A0A087XP39_POEFO Loading...

Protein Wnt

Ligand for members of the frizzled family of seven transmembrane receptors.

AlphaFold DB , UniProt , Accession A0A087XP39, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 378 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	31.4	Very low	30.2	Very low	237 Å²	237	164.6 Å²	164.6	100%	1.167	82%	0.82	S	S	*	*				0	121.1	0	-125	150.2	80.1	0	0	107.3
2	N	25.5	Very low	30.4	Very low	148 Å²	148	162.1 Å²	162.1	79%	0.791	82%	0.819	S	S	*	*			trans	15.2	142	151.2	-69.9	-7.9	0	0	0	118.3
3	M	26.8	Very low	30.6	Very low	168 Å²	168	158.2 Å²	158.2	83%	0.828	81%	0.814	S	S	*	*			cis	-175.9	173.6	34.4	-126.4	156	85.5	0	0	110.2
4	R	28.6	Very low	30.7	Very low	226 Å²	226	163.9 Å²	163.9	85%	0.853	82%	0.82	S	S	*	*			trans	-68.5	177.8	-175.4	-65.7	173.2	163.8	-165.5	-4.1	117
5	L	30.8	Very low	31.1	Very low	160 Å²	160	160.8 Å²	160.8	84%	0.838	82%	0.816	S	S	*	*			trans	98.9	126	152.8	-62.8	130.9	0	0	0	114.3
6	G	26.9	Very low	31.5	Very low	56 Å²	56	159.2 Å²	159.2	58%	0.577	82%	0.822	S	S	*	*			cis	123.6	106	7.2	0	0	0	0	0	111.1
7	W	31.6	Very low	31.5	Very low	249 Å²	249	153.8 Å²	153.8	94%	0.943	82%	0.815	S	S	*	*			trans	-163.5	116.2	163.5	-67.9	93	0	0	0	106.5
8	V	30.2	Very low	31.8	Very low	123 Å²	123	151.2 Å²	151.2	75%	0.745	81%	0.811	S	S	*	*				81.7	106.6	54.9	-177.2	0	0	0	0	115
9	C	31	Very low	32.5	Very low	112 Å²	112	152.5 Å²	152.5	76%	0.757	82%	0.817	S	S	*	*			trans	66.2	142.5	147.5	-75.3	0	0	0	0	120.6
10	R	31.8	Very low	32.9	Very low	235 Å²	235	153.1 Å²	153.1	89%	0.887	82%	0.819	S	S	*	*			cis	-163.1	174.9	25.1	-119.2	-175.5	-170.6	-121.2	0.3	111.3
11	P	38	Very low	33.5	Very low	97 Å²	97	149.9 Å²	149.9	63%	0.63	80%	0.802	S	S	*	*			trans	-101.1	167.5	-158.2	40.8	-37.7	0	0	0	115.1
12	V	32.1	Very low	34.3	Very low	134 Å²	134	142.9 Å²	142.9	81%	0.812	78%	0.776	S	S	*	*			trans	-115.9	114.5	158.7	178.6	0	0	0	0	108.5
13	C	32.7	Very low	35.4	Very low	111 Å²	111	144.2 Å²	144.2	75%	0.75	77%	0.77	S	S	*	*			trans	-77.8	135.5	171.7	-67.4	0	0	0	0	110.6
14	W	32.6	Very low	36.5	Very low	239 Å²	239	142.7 Å²	142.7	91%	0.905	76%	0.761	S	S	*	*			trans	-130.2	148.8	152.6	-94.7	64.7	0	0	0	109.7
15	P	37	Very low	37.5	Very low	117 Å²	117	135.9 Å²	135.9	76%	0.76	75%	0.747	S	S	*	*			trans	-88.2	151.9	-146.9	33.4	-33.9	0	0	0	114.5
16	C	37.3	Very low	38.7	Very low	135 Å²	135	132.3 Å²	132.3	91%	0.912	73%	0.732	S	S	*	*			trans	-65.7	137.9	168.6	-162.5	0	0	0	0	110.7
17	G	31.6	Very low	39.9	Very low	68 Å²	68	136.5 Å²	136.5	70%	0.701	73%	0.734	S	S	*	*			trans	175.9	83.4	171.2	0	0	0	0	0	113.8
18	S	36.3	Very low	41	Very low	106 Å²	106	127.3 Å²	127.3	74%	0.741	71%	0.711	S	S	*	*				149.4	109.3	126	65.9	0	0	0	0	110.9	L20	S18-L20 PolarHBondContact O-N 3.39Å
19	L	45.8	Very low	42.2	Very low	176 Å²	176	127 Å²	127	92%	0.921	71%	0.705	S	S	*	*			trans	-56.3	111.6	167.1	-78.8	120.8	0	0	0	109.8
20	L	40.5	Very low	43.5	Very low	165 Å²	165	124.6 Å²	124.6	86%	0.864	69%	0.687	S	S	*	*			trans	-76.2	121.8	157.1	-109.2	85	0	0	0	108.2	S18 S22	S18-L20 PolarHBondContact O-N 3.39Å; L20-S22 PolarHBondContact O-N 3.04Å
21	D	45.9	Very low	44.5	Very low	85 Å²	85	118.6 Å²	118.6	46%	0.455	67%	0.672	S	S	.	*			trans	-55.9	116	-170.7	-164.6	-10.7	0	0	0	112.7	R23 H24	D21-R23 PolarHBondContact O-N 3.24Å; D21-R23 PolarHBondContact OD1-N 3.03Å; D21-H24 PolarHBondContact O-N 3.25Å
22	S	48.2	Very low	45.2	Very low	90 Å²	90	119.7 Å²	119.7	63%	0.629	67%	0.672	S	S	*	*	H	α-helix	trans	-55.7	-22.8	178.2	-176	0	0	0	0	112.4	L20 H24 V26	L20-S22 PolarHBondContact O-N 3.04Å; S22-H24 PolarHBondContact O-N 3.32Å; S22-V26 WeakPolarHBondContact O-CG2 3.39Å; S22-V26 PolarHBondContact O-N 3.47Å
23	R	48.5	Very low	46.2	Very low	176 Å²	176	117.5 Å²	117.5	66%	0.664	66%	0.659	S	S	*	*	H	α-helix	trans	-68.1	-32.2	177.5	-65.9	177	80.2	-177.9	4	112.8	D21 F27	D21-R23 PolarHBondContact O-N 3.24Å; D21-R23 PolarHBondContact OD1-N 3.03Å; R23-F27 WeakPolarHBondContact O-CD2 3.49Å; R23-F27 PolarHBondContact O-N 2.9Å
24	H	48.7	Very low	46.7	Very low	136 Å²	136	117.9 Å²	117.9	63%	0.63	65%	0.652	S	S	*	*	H	α-helix	trans	-77.3	-33	-179.1	-68.5	-5.1	0	0	0	112.7	D21 S22 A28	D21-H24 PolarHBondContact O-N 3.25Å; S22-H24 PolarHBondContact O-N 3.32Å; H24-A28 WeakPolarHBondContact O-CB 3.4Å; H24-A28 PolarHBondContact O-N 3.43Å
25	C	49.6	Very low	47.1	Very low	84 Å²	84	112.9 Å²	112.9	57%	0.568	64%	0.643	S	S	*	*	H	α-helix	trans	-66.2	-41.4	170.9	-91.7	0	0	0	0	111.9	A28 L29	C25-A28 PolarHBondContact O-N 2.85Å; C25-L29 WeakPolarHBondContact O-CB 3.31Å; C25-L29 WeakPolarHBondContact O-CD1 2.83Å; C25-L29 PolarHBondContact O-N 2.84Å
26	V	55.6	Low	47.2	Very low	85 Å²	85	114.4 Å²	114.4	52%	0.515	64%	0.642	S	S	.	*	H	α-helix	trans	-66.3	-42.5	177.1	177.4	0	0	0	0	110.6	S22 L29 T30	S22-V26 WeakPolarHBondContact O-CG2 3.39Å; S22-V26 PolarHBondContact O-N 3.47Å; V26-L29 PolarHBondContact O-N 3.21Å; V26-T30 HydrophobicContact CG1-CG2 4.2Å; V26-T30 WeakPolarHBondContact O-CB 3.42Å; V26-T30 VanDerWaalsContact O-CG2 3.25Å; V26-T30 WeakPolarHBondContact O-CG2 3.37Å; V26-T30 PolarHBondContact O-N 2.96Å; V26-T30 PolarHBondContact O-OG1 3.14Å
27	F	52.5	Low	47.4	Very low	144 Å²	144	115 Å²	115	63%	0.632	63%	0.631	S	S	*	*	H	α-helix	trans	-63.5	-42.9	175.7	-95.5	-80.7	0	0	0	112.6	R23 T30 L31	R23-F27 WeakPolarHBondContact O-CD2 3.49Å; R23-F27 PolarHBondContact O-N 2.9Å; F27-T30 VanDerWaalsContact CA-OG1 3.3Å; F27-T30 WeakPolarHBondContact CA-OG1 3.28Å; F27-T30 PolarHBondContact O-N 2.91Å; F27-T30 PolarHBondContact O-OG1 2.81Å; F27-L31 VanDerWaalsContact O-CB 3.27Å; F27-L31 WeakPolarHBondContact O-CB 3.27Å; F27-L31 PolarHBondContact O-N 3.45Å
28	A	56.2	Low	47.6	Very low	56 Å²	56	117.8 Å²	117.8	46%	0.463	63%	0.634	S	S	.	*	H	α-helix	trans	-65	-40.2	176.7	0	0	0	0	0	112.5	H24 C25 L31 L32	H24-A28 WeakPolarHBondContact O-CB 3.4Å; H24-A28 PolarHBondContact O-N 3.43Å; C25-A28 PolarHBondContact O-N 2.85Å; A28-L31 PolarHBondContact O-N 2.91Å; A28-L32 WeakPolarHBondContact O-CB 3.3Å; A28-L32 PolarHBondContact O-N 3Å
29	L	55.4	Low	47.5	Very low	117 Å²	117	118.8 Å²	118.8	61%	0.613	64%	0.636	S	S	*	*	H	α-helix	trans	-68.3	-38.9	173.6	-95.1	131.1	0	0	0	112.2	C25 V26 L31 L32 T33	C25-L29 WeakPolarHBondContact O-CB 3.31Å; C25-L29 WeakPolarHBondContact O-CD1 2.83Å; C25-L29 PolarHBondContact O-N 2.84Å; V26-L29 PolarHBondContact O-N 3.21Å; L29-L31 VanDerWaalsContact C-N 3.35Å; L29-L32 PolarHBondContact O-N 3.33Å; L29-T33 WeakPolarHBondContact O-CB 3.42Å; L29-T33 VanDerWaalsContact O-CG2 3.28Å; L29-T33 WeakPolarHBondContact O-CG2 3.15Å; L29-T33 PolarHBondContact O-N 2.8Å; L29-T33 PolarHBondContact O-OG1 3.02Å
30	T	56.8	Low	47.1	Very low	60 Å²	60	114.8 Å²	114.8	37%	0.368	62%	0.618	S	S	.	*	H	α-helix	trans	-70.2	-30.5	175	57.4	0	0	0	0	112.8	V26 F27 T33 L34	V26-T30 HydrophobicContact CG1-CG2 4.2Å; V26-T30 WeakPolarHBondContact O-CB 3.42Å; V26-T30 VanDerWaalsContact O-CG2 3.25Å; V26-T30 WeakPolarHBondContact O-CG2 3.37Å; V26-T30 PolarHBondContact O-N 2.96Å; V26-T30 PolarHBondContact O-OG1 3.14Å; F27-T30 VanDerWaalsContact CA-OG1 3.3Å; F27-T30 WeakPolarHBondContact CA-OG1 3.28Å; F27-T30 PolarHBondContact O-N 2.91Å; F27-T30 PolarHBondContact O-OG1 2.81Å; T30-T33 VanDerWaalsContact CA-OG1 3.29Å; T30-T33 WeakPolarHBondContact CA-OG1 3.25Å; T30-T33 PolarHBondContact O-OG1 2.8Å; T30-L34 VanDerWaalsContact O-CB 3.28Å; T30-L34 WeakPolarHBondContact O-CB 3.43Å; T30-L34 WeakPolarHBondContact O-CD1 3.32Å; T30-L34 PolarHBondContact O-N 2.8Å
31	L	52.9	Low	47.1	Very low	110 Å²	110	113.9 Å²	113.9	58%	0.576	61%	0.609	S	S	*	*	H	α-helix	trans	-76.6	-35.8	174.5	-164.4	73.4	0	0	0	110.8	F27 A28 L29 L34 L35	F27-L31 VanDerWaalsContact O-CB 3.27Å; F27-L31 WeakPolarHBondContact O-CB 3.27Å; F27-L31 PolarHBondContact O-N 3.45Å; A28-L31 PolarHBondContact O-N 2.91Å; L29-L31 VanDerWaalsContact C-N 3.35Å; L31-L34 PolarHBondContact O-N 3.39Å; L31-L35 HydrophobicContact CG-CD1 4.39Å; L31-L35 VanDerWaalsContact O-CB 3.29Å; L31-L35 WeakPolarHBondContact O-CB 3.43Å; L31-L35 WeakPolarHBondContact O-CD1 3.48Å; L31-L35 VanDerWaalsContact O-CG 3.26Å; L31-L35 WeakPolarHBondContact O-CG 3Å; L31-L35 PolarHBondContact O-N 3.44Å
32	L	52.2	Low	47.1	Very low	120 Å²	120	111 Å²	111	63%	0.628	60%	0.598	S	S	*	*	H	α-helix	trans	-67.2	-35.4	170.4	-122.9	88.7	0	0	0	111.8	A28 L29 M36	A28-L32 WeakPolarHBondContact O-CB 3.3Å; A28-L32 PolarHBondContact O-N 3Å; L29-L32 PolarHBondContact O-N 3.33Å; L32-M36 WeakPolarHBondContact O-CB 2.97Å; L32-M36 VanDerWaalsContact O-CG 3.26Å; L32-M36 WeakPolarHBondContact O-CG 3.39Å; L32-M36 PolarHBondContact O-N 1.99Å
33	T	53.3	Low	47.4	Very low	88 Å²	88	109.4 Å²	109.4	54%	0.54	58%	0.582	S	S	.	*	H	α-helix	trans	-79.8	-25.3	174.5	58.6	0	0	0	0	113	L29 T30 M36	L29-T33 WeakPolarHBondContact O-CB 3.42Å; L29-T33 VanDerWaalsContact O-CG2 3.28Å; L29-T33 WeakPolarHBondContact O-CG2 3.15Å; L29-T33 PolarHBondContact O-N 2.8Å; L29-T33 PolarHBondContact O-OG1 3.02Å; T30-T33 VanDerWaalsContact CA-OG1 3.29Å; T30-T33 WeakPolarHBondContact CA-OG1 3.25Å; T30-T33 PolarHBondContact O-OG1 2.8Å; T33-M36 CarbonylContact O-C 3.57Å; T33-M36 VanDerWaalsContact O-C 3.26Å
34	L	43.2	Very low	48.1	Very low	118 Å²	118	101.1 Å²	101.1	62%	0.618	55%	0.551	S	S	*	*	H	α-helix	trans	-73.5	-30	166.4	-111.6	88	0	0	0	112.5	T30 L31 Q37	T30-L34 VanDerWaalsContact O-CB 3.28Å; T30-L34 WeakPolarHBondContact O-CB 3.43Å; T30-L34 WeakPolarHBondContact O-CD1 3.32Å; T30-L34 PolarHBondContact O-N 2.8Å; L31-L34 PolarHBondContact O-N 3.39Å; L34-Q37 WeakPolarHBondContact O-CG 3.44Å; L34-Q37 PolarHBondContact O-N 2.92Å
35	L	42.3	Very low	49	Very low	134 Å²	134	95 Å²	95	70%	0.702	52%	0.523	S	S	*	.	H	α-helix	trans	-78.7	-26.9	172.1	-77.4	162.9	0	0	0	111.8	L31 Q37	L31-L35 HydrophobicContact CG-CD1 4.39Å; L31-L35 VanDerWaalsContact O-CB 3.29Å; L31-L35 WeakPolarHBondContact O-CB 3.43Å; L31-L35 WeakPolarHBondContact O-CD1 3.48Å; L31-L35 VanDerWaalsContact O-CG 3.26Å; L31-L35 WeakPolarHBondContact O-CG 3Å; L31-L35 PolarHBondContact O-N 3.44Å; L35-Q37 PolarHBondContact O-N 2.94Å; L35-Q37 VanDerWaalsContact O-N 3.12Å
36	M	38.8	Very low	49.6	Very low	149 Å²	149	91.3 Å²	91.3	73%	0.734	50%	0.497	S	S	*	.	S	Bend	trans	-81.9	47.4	160.6	-65	-70.7	-120.2	0	0	110.3	L32 T33 V38	L32-M36 WeakPolarHBondContact O-CB 2.97Å; L32-M36 VanDerWaalsContact O-CG 3.26Å; L32-M36 WeakPolarHBondContact O-CG 3.39Å; L32-M36 PolarHBondContact O-N 1.99Å; T33-M36 CarbonylContact O-C 3.57Å; T33-M36 VanDerWaalsContact O-C 3.26Å; M36-V38 PolarHBondContact O-N 3.46Å
37	Q	40.3	Very low	49.9	Very low	149 Å²	149	88 Å²	88	70%	0.696	48%	0.477	S	S	*	.			trans	-51	121.4	155.1	-93.5	175.5	3.7	0	0	106.7	L34 L35 V39	L34-Q37 WeakPolarHBondContact O-CG 3.44Å; L34-Q37 PolarHBondContact O-N 2.92Å; L35-Q37 PolarHBondContact O-N 2.94Å; L35-Q37 VanDerWaalsContact O-N 3.12Å; Q37-V39 VanDerWaalsContact C-N 3.32Å; Q37-V39 PolarHBondContact O-N 2.92Å
38	V	36	Very low	50.3	Low	126 Å²	126	81.6 Å²	81.6	76%	0.764	45%	0.449	S	S	*	.			trans	-48.3	97.5	176	-172.9	0	0	0	0	108.1	M36 V40	M36-V38 PolarHBondContact O-N 3.46Å; V38-V40 HydrophobicContact CB-CG2 4.43Å; V38-V40 HydrophobicContact CG1-CG2 3.43Å; V38-V40 VanDerWaalsContact CG1-CG2 3.43Å; V38-V40 PolarHBondContact O-N 2.85Å
39	V	35.6	Very low	50.3	Low	127 Å²	127	79.3 Å²	79.3	77%	0.77	43%	0.431	S	S	*	.			trans	-71.5	82.8	159.3	-177.3	0	0	0	0	104	Q37 E41	Q37-V39 VanDerWaalsContact C-N 3.32Å; Q37-V39 PolarHBondContact O-N 2.92Å; V39-E41 VanDerWaalsContact C-N 3.32Å; V39-E41 PolarHBondContact O-N 2.88Å
40	V	37.1	Very low	50.5	Low	92 Å²	92	79 Å²	79	56%	0.558	43%	0.427	S	S	*	.			trans	-60.2	109.2	159.9	-179.4	0	0	0	0	104.1	V38 A42	V38-V40 HydrophobicContact CB-CG2 4.43Å; V38-V40 HydrophobicContact CG1-CG2 3.43Å; V38-V40 VanDerWaalsContact CG1-CG2 3.43Å; V38-V40 PolarHBondContact O-N 2.85Å; V40-A42 VanDerWaalsContact C-N 3.34Å; V40-A42 PolarHBondContact O-N 2.77Å
41	E	40.4	Very low	50.6	Low	145 Å²	145	81.5 Å²	81.5	68%	0.678	44%	0.439	S	S	*	.			trans	-54.5	93	-179.1	-75	-169	161.1	0	0	111	V39 N43	V39-E41 VanDerWaalsContact C-N 3.32Å; V39-E41 PolarHBondContact O-N 2.88Å; E41-N43 HydrophobicContact CB-CB 4.09Å; E41-N43 VanDerWaalsContact CB-ND2 3.34Å; E41-N43 WeakPolarHBondContact CB-ND2 3.43Å; E41-N43 WeakPolarHBondContact CG-ND2 3.36Å; E41-N43 PolarHBondContact O-N 2.04Å; E41-N43 PolarHBondContact OE1-ND2 2.88Å; E41-N43 PolarHBondContact OE2-ND2 3.24Å
42	A	45	Very low	50.6	Low	26 Å²	26	81.2 Å²	81.2	22%	0.215	44%	0.443	C	S	.	.			trans	-72.9	54.1	160	0	0	0	0	0	109.3	V40 S44 A119	V40-A42 VanDerWaalsContact C-N 3.34Å; V40-A42 PolarHBondContact O-N 2.77Å; A42-S44 PolarHBondContact O-N 2.91Å; A42-S44 VanDerWaalsContact O-N 3.11Å; A42-A119 HydrophobicContact CB-CB 3.8Å
43	N	55.3	Low	50.8	Low	56 Å²	56	77.1 Å²	77.1	30%	0.299	42%	0.422	S	S	.	.			trans	-86.6	81.1	-172.6	-81.4	-15.8	0	0	0	109.2	E41 R198	E41-N43 HydrophobicContact CB-CB 4.09Å; E41-N43 VanDerWaalsContact CB-ND2 3.34Å; E41-N43 WeakPolarHBondContact CB-ND2 3.43Å; E41-N43 WeakPolarHBondContact CG-ND2 3.36Å; E41-N43 PolarHBondContact O-N 2.04Å; E41-N43 PolarHBondContact OE1-ND2 2.88Å; E41-N43 PolarHBondContact OE2-ND2 3.24Å; N43-R198 PolarHBondContact O-NH1 3.26Å; N43-R198 PolarHBondContact O-NH2 2.88Å
44	S	63.9	Low	50.6	Low	2 Å²	2	80.2 Å²	80.2	1%	0.014	43%	0.434	C	S	.	.			trans	-131.1	144	170.2	-166.1	0	0	0	0	112.1	A42 W46 S47 G72 G123	A42-S44 PolarHBondContact O-N 2.91Å; A42-S44 VanDerWaalsContact O-N 3.11Å; S44-W46 PolarHBondContact O-N 2.04Å; S44-S47 WeakPolarHBondContact O-CB 3.48Å; S44-S47 PolarHBondContact O-N 3.45Å; S44-S47 PolarHBondContact O-OG 3.04Å; S44-G72 CarbonylContact C-O 3.46Å; S44-G72 WeakPolarHBondContact CA-O 3.3Å; S44-G123 WeakPolarHBondContact OG-CA 3.07Å; S44-G123 PolarHBondContact OG-N 2.72Å
45	W	66.8	Low	51.1	Low	8 Å²	8	79.1 Å²	79.1	3%	0.03	43%	0.428	C	S	.	.	G	3₁₀ helix	trans	-60.2	-18.5	175.1	71.5	-92.8	0	0	0	112.8	S47 L48 G72 L73 I91 A95 V144 F194 V195	W45-S47 PolarHBondContact O-N 2.87Å; W45-L48 WeakPolarHBondContact O-CB 3.31Å; W45-L48 WeakPolarHBondContact O-CD1 3.07Å; W45-L48 WeakPolarHBondContact O-CG 3.29Å; W45-L48 PolarHBondContact O-N 3.23Å; W45-G72 PolarHBondContact N-O 2.93Å; W45-L73 HydrophobicContact CB-CD2 3.35Å; W45-I91 HydrophobicContact CE3-CG2 3.5Å; W45-I91 VanDerWaalsContact CE3-CG2 3.5Å; W45-I91 HydrophobicContact CH2-CG2 4.29Å; W45-I91 HydrophobicContact CZ3-CG2 3.27Å; W45-A95 HydrophobicContact CH2-CB 4.15Å; W45-A95 HydrophobicContact CZ3-CB 3.76Å; W45-V144 HydrophobicContact CH2-CG2 3.32Å; W45-V144 HydrophobicContact CZ2-CG2 4.13Å; W45-V144 HydrophobicContact CZ3-CG2 4.02Å; W45-F194 HydrophobicContact CB-CE1 4.26Å; W45-F194 HydrophobicContact CB-CZ 4.46Å; W45-F194 HydrophobicContact CD2-CD1 4.46Å; W45-F194 AromaticContact CD2-CE1 3.72Å; W45-F194 HydrophobicContact CD2-CE1 3.72Å; W45-F194 HydrophobicContact CE3-CD1 4.5Å; W45-F194 AromaticContact CE3-CE1 3.66Å; W45-F194 HydrophobicContact CE3-CE1 3.66Å; W45-F194 HydrophobicContact CG-CE1 4.04Å; W45-F194 HydrophobicContact CZ3-CE1 4.27Å; W45-V195 HydrophobicContact CH2-CG2 4.29Å; W45-V195 HydrophobicContact CZ2-CB 4.39Å; W45-V195 HydrophobicContact CZ2-CG1 4.06Å; W45-V195 HydrophobicContact CZ2-CG2 3.73Å
46	W	61.2	Low	51.1	Low	6 Å²	6	76.2 Å²	76.2	2%	0.023	42%	0.417	C	S	.	.	G	3₁₀ helix	trans	-62.7	-16.4	172.8	-77.3	78.2	0	0	0	114.6	S44 L48 A49 A95 I99 F122 S140	S44-W46 PolarHBondContact O-N 2.04Å; W46-L48 PolarHBondContact O-N 3.24Å; W46-L48 VanDerWaalsContact O-N 3.12Å; W46-A49 VanDerWaalsContact O-CB 3.25Å; W46-A49 WeakPolarHBondContact O-CB 3.03Å; W46-A49 PolarHBondContact O-N 3.18Å; W46-A95 HydrophobicContact CD2-CB 3.83Å; W46-A95 HydrophobicContact CE3-CB 3.44Å; W46-A95 VanDerWaalsContact CE3-CB 3.44Å; W46-A95 HydrophobicContact CH2-CB 3.81Å; W46-A95 HydrophobicContact CZ2-CB 4.05Å; W46-A95 HydrophobicContact CZ3-CB 3.59Å; W46-A95 WeakPolarHBondContact CZ3-O 3.49Å; W46-I99 HydrophobicContact CE3-CD1 3.99Å; W46-I99 HydrophobicContact CE3-CG1 3.82Å; W46-I99 HydrophobicContact CZ3-CD1 4.4Å; W46-I99 HydrophobicContact CZ3-CG1 3.71Å; W46-F122 HydrophobicContact CD2-CB 3.75Å; W46-F122 AromaticContact CD2-CD2 3.89Å; W46-F122 HydrophobicContact CD2-CD2 3.89Å; W46-F122 HydrophobicContact CD2-CG 4.25Å; W46-F122 HydrophobicContact CE3-CB 4.1Å; W46-F122 AromaticContact CE3-CD2 3.31Å; W46-F122 HydrophobicContact CE3-CD2 3.31Å; W46-F122 HydrophobicContact CE3-CE2 4.13Å; W46-F122 HydrophobicContact CE3-CG 4.1Å; W46-F122 HydrophobicContact CG-CB 3.86Å; W46-F122 AromaticContact CZ3-CD2 3.55Å; W46-F122 HydrophobicContact CZ3-CD2 3.55Å; W46-F122 HydrophobicContact CZ3-CE2 4.03Å; W46-F122 HydrophobicContact CZ3-CG 4.37Å; W46-S140 VanDerWaalsContact CE2-OG 3.31Å; W46-S140 VanDerWaalsContact CH2-CB 3.46Å; W46-S140 WeakPolarHBondContact CH2-OG 3.03Å; W46-S140 WeakPolarHBondContact CZ2-OG 3.31Å
47	S	61.9	Low	51.2	Low	14 Å²	14	78.9 Å²	78.9	10%	0.098	43%	0.428	C	S	.	.	G	3₁₀ helix	trans	-54.8	-25.8	171.7	60.4	0	0	0	0	112.5	S44 W45 A49 M50 N51 V71	S44-S47 WeakPolarHBondContact O-CB 3.48Å; S44-S47 PolarHBondContact O-N 3.45Å; S44-S47 PolarHBondContact O-OG 3.04Å; W45-S47 PolarHBondContact O-N 2.87Å; S47-A49 PolarHBondContact O-N 3.38Å; S47-M50 PolarHBondContact O-N 3.46Å; S47-N51 PolarHBondContact O-N 3.02Å; S47-V71 PolarHBondContact OG-O 3.44Å
48	L	60.9	Low	51.2	Low	10 Å²	10	75.8 Å²	75.8	5%	0.052	43%	0.428	C	S	.	.	G	3₁₀ helix	trans	-60.5	-22.1	173.8	-60.3	174.3	0	0	0	113.3	W45 W46 M50 L53 L70 L73 M88 I91	W45-L48 WeakPolarHBondContact O-CB 3.31Å; W45-L48 WeakPolarHBondContact O-CD1 3.07Å; W45-L48 WeakPolarHBondContact O-CG 3.29Å; W45-L48 PolarHBondContact O-N 3.23Å; W46-L48 PolarHBondContact O-N 3.24Å; W46-L48 VanDerWaalsContact O-N 3.12Å; L48-M50 VanDerWaalsContact C-N 3.31Å; L48-L53 HydrophobicContact CD2-CD2 4.11Å; L48-L70 HydrophobicContact CD2-CB 4.29Å; L48-L70 HydrophobicContact CD2-CD1 3.78Å; L48-L70 HydrophobicContact CD2-CD2 3.72Å; L48-L70 HydrophobicContact CD2-CG 4.07Å; L48-L73 HydrophobicContact CD1-CD2 4.28Å; L48-M88 HydrophobicContact CD1-CE 3.37Å; L48-I91 HydrophobicContact CD1-CG2 4.12Å
49	A	56.5	Low	51.8	Low	8 Å²	8	77.4 Å²	77.4	7%	0.066	42%	0.421	C	S	.	.	G	3₁₀ helix	trans	-72.8	-25.2	174.3	0	0	0	0	0	113.2	W46 S47 A95 K96 I99	W46-A49 VanDerWaalsContact O-CB 3.25Å; W46-A49 WeakPolarHBondContact O-CB 3.03Å; W46-A49 PolarHBondContact O-N 3.18Å; S47-A49 PolarHBondContact O-N 3.38Å; A49-A95 HydrophobicContact CB-CB 3.84Å; A49-K96 HydrophobicContact CB-CB 3.92Å; A49-I99 HydrophobicContact CB-CD1 4.05Å
50	M	59.9	Low	52.1	Low	110 Å²	110	78.7 Å²	78.7	54%	0.542	42%	0.422	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.7	-31.5	-171.8	-61.8	-59.9	-73.4	0	0	112.5	S47 L48	S47-M50 PolarHBondContact O-N 3.46Å; L48-M50 VanDerWaalsContact C-N 3.31Å
51	N	59.4	Low	52.1	Low	114 Å²	114	82.2 Å²	82.2	61%	0.61	44%	0.436	S	S	*	.	S	Bend	trans	-107.6	106.1	175	-65.9	-57.2	0	0	0	108.9	S47 L53	S47-N51 PolarHBondContact O-N 3.02Å; N51-L53 PolarHBondContact O-N 2.78Å
52	P	52.9	Low	52.2	Low	104 Å²	104	79.4 Å²	79.4	68%	0.675	45%	0.446	S	S	*	.			trans	-56.9	126.8	173.1	-5.9	14.8	0	0	0	108.5	L54	P52-L54 VanDerWaalsContact C-N 3.27Å; P52-L54 PolarHBondContact O-N 3.37Å
53	L	56.8	Low	52	Low	33 Å²	33	81 Å²	81	17%	0.173	46%	0.459	C	S	.	.			trans	-66.4	94.8	167.7	-61.2	178.1	0	0	0	106.7	L48 N51 I55 L70 M88	L48-L53 HydrophobicContact CD2-CD2 4.11Å; N51-L53 PolarHBondContact O-N 2.78Å; L53-I55 VanDerWaalsContact C-N 3.32Å; L53-I55 HydrophobicContact CB-CG1 4.35Å; L53-I55 PolarHBondContact O-N 2.87Å; L53-L70 HydrophobicContact CD2-CD2 3.45Å; L53-L70 VanDerWaalsContact CD2-CD2 3.45Å; L53-M88 HydrophobicContact CD1-CB 3.64Å
54	L	49.3	Very low	51.9	Low	154 Å²	154	82.2 Å²	82.2	81%	0.806	46%	0.463	S	S	*	.			trans	-69.5	99.3	165.5	-68.2	171.9	0	0	0	105.5	P52 P56	P52-L54 VanDerWaalsContact C-N 3.27Å; P52-L54 PolarHBondContact O-N 3.37Å; L54-P56 VanDerWaalsContact O-CD 3.25Å; L54-P56 WeakPolarHBondContact O-CD 3.24Å
55	I	52.3	Low	51.5	Low	94 Å²	94	84.2 Å²	84.2	48%	0.482	48%	0.476	S	S	.	.			trans	-89.2	102.6	168.5	-54.8	172.8	0	0	0	105	L53	L53-I55 VanDerWaalsContact C-N 3.32Å; L53-I55 HydrophobicContact CB-CG1 4.35Å; L53-I55 PolarHBondContact O-N 2.87Å
56	P	41.8	Very low	51.5	Low	73 Å²	73	86.9 Å²	86.9	47%	0.474	49%	0.49	S	S	.	.			trans	-66.8	142.8	173.8	-11.5	28.7	0	0	0	108.6	L54 A58 Y59	L54-P56 VanDerWaalsContact O-CD 3.25Å; L54-P56 WeakPolarHBondContact O-CD 3.24Å; P56-A58 PolarHBondContact O-N 2.83Å; P56-Y59 HydrophobicContact CG-CD2 4.43Å; P56-Y59 HydrophobicContact CG-CE2 4.33Å
57	E	42.3	Very low	52.2	Low	205 Å²	205	86.6 Å²	86.6	96%	0.958	49%	0.49	S	S	*	.	S	Bend	trans	-58.5	-7.9	177.9	-66.7	178.1	152.5	0	0	113.9	Y59	E57-Y59 PolarHBondContact O-N 3.39Å
58	A	40.3	Very low	52.7	Low	84 Å²	84	88.9 Å²	88.9	69%	0.694	51%	0.505	S	S	*	.			trans	-99	55.7	179.8	0	0	0	0	0	113.3	P56	P56-A58 PolarHBondContact O-N 2.83Å
59	Y	47.8	Very low	53.3	Low	160 Å²	160	95.5 Å²	95.5	63%	0.627	54%	0.536	S	S	*	.			trans	-134.9	55.8	168.4	-87.2	-78.4	0	0	0	111.7	P56 E57 A63	P56-Y59 HydrophobicContact CG-CD2 4.43Å; P56-Y59 HydrophobicContact CG-CE2 4.33Å; E57-Y59 PolarHBondContact O-N 3.39Å; Y59-A63 HydrophobicContact CD1-CB 3.74Å; Y59-A63 HydrophobicContact CE1-CB 3.42Å; Y59-A63 VanDerWaalsContact CE1-CB 3.42Å
60	I	41.6	Very low	54	Low	155 Å²	155	96.2 Å²	96.2	80%	0.795	54%	0.539	S	S	*	.			trans	-101.6	128.5	155.9	-55.2	-177.1	0	0	0	104.8
61	I	38.8	Very low	54.5	Low	165 Å²	165	95.6 Å²	95.6	85%	0.846	54%	0.541	S	S	*	.	S	Bend	trans	90.4	89.5	-177.1	-43	167.2	0	0	0	114.7
62	G	41.1	Very low	55.2	Low	86 Å²	86	90.5 Å²	90.5	89%	0.887	52%	0.515	S	S	*	.	S	Bend	trans	94.4	13.5	136.4	0	0	0	0	0	120.6
63	A	40.6	Very low	56.6	Low	59 Å²	59	86 Å²	86	49%	0.488	49%	0.486	S	S	.	.			trans	-116.2	126.8	179	0	0	0	0	0	113.8	Y59	Y59-A63 HydrophobicContact CD1-CB 3.74Å; Y59-A63 HydrophobicContact CE1-CB 3.42Å; Y59-A63 VanDerWaalsContact CE1-CB 3.42Å
64	Q	53.5	Low	58	Low	83 Å²	83	85.1 Å²	85.1	39%	0.388	48%	0.482	S	S	.	.			trans	-132.8	153.5	152.7	-99.1	-129.1	-25.4	0	0	109.3	Q85	Q64-Q85 VanDerWaalsContact NE2-CD 3.35Å
65	P	56.7	Low	59.9	Low	44 Å²	44	83.8 Å²	83.8	29%	0.286	47%	0.471	S	S	.	.			cis	-132.4	117.8	19.5	12.1	16.3	0	0	0	114.3	C67 S68	P65-C67 PolarHBondContact O-N 3.43Å; P65-S68 WeakPolarHBondContact CB-OG 3.34Å; P65-S68 WeakPolarHBondContact CD-OG 3.39Å; P65-S68 WeakPolarHBondContact CG-OG 3.41Å; P65-S68 PolarHBondContact O-N 3.02Å; P65-S68 PolarHBondContact O-OG 3.43Å
66	L	66.2	Low	61.6	Low	63 Å²	63	80.1 Å²	80.1	33%	0.33	46%	0.457	S	S	.	.	H	α-helix	trans	-48.3	-45.2	159.6	-167.2	81.7	0	0	0	109.4	S68 Q69 L70	L66-S68 PolarHBondContact O-N 2.86Å; L66-Q69 PolarHBondContact O-N 2.87Å; L66-L70 VanDerWaalsContact O-CG 3.32Å; L66-L70 WeakPolarHBondContact O-CG 3.29Å; L66-L70 PolarHBondContact O-N 2.99Å
67	C	75.5	Confident	63.9	Low	1 Å²	1	76.6 Å²	76.6	1%	0.007	43%	0.434	C	S	.	.	H	α-helix	trans	-69.2	-27.3	-172.8	-59.9	0	0	0	0	116.8	P65 C81 Q82	P65-C67 PolarHBondContact O-N 3.43Å; C67-C81 VanDerWaalsContact CA-SG 3.52Å; C67-C81 HydrophobicContact CB-CB 3.7Å; C67-C81 WeakPolarHBondContact CB-SG 3.34Å; C67-C81 WeakPolarHBondContact SG-CB 3.44Å; C67-C81 PolarHBondContact SG-O 3.07Å; C67-C81 CovalentContact SG-SG 2.03Å; C67-C81 PolarHBondContact SG-SG 2.69Å; C67-Q82 HydrophobicContact CB-CG 4.12Å; C67-Q82 PolarHBondContact SG-N 3.38Å
68	S	73.7	Confident	66.2	Low	61 Å²	61	69.4 Å²	69.4	43%	0.427	40%	0.4	S	S	.	.	H	α-helix	trans	-78.9	-28.4	179.3	65.2	0	0	0	0	111.6	P65 L66	P65-S68 WeakPolarHBondContact CB-OG 3.34Å; P65-S68 WeakPolarHBondContact CD-OG 3.39Å; P65-S68 WeakPolarHBondContact CG-OG 3.41Å; P65-S68 PolarHBondContact O-N 3.02Å; P65-S68 PolarHBondContact O-OG 3.43Å; L66-S68 PolarHBondContact O-N 2.86Å
69	Q	71.6	Confident	68.6	Low	150 Å²	150	72.3 Å²	72.3	70%	0.701	40%	0.397	S	S	*	.	H	α-helix	trans	-80.7	-18	177.2	-62.3	-179.7	-8	0	0	112.4	L66 V71	L66-Q69 PolarHBondContact O-N 2.87Å; Q69-V71 PolarHBondContact O-N 2.67Å
70	L	71.3	Confident	70.7	Confident	22 Å²	22	66.1 Å²	66.1	12%	0.115	37%	0.374	C	S	.	.	S	Bend	trans	-67.5	103.3	173.9	-59.5	178.8	0	0	0	110.3	L48 L53 L66 G72 L73 M88	L48-L70 HydrophobicContact CD2-CB 4.29Å; L48-L70 HydrophobicContact CD2-CD1 3.78Å; L48-L70 HydrophobicContact CD2-CD2 3.72Å; L48-L70 HydrophobicContact CD2-CG 4.07Å; L53-L70 HydrophobicContact CD2-CD2 3.45Å; L53-L70 VanDerWaalsContact CD2-CD2 3.45Å; L66-L70 VanDerWaalsContact O-CG 3.32Å; L66-L70 WeakPolarHBondContact O-CG 3.29Å; L66-L70 PolarHBondContact O-N 2.99Å; L70-G72 PolarHBondContact O-N 2.91Å; L70-L73 HydrophobicContact CB-CD1 3.87Å; L70-L73 HydrophobicContact CB-CG 4Å; L70-L73 HydrophobicContact CD1-CD1 3.88Å; L70-L73 HydrophobicContact CG-CD1 4.47Å; L70-M88 HydrophobicContact CD1-CE 3.83Å
71	V	71.4	Confident	73	Confident	98 Å²	98	58.8 Å²	58.8	59%	0.594	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.5	131.8	174.6	-178.3	0	0	0	0	109.3	S47 Q69	S47-V71 PolarHBondContact OG-O 3.44Å; Q69-V71 PolarHBondContact O-N 2.67Å
72	G	74.4	Confident	75.4	Confident	6 Å²	6	55.3 Å²	55.3	6%	0.062	32%	0.317	C	S	.	.	T	Hydrogen-bonded Turn	trans	94.2	-1.9	173.4	0	0	0	0	0	116.6	S44 W45 L70 R198	S44-G72 CarbonylContact C-O 3.46Å; S44-G72 WeakPolarHBondContact CA-O 3.3Å; W45-G72 PolarHBondContact N-O 2.93Å; L70-G72 PolarHBondContact O-N 2.91Å; G72-R198 PolarHBondContact O-NH2 2.89Å
73	L	82.7	Confident	77.8	Confident	11 Å²	11	57 Å²	57	6%	0.058	31%	0.305	C	S	.	.			trans	-74.8	135.7	168.2	-63.5	-170.8	0	0	0	111.7	W45 L48 L70 Q77 K78 C81 M88 F194	W45-L73 HydrophobicContact CB-CD2 3.35Å; L48-L73 HydrophobicContact CD1-CD2 4.28Å; L70-L73 HydrophobicContact CB-CD1 3.87Å; L70-L73 HydrophobicContact CB-CG 4Å; L70-L73 HydrophobicContact CD1-CD1 3.88Å; L70-L73 HydrophobicContact CG-CD1 4.47Å; L73-Q77 HydrophobicContact CB-CB 4.09Å; L73-Q77 HydrophobicContact CD2-CB 4.15Å; L73-K78 HydrophobicContact CB-CG 3.73Å; L73-K78 HydrophobicContact CD1-CG 4.36Å; L73-K78 WeakPolarHBondContact O-CE 3.12Å; L73-C81 HydrophobicContact CD1-CB 3.95Å; L73-M88 HydrophobicContact CD1-CE 4.09Å; L73-M88 HydrophobicContact CD2-CE 4.48Å; L73-F194 HydrophobicContact CD2-CZ 3.92Å
74	S	86.3	Confident	80.2	Confident	14 Å²	14	56.8 Å²	56.8	10%	0.098	29%	0.292	C	S	.	.			trans	-70.6	172.1	166.9	71	0	0	0	0	111.8	G76 Q77 K78 E201	S74-G76 PolarHBondContact O-N 3.39Å; S74-Q77 PolarHBondContact O-N 2.81Å; S74-Q77 VanDerWaalsContact OG-CG 3.23Å; S74-Q77 WeakPolarHBondContact OG-CG 3.4Å; S74-Q77 PolarHBondContact OG-N 3.19Å; S74-Q77 PolarHBondContact OG-OE1 3.41Å; S74-K78 WeakPolarHBondContact O-CG 3.38Å; S74-K78 PolarHBondContact O-N 3.47Å; S74-E201 VanDerWaalsContact CB-OE1 3.31Å; S74-E201 WeakPolarHBondContact CB-OE1 3.29Å; S74-E201 VanDerWaalsContact CB-OE2 3.31Å; S74-E201 WeakPolarHBondContact CB-OE2 3.48Å; S74-E201 PolarHBondContact OG-OE1 3.12Å; S74-E201 PolarHBondContact OG-OE2 3.17Å
75	Q	88	Confident	81.9	Confident	125 Å²	125	56.9 Å²	56.9	58%	0.584	29%	0.292	S	S	*	.	H	α-helix	trans	-67.5	-38.6	-175.8	-68.4	-62.7	-22.7	0	0	112.1	K78 K79 E201	Q75-K78 PolarHBondContact O-N 3.12Å; Q75-K79 WeakPolarHBondContact O-CG 3.45Å; Q75-K79 PolarHBondContact O-N 2.91Å; Q75-K79 VanDerWaalsContact O-N 3.15Å; Q75-E201 PolarHBondContact N-OE2 3.48Å
76	G	88.8	Confident	83.4	Confident	17 Å²	17	57.1 Å²	57.1	18%	0.175	29%	0.291	C	S	.	.	H	α-helix	trans	-66.7	-39.4	172.5	0	0	0	0	0	112.1	S74 K78 K79 L80 E201	S74-G76 PolarHBondContact O-N 3.39Å; G76-K78 VanDerWaalsContact C-N 3.33Å; G76-K78 PolarHBondContact O-N 3.23Å; G76-K79 PolarHBondContact O-N 2.82Å; G76-L80 WeakPolarHBondContact O-CG 3.48Å; G76-L80 PolarHBondContact O-N 2.8Å; G76-E201 WeakPolarHBondContact CA-OE1 3.14Å; G76-E201 PolarHBondContact N-OE1 2.92Å; G76-E201 PolarHBondContact N-OE2 3.09Å
77	Q	90.1	Very high	84.6	Confident	0 Å²	0	54.1 Å²	54.1	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-65.3	-35.7	174.4	-69.7	178.5	-41	0	0	112.6	L73 S74 L80 C81 F194 A197	L73-Q77 HydrophobicContact CB-CB 4.09Å; L73-Q77 HydrophobicContact CD2-CB 4.15Å; S74-Q77 PolarHBondContact O-N 2.81Å; S74-Q77 VanDerWaalsContact OG-CG 3.23Å; S74-Q77 WeakPolarHBondContact OG-CG 3.4Å; S74-Q77 PolarHBondContact OG-N 3.19Å; S74-Q77 PolarHBondContact OG-OE1 3.41Å; Q77-L80 PolarHBondContact O-N 3.24Å; Q77-C81 VanDerWaalsContact O-CB 3.29Å; Q77-C81 WeakPolarHBondContact O-CB 3.26Å; Q77-C81 PolarHBondContact O-N 3.5Å; Q77-F194 HydrophobicContact CB-CE2 4.08Å; Q77-F194 HydrophobicContact CB-CZ 4.27Å; Q77-F194 HydrophobicContact CG-CE2 4.29Å; Q77-F194 HydrophobicContact CG-CZ 4.33Å; Q77-F194 WeakPolarHBondContact CG-O 3.46Å; Q77-F194 PolarHBondContact NE2-O 3.28Å; Q77-A197 HydrophobicContact CG-CB 3.8Å
78	K	89.1	Confident	85.2	Confident	54 Å²	54	54.1 Å²	54.1	24%	0.235	28%	0.276	C	S	.	.	H	α-helix	trans	-62.8	-44.1	173.4	-74.8	177.5	179.9	-175.4	0	111.5	L73 S74 Q75 G76 L80 C81 Q82	L73-K78 HydrophobicContact CB-CG 3.73Å; L73-K78 HydrophobicContact CD1-CG 4.36Å; L73-K78 WeakPolarHBondContact O-CE 3.12Å; S74-K78 WeakPolarHBondContact O-CG 3.38Å; S74-K78 PolarHBondContact O-N 3.47Å; Q75-K78 PolarHBondContact O-N 3.12Å; G76-K78 VanDerWaalsContact C-N 3.33Å; G76-K78 PolarHBondContact O-N 3.23Å; K78-L80 VanDerWaalsContact C-N 3.34Å; K78-L80 PolarHBondContact O-N 2.01Å; K78-C81 WeakPolarHBondContact O-CB 3.12Å; K78-C81 PolarHBondContact O-N 2.92Å; K78-Q82 VanDerWaalsContact O-CG 3.31Å; K78-Q82 WeakPolarHBondContact O-CG 3.28Å; K78-Q82 PolarHBondContact O-N 2.82Å
79	K	90.9	Very high	85.9	Confident	144 Å²	144	55.2 Å²	55.2	63%	0.626	27%	0.274	S	S	*	.	H	α-helix	trans	-60	-44.2	174.8	-68.4	174.1	-177.7	-177.8	0	111.8	Q75 G76 Q82 L83	Q75-K79 WeakPolarHBondContact O-CG 3.45Å; Q75-K79 PolarHBondContact O-N 2.91Å; Q75-K79 VanDerWaalsContact O-N 3.15Å; G76-K79 PolarHBondContact O-N 2.82Å; K79-Q82 PolarHBondContact O-N 3.06Å; K79-L83 PolarHBondContact O-N 2.76Å
80	L	91.5	Very high	86.9	Confident	30 Å²	30	49 Å²	49	16%	0.157	24%	0.244	C	C	.	.	H	α-helix	trans	-65.6	-41.1	176.3	-69.7	171.8	0	0	0	112.1	G76 Q77 K78 Q82 L83 Y84 E193 F194 A197	G76-L80 WeakPolarHBondContact O-CG 3.48Å; G76-L80 PolarHBondContact O-N 2.8Å; Q77-L80 PolarHBondContact O-N 3.24Å; K78-L80 VanDerWaalsContact C-N 3.34Å; K78-L80 PolarHBondContact O-N 2.01Å; L80-Q82 VanDerWaalsContact C-N 3.29Å; L80-Q82 PolarHBondContact O-N 2.84Å; L80-L83 PolarHBondContact O-N 2.99Å; L80-L83 VanDerWaalsContact O-N 3.17Å; L80-Y84 HydrophobicContact CD2-CD2 4.3Å; L80-Y84 HydrophobicContact CD2-CE2 4.14Å; L80-Y84 WeakPolarHBondContact O-CB 3.26Å; L80-Y84 WeakPolarHBondContact O-CD2 3.31Å; L80-Y84 PolarHBondContact O-N 3.12Å; L80-E193 HydrophobicContact CD1-CB 4.38Å; L80-E193 WeakPolarHBondContact CD1-O 3.42Å; L80-F194 HydrophobicContact CB-CD2 4.01Å; L80-F194 HydrophobicContact CD1-CB 4.23Å; L80-F194 HydrophobicContact CD1-CD2 4.15Å; L80-A197 HydrophobicContact CD1-CB 4.25Å
81	C	89.9	Confident	87.8	Confident	1 Å²	1	47.9 Å²	47.9	1%	0.007	24%	0.239	C	C	.	.	H	α-helix	trans	-59.2	-41.2	175.1	177.2	0	0	0	0	111.7	C67 L73 Q77 K78 L83 Y84 Q85 M88	C67-C81 VanDerWaalsContact CA-SG 3.52Å; C67-C81 HydrophobicContact CB-CB 3.7Å; C67-C81 WeakPolarHBondContact CB-SG 3.34Å; C67-C81 WeakPolarHBondContact SG-CB 3.44Å; C67-C81 PolarHBondContact SG-O 3.07Å; C67-C81 CovalentContact SG-SG 2.03Å; C67-C81 PolarHBondContact SG-SG 2.69Å; L73-C81 HydrophobicContact CD1-CB 3.95Å; Q77-C81 VanDerWaalsContact O-CB 3.29Å; Q77-C81 WeakPolarHBondContact O-CB 3.26Å; Q77-C81 PolarHBondContact O-N 3.5Å; K78-C81 WeakPolarHBondContact O-CB 3.12Å; K78-C81 PolarHBondContact O-N 2.92Å; C81-L83 VanDerWaalsContact C-N 3.27Å; C81-L83 PolarHBondContact O-N 3.28Å; C81-Y84 CarbonylContact O-C 3.17Å; C81-Y84 PolarHBondContact O-N 2.88Å; C81-Q85 WeakPolarHBondContact O-CA 3.3Å; C81-Q85 WeakPolarHBondContact O-CG 2.97Å; C81-Q85 PolarHBondContact O-N 3.41Å; C81-M88 HydrophobicContact CB-CE 4.15Å; C81-M88 HydrophobicContact CB-CG 4.32Å; C81-M88 HydrophobicContact CB-SD 3.57Å; C81-M88 VanDerWaalsContact CB-SD 3.57Å; C81-M88 VanDerWaalsContact SG-CG 3.51Å; C81-M88 PolarHBondContact SG-SD 2.84Å
82	Q	90.3	Very high	88.5	Confident	92 Å²	92	43.5 Å²	43.5	43%	0.43	21%	0.214	S	C	.	.	H	α-helix	trans	-63.7	-35.7	177.9	-70.9	176.9	-41.8	0	0	112.4	C67 K78 K79 L80 Q85	C67-Q82 HydrophobicContact CB-CG 4.12Å; C67-Q82 PolarHBondContact SG-N 3.38Å; K78-Q82 VanDerWaalsContact O-CG 3.31Å; K78-Q82 WeakPolarHBondContact O-CG 3.28Å; K78-Q82 PolarHBondContact O-N 2.82Å; K79-Q82 PolarHBondContact O-N 3.06Å; L80-Q82 VanDerWaalsContact C-N 3.29Å; L80-Q82 PolarHBondContact O-N 2.84Å; Q82-Q85 PolarHBondContact O-NE2 3.49Å
83	L	91.1	Very high	89.2	Confident	123 Å²	123	47.2 Å²	47.2	64%	0.644	23%	0.229	S	C	*	.	H	α-helix	trans	-78.7	-35.8	178.7	-175.2	61	0	0	0	113	K79 L80 C81	K79-L83 PolarHBondContact O-N 2.76Å; L80-L83 PolarHBondContact O-N 2.99Å; L80-L83 VanDerWaalsContact O-N 3.17Å; C81-L83 VanDerWaalsContact C-N 3.27Å; C81-L83 PolarHBondContact O-N 3.28Å
84	Y	91.7	Very high	89.7	Confident	54 Å²	54	46.7 Å²	46.7	21%	0.212	23%	0.227	C	C	.	.			trans	-123.9	56.8	-171.5	-62	-67.6	0	0	0	111	L80 C81 D86 H87 F190	L80-Y84 HydrophobicContact CD2-CD2 4.3Å; L80-Y84 HydrophobicContact CD2-CE2 4.14Å; L80-Y84 WeakPolarHBondContact O-CB 3.26Å; L80-Y84 WeakPolarHBondContact O-CD2 3.31Å; L80-Y84 PolarHBondContact O-N 3.12Å; C81-Y84 CarbonylContact O-C 3.17Å; C81-Y84 PolarHBondContact O-N 2.88Å; Y84-D86 VanDerWaalsContact C-N 3.34Å; Y84-D86 PolarHBondContact O-N 2.87Å; Y84-H87 AromaticContact CD1-CE1 3.83Å; Y84-H87 WeakPolarHBondContact O-CB 3.14Å; Y84-H87 PolarHBondContact O-N 2.87Å; Y84-H87 VanDerWaalsContact O-N 3.09Å; Y84-F190 HydrophobicContact CD1-CE2 4.38Å; Y84-F190 AromaticContact CD2-CE2 3.77Å; Y84-F190 HydrophobicContact CD2-CE2 3.77Å; Y84-F190 HydrophobicContact CE2-CE2 4.33Å; Y84-F190 AromaticContact CG-CE2 3.78Å; Y84-F190 HydrophobicContact CG-CE2 3.78Å
85	Q	87.8	Confident	89.7	Confident	84 Å²	84	46 Å²	46	39%	0.393	22%	0.222	S	C	.	.	G	3₁₀ helix	trans	-62.8	-40.2	-174.2	-66.4	175.1	33.7	0	0	112.6	Q64 C81 Q82 H87 M88	Q64-Q85 VanDerWaalsContact NE2-CD 3.35Å; C81-Q85 WeakPolarHBondContact O-CA 3.3Å; C81-Q85 WeakPolarHBondContact O-CG 2.97Å; C81-Q85 PolarHBondContact O-N 3.41Å; Q82-Q85 PolarHBondContact O-NE2 3.49Å; Q85-H87 PolarHBondContact O-N 2.04Å; Q85-M88 WeakPolarHBondContact O-CB 2.95Å; Q85-M88 WeakPolarHBondContact O-CG 3.14Å; Q85-M88 PolarHBondContact O-N 3.39Å; Q85-M88 VanDerWaalsContact O-N 3.16Å
86	D	89.1	Confident	89.7	Confident	50 Å²	50	44.3 Å²	44.3	27%	0.267	21%	0.213	S	C	.	.	G	3₁₀ helix	trans	-63.4	-16.8	176	57	-11.9	0	0	0	113.2	Y84 L157 N158	Y84-D86 VanDerWaalsContact C-N 3.34Å; Y84-D86 PolarHBondContact O-N 2.87Å; D86-L157 HydrophobicContact CB-CD2 4.31Å; D86-L157 WeakPolarHBondContact O-CD2 3.35Å; D86-N158 PolarHBondContact OD2-N 2.86Å; D86-N158 VanDerWaalsContact OD2-N 3.17Å; D86-N158 PolarHBondContact OD2-ND2 3.4Å
87	H	92.1	Very high	89.9	Confident	0 Å²	0	46 Å²	46	0%	0	22%	0.217	C	C	.	.	G	3₁₀ helix	trans	-82.6	-20.5	177.3	-63.2	53.9	0	0	0	112.7	Y84 Q85 Q89 F90 I91 S159 Y186 F190	Y84-H87 AromaticContact CD1-CE1 3.83Å; Y84-H87 WeakPolarHBondContact O-CB 3.14Å; Y84-H87 PolarHBondContact O-N 2.87Å; Y84-H87 VanDerWaalsContact O-N 3.09Å; Q85-H87 PolarHBondContact O-N 2.04Å; H87-Q89 VanDerWaalsContact C-N 3.3Å; H87-Q89 PolarHBondContact O-N 3.27Å; H87-F90 PolarHBondContact O-N 2.67Å; H87-F90 VanDerWaalsContact O-N 3.11Å; H87-I91 HydrophobicContact CB-CD1 4.13Å; H87-I91 VanDerWaalsContact O-CG1 3.25Å; H87-I91 WeakPolarHBondContact O-CG1 3.34Å; H87-I91 PolarHBondContact O-N 3.43Å; H87-S159 PolarHBondContact CE1-OG 3.21Å; H87-S159 PolarHBondContact NE2-OG 3.02Å; H87-S159 VanDerWaalsContact NE2-OG 3.08Å; H87-Y186 AromaticContact NE2-CE1 3.5Å; H87-Y186 AromaticContact NE2-CZ 3.59Å; H87-Y186 PolarHBondContact NE2-OH 2.61Å; H87-F190 HydrophobicContact CB-CE1 4.23Å; H87-F190 HydrophobicContact CB-CE2 4.14Å; H87-F190 HydrophobicContact CB-CZ 3.63Å; H87-F190 AromaticContact CD2-CD2 3.72Å; H87-F190 AromaticContact CD2-CE2 3.42Å; H87-F190 VanDerWaalsContact CD2-CE2 3.42Å; H87-F190 WeakPolarHBondContact CD2-CE2 3.41Å; H87-F190 AromaticContact CD2-CZ 3.68Å; H87-F190 AromaticContact CG-CE2 3.84Å; H87-F190 AromaticContact CG-CZ 3.85Å
88	M	88.1	Confident	90	Very high	1 Å²	1	46 Å²	46	1%	0.005	22%	0.217	C	C	.	.	H	α-helix	trans	-64.8	-33.5	-167.7	-64	-54.7	-53.6	0	0	113.1	L48 L53 L70 L73 C81 Q85 I91 G92 F194	L48-M88 HydrophobicContact CD1-CE 3.37Å; L53-M88 HydrophobicContact CD1-CB 3.64Å; L70-M88 HydrophobicContact CD1-CE 3.83Å; L73-M88 HydrophobicContact CD1-CE 4.09Å; L73-M88 HydrophobicContact CD2-CE 4.48Å; C81-M88 HydrophobicContact CB-CE 4.15Å; C81-M88 HydrophobicContact CB-CG 4.32Å; C81-M88 HydrophobicContact CB-SD 3.57Å; C81-M88 VanDerWaalsContact CB-SD 3.57Å; C81-M88 VanDerWaalsContact SG-CG 3.51Å; C81-M88 PolarHBondContact SG-SD 2.84Å; Q85-M88 WeakPolarHBondContact O-CB 2.95Å; Q85-M88 WeakPolarHBondContact O-CG 3.14Å; Q85-M88 PolarHBondContact O-N 3.39Å; Q85-M88 VanDerWaalsContact O-N 3.16Å; M88-I91 HydrophobicContact CE-CD1 4.29Å; M88-I91 HydrophobicContact SD-CD1 3.69Å; M88-G92 PolarHBondContact O-N 2.93Å; M88-F194 HydrophobicContact CE-CE2 4.27Å; M88-F194 HydrophobicContact CE-CZ 4.03Å; M88-F194 HydrophobicContact SD-CE2 4.14Å; M88-F194 HydrophobicContact SD-CZ 4.44Å
89	Q	87.9	Confident	90	Very high	84 Å²	84	44 Å²	44	39%	0.393	21%	0.208	S	C	.	.	H	α-helix	trans	-61.5	-52.1	172.6	178.5	-179.2	-25.8	0	0	110.8	H87 I91 G92 E93	H87-Q89 VanDerWaalsContact C-N 3.3Å; H87-Q89 PolarHBondContact O-N 3.27Å; Q89-I91 VanDerWaalsContact C-N 3.3Å; Q89-I91 PolarHBondContact O-N 3.38Å; Q89-G92 WeakPolarHBondContact O-CA 3.39Å; Q89-G92 PolarHBondContact O-N 3.16Å; Q89-E93 PolarHBondContact NE2-OE1 2.89Å; Q89-E93 WeakPolarHBondContact O-CG 3.36Å; Q89-E93 PolarHBondContact O-N 2.73Å
90	F	92.1	Very high	90	Very high	18 Å²	18	44.3 Å²	44.3	8%	0.079	21%	0.205	C	C	.	.	H	α-helix	trans	-68.4	-28.1	-178	-60.4	-72.6	0	0	0	113.2	H87 G94 T147 V148 A151 E156 L157	H87-F90 PolarHBondContact O-N 2.67Å; H87-F90 VanDerWaalsContact O-N 3.11Å; F90-G94 PolarHBondContact O-N 3.28Å; F90-T147 WeakPolarHBondContact O-CB 3.31Å; F90-T147 PolarHBondContact O-OG1 2.88Å; F90-V148 HydrophobicContact CB-CG2 4.46Å; F90-A151 HydrophobicContact CB-CB 4.43Å; F90-A151 HydrophobicContact CD1-CB 3.57Å; F90-A151 HydrophobicContact CD2-CB 3.85Å; F90-A151 HydrophobicContact CE1-CB 3.67Å; F90-A151 HydrophobicContact CE2-CB 3.94Å; F90-A151 HydrophobicContact CG-CB 3.66Å; F90-A151 HydrophobicContact CZ-CB 3.86Å; F90-E156 HydrophobicContact CE1-CB 4.37Å; F90-E156 HydrophobicContact CE2-CB 3.78Å; F90-E156 HydrophobicContact CZ-CB 3.41Å; F90-E156 VanDerWaalsContact CZ-CB 3.41Å; F90-E156 HydrophobicContact CZ-CG 3.84Å; F90-L157 HydrophobicContact CD2-CD2 3.69Å; F90-L157 HydrophobicContact CD2-CG 4.29Å; F90-L157 HydrophobicContact CE2-CD2 3.86Å; F90-L157 HydrophobicContact CE2-CG 4.37Å
91	I	90.6	Very high	90.3	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-63.6	-47.3	168.6	-68.8	167.9	0	0	0	110.2	W45 L48 H87 M88 Q89 G94 A95 F190 F194	W45-I91 HydrophobicContact CE3-CG2 3.5Å; W45-I91 VanDerWaalsContact CE3-CG2 3.5Å; W45-I91 HydrophobicContact CH2-CG2 4.29Å; W45-I91 HydrophobicContact CZ3-CG2 3.27Å; L48-I91 HydrophobicContact CD1-CG2 4.12Å; H87-I91 HydrophobicContact CB-CD1 4.13Å; H87-I91 VanDerWaalsContact O-CG1 3.25Å; H87-I91 WeakPolarHBondContact O-CG1 3.34Å; H87-I91 PolarHBondContact O-N 3.43Å; M88-I91 HydrophobicContact CE-CD1 4.29Å; M88-I91 HydrophobicContact SD-CD1 3.69Å; Q89-I91 VanDerWaalsContact C-N 3.3Å; Q89-I91 PolarHBondContact O-N 3.38Å; I91-G94 PolarHBondContact O-N 3.47Å; I91-A95 WeakPolarHBondContact O-CB 3.27Å; I91-A95 PolarHBondContact O-N 3.21Å; I91-F190 HydrophobicContact CD1-CE1 3.5Å; I91-F190 VanDerWaalsContact CD1-CE1 3.5Å; I91-F190 HydrophobicContact CD1-CZ 3.64Å; I91-F190 HydrophobicContact CG1-CE1 3.72Å; I91-F190 HydrophobicContact CG1-CZ 4.32Å; I91-F194 HydrophobicContact CD1-CD1 4.1Å; I91-F194 HydrophobicContact CD1-CD2 3.96Å; I91-F194 HydrophobicContact CD1-CE1 4.02Å; I91-F194 HydrophobicContact CD1-CE2 3.87Å; I91-F194 HydrophobicContact CD1-CG 4.07Å; I91-F194 HydrophobicContact CD1-CZ 3.9Å; I91-F194 HydrophobicContact CG2-CD1 4.08Å; I91-F194 HydrophobicContact CG2-CE1 3.5Å; I91-F194 HydrophobicContact CG2-CZ 3.99Å
92	G	86.1	Confident	90.5	Very high	6 Å²	6	43.3 Å²	43.3	6%	0.062	20%	0.2	C	C	.	.	H	α-helix	trans	-61.9	-42.1	175.8	0	0	0	0	0	112.7	M88 Q89 A95 K96	M88-G92 PolarHBondContact O-N 2.93Å; Q89-G92 WeakPolarHBondContact O-CA 3.39Å; Q89-G92 PolarHBondContact O-N 3.16Å; G92-A95 WeakPolarHBondContact O-CB 3.17Å; G92-A95 PolarHBondContact O-N 3.41Å; G92-K96 WeakPolarHBondContact O-CB 3.37Å; G92-K96 PolarHBondContact O-N 2.87Å
93	E	89.4	Confident	90.7	Very high	84 Å²	84	42.6 Å²	42.6	39%	0.393	20%	0.197	S	C	.	.	H	α-helix	trans	-64.4	-42.6	174.1	-70.5	178.1	-172	0	0	112.3	Q89 A95 K96 M97 T147	Q89-E93 PolarHBondContact NE2-OE1 2.89Å; Q89-E93 WeakPolarHBondContact O-CG 3.36Å; Q89-E93 PolarHBondContact O-N 2.73Å; E93-A95 VanDerWaalsContact C-N 3.29Å; E93-A95 PolarHBondContact O-N 3.41Å; E93-K96 WeakPolarHBondContact O-CB 3.42Å; E93-K96 PolarHBondContact O-N 3.03Å; E93-M97 WeakPolarHBondContact O-CB 3.26Å; E93-M97 PolarHBondContact O-N 3.3Å; E93-T147 HydrophobicContact CB-CG2 4.29Å
94	G	92	Very high	90.9	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-64.2	-38.5	176.9	0	0	0	0	0	111.5	F90 I91 M97 G98 G143 T147	F90-G94 PolarHBondContact O-N 3.28Å; I91-G94 PolarHBondContact O-N 3.47Å; G94-M97 PolarHBondContact O-N 3.49Å; G94-G98 PolarHBondContact O-N 2.63Å; G94-G143 WeakPolarHBondContact CA-O 3.43Å; G94-G143 WeakPolarHBondContact O-CA 3.33Å; G94-T147 VanDerWaalsContact CA-CG2 3.41Å; G94-T147 VanDerWaalsContact CA-OG1 3.28Å; G94-T147 WeakPolarHBondContact CA-OG1 3.37Å; G94-T147 PolarHBondContact N-OG1 3.08Å
95	A	87.8	Confident	91.2	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-60.3	-54.9	170.2	0	0	0	0	0	111	W45 W46 A49 I91 G92 E93 M97 G98 I99	W45-A95 HydrophobicContact CH2-CB 4.15Å; W45-A95 HydrophobicContact CZ3-CB 3.76Å; W46-A95 HydrophobicContact CD2-CB 3.83Å; W46-A95 HydrophobicContact CE3-CB 3.44Å; W46-A95 VanDerWaalsContact CE3-CB 3.44Å; W46-A95 HydrophobicContact CH2-CB 3.81Å; W46-A95 HydrophobicContact CZ2-CB 4.05Å; W46-A95 HydrophobicContact CZ3-CB 3.59Å; W46-A95 WeakPolarHBondContact CZ3-O 3.49Å; A49-A95 HydrophobicContact CB-CB 3.84Å; I91-A95 WeakPolarHBondContact O-CB 3.27Å; I91-A95 PolarHBondContact O-N 3.21Å; G92-A95 WeakPolarHBondContact O-CB 3.17Å; G92-A95 PolarHBondContact O-N 3.41Å; E93-A95 VanDerWaalsContact C-N 3.29Å; E93-A95 PolarHBondContact O-N 3.41Å; A95-M97 PolarHBondContact O-N 2.97Å; A95-G98 WeakPolarHBondContact O-CA 3.48Å; A95-G98 PolarHBondContact O-N 2.78Å; A95-I99 WeakPolarHBondContact O-CG1 3.49Å; A95-I99 PolarHBondContact O-N 2.87Å
96	K	86.6	Confident	91.5	Very high	89 Å²	89	35.4 Å²	35.4	39%	0.387	16%	0.159	S	C	.	.	H	α-helix	trans	-55	-39.9	178.8	-164.9	176.3	-166.4	174.5	0	113.1	A49 G92 E93 I99 R100	A49-K96 HydrophobicContact CB-CB 3.92Å; G92-K96 WeakPolarHBondContact O-CB 3.37Å; G92-K96 PolarHBondContact O-N 2.87Å; E93-K96 WeakPolarHBondContact O-CB 3.42Å; E93-K96 PolarHBondContact O-N 3.03Å; K96-I99 PolarHBondContact O-N 3.31Å; K96-R100 VanDerWaalsContact CE-NH2 3.29Å; K96-R100 VanDerWaalsContact O-CG 3.31Å; K96-R100 WeakPolarHBondContact O-CG 3.05Å; K96-R100 PolarHBondContact O-N 3.42Å
97	M	93.3	Very high	91.7	Very high	53 Å²	53	38.2 Å²	38.2	26%	0.261	17%	0.165	S	C	.	.	H	α-helix	trans	-61.3	-47.4	175.4	-173.7	-175.7	-69.9	0	0	111.3	E93 G94 A95 I99 R100 E101 N146 T147 F257	E93-M97 WeakPolarHBondContact O-CB 3.26Å; E93-M97 PolarHBondContact O-N 3.3Å; G94-M97 PolarHBondContact O-N 3.49Å; A95-M97 PolarHBondContact O-N 2.97Å; M97-I99 PolarHBondContact O-N 2.72Å; M97-R100 PolarHBondContact O-N 3.25Å; M97-E101 WeakPolarHBondContact O-CB 3.07Å; M97-E101 PolarHBondContact O-N 2.9Å; M97-N146 HydrophobicContact SD-CB 4.15Å; M97-N146 PolarHBondContact SD-OD1 3.34Å; M97-T147 HydrophobicContact CE-CG2 3.59Å; M97-T147 HydrophobicContact SD-CG2 4.23Å; M97-F257 HydrophobicContact CG-CB 4.4Å; M97-F257 HydrophobicContact CG-CD1 3.45Å; M97-F257 VanDerWaalsContact CG-CD1 3.45Å; M97-F257 HydrophobicContact CG-CD2 4.37Å; M97-F257 HydrophobicContact CG-CE1 3.67Å; M97-F257 HydrophobicContact CG-CG 3.82Å; M97-F257 HydrophobicContact CG-CZ 4.23Å; M97-F257 HydrophobicContact SD-CB 3.86Å; M97-F257 HydrophobicContact SD-CD1 3.8Å; M97-F257 HydrophobicContact SD-CD2 3.65Å; M97-F257 HydrophobicContact SD-CE1 4.21Å; M97-F257 HydrophobicContact SD-CE2 4.09Å; M97-F257 HydrophobicContact SD-CG 3.48Å; M97-F257 WeakPolarHBondContact SD-CG 3.47Å; M97-F257 HydrophobicContact SD-CZ 4.34Å
98	G	93	Very high	91.7	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-59.9	-42.2	175.2	0	0	0	0	0	113.4	G94 A95 E101 C102	G94-G98 PolarHBondContact O-N 2.63Å; A95-G98 WeakPolarHBondContact O-CA 3.48Å; A95-G98 PolarHBondContact O-N 2.78Å; G98-E101 PolarHBondContact O-N 3.03Å; G98-C102 WeakPolarHBondContact O-CB 3.38Å; G98-C102 PolarHBondContact O-N 2.75Å
99	I	88.3	Confident	91.9	Very high	11 Å²	11	45.3 Å²	45.3	6%	0.056	20%	0.196	C	C	.	.	H	α-helix	trans	-60.7	-52.5	177.5	-44.8	-149.1	0	0	0	110.8	W46 A49 A95 K96 M97 E101 C102 Q103 V121 F122	W46-I99 HydrophobicContact CE3-CD1 3.99Å; W46-I99 HydrophobicContact CE3-CG1 3.82Å; W46-I99 HydrophobicContact CZ3-CD1 4.4Å; W46-I99 HydrophobicContact CZ3-CG1 3.71Å; A49-I99 HydrophobicContact CB-CD1 4.05Å; A95-I99 WeakPolarHBondContact O-CG1 3.49Å; A95-I99 PolarHBondContact O-N 2.87Å; K96-I99 PolarHBondContact O-N 3.31Å; M97-I99 PolarHBondContact O-N 2.72Å; I99-E101 VanDerWaalsContact C-N 3.25Å; I99-E101 PolarHBondContact O-N 3.43Å; I99-C102 WeakPolarHBondContact O-CB 3.39Å; I99-C102 PolarHBondContact O-N 2.97Å; I99-Q103 HydrophobicContact CG2-CG 4.31Å; I99-Q103 WeakPolarHBondContact O-CG 3.14Å; I99-Q103 PolarHBondContact O-N 3.45Å; I99-V121 HydrophobicContact CD1-CB 4.1Å; I99-V121 HydrophobicContact CD1-CG2 4.07Å; I99-V121 HydrophobicContact CG2-CB 4.49Å; I99-V121 HydrophobicContact CG2-CG1 4.35Å; I99-V121 HydrophobicContact CG2-CG2 4.32Å; I99-F122 HydrophobicContact CB-CE2 3.75Å; I99-F122 HydrophobicContact CD1-CD2 4.03Å; I99-F122 HydrophobicContact CD1-CE2 3.84Å; I99-F122 HydrophobicContact CG1-CD2 3.94Å; I99-F122 HydrophobicContact CG1-CE2 3.46Å; I99-F122 VanDerWaalsContact CG1-CE2 3.46Å; I99-F122 HydrophobicContact CG2-CE2 3.86Å; I99-F122 HydrophobicContact CG2-CZ 4.41Å
100	R	92	Very high	92.2	Very high	150 Å²	150	45.8 Å²	45.8	57%	0.566	19%	0.194	S	C	*	.	H	α-helix	trans	-60.5	-40.7	-176.7	-74.9	170.2	170.2	180	-8.5	111	K96 M97 Y104	K96-R100 VanDerWaalsContact CE-NH2 3.29Å; K96-R100 VanDerWaalsContact O-CG 3.31Å; K96-R100 WeakPolarHBondContact O-CG 3.05Å; K96-R100 PolarHBondContact O-N 3.42Å; M97-R100 PolarHBondContact O-N 3.25Å; R100-Y104 WeakPolarHBondContact O-CB 3.42Å; R100-Y104 PolarHBondContact O-N 2.92Å
101	E	97.1	Very high	92.2	Very high	11 Å²	11	45.4 Å²	45.4	5%	0.051	19%	0.192	C	C	.	.	H	α-helix	trans	-70	-40.2	178.1	-170	53.4	-150.6	0	0	111.7	M97 G98 I99 Y104 Q105 I139 F257 R258	M97-E101 WeakPolarHBondContact O-CB 3.07Å; M97-E101 PolarHBondContact O-N 2.9Å; G98-E101 PolarHBondContact O-N 3.03Å; I99-E101 VanDerWaalsContact C-N 3.25Å; I99-E101 PolarHBondContact O-N 3.43Å; E101-Y104 WeakPolarHBondContact O-CB 3.39Å; E101-Y104 PolarHBondContact O-N 2.93Å; E101-Q105 HydrophobicContact CG-CG 4.46Å; E101-Q105 WeakPolarHBondContact O-CB 3.41Å; E101-Q105 VanDerWaalsContact O-CG 3.29Å; E101-Q105 WeakPolarHBondContact O-CG 3.46Å; E101-Q105 PolarHBondContact O-N 3.21Å; E101-Q105 PolarHBondContact OE1-NE2 3.36Å; E101-I139 HydrophobicContact CB-CD1 4.34Å; E101-I139 HydrophobicContact CB-CG1 4.34Å; E101-I139 HydrophobicContact CG-CD1 4.01Å; E101-I139 HydrophobicContact CG-CG1 4.48Å; E101-F257 HydrophobicContact CB-CD1 3.8Å; E101-F257 HydrophobicContact CB-CE1 3.59Å; E101-F257 HydrophobicContact CG-CD1 3.9Å; E101-F257 HydrophobicContact CG-CE1 3.91Å; E101-R258 VanDerWaalsContact CD-NE 3.26Å; E101-R258 VanDerWaalsContact OE1-CD 3.3Å; E101-R258 WeakPolarHBondContact OE1-CD 3.32Å; E101-R258 IonicContact OE1-CZ 2.66Å; E101-R258 IonicContact OE1-NE 3.32Å; E101-R258 PolarHBondContact OE1-NE 3.28Å; E101-R258 IonicContact OE2-CZ 3.11Å; E101-R258 IonicContact OE2-NE 2.89Å; E101-R258 PolarHBondContact OE2-NE 3.15Å; E101-R258 IonicContact OE2-NH2 3.86Å; E101-R258 PolarHBondContact OE2-NH2 3.47Å
102	C	95.1	Very high	92.2	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-60.7	-47.9	173.6	-171.1	0	0	0	0	112.3	G98 I99 Y104 Q105 F106 C113 F122 F135 I139	G98-C102 WeakPolarHBondContact O-CB 3.38Å; G98-C102 PolarHBondContact O-N 2.75Å; I99-C102 WeakPolarHBondContact O-CB 3.39Å; I99-C102 PolarHBondContact O-N 2.97Å; C102-Y104 VanDerWaalsContact C-N 3.26Å; C102-Y104 PolarHBondContact O-N 3.29Å; C102-Q105 PolarHBondContact O-N 2.89Å; C102-F106 WeakPolarHBondContact O-CB 3.16Å; C102-F106 WeakPolarHBondContact O-CD2 3.28Å; C102-F106 PolarHBondContact O-N 3.34Å; C102-C113 HydrophobicContact CB-CB 3.86Å; C102-C113 WeakPolarHBondContact CB-SG 3.44Å; C102-C113 WeakPolarHBondContact SG-CB 3.48Å; C102-C113 CovalentContact SG-SG 2.01Å; C102-C113 PolarHBondContact SG-SG 2.86Å; C102-F122 HydrophobicContact CB-CZ 3.99Å; C102-F135 HydrophobicContact CB-CE1 3.93Å; C102-I139 HydrophobicContact CB-CG2 4.23Å
103	Q	93.6	Very high	92.3	Very high	77 Å²	77	47.6 Å²	47.6	36%	0.36	20%	0.202	S	C	.	.	H	α-helix	trans	-59.8	-39.4	175	-71.6	173.4	-20.2	0	0	111.5	I99 R107 C113	I99-Q103 HydrophobicContact CG2-CG 4.31Å; I99-Q103 WeakPolarHBondContact O-CG 3.14Å; I99-Q103 PolarHBondContact O-N 3.45Å; Q103-R107 WeakPolarHBondContact O-CA 3.29Å; Q103-R107 WeakPolarHBondContact O-CB 3.37Å; Q103-R107 PolarHBondContact O-N 3.34Å; Q103-C113 HydrophobicContact CG-CB 4.17Å
104	Y	95.9	Very high	91.8	Very high	84 Å²	84	44.9 Å²	44.9	33%	0.329	19%	0.192	S	C	.	.	H	α-helix	trans	-61.4	-52.2	174.7	177.1	-92.3	0	0	0	111.5	R100 E101 C102 F106 R107 R258	R100-Y104 WeakPolarHBondContact O-CB 3.42Å; R100-Y104 PolarHBondContact O-N 2.92Å; E101-Y104 WeakPolarHBondContact O-CB 3.39Å; E101-Y104 PolarHBondContact O-N 2.93Å; C102-Y104 VanDerWaalsContact C-N 3.26Å; C102-Y104 PolarHBondContact O-N 3.29Å; Y104-F106 PolarHBondContact O-N 2.86Å; Y104-R107 VanDerWaalsContact CE1-NH1 3.3Å; Y104-R107 WeakPolarHBondContact O-CD 3.44Å; Y104-R107 VanDerWaalsContact O-CG 3.29Å; Y104-R107 WeakPolarHBondContact O-CG 3.41Å; Y104-R107 PolarHBondContact O-N 3.22Å; Y104-R107 PolarHBondContact O-NH1 3Å; Y104-R258 VanDerWaalsContact CD1-NE 3.35Å; Y104-R258 VanDerWaalsContact CG-CZ 3.5Å; Y104-R258 VanDerWaalsContact CZ-CZ 3.44Å; Y104-R258 PolarHBondContact OH-NH1 2.98Å
105	Q	97.4	Very high	90.5	Very high	26 Å²	26	45 Å²	45	12%	0.121	19%	0.193	C	C	.	.	H	α-helix	trans	-62.6	-31.5	-177.8	-69.2	-61.2	-20	0	0	112.6	E101 C102 F135 D262 K265	E101-Q105 HydrophobicContact CG-CG 4.46Å; E101-Q105 WeakPolarHBondContact O-CB 3.41Å; E101-Q105 VanDerWaalsContact O-CG 3.29Å; E101-Q105 WeakPolarHBondContact O-CG 3.46Å; E101-Q105 PolarHBondContact O-N 3.21Å; E101-Q105 PolarHBondContact OE1-NE2 3.36Å; C102-Q105 PolarHBondContact O-N 2.89Å; Q105-F135 HydrophobicContact CB-CZ 4.27Å; Q105-F135 HydrophobicContact CG-CZ 4.17Å; Q105-D262 PolarHBondContact NE2-OD1 2.73Å; Q105-K265 HydrophobicContact CB-CD 4.25Å; Q105-K265 HydrophobicContact CB-CG 4.47Å; Q105-K265 HydrophobicContact CG-CB 4.34Å
106	F	95	Very high	88.9	Confident	0 Å²	0	46.7 Å²	46.7	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-106.1	5.6	-175.3	-73.2	-92.5	0	0	0	114.9	C102 Y104 H108 R109 W111 N112 C113 F135 K265 Y268	C102-F106 WeakPolarHBondContact O-CB 3.16Å; C102-F106 WeakPolarHBondContact O-CD2 3.28Å; C102-F106 PolarHBondContact O-N 3.34Å; Y104-F106 PolarHBondContact O-N 2.86Å; F106-H108 PolarHBondContact O-N 2.83Å; F106-R109 HydrophobicContact CD1-CB 4.06Å; F106-R109 HydrophobicContact CD1-CG 3.91Å; F106-R109 PolarHBondContact O-N 3.01Å; F106-W111 HydrophobicContact CB-CE3 4.25Å; F106-W111 HydrophobicContact CB-CZ3 4.35Å; F106-W111 WeakPolarHBondContact CB-O 3.32Å; F106-W111 AromaticContact CD1-CE3 3.46Å; F106-W111 HydrophobicContact CD1-CE3 3.46Å; F106-W111 VanDerWaalsContact CD1-CE3 3.46Å; F106-W111 AromaticContact CD1-CZ3 3.64Å; F106-W111 HydrophobicContact CD1-CZ3 3.64Å; F106-W111 HydrophobicContact CD2-CE3 4.41Å; F106-W111 AromaticContact CD2-CZ3 3.81Å; F106-W111 HydrophobicContact CD2-CZ3 3.81Å; F106-W111 AromaticContact CE1-CE3 3.83Å; F106-W111 HydrophobicContact CE1-CE3 3.83Å; F106-W111 AromaticContact CE1-CZ3 3.78Å; F106-W111 HydrophobicContact CE1-CZ3 3.78Å; F106-W111 AromaticContact CE2-CZ3 3.96Å; F106-W111 HydrophobicContact CE2-CZ3 3.96Å; F106-W111 AromaticContact CG-CE3 3.79Å; F106-W111 HydrophobicContact CG-CE3 3.79Å; F106-W111 AromaticContact CG-CZ3 3.65Å; F106-W111 HydrophobicContact CG-CZ3 3.65Å; F106-W111 HydrophobicContact CZ-CE3 4.45Å; F106-W111 AromaticContact CZ-CZ3 3.94Å; F106-W111 HydrophobicContact CZ-CZ3 3.94Å; F106-N112 WeakPolarHBondContact O-CA 3.33Å; F106-C113 HydrophobicContact CB-CB 4.33Å; F106-F135 HydrophobicContact CD2-CD1 4.38Å; F106-F135 HydrophobicContact CD2-CE1 4.23Å; F106-F135 AromaticContact CE2-CD1 3.55Å; F106-F135 HydrophobicContact CE2-CD1 3.55Å; F106-F135 HydrophobicContact CE2-CD2 4.16Å; F106-F135 AromaticContact CE2-CE1 3.66Å; F106-F135 HydrophobicContact CE2-CE1 3.66Å; F106-F135 HydrophobicContact CE2-CE2 4.22Å; F106-F135 AromaticContact CE2-CG 3.82Å; F106-F135 HydrophobicContact CE2-CG 3.82Å; F106-F135 AromaticContact CE2-CZ 3.99Å; F106-F135 HydrophobicContact CE2-CZ 3.99Å; F106-F135 HydrophobicContact CZ-CD1 4.29Å; F106-F135 HydrophobicContact CZ-CG 4.18Å; F106-K265 HydrophobicContact CE2-CD 4.07Å; F106-K265 HydrophobicContact CZ-CD 4.05Å; F106-Y268 HydrophobicContact CE1-CD1 4.28Å; F106-Y268 HydrophobicContact CE1-CD2 4.36Å; F106-Y268 AromaticContact CE1-CE1 3.77Å; F106-Y268 HydrophobicContact CE1-CE1 3.77Å; F106-Y268 AromaticContact CE1-CE2 3.83Å; F106-Y268 HydrophobicContact CE1-CE2 3.83Å; F106-Y268 AromaticContact CE1-CZ 3.53Å; F106-Y268 AromaticContact CZ-CD1 3.96Å; F106-Y268 HydrophobicContact CZ-CD1 3.96Å; F106-Y268 AromaticContact CZ-CD2 3.78Å; F106-Y268 HydrophobicContact CZ-CD2 3.78Å; F106-Y268 AromaticContact CZ-CE1 3.91Å; F106-Y268 HydrophobicContact CZ-CE1 3.91Å; F106-Y268 AromaticContact CZ-CE2 3.72Å; F106-Y268 HydrophobicContact CZ-CE2 3.72Å; F106-Y268 AromaticContact CZ-CG 3.9Å; F106-Y268 HydrophobicContact CZ-CG 3.9Å; F106-Y268 AromaticContact CZ-CZ 3.8Å
107	R	92.8	Very high	87.4	Confident	109 Å²	109	46.2 Å²	46.2	41%	0.411	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.4	-29.5	-177.3	69.5	-167.8	-177.4	-91.6	3.2	114.7	Q103 Y104 R321	Q103-R107 WeakPolarHBondContact O-CA 3.29Å; Q103-R107 WeakPolarHBondContact O-CB 3.37Å; Q103-R107 PolarHBondContact O-N 3.34Å; Y104-R107 VanDerWaalsContact CE1-NH1 3.3Å; Y104-R107 WeakPolarHBondContact O-CD 3.44Å; Y104-R107 VanDerWaalsContact O-CG 3.29Å; Y104-R107 WeakPolarHBondContact O-CG 3.41Å; Y104-R107 PolarHBondContact O-N 3.22Å; Y104-R107 PolarHBondContact O-NH1 3Å; R107-R321 PolarHBondContact O-NH2 3.24Å; R107-R321 VanDerWaalsContact O-NH2 3.16Å
108	H	91.3	Very high	85.3	Confident	92 Å²	92	49.5 Å²	49.5	43%	0.426	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-104.6	8.2	-177.3	-67.8	-46.5	0	0	0	113.8	F106 M330 D331 M336	F106-H108 PolarHBondContact O-N 2.83Å; H108-M330 CarbonylContact O-C 3.57Å; H108-D331 HydrophobicContact CB-CB 3.94Å; H108-D331 PolarHBondContact O-N 3.15Å; H108-M336 VanDerWaalsContact O-CE 3.28Å; H108-M336 WeakPolarHBondContact O-CE 3.37Å
109	R	93.3	Very high	83.2	Confident	58 Å²	58	51.9 Å²	51.9	22%	0.219	24%	0.244	C	C	.	.	S	Bend	trans	-104.5	159.2	176.8	-65.4	-74.7	-172.4	136.6	3.9	110.1	F106 W111 D269 R321 M330	F106-R109 HydrophobicContact CD1-CB 4.06Å; F106-R109 HydrophobicContact CD1-CG 3.91Å; F106-R109 PolarHBondContact O-N 3.01Å; R109-W111 VanDerWaalsContact C-N 3.33Å; R109-W111 WeakPolarHBondContact CB-O 3.36Å; R109-W111 PolarHBondContact O-N 3.11Å; R109-D269 IonicContact NH2-OD1 2.67Å; R109-D269 PolarHBondContact NH2-OD1 3.23Å; R109-D269 VanDerWaalsContact NH2-OD1 3.11Å; R109-R321 VanDerWaalsContact O-CZ 3.23Å; R109-R321 PolarHBondContact O-NH1 2.98Å; R109-R321 PolarHBondContact O-NH2 3.36Å; R109-M330 WeakPolarHBondContact CD-SD 3.05Å; R109-M330 PolarHBondContact NE-SD 2.97Å; R109-M330 VanDerWaalsContact NE-SD 3.43Å; R109-M330 VanDerWaalsContact NH1-CE 3.25Å; R109-M330 PolarHBondContact NH1-SD 3.25Å
110	R	93.6	Very high	81.4	Confident	93 Å²	93	51.8 Å²	51.8	35%	0.351	24%	0.244	S	C	.	.	S	Bend	trans	-58.8	-41.1	177	-64.5	-178.6	-173.8	156.5	3.9	112.9	T318 R321 L335	R110-T318 HydrophobicContact CB-CG2 3.91Å; R110-T318 HydrophobicContact CG-CG2 4.02Å; R110-R321 VanDerWaalsContact CA-NH1 3.28Å; R110-R321 PolarHBondContact O-NH1 3.4Å; R110-L335 VanDerWaalsContact CZ-O 3.25Å; R110-L335 PolarHBondContact NE-O 3.29Å; R110-L335 PolarHBondContact NH2-O 3.28Å
111	W	91.7	Very high	79.4	Confident	11 Å²	11	45.4 Å²	45.4	4%	0.042	22%	0.221	C	C	.	.	S	Bend	trans	-89.5	117.5	163.2	-179.6	81.2	0	0	0	108.5	F106 R109 C113 M126 E132 T136 Y306	F106-W111 HydrophobicContact CB-CE3 4.25Å; F106-W111 HydrophobicContact CB-CZ3 4.35Å; F106-W111 WeakPolarHBondContact CB-O 3.32Å; F106-W111 AromaticContact CD1-CE3 3.46Å; F106-W111 HydrophobicContact CD1-CE3 3.46Å; F106-W111 VanDerWaalsContact CD1-CE3 3.46Å; F106-W111 AromaticContact CD1-CZ3 3.64Å; F106-W111 HydrophobicContact CD1-CZ3 3.64Å; F106-W111 HydrophobicContact CD2-CE3 4.41Å; F106-W111 AromaticContact CD2-CZ3 3.81Å; F106-W111 HydrophobicContact CD2-CZ3 3.81Å; F106-W111 AromaticContact CE1-CE3 3.83Å; F106-W111 HydrophobicContact CE1-CE3 3.83Å; F106-W111 AromaticContact CE1-CZ3 3.78Å; F106-W111 HydrophobicContact CE1-CZ3 3.78Å; F106-W111 AromaticContact CE2-CZ3 3.96Å; F106-W111 HydrophobicContact CE2-CZ3 3.96Å; F106-W111 AromaticContact CG-CE3 3.79Å; F106-W111 HydrophobicContact CG-CE3 3.79Å; F106-W111 AromaticContact CG-CZ3 3.65Å; F106-W111 HydrophobicContact CG-CZ3 3.65Å; F106-W111 HydrophobicContact CZ-CE3 4.45Å; F106-W111 AromaticContact CZ-CZ3 3.94Å; F106-W111 HydrophobicContact CZ-CZ3 3.94Å; R109-W111 VanDerWaalsContact C-N 3.33Å; R109-W111 WeakPolarHBondContact CB-O 3.36Å; R109-W111 PolarHBondContact O-N 3.11Å; W111-C113 HydrophobicContact CE3-CB 4.47Å; W111-C113 HydrophobicContact CH2-CB 3.78Å; W111-C113 WeakPolarHBondContact CH2-SG 3.33Å; W111-C113 HydrophobicContact CZ2-CB 4.11Å; W111-C113 HydrophobicContact CZ3-CB 3.97Å; W111-M126 HydrophobicContact CZ2-SD 4.04Å; W111-E132 HydrophobicContact CB-CG 4.38Å; W111-E132 HydrophobicContact CD2-CB 3.89Å; W111-E132 HydrophobicContact CD2-CG 3.58Å; W111-E132 HydrophobicContact CE3-CB 3.8Å; W111-E132 HydrophobicContact CE3-CG 3.39Å; W111-E132 HydrophobicContact CG-CG 4.05Å; W111-E132 HydrophobicContact CH2-CB 3.81Å; W111-E132 HydrophobicContact CH2-CG 4.35Å; W111-E132 HydrophobicContact CZ2-CB 3.91Å; W111-E132 HydrophobicContact CZ3-CB 3.76Å; W111-E132 HydrophobicContact CZ3-CG 3.82Å; W111-T136 HydrophobicContact CH2-CG2 3.59Å; W111-T136 HydrophobicContact CZ2-CG2 3.87Å; W111-Y306 HydrophobicContact CB-CD1 3.85Å; W111-Y306 HydrophobicContact CB-CD2 3.82Å; W111-Y306 HydrophobicContact CB-CE1 3.94Å; W111-Y306 HydrophobicContact CB-CE2 3.9Å; W111-Y306 HydrophobicContact CB-CG 3.79Å; W111-Y306 AromaticContact CD1-CD1 3.96Å; W111-Y306 AromaticContact CD1-CE1 3.59Å; W111-Y306 HydrophobicContact CG-CD1 4.24Å; W111-Y306 AromaticContact CG-CE1 3.95Å; W111-Y306 HydrophobicContact CG-CE1 3.95Å; W111-Y306 HydrophobicContact CG-CE2 4.46Å
112	N	90.6	Very high	77.2	Confident	52 Å²	52	45.4 Å²	45.4	28%	0.278	22%	0.222	S	C	.	.			trans	-104.8	25.3	-175.8	70.6	-16.3	0	0	0	112.7	F106 S114	F106-N112 WeakPolarHBondContact O-CA 3.33Å; N112-S114 PolarHBondContact ND2-OG 2.66Å; N112-S114 PolarHBondContact O-N 3.23Å; N112-S114 WeakPolarHBondContact OD1-CB 3.44Å; N112-S114 PolarHBondContact OD1-N 3.11Å; N112-S114 PolarHBondContact OD1-OG 2.89Å
113	C	88.3	Confident	75.3	Confident	0 Å²	0	45.7 Å²	45.7	0%	0	22%	0.224	C	C	.	.	S	Bend	trans	60.8	30.3	-174.5	-153.1	0	0	0	0	115	C102 Q103 F106 W111 V121 F122	C102-C113 HydrophobicContact CB-CB 3.86Å; C102-C113 WeakPolarHBondContact CB-SG 3.44Å; C102-C113 WeakPolarHBondContact SG-CB 3.48Å; C102-C113 CovalentContact SG-SG 2.01Å; C102-C113 PolarHBondContact SG-SG 2.86Å; Q103-C113 HydrophobicContact CG-CB 4.17Å; F106-C113 HydrophobicContact CB-CB 4.33Å; W111-C113 HydrophobicContact CE3-CB 4.47Å; W111-C113 HydrophobicContact CH2-CB 3.78Å; W111-C113 WeakPolarHBondContact CH2-SG 3.33Å; W111-C113 HydrophobicContact CZ2-CB 4.11Å; W111-C113 HydrophobicContact CZ3-CB 3.97Å; C113-V121 WeakPolarHBondContact O-CG1 3.49Å; C113-F122 WeakPolarHBondContact SG-CE1 3.35Å; C113-F122 WeakPolarHBondContact SG-CZ 3.17Å
114	S	78.1	Confident	73.8	Confident	26 Å²	26	45.6 Å²	45.6	18%	0.182	22%	0.22	C	C	.	.			trans	-108.2	153.6	169.3	-52.8	0	0	0	0	110.1	N112	N112-S114 PolarHBondContact ND2-OG 2.66Å; N112-S114 PolarHBondContact O-N 3.23Å; N112-S114 WeakPolarHBondContact OD1-CB 3.44Å; N112-S114 PolarHBondContact OD1-N 3.11Å; N112-S114 PolarHBondContact OD1-OG 2.89Å
115	T	65.1	Low	71.8	Confident	3 Å²	3	43 Å²	43	2%	0.018	21%	0.213	C	C	.	.			trans	-124.6	154.6	179.6	62.5	0	0	0	0	110	D117 N118 S120 V121 V125	T115-D117 PolarHBondContact O-N 2.88Å; T115-D117 VanDerWaalsContact O-N 3.08Å; T115-N118 PolarHBondContact O-N 3.25Å; T115-S120 PolarHBondContact OG1-O 2.78Å; T115-V121 HydrophobicContact CG2-CG1 4.28Å; T115-V121 WeakPolarHBondContact CG2-O 3.38Å; T115-V125 VanDerWaalsContact CB-CG1 3.45Å; T115-V125 HydrophobicContact CG2-CB 4.41Å; T115-V125 HydrophobicContact CG2-CG1 3.41Å; T115-V125 VanDerWaalsContact CG2-CG1 3.41Å
116	V	54.8	Low	70.2	Confident	35 Å²	35	42.2 Å²	42.2	21%	0.212	21%	0.21	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.7	-28.2	-170.3	179.4	0	0	0	0	113.3	Q311 S315 I316	V116-Q311 HydrophobicContact CG1-CG 4.28Å; V116-S315 WeakPolarHBondContact CG2-O 3.35Å; V116-I316 HydrophobicContact CG2-CG1 4.06Å
117	D	54.3	Low	69.3	Low	79 Å²	79	47.8 Å²	47.8	42%	0.422	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-104.9	2.6	-169.9	-67.4	-27	0	0	0	115.8	T115 A119	T115-D117 PolarHBondContact O-N 2.88Å; T115-D117 VanDerWaalsContact O-N 3.08Å; D117-A119 WeakPolarHBondContact O-CB 3.21Å; D117-A119 PolarHBondContact O-N 2.86Å
118	N	50.7	Low	69	Low	122 Å²	122	44.2 Å²	44.2	65%	0.652	23%	0.225	S	C	*	.	S	Bend	trans	51.7	-12.3	179	-78.2	-18.5	0	0	0	117.8	T115	T115-N118 PolarHBondContact O-N 3.25Å
119	A	47.6	Very low	69.1	Low	51 Å²	51	39.9 Å²	39.9	42%	0.421	20%	0.204	S	C	.	.	S	Bend	trans	-95.7	-18.2	-169.6	0	0	0	0	0	112.6	A42 D117	A42-A119 HydrophobicContact CB-CB 3.8Å; D117-A119 WeakPolarHBondContact O-CB 3.21Å; D117-A119 PolarHBondContact O-N 2.86Å
120	S	50.6	Low	69.1	Low	8 Å²	8	37.1 Å²	37.1	6%	0.056	19%	0.194	C	C	.	.			trans	-152.7	117	167.3	63.1	0	0	0	0	108.9	T115 V125	T115-S120 PolarHBondContact OG1-O 2.78Å; S120-V125 WeakPolarHBondContact O-CG1 3.46Å; S120-V125 WeakPolarHBondContact O-CG2 3.02Å; S120-V125 WeakPolarHBondContact OG-CG2 3.3Å
121	V	50	Low	69.2	Low	16 Å²	16	36.9 Å²	36.9	10%	0.097	19%	0.193	C	C	.	.	S	Bend	trans	-81.8	-22.6	178.9	-171.5	0	0	0	0	110.3	I99 C113 T115	I99-V121 HydrophobicContact CD1-CB 4.1Å; I99-V121 HydrophobicContact CD1-CG2 4.07Å; I99-V121 HydrophobicContact CG2-CB 4.49Å; I99-V121 HydrophobicContact CG2-CG1 4.35Å; I99-V121 HydrophobicContact CG2-CG2 4.32Å; C113-V121 WeakPolarHBondContact O-CG1 3.49Å; T115-V121 HydrophobicContact CG2-CG1 4.28Å; T115-V121 WeakPolarHBondContact CG2-O 3.38Å
122	F	51.1	Low	69.3	Low	12 Å²	12	36.6 Å²	36.6	5%	0.053	19%	0.192	C	C	.	.	S	Bend	trans	-142.1	29	-168.7	-52.3	-65	0	0	0	115.9	W46 I99 C102 C113 T136	W46-F122 HydrophobicContact CD2-CB 3.75Å; W46-F122 AromaticContact CD2-CD2 3.89Å; W46-F122 HydrophobicContact CD2-CD2 3.89Å; W46-F122 HydrophobicContact CD2-CG 4.25Å; W46-F122 HydrophobicContact CE3-CB 4.1Å; W46-F122 AromaticContact CE3-CD2 3.31Å; W46-F122 HydrophobicContact CE3-CD2 3.31Å; W46-F122 HydrophobicContact CE3-CE2 4.13Å; W46-F122 HydrophobicContact CE3-CG 4.1Å; W46-F122 HydrophobicContact CG-CB 3.86Å; W46-F122 AromaticContact CZ3-CD2 3.55Å; W46-F122 HydrophobicContact CZ3-CD2 3.55Å; W46-F122 HydrophobicContact CZ3-CE2 4.03Å; W46-F122 HydrophobicContact CZ3-CG 4.37Å; I99-F122 HydrophobicContact CB-CE2 3.75Å; I99-F122 HydrophobicContact CD1-CD2 4.03Å; I99-F122 HydrophobicContact CD1-CE2 3.84Å; I99-F122 HydrophobicContact CG1-CD2 3.94Å; I99-F122 HydrophobicContact CG1-CE2 3.46Å; I99-F122 VanDerWaalsContact CG1-CE2 3.46Å; I99-F122 HydrophobicContact CG2-CE2 3.86Å; I99-F122 HydrophobicContact CG2-CZ 4.41Å; C102-F122 HydrophobicContact CB-CZ 3.99Å; C113-F122 WeakPolarHBondContact SG-CE1 3.35Å; C113-F122 WeakPolarHBondContact SG-CZ 3.17Å; F122-T136 HydrophobicContact CD1-CG2 3.43Å; F122-T136 VanDerWaalsContact CD1-CG2 3.43Å; F122-T136 HydrophobicContact CE1-CG2 3.24Å
123	G	55.6	Low	69.4	Low	5 Å²	5	34.2 Å²	34.2	5%	0.052	18%	0.179	C	C	.	.	S	Bend	trans	-73.6	-156.5	162.4	0	0	0	0	0	113.2	S44 V125	S44-G123 WeakPolarHBondContact OG-CA 3.07Å; S44-G123 PolarHBondContact OG-N 2.72Å; G123-V125 VanDerWaalsContact N-CG2 3.32Å; G123-V125 PolarHBondContact O-N 3.35Å
124	R	61.5	Low	69.8	Low	76 Å²	76	34.2 Å²	34.2	29%	0.287	18%	0.179	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.8	48.9	157.5	-77.2	-165.8	-178.3	-149	-9.8	111	Y204 D210	R124-Y204 PolarHBondContact NH1-OH 3.49Å; R124-Y204 PolarHBondContact NH2-OH 2.89Å; R124-D210 IonicContact NH1-OD1 2.88Å
125	V	54.9	Low	70.7	Confident	30 Å²	30	33 Å²	33	18%	0.182	17%	0.171	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.6	-39.3	-170.2	179.2	0	0	0	0	109.8	T115 S120 G123 Q127	T115-V125 VanDerWaalsContact CB-CG1 3.45Å; T115-V125 HydrophobicContact CG2-CB 4.41Å; T115-V125 HydrophobicContact CG2-CG1 3.41Å; T115-V125 VanDerWaalsContact CG2-CG1 3.41Å; S120-V125 WeakPolarHBondContact O-CG1 3.46Å; S120-V125 WeakPolarHBondContact O-CG2 3.02Å; S120-V125 WeakPolarHBondContact OG-CG2 3.3Å; G123-V125 VanDerWaalsContact N-CG2 3.32Å; G123-V125 PolarHBondContact O-N 3.35Å; V125-Q127 PolarHBondContact O-N 3.03Å
126	M	64.3	Low	72	Confident	9 Å²	9	33.1 Å²	33.1	4%	0.044	17%	0.172	C	C	.	.	S	Bend	trans	-84.9	100.9	164.3	-64.1	-163.3	70.4	0	0	108.4	W111 I128 S130 E132 T133 R213 Y306	W111-M126 HydrophobicContact CZ2-SD 4.04Å; M126-I128 HydrophobicContact CE-CG1 4.46Å; M126-I128 PolarHBondContact O-N 3.46Å; M126-I128 VanDerWaalsContact O-N 3.16Å; M126-S130 WeakPolarHBondContact CE-OG 3.47Å; M126-E132 HydrophobicContact CE-CB 3.95Å; M126-E132 HydrophobicContact SD-CB 3.93Å; M126-T133 HydrophobicContact CB-CG2 4.26Å; M126-T133 VanDerWaalsContact CB-OG1 3.31Å; M126-T133 WeakPolarHBondContact CB-OG1 3.49Å; M126-T133 PolarHBondContact SD-OG1 3.41Å; M126-R213 VanDerWaalsContact O-CZ 3.25Å; M126-R213 PolarHBondContact O-NH1 2.88Å; M126-R213 VanDerWaalsContact O-NH1 3.13Å; M126-R213 PolarHBondContact O-NH2 2.97Å; M126-Y306 VanDerWaalsContact CE-OH 3.3Å; M126-Y306 WeakPolarHBondContact CE-OH 3.5Å
127	Q	74.6	Confident	73.9	Confident	116 Å²	116	32.5 Å²	32.5	54%	0.542	17%	0.166	S	C	.	.	S	Bend	trans	-56.8	-30	178.7	-65.1	-63	-14.8	0	0	112.2	V125 Y209 R213	V125-Q127 PolarHBondContact O-N 3.03Å; Q127-Y209 PolarHBondContact O-OH 3.48Å; Q127-R213 PolarHBondContact O-NH1 3.41Å
128	I	87.7	Confident	76	Confident	35 Å²	35	28.7 Å²	28.7	18%	0.179	15%	0.146	C	C	.	.	S	Bend	trans	-93.6	146.7	179.3	59.3	172.5	0	0	0	112.2	M126 S130 T133 R213 D301 P304	M126-I128 HydrophobicContact CE-CG1 4.46Å; M126-I128 PolarHBondContact O-N 3.46Å; M126-I128 VanDerWaalsContact O-N 3.16Å; I128-S130 PolarHBondContact O-N 3.18Å; I128-T133 PolarHBondContact O-OG1 3.41Å; I128-R213 PolarHBondContact O-NH1 3.42Å; I128-D301 HydrophobicContact CB-CB 4.26Å; I128-P304 HydrophobicContact CD1-CB 4.18Å; I128-P304 VanDerWaalsContact CD1-CD 3.43Å; I128-P304 HydrophobicContact CD1-CG 3.64Å
129	G	92.4	Very high	78.2	Confident	0 Å²	0	22.9 Å²	22.9	0%	0	12%	0.115	C	C	.	.			trans	-87.4	58.1	176.3	0	0	0	0	0	111.4	Y209 R213 H299 I300 D301	G129-Y209 PolarHBondContact N-OH 2.98Å; G129-R213 VanDerWaalsContact N-NH1 3.16Å; G129-H299 WeakPolarHBondContact O-CB 3.44Å; G129-I300 PolarHBondContact O-N 3.19Å; G129-D301 PolarHBondContact N-OD2 3.16Å; G129-D301 PolarHBondContact O-N 3.33Å
130	S	94.3	Very high	80.4	Confident	0 Å²	0	20.7 Å²	20.7	0%	0	10%	0.096	C	C	.	.			trans	-76.3	172.5	-179	71.8	0	0	0	0	113.1	M126 I128 E132 T133 A134	M126-S130 WeakPolarHBondContact CE-OG 3.47Å; I128-S130 PolarHBondContact O-N 3.18Å; S130-E132 VanDerWaalsContact C-N 3.26Å; S130-E132 WeakPolarHBondContact CB-OE2 3.42Å; S130-E132 PolarHBondContact O-N 2.7Å; S130-E132 PolarHBondContact OG-N 2.67Å; S130-E132 PolarHBondContact OG-OE2 3.1Å; S130-T133 PolarHBondContact N-OG1 3.46Å; S130-T133 VanDerWaalsContact O-CB 3.31Å; S130-T133 WeakPolarHBondContact O-CB 3.32Å; S130-T133 PolarHBondContact O-N 3.17Å; S130-T133 PolarHBondContact OG-N 3.07Å; S130-T133 VanDerWaalsContact OG-N 3.15Å; S130-T133 PolarHBondContact OG-OG1 2.98Å; S130-A134 PolarHBondContact O-N 2.91Å
131	R	95.6	Very high	82.6	Confident	88 Å²	88	20.3 Å²	20.3	33%	0.332	9%	0.093	S	C	.	.	H	α-helix	trans	-59.5	-38	171.6	-71.6	-172.2	-67.2	177.4	-4.5	112.3	T133 A134 F135 Y268 A271 H299	R131-T133 VanDerWaalsContact C-N 3.34Å; R131-A134 WeakPolarHBondContact O-CB 3.02Å; R131-A134 PolarHBondContact O-N 2.56Å; R131-F135 PolarHBondContact O-N 3.27Å; R131-F135 VanDerWaalsContact O-N 3.1Å; R131-Y268 HydrophobicContact CB-CD2 4.02Å; R131-Y268 HydrophobicContact CB-CE2 3.58Å; R131-Y268 WeakPolarHBondContact O-CD2 3.29Å; R131-A271 HydrophobicContact CG-CB 4.18Å; R131-H299 HydrophobicContact CG-CB 4.3Å; R131-H299 WeakPolarHBondContact CG-CD2 3.17Å; R131-H299 WeakPolarHBondContact CG-NE2 3.23Å
132	E	93.4	Very high	84.9	Confident	6 Å²	6	19.5 Å²	19.5	3%	0.028	9%	0.088	C	C	.	.	H	α-helix	trans	-61.9	-47.8	177.2	-66.1	70.1	-139	0	0	109.2	W111 M126 S130 A134 F135 T136 Y268 S303 Y306	W111-E132 HydrophobicContact CB-CG 4.38Å; W111-E132 HydrophobicContact CD2-CB 3.89Å; W111-E132 HydrophobicContact CD2-CG 3.58Å; W111-E132 HydrophobicContact CE3-CB 3.8Å; W111-E132 HydrophobicContact CE3-CG 3.39Å; W111-E132 HydrophobicContact CG-CG 4.05Å; W111-E132 HydrophobicContact CH2-CB 3.81Å; W111-E132 HydrophobicContact CH2-CG 4.35Å; W111-E132 HydrophobicContact CZ2-CB 3.91Å; W111-E132 HydrophobicContact CZ3-CB 3.76Å; W111-E132 HydrophobicContact CZ3-CG 3.82Å; M126-E132 HydrophobicContact CE-CB 3.95Å; M126-E132 HydrophobicContact SD-CB 3.93Å; S130-E132 VanDerWaalsContact C-N 3.26Å; S130-E132 WeakPolarHBondContact CB-OE2 3.42Å; S130-E132 PolarHBondContact O-N 2.7Å; S130-E132 PolarHBondContact OG-N 2.67Å; S130-E132 PolarHBondContact OG-OE2 3.1Å; E132-A134 VanDerWaalsContact C-N 3.28Å; E132-A134 PolarHBondContact O-N 3.23Å; E132-F135 PolarHBondContact O-N 3.38Å; E132-F135 VanDerWaalsContact O-N 3.15Å; E132-T136 VanDerWaalsContact O-CG2 3.24Å; E132-T136 WeakPolarHBondContact O-CG2 3.5Å; E132-T136 PolarHBondContact O-N 3.4Å; E132-Y268 HydrophobicContact CG-CE2 4.19Å; E132-Y268 PolarHBondContact OE1-OH 3.38Å; E132-S303 PolarHBondContact OE1-OG 3.22Å; E132-S303 WeakPolarHBondContact OE2-CB 3.14Å; E132-S303 PolarHBondContact OE2-OG 2.82Å; E132-Y306 VanDerWaalsContact CD-OH 3.23Å; E132-Y306 HydrophobicContact CG-CE2 4.1Å; E132-Y306 WeakPolarHBondContact CG-OH 3.34Å; E132-Y306 PolarHBondContact OE2-OH 3.47Å
133	T	92.5	Very high	87.2	Confident	1 Å²	1	19 Å²	19	1%	0.006	9%	0.086	C	C	.	.	H	α-helix	trans	-53.8	-45.2	174	-46.3	0	0	0	0	111.3	M126 I128 S130 R131 F135 T136 Y137 M216	M126-T133 HydrophobicContact CB-CG2 4.26Å; M126-T133 VanDerWaalsContact CB-OG1 3.31Å; M126-T133 WeakPolarHBondContact CB-OG1 3.49Å; M126-T133 PolarHBondContact SD-OG1 3.41Å; I128-T133 PolarHBondContact O-OG1 3.41Å; S130-T133 PolarHBondContact N-OG1 3.46Å; S130-T133 VanDerWaalsContact O-CB 3.31Å; S130-T133 WeakPolarHBondContact O-CB 3.32Å; S130-T133 PolarHBondContact O-N 3.17Å; S130-T133 PolarHBondContact OG-N 3.07Å; S130-T133 VanDerWaalsContact OG-N 3.15Å; S130-T133 PolarHBondContact OG-OG1 2.98Å; R131-T133 VanDerWaalsContact C-N 3.34Å; T133-F135 PolarHBondContact O-N 2.01Å; T133-T136 WeakPolarHBondContact CA-OG1 3.34Å; T133-T136 PolarHBondContact O-N 2.63Å; T133-T136 VanDerWaalsContact O-N 3.16Å; T133-T136 PolarHBondContact O-OG1 2.89Å; T133-Y137 HydrophobicContact CG2-CD2 3.9Å; T133-Y137 HydrophobicContact CG2-CE2 3.78Å; T133-Y137 WeakPolarHBondContact O-CD2 3.29Å; T133-Y137 PolarHBondContact O-N 3.44Å; T133-Y137 VanDerWaalsContact O-N 3.1Å; T133-M216 HydrophobicContact CG2-CE 4.16Å
134	A	96.4	Very high	89.2	Confident	0 Å²	0	18.7 Å²	18.7	0%	0	8%	0.084	C	C	.	.	H	α-helix	trans	-58.6	-48	178.7	0	0	0	0	0	112.5	S130 R131 E132 T136 Y137 A138 N220 L297 V298 H299	S130-A134 PolarHBondContact O-N 2.91Å; R131-A134 WeakPolarHBondContact O-CB 3.02Å; R131-A134 PolarHBondContact O-N 2.56Å; E132-A134 VanDerWaalsContact C-N 3.28Å; E132-A134 PolarHBondContact O-N 3.23Å; A134-T136 VanDerWaalsContact C-N 3.31Å; A134-T136 PolarHBondContact O-N 2.91Å; A134-Y137 PolarHBondContact O-N 2.75Å; A134-A138 PolarHBondContact O-N 2.93Å; A134-N220 VanDerWaalsContact CA-ND2 3.32Å; A134-N220 WeakPolarHBondContact CA-ND2 3.45Å; A134-N220 WeakPolarHBondContact CB-ND2 3.33Å; A134-L297 HydrophobicContact CB-CB 4.31Å; A134-V298 VanDerWaalsContact CB-O 3.25Å; A134-V298 WeakPolarHBondContact CB-O 3.39Å; A134-H299 HydrophobicContact CB-CB 4.45Å
135	F	96.9	Very high	90.9	Very high	0 Å²	0	15.1 Å²	15.1	0%	0	7%	0.07	C	C	.	.	H	α-helix	trans	-61	-41.7	175.5	-178.5	-86.3	0	0	0	111.6	C102 Q105 F106 R131 E132 T133 Y137 A138 I139 L264 K265 Y268 L297	C102-F135 HydrophobicContact CB-CE1 3.93Å; Q105-F135 HydrophobicContact CB-CZ 4.27Å; Q105-F135 HydrophobicContact CG-CZ 4.17Å; F106-F135 HydrophobicContact CD2-CD1 4.38Å; F106-F135 HydrophobicContact CD2-CE1 4.23Å; F106-F135 AromaticContact CE2-CD1 3.55Å; F106-F135 HydrophobicContact CE2-CD1 3.55Å; F106-F135 HydrophobicContact CE2-CD2 4.16Å; F106-F135 AromaticContact CE2-CE1 3.66Å; F106-F135 HydrophobicContact CE2-CE1 3.66Å; F106-F135 HydrophobicContact CE2-CE2 4.22Å; F106-F135 AromaticContact CE2-CG 3.82Å; F106-F135 HydrophobicContact CE2-CG 3.82Å; F106-F135 AromaticContact CE2-CZ 3.99Å; F106-F135 HydrophobicContact CE2-CZ 3.99Å; F106-F135 HydrophobicContact CZ-CD1 4.29Å; F106-F135 HydrophobicContact CZ-CG 4.18Å; R131-F135 PolarHBondContact O-N 3.27Å; R131-F135 VanDerWaalsContact O-N 3.1Å; E132-F135 PolarHBondContact O-N 3.38Å; E132-F135 VanDerWaalsContact O-N 3.15Å; T133-F135 PolarHBondContact O-N 2.01Å; F135-Y137 PolarHBondContact O-N 3.29Å; F135-A138 PolarHBondContact O-N 3.18Å; F135-I139 HydrophobicContact CD1-CB 4.41Å; F135-I139 HydrophobicContact CD1-CG2 4.11Å; F135-I139 HydrophobicContact CE1-CB 3.92Å; F135-I139 HydrophobicContact CE1-CG1 4.3Å; F135-I139 HydrophobicContact CE1-CG2 3.84Å; F135-I139 HydrophobicContact CZ-CB 4.25Å; F135-I139 HydrophobicContact CZ-CG1 4.41Å; F135-I139 WeakPolarHBondContact O-CG2 3.37Å; F135-I139 PolarHBondContact O-N 2.9Å; F135-L264 HydrophobicContact CD2-CB 4.16Å; F135-L264 HydrophobicContact CE2-CB 3.68Å; F135-L264 HydrophobicContact CZ-CB 4.49Å; F135-K265 HydrophobicContact CE2-CB 4.14Å; F135-Y268 HydrophobicContact CB-CD2 3.87Å; F135-Y268 HydrophobicContact CB-CG 4.45Å; F135-L297 HydrophobicContact CB-CD1 4.29Å; F135-L297 HydrophobicContact CD2-CD1 4.43Å
136	T	93.5	Very high	93	Very high	7 Å²	7	13.7 Å²	13.7	4%	0.043	6%	0.061	C	C	.	.	H	α-helix	trans	-59.9	-44.5	-179.7	65.8	0	0	0	0	112.9	W111 F122 E132 T133 A134 A138 I139 S140	W111-T136 HydrophobicContact CH2-CG2 3.59Å; W111-T136 HydrophobicContact CZ2-CG2 3.87Å; F122-T136 HydrophobicContact CD1-CG2 3.43Å; F122-T136 VanDerWaalsContact CD1-CG2 3.43Å; F122-T136 HydrophobicContact CE1-CG2 3.24Å; E132-T136 VanDerWaalsContact O-CG2 3.24Å; E132-T136 WeakPolarHBondContact O-CG2 3.5Å; E132-T136 PolarHBondContact O-N 3.4Å; T133-T136 WeakPolarHBondContact CA-OG1 3.34Å; T133-T136 PolarHBondContact O-N 2.63Å; T133-T136 VanDerWaalsContact O-N 3.16Å; T133-T136 PolarHBondContact O-OG1 2.89Å; A134-T136 VanDerWaalsContact C-N 3.31Å; A134-T136 PolarHBondContact O-N 2.91Å; T136-A138 VanDerWaalsContact C-N 3.33Å; T136-A138 PolarHBondContact O-N 3.15Å; T136-I139 WeakPolarHBondContact O-CG2 3.31Å; T136-S140 WeakPolarHBondContact O-CB 2.99Å; T136-S140 PolarHBondContact O-N 2.94Å; T136-S140 PolarHBondContact O-OG 3.29Å
137	Y	94.4	Very high	94.6	Very high	21 Å²	21	13.6 Å²	13.6	8%	0.082	6%	0.061	C	C	.	.	H	α-helix	trans	-66.4	-39	179	-87.5	-100.3	0	0	0	110.8	T133 A134 F135 S140 A141 E199 N217 N221	T133-Y137 HydrophobicContact CG2-CD2 3.9Å; T133-Y137 HydrophobicContact CG2-CE2 3.78Å; T133-Y137 WeakPolarHBondContact O-CD2 3.29Å; T133-Y137 PolarHBondContact O-N 3.44Å; T133-Y137 VanDerWaalsContact O-N 3.1Å; A134-Y137 PolarHBondContact O-N 2.75Å; F135-Y137 PolarHBondContact O-N 3.29Å; Y137-S140 WeakPolarHBondContact O-CB 3.47Å; Y137-S140 PolarHBondContact O-N 3.13Å; Y137-A141 PolarHBondContact O-N 3.15Å; Y137-E199 PolarHBondContact OH-OE1 3.06Å; Y137-N217 HydrophobicContact CD1-CB 3.76Å; Y137-N217 HydrophobicContact CE1-CB 3.54Å; Y137-N217 WeakPolarHBondContact CE2-OD1 3.4Å; Y137-N217 HydrophobicContact CG-CB 4.46Å; Y137-N217 VanDerWaalsContact CZ-ND2 3.34Å; Y137-N217 PolarHBondContact OH-ND2 3.01Å; Y137-N221 WeakPolarHBondContact CB-OD1 3.36Å; Y137-N221 WeakPolarHBondContact CD1-OD1 3.4Å; Y137-N221 PolarHBondContact O-OD1 3.22Å; Y137-N221 VanDerWaalsContact O-OD1 3.09Å
138	A	97.9	Very high	95.8	Very high	0 Å²	0	8.1 Å²	8.1	0%	0	4%	0.036	C	C	.	.	H	α-helix	trans	-65.5	-54.7	177.9	0	0	0	0	0	113	A134 F135 T136 S140 A141 A142 N220 G224 L264 L297	A134-A138 PolarHBondContact O-N 2.93Å; F135-A138 PolarHBondContact O-N 3.18Å; T136-A138 VanDerWaalsContact C-N 3.33Å; T136-A138 PolarHBondContact O-N 3.15Å; A138-S140 PolarHBondContact O-N 2.93Å; A138-A141 PolarHBondContact O-N 3.21Å; A138-A142 VanDerWaalsContact O-CB 3.3Å; A138-A142 WeakPolarHBondContact O-CB 3.4Å; A138-A142 PolarHBondContact O-N 2.72Å; A138-N220 VanDerWaalsContact CA-O 3.24Å; A138-N220 WeakPolarHBondContact CA-O 3.43Å; A138-N220 VanDerWaalsContact CB-O 3.3Å; A138-N220 WeakPolarHBondContact CB-O 3.42Å; A138-G224 VanDerWaalsContact O-CA 3.25Å; A138-G224 WeakPolarHBondContact O-CA 3.35Å; A138-L264 HydrophobicContact CB-CD1 4.24Å; A138-L264 HydrophobicContact CB-CD2 3.98Å; A138-L297 HydrophobicContact CB-CD2 3.54Å
139	I	97.5	Very high	96.3	Very high	0 Å²	0	6.4 Å²	6.4	0%	0	3%	0.027	C	C	.	.	H	α-helix	trans	-63.4	-28.3	179.8	-162.3	65.6	0	0	0	111.2	E101 C102 F135 T136 G143 F257 L264	E101-I139 HydrophobicContact CB-CD1 4.34Å; E101-I139 HydrophobicContact CB-CG1 4.34Å; E101-I139 HydrophobicContact CG-CD1 4.01Å; E101-I139 HydrophobicContact CG-CG1 4.48Å; C102-I139 HydrophobicContact CB-CG2 4.23Å; F135-I139 HydrophobicContact CD1-CB 4.41Å; F135-I139 HydrophobicContact CD1-CG2 4.11Å; F135-I139 HydrophobicContact CE1-CB 3.92Å; F135-I139 HydrophobicContact CE1-CG1 4.3Å; F135-I139 HydrophobicContact CE1-CG2 3.84Å; F135-I139 HydrophobicContact CZ-CB 4.25Å; F135-I139 HydrophobicContact CZ-CG1 4.41Å; F135-I139 WeakPolarHBondContact O-CG2 3.37Å; F135-I139 PolarHBondContact O-N 2.9Å; T136-I139 WeakPolarHBondContact O-CG2 3.31Å; I139-G143 PolarHBondContact O-N 2.7Å; I139-F257 HydrophobicContact CD1-CE1 3.73Å; I139-F257 HydrophobicContact CD1-CZ 3.63Å; I139-F257 HydrophobicContact CG1-CE1 4.14Å; I139-F257 HydrophobicContact CG1-CZ 4.1Å; I139-L264 HydrophobicContact CB-CD1 4.26Å; I139-L264 HydrophobicContact CD1-CD1 3.76Å
140	S	93.6	Very high	96.5	Very high	4 Å²	4	9.9 Å²	9.9	3%	0.028	4%	0.04	C	C	.	.	H	α-helix	trans	-64.5	-54.5	175.9	-74.7	0	0	0	0	113.2	W46 T136 Y137 A138 A142 G143 V144	W46-S140 VanDerWaalsContact CE2-OG 3.31Å; W46-S140 VanDerWaalsContact CH2-CB 3.46Å; W46-S140 WeakPolarHBondContact CH2-OG 3.03Å; W46-S140 WeakPolarHBondContact CZ2-OG 3.31Å; T136-S140 WeakPolarHBondContact O-CB 2.99Å; T136-S140 PolarHBondContact O-N 2.94Å; T136-S140 PolarHBondContact O-OG 3.29Å; Y137-S140 WeakPolarHBondContact O-CB 3.47Å; Y137-S140 PolarHBondContact O-N 3.13Å; A138-S140 PolarHBondContact O-N 2.93Å; S140-A142 VanDerWaalsContact C-N 3.29Å; S140-A142 PolarHBondContact O-N 3.41Å; S140-G143 PolarHBondContact O-N 3.02Å; S140-V144 PolarHBondContact O-N 3.2Å
141	A	97.3	Very high	96.7	Very high	0 Å²	0	9.9 Å²	9.9	0%	0	4%	0.04	C	C	.	.	H	α-helix	trans	-64.5	-37.1	177.2	0	0	0	0	0	111.7	Y137 A138 V144 V145 S191 V195 N221 R225	Y137-A141 PolarHBondContact O-N 3.15Å; A138-A141 PolarHBondContact O-N 3.21Å; A141-V144 PolarHBondContact O-N 3.16Å; A141-V145 WeakPolarHBondContact O-CG2 3.3Å; A141-V145 PolarHBondContact O-N 2.95Å; A141-S191 PolarHBondContact O-OG 2.52Å; A141-V195 HydrophobicContact CB-CG1 4.35Å; A141-N221 HydrophobicContact CB-CB 3.98Å; A141-N221 WeakPolarHBondContact CB-O 3.44Å; A141-R225 HydrophobicContact CB-CG 4.09Å
142	A	98.6	Very high	96.8	Very high	0 Å²	0	5.7 Å²	5.7	0%	0	3%	0.025	C	C	.	.	H	α-helix	trans	-61.1	-43.6	175.6	0	0	0	0	0	112.5	A138 S140 V144 V145 N146 G224 V228 F257 V260 L264	A138-A142 VanDerWaalsContact O-CB 3.3Å; A138-A142 WeakPolarHBondContact O-CB 3.4Å; A138-A142 PolarHBondContact O-N 2.72Å; S140-A142 VanDerWaalsContact C-N 3.29Å; S140-A142 PolarHBondContact O-N 3.41Å; A142-V144 VanDerWaalsContact C-N 3.34Å; A142-V144 PolarHBondContact O-N 3.49Å; A142-V145 PolarHBondContact O-N 3.12Å; A142-N146 PolarHBondContact O-N 3.26Å; A142-G224 WeakPolarHBondContact CB-O 3.43Å; A142-V228 HydrophobicContact CB-CG2 3.62Å; A142-F257 HydrophobicContact CB-CE2 4.17Å; A142-F257 HydrophobicContact CB-CZ 4.38Å; A142-V260 HydrophobicContact CB-CG1 4.09Å; A142-L264 HydrophobicContact CB-CD1 4.26Å
143	G	97.8	Very high	97	Very high	0 Å²	0	9.1 Å²	9.1	0%	0	4%	0.037	C	C	.	.	H	α-helix	trans	-57.7	-44.7	178.1	0	0	0	0	0	112.5	G94 I139 S140 N146 T147	G94-G143 WeakPolarHBondContact CA-O 3.43Å; G94-G143 WeakPolarHBondContact O-CA 3.33Å; I139-G143 PolarHBondContact O-N 2.7Å; S140-G143 PolarHBondContact O-N 3.02Å; G143-N146 PolarHBondContact O-N 3.23Å; G143-T147 PolarHBondContact O-N 2.69Å; G143-T147 VanDerWaalsContact O-N 3.07Å; G143-T147 PolarHBondContact O-OG1 3.21Å
144	V	97.5	Very high	97.2	Very high	0 Å²	0	14.1 Å²	14.1	0%	0	6%	0.06	C	C	.	.	H	α-helix	trans	-65.7	-40.7	176.9	179.7	0	0	0	0	112.1	W45 S140 A141 A142 N146 V148 F190 V195	W45-V144 HydrophobicContact CH2-CG2 3.32Å; W45-V144 HydrophobicContact CZ2-CG2 4.13Å; W45-V144 HydrophobicContact CZ3-CG2 4.02Å; S140-V144 PolarHBondContact O-N 3.2Å; A141-V144 PolarHBondContact O-N 3.16Å; A142-V144 VanDerWaalsContact C-N 3.34Å; A142-V144 PolarHBondContact O-N 3.49Å; V144-N146 VanDerWaalsContact C-N 3.29Å; V144-N146 PolarHBondContact O-N 3.03Å; V144-V148 HydrophobicContact CG1-CG2 3.99Å; V144-V148 VanDerWaalsContact O-CB 3.29Å; V144-V148 WeakPolarHBondContact O-CB 3.24Å; V144-V148 VanDerWaalsContact O-CG2 3.29Å; V144-V148 WeakPolarHBondContact O-CG2 3.46Å; V144-V148 PolarHBondContact O-N 3.46Å; V144-V148 VanDerWaalsContact O-N 3.1Å; V144-F190 HydrophobicContact CG1-CD1 4.23Å; V144-V195 HydrophobicContact CB-CG2 4.24Å; V144-V195 HydrophobicContact CG1-CG2 4.44Å; V144-V195 HydrophobicContact CG2-CG2 3.89Å
145	V	98.6	Very high	97.2	Very high	0 Å²	0	16.9 Å²	16.9	0%	0	9%	0.088	C	C	.	.	H	α-helix	trans	-59.6	-45.7	174.3	177.8	0	0	0	0	110	A141 A142 S149 L184 S191 R225 V228	A141-V145 WeakPolarHBondContact O-CG2 3.3Å; A141-V145 PolarHBondContact O-N 2.95Å; A142-V145 PolarHBondContact O-N 3.12Å; V145-S149 WeakPolarHBondContact O-CB 3.19Å; V145-S149 PolarHBondContact O-N 2.99Å; V145-S149 PolarHBondContact O-OG 3.34Å; V145-L184 HydrophobicContact CG1-CD1 3.77Å; V145-S191 VanDerWaalsContact CG2-CB 3.46Å; V145-R225 HydrophobicContact CG2-CB 4.17Å; V145-R225 HydrophobicContact CG2-CG 3.69Å; V145-V228 HydrophobicContact CB-CB 4.45Å; V145-V228 HydrophobicContact CB-CG1 4.32Å; V145-V228 HydrophobicContact CB-CG2 4.42Å; V145-V228 HydrophobicContact CG1-CB 4.09Å; V145-V228 HydrophobicContact CG1-CG1 3.68Å
146	N	98.6	Very high	97.2	Very high	0 Å²	0	22.2 Å²	22.2	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-61.3	-52.3	-176.4	-169.3	-83.9	0	0	0	112.4	M97 A142 G143 V144 R150 L254 F257	M97-N146 HydrophobicContact SD-CB 4.15Å; M97-N146 PolarHBondContact SD-OD1 3.34Å; A142-N146 PolarHBondContact O-N 3.26Å; G143-N146 PolarHBondContact O-N 3.23Å; V144-N146 VanDerWaalsContact C-N 3.29Å; V144-N146 PolarHBondContact O-N 3.03Å; N146-R150 WeakPolarHBondContact O-CG 3.31Å; N146-R150 PolarHBondContact O-N 3.06Å; N146-L254 HydrophobicContact CB-CD1 4.48Å; N146-F257 HydrophobicContact CB-CD2 3.89Å; N146-F257 HydrophobicContact CB-CE2 4.06Å
147	T	98.2	Very high	97.2	Very high	8 Å²	8	22 Å²	22	5%	0.049	11%	0.112	C	C	.	.	H	α-helix	trans	-72.1	-44.1	-174.9	53.8	0	0	0	0	112.5	F90 E93 G94 M97 G143 S149 R150 A151	F90-T147 WeakPolarHBondContact O-CB 3.31Å; F90-T147 PolarHBondContact O-OG1 2.88Å; E93-T147 HydrophobicContact CB-CG2 4.29Å; G94-T147 VanDerWaalsContact CA-CG2 3.41Å; G94-T147 VanDerWaalsContact CA-OG1 3.28Å; G94-T147 WeakPolarHBondContact CA-OG1 3.37Å; G94-T147 PolarHBondContact N-OG1 3.08Å; M97-T147 HydrophobicContact CE-CG2 3.59Å; M97-T147 HydrophobicContact SD-CG2 4.23Å; G143-T147 PolarHBondContact O-N 2.69Å; G143-T147 VanDerWaalsContact O-N 3.07Å; G143-T147 PolarHBondContact O-OG1 3.21Å; T147-S149 PolarHBondContact O-N 2.76Å; T147-R150 PolarHBondContact O-N 3.37Å; T147-A151 WeakPolarHBondContact O-CB 3.48Å; T147-A151 PolarHBondContact O-N 2.82Å
148	V	98.3	Very high	97.1	Very high	0 Å²	0	28 Å²	28	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-64.8	-42	179.4	174.8	0	0	0	0	111.1	F90 V144 R150 A151 C152 L157 Y186 F190	F90-V148 HydrophobicContact CB-CG2 4.46Å; V144-V148 HydrophobicContact CG1-CG2 3.99Å; V144-V148 VanDerWaalsContact O-CB 3.29Å; V144-V148 WeakPolarHBondContact O-CB 3.24Å; V144-V148 VanDerWaalsContact O-CG2 3.29Å; V144-V148 WeakPolarHBondContact O-CG2 3.46Å; V144-V148 PolarHBondContact O-N 3.46Å; V144-V148 VanDerWaalsContact O-N 3.1Å; V148-R150 VanDerWaalsContact C-N 3.3Å; V148-R150 PolarHBondContact O-N 2.88Å; V148-A151 PolarHBondContact O-N 3.12Å; V148-C152 PolarHBondContact O-N 2.9Å; V148-C152 PolarHBondContact O-SG 2.66Å; V148-L157 HydrophobicContact CG1-CD1 4Å; V148-Y186 HydrophobicContact CG1-CD1 3.86Å; V148-Y186 HydrophobicContact CG1-CE1 3.84Å; V148-F190 HydrophobicContact CG1-CB 4.32Å; V148-F190 HydrophobicContact CG1-CD1 4.25Å; V148-F190 HydrophobicContact CG1-CG 4.31Å; V148-F190 HydrophobicContact CG2-CD1 3.99Å; V148-F190 HydrophobicContact CG2-CE1 4.3Å
149	S	98.4	Very high	96.9	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-64.1	-33.6	177.4	-73.2	0	0	0	0	113.6	V145 T147 R153 N183 L184 G187	V145-S149 WeakPolarHBondContact O-CB 3.19Å; V145-S149 PolarHBondContact O-N 2.99Å; V145-S149 PolarHBondContact O-OG 3.34Å; T147-S149 PolarHBondContact O-N 2.76Å; S149-R153 PolarHBondContact O-N 3.35Å; S149-N183 WeakPolarHBondContact CB-O 2.91Å; S149-N183 PolarHBondContact O-N 2.66Å; S149-N183 VanDerWaalsContact O-N 3.11Å; S149-N183 PolarHBondContact OG-O 2.99Å; S149-L184 VanDerWaalsContact OG-CA 3.31Å; S149-L184 WeakPolarHBondContact OG-CA 3.25Å; S149-G187 WeakPolarHBondContact OG-CA 3.41Å
150	R	98.2	Very high	96.9	Very high	72 Å²	72	31.8 Å²	31.8	27%	0.272	17%	0.172	S	C	.	.	H	α-helix	trans	-75.7	-41	176.1	-75.6	178.3	176	-158.7	4.8	112	N146 T147 V148 C152 R153 E154 D182 A255	N146-R150 WeakPolarHBondContact O-CG 3.31Å; N146-R150 PolarHBondContact O-N 3.06Å; T147-R150 PolarHBondContact O-N 3.37Å; V148-R150 VanDerWaalsContact C-N 3.3Å; V148-R150 PolarHBondContact O-N 2.88Å; R150-C152 VanDerWaalsContact C-N 3.26Å; R150-C152 PolarHBondContact O-N 2.75Å; R150-R153 WeakPolarHBondContact O-CA 3.4Å; R150-R153 WeakPolarHBondContact O-CB 3.38Å; R150-R153 PolarHBondContact O-N 2.83Å; R150-E154 PolarHBondContact O-N 3.18Å; R150-D182 WeakPolarHBondContact CG-OD1 3.42Å; R150-A255 PolarHBondContact NH2-O 3.45Å
151	A	98.2	Very high	97	Very high	0 Å²	0	33 Å²	33	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-58.4	-39.3	174.2	0	0	0	0	0	111.7	F90 T147 V148 R153 E154 G155 E156 L157	F90-A151 HydrophobicContact CB-CB 4.43Å; F90-A151 HydrophobicContact CD1-CB 3.57Å; F90-A151 HydrophobicContact CD2-CB 3.85Å; F90-A151 HydrophobicContact CE1-CB 3.67Å; F90-A151 HydrophobicContact CE2-CB 3.94Å; F90-A151 HydrophobicContact CG-CB 3.66Å; F90-A151 HydrophobicContact CZ-CB 3.86Å; T147-A151 WeakPolarHBondContact O-CB 3.48Å; T147-A151 PolarHBondContact O-N 2.82Å; V148-A151 PolarHBondContact O-N 3.12Å; A151-R153 VanDerWaalsContact C-N 3.33Å; A151-R153 PolarHBondContact O-N 3.18Å; A151-E154 PolarHBondContact O-N 3.46Å; A151-G155 PolarHBondContact O-N 3.44Å; A151-E156 HydrophobicContact CB-CB 4.3Å; A151-E156 PolarHBondContact O-N 3.06Å; A151-E156 VanDerWaalsContact O-N 3.1Å; A151-L157 HydrophobicContact CB-CD1 3.74Å; A151-L157 HydrophobicContact CB-CG 3.85Å
152	C	98.1	Very high	96.9	Very high	1 Å²	1	35.8 Å²	35.8	1%	0.007	20%	0.204	C	C	.	.	H	α-helix	trans	-60.7	-37.8	171.3	-67.1	0	0	0	0	113.6	V148 R150 E154 C160 G161 N183 Y186	V148-C152 PolarHBondContact O-N 2.9Å; V148-C152 PolarHBondContact O-SG 2.66Å; R150-C152 VanDerWaalsContact C-N 3.26Å; R150-C152 PolarHBondContact O-N 2.75Å; C152-E154 VanDerWaalsContact C-N 3.33Å; C152-C160 WeakPolarHBondContact CA-SG 3.12Å; C152-C160 HydrophobicContact CB-CB 3.86Å; C152-C160 WeakPolarHBondContact CB-SG 3.41Å; C152-C160 WeakPolarHBondContact SG-CB 3.42Å; C152-C160 CovalentContact SG-SG 2.03Å; C152-C160 PolarHBondContact SG-SG 3.27Å; C152-G161 CarbonylContact O-C 3.53Å; C152-G161 VanDerWaalsContact O-CA 3.3Å; C152-G161 WeakPolarHBondContact O-CA 3.25Å; C152-N183 HydrophobicContact CB-CB 3.66Å; C152-Y186 WeakPolarHBondContact SG-CD1 3.36Å
153	R	97	Very high	96.7	Very high	78 Å²	78	37.1 Å²	37.1	29%	0.294	21%	0.213	S	C	.	.	H	α-helix	trans	-69.4	-35.1	176.9	179.9	-173.8	58.2	75.7	9.2	111.3	S149 R150 A151 G155 C180 D182	S149-R153 PolarHBondContact O-N 3.35Å; R150-R153 WeakPolarHBondContact O-CA 3.4Å; R150-R153 WeakPolarHBondContact O-CB 3.38Å; R150-R153 PolarHBondContact O-N 2.83Å; A151-R153 VanDerWaalsContact C-N 3.33Å; A151-R153 PolarHBondContact O-N 3.18Å; R153-G155 VanDerWaalsContact C-N 3.3Å; R153-C180 WeakPolarHBondContact CD-O 3.21Å; R153-C180 HydrophobicContact CG-CB 4.37Å; R153-C180 VanDerWaalsContact CG-O 3.3Å; R153-C180 WeakPolarHBondContact CG-O 3.34Å; R153-C180 PolarHBondContact O-SG 3.03Å; R153-D182 WeakPolarHBondContact CD-OD1 3.3Å; R153-D182 IonicContact CZ-OD1 2.72Å; R153-D182 IonicContact NE-OD1 2.86Å; R153-D182 PolarHBondContact NE-OD1 2.89Å
154	E	96.6	Very high	96.5	Very high	106 Å²	106	48.6 Å²	48.6	50%	0.495	26%	0.256	S	S	.	.	H	α-helix	trans	-80.6	-13.2	-178.1	-71	167.4	177.6	0	0	112.7	R150 A151 C152 E156	R150-E154 PolarHBondContact O-N 3.18Å; A151-E154 PolarHBondContact O-N 3.46Å; C152-E154 VanDerWaalsContact C-N 3.33Å; E154-E156 HydrophobicContact CB-CG 3.94Å
155	G	96.2	Very high	96.3	Very high	57 Å²	57	50.2 Å²	50.2	59%	0.588	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	82.1	16.4	179.9	0	0	0	0	0	113.4	A151 R153 L157	A151-G155 PolarHBondContact O-N 3.44Å; R153-G155 VanDerWaalsContact C-N 3.3Å; G155-L157 VanDerWaalsContact C-N 3.28Å; G155-L157 PolarHBondContact O-N 3.01Å
156	E	95.8	Very high	96.1	Very high	113 Å²	113	54.4 Å²	54.4	53%	0.528	30%	0.304	S	S	.	.			trans	-78.7	-12.1	-178.4	-62.2	-67.2	161.7	0	0	113.3	F90 A151 E154	F90-E156 HydrophobicContact CE1-CB 4.37Å; F90-E156 HydrophobicContact CE2-CB 3.78Å; F90-E156 HydrophobicContact CZ-CB 3.41Å; F90-E156 VanDerWaalsContact CZ-CB 3.41Å; F90-E156 HydrophobicContact CZ-CG 3.84Å; A151-E156 HydrophobicContact CB-CB 4.3Å; A151-E156 PolarHBondContact O-N 3.06Å; A151-E156 VanDerWaalsContact O-N 3.1Å; E154-E156 HydrophobicContact CB-CG 3.94Å
157	L	94.9	Very high	95.9	Very high	3 Å²	3	58.8 Å²	58.8	2%	0.016	32%	0.321	C	S	.	.			trans	-118.7	130.1	-177.3	-65	179.7	0	0	0	110.4	D86 F90 V148 A151 G155 S159 C160	D86-L157 HydrophobicContact CB-CD2 4.31Å; D86-L157 WeakPolarHBondContact O-CD2 3.35Å; F90-L157 HydrophobicContact CD2-CD2 3.69Å; F90-L157 HydrophobicContact CD2-CG 4.29Å; F90-L157 HydrophobicContact CE2-CD2 3.86Å; F90-L157 HydrophobicContact CE2-CG 4.37Å; V148-L157 HydrophobicContact CG1-CD1 4Å; A151-L157 HydrophobicContact CB-CD1 3.74Å; A151-L157 HydrophobicContact CB-CG 3.85Å; G155-L157 VanDerWaalsContact C-N 3.28Å; G155-L157 PolarHBondContact O-N 3.01Å; L157-S159 VanDerWaalsContact C-N 3.33Å; L157-S159 PolarHBondContact O-N 3.42Å; L157-C160 VanDerWaalsContact CB-SG 3.5Å; L157-C160 VanDerWaalsContact O-O 3.06Å
158	N	92.1	Very high	95.7	Very high	147 Å²	147	60 Å²	60	79%	0.786	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.1	-22.9	-175.7	-60.9	-67.4	0	0	0	113.3	D86	D86-N158 PolarHBondContact OD2-N 2.86Å; D86-N158 VanDerWaalsContact OD2-N 3.17Å; D86-N158 PolarHBondContact OD2-ND2 3.4Å
159	S	93.9	Very high	95.5	Very high	55 Å²	55	70.4 Å²	70.4	39%	0.385	37%	0.374	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.7	-10.7	-174.8	59.6	0	0	0	0	113.9	H87 L157 Y186	H87-S159 PolarHBondContact CE1-OG 3.21Å; H87-S159 PolarHBondContact NE2-OG 3.02Å; H87-S159 VanDerWaalsContact NE2-OG 3.08Å; L157-S159 VanDerWaalsContact C-N 3.33Å; L157-S159 PolarHBondContact O-N 3.42Å; S159-Y186 WeakPolarHBondContact CB-OH 3.49Å; S159-Y186 VanDerWaalsContact OG-CZ 3.31Å; S159-Y186 PolarHBondContact OG-OH 2.89Å
160	C	96.8	Very high	95.2	Very high	24 Å²	24	77.2 Å²	77.2	16%	0.162	41%	0.41	C	S	.	.			trans	-146	172.9	-174.2	61.7	0	0	0	0	111.6	C152 L157 Y186	C152-C160 WeakPolarHBondContact CA-SG 3.12Å; C152-C160 HydrophobicContact CB-CB 3.86Å; C152-C160 WeakPolarHBondContact CB-SG 3.41Å; C152-C160 WeakPolarHBondContact SG-CB 3.42Å; C152-C160 CovalentContact SG-SG 2.03Å; C152-C160 PolarHBondContact SG-SG 3.27Å; L157-C160 VanDerWaalsContact CB-SG 3.5Å; L157-C160 VanDerWaalsContact O-O 3.06Å; C160-Y186 HydrophobicContact CB-CD1 3.85Å; C160-Y186 HydrophobicContact CB-CD2 3.74Å; C160-Y186 HydrophobicContact CB-CE1 4.04Å; C160-Y186 HydrophobicContact CB-CE2 3.95Å; C160-Y186 HydrophobicContact CB-CG 3.71Å
161	G	95.8	Very high	95	Very high	30 Å²	30	74.5 Å²	74.5	31%	0.309	40%	0.401	S	S	.	.			trans	-151.5	-155.8	173.6	0	0	0	0	0	109.9	C152 N183	C152-G161 CarbonylContact O-C 3.53Å; C152-G161 VanDerWaalsContact O-CA 3.3Å; C152-G161 WeakPolarHBondContact O-CA 3.25Å; G161-N183 WeakPolarHBondContact O-CB 2.98Å; G161-N183 PolarHBondContact O-ND2 3.19Å
162	C	95.6	Very high	94.7	Very high	57 Å²	57	79.4 Å²	79.4	39%	0.385	42%	0.424	S	S	.	.	S	Bend	trans	-52.1	152.4	178.4	-52.2	0	0	0	0	113.6	R164 C180	C162-R164 PolarHBondContact O-N 3.45Å; C162-C180 HydrophobicContact CB-CB 3.95Å; C162-C180 WeakPolarHBondContact CB-SG 3.49Å; C162-C180 WeakPolarHBondContact SG-CB 3.45Å; C162-C180 CovalentContact SG-SG 2.03Å; C162-C180 PolarHBondContact SG-SG 3.2Å
163	S	95.1	Very high	94.3	Very high	28 Å²	28	90.8 Å²	90.8	20%	0.196	47%	0.467	C	S	.	.			trans	-53.3	134.8	173.7	-164.5	0	0	0	0	112.6	A165 G181 D182	S163-A165 WeakPolarHBondContact OG-CB 3.18Å; S163-A165 PolarHBondContact OG-N 3.26Å; S163-G181 WeakPolarHBondContact CB-O 3.45Å; S163-G181 PolarHBondContact N-O 3.45Å; S163-D182 VanDerWaalsContact CB-O 3.22Å; S163-D182 WeakPolarHBondContact CB-O 3.48Å; S163-D182 PolarHBondContact OG-O 2.94Å
164	R	92.2	Very high	94	Very high	242 Å²	242	92.5 Å²	92.5	91%	0.913	48%	0.482	S	S	*	.			trans	-101.2	24	169.1	-59.5	-176.2	-177.1	173.5	0.9	111.8	C162 A166	C162-R164 PolarHBondContact O-N 3.45Å; R164-A166 PolarHBondContact O-N 3.44Å
165	A	93.4	Very high	93.9	Very high	34 Å²	34	90.2 Å²	90.2	28%	0.281	47%	0.469	S	S	.	.	P	Polyproline II helix	trans	-59.6	135.7	179.7	0	0	0	0	0	110.7	S163 W177 L252	S163-A165 WeakPolarHBondContact OG-CB 3.18Å; S163-A165 PolarHBondContact OG-N 3.26Å; A165-W177 HydrophobicContact CB-CZ2 4.17Å; A165-W177 PolarHBondContact O-NE1 3Å; A165-L252 HydrophobicContact CB-CB 4.21Å; A165-L252 HydrophobicContact CB-CD2 3.84Å
166	A	93.9	Very high	93.8	Very high	87 Å²	87	91.6 Å²	91.6	72%	0.719	46%	0.462	S	S	*	.	P	Polyproline II helix	trans	-66.4	151	174.9	0	0	0	0	0	110.3	R164 P168	R164-A166 PolarHBondContact O-N 3.44Å; A166-P168 WeakPolarHBondContact O-CD 3.47Å
167	R	94.4	Very high	93.8	Very high	92 Å²	92	89.4 Å²	89.4	35%	0.347	45%	0.449	S	S	.	.	P	Polyproline II helix	trans	-57	126.8	173.4	179.9	-175.4	175.5	110.3	8.4	110.1	L171 Q172 W175 W177	R167-L171 HydrophobicContact CG-CD2 4.11Å; R167-L171 PolarHBondContact NH2-O 3.28Å; R167-Q172 PolarHBondContact NH2-O 3.28Å; R167-W175 PolarHBondContact NH1-O 3.39Å; R167-W175 PolarHBondContact NH2-O 3.03Å; R167-W177 HydrophobicContact CB-CB 4Å; R167-W177 HydrophobicContact CB-CD2 4.19Å; R167-W177 HydrophobicContact CB-CG 3.72Å; R167-W177 HydrophobicContact CG-CB 3.86Å; R167-W177 HydrophobicContact CG-CD2 4.39Å; R167-W177 HydrophobicContact CG-CG 4Å
168	P	94.7	Very high	93.5	Very high	33 Å²	33	90.6 Å²	90.6	21%	0.214	46%	0.462	C	S	.	.	P	Polyproline II helix	trans	-61.1	140.8	173.5	-24.8	36.4	0	0	0	111.9	A166 D170 L171 W177 V234	A166-P168 WeakPolarHBondContact O-CD 3.47Å; P168-D170 VanDerWaalsContact C-N 3.26Å; P168-D170 WeakPolarHBondContact CB-OD1 3.42Å; P168-D170 PolarHBondContact O-N 3.29Å; P168-L171 HydrophobicContact CB-CB 4.37Å; P168-L171 WeakPolarHBondContact O-CB 3.47Å; P168-L171 PolarHBondContact O-N 3.1Å; P168-W177 HydrophobicContact CG-CH2 4.12Å; P168-W177 HydrophobicContact CG-CZ3 4.13Å; P168-V234 HydrophobicContact CB-CG2 4.48Å; P168-V234 HydrophobicContact CG-CG2 3.68Å
169	K	93.3	Very high	93.5	Very high	219 Å²	219	86.6 Å²	86.6	95%	0.952	46%	0.456	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.3	-29.1	-174.7	-68.1	-176.5	178.9	-179.7	0	112.8	L171	K169-L171 VanDerWaalsContact C-N 3.34Å
170	D	93.7	Very high	93.5	Very high	143 Å²	143	86.2 Å²	86.2	77%	0.765	45%	0.452	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.9	-7.5	179.7	58.2	-43.9	0	0	0	113.3	P168 Q172	P168-D170 VanDerWaalsContact C-N 3.26Å; P168-D170 WeakPolarHBondContact CB-OD1 3.42Å; P168-D170 PolarHBondContact O-N 3.29Å; D170-Q172 PolarHBondContact O-N 3.35Å
171	L	93.3	Very high	93.5	Very high	16 Å²	16	85.1 Å²	85.1	8%	0.084	45%	0.445	C	S	.	.	S	Bend	trans	-71.3	123.9	178.5	-169.9	66.8	0	0	0	111.7	R167 P168 K169 R173 W175 W177 V234 C250	R167-L171 HydrophobicContact CG-CD2 4.11Å; R167-L171 PolarHBondContact NH2-O 3.28Å; P168-L171 HydrophobicContact CB-CB 4.37Å; P168-L171 WeakPolarHBondContact O-CB 3.47Å; P168-L171 PolarHBondContact O-N 3.1Å; K169-L171 VanDerWaalsContact C-N 3.34Å; L171-R173 PolarHBondContact O-N 3.1Å; L171-W175 HydrophobicContact CD1-CD2 4.44Å; L171-W175 HydrophobicContact CD1-CE3 3.53Å; L171-W175 HydrophobicContact CD1-CZ3 4.06Å; L171-W175 HydrophobicContact CG-CB 4.43Å; L171-W175 HydrophobicContact CG-CE3 4.47Å; L171-W177 HydrophobicContact CD2-CB 4.42Å; L171-W177 HydrophobicContact CD2-CE3 3.69Å; L171-W177 HydrophobicContact CD2-CZ3 4.38Å; L171-V234 HydrophobicContact CD1-CG1 3.85Å; L171-C250 HydrophobicContact CD2-CB 4.31Å
172	Q	91.7	Very high	93.6	Very high	103 Å²	103	83.8 Å²	83.8	48%	0.481	43%	0.431	S	S	.	.			trans	-47.4	128.7	179.4	-58.8	-171.7	8.1	0	0	112	R167 D170 D174 W175	R167-Q172 PolarHBondContact NH2-O 3.28Å; D170-Q172 PolarHBondContact O-N 3.35Å; Q172-D174 VanDerWaalsContact CB-OD1 3.28Å; Q172-D174 WeakPolarHBondContact CB-OD1 3.48Å; Q172-D174 PolarHBondContact O-N 3.46Å; Q172-D174 VanDerWaalsContact O-N 3.16Å; Q172-W175 HydrophobicContact CB-CD2 3.99Å; Q172-W175 HydrophobicContact CB-CG 4.02Å; Q172-W175 HydrophobicContact CB-CZ2 4.46Å; Q172-W175 VanDerWaalsContact CD-CE2 3.47Å; Q172-W175 HydrophobicContact CG-CD2 4.36Å; Q172-W175 HydrophobicContact CG-CH2 4.41Å; Q172-W175 HydrophobicContact CG-CZ2 4.02Å; Q172-W175 WeakPolarHBondContact O-CB 3.31Å; Q172-W175 PolarHBondContact O-N 2.76Å; Q172-W175 VanDerWaalsContact OE1-CZ2 3.28Å
173	R	90.8	Very high	93.7	Very high	240 Å²	240	82.1 Å²	82.1	91%	0.906	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.4	-33.8	-166.8	-68.6	-174.5	-179.4	-170.8	1.1	113.7	L171 W175	L171-R173 PolarHBondContact O-N 3.1Å; R173-W175 VanDerWaalsContact C-N 3.32Å
174	D	90.6	Very high	93.8	Very high	114 Å²	114	81.6 Å²	81.6	61%	0.61	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.9	-18.9	178.4	58.4	-51.8	0	0	0	113.6	Q172	Q172-D174 VanDerWaalsContact CB-OD1 3.28Å; Q172-D174 WeakPolarHBondContact CB-OD1 3.48Å; Q172-D174 PolarHBondContact O-N 3.46Å; Q172-D174 VanDerWaalsContact O-N 3.16Å
175	W	93.4	Very high	94.1	Very high	58 Å²	58	74.7 Å²	74.7	22%	0.22	39%	0.394	C	S	.	.	S	Bend	trans	-80.8	129.7	176.1	-60.2	7.5	0	0	0	109.5	R167 L171 Q172 R173 K248 C250	R167-W175 PolarHBondContact NH1-O 3.39Å; R167-W175 PolarHBondContact NH2-O 3.03Å; L171-W175 HydrophobicContact CD1-CD2 4.44Å; L171-W175 HydrophobicContact CD1-CE3 3.53Å; L171-W175 HydrophobicContact CD1-CZ3 4.06Å; L171-W175 HydrophobicContact CG-CB 4.43Å; L171-W175 HydrophobicContact CG-CE3 4.47Å; Q172-W175 HydrophobicContact CB-CD2 3.99Å; Q172-W175 HydrophobicContact CB-CG 4.02Å; Q172-W175 HydrophobicContact CB-CZ2 4.46Å; Q172-W175 VanDerWaalsContact CD-CE2 3.47Å; Q172-W175 HydrophobicContact CG-CD2 4.36Å; Q172-W175 HydrophobicContact CG-CH2 4.41Å; Q172-W175 HydrophobicContact CG-CZ2 4.02Å; Q172-W175 WeakPolarHBondContact O-CB 3.31Å; Q172-W175 PolarHBondContact O-N 2.76Å; Q172-W175 VanDerWaalsContact OE1-CZ2 3.28Å; R173-W175 VanDerWaalsContact C-N 3.32Å; W175-K248 HydrophobicContact CD2-CD 3.75Å; W175-K248 HydrophobicContact CE3-CD 4.09Å; W175-K248 HydrophobicContact CG-CB 4.46Å; W175-K248 HydrophobicContact CG-CD 4.1Å; W175-K248 HydrophobicContact CG-CG 4.49Å; W175-K248 HydrophobicContact CZ2-CD 4.26Å; W175-C250 VanDerWaalsContact CE3-SG 3.58Å
176	L	93.6	Very high	94.3	Very high	86 Å²	86	75 Å²	75	45%	0.45	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	135	178	-60.9	-177.9	0	0	0	110	L247 K248 T249 C250	L176-L247 HydrophobicContact CD1-CD1 3.68Å; L176-L247 HydrophobicContact CD1-CG 4.31Å; L176-L247 HydrophobicContact CG-CD1 4.14Å; L176-K248 WeakPolarHBondContact CB-O 3.45Å; L176-K248 PolarHBondContact N-O 2.81Å; L176-T249 CarbonylContact O-C 3.49Å; L176-T249 WeakPolarHBondContact O-CA 3.49Å; L176-C250 PolarHBondContact O-N 3.36Å
177	W	96.1	Very high	94.5	Very high	67 Å²	67	70.9 Å²	70.9	25%	0.254	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	117.6	170	-177.5	-105.8	0	0	0	108.9	A165 R167 P168 L171 V234 C250 L252	A165-W177 HydrophobicContact CB-CZ2 4.17Å; A165-W177 PolarHBondContact O-NE1 3Å; R167-W177 HydrophobicContact CB-CB 4Å; R167-W177 HydrophobicContact CB-CD2 4.19Å; R167-W177 HydrophobicContact CB-CG 3.72Å; R167-W177 HydrophobicContact CG-CB 3.86Å; R167-W177 HydrophobicContact CG-CD2 4.39Å; R167-W177 HydrophobicContact CG-CG 4Å; P168-W177 HydrophobicContact CG-CH2 4.12Å; P168-W177 HydrophobicContact CG-CZ3 4.13Å; L171-W177 HydrophobicContact CD2-CB 4.42Å; L171-W177 HydrophobicContact CD2-CE3 3.69Å; L171-W177 HydrophobicContact CD2-CZ3 4.38Å; W177-V234 HydrophobicContact CZ3-CG1 4.04Å; W177-V234 HydrophobicContact CZ3-CG2 4.03Å; W177-C250 WeakPolarHBondContact CA-O 3.34Å; W177-C250 HydrophobicContact CE3-CB 4.25Å; W177-L252 HydrophobicContact CH2-CB 4.01Å; W177-L252 VanDerWaalsContact CH2-N 3.28Å; W177-L252 HydrophobicContact CZ2-CB 4.38Å
178	G	90.2	Very high	94.7	Very high	27 Å²	27	68.3 Å²	68.3	28%	0.278	35%	0.345	S	S	.	.			trans	169.6	-168.1	-175.4	0	0	0	0	0	112.9	C250 W251	G178-C250 PolarHBondContact N-O 3.38Å; G178-C250 CarbonylContact O-C 3.57Å; G178-W251 WeakPolarHBondContact O-CB 3.32Å
179	G	90.5	Very high	94.9	Very high	64 Å²	64	74 Å²	74	66%	0.66	36%	0.362	S	S	*	.	S	Bend	trans	83.5	-169.3	-169.3	0	0	0	0	0	112.2
180	C	94.7	Very high	95.1	Very high	46 Å²	46	64 Å²	64	31%	0.311	32%	0.319	S	S	.	.			trans	-108.4	99.3	-178.4	-168.8	0	0	0	0	110.1	R153 C162	R153-C180 WeakPolarHBondContact CD-O 3.21Å; R153-C180 HydrophobicContact CG-CB 4.37Å; R153-C180 VanDerWaalsContact CG-O 3.3Å; R153-C180 WeakPolarHBondContact CG-O 3.34Å; R153-C180 PolarHBondContact O-SG 3.03Å; C162-C180 HydrophobicContact CB-CB 3.95Å; C162-C180 WeakPolarHBondContact CB-SG 3.49Å; C162-C180 WeakPolarHBondContact SG-CB 3.45Å; C162-C180 CovalentContact SG-SG 2.03Å; C162-C180 PolarHBondContact SG-SG 3.2Å
181	G	96.2	Very high	95.3	Very high	2 Å²	2	57.1 Å²	57.1	2%	0.021	28%	0.282	C	S	.	.			trans	-90.6	167.2	175.5	0	0	0	0	0	113.5	S163 L252	S163-G181 WeakPolarHBondContact CB-O 3.45Å; S163-G181 PolarHBondContact N-O 3.45Å; G181-L252 CarbonylContact C-O 3.05Å; G181-L252 WeakPolarHBondContact CA-O 3.25Å
182	D	98.1	Very high	95.5	Very high	2 Å²	2	62.3 Å²	62.3	1%	0.011	30%	0.301	C	S	.	.			trans	-65.9	130.8	178.8	-66.4	-40.5	0	0	0	111.4	R150 R153 S163 L184 L252 L254	R150-D182 WeakPolarHBondContact CG-OD1 3.42Å; R153-D182 WeakPolarHBondContact CD-OD1 3.3Å; R153-D182 IonicContact CZ-OD1 2.72Å; R153-D182 IonicContact NE-OD1 2.86Å; R153-D182 PolarHBondContact NE-OD1 2.89Å; S163-D182 VanDerWaalsContact CB-O 3.22Å; S163-D182 WeakPolarHBondContact CB-O 3.48Å; S163-D182 PolarHBondContact OG-O 2.94Å; D182-L184 VanDerWaalsContact C-N 3.25Å; D182-L184 PolarHBondContact O-N 3.42Å; D182-L252 PolarHBondContact N-O 3.47Å; D182-L254 HydrophobicContact CB-CD1 4.33Å; D182-L254 HydrophobicContact CB-CD2 4.43Å; D182-L254 HydrophobicContact CB-CG 3.72Å; D182-L254 PolarHBondContact OD2-N 2.58Å
183	N	98.1	Very high	95.8	Very high	22 Å²	22	61.9 Å²	61.9	12%	0.118	30%	0.298	C	S	.	.			trans	-83	72	-177.4	-162.3	-23.3	0	0	0	111.4	S149 C152 G161 N185 Y186 G187	S149-N183 WeakPolarHBondContact CB-O 2.91Å; S149-N183 PolarHBondContact O-N 2.66Å; S149-N183 VanDerWaalsContact O-N 3.11Å; S149-N183 PolarHBondContact OG-O 2.99Å; C152-N183 HydrophobicContact CB-CB 3.66Å; G161-N183 WeakPolarHBondContact O-CB 2.98Å; G161-N183 PolarHBondContact O-ND2 3.19Å; N183-N185 VanDerWaalsContact C-N 3.34Å; N183-N185 PolarHBondContact O-N 3.44Å; N183-Y186 PolarHBondContact O-N 3.49Å; N183-Y186 WeakPolarHBondContact OD1-CB 3.38Å; N183-Y186 PolarHBondContact OD1-N 3.41Å; N183-G187 PolarHBondContact O-N 3.22Å; N183-G187 VanDerWaalsContact O-N 3.12Å
184	L	97.8	Very high	96	Very high	17 Å²	17	50.5 Å²	50.5	9%	0.089	26%	0.256	C	S	.	.	H	α-helix	trans	-56.1	-44.3	-177.9	174.2	59.4	0	0	0	112.5	V145 S149 D182 Y186 G187 Y188 V228 A232 L252 L254	V145-L184 HydrophobicContact CG1-CD1 3.77Å; S149-L184 VanDerWaalsContact OG-CA 3.31Å; S149-L184 WeakPolarHBondContact OG-CA 3.25Å; D182-L184 VanDerWaalsContact C-N 3.25Å; D182-L184 PolarHBondContact O-N 3.42Å; L184-Y186 VanDerWaalsContact C-N 3.34Å; L184-Y186 PolarHBondContact O-N 3.1Å; L184-G187 PolarHBondContact O-N 3.44Å; L184-Y188 WeakPolarHBondContact O-CB 3.28Å; L184-Y188 PolarHBondContact O-N 3.16Å; L184-V228 HydrophobicContact CD1-CG1 4.19Å; L184-A232 HydrophobicContact CD2-CB 3.88Å; L184-L252 HydrophobicContact CB-CD2 4.21Å; L184-L252 HydrophobicContact CD2-CD2 4.37Å; L184-L254 HydrophobicContact CB-CD2 4.21Å; L184-L254 HydrophobicContact CD1-CD2 3.9Å; L184-L254 HydrophobicContact CG-CD2 4.42Å
185	N	97.8	Very high	96.1	Very high	96 Å²	96	45.5 Å²	45.5	51%	0.513	23%	0.229	S	C	.	.	H	α-helix	trans	-63.8	-39.1	-178.4	176.9	57.5	0	0	0	112.2	N183 R189	N183-N185 VanDerWaalsContact C-N 3.34Å; N183-N185 PolarHBondContact O-N 3.44Å; N185-R189 VanDerWaalsContact O-CG 3.29Å; N185-R189 WeakPolarHBondContact O-CG 3.32Å; N185-R189 PolarHBondContact O-N 3.04Å; N185-R189 PolarHBondContact OD1-NE 3.49Å; N185-R189 VanDerWaalsContact OD1-NE 3.14Å
186	Y	98.3	Very high	96.1	Very high	41 Å²	41	42.9 Å²	42.9	16%	0.161	22%	0.22	C	C	.	.	H	α-helix	trans	-65.1	-54.3	175.4	-174.4	-90.1	0	0	0	111.3	H87 V148 C152 S159 C160 N183 L184 Y188 R189 F190	H87-Y186 AromaticContact NE2-CE1 3.5Å; H87-Y186 AromaticContact NE2-CZ 3.59Å; H87-Y186 PolarHBondContact NE2-OH 2.61Å; V148-Y186 HydrophobicContact CG1-CD1 3.86Å; V148-Y186 HydrophobicContact CG1-CE1 3.84Å; C152-Y186 WeakPolarHBondContact SG-CD1 3.36Å; S159-Y186 WeakPolarHBondContact CB-OH 3.49Å; S159-Y186 VanDerWaalsContact OG-CZ 3.31Å; S159-Y186 PolarHBondContact OG-OH 2.89Å; C160-Y186 HydrophobicContact CB-CD1 3.85Å; C160-Y186 HydrophobicContact CB-CD2 3.74Å; C160-Y186 HydrophobicContact CB-CE1 4.04Å; C160-Y186 HydrophobicContact CB-CE2 3.95Å; C160-Y186 HydrophobicContact CB-CG 3.71Å; N183-Y186 PolarHBondContact O-N 3.49Å; N183-Y186 WeakPolarHBondContact OD1-CB 3.38Å; N183-Y186 PolarHBondContact OD1-N 3.41Å; L184-Y186 VanDerWaalsContact C-N 3.34Å; L184-Y186 PolarHBondContact O-N 3.1Å; Y186-Y188 VanDerWaalsContact C-N 3.29Å; Y186-Y188 PolarHBondContact O-N 3.41Å; Y186-R189 PolarHBondContact O-N 3.34Å; Y186-R189 VanDerWaalsContact O-N 3.16Å; Y186-F190 HydrophobicContact CE1-CB 4.3Å; Y186-F190 HydrophobicContact CE1-CD2 4.49Å; Y186-F190 WeakPolarHBondContact O-CB 3.25Å; Y186-F190 PolarHBondContact O-N 2.84Å
187	G	98.3	Very high	96.1	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-60.3	-36.8	-179.5	0	0	0	0	0	113.3	S149 N183 L184 S191	S149-G187 WeakPolarHBondContact OG-CA 3.41Å; N183-G187 PolarHBondContact O-N 3.22Å; N183-G187 VanDerWaalsContact O-N 3.12Å; L184-G187 PolarHBondContact O-N 3.44Å; G187-S191 VanDerWaalsContact O-CB 3.26Å; G187-S191 WeakPolarHBondContact O-CB 3.49Å; G187-S191 PolarHBondContact O-N 3.39Å
188	Y	98.6	Very high	95.8	Very high	38 Å²	38	38 Å²	38	15%	0.149	20%	0.198	C	C	.	.	H	α-helix	trans	-59.8	-50.7	174	-164.5	-67.9	0	0	0	111.9	L184 Y186 R192 E222 R225 R226	L184-Y188 WeakPolarHBondContact O-CB 3.28Å; L184-Y188 PolarHBondContact O-N 3.16Å; Y186-Y188 VanDerWaalsContact C-N 3.29Å; Y186-Y188 PolarHBondContact O-N 3.41Å; Y188-R192 WeakPolarHBondContact O-CB 3.25Å; Y188-R192 PolarHBondContact O-N 2.81Å; Y188-E222 PolarHBondContact OH-OE1 2.95Å; Y188-E222 PolarHBondContact OH-OE2 2.79Å; Y188-R225 HydrophobicContact CD2-CB 3.91Å; Y188-R225 HydrophobicContact CE1-CB 4.16Å; Y188-R225 HydrophobicContact CE2-CB 3.52Å; Y188-R225 HydrophobicContact CG-CB 4.4Å; Y188-R226 HydrophobicContact CE2-CG 4.46Å; Y188-R226 WeakPolarHBondContact OH-CG 3.3Å
189	R	98.3	Very high	95.7	Very high	154 Å²	154	37.1 Å²	37.1	58%	0.581	19%	0.186	S	C	*	.	H	α-helix	trans	-64.3	-46.3	-179.9	-72	175.2	-178	-148.9	-3.1	111	N185 Y186 R192 E193	N185-R189 VanDerWaalsContact O-CG 3.29Å; N185-R189 WeakPolarHBondContact O-CG 3.32Å; N185-R189 PolarHBondContact O-N 3.04Å; N185-R189 PolarHBondContact OD1-NE 3.49Å; N185-R189 VanDerWaalsContact OD1-NE 3.14Å; Y186-R189 PolarHBondContact O-N 3.34Å; Y186-R189 VanDerWaalsContact O-N 3.16Å; R189-R192 WeakPolarHBondContact O-CB 3.28Å; R189-R192 PolarHBondContact O-N 2.87Å; R189-E193 PolarHBondContact O-N 3.37Å
190	F	98	Very high	95.7	Very high	7 Å²	7	40 Å²	40	3%	0.031	18%	0.177	C	C	.	.	H	α-helix	trans	-60.9	-47.8	179.1	-173.5	-88.5	0	0	0	111.8	Y84 H87 I91 V144 V148 Y186 R192 E193 F194	Y84-F190 HydrophobicContact CD1-CE2 4.38Å; Y84-F190 AromaticContact CD2-CE2 3.77Å; Y84-F190 HydrophobicContact CD2-CE2 3.77Å; Y84-F190 HydrophobicContact CE2-CE2 4.33Å; Y84-F190 AromaticContact CG-CE2 3.78Å; Y84-F190 HydrophobicContact CG-CE2 3.78Å; H87-F190 HydrophobicContact CB-CE1 4.23Å; H87-F190 HydrophobicContact CB-CE2 4.14Å; H87-F190 HydrophobicContact CB-CZ 3.63Å; H87-F190 AromaticContact CD2-CD2 3.72Å; H87-F190 AromaticContact CD2-CE2 3.42Å; H87-F190 VanDerWaalsContact CD2-CE2 3.42Å; H87-F190 WeakPolarHBondContact CD2-CE2 3.41Å; H87-F190 AromaticContact CD2-CZ 3.68Å; H87-F190 AromaticContact CG-CE2 3.84Å; H87-F190 AromaticContact CG-CZ 3.85Å; I91-F190 HydrophobicContact CD1-CE1 3.5Å; I91-F190 VanDerWaalsContact CD1-CE1 3.5Å; I91-F190 HydrophobicContact CD1-CZ 3.64Å; I91-F190 HydrophobicContact CG1-CE1 3.72Å; I91-F190 HydrophobicContact CG1-CZ 4.32Å; V144-F190 HydrophobicContact CG1-CD1 4.23Å; V148-F190 HydrophobicContact CG1-CB 4.32Å; V148-F190 HydrophobicContact CG1-CD1 4.25Å; V148-F190 HydrophobicContact CG1-CG 4.31Å; V148-F190 HydrophobicContact CG2-CD1 3.99Å; V148-F190 HydrophobicContact CG2-CE1 4.3Å; Y186-F190 HydrophobicContact CE1-CB 4.3Å; Y186-F190 HydrophobicContact CE1-CD2 4.49Å; Y186-F190 WeakPolarHBondContact O-CB 3.25Å; Y186-F190 PolarHBondContact O-N 2.84Å; F190-R192 VanDerWaalsContact C-N 3.28Å; F190-R192 PolarHBondContact O-N 3.38Å; F190-E193 PolarHBondContact O-N 3.46Å; F190-E193 VanDerWaalsContact O-N 3.09Å; F190-F194 HydrophobicContact CD1-CB 4.41Å; F190-F194 HydrophobicContact CE1-CB 3.97Å; F190-F194 HydrophobicContact CE1-CG 4.3Å; F190-F194 HydrophobicContact CZ-CB 4.31Å; F190-F194 HydrophobicContact CZ-CD2 4.48Å; F190-F194 WeakPolarHBondContact O-CB 2.95Å; F190-F194 PolarHBondContact O-N 2.88Å
191	S	97.8	Very high	95.4	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-57.3	-42	175	174.4	0	0	0	0	111.6	A141 V145 G187 E193 V195	A141-S191 PolarHBondContact O-OG 2.52Å; V145-S191 VanDerWaalsContact CG2-CB 3.46Å; G187-S191 VanDerWaalsContact O-CB 3.26Å; G187-S191 WeakPolarHBondContact O-CB 3.49Å; G187-S191 PolarHBondContact O-N 3.39Å; S191-E193 PolarHBondContact O-N 3.06Å; S191-V195 WeakPolarHBondContact O-CB 3.33Å; S191-V195 WeakPolarHBondContact O-CG2 3.43Å; S191-V195 PolarHBondContact O-N 3.07Å
192	R	97.8	Very high	94.8	Very high	125 Å²	125	46.2 Å²	46.2	47%	0.472	20%	0.2	S	C	.	.	H	α-helix	trans	-63.6	-36.7	175.3	177.1	178.3	157	167.2	-0.2	113.2	Y188 R189 F190 D196	Y188-R192 WeakPolarHBondContact O-CB 3.25Å; Y188-R192 PolarHBondContact O-N 2.81Å; R189-R192 WeakPolarHBondContact O-CB 3.28Å; R189-R192 PolarHBondContact O-N 2.87Å; F190-R192 VanDerWaalsContact C-N 3.28Å; F190-R192 PolarHBondContact O-N 3.38Å; R192-D196 WeakPolarHBondContact O-CB 3.48Å
193	E	96.2	Very high	94.4	Very high	93 Å²	93	51.7 Å²	51.7	44%	0.435	24%	0.238	S	C	.	.	H	α-helix	trans	-74.5	-47.7	177.9	-72.4	176.6	-170.7	0	0	111.4	L80 R189 F190 S191 A197	L80-E193 HydrophobicContact CD1-CB 4.38Å; L80-E193 WeakPolarHBondContact CD1-O 3.42Å; R189-E193 PolarHBondContact O-N 3.37Å; F190-E193 PolarHBondContact O-N 3.46Å; F190-E193 VanDerWaalsContact O-N 3.09Å; S191-E193 PolarHBondContact O-N 3.06Å; E193-A197 VanDerWaalsContact O-CB 3.31Å; E193-A197 WeakPolarHBondContact O-CB 3.14Å; E193-A197 PolarHBondContact O-N 2.99Å
194	F	94.8	Very high	94.1	Very high	1 Å²	1	53 Å²	53	0%	0.004	24%	0.242	C	C	.	.	H	α-helix	trans	-79.7	-47.4	-172.9	-173.1	-90.2	0	0	0	114	W45 L73 Q77 L80 M88 I91 F190	W45-F194 HydrophobicContact CB-CE1 4.26Å; W45-F194 HydrophobicContact CB-CZ 4.46Å; W45-F194 HydrophobicContact CD2-CD1 4.46Å; W45-F194 AromaticContact CD2-CE1 3.72Å; W45-F194 HydrophobicContact CD2-CE1 3.72Å; W45-F194 HydrophobicContact CE3-CD1 4.5Å; W45-F194 AromaticContact CE3-CE1 3.66Å; W45-F194 HydrophobicContact CE3-CE1 3.66Å; W45-F194 HydrophobicContact CG-CE1 4.04Å; W45-F194 HydrophobicContact CZ3-CE1 4.27Å; L73-F194 HydrophobicContact CD2-CZ 3.92Å; Q77-F194 HydrophobicContact CB-CE2 4.08Å; Q77-F194 HydrophobicContact CB-CZ 4.27Å; Q77-F194 HydrophobicContact CG-CE2 4.29Å; Q77-F194 HydrophobicContact CG-CZ 4.33Å; Q77-F194 WeakPolarHBondContact CG-O 3.46Å; Q77-F194 PolarHBondContact NE2-O 3.28Å; L80-F194 HydrophobicContact CB-CD2 4.01Å; L80-F194 HydrophobicContact CD1-CB 4.23Å; L80-F194 HydrophobicContact CD1-CD2 4.15Å; M88-F194 HydrophobicContact CE-CE2 4.27Å; M88-F194 HydrophobicContact CE-CZ 4.03Å; M88-F194 HydrophobicContact SD-CE2 4.14Å; M88-F194 HydrophobicContact SD-CZ 4.44Å; I91-F194 HydrophobicContact CD1-CD1 4.1Å; I91-F194 HydrophobicContact CD1-CD2 3.96Å; I91-F194 HydrophobicContact CD1-CE1 4.02Å; I91-F194 HydrophobicContact CD1-CE2 3.87Å; I91-F194 HydrophobicContact CD1-CG 4.07Å; I91-F194 HydrophobicContact CD1-CZ 3.9Å; I91-F194 HydrophobicContact CG2-CD1 4.08Å; I91-F194 HydrophobicContact CG2-CE1 3.5Å; I91-F194 HydrophobicContact CG2-CZ 3.99Å; F190-F194 HydrophobicContact CD1-CB 4.41Å; F190-F194 HydrophobicContact CE1-CB 3.97Å; F190-F194 HydrophobicContact CE1-CG 4.3Å; F190-F194 HydrophobicContact CZ-CB 4.31Å; F190-F194 HydrophobicContact CZ-CD2 4.48Å; F190-F194 WeakPolarHBondContact O-CB 2.95Å; F190-F194 PolarHBondContact O-N 2.88Å
195	V	93.5	Very high	93.8	Very high	9 Å²	9	56.8 Å²	56.8	6%	0.055	27%	0.267	C	S	.	.	H	α-helix	trans	-72.6	-38.1	-175.8	-176.3	0	0	0	0	110.8	W45 A141 V144 S191	W45-V195 HydrophobicContact CH2-CG2 4.29Å; W45-V195 HydrophobicContact CZ2-CB 4.39Å; W45-V195 HydrophobicContact CZ2-CG1 4.06Å; W45-V195 HydrophobicContact CZ2-CG2 3.73Å; A141-V195 HydrophobicContact CB-CG1 4.35Å; V144-V195 HydrophobicContact CB-CG2 4.24Å; V144-V195 HydrophobicContact CG1-CG2 4.44Å; V144-V195 HydrophobicContact CG2-CG2 3.89Å; S191-V195 WeakPolarHBondContact O-CB 3.33Å; S191-V195 WeakPolarHBondContact O-CG2 3.43Å; S191-V195 PolarHBondContact O-N 3.07Å
196	D	94.4	Very high	93.4	Very high	4 Å²	4	61.1 Å²	61.1	2%	0.021	28%	0.282	C	S	.	.	H	α-helix	trans	-81.9	-14.1	-179.6	-58	-2.1	0	0	0	113.2	R192 R198 E199 R200 L218 N221 R225	R192-D196 WeakPolarHBondContact O-CB 3.48Å; D196-R198 VanDerWaalsContact C-N 3.29Å; D196-R198 PolarHBondContact O-N 3.15Å; D196-E199 PolarHBondContact O-N 3.23Å; D196-R200 WeakPolarHBondContact O-CG 3.46Å; D196-R200 PolarHBondContact O-N 3.03Å; D196-R200 IonicContact OD2-CZ 3.76Å; D196-R200 IonicContact OD2-NE 3.16Å; D196-R200 IonicContact OD2-NH2 2.87Å; D196-R200 PolarHBondContact OD2-NH2 2.68Å; D196-L218 HydrophobicContact CB-CD2 3.63Å; D196-N221 PolarHBondContact OD1-ND2 2.93Å; D196-R225 IonicContact OD1-CZ 2.76Å; D196-R225 IonicContact OD1-NH1 2.82Å; D196-R225 PolarHBondContact OD1-NH1 2.91Å; D196-R225 IonicContact OD1-NH2 3.75Å; D196-R225 PolarHBondContact OD1-NH2 3.48Å; D196-R225 VanDerWaalsContact OD1-NH2 3.16Å; D196-R225 IonicContact OD2-CZ 3.52Å; D196-R225 IonicContact OD2-NH1 3.95Å; D196-R225 IonicContact OD2-NH2 3.49Å; D196-R225 PolarHBondContact OD2-NH2 3.49Å
197	A	93.3	Very high	93	Very high	13 Å²	13	61.5 Å²	61.5	11%	0.107	30%	0.298	C	S	.	.	H	α-helix	trans	-49.4	-49.8	-175.4	0	0	0	0	0	112.2	Q77 L80 E193 E199 R200 E201	Q77-A197 HydrophobicContact CG-CB 3.8Å; L80-A197 HydrophobicContact CD1-CB 4.25Å; E193-A197 VanDerWaalsContact O-CB 3.31Å; E193-A197 WeakPolarHBondContact O-CB 3.14Å; E193-A197 PolarHBondContact O-N 2.99Å; A197-E199 PolarHBondContact O-N 3.39Å; A197-R200 PolarHBondContact O-N 3.41Å; A197-E201 VanDerWaalsContact O-CG 3.29Å; A197-E201 WeakPolarHBondContact O-CG 3.38Å; A197-E201 PolarHBondContact O-N 3.33Å
198	R	88.6	Confident	92.8	Very high	36 Å²	36	63 Å²	63	14%	0.136	31%	0.308	C	S	.	.	H	α-helix	trans	-58.5	-42.9	178.9	171.8	176.8	-73.5	-150.7	-16.2	113.7	N43 G72 D196 R200	N43-R198 PolarHBondContact O-NH1 3.26Å; N43-R198 PolarHBondContact O-NH2 2.88Å; G72-R198 PolarHBondContact O-NH2 2.89Å; D196-R198 VanDerWaalsContact C-N 3.29Å; D196-R198 PolarHBondContact O-N 3.15Å; R198-R200 VanDerWaalsContact C-N 3.31Å
199	E	89.1	Confident	92.5	Very high	9 Å²	9	65.7 Å²	65.7	4%	0.042	32%	0.319	C	S	.	.	H	α-helix	trans	-70.1	-34	-178.7	-60	-62.7	149.6	0	0	110.1	Y137 D196 A197 L214 N217 L218	Y137-E199 PolarHBondContact OH-OE1 3.06Å; D196-E199 PolarHBondContact O-N 3.23Å; A197-E199 PolarHBondContact O-N 3.39Å; E199-L214 WeakPolarHBondContact O-CD1 3.44Å; E199-N217 VanDerWaalsContact CD-ND2 3.28Å; E199-N217 HydrophobicContact CG-CB 4.14Å; E199-N217 PolarHBondContact OE1-ND2 3.31Å; E199-N217 PolarHBondContact OE2-ND2 3.45Å; E199-L218 HydrophobicContact CB-CD2 3.92Å; E199-L218 HydrophobicContact CB-CG 4.29Å
200	R	90.7	Very high	92.2	Very high	125 Å²	125	61 Å²	61	47%	0.472	31%	0.305	S	S	.	.	H	α-helix	trans	-79.9	-22.7	179.5	-65.3	-178.2	-170.9	173.1	13.9	114.5	D196 A197 R198 K202 L218	D196-R200 WeakPolarHBondContact O-CG 3.46Å; D196-R200 PolarHBondContact O-N 3.03Å; D196-R200 IonicContact OD2-CZ 3.76Å; D196-R200 IonicContact OD2-NE 3.16Å; D196-R200 IonicContact OD2-NH2 2.87Å; D196-R200 PolarHBondContact OD2-NH2 2.68Å; A197-R200 PolarHBondContact O-N 3.41Å; R198-R200 VanDerWaalsContact C-N 3.31Å; R200-K202 VanDerWaalsContact C-N 3.25Å; R200-K202 PolarHBondContact O-N 2.67Å; R200-L218 HydrophobicContact CG-CD2 4.45Å
201	E	88.5	Confident	92.1	Very high	82 Å²	82	61.3 Å²	61.3	38%	0.383	31%	0.308	S	S	.	.	H	α-helix	trans	-67.4	-26.8	176.4	-79.9	166.3	-128.2	0	0	112.9	S74 Q75 G76 A197	S74-E201 VanDerWaalsContact CB-OE1 3.31Å; S74-E201 WeakPolarHBondContact CB-OE1 3.29Å; S74-E201 VanDerWaalsContact CB-OE2 3.31Å; S74-E201 WeakPolarHBondContact CB-OE2 3.48Å; S74-E201 PolarHBondContact OG-OE1 3.12Å; S74-E201 PolarHBondContact OG-OE2 3.17Å; Q75-E201 PolarHBondContact N-OE2 3.48Å; G76-E201 WeakPolarHBondContact CA-OE1 3.14Å; G76-E201 PolarHBondContact N-OE1 2.92Å; G76-E201 PolarHBondContact N-OE2 3.09Å; A197-E201 VanDerWaalsContact O-CG 3.29Å; A197-E201 WeakPolarHBondContact O-CG 3.38Å; A197-E201 PolarHBondContact O-N 3.33Å
202	K	84.1	Confident	91.9	Very high	96 Å²	96	61.6 Å²	61.6	42%	0.417	31%	0.311	S	S	.	.			trans	-97.3	130.3	-177.9	-60.3	-164.6	-177.8	-172.1	0	110.3	R200 Y204 L214	R200-K202 VanDerWaalsContact C-N 3.25Å; R200-K202 PolarHBondContact O-N 2.67Å; K202-Y204 HydrophobicContact CB-CD2 4.35Å; K202-Y204 HydrophobicContact CB-CE2 3.58Å; K202-Y204 HydrophobicContact CD-CE2 4.27Å; K202-Y204 WeakPolarHBondContact CD-OH 3.43Å; K202-L214 WeakPolarHBondContact O-CD1 3.4Å
203	S	88.9	Confident	91.7	Very high	117 Å²	117	56.1 Å²	56.1	82%	0.818	29%	0.29	S	S	*	.			trans	-104.7	130.8	170.8	-173.2	0	0	0	0	109.2
204	Y	90.6	Very high	91.6	Very high	50 Å²	50	53.1 Å²	53.1	20%	0.196	28%	0.277	C	S	.	.			trans	-119.8	145.4	-179.9	-70.1	-68.8	0	0	0	110.6	R124 K202 K206 D210 L214	R124-Y204 PolarHBondContact NH1-OH 3.49Å; R124-Y204 PolarHBondContact NH2-OH 2.89Å; K202-Y204 HydrophobicContact CB-CD2 4.35Å; K202-Y204 HydrophobicContact CB-CE2 3.58Å; K202-Y204 HydrophobicContact CD-CE2 4.27Å; K202-Y204 WeakPolarHBondContact CD-OH 3.43Å; Y204-K206 PolarHBondContact O-N 3.45Å; Y204-D210 HydrophobicContact CD1-CB 3.24Å; Y204-D210 HydrophobicContact CD2-CB 3.77Å; Y204-D210 HydrophobicContact CE1-CB 3.44Å; Y204-D210 VanDerWaalsContact CE1-CB 3.44Å; Y204-D210 HydrophobicContact CE2-CB 3.95Å; Y204-D210 HydrophobicContact CG-CB 3.41Å; Y204-D210 VanDerWaalsContact CG-CB 3.41Å; Y204-L214 HydrophobicContact CD2-CB 4.49Å; Y204-L214 HydrophobicContact CD2-CD1 3.88Å; Y204-L214 HydrophobicContact CE2-CD1 4.32Å
205	P	91.6	Very high	91.7	Very high	96 Å²	96	55.7 Å²	55.7	62%	0.623	29%	0.289	S	S	*	.			trans	-53.4	134.2	174	-24.8	33.9	0	0	0	111	G207 S208 S211	P205-G207 PolarHBondContact O-N 3.41Å; P205-S208 VanDerWaalsContact O-CB 3.26Å; P205-S208 WeakPolarHBondContact O-CB 3.32Å; P205-S208 PolarHBondContact O-N 3.42Å; P205-S208 VanDerWaalsContact O-N 3.07Å; P205-S208 PolarHBondContact O-OG 3.26Å; P205-S211 WeakPolarHBondContact O-CB 3.31Å
206	K	89.7	Confident	91.8	Very high	188 Å²	188	55.2 Å²	55.2	82%	0.817	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.7	135.1	175.8	-71.2	-177	-179.4	176.5	0	109.3	Y204 S208	Y204-K206 PolarHBondContact O-N 3.45Å; K206-S208 VanDerWaalsContact C-N 3.31Å
207	G	90.3	Very high	91.9	Very high	48 Å²	48	55.1 Å²	55.1	50%	0.495	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	89.4	-12.2	-177.4	0	0	0	0	0	114.6	P205 L276	P205-G207 PolarHBondContact O-N 3.41Å; G207-L276 WeakPolarHBondContact O-CD1 3.06Å
208	S	94.2	Very high	92	Very high	31 Å²	31	56.4 Å²	56.4	22%	0.217	29%	0.291	C	S	.	.	S	Bend	trans	-72.6	155.3	177.3	65.2	0	0	0	0	112.6	P205 K206 D210 S211 A212 L276	P205-S208 VanDerWaalsContact O-CB 3.26Å; P205-S208 WeakPolarHBondContact O-CB 3.32Å; P205-S208 PolarHBondContact O-N 3.42Å; P205-S208 VanDerWaalsContact O-N 3.07Å; P205-S208 PolarHBondContact O-OG 3.26Å; K206-S208 VanDerWaalsContact C-N 3.31Å; S208-D210 VanDerWaalsContact C-N 3.31Å; S208-D210 PolarHBondContact O-N 3.35Å; S208-S211 WeakPolarHBondContact O-CB 3.31Å; S208-S211 PolarHBondContact O-N 3.02Å; S208-S211 VanDerWaalsContact O-N 3.09Å; S208-S211 WeakPolarHBondContact OG-CB 3.12Å; S208-S211 PolarHBondContact OG-N 2.94Å; S208-A212 PolarHBondContact O-N 3.18Å; S208-A212 VanDerWaalsContact O-N 3.08Å; S208-L276 WeakPolarHBondContact O-CD1 3.44Å
209	Y	93.2	Very high	92.5	Very high	96 Å²	96	57 Å²	57	38%	0.376	30%	0.295	S	S	.	.	H	α-helix	trans	-54.9	-45.5	172.6	173.5	-93.2	0	0	0	112.1	Q127 G129 S211 A212 R213 I300 D301	Q127-Y209 PolarHBondContact O-OH 3.48Å; G129-Y209 PolarHBondContact N-OH 2.98Å; Y209-S211 VanDerWaalsContact C-N 3.26Å; Y209-S211 PolarHBondContact O-N 3.18Å; Y209-A212 WeakPolarHBondContact O-CA 2.96Å; Y209-A212 VanDerWaalsContact O-CB 3.3Å; Y209-A212 WeakPolarHBondContact O-CB 3.5Å; Y209-A212 PolarHBondContact O-N 3.44Å; Y209-R213 PolarHBondContact O-N 2.92Å; Y209-I300 HydrophobicContact CD2-CD1 4.27Å; Y209-I300 HydrophobicContact CE2-CD1 3.74Å; Y209-I300 HydrophobicContact CE2-CG1 4.38Å; Y209-D301 WeakPolarHBondContact CE2-OD2 3.39Å; Y209-D301 PolarHBondContact OH-OD2 2.96Å
210	D	92.1	Very high	92.9	Very high	54 Å²	54	56.6 Å²	56.6	29%	0.289	29%	0.293	S	S	.	.	H	α-helix	trans	-62	-34	177.1	-74.5	-75.6	0	0	0	112.6	R124 Y204 S208 R213 L214	R124-D210 IonicContact NH1-OD1 2.88Å; Y204-D210 HydrophobicContact CD1-CB 3.24Å; Y204-D210 HydrophobicContact CD2-CB 3.77Å; Y204-D210 HydrophobicContact CE1-CB 3.44Å; Y204-D210 VanDerWaalsContact CE1-CB 3.44Å; Y204-D210 HydrophobicContact CE2-CB 3.95Å; Y204-D210 HydrophobicContact CG-CB 3.41Å; Y204-D210 VanDerWaalsContact CG-CB 3.41Å; S208-D210 VanDerWaalsContact C-N 3.31Å; S208-D210 PolarHBondContact O-N 3.35Å; D210-R213 PolarHBondContact O-N 2.92Å; D210-L214 WeakPolarHBondContact O-CB 3.46Å; D210-L214 PolarHBondContact O-N 3.07Å
211	S	93.9	Very high	93.3	Very high	14 Å²	14	50.7 Å²	50.7	10%	0.098	27%	0.271	C	S	.	.	H	α-helix	trans	-65.6	-39.6	173.1	-174.2	0	0	0	0	111.9	P205 S208 Y209 Q215	P205-S211 WeakPolarHBondContact O-CB 3.31Å; S208-S211 WeakPolarHBondContact O-CB 3.31Å; S208-S211 PolarHBondContact O-N 3.02Å; S208-S211 VanDerWaalsContact O-N 3.09Å; S208-S211 WeakPolarHBondContact OG-CB 3.12Å; S208-S211 PolarHBondContact OG-N 2.94Å; Y209-S211 VanDerWaalsContact C-N 3.26Å; Y209-S211 PolarHBondContact O-N 3.18Å; S211-Q215 WeakPolarHBondContact O-CG 3.26Å; S211-Q215 PolarHBondContact O-N 3.23Å; S211-Q215 VanDerWaalsContact O-N 3.17Å; S211-Q215 PolarHBondContact O-NE2 3.44Å
212	A	95.3	Very high	93.7	Very high	7 Å²	7	48.5 Å²	48.5	6%	0.058	26%	0.261	C	S	.	.	H	α-helix	trans	-62.4	-46.5	173	0	0	0	0	0	111.2	S208 Y209 Q215 M216 L276 L282 I300	S208-A212 PolarHBondContact O-N 3.18Å; S208-A212 VanDerWaalsContact O-N 3.08Å; Y209-A212 WeakPolarHBondContact O-CA 2.96Å; Y209-A212 VanDerWaalsContact O-CB 3.3Å; Y209-A212 WeakPolarHBondContact O-CB 3.5Å; Y209-A212 PolarHBondContact O-N 3.44Å; A212-Q215 PolarHBondContact O-N 3.5Å; A212-M216 WeakPolarHBondContact O-CB 3.39Å; A212-M216 PolarHBondContact O-N 2.95Å; A212-L276 HydrophobicContact CB-CD1 3.73Å; A212-L276 HydrophobicContact CB-CD2 3.97Å; A212-L276 HydrophobicContact CB-CG 3.7Å; A212-L282 HydrophobicContact CB-CD2 4.07Å; A212-I300 HydrophobicContact CB-CD1 3.98Å; A212-I300 HydrophobicContact CB-CG2 4.41Å
213	R	93.5	Very high	94.4	Very high	9 Å²	9	44 Å²	44	3%	0.034	24%	0.241	C	C	.	.	H	α-helix	trans	-63.1	-43.3	-179.6	-173	178.1	172.7	94.2	10.4	112.1	M126 Q127 I128 G129 Y209 D210 Q215 M216 N217 I300	M126-R213 VanDerWaalsContact O-CZ 3.25Å; M126-R213 PolarHBondContact O-NH1 2.88Å; M126-R213 VanDerWaalsContact O-NH1 3.13Å; M126-R213 PolarHBondContact O-NH2 2.97Å; Q127-R213 PolarHBondContact O-NH1 3.41Å; I128-R213 PolarHBondContact O-NH1 3.42Å; G129-R213 VanDerWaalsContact N-NH1 3.16Å; Y209-R213 PolarHBondContact O-N 2.92Å; D210-R213 PolarHBondContact O-N 2.92Å; R213-Q215 PolarHBondContact O-N 2.75Å; R213-M216 HydrophobicContact CG-CE 4.27Å; R213-M216 WeakPolarHBondContact O-CB 3.35Å; R213-M216 PolarHBondContact O-N 3.34Å; R213-N217 WeakPolarHBondContact O-CB 3.45Å; R213-N217 PolarHBondContact O-N 3.19Å; R213-N217 PolarHBondContact O-ND2 2.93Å; R213-N217 PolarHBondContact O-OD1 2.98Å; R213-I300 HydrophobicContact CB-CD1 3.9Å
214	L	93.8	Very high	94.9	Very high	30 Å²	30	38.4 Å²	38.4	16%	0.157	20%	0.202	C	C	.	.	H	α-helix	trans	-58	-47.3	174.5	179.6	159.2	0	0	0	111.1	E199 K202 Y204 D210 M216 N217 L218	E199-L214 WeakPolarHBondContact O-CD1 3.44Å; K202-L214 WeakPolarHBondContact O-CD1 3.4Å; Y204-L214 HydrophobicContact CD2-CB 4.49Å; Y204-L214 HydrophobicContact CD2-CD1 3.88Å; Y204-L214 HydrophobicContