE2 3.43Å; A710-E762 PolarHBondContact N-OE1 3.05Å; A710-E762 PolarHBondContact N-OE2 2.96Å; E758-E762 WeakPolarHBondContact O-CG 3.33Å; E758-E762 PolarHBondContact O-N 3.26Å; I759-E762 WeakPolarHBondContact O-CB 3.41Å; I759-E762 PolarHBondContact O-N 3.34Å; E762-C764 VanDerWaalsContact C-N 3.29Å; E762-C764 PolarHBondContact O-N 3.4Å; E762-E765 PolarHBondContact O-N 3.32Å; E762-E766 WeakPolarHBondContact O-CG 3.4Å; E762-E766 PolarHBondContact O-N 3.39Å
763	I	89.8	Confident	90.5	Very high	57 Å²	57	65.6 Å²	65.6	29%	0.292	31%	0.313	S	S	.	.	H	α-helix	trans	-56.6	-42.8	175.6	-66.3	167	0	0	0	111.1	I759 W760 E765 E766 I767	I759-I763 HydrophobicContact CG2-CD1 4.03Å; I759-I763 WeakPolarHBondContact O-CG1 3.44Å; I759-I763 PolarHBondContact O-N 3.12Å; W760-I763 HydrophobicContact CD2-CD1 4.48Å; W760-I763 HydrophobicContact CE3-CD1 3.94Å; W760-I763 HydrophobicContact CZ3-CD1 4.16Å; I763-E765 VanDerWaalsContact C-N 3.3Å; I763-E765 PolarHBondContact O-N 3.43Å; I763-E766 PolarHBondContact O-N 3.32Å; I763-I767 HydrophobicContact CG2-CD1 3.72Å; I763-I767 HydrophobicContact CG2-CG1 4.43Å; I763-I767 WeakPolarHBondContact O-CD1 3.13Å; I763-I767 VanDerWaalsContact O-CG1 3.25Å; I763-I767 WeakPolarHBondContact O-CG1 3.42Å; I763-I767 PolarHBondContact O-N 3.14Å
764	C	89.4	Confident	90.2	Very high	17 Å²	17	66.2 Å²	66.2	12%	0.115	32%	0.316	C	S	.	.	H	α-helix	trans	-60.1	-38.8	177	-72.5	0	0	0	0	112.7	W760 N761 E762 K768 L782	W760-C764 PolarHBondContact O-N 3.2Å; W760-C764 PolarHBondContact O-SG 3.43Å; N761-C764 WeakPolarHBondContact O-CB 3.24Å; N761-C764 PolarHBondContact O-N 3.39Å; E762-C764 VanDerWaalsContact C-N 3.29Å; E762-C764 PolarHBondContact O-N 3.4Å; C764-K768 VanDerWaalsContact O-CG 3.28Å; C764-K768 WeakPolarHBondContact O-CG 3.34Å; C764-K768 PolarHBondContact O-N 3.1Å; C764-L782 VanDerWaalsContact SG-CD1 3.59Å; C764-L782 VanDerWaalsContact SG-CD2 3.57Å; C764-L782 VanDerWaalsContact SG-CG 3.53Å
765	E	89.1	Confident	90.1	Very high	75 Å²	75	70.2 Å²	70.2	35%	0.35	34%	0.341	S	S	.	.	H	α-helix	trans	-77.6	-37.4	179.8	-68.6	-58.6	129.8	0	0	111.8	I699 N761 E762 I763 K768 L769	I699-E765 HydrophobicContact CB-CB 4.3Å; I699-E765 HydrophobicContact CD1-CB 3.72Å; I699-E765 HydrophobicContact CD1-CG 3.76Å; I699-E765 HydrophobicContact CG2-CB 4.02Å; N761-E765 WeakPolarHBondContact O-CG 3.44Å; N761-E765 PolarHBondContact O-N 3.01Å; N761-E765 VanDerWaalsContact O-N 3.11Å; E762-E765 PolarHBondContact O-N 3.32Å; I763-E765 VanDerWaalsContact C-N 3.3Å; I763-E765 PolarHBondContact O-N 3.43Å; E765-K768 WeakPolarHBondContact O-CB 3.41Å; E765-K768 PolarHBondContact O-N 2.93Å; E765-K768 IonicContact OE1-NZ 3.91Å; E765-K768 PolarHBondContact OE1-NZ 3.22Å; E765-L769 VanDerWaalsContact O-CG 3.31Å; E765-L769 WeakPolarHBondContact O-CG 3.3Å; E765-L769 PolarHBondContact O-N 2.95Å
766	E	89.5	Confident	89.9	Confident	41 Å²	41	75.2 Å²	75.2	19%	0.192	37%	0.372	C	S	.	.	H	α-helix	trans	-59.5	-48.4	173.7	-71.2	178.6	-177.7	0	0	111.7	I699 E762 I763 K768 L769 E770	I699-E766 HydrophobicContact CG2-CG 3.83Å; E762-E766 WeakPolarHBondContact O-CG 3.4Å; E762-E766 PolarHBondContact O-N 3.39Å; I763-E766 PolarHBondContact O-N 3.32Å; E766-K768 PolarHBondContact O-N 3.43Å; E766-L769 PolarHBondContact O-N 3.49Å; E766-E770 WeakPolarHBondContact O-CG 3.02Å; E766-E770 PolarHBondContact O-N 3.26Å
767	I	89.6	Confident	89.8	Confident	32 Å²	32	74.8 Å²	74.8	16%	0.164	38%	0.377	C	S	.	.	H	α-helix	trans	-56.2	-39.3	176.6	-70.4	165	0	0	0	111.4	I763 Q771 L772 L774 L782	I763-I767 HydrophobicContact CG2-CD1 3.72Å; I763-I767 HydrophobicContact CG2-CG1 4.43Å; I763-I767 WeakPolarHBondContact O-CD1 3.13Å; I763-I767 VanDerWaalsContact O-CG1 3.25Å; I763-I767 WeakPolarHBondContact O-CG1 3.42Å; I763-I767 PolarHBondContact O-N 3.14Å; I767-Q771 PolarHBondContact O-N 3.07Å; I767-L772 HydrophobicContact CG2-CB 4.18Å; I767-L772 PolarHBondContact O-N 3.47Å; I767-L772 VanDerWaalsContact O-N 3.13Å; I767-L774 HydrophobicContact CD1-CD1 4.28Å; I767-L774 HydrophobicContact CD1-CD2 4.18Å; I767-L774 HydrophobicContact CG2-CD1 4.08Å; I767-L774 HydrophobicContact CG2-CD2 4.32Å; I767-L774 HydrophobicContact CG2-CG 4Å; I767-L782 HydrophobicContact CD1-CD2 4.28Å
768	K	88.8	Confident	89.7	Confident	131 Å²	131	78.6 Å²	78.6	57%	0.57	40%	0.396	S	S	*	.	H	α-helix	trans	-68.6	-42.1	177.4	-70.9	170.1	-166.2	170.6	0	111.8	C764 E765 E766 Q771	C764-K768 VanDerWaalsContact O-CG 3.28Å; C764-K768 WeakPolarHBondContact O-CG 3.34Å; C764-K768 PolarHBondContact O-N 3.1Å; E765-K768 WeakPolarHBondContact O-CB 3.41Å; E765-K768 PolarHBondContact O-N 2.93Å; E765-K768 IonicContact OE1-NZ 3.91Å; E765-K768 PolarHBondContact OE1-NZ 3.22Å; E766-K768 PolarHBondContact O-N 3.43Å; K768-Q771 PolarHBondContact O-N 3.38Å
769	L	89.2	Confident	89.6	Confident	92 Å²	92	83.8 Å²	83.8	48%	0.482	42%	0.419	S	S	.	.	H	α-helix	trans	-68.1	-38.7	-179.9	-71.6	169.2	0	0	0	112.1	I699 P701 E765 E766 Q771	I699-L769 WeakPolarHBondContact O-CD1 3.35Å; P701-L769 HydrophobicContact CG-CB 4.11Å; E765-L769 VanDerWaalsContact O-CG 3.31Å; E765-L769 WeakPolarHBondContact O-CG 3.3Å; E765-L769 PolarHBondContact O-N 2.95Å; E766-L769 PolarHBondContact O-N 3.49Å; L769-Q771 PolarHBondContact O-N 3.15Å
770	E	89	Confident	89.6	Confident	103 Å²	103	87.6 Å²	87.6	48%	0.481	44%	0.437	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.2	-6.3	175.5	-65.6	-169.4	152.3	0	0	113.5	P701 E766 L772	P701-E770 HydrophobicContact CB-CG 3.75Å; P701-E770 VanDerWaalsContact CB-OE1 3.22Å; P701-E770 WeakPolarHBondContact CB-OE1 3.34Å; P701-E770 HydrophobicContact CG-CG 3.56Å; E766-E770 WeakPolarHBondContact O-CG 3.02Å; E766-E770 PolarHBondContact O-N 3.26Å; E770-L772 HydrophobicContact CB-CD1 4.24Å; E770-L772 HydrophobicContact CB-CG 3.85Å; E770-L772 PolarHBondContact O-N 3.06Å; E770-L772 WeakPolarHBondContact OE2-CD1 3.38Å
771	Q	87.4	Confident	89.7	Confident	176 Å²	176	86.3 Å²	86.3	82%	0.822	44%	0.441	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.3	33.1	-178.5	-53.5	-179	9.2	0	0	113.2	I767 K768 L769	I767-Q771 PolarHBondContact O-N 3.07Å; K768-Q771 PolarHBondContact O-N 3.38Å; L769-Q771 PolarHBondContact O-N 3.15Å
772	L	86.2	Confident	89.7	Confident	99 Å²	99	85.2 Å²	85.2	52%	0.518	44%	0.435	S	S	.	.			trans	-74.2	133.7	178.8	-66.6	178.2	0	0	0	111	I767 E770	I767-L772 HydrophobicContact CG2-CB 4.18Å; I767-L772 PolarHBondContact O-N 3.47Å; I767-L772 VanDerWaalsContact O-N 3.13Å; E770-L772 HydrophobicContact CB-CD1 4.24Å; E770-L772 HydrophobicContact CB-CG 3.85Å; E770-L772 PolarHBondContact O-N 3.06Å; E770-L772 WeakPolarHBondContact OE2-CD1 3.38Å
773	K	87.5	Confident	89.8	Confident	202 Å²	202	89.7 Å²	89.7	88%	0.878	46%	0.456	S	S	*	.			trans	-93.4	102.1	176.6	-170.3	179.2	-179.4	-178.5	0	110.4
774	L	87.2	Confident	89.9	Confident	62 Å²	62	90.8 Å²	90.8	33%	0.325	47%	0.469	S	S	.	.			trans	-65.3	145.7	175.3	-65.2	174.7	0	0	0	112.3	I767 D778 K779 L782	I767-L774 HydrophobicContact CD1-CD1 4.28Å; I767-L774 HydrophobicContact CD1-CD2 4.18Å; I767-L774 HydrophobicContact CG2-CD1 4.08Å; I767-L774 HydrophobicContact CG2-CD2 4.32Å; I767-L774 HydrophobicContact CG2-CG 4Å; L774-D778 HydrophobicContact CB-CB 4.48Å; L774-D778 HydrophobicContact CD2-CB 4.37Å; L774-K779 HydrophobicContact CB-CB 4.39Å; L774-L782 HydrophobicContact CD1-CD2 3.86Å
775	V	92.4	Very high	90.1	Very high	92 Å²	92	92.4 Å²	92.4	56%	0.558	48%	0.476	S	S	*	.			trans	-68.3	152.6	167.9	-176.7	0	0	0	0	108.9	S777 D778 K779	V775-S777 PolarHBondContact O-N 3.43Å; V775-D778 PolarHBondContact O-N 3.02Å; V775-D778 VanDerWaalsContact O-N 3.1Å; V775-K779 PolarHBondContact O-N 3.28Å
776	T	90.2	Very high	90.1	Very high	110 Å²	110	90.5 Å²	90.5	68%	0.675	47%	0.469	S	S	*	.	H	α-helix	trans	-53.6	-39.7	-178	46.3	0	0	0	0	113.2	M780	T776-M780 WeakPolarHBondContact O-CG 3.34Å; T776-M780 PolarHBondContact O-N 2.88Å
777	S	92.2	Very high	90.3	Very high	74 Å²	74	90.7 Å²	90.7	52%	0.517	48%	0.478	S	S	.	.	H	α-helix	trans	-61	-47.4	176.4	-173.4	0	0	0	0	112.6	V775 M780 S781	V775-S777 PolarHBondContact O-N 3.43Å; S777-M780 PolarHBondContact O-N 3.01Å; S777-S781 WeakPolarHBondContact O-CB 3.44Å; S777-S781 PolarHBondContact O-N 3.41Å; S777-S781 PolarHBondContact O-OG 2.89Å
778	D	90.9	Very high	90.4	Very high	85 Å²	85	91.5 Å²	91.5	46%	0.455	49%	0.489	S	S	.	.	H	α-helix	trans	-69	-38.9	-178.3	-56.7	-27.3	0	0	0	110.9	L774 V775 S781 L782	L774-D778 HydrophobicContact CB-CB 4.48Å; L774-D778 HydrophobicContact CD2-CB 4.37Å; V775-D778 PolarHBondContact O-N 3.02Å; V775-D778 VanDerWaalsContact O-N 3.1Å; D778-S781 PolarHBondContact O-N 3.34Å; D778-L782 WeakPolarHBondContact O-CB 3.45Å; D778-L782 PolarHBondContact O-N 3.03Å
779	K	90.2	Very high	90.5	Very high	114 Å²	114	86.4 Å²	86.4	50%	0.496	47%	0.469	S	S	.	.	H	α-helix	trans	-59.6	-48.4	174.4	-178.1	177.9	172.9	-179.7	0	111.6	L774 V775 S781 L782 E783	L774-K779 HydrophobicContact CB-CB 4.39Å; V775-K779 PolarHBondContact O-N 3.28Å; K779-S781 VanDerWaalsContact C-N 3.3Å; K779-S781 PolarHBondContact O-N 3.01Å; K779-L782 PolarHBondContact O-N 3.24Å; K779-E783 WeakPolarHBondContact CE-OE1 3.44Å; K779-E783 IonicContact NZ-OE1 3.55Å; K779-E783 WeakPolarHBondContact O-CB 3.44Å; K779-E783 WeakPolarHBondContact O-CG 3.44Å; K779-E783 PolarHBondContact O-N 3.21Å
780	M	91.6	Very high	90.6	Very high	133 Å²	133	84.2 Å²	84.2	66%	0.655	46%	0.456	S	S	*	.	H	α-helix	trans	-62.5	-38.6	177.1	-74.2	-177.7	171.9	0	0	111.9	T776 S777 S784	T776-M780 WeakPolarHBondContact O-CG 3.34Å; T776-M780 PolarHBondContact O-N 2.88Å; S777-M780 PolarHBondContact O-N 3.01Å; M780-S784 WeakPolarHBondContact O-CB 3.23Å; M780-S784 PolarHBondContact O-N 3.19Å
781	S	92.4	Very high	90.8	Very high	59 Å²	59	83.6 Å²	83.6	41%	0.413	46%	0.456	S	S	.	.	H	α-helix	trans	-64.9	-45.7	177.3	-57.7	0	0	0	0	111.3	S777 D778 K779 S784 I785	S777-S781 WeakPolarHBondContact O-CB 3.44Å; S777-S781 PolarHBondContact O-N 3.41Å; S777-S781 PolarHBondContact O-OG 2.89Å; D778-S781 PolarHBondContact O-N 3.34Å; K779-S781 VanDerWaalsContact C-N 3.3Å; K779-S781 PolarHBondContact O-N 3.01Å; S781-S784 WeakPolarHBondContact O-CB 3.48Å; S781-S784 PolarHBondContact O-N 3.11Å; S781-I785 VanDerWaalsContact O-CG1 3.24Å; S781-I785 WeakPolarHBondContact O-CG1 3.29Å; S781-I785 PolarHBondContact O-N 3.44Å
782	L	91.8	Very high	91.1	Very high	25 Å²	25	77.2 Å²	77.2	13%	0.131	43%	0.427	C	S	.	.	H	α-helix	trans	-64.5	-41.6	178.6	-167.8	65.3	0	0	0	112.2	W760 C764 I767 L774 D778 K779 S784 I785 T786	W760-L782 HydrophobicContact CE3-CD1 3.76Å; W760-L782 HydrophobicContact CZ3-CD1 4.1Å; C764-L782 VanDerWaalsContact SG-CD1 3.59Å; C764-L782 VanDerWaalsContact SG-CD2 3.57Å; C764-L782 VanDerWaalsContact SG-CG 3.53Å; I767-L782 HydrophobicContact CD1-CD2 4.28Å; L774-L782 HydrophobicContact CD1-CD2 3.86Å; D778-L782 WeakPolarHBondContact O-CB 3.45Å; D778-L782 PolarHBondContact O-N 3.03Å; K779-L782 PolarHBondContact O-N 3.24Å; L782-S784 VanDerWaalsContact C-N 3.35Å; L782-I785 PolarHBondContact O-N 3.37Å; L782-T786 WeakPolarHBondContact O-CB 3.17Å; L782-T786 WeakPolarHBondContact O-CG2 3.48Å; L782-T786 PolarHBondContact O-N 3.34Å; L782-T786 PolarHBondContact O-OG1 2.91Å
783	E	91	Very high	91.5	Very high	105 Å²	105	72.5 Å²	72.5	49%	0.491	40%	0.403	S	S	.	.	H	α-helix	trans	-62.5	-40.5	173.1	-74.4	174	179.2	0	0	111.7	K779 T786 A787	K779-E783 WeakPolarHBondContact CE-OE1 3.44Å; K779-E783 IonicContact NZ-OE1 3.55Å; K779-E783 WeakPolarHBondContact O-CB 3.44Å; K779-E783 WeakPolarHBondContact O-CG 3.44Å; K779-E783 PolarHBondContact O-N 3.21Å; E783-T786 WeakPolarHBondContact CA-OG1 3.08Å; E783-T786 PolarHBondContact O-OG1 3.15Å; E783-T786 VanDerWaalsContact O-OG1 3.05Å; E783-A787 VanDerWaalsContact O-CB 3.22Å; E783-A787 WeakPolarHBondContact O-CB 3.33Å; E783-A787 PolarHBondContact O-N 3.16Å
784	S	93.3	Very high	91.8	Very high	80 Å²	80	67 Å²	67	56%	0.559	38%	0.379	S	S	*	.	H	α-helix	trans	-66.4	-41.6	176	-172.3	0	0	0	0	112.3	M780 S781 L782 A788	M780-S784 WeakPolarHBondContact O-CB 3.23Å; M780-S784 PolarHBondContact O-N 3.19Å; S781-S784 WeakPolarHBondContact O-CB 3.48Å; S781-S784 PolarHBondContact O-N 3.11Å; L782-S784 VanDerWaalsContact C-N 3.35Å; S784-A788 WeakPolarHBondContact O-CB 3.44Å; S784-A788 PolarHBondContact O-N 3.37Å
785	I	92.6	Very high	92.2	Very high	51 Å²	51	67.8 Å²	67.8	26%	0.262	38%	0.382	S	S	.	.	H	α-helix	trans	-65.8	-49.6	178.9	-69.3	163.5	0	0	0	110.2	W760 S781 L782 A787 A788 T789	W760-I785 HydrophobicContact CB-CG2 4.19Å; W760-I785 VanDerWaalsContact CD1-CG2 3.5Å; W760-I785 HydrophobicContact CD2-CG2 3.71Å; W760-I785 HydrophobicContact CE3-CG2 4.44Å; W760-I785 HydrophobicContact CG-CG2 3.54Å; W760-I785 HydrophobicContact CH2-CD1 3.98Å; W760-I785 HydrophobicContact CZ2-CD1 3.95Å; W760-I785 HydrophobicContact CZ3-CD1 4.26Å; S781-I785 VanDerWaalsContact O-CG1 3.24Å; S781-I785 WeakPolarHBondContact O-CG1 3.29Å; S781-I785 PolarHBondContact O-N 3.44Å; L782-I785 PolarHBondContact O-N 3.37Å; I785-A787 PolarHBondContact O-N 3.32Å; I785-A788 WeakPolarHBondContact O-CB 3.42Å; I785-A788 PolarHBondContact O-N 3.27Å; I785-T789 HydrophobicContact CG2-CG2 4.5Å; I785-T789 WeakPolarHBondContact O-CG2 3.47Å; I785-T789 PolarHBondContact O-N 2.82Å; I785-T789 PolarHBondContact O-OG1 2.79Å
786	T	89.8	Confident	92.3	Very high	35 Å²	35	63.5 Å²	63.5	22%	0.215	36%	0.356	C	S	.	.	H	α-helix	trans	-61	-43	178.3	48.1	0	0	0	0	111.7	L782 E783 A788 T789 E790	L782-T786 WeakPolarHBondContact O-CB 3.17Å; L782-T786 WeakPolarHBondContact O-CG2 3.48Å; L782-T786 PolarHBondContact O-N 3.34Å; L782-T786 PolarHBondContact O-OG1 2.91Å; E783-T786 WeakPolarHBondContact CA-OG1 3.08Å; E783-T786 PolarHBondContact O-OG1 3.15Å; E783-T786 VanDerWaalsContact O-OG1 3.05Å; T786-A788 PolarHBondContact O-N 2.93Å; T786-T789 PolarHBondContact O-N 3.18Å; T786-T789 PolarHBondContact O-OG1 3.43Å; T786-E790 PolarHBondContact O-N 3.04Å
787	A	92.1	Very high	92.4	Very high	44 Å²	44	59.2 Å²	59.2	36%	0.364	33%	0.331	S	S	.	.	H	α-helix	trans	-62.1	-41.5	174.3	0	0	0	0	0	112.7	E783 I785 E790 N791	E783-A787 VanDerWaalsContact O-CB 3.22Å; E783-A787 WeakPolarHBondContact O-CB 3.33Å; E783-A787 PolarHBondContact O-N 3.16Å; I785-A787 PolarHBondContact O-N 3.32Å; A787-E790 PolarHBondContact O-N 3.15Å; A787-N791 WeakPolarHBondContact O-CB 3.48Å; A787-N791 PolarHBondContact O-N 3.27Å; A787-N791 PolarHBondContact O-ND2 2.96Å
788	A	92.2	Very high	92.5	Very high	49 Å²	49	59.3 Å²	59.3	41%	0.405	33%	0.329	S	S	.	.	H	α-helix	trans	-62	-44.5	176.7	0	0	0	0	0	111.6	S784 I785 T786 N791 I792	S784-A788 WeakPolarHBondContact O-CB 3.44Å; S784-A788 PolarHBondContact O-N 3.37Å; I785-A788 WeakPolarHBondContact O-CB 3.42Å; I785-A788 PolarHBondContact O-N 3.27Å; T786-A788 PolarHBondContact O-N 2.93Å; A788-N791 PolarHBondContact O-N 3.12Å; A788-I792 WeakPolarHBondContact O-CG1 3.48Å; A788-I792 PolarHBondContact O-N 3.44Å; A788-I792 VanDerWaalsContact O-N 3.16Å
789	T	90.6	Very high	92.6	Very high	24 Å²	24	58.7 Å²	58.7	15%	0.147	33%	0.326	C	S	.	.	H	α-helix	trans	-64.8	-41.2	178.9	61.9	0	0	0	0	112.4	I785 T786 N791 I792 G793	I785-T789 HydrophobicContact CG2-CG2 4.5Å; I785-T789 WeakPolarHBondContact O-CG2 3.47Å; I785-T789 PolarHBondContact O-N 2.82Å; I785-T789 PolarHBondContact O-OG1 2.79Å; T786-T789 PolarHBondContact O-N 3.18Å; T786-T789 PolarHBondContact O-OG1 3.43Å; T789-N791 VanDerWaalsContact C-N 3.34Å; T789-N791 PolarHBondContact O-N 3.11Å; T789-I792 PolarHBondContact O-N 3.41Å; T789-G793 PolarHBondContact O-N 3.29Å
790	E	91.6	Very high	92.8	Very high	46 Å²	46	53.3 Å²	53.3	22%	0.215	30%	0.302	C	S	.	.	H	α-helix	trans	-64.6	-37.9	174.4	-174.6	-177.2	159.7	0	0	112	K686 T786 A787 I792 G793 K794	K686-E790 WeakPolarHBondContact CE-OE1 3.29Å; K686-E790 WeakPolarHBondContact CE-OE2 3.49Å; K686-E790 HydrophobicContact CG-CG 3.82Å; K686-E790 IonicContact NZ-OE2 3.57Å; T786-E790 PolarHBondContact O-N 3.04Å; A787-E790 PolarHBondContact O-N 3.15Å; E790-I792 VanDerWaalsContact C-N 3.29Å; E790-I792 PolarHBondContact O-N 2.92Å; E790-G793 PolarHBondContact O-N 3.36Å; E790-G793 VanDerWaalsContact O-N 3.16Å; E790-K794 PolarHBondContact O-N 3.39Å; E790-K794 WeakPolarHBondContact OE1-CE 3.4Å; E790-K794 IonicContact OE1-NZ 2.77Å; E790-K794 PolarHBondContact OE1-NZ 2.87Å
791	N	93.9	Very high	92.8	Very high	91 Å²	91	49.2 Å²	49.2	49%	0.487	29%	0.287	S	S	.	.	H	α-helix	trans	-63.9	-33.9	177.1	-73.5	-23.4	0	0	0	112.3	A787 A788 T789 K794 M795	A787-N791 WeakPolarHBondContact O-CB 3.48Å; A787-N791 PolarHBondContact O-N 3.27Å; A787-N791 PolarHBondContact O-ND2 2.96Å; A788-N791 PolarHBondContact O-N 3.12Å; T789-N791 VanDerWaalsContact C-N 3.34Å; T789-N791 PolarHBondContact O-N 3.11Å; N791-K794 PolarHBondContact O-N 3.3Å; N791-M795 WeakPolarHBondContact O-CB 3.43Å; N791-M795 PolarHBondContact O-N 2.75Å
792	I	94.1	Very high	92.7	Very high	41 Å²	41	51.8 Å²	51.8	21%	0.21	29%	0.292	C	S	.	.	H	α-helix	trans	-63	-44.6	172.8	-63.5	169.7	0	0	0	110.1	R750 D753 F754 A788 T789 E790 K794 M795 V796	R750-I792 HydrophobicContact CB-CG2 4.4Å; R750-I792 HydrophobicContact CG-CG2 4.37Å; D753-I792 HydrophobicContact CB-CD1 4.02Å; D753-I792 HydrophobicContact CB-CG2 4.19Å; F754-I792 HydrophobicContact CD1-CG2 4.48Å; F754-I792 HydrophobicContact CE1-CG2 3.91Å; A788-I792 WeakPolarHBondContact O-CG1 3.48Å; A788-I792 PolarHBondContact O-N 3.44Å; A788-I792 VanDerWaalsContact O-N 3.16Å; T789-I792 PolarHBondContact O-N 3.41Å; E790-I792 VanDerWaalsContact C-N 3.29Å; E790-I792 PolarHBondContact O-N 2.92Å; I792-K794 PolarHBondContact O-N 2.88Å; I792-M795 HydrophobicContact CG2-CE 4.42Å; I792-M795 PolarHBondContact O-N 3.07Å; I792-V796 WeakPolarHBondContact O-CG2 3.38Å; I792-V796 PolarHBondContact O-N 2.9Å
793	G	93.1	Very high	92.6	Very high	0 Å²	0	53.7 Å²	53.7	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-58.4	-44.3	174.8	0	0	0	0	0	112.9	T789 E790 V796 A797	T789-G793 PolarHBondContact O-N 3.29Å; E790-G793 PolarHBondContact O-N 3.36Å; E790-G793 VanDerWaalsContact O-N 3.16Å; G793-V796 PolarHBondContact O-N 3.21Å; G793-A797 PolarHBondContact O-N 3.34Å
794	K	94.1	Very high	92.5	Very high	87 Å²	87	51 Å²	51	38%	0.378	29%	0.29	S	S	.	.	H	α-helix	trans	-62.5	-46.7	175.1	-71	171.5	-176.7	159.4	0	112.1	T685 E790 N791 I792 V796 A797 T798	T685-K794 HydrophobicContact CG2-CG 4.07Å; E790-K794 PolarHBondContact O-N 3.39Å; E790-K794 WeakPolarHBondContact OE1-CE 3.4Å; E790-K794 IonicContact OE1-NZ 2.77Å; E790-K794 PolarHBondContact OE1-NZ 2.87Å; N791-K794 PolarHBondContact O-N 3.3Å; I792-K794 PolarHBondContact O-N 2.88Å; K794-V796 VanDerWaalsContact C-N 3.33Å; K794-V796 PolarHBondContact O-N 3.49Å; K794-A797 PolarHBondContact O-N 3.21Å; K794-T798 PolarHBondContact O-N 2.85Å; K794-T798 PolarHBondContact O-OG1 3.34Å; K794-T798 VanDerWaalsContact O-OG1 3.09Å
795	M	95.5	Very high	92.3	Very high	79 Å²	79	52 Å²	52	39%	0.389	29%	0.285	S	S	.	.	H	α-helix	trans	-57	-46.6	177.7	179.3	-172.2	69.6	0	0	111.3	N791 I792 T798 L799	N791-M795 WeakPolarHBondContact O-CB 3.43Å; N791-M795 PolarHBondContact O-N 2.75Å; I792-M795 HydrophobicContact CG2-CE 4.42Å; I792-M795 PolarHBondContact O-N 3.07Å; M795-T798 PolarHBondContact O-N 3.28Å; M795-L799 HydrophobicContact CG-CD1 4.21Å; M795-L799 WeakPolarHBondContact O-CG 3.39Å; M795-L799 PolarHBondContact O-N 3.16Å
796	V	94.8	Very high	92.1	Very high	1 Å²	1	52.8 Å²	52.8	1%	0.006	30%	0.295	C	S	.	.	H	α-helix	trans	-64.1	-42.2	177.8	174.5	0	0	0	0	111.4	I682 C746 R750 F754 I792 G793 K794 T798 L799 Q800	I682-V796 HydrophobicContact CD1-CB 3.92Å; I682-V796 HydrophobicContact CD1-CG1 3.5Å; I682-V796 VanDerWaalsContact CD1-CG1 3.5Å; C746-V796 HydrophobicContact CB-CG1 3.97Å; R750-V796 HydrophobicContact CB-CG2 4.23Å; R750-V796 HydrophobicContact CG-CG2 3.76Å; F754-V796 HydrophobicContact CZ-CB 4.16Å; F754-V796 HydrophobicContact CZ-CG1 4.36Å; F754-V796 HydrophobicContact CZ-CG2 3.87Å; I792-V796 WeakPolarHBondContact O-CG2 3.38Å; I792-V796 PolarHBondContact O-N 2.9Å; G793-V796 PolarHBondContact O-N 3.21Å; K794-V796 VanDerWaalsContact C-N 3.33Å; K794-V796 PolarHBondContact O-N 3.49Å; V796-T798 VanDerWaalsContact C-N 3.33Å; V796-T798 PolarHBondContact O-N 2.68Å; V796-L799 PolarHBondContact O-N 2.58Å; V796-Q800 HydrophobicContact CG1-CG 4.33Å; V796-Q800 VanDerWaalsContact O-CG 3.27Å; V796-Q800 WeakPolarHBondContact O-CG 3.24Å; V796-Q800 PolarHBondContact O-N 3.46Å
797	A	93.6	Very high	91.9	Very high	20 Å²	20	54.2 Å²	54.2	17%	0.165	30%	0.3	C	S	.	.	H	α-helix	trans	-63.3	-37.8	176.8	0	0	0	0	0	112.7	T685 G793 K794 S801	T685-A797 HydrophobicContact CG2-CB 4.24Å; G793-A797 PolarHBondContact O-N 3.34Å; K794-A797 PolarHBondContact O-N 3.21Å; A797-S801 PolarHBondContact O-N 3.25Å; A797-S801 PolarHBondContact O-OG 2.96Å
798	T	93.9	Very high	91.7	Very high	77 Å²	77	54.6 Å²	54.6	47%	0.472	30%	0.303	S	S	.	.	H	α-helix	trans	-63.7	-48.8	173.1	-58	0	0	0	0	111	K794 M795 V796 Q800 S801 E802	K794-T798 PolarHBondContact O-N 2.85Å; K794-T798 PolarHBondContact O-OG1 3.34Å; K794-T798 VanDerWaalsContact O-OG1 3.09Å; M795-T798 PolarHBondContact O-N 3.28Å; V796-T798 VanDerWaalsContact C-N 3.33Å; V796-T798 PolarHBondContact O-N 2.68Å; T798-Q800 VanDerWaalsContact C-N 3.34Å; T798-Q800 PolarHBondContact O-N 2.89Å; T798-S801 WeakPolarHBondContact O-CB 3.21Å; T798-S801 PolarHBondContact O-N 3.22Å; T798-S801 VanDerWaalsContact O-N 3.12Å; T798-E802 WeakPolarHBondContact O-CG 3.44Å; T798-E802 PolarHBondContact O-N 3.26Å
799	L	92.6	Very high	91.5	Very high	72 Å²	72	59.9 Å²	59.9	38%	0.377	31%	0.312	S	S	.	.	H	α-helix	trans	-57.4	-45.8	176.6	-72.9	168.4	0	0	0	111.5	M795 V796 S801 E802 M803	M795-L799 HydrophobicContact CG-CD1 4.21Å; M795-L799 WeakPolarHBondContact O-CG 3.39Å; M795-L799 PolarHBondContact O-N 3.16Å; V796-L799 PolarHBondContact O-N 2.58Å; L799-S801 VanDerWaalsContact C-N 3.3Å; L799-S801 PolarHBondContact O-N 2.93Å; L799-E802 PolarHBondContact O-N 2.77Å; L799-M803 VanDerWaalsContact O-CG 3.22Å; L799-M803 WeakPolarHBondContact O-CG 3.2Å; L799-M803 PolarHBondContact O-N 2.69Å
800	Q	93.4	Very high	91.4	Very high	0 Å²	0	63.3 Å²	63.3	0%	0	33%	0.326	C	S	.	.	H	α-helix	trans	-59.5	-41.2	176.8	-71.5	177.5	-35.2	0	0	112.2	M681 V743 C746 I747 V796 T798 M803 I804	M681-Q800 HydrophobicContact CG-CB 3.98Å; M681-Q800 HydrophobicContact SD-CB 3.86Å; V743-Q800 HydrophobicContact CG1-CB 4.36Å; V743-Q800 HydrophobicContact CG1-CG 3.97Å; V743-Q800 PolarHBondContact O-NE2 3.31Å; C746-Q800 HydrophobicContact CB-CG 4.31Å; I747-Q800 VanDerWaalsContact CG1-NE2 3.27Å; V796-Q800 HydrophobicContact CG1-CG 4.33Å; V796-Q800 VanDerWaalsContact O-CG 3.27Å; V796-Q800 WeakPolarHBondContact O-CG 3.24Å; V796-Q800 PolarHBondContact O-N 3.46Å; T798-Q800 VanDerWaalsContact C-N 3.34Å; T798-Q800 PolarHBondContact O-N 2.89Å; Q800-M803 PolarHBondContact O-N 2.96Å; Q800-I804 WeakPolarHBondContact O-CG1 3.26Å; Q800-I804 PolarHBondContact O-N 3.37Å; Q800-I804 VanDerWaalsContact O-N 3.1Å
801	S	91.8	Very high	91.2	Very high	48 Å²	48	64.9 Å²	64.9	34%	0.336	34%	0.336	S	S	.	.	H	α-helix	trans	-63.6	-46.4	177.6	-58.9	0	0	0	0	111.5	A797 T798 L799 M803 I804 E805	A797-S801 PolarHBondContact O-N 3.25Å; A797-S801 PolarHBondContact O-OG 2.96Å; T798-S801 WeakPolarHBondContact O-CB 3.21Å; T798-S801 PolarHBondContact O-N 3.22Å; T798-S801 VanDerWaalsContact O-N 3.12Å; L799-S801 VanDerWaalsContact C-N 3.3Å; L799-S801 PolarHBondContact O-N 2.93Å; S801-M803 VanDerWaalsContact C-N 3.31Å; S801-M803 PolarHBondContact O-N 2.64Å; S801-I804 PolarHBondContact O-N 3.38Å; S801-E805 WeakPolarHBondContact O-CG 2.91Å; S801-E805 PolarHBondContact O-N 3.24Å
802	E	91.2	Very high	91	Very high	113 Å²	113	64 Å²	64	53%	0.528	33%	0.334	S	S	.	.	H	α-helix	trans	-59.9	-40.8	176.9	-70.7	175.6	-177.1	0	0	112	T798 L799 E805 S806	T798-E802 WeakPolarHBondContact O-CG 3.44Å; T798-E802 PolarHBondContact O-N 3.26Å; L799-E802 PolarHBondContact O-N 2.77Å; E802-E805 PolarHBondContact O-N 3.07Å; E802-S806 WeakPolarHBondContact O-CB 3.43Å; E802-S806 PolarHBondContact O-N 3.35Å
803	M	88.4	Confident	90.8	Very high	65 Å²	65	66.5 Å²	66.5	32%	0.32	35%	0.345	S	S	.	.	H	α-helix	trans	-65.3	-43.4	178.6	-68.2	-176.7	92.9	0	0	112.4	F742 C746 L799 Q800 S801 S806 Q807	F742-M803 HydrophobicContact CB-CE 3.4Å; F742-M803 VanDerWaalsContact CB-CE 3.4Å; F742-M803 HydrophobicContact CB-SD 4.35Å; F742-M803 HydrophobicContact CD1-CE 4.03Å; F742-M803 HydrophobicContact CG-CE 3.81Å; C746-M803 VanDerWaalsContact SG-SD 3.69Å; L799-M803 VanDerWaalsContact O-CG 3.22Å; L799-M803 WeakPolarHBondContact O-CG 3.2Å; L799-M803 PolarHBondContact O-N 2.69Å; Q800-M803 PolarHBondContact O-N 2.96Å; S801-M803 VanDerWaalsContact C-N 3.31Å; S801-M803 PolarHBondContact O-N 2.64Å; M803-S806 PolarHBondContact O-N 3.46Å; M803-Q807 WeakPolarHBondContact O-CB 3.29Å; M803-Q807 PolarHBondContact O-N 3.12Å
804	I	89.4	Confident	90.6	Very high	48 Å²	48	69.5 Å²	69.5	25%	0.246	36%	0.361	C	S	.	.	H	α-helix	trans	-66.9	-42.2	177.7	-67.9	168	0	0	0	110.7	N679 M681 V743 Q800 S801 S806 Q807 A808	N679-I804 HydrophobicContact CB-CD1 3.65Å; M681-I804 HydrophobicContact CE-CD1 4.22Å; M681-I804 HydrophobicContact CG-CD1 3.72Å; M681-I804 HydrophobicContact SD-CD1 3.42Å; M681-I804 WeakPolarHBondContact SD-CD1 3.48Å; V743-I804 HydrophobicContact CG2-CD1 4.2Å; V743-I804 HydrophobicContact CG2-CG1 3.95Å; Q800-I804 WeakPolarHBondContact O-CG1 3.26Å; Q800-I804 PolarHBondContact O-N 3.37Å; Q800-I804 VanDerWaalsContact O-N 3.1Å; S801-I804 PolarHBondContact O-N 3.38Å; I804-S806 VanDerWaalsContact C-N 3.34Å; I804-Q807 PolarHBondContact O-N 3.17Å; I804-A808 WeakPolarHBondContact O-CB 3.31Å; I804-A808 PolarHBondContact O-N 3.1Å
805	E	89.1	Confident	90.4	Very high	101 Å²	101	70.3 Å²	70.3	47%	0.472	37%	0.366	S	S	.	.	H	α-helix	trans	-61.3	-43.6	174.8	-77.6	-169.2	-161.3	0	0	112	S801 E802 Q807 A808 R809	S801-E805 WeakPolarHBondContact O-CG 2.91Å; S801-E805 PolarHBondContact O-N 3.24Å; E802-E805 PolarHBondContact O-N 3.07Å; E805-Q807 VanDerWaalsContact C-N 3.34Å; E805-Q807 PolarHBondContact O-N 3.36Å; E805-A808 PolarHBondContact O-N 3.3Å; E805-R809 VanDerWaalsContact O-CG 3.26Å; E805-R809 WeakPolarHBondContact O-CG 3.41Å; E805-R809 PolarHBondContact O-N 3.2Å; E805-R809 IonicContact OE2-CZ 2.66Å; E805-R809 IonicContact OE2-NH2 3.34Å; E805-R809 PolarHBondContact OE2-NH2 2.97Å
806	S	88.3	Confident	90.2	Very high	67 Å²	67	72.2 Å²	72.2	47%	0.469	37%	0.374	S	S	.	.	H	α-helix	trans	-60.2	-45.3	176.4	-175.4	0	0	0	0	111.2	E802 M803 I804 R809 Q810	E802-S806 WeakPolarHBondContact O-CB 3.43Å; E802-S806 PolarHBondContact O-N 3.35Å; M803-S806 PolarHBondContact O-N 3.46Å; I804-S806 VanDerWaalsContact C-N 3.34Å; S806-R809 PolarHBondContact O-N 3.47Å; S806-Q810 WeakPolarHBondContact O-CB 2.86Å; S806-Q810 PolarHBondContact O-N 3.33Å
807	Q	86.9	Confident	90	Very high	66 Å²	66	79.3 Å²	79.3	31%	0.308	40%	0.401	S	S	.	.	H	α-helix	trans	-61.3	-47.1	176.1	-177.2	59.4	44.2	0	0	111.5	A739 M803 I804 E805 R809 Q810 D811	A739-Q807 HydrophobicContact CB-CB 4.23Å; A739-Q807 HydrophobicContact CB-CG 3.79Å; M803-Q807 WeakPolarHBondContact O-CB 3.29Å; M803-Q807 PolarHBondContact O-N 3.12Å; I804-Q807 PolarHBondContact O-N 3.17Å; E805-Q807 VanDerWaalsContact C-N 3.34Å; E805-Q807 PolarHBondContact O-N 3.36Å; Q807-R809 VanDerWaalsContact C-N 3.33Å; Q807-R809 PolarHBondContact O-N 2.77Å; Q807-Q810 PolarHBondContact O-N 3.06Å; Q807-Q810 VanDerWaalsContact O-N 3.1Å; Q807-D811 VanDerWaalsContact NE2-CG 3.27Å; Q807-D811 PolarHBondContact NE2-OD1 3.16Å; Q807-D811 PolarHBondContact NE2-OD2 3.34Å; Q807-D811 VanDerWaalsContact NE2-OD2 3.09Å; Q807-D811 PolarHBondContact O-N 3.5Å
808	A	87.2	Confident	89.7	Confident	51 Å²	51	82.4 Å²	82.4	42%	0.421	42%	0.417	S	S	.	.	H	α-helix	trans	-60.5	-41.7	178	0	0	0	0	0	112	I804 E805 Q810 D811 V812	I804-A808 WeakPolarHBondContact O-CB 3.31Å; I804-A808 PolarHBondContact O-N 3.1Å; E805-A808 PolarHBondContact O-N 3.3Å; A808-Q810 VanDerWaalsContact C-N 3.32Å; A808-Q810 PolarHBondContact O-N 3.14Å; A808-D811 PolarHBondContact O-N 3.41Å; A808-V812 VanDerWaalsContact O-CG2 3.31Å; A808-V812 WeakPolarHBondContact O-CG2 3.42Å; A808-V812 PolarHBondContact O-N 2.93Å
809	R	88.8	Confident	89.5	Confident	160 Å²	160	84.9 Å²	84.9	60%	0.604	42%	0.419	S	S	*	.	H	α-helix	trans	-61.9	-41.6	174.3	-70.8	173.4	-161.7	-177.9	9.5	111.2	E805 S806 Q807 Q813	E805-R809 VanDerWaalsContact O-CG 3.26Å; E805-R809 WeakPolarHBondContact O-CG 3.41Å; E805-R809 PolarHBondContact O-N 3.2Å; E805-R809 IonicContact OE2-CZ 2.66Å; E805-R809 IonicContact OE2-NH2 3.34Å; E805-R809 PolarHBondContact OE2-NH2 2.97Å; S806-R809 PolarHBondContact O-N 3.47Å; Q807-R809 VanDerWaalsContact C-N 3.33Å; Q807-R809 PolarHBondContact O-N 2.77Å; R809-Q813 VanDerWaalsContact O-CG 3.31Å; R809-Q813 WeakPolarHBondContact O-CG 3.25Å; R809-Q813 PolarHBondContact O-N 3.21Å
810	Q	87.4	Confident	89.3	Confident	96 Å²	96	84 Å²	84	45%	0.449	42%	0.423	S	S	.	.	H	α-helix	trans	-69.4	-37.8	179.5	-169.8	158.3	0.9	0	0	112.4	S806 Q807 A808 Q813 N814	S806-Q810 WeakPolarHBondContact O-CB 2.86Å; S806-Q810 PolarHBondContact O-N 3.33Å; Q807-Q810 PolarHBondContact O-N 3.06Å; Q807-Q810 VanDerWaalsContact O-N 3.1Å; A808-Q810 VanDerWaalsContact C-N 3.32Å; A808-Q810 PolarHBondContact O-N 3.14Å; Q810-Q813 PolarHBondContact O-N 3Å; Q810-N814 WeakPolarHBondContact O-CB 3.48Å; Q810-N814 PolarHBondContact O-N 3.38Å; Q810-N814 PolarHBondContact O-ND2 2.92Å
811	D	87.2	Confident	89.1	Confident	79 Å²	79	91.5 Å²	91.5	42%	0.422	46%	0.455	S	S	.	.	H	α-helix	trans	-64.8	-44	175.3	-71.4	-26.6	0	0	0	111.4	Q807 A808 Q813 N814 E815	Q807-D811 VanDerWaalsContact NE2-CG 3.27Å; Q807-D811 PolarHBondContact NE2-OD1 3.16Å; Q807-D811 PolarHBondContact NE2-OD2 3.34Å; Q807-D811 VanDerWaalsContact NE2-OD2 3.09Å; Q807-D811 PolarHBondContact O-N 3.5Å; A808-D811 PolarHBondContact O-N 3.41Å; D811-Q813 VanDerWaalsContact C-N 3.34Å; D811-Q813 PolarHBondContact O-N 3.47Å; D811-N814 PolarHBondContact O-N 2.92Å; D811-E815 WeakPolarHBondContact O-CB 3.46Å; D811-E815 PolarHBondContact O-N 2.93Å
812	V	90.8	Very high	89	Confident	72 Å²	72	93 Å²	93	44%	0.436	46%	0.458	S	S	.	.	H	α-helix	trans	-60.5	-43.2	173.2	171.6	0	0	0	0	111.2	A808 N814 E815 Q816	A808-V812 VanDerWaalsContact O-CG2 3.31Å; A808-V812 WeakPolarHBondContact O-CG2 3.42Å; A808-V812 PolarHBondContact O-N 2.93Å; V812-N814 PolarHBondContact O-N 3.33Å; V812-E815 PolarHBondContact O-N 3.25Å; V812-Q816 HydrophobicContact CG1-CG 4.5Å; V812-Q816 WeakPolarHBondContact O-CB 3.42Å; V812-Q816 VanDerWaalsContact O-CG 3.24Å; V812-Q816 WeakPolarHBondContact O-CG 3.35Å; V812-Q816 PolarHBondContact O-N 3.49Å
813	Q	90.2	Very high	88.8	Confident	95 Å²	95	94.2 Å²	94.2	44%	0.444	46%	0.464	S	S	.	.	H	α-helix	trans	-63.5	-40.5	176	-74.6	178.3	17.5	0	0	112.2	R809 Q810 D811 Q816 R817	R809-Q813 VanDerWaalsContact O-CG 3.31Å; R809-Q813 WeakPolarHBondContact O-CG 3.25Å; R809-Q813 PolarHBondContact O-N 3.21Å; Q810-Q813 PolarHBondContact O-N 3Å; D811-Q813 VanDerWaalsContact C-N 3.34Å; D811-Q813 PolarHBondContact O-N 3.47Å; Q813-Q816 PolarHBondContact O-N 2.89Å; Q813-R817 VanDerWaalsContact O-CG 3.3Å; Q813-R817 WeakPolarHBondContact O-CG 3.38Å; Q813-R817 PolarHBondContact O-N 3.24Å
814	N	88.3	Confident	88.6	Confident	62 Å²	62	93.5 Å²	93.5	33%	0.332	47%	0.468	S	S	.	.	H	α-helix	trans	-66.5	-43.5	177.5	-73.7	-25.3	0	0	0	111.3	Q810 D811 V812 Q816 R817 V818	Q810-N814 WeakPolarHBondContact O-CB 3.48Å; Q810-N814 PolarHBondContact O-N 3.38Å; Q810-N814 PolarHBondContact O-ND2 2.92Å; D811-N814 PolarHBondContact O-N 2.92Å; V812-N814 PolarHBondContact O-N 3.33Å; N814-Q816 PolarHBondContact O-N 3.32Å; N814-R817 WeakPolarHBondContact O-CB 3.49Å; N814-R817 PolarHBondContact O-N 3.22Å; N814-R817 PolarHBondContact OD1-NH1 2.7Å; N814-V818 WeakPolarHBondContact O-CG2 3.49Å; N814-V818 PolarHBondContact O-N 2.88Å
815	E	89.8	Confident	88.4	Confident	104 Å²	104	95 Å²	95	49%	0.486	48%	0.48	S	S	.	.	H	α-helix	trans	-59.3	-46.2	174.2	-176.8	177.4	-167.9	0	0	110.9	D811 V812 R817 V818 Y819	D811-E815 WeakPolarHBondContact O-CB 3.46Å; D811-E815 PolarHBondContact O-N 2.93Å; V812-E815 PolarHBondContact O-N 3.25Å; E815-R817 VanDerWaalsContact C-N 3.33Å; E815-R817 PolarHBondContact O-N 3.28Å; E815-V818 WeakPolarHBondContact O-CB 3.45Å; E815-V818 PolarHBondContact O-N 3.34Å; E815-V818 VanDerWaalsContact O-N 3.11Å; E815-Y819 HydrophobicContact CG-CD2 3.71Å; E815-Y819 HydrophobicContact CG-CE2 3.42Å; E815-Y819 VanDerWaalsContact CG-CE2 3.42Å; E815-Y819 VanDerWaalsContact O-CD2 3.27Å; E815-Y819 WeakPolarHBondContact O-CD2 3.48Å; E815-Y819 PolarHBondContact O-N 2.81Å; E815-Y819 VanDerWaalsContact OE1-CE2 3.3Å; E815-Y819 WeakPolarHBondContact OE1-CE2 3.34Å
816	Q	90.9	Very high	88.2	Confident	120 Å²	120	95.4 Å²	95.4	56%	0.561	48%	0.482	S	S	*	.	H	α-helix	trans	-59.2	-41.3	174.5	-75.2	174.7	1.4	0	0	112.5	V812 Q813 N814 V818 Y819 A820	V812-Q816 HydrophobicContact CG1-CG 4.5Å; V812-Q816 WeakPolarHBondContact O-CB 3.42Å; V812-Q816 VanDerWaalsContact O-CG 3.24Å; V812-Q816 WeakPolarHBondContact O-CG 3.35Å; V812-Q816 PolarHBondContact O-N 3.49Å; Q813-Q816 PolarHBondContact O-N 2.89Å; N814-Q816 PolarHBondContact O-N 3.32Å; Q816-V818 VanDerWaalsContact C-N 3.33Å; Q816-V818 PolarHBondContact O-N 3.47Å; Q816-Y819 PolarHBondContact O-N 3.29Å; Q816-A820 VanDerWaalsContact O-CB 3.28Å; Q816-A820 WeakPolarHBondContact O-CB 3.42Å; Q816-A820 PolarHBondContact O-N 3.35Å
817	R	90.1	Very high	88.1	Confident	149 Å²	149	98.8 Å²	98.8	56%	0.562	49%	0.488	S	S	*	.	H	α-helix	trans	-63.3	-39.6	174.7	-73.1	172.3	-170.2	146.9	1.4	111.7	Q813 N814 E815 A820 K821	Q813-R817 VanDerWaalsContact O-CG 3.3Å; Q813-R817 WeakPolarHBondContact O-CG 3.38Å; Q813-R817 PolarHBondContact O-N 3.24Å; N814-R817 WeakPolarHBondContact O-CB 3.49Å; N814-R817 PolarHBondContact O-N 3.22Å; N814-R817 PolarHBondContact OD1-NH1 2.7Å; E815-R817 VanDerWaalsContact C-N 3.33Å; E815-R817 PolarHBondContact O-N 3.28Å; R817-A820 PolarHBondContact O-N 3.49Å; R817-K821 WeakPolarHBondContact O-CB 3.45Å; R817-K821 PolarHBondContact O-N 2.99Å
818	V	88.1	Confident	87.9	Confident	86 Å²	86	102.3 Å²	102.3	52%	0.521	50%	0.504	S	S	.	.	H	α-helix	trans	-65.6	-47.4	176.2	172.6	0	0	0	0	110.6	N814 E815 Q816 A820 K821 I822	N814-V818 WeakPolarHBondContact O-CG2 3.49Å; N814-V818 PolarHBondContact O-N 2.88Å; E815-V818 WeakPolarHBondContact O-CB 3.45Å; E815-V818 PolarHBondContact O-N 3.34Å; E815-V818 VanDerWaalsContact O-N 3.11Å; Q816-V818 VanDerWaalsContact C-N 3.33Å; Q816-V818 PolarHBondContact O-N 3.47Å; V818-A820 VanDerWaalsContact C-N 3.35Å; V818-A820 PolarHBondContact O-N 3.32Å; V818-K821 WeakPolarHBondContact O-CB 3.37Å; V818-K821 PolarHBondContact O-N 3.27Å; V818-K821 VanDerWaalsContact O-N 3.14Å; V818-I822 HydrophobicContact CG1-CD1 3.99Å; V818-I822 WeakPolarHBondContact O-CG1 3.49Å; V818-I822 PolarHBondContact O-N 3.46Å
819	Y	89.4	Confident	87.7	Confident	128 Å²	128	108.1 Å²	108.1	50%	0.502	52%	0.515	S	S	.	.	H	α-helix	trans	-60.2	-43.1	174.6	-80.4	-64.5	0	0	0	112.3	E815 Q816 K821 I822 Q823	E815-Y819 HydrophobicContact CG-CD2 3.71Å; E815-Y819 HydrophobicContact CG-CE2 3.42Å; E815-Y819 VanDerWaalsContact CG-CE2 3.42Å; E815-Y819 VanDerWaalsContact O-CD2 3.27Å; E815-Y819 WeakPolarHBondContact O-CD2 3.48Å; E815-Y819 PolarHBondContact O-N 2.81Å; E815-Y819 VanDerWaalsContact OE1-CE2 3.3Å; E815-Y819 WeakPolarHBondContact OE1-CE2 3.34Å; Q816-Y819 PolarHBondContact O-N 3.29Å; Y819-K821 VanDerWaalsContact C-N 3.27Å; Y819-K821 PolarHBondContact O-N 3.44Å; Y819-I822 PolarHBondContact O-N 3.46Å; Y819-I822 VanDerWaalsContact O-N 3.16Å; Y819-Q823 WeakPolarHBondContact O-CB 3.3Å; Y819-Q823 WeakPolarHBondContact O-CG 3.45Å; Y819-Q823 PolarHBondContact O-N 3.09Å
820	A	89.1	Confident	87.5	Confident	55 Å²	55	105.8 Å²	105.8	46%	0.455	51%	0.511	S	S	.	.	H	α-helix	trans	-60	-39.5	175.7	0	0	0	0	0	111.4	Q816 R817 V818 Q823 A824	Q816-A820 VanDerWaalsContact O-CB 3.28Å; Q816-A820 WeakPolarHBondContact O-CB 3.42Å; Q816-A820 PolarHBondContact O-N 3.35Å; R817-A820 PolarHBondContact O-N 3.49Å; V818-A820 VanDerWaalsContact C-N 3.35Å; V818-A820 PolarHBondContact O-N 3.32Å; A820-Q823 PolarHBondContact O-N 3.08Å; A820-A824 VanDerWaalsContact O-CB 3.23Å; A820-A824 WeakPolarHBondContact O-CB 3.46Å; A820-A824 PolarHBondContact O-N 2.98Å
821	K	89.3	Confident	87.3	Confident	156 Å²	156	106.1 Å²	106.1	68%	0.678	52%	0.516	S	S	*	.	H	α-helix	trans	-65.2	-41.9	174.6	-169.5	178.6	-177.7	-179.2	0	112	R817 V818 Y819 A824 T825	R817-K821 WeakPolarHBondContact O-CB 3.45Å; R817-K821 PolarHBondContact O-N 2.99Å; V818-K821 WeakPolarHBondContact O-CB 3.37Å; V818-K821 PolarHBondContact O-N 3.27Å; V818-K821 VanDerWaalsContact O-N 3.14Å; Y819-K821 VanDerWaalsContact C-N 3.27Å; Y819-K821 PolarHBondContact O-N 3.44Å; K821-A824 PolarHBondContact O-N 3.34Å; K821-T825 WeakPolarHBondContact O-CB 3.48Å; K821-T825 PolarHBondContact O-N 3.26Å; K821-T825 PolarHBondContact O-OG1 3.48Å
822	I	89.1	Confident	86.9	Confident	80 Å²	80	105 Å²	105	41%	0.41	52%	0.517	S	S	.	.	H	α-helix	trans	-63.2	-49.7	175.6	-67.3	167.2	0	0	0	110	V818 Y819 A824 T825 H826	V818-I822 HydrophobicContact CG1-CD1 3.99Å; V818-I822 WeakPolarHBondContact O-CG1 3.49Å; V818-I822 PolarHBondContact O-N 3.46Å; Y819-I822 PolarHBondContact O-N 3.46Å; Y819-I822 VanDerWaalsContact O-N 3.16Å; I822-A824 VanDerWaalsContact C-N 3.35Å; I822-A824 PolarHBondContact O-N 3.33Å; I822-T825 WeakPolarHBondContact O-CB 3.38Å; I822-T825 PolarHBondContact O-N 3.42Å; I822-T825 VanDerWaalsContact O-N 3.1Å; I822-H826 PolarHBondContact O-CD2 2.91Å; I822-H826 PolarHBondContact O-N 2.96Å
823	Q	86.4	Confident	86.6	Confident	138 Å²	138	105.9 Å²	105.9	65%	0.645	52%	0.52	S	S	*	.	H	α-helix	trans	-59.3	-43.6	177.1	-73.9	-178	4.3	0	0	112	Y819 A820 T825 H826 K827	Y819-Q823 WeakPolarHBondContact O-CB 3.3Å; Y819-Q823 WeakPolarHBondContact O-CG 3.45Å; Y819-Q823 PolarHBondContact O-N 3.09Å; A820-Q823 PolarHBondContact O-N 3.08Å; Q823-T825 VanDerWaalsContact C-N 3.3Å; Q823-T825 PolarHBondContact O-N 3.16Å; Q823-H826 PolarHBondContact O-N 3.44Å; Q823-K827 WeakPolarHBondContact O-CB 3.49Å; Q823-K827 PolarHBondContact O-N 3.49Å
824	A	85.3	Confident	86.3	Confident	50 Å²	50	107 Å²	107	41%	0.413	52%	0.523	S	S	.	.	H	α-helix	trans	-61.1	-40.3	175.1	0	0	0	0	0	111.7	A820 K821 I822 K827 Q828	A820-A824 VanDerWaalsContact O-CB 3.23Å; A820-A824 WeakPolarHBondContact O-CB 3.46Å; A820-A824 PolarHBondContact O-N 2.98Å; K821-A824 PolarHBondContact O-N 3.34Å; I822-A824 VanDerWaalsContact C-N 3.35Å; I822-A824 PolarHBondContact O-N 3.33Å; A824-K827 PolarHBondContact O-N 3.1Å; A824-Q828 WeakPolarHBondContact O-CB 3.23Å; A824-Q828 WeakPolarHBondContact O-CG 3.43Å; A824-Q828 PolarHBondContact O-N 3.14Å
825	T	85.2	Confident	85.8	Confident	79 Å²	79	107.8 Å²	107.8	49%	0.485	53%	0.534	S	S	.	.	H	α-helix	trans	-65.2	-42.6	176.2	-52.7	0	0	0	0	111.3	K821 I822 Q823 Q828 R829	K821-T825 WeakPolarHBondContact O-CB 3.48Å; K821-T825 PolarHBondContact O-N 3.26Å; K821-T825 PolarHBondContact O-OG1 3.48Å; I822-T825 WeakPolarHBondContact O-CB 3.38Å; I822-T825 PolarHBondContact O-N 3.42Å; I822-T825 VanDerWaalsContact O-N 3.1Å; Q823-T825 VanDerWaalsContact C-N 3.3Å; Q823-T825 PolarHBondContact O-N 3.16Å; T825-Q828 PolarHBondContact O-N 3.36Å; T825-R829 WeakPolarHBondContact O-CB 3.43Å; T825-R829 PolarHBondContact O-N 2.65Å
826	H	84.8	Confident	85.2	Confident	110 Å²	110	110.1 Å²	110.1	51%	0.509	54%	0.538	S	S	.	.	H	α-helix	trans	-62.7	-46.1	173.9	-88.1	-87.3	0	0	0	112	I822 Q823 Q828 R829 E830	I822-H826 PolarHBondContact O-CD2 2.91Å; I822-H826 PolarHBondContact O-N 2.96Å; Q823-H826 PolarHBondContact O-N 3.44Å; H826-Q828 VanDerWaalsContact C-N 3.33Å; H826-Q828 PolarHBondContact O-N 2.87Å; H826-R829 CarbonylContact O-C 3.39Å; H826-R829 WeakPolarHBondContact O-CB 3.38Å; H826-R829 PolarHBondContact O-N 2.99Å; H826-R829 VanDerWaalsContact O-N 3.11Å; H826-E830 PolarHBondContact O-N 2.87Å
827	K	85.9	Confident	84.7	Confident	139 Å²	139	110.3 Å²	110.3	60%	0.604	54%	0.539	S	S	*	.	H	α-helix	trans	-62.3	-39.9	177.6	-169.3	174.9	-177.6	177	0	111.8	Q823 A824 E830 L831	Q823-K827 WeakPolarHBondContact O-CB 3.49Å; Q823-K827 PolarHBondContact O-N 3.49Å; A824-K827 PolarHBondContact O-N 3.1Å; K827-E830 PolarHBondContact O-N 3.22Å; K827-L831 HydrophobicContact CG-CD1 4.35Å; K827-L831 WeakPolarHBondContact O-CB 3.28Å; K827-L831 VanDerWaalsContact O-CG 3.28Å; K827-L831 WeakPolarHBondContact O-CG 3.26Å; K827-L831 PolarHBondContact O-N 3.07Å
828	Q	82.4	Confident	84.1	Confident	140 Å²	140	107.7 Å²	107.7	65%	0.654	54%	0.536	S	S	*	.	H	α-helix	trans	-62.7	-42.5	172.2	-80.1	-174.9	-10.3	0	0	111.9	A824 T825 H826 L831 A832	A824-Q828 WeakPolarHBondContact O-CB 3.23Å; A824-Q828 WeakPolarHBondContact O-CG 3.43Å; A824-Q828 PolarHBondContact O-N 3.14Å; T825-Q828 PolarHBondContact O-N 3.36Å; H826-Q828 VanDerWaalsContact C-N 3.33Å; H826-Q828 PolarHBondContact O-N 2.87Å; Q828-L831 PolarHBondContact O-N 3Å; Q828-A832 WeakPolarHBondContact O-CB 3.38Å; Q828-A832 PolarHBondContact O-N 2.85Å
829	R	83.2	Confident	83.4	Confident	172 Å²	172	109 Å²	109	65%	0.649	54%	0.535	S	S	*	.	H	α-helix	trans	-64	-41.8	176.1	-175.9	179.8	-91.9	175.1	-7.7	111.9	T825 H826 A832 N833	T825-R829 WeakPolarHBondContact O-CB 3.43Å; T825-R829 PolarHBondContact O-N 2.65Å; H826-R829 CarbonylContact O-C 3.39Å; H826-R829 WeakPolarHBondContact O-CB 3.38Å; H826-R829 PolarHBondContact O-N 2.99Å; H826-R829 VanDerWaalsContact O-N 3.11Å; R829-A832 PolarHBondContact O-N 3.28Å; R829-N833 VanDerWaalsContact O-CG 3.32Å; R829-N833 PolarHBondContact O-N 2.99Å; R829-N833 PolarHBondContact O-OD1 3.13Å
830	E	84.3	Confident	82.6	Confident	111 Å²	111	106.3 Å²	106.3	52%	0.519	53%	0.529	S	S	.	.	H	α-helix	trans	-63.4	-43.3	174.1	-77.9	-172.6	176.3	0	0	112.6	H826 K827 A832 N833 K834	H826-E830 PolarHBondContact O-N 2.87Å; K827-E830 PolarHBondContact O-N 3.22Å; E830-A832 VanDerWaalsContact C-N 3.3Å; E830-A832 PolarHBondContact O-N 3Å; E830-N833 PolarHBondContact O-N 3.28Å; E830-K834 WeakPolarHBondContact O-CG 3.46Å; E830-K834 PolarHBondContact O-N 3.17Å
831	L	84.3	Confident	81.9	Confident	103 Å²	103	105 Å²	105	54%	0.539	52%	0.518	S	S	.	.	H	α-helix	trans	-62.7	-39.8	175.8	-74.8	167.2	0	0	0	111.2	K827 Q828 K834 S835	K827-L831 HydrophobicContact CG-CD1 4.35Å; K827-L831 WeakPolarHBondContact O-CB 3.28Å; K827-L831 VanDerWaalsContact O-CG 3.28Å; K827-L831 WeakPolarHBondContact O-CG 3.26Å; K827-L831 PolarHBondContact O-N 3.07Å; Q828-L831 PolarHBondContact O-N 3Å; L831-K834 PolarHBondContact O-N 3.35Å; L831-S835 VanDerWaalsContact O-CB 3.28Å; L831-S835 WeakPolarHBondContact O-CB 3.48Å; L831-S835 PolarHBondContact O-N 3.41Å
832	A	78.9	Confident	80.8	Confident	56 Å²	56	106.3 Å²	106.3	46%	0.463	52%	0.519	S	S	.	.	H	α-helix	trans	-63.2	-43.6	173.3	0	0	0	0	0	111.7	Q828 R829 E830 S835 W836	Q828-A832 WeakPolarHBondContact O-CB 3.38Å; Q828-A832 PolarHBondContact O-N 2.85Å; R829-A832 PolarHBondContact O-N 3.28Å; E830-A832 VanDerWaalsContact C-N 3.3Å; E830-A832 PolarHBondContact O-N 3Å; A832-S835 WeakPolarHBondContact O-CB 3.43Å; A832-S835 PolarHBondContact O-N 3.18Å; A832-W836 WeakPolarHBondContact O-CB 3.34Å; A832-W836 PolarHBondContact O-N 3.23Å
833	N	83.1	Confident	79.6	Confident	90 Å²	90	106.1 Å²	106.1	48%	0.481	52%	0.521	S	S	.	.	H	α-helix	trans	-63	-45.6	175.7	-73.8	-4.8	0	0	0	112	R829 E830 S835 W836 E837	R829-N833 VanDerWaalsContact O-CG 3.32Å; R829-N833 PolarHBondContact O-N 2.99Å; R829-N833 PolarHBondContact O-OD1 3.13Å; E830-N833 PolarHBondContact O-N 3.28Å; N833-S835 VanDerWaalsContact C-N 3.33Å; N833-S835 PolarHBondContact O-N 3Å; N833-W836 CarbonylContact O-C 3.6Å; N833-W836 WeakPolarHBondContact O-CB 3.43Å; N833-W836 PolarHBondContact O-N 3.18Å; N833-W836 VanDerWaalsContact O-N 3.15Å; N833-E837 WeakPolarHBondContact O-CG 3.33Å; N833-E837 PolarHBondContact O-N 3.05Å
834	K	83.9	Confident	78.5	Confident	119 Å²	119	103.8 Å²	103.8	52%	0.517	52%	0.52	S	S	.	.	H	α-helix	trans	-63.6	-38.4	175.5	-75.2	177.4	-179.1	170.6	0	112.1	E830 L831 W836 N838	E830-K834 WeakPolarHBondContact O-CG 3.46Å; E830-K834 PolarHBondContact O-N 3.17Å; L831-K834 PolarHBondContact O-N 3.35Å; K834-W836 VanDerWaalsContact C-N 3.32Å; K834-N838 VanDerWaalsContact O-CB 3.27Å; K834-N838 WeakPolarHBondContact O-CB 3.5Å; K834-N838 PolarHBondContact O-N 3.41Å; K834-N838 PolarHBondContact O-ND2 2.8Å
835	S	78.4	Confident	77.9	Confident	79 Å²	79	104.9 Å²	104.9	55%	0.552	52%	0.519	S	S	*	.	H	α-helix	trans	-63.4	-40.6	173.3	-175.1	0	0	0	0	111.2	L831 A832 N833 F839	L831-S835 VanDerWaalsContact O-CB 3.28Å; L831-S835 WeakPolarHBondContact O-CB 3.48Å; L831-S835 PolarHBondContact O-N 3.41Å; A832-S835 WeakPolarHBondContact O-CB 3.43Å; A832-S835 PolarHBondContact O-N 3.18Å; N833-S835 VanDerWaalsContact C-N 3.33Å; N833-S835 PolarHBondContact O-N 3Å; S835-F839 WeakPolarHBondContact O-CB 3.48Å; S835-F839 PolarHBondContact O-N 3.41Å
836	W	77.9	Confident	77.2	Confident	153 Å²	153	104.3 Å²	104.3	58%	0.58	52%	0.523	S	S	*	.	H	α-helix	trans	-66.9	-45.3	176.3	-179.3	-108.8	0	0	0	112.6	A832 N833 K834 N838 F839 L840	A832-W836 WeakPolarHBondContact O-CB 3.34Å; A832-W836 PolarHBondContact O-N 3.23Å; N833-W836 CarbonylContact O-C 3.6Å; N833-W836 WeakPolarHBondContact O-CB 3.43Å; N833-W836 PolarHBondContact O-N 3.18Å; N833-W836 VanDerWaalsContact O-N 3.15Å; K834-W836 VanDerWaalsContact C-N 3.32Å; W836-N838 PolarHBondContact O-N 3.1Å; W836-F839 HydrophobicContact CE3-CD1 4.28Å; W836-F839 HydrophobicContact CZ3-CD1 4.09Å; W836-F839 HydrophobicContact CZ3-CE1 4.37Å; W836-F839 WeakPolarHBondContact O-CB 3.45Å; W836-F839 PolarHBondContact O-N 3.26Å; W836-L840 HydrophobicContact CZ2-CD1 4.48Å; W836-L840 HydrophobicContact CZ2-CD2 4.35Å; W836-L840 HydrophobicContact CZ2-CG 4.45Å; W836-L840 WeakPolarHBondContact O-CG 3.45Å; W836-L840 PolarHBondContact O-N 3.08Å
837	E	80.3	Confident	76.7	Confident	124 Å²	124	107.2 Å²	107.2	58%	0.579	53%	0.533	S	S	*	.	H	α-helix	trans	-61.1	-43.2	173.6	-75.7	176.8	178.2	0	0	111.8	N833 F839 L840 A841	N833-E837 WeakPolarHBondContact O-CG 3.33Å; N833-E837 PolarHBondContact O-N 3.05Å; E837-F839 VanDerWaalsContact C-N 3.32Å; E837-F839 PolarHBondContact O-N 3Å; E837-L840 PolarHBondContact O-N 3.02Å; E837-A841 VanDerWaalsContact O-CB 3.24Å; E837-A841 WeakPolarHBondContact O-CB 3.42Å; E837-A841 PolarHBondContact O-N 3.07Å
838	N	76.4	Confident	75.9	Confident	93 Å²	93	103.3 Å²	103.3	50%	0.497	52%	0.522	S	S	.	.	H	α-helix	trans	-62.8	-39.5	174.2	-84.9	-33.1	0	0	0	112	K834 W836 R842	K834-N838 VanDerWaalsContact O-CB 3.27Å; K834-N838 WeakPolarHBondContact O-CB 3.5Å; K834-N838 PolarHBondContact O-N 3.41Å; K834-N838 PolarHBondContact O-ND2 2.8Å; W836-N838 PolarHBondContact O-N 3.1Å; N838-R842 WeakPolarHBondContact O-CB 3.39Å; N838-R842 VanDerWaalsContact O-CG 3.23Å; N838-R842 WeakPolarHBondContact O-CG 3.47Å; N838-R842 PolarHBondContact O-N 3.34Å
839	F	73.6	Confident	75.2	Confident	113 Å²	113	100.6 Å²	100.6	50%	0.496	51%	0.511	S	S	.	.	H	α-helix	trans	-61.8	-52.3	174.4	177.6	-98.8	0	0	0	110.8	S835 W836 E837 A841 R842 T843	S835-F839 WeakPolarHBondContact O-CB 3.48Å; S835-F839 PolarHBondContact O-N 3.41Å; W836-F839 HydrophobicContact CE3-CD1 4.28Å; W836-F839 HydrophobicContact CZ3-CD1 4.09Å; W836-F839 HydrophobicContact CZ3-CE1 4.37Å; W836-F839 WeakPolarHBondContact O-CB 3.45Å; W836-F839 PolarHBondContact O-N 3.26Å; E837-F839 VanDerWaalsContact C-N 3.32Å; E837-F839 PolarHBondContact O-N 3Å; F839-A841 VanDerWaalsContact C-N 3.33Å; F839-A841 PolarHBondContact O-N 3.26Å; F839-R842 PolarHBondContact O-N 3.19Å; F839-R842 VanDerWaalsContact O-N 3.1Å; F839-T843 HydrophobicContact CE1-CG2 4.33Å; F839-T843 HydrophobicContact CE2-CG2 4.17Å; F839-T843 HydrophobicContact CZ-CG2 4.04Å; F839-T843 PolarHBondContact O-N 2.97Å; F839-T843 PolarHBondContact O-OG1 2.92Å
840	L	73.9	Confident	74.7	Confident	73 Å²	73	100.1 Å²	100.1	38%	0.382	51%	0.514	S	S	.	.	H	α-helix	trans	-58	-41.4	176	-74.4	174.5	0	0	0	112.7	W836 E837 R842 T843 S844	W836-L840 HydrophobicContact CZ2-CD1 4.48Å; W836-L840 HydrophobicContact CZ2-CD2 4.35Å; W836-L840 HydrophobicContact CZ2-CG 4.45Å; W836-L840 WeakPolarHBondContact O-CG 3.45Å; W836-L840 PolarHBondContact O-N 3.08Å; E837-L840 PolarHBondContact O-N 3.02Å; L840-R842 VanDerWaalsContact C-N 3.31Å; L840-R842 PolarHBondContact O-N 3.06Å; L840-T843 PolarHBondContact O-N 3.46Å; L840-T843 PolarHBondContact O-OG1 3.18Å; L840-S844 VanDerWaalsContact O-CB 3.28Å; L840-S844 WeakPolarHBondContact O-CB 3.29Å; L840-S844 PolarHBondContact O-N 3.46Å; L840-S844 PolarHBondContact O-OG 3.27Å
841	A	72.5	Confident	74.3	Confident	27 Å²	27	102.1 Å²	102.1	22%	0.223	52%	0.521	C	S	.	.	H	α-helix	trans	-66.4	-33.5	178	0	0	0	0	0	112.3	E837 F839 N845 T848	E837-A841 VanDerWaalsContact O-CB 3.24Å; E837-A841 WeakPolarHBondContact O-CB 3.42Å; E837-A841 PolarHBondContact O-N 3.07Å; F839-A841 VanDerWaalsContact C-N 3.33Å; F839-A841 PolarHBondContact O-N 3.26Å; A841-N845 PolarHBondContact O-N 3.38Å; A841-T848 HydrophobicContact CB-CG2 4.42Å
842	R	66.2	Low	73.6	Confident	184 Å²	184	99.8 Å²	99.8	69%	0.694	52%	0.516	S	S	*	.	H	α-helix	trans	-76.7	-27	176	-74.7	173.9	-177	-176.9	1.6	113	N838 F839 L840 L849	N838-R842 WeakPolarHBondContact O-CB 3.39Å; N838-R842 VanDerWaalsContact O-CG 3.23Å; N838-R842 WeakPolarHBondContact O-CG 3.47Å; N838-R842 PolarHBondContact O-N 3.34Å; F839-R842 PolarHBondContact O-N 3.19Å; F839-R842 VanDerWaalsContact O-N 3.1Å; L840-R842 VanDerWaalsContact C-N 3.31Å; L840-R842 PolarHBondContact O-N 3.06Å; R842-L849 WeakPolarHBondContact O-CD2 3.28Å
843	T	64.7	Low	73.2	Confident	76 Å²	76	102.2 Å²	102.2	47%	0.466	52%	0.516	S	S	.	.	H	α-helix	trans	-95.1	-28.2	-179.5	54.2	0	0	0	0	113.7	F839 L840	F839-T843 HydrophobicContact CE1-CG2 4.33Å; F839-T843 HydrophobicContact CE2-CG2 4.17Å; F839-T843 HydrophobicContact CZ-CG2 4.04Å; F839-T843 PolarHBondContact O-N 2.97Å; F839-T843 PolarHBondContact O-OG1 2.92Å; L840-T843 PolarHBondContact O-N 3.46Å; L840-T843 PolarHBondContact O-OG1 3.18Å
844	S	63.9	Low	72.7	Confident	89 Å²	89	100.4 Å²	100.4	62%	0.622	51%	0.514	S	S	*	.	H	α-helix	trans	-129.4	-12.9	-160.9	-41.2	0	0	0	0	114.9	L840	L840-S844 VanDerWaalsContact O-CB 3.28Å; L840-S844 WeakPolarHBondContact O-CB 3.29Å; L840-S844 PolarHBondContact O-N 3.46Å; L840-S844 PolarHBondContact O-OG 3.27Å
845	N	72.4	Confident	72.3	Confident	73 Å²	73	100.6 Å²	100.6	39%	0.39	52%	0.52	S	S	.	.			trans	-104	103.4	-179	-170.5	-30.2	0	0	0	112.1	A841 K847 T848 L849	A841-N845 PolarHBondContact O-N 3.38Å; N845-K847 PolarHBondContact O-N 2.87Å; N845-K847 WeakPolarHBondContact OD1-CB 3.43Å; N845-K847 PolarHBondContact OD1-N 2.8Å; N845-T848 PolarHBondContact ND2-OG1 3.28Å; N845-T848 PolarHBondContact O-N 2.94Å; N845-T848 VanDerWaalsContact O-N 3.14Å; N845-T848 PolarHBondContact OD1-N 3.43Å; N845-T848 PolarHBondContact OD1-OG1 3.46Å; N845-L849 PolarHBondContact O-N 3.4Å
846	A	70.4	Confident	71.7	Confident	67 Å²	67	102.4 Å²	102.4	55%	0.554	52%	0.52	S	S	*	.	H	α-helix	trans	-58.7	-30.6	-177.9	0	0	0	0	0	114.2	K850	A846-K850 WeakPolarHBondContact O-CG 3.34Å; A846-K850 PolarHBondContact O-N 3.29Å; A846-K850 VanDerWaalsContact O-N 3.13Å
847	K	74.8	Confident	71.4	Confident	170 Å²	170	99.6 Å²	99.6	74%	0.739	51%	0.513	S	S	*	.	H	α-helix	trans	-71.5	-40.2	179.1	-126.5	177.7	-175.9	177.1	0	111	N845 K851	N845-K847 PolarHBondContact O-N 2.87Å; N845-K847 WeakPolarHBondContact OD1-CB 3.43Å; N845-K847 PolarHBondContact OD1-N 2.8Å; K847-K851 PolarHBondContact O-N 3.03Å
848	T	68.9	Low	71.1	Confident	58 Å²	58	101 Å²	101	36%	0.356	52%	0.517	S	S	.	.	H	α-helix	trans	-71.4	-39.8	178.7	-43.3	0	0	0	0	111.4	A841 N845 K851 A852	A841-T848 HydrophobicContact CB-CG2 4.42Å; N845-T848 PolarHBondContact ND2-OG1 3.28Å; N845-T848 PolarHBondContact O-N 2.94Å; N845-T848 VanDerWaalsContact O-N 3.14Å; N845-T848 PolarHBondContact OD1-N 3.43Å; N845-T848 PolarHBondContact OD1-OG1 3.46Å; T848-K851 PolarHBondContact O-N 3.07Å; T848-A852 PolarHBondContact O-N 3.48Å
849	L	66.5	Low	70.7	Confident	82 Å²	82	99.3 Å²	99.3	43%	0.429	52%	0.516	S	S	.	.	H	α-helix	trans	-61.2	-43.3	173.5	-81.1	169.9	0	0	0	112.8	R842 N845 K851 A852 K853	R842-L849 WeakPolarHBondContact O-CD2 3.28Å; N845-L849 PolarHBondContact O-N 3.4Å; L849-K851 PolarHBondContact O-N 3.16Å; L849-A852 PolarHBondContact O-N 3.41Å; L849-K853 WeakPolarHBondContact O-CB 3.5Å; L849-K853 PolarHBondContact O-N 3.01Å
850	K	72.7	Confident	70.2	Confident	162 Å²	162	98 Å²	98	70%	0.704	51%	0.513	S	S	*	.	H	α-helix	trans	-62.4	-40.9	174.4	-76.5	-178.8	-179.6	-175.3	0	112.4	A846 K853 A854	A846-K850 WeakPolarHBondContact O-CG 3.34Å; A846-K850 PolarHBondContact O-N 3.29Å; A846-K850 VanDerWaalsContact O-N 3.13Å; K850-K853 PolarHBondContact O-N 2.81Å; K850-A854 WeakPolarHBondContact O-CB 3.37Å; K850-A854 PolarHBondContact O-N 2.94Å
851	K	75.6	Confident	69.9	Low	154 Å²	154	100 Å²	100	67%	0.67	52%	0.521	S	S	*	.	H	α-helix	trans	-64.7	-42.5	174.7	-80.9	-173.7	176.2	-176	0	112.5	K847 T848 L849 A854 L855	K847-K851 PolarHBondContact O-N 3.03Å; T848-K851 PolarHBondContact O-N 3.07Å; L849-K851 PolarHBondContact O-N 3.16Å; K851-A854 PolarHBondContact O-N 3.46Å; K851-L855 PolarHBondContact O-N 2.9Å
852	A	70.5	Confident	69.6	Low	54 Å²	54	103.4 Å²	103.4	45%	0.446	54%	0.543	S	S	.	.	H	α-helix	trans	-64.2	-41.1	176.6	0	0	0	0	0	111.6	T848 L849 L855 Q856	T848-A852 PolarHBondContact O-N 3.48Å; L849-A852 PolarHBondContact O-N 3.41Å; A852-L855 PolarHBondContact O-N 3.49Å; A852-Q856 WeakPolarHBondContact O-CB 3.3Å; A852-Q856 PolarHBondContact O-N 3.43Å
853	K	70.1	Confident	69.4	Low	107 Å²	107	98.5 Å²	98.5	47%	0.465	54%	0.536	S	S	.	.	H	α-helix	trans	-61	-44.9	172.8	-176.6	171	178.7	172.5	0	111.9	L849 K850 L855 Q856 E857	L849-K853 WeakPolarHBondContact O-CB 3.5Å; L849-K853 PolarHBondContact O-N 3.01Å; K850-K853 PolarHBondContact O-N 2.81Å; K853-L855 PolarHBondContact O-N 2.8Å; K853-Q856 WeakPolarHBondContact O-CB 3.38Å; K853-Q856 PolarHBondContact O-N 3.37Å; K853-E857 WeakPolarHBondContact CE-OE1 3.45Å; K853-E857 WeakPolarHBondContact O-CB 3.39Å; K853-E857 WeakPolarHBondContact O-CG 3.48Å; K853-E857 PolarHBondContact O-N 2.92Å
854	A	73.2	Confident	69.2	Low	52 Å²	52	100.3 Å²	100.3	43%	0.43	54%	0.538	S	S	.	.	H	α-helix	trans	-64.2	-37.3	176.6	0	0	0	0	0	112.9	K850 K851 E857 K858	K850-A854 WeakPolarHBondContact O-CB 3.37Å; K850-A854 PolarHBondContact O-N 2.94Å; K851-A854 PolarHBondContact O-N 3.46Å; A854-E857 PolarHBondContact O-N 3.42Å; A854-K858 VanDerWaalsContact O-CB 3.3Å; A854-K858 WeakPolarHBondContact O-CB 3.43Å; A854-K858 PolarHBondContact O-N 3.17Å
855	L	74.6	Confident	68.9	Low	123 Å²	123	106.8 Å²	106.8	64%	0.644	55%	0.55	S	S	*	*	H	α-helix	trans	-66.9	-40.1	173.4	-81.7	167.5	0	0	0	112	K851 A852 K853 K858 A859	K851-L855 PolarHBondContact O-N 2.9Å; A852-L855 PolarHBondContact O-N 3.49Å; K853-L855 PolarHBondContact O-N 2.8Å; L855-K858 PolarHBondContact O-N 3.34Å; L855-A859 WeakPolarHBondContact O-CB 3.41Å; L855-A859 PolarHBondContact O-N 3.14Å
856	Q	67.5	Low	68.2	Low	116 Å²	116	109.2 Å²	109.2	54%	0.542	57%	0.573	S	S	.	*	H	α-helix	trans	-63.7	-45	174.2	-175	179.9	1.7	0	0	111.2	A852 K853 K858 A859 I860	A852-Q856 WeakPolarHBondContact O-CB 3.3Å; A852-Q856 PolarHBondContact O-N 3.43Å; K853-Q856 WeakPolarHBondContact O-CB 3.38Å; K853-Q856 PolarHBondContact O-N 3.37Å; Q856-K858 VanDerWaalsContact C-N 3.34Å; Q856-K858 PolarHBondContact O-N 3.49Å; Q856-A859 PolarHBondContact O-N 3.15Å; Q856-I860 HydrophobicContact CG-CD1 4.08Å; Q856-I860 VanDerWaalsContact O-CG1 3.23Å; Q856-I860 WeakPolarHBondContact O-CG1 3.28Å; Q856-I860 PolarHBondContact O-N 2.67Å
857	E	70.1	Confident	67.5	Low	95 Å²	95	114.4 Å²	114.4	44%	0.444	59%	0.586	S	S	.	*	H	α-helix	trans	-59.9	-43.6	173.9	-75	168.3	178.2	0	0	111.1	K853 A854 A859 I860 E861	K853-E857 WeakPolarHBondContact CE-OE1 3.45Å; K853-E857 WeakPolarHBondContact O-CB 3.39Å; K853-E857 WeakPolarHBondContact O-CG 3.48Å; K853-E857 PolarHBondContact O-N 2.92Å; A854-E857 PolarHBondContact O-N 3.42Å; E857-A859 PolarHBondContact O-N 3.16Å; E857-I860 WeakPolarHBondContact O-CB 3.43Å; E857-I860 PolarHBondContact O-N 2.75Å; E857-E861 WeakPolarHBondContact O-CB 3.31Å; E857-E861 PolarHBondContact O-N 2.88Å
858	K	74.1	Confident	66.6	Low	154 Å²	154	118 Å²	118	67%	0.67	60%	0.595	S	S	*	*	H	α-helix	trans	-65.4	-36.9	176.2	-163.7	176.8	-175.4	-179.9	0	113	A854 L855 Q856 E861 S862	A854-K858 VanDerWaalsContact O-CB 3.3Å; A854-K858 WeakPolarHBondContact O-CB 3.43Å; A854-K858 PolarHBondContact O-N 3.17Å; L855-K858 PolarHBondContact O-N 3.34Å; Q856-K858 VanDerWaalsContact C-N 3.34Å; Q856-K858 PolarHBondContact O-N 3.49Å; K858-E861 PolarHBondContact O-N 2.83Å; K858-S862 WeakPolarHBondContact O-CB 3.02Å; K858-S862 PolarHBondContact O-N 3.1Å; K858-S862 PolarHBondContact O-OG 3.3Å
859	A	67.5	Low	65.8	Low	57 Å²	57	120.1 Å²	120.1	47%	0.471	61%	0.609	S	S	.	*	H	α-helix	trans	-66.9	-39.7	173.1	0	0	0	0	0	111.5	L855 Q856 E857 S862 S863	L855-A859 WeakPolarHBondContact O-CB 3.41Å; L855-A859 PolarHBondContact O-N 3.14Å; Q856-A859 PolarHBondContact O-N 3.15Å; E857-A859 PolarHBondContact O-N 3.16Å; A859-S862 WeakPolarHBondContact CA-OG 3.29Å; A859-S862 PolarHBondContact O-OG 3.03Å; A859-S862 VanDerWaalsContact O-OG 3.06Å; A859-S863 PolarHBondContact O-N 3.18Å; A859-S863 VanDerWaalsContact O-N 3.1Å
860	I	65.1	Low	65.2	Low	86 Å²	86	125.1 Å²	125.1	44%	0.441	63%	0.631	S	S	.	*	H	α-helix	trans	-64.6	-44.5	173.3	-68.3	163.9	0	0	0	110.3	Q856 E857 S863	Q856-I860 HydrophobicContact CG-CD1 4.08Å; Q856-I860 VanDerWaalsContact O-CG1 3.23Å; Q856-I860 WeakPolarHBondContact O-CG1 3.28Å; Q856-I860 PolarHBondContact O-N 2.67Å; E857-I860 WeakPolarHBondContact O-CB 3.43Å; E857-I860 PolarHBondContact O-N 2.75Å; I860-S863 PolarHBondContact O-N 2.87Å; I860-S863 PolarHBondContact O-OG 3.48Å
861	E	65.8	Low	64.4	Low	115 Å²	115	125.6 Å²	125.6	54%	0.537	64%	0.641	S	S	.	*	H	α-helix	trans	-62.4	-44.4	178.4	-137.2	93.2	-113.2	0	0	111.9	E857 K858 S863 K864	E857-E861 WeakPolarHBondContact O-CB 3.31Å; E857-E861 PolarHBondContact O-N 2.88Å; K858-E861 PolarHBondContact O-N 2.83Å; E861-S863 PolarHBondContact O-N 2.87Å; E861-K864 WeakPolarHBondContact O-CB 3.05Å; E861-K864 PolarHBondContact O-N 3.33Å; E861-K864 VanDerWaalsContact O-N 3.1Å; E861-K864 IonicContact OE1-NZ 2.68Å; E861-K864 PolarHBondContact OE1-NZ 2.98Å
862	S	66.3	Low	63.4	Low	98 Å²	98	121 Å²	121	69%	0.685	63%	0.631	S	S	*	*	H	α-helix	trans	-70.3	-18.8	178	51.8	0	0	0	0	113.9	K858 A859 K864	K858-S862 WeakPolarHBondContact O-CB 3.02Å; K858-S862 PolarHBondContact O-N 3.1Å; K858-S862 PolarHBondContact O-OG 3.3Å; A859-S862 WeakPolarHBondContact CA-OG 3.29Å; A859-S862 PolarHBondContact O-OG 3.03Å; A859-S862 VanDerWaalsContact O-OG 3.06Å; S862-K864 VanDerWaalsContact C-N 3.31Å
863	S	62.3	Low	62.5	Low	80 Å²	80	127 Å²	127	56%	0.559	66%	0.655	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.1	-5.6	170.5	73.6	0	0	0	0	114.1	A859 I860 E861	A859-S863 PolarHBondContact O-N 3.18Å; A859-S863 VanDerWaalsContact O-N 3.1Å; I860-S863 PolarHBondContact O-N 2.87Å; I860-S863 PolarHBondContact O-OG 3.48Å; E861-S863 PolarHBondContact O-N 2.87Å
864	K	61.7	Low	61.7	Low	115 Å²	115	130.1 Å²	130.1	50%	0.5	67%	0.669	S	S	.	*	S	Bend	trans	-85.9	122.9	176.1	-64.6	173.8	-173.3	166.8	0	110.3	E861 S862	E861-K864 WeakPolarHBondContact O-CB 3.05Å; E861-K864 PolarHBondContact O-N 3.33Å; E861-K864 VanDerWaalsContact O-N 3.1Å; E861-K864 IonicContact OE1-NZ 2.68Å; E861-K864 PolarHBondContact OE1-NZ 2.98Å; S862-K864 VanDerWaalsContact C-N 3.31Å
865	Y	57.3	Low	60.8	Low	225 Å²	225	136.3 Å²	136.3	88%	0.882	69%	0.689	S	S	*	*			trans	-68.2	139.3	174.8	-76.9	-92.1	0	0	0	112.3
866	S	56.7	Low	59.6	Low	123 Å²	123	139.3 Å²	139.3	86%	0.86	70%	0.699	S	S	*	*	S	Bend	trans	-97.9	-5.9	-175.9	27.1	0	0	0	0	115.7
867	E	55.9	Low	58.9	Low	176 Å²	176	140 Å²	140	82%	0.822	71%	0.712	S	S	*	*	S	Bend	trans	-127.4	130.4	174.2	-72.6	-175.1	165.8	0	0	111.1
868	R	55.9	Low	58.1	Low	246 Å²	246	140.2 Å²	140.2	93%	0.928	72%	0.719	S	S	*	*	P	Polyproline II helix	trans	-99.4	117.3	-174.4	-67.2	-180	-179.1	175.6	0.8	110.6
869	P	52.5	Low	57.2	Low	102 Å²	102	138.6 Å²	138.6	66%	0.662	72%	0.717	S	S	*	*	P	Polyproline II helix	trans	-74.9	138	170.2	-10.2	26.3	0	0	0	110.9	N871	P869-N871 PolarHBondContact O-N 3.38Å
870	Q	52.9	Low	56.3	Low	188 Å²	188	145.4 Å²	145.4	88%	0.879	74%	0.736	S	S	*	*	S	Bend	trans	-72	123.6	172.5	-76.2	174.6	-14.3	0	0	109.5
871	N	56.3	Low	55.7	Low	171 Å²	171	144.9 Å²	144.9	91%	0.914	75%	0.752	S	S	*	*	S	Bend	trans	90.4	55.2	178.3	-55.1	-19.5	0	0	0	117.8	P869	P869-N871 PolarHBondContact O-N 3.38Å
872	A	54.4	Low	54.8	Low	57 Å²	57	144.4 Å²	144.4	47%	0.471	75%	0.752	S	S	.	*			trans	-135.4	129	157.4	0	0	0	0	0	111.2	F874	A872-F874 HydrophobicContact CB-CD2 4.13Å; A872-F874 HydrophobicContact CB-CE2 3.56Å; A872-F874 HydrophobicContact CB-CZ 4.14Å
873	L	52.1	Low	54	Low	182 Å²	182	146.5 Å²	146.5	95%	0.953	76%	0.756	S	S	*	*			trans	-81.3	114.9	170.8	-90.3	154.1	0	0	0	108.9
874	F	53.6	Low	53	Low	172 Å²	172	147.4 Å²	147.4	75%	0.754	76%	0.758	S	S	*	*			trans	-107.2	137.9	174.2	-72.3	-84.6	0	0	0	111	A872	A872-F874 HydrophobicContact CB-CD2 4.13Å; A872-F874 HydrophobicContact CB-CE2 3.56Å; A872-F874 HydrophobicContact CB-CZ 4.14Å
875	H	53.5	Low	52	Low	181 Å²	181	148.3 Å²	148.3	84%	0.838	77%	0.773	S	S	*	*			trans	-79.3	131.3	167	-66.3	-70.7	0	0	0	110.3	T877	H875-T877 PolarHBondContact O-N 3.12Å
876	Q	49	Very low	51.1	Low	186 Å²	186	143.3 Å²	143.3	87%	0.869	77%	0.766	S	S	*	*			trans	-77.2	102	-177.7	-157.1	171.3	19.9	0	0	110	V878	Q876-V878 VanDerWaalsContact C-N 3.28Å; Q876-V878 PolarHBondContact O-N 3.13Å
877	T	53.5	Low	50.4	Low	132 Å²	132	142.7 Å²	142.7	81%	0.81	76%	0.759	S	S	*	*			trans	-85.8	10	-179	46.4	0	0	0	0	114.2	H875	H875-T877 PolarHBondContact O-N 3.12Å
878	V	52.6	Low	50	Low	98 Å²	98	140.6 Å²	140.6	59%	0.594	76%	0.764	S	S	*	*			trans	-96.9	101.5	180	-177.1	0	0	0	0	110.2	Q876	Q876-V878 VanDerWaalsContact C-N 3.28Å; Q876-V878 PolarHBondContact O-N 3.13Å
879	I	56	Low	49.4	Very low	121 Å²	121	131.9 Å²	131.9	62%	0.621	75%	0.751	S	S	*	*			trans	-87.2	107.5	169	-55.5	173.3	0	0	0	108.2	G881 L882	I879-G881 PolarHBondContact O-N 3.3Å; I879-L882 HydrophobicContact CB-CB 4.44Å; I879-L882 HydrophobicContact CB-CD1 4.43Å; I879-L882 HydrophobicContact CD1-CD1 4.41Å; I879-L882 HydrophobicContact CG2-CB 4.42Å; I879-L882 HydrophobicContact CG2-CD1 4.03Å
880	K	47.9	Very low	48.6	Very low	200 Å²	200	138.3 Å²	138.3	87%	0.87	76%	0.762	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.4	127.8	175.1	-76.9	-175.3	176.4	-179.7	0	110
881	G	53.9	Low	47.9	Very low	75 Å²	75	136 Å²	136	77%	0.773	76%	0.76	S	S	*	*	T	Hydrogen-bonded Turn	trans	97.1	5.6	177.2	0	0	0	0	0	115.9	I879 N883	I879-G881 PolarHBondContact O-N 3.3Å; G881-N883 PolarHBondContact O-N 2.98Å; G881-N883 VanDerWaalsContact O-N 3.09Å
882	L	46.3	Very low	47	Very low	105 Å²	105	133.6 Å²	133.6	55%	0.55	75%	0.751	S	S	.	*			trans	-75.6	97.8	179	-150.7	85.3	0	0	0	111.2	I879 T884	I879-L882 HydrophobicContact CB-CB 4.44Å; I879-L882 HydrophobicContact CB-CD1 4.43Å; I879-L882 HydrophobicContact CD1-CD1 4.41Å; I879-L882 HydrophobicContact CG2-CB 4.42Å; I879-L882 HydrophobicContact CG2-CD1 4.03Å; L882-T884 VanDerWaalsContact C-N 3.31Å; L882-T884 WeakPolarHBondContact CD2-OG1 3.17Å; L882-T884 HydrophobicContact CG-CG2 4.41Å; L882-T884 PolarHBondContact O-N 3.23Å
883	N	50.4	Low	46.1	Very low	142 Å²	142	137.1 Å²	137.1	76%	0.759	77%	0.767	S	S	*	*			trans	-93.2	41.2	173.3	-80	-33.3	0	0	0	112.1	G881	G881-N883 PolarHBondContact O-N 2.98Å; G881-N883 VanDerWaalsContact O-N 3.09Å
884	T	41.3	Very low	45.4	Very low	98 Å²	98	134.6 Å²	134.6	60%	0.601	76%	0.759	S	S	*	*			trans	-98	108	176.3	56.9	0	0	0	0	110	L882 V886	L882-T884 VanDerWaalsContact C-N 3.31Å; L882-T884 WeakPolarHBondContact CD2-OG1 3.17Å; L882-T884 HydrophobicContact CG-CG2 4.41Å; L882-T884 PolarHBondContact O-N 3.23Å; T884-V886 PolarHBondContact O-N 2.99Å
885	T	40.5	Very low	44.7	Very low	135 Å²	135	135.2 Å²	135.2	83%	0.828	76%	0.764	S	S	*	*	P	Polyproline II helix	trans	-63.7	118.8	159.3	38	0	0	0	0	108.5	P887	T885-P887 WeakPolarHBondContact O-CD 3.47Å
886	V	38.5	Very low	44.3	Very low	119 Å²	119	131.8 Å²	131.8	72%	0.721	76%	0.76	S	S	*	*	P	Polyproline II helix	trans	-57.7	123.2	171.9	-177.4	0	0	0	0	108.3	T884 S888	T884-V886 PolarHBondContact O-N 2.99Å; V886-S888 PolarHBondContact O-N 3.25Å
887	P	41.7	Very low	43.9	Very low	111 Å²	111	128.5 Å²	128.5	72%	0.721	75%	0.753	S	S	*	*	P	Polyproline II helix	trans	-70.4	127.2	170	28.9	-29.6	0	0	0	108.2	T885 G889	T885-P887 WeakPolarHBondContact O-CD 3.47Å; P887-G889 PolarHBondContact O-N 3.1Å
888	S	46.6	Very low	43.6	Very low	132 Å²	132	126.6 Å²	126.6	92%	0.923	74%	0.743	S	S	*	*			trans	-68.9	94.8	171	-38.8	0	0	0	0	108.5	V886	V886-S888 PolarHBondContact O-N 3.25Å
889	G	43	Very low	43.3	Very low	63 Å²	63	128.5 Å²	128.5	65%	0.649	76%	0.755	S	S	*	*			trans	-173.4	89.8	177.6	0	0	0	0	0	113.7	P887	P887-G889 PolarHBondContact O-N 3.1Å
890	R	36.2	Very low	43	Very low	237 Å²	237	134.3 Å²	134.3	89%	0.894	77%	0.769	S	S	*	*				176.6	118.3	129.2	-96.2	170	-170.6	-166.8	3.1	109	V892	R890-V892 PolarHBondContact O-N 2.68Å
891	V	38.7	Very low	43	Very low	140 Å²	140	131.6 Å²	131.6	85%	0.848	76%	0.763	S	S	*	*	P	Polyproline II helix	trans	-61.3	122.1	163.7	173.3	0	0	0	0	107.2
892	V	36.5	Very low	42.7	Very low	119 Å²	119	135.6 Å²	135.6	72%	0.721	77%	0.766	S	S	*	*	P	Polyproline II helix	trans	-96.1	118.4	164.9	176.5	0	0	0	0	106.2	R890 V894	R890-V892 PolarHBondContact O-N 2.68Å; V892-V894 HydrophobicContact CG1-CG2 4.35Å; V892-V894 PolarHBondContact O-N 3.43Å
893	T	36.6	Very low	42.6	Very low	131 Å²	131	134.7 Å²	134.7	80%	0.804	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-73.5	117.2	165.8	34.2	0	0	0	0	108.5
894	V	36.9	Very low	42	Very low	130 Å²	130	131 Å²	131	79%	0.788	78%	0.777	S	S	*	*	P	Polyproline II helix	trans	-97	126.1	168.4	-177.8	0	0	0	0	107.3	V892	V892-V894 HydrophobicContact CG1-CG2 4.35Å; V892-V894 PolarHBondContact O-N 3.43Å
895	E	39.4	Very low	42.4	Very low	185 Å²	185	132.5 Å²	132.5	86%	0.864	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-65.9	146.3	173.3	-72.6	-177.8	157.3	0	0	111.1
896	S	45.6	Very low	42.4	Very low	108 Å²	108	133.6 Å²	133.6	76%	0.755	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-48.3	141.6	-165.9	52	0	0	0	0	117.6
897	T	40	Very low	42.5	Very low	117 Å²	117	132.4 Å²	132.4	72%	0.718	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-64.3	133.2	156.2	-41	0	0	0	0	110.1	L901	T897-L901 HydrophobicContact CG2-CD1 4.3Å
898	P	47.6	Very low	42.6	Very low	93 Å²	93	134.5 Å²	134.5	60%	0.604	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-64	145.4	-176.3	-22.3	32.3	0	0	0	114.5	R900 L901	P898-R900 PolarHBondContact O-N 3.39Å; P898-L901 PolarHBondContact O-N 3.23Å
899	T	45.7	Very low	42.5	Very low	137 Å²	137	133.4 Å²	133.4	84%	0.84	78%	0.784	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61	1.4	-174.5	-14.1	0	0	0	0	116.2
900	R	50.1	Low	42.4	Very low	244 Å²	244	138.7 Å²	138.7	92%	0.921	80%	0.798	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.9	-8.8	178.9	-87.1	-176.9	174	179	-1.8	114.6	P898	P898-R900 PolarHBondContact O-N 3.39Å
901	L	48.6	Very low	42.5	Very low	143 Å²	143	136 Å²	136	75%	0.749	80%	0.798	S	S	*	*	S	Bend	trans	-103.9	5.6	-176.1	-71.8	170.3	0	0	0	114.8	T897 P898	T897-L901 HydrophobicContact CG2-CD1 4.3Å; P898-L901 PolarHBondContact O-N 3.23Å
902	L	45.8	Very low	42.2	Very low	159 Å²	159	133.8 Å²	133.8	83%	0.832	79%	0.794	S	S	*	*			trans	-105.7	79.6	174.9	-69.7	171.3	0	0	0	110.5
903	G	44.2	Very low	42.2	Very low	86 Å²	86	136.1 Å²	136.1	89%	0.887	80%	0.801	S	S	*	*			trans	-85.4	110.3	158.7	0	0	0	0	0	109.7
904	G	39.2	Very low	41.9	Very low	63 Å²	63	139.1 Å²	139.1	65%	0.649	80%	0.803	S	S	*	*	S	Bend	trans	151.6	148.6	169.2	0	0	0	0	0	114.8
905	P	49	Very low	41.7	Very low	130 Å²	130	145 Å²	145	84%	0.844	81%	0.811	S	S	*	*	S	Bend	trans	-104.8	93.4	-137.4	36	-27.9	0	0	0	113.6
906	L	41.2	Very low	41.1	Very low	159 Å²	159	143.6 Å²	143.6	83%	0.832	81%	0.809	S	S	*	*			trans	-152.8	34.1	162.1	-80.2	-178.5	0	0	0	111.5
907	A	39.7	Very low	40.3	Very low	93 Å²	93	143.5 Å²	143.5	77%	0.769	81%	0.806	S	S	*	*			trans	-82.1	-9.2	-177.4	0	0	0	0	0	114.6
908	D	45	Very low	39.8	Very low	156 Å²	156	145 Å²	145	83%	0.834	81%	0.814	S	S	*	*			trans	-122.3	61.1	-173.3	-67.6	-36.7	0	0	0	113.3
909	T	42.8	Very low	39	Very low	108 Å²	108	151.9 Å²	151.9	66%	0.663	83%	0.828	S	S	*	*			trans	-143.9	135.3	160.4	48.1	0	0	0	0	114	M911	T909-M911 PolarHBondContact O-N 2.74Å
910	D	41	Very low	38.2	Very low	174 Å²	174	149.1 Å²	149.1	93%	0.93	83%	0.826	S	S	*	*	S	Bend	trans	-61.8	18.2	-172.2	-84.1	-37.5	0	0	0	117.8	A912	D910-A912 PolarHBondContact O-N 3.45Å
911	M	38.6	Very low	37.1	Very low	182 Å²	182	141.1 Å²	141.1	90%	0.897	82%	0.82	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.4	7.5	-170.9	-96.3	-176.5	37.7	0	0	115.9	T909	T909-M911 PolarHBondContact O-N 2.74Å
912	A	33.7	Very low	36.2	Very low	93 Å²	93	139 Å²	139	77%	0.769	82%	0.823	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.2	-1	-172.6	0	0	0	0	0	116.6	D910	D910-A912 PolarHBondContact O-N 3.45Å
913	L	35.3	Very low	35.3	Very low	167 Å²	167	139.5 Å²	139.5	87%	0.874	83%	0.826	S	S	*	*			trans	-129.3	53	-175.2	-73.5	172.2	0	0	0	115.3
914	K	30.7	Very low	34.8	Very low	195 Å²	195	144.3 Å²	144.3	85%	0.848	83%	0.825	S	S	*	*			trans	-132.6	82.4	154.2	-83.1	-174.2	179.7	171.1	0	111.4	L916	K914-L916 PolarHBondContact O-N 3.4Å
915	R	32.7	Very low	34.4	Very low	254 Å²	254	153.1 Å²	153.1	96%	0.958	84%	0.839	S	S	*	*			trans	-78.2	107	152.1	-77.9	-173.8	177.6	-178.8	0.8	107.7
916	L	26.1	Very low	33.3	Very low	154 Å²	154	153.4 Å²	153.4	81%	0.806	84%	0.838	S	S	*	*			trans	-97	136.6	163.9	-89.6	164.3	0	0	0	109.9	K914	K914-L916 PolarHBondContact O-N 3.4Å
917	P	29.1	Very low	33	Very low	107 Å²	107	155.2 Å²	155.2	70%	0.695	84%	0.839	S	S	*	*			trans	-88.6	137.9	-174.8	34.7	-31.7	0	0	0	111.4
918	V	30	Very low	32.5	Very low	147 Å²	147	157.8 Å²	157.8	89%	0.891	85%	0.845	S	S	*	*			trans	-90.8	112	164.4	178	0	0	0	0	108
919	R	30.6	Very low	31.7	Very low	239 Å²	239	159.6 Å²	159.6	90%	0.902	85%	0.845	S	S	*	*			trans	-73.8	134.5	171.8	-82.1	-178.1	170.5	-178.8	-1.8	110.7
920	G	28.1	Very low	31	Very low	78 Å²	78	161.4 Å²	161.4	80%	0.804	86%	0.857	S	S	*	*			trans	-128.4	112.5	151.9	0	0	0	0	0	109.5
921	G	28.4	Very low	30.5	Very low	77 Å²	77	160 Å²	160	79%	0.794	85%	0.848	S	S	*	*			trans	54	114	149	0	0	0	0	0	123
922	A	28.1	Very low	30.1	Very low	98 Å²	98	158.2 Å²	158.2	81%	0.81	84%	0.842	S	S	*	*			trans	68.9	104.3	143.3	0	0	0	0	0	121.1
923	L	28.1	Very low	30	Very low	169 Å²	169	162.3 Å²	162.3	89%	0.885	85%	0.846	S	S	*	*				178.8	142.1	109	-92.6	162.5	0	0	0	109.7
924	Q	34.3	Very low	30	Very low	187 Å²	187	160.3 Å²	160.3	87%	0.874	84%	0.842	S	S	*	*			trans	-54	144.9	-176.8	-73.9	167.1	-28.8	0	0	113.1
925	R	29.5	Very low	30.2	Very low	249 Å²	249	160.8 Å²	160.8	94%	0.94	84%	0.844	S	S	*	*			trans	-128.7	120.8	157.9	-95.8	-172.7	176.3	-177.4	-0.5	111.8
926	V	26.9	Very low	30.2	Very low	135 Å²	135	158 Å²	158	82%	0.818	84%	0.84	S	S	*	*			trans	-67.1	149.5	168.5	171.6	0	0	0	0	110.3
927	K	33.8	Very low	30.5	Very low	197 Å²	197	157 Å²	157	86%	0.857	84%	0.839	S	S	*	*			trans	-56.4	143.5	178.8	-71.8	175.1	172	176.5	0	113.6
928	V	28.8	Very low	30.7	Very low	148 Å²	148	156.4 Å²	156.4	90%	0.897	84%	0.844	S	S	*	*			trans	-139.2	133.6	147.7	-178.6	0	0	0	0	109.7
929	K	29.4	Very low	31.6	Very low	193 Å²	193	154.9 Å²	154.9	84%	0.839	84%	0.837	S	S	*	*			trans	-66.9	144.3	-179.2	-72.2	170.3	168.8	178	0	112.5
930	T	28.4	Very low	31.8	Very low	147 Å²	147	155 Å²	155	90%	0.902	85%	0.853	S	S	*	*			trans	-89.8	135.1	161.8	30.8	0	0	0	0	110.2
931	L	29.4	Very low	32	Very low	144 Å²	144	158.8 Å²	158.8	75%	0.754	86%	0.855	S	S	*	*			trans	-129.7	128.7	173	-110.2	150.2	0	0	0	108.5
932	N	31.8	Very low	32.2	Very low	145 Å²	145	163.1 Å²	163.1	78%	0.775	86%	0.858	S	S	*	*			trans	69	116.9	151	-65.2	-10.6	0	0	0	122.1
933	E	31.4	Very low	32.4	Very low	179 Å²	179	166.7 Å²	166.7	84%	0.836	86%	0.861	S	S	*	*			trans	-75.1	153.5	145.3	-67.4	-177.3	151.3	0	0	111.4
934	P	35.3	Very low	32.7	Very low	124 Å²	124	166.6 Å²	166.6	81%	0.805	86%	0.86	S	S	*	*			trans	-107.2	130.4	160.5	33.8	-22.2	0	0	0	112.1
935	K	33.6	Very low	32.6	Very low	205 Å²	205	165.3 Å²	165.3	89%	0.891	86%	0.859	S	S	*	*			trans	-81.3	142.1	164	-78.5	-178.5	176.2	178.9	0	110.6
936	K	33.5	Very low	32.8	Very low	197 Å²	197	159.7 Å²	159.7	86%	0.857	85%	0.854	S	S	*	*			trans	-82.1	128.9	171.7	-84.9	-178.4	174.8	179.2	0	111.5
937	T	33	Very low	33.2	Very low	131 Å²	131	161.5 Å²	161.5	80%	0.804	86%	0.856	S	S	*	*			trans	28.7	140.2	134.3	59.1	0	0	0	0	119
938	A	33.1	Very low	33.1	Very low	95 Å²	95	158.8 Å²	158.8	79%	0.785	86%	0.856	S	S	*	*			cis	-171.7	-178.5	45.4	0	0	0	0	0	111.4
939	P	48.2	Very low	33.5	Very low	115 Å²	115	159.7 Å²	159.7	75%	0.747	85%	0.853	S	S	*	*			trans	-108.3	176.6	-142.5	42.8	-38.7	0	0	0	117.4
940	I	35.1	Very low	33.9	Very low	241 Å²	241	156.6 Å²	156.6	100%	1.236	85%	0.854	S	S	*	*			trans	92	0	175.1	-52.1	176.2	0	0	0	113.7

Retrieved 940 of 940 residues in 1301.7 ms (Link to these results)

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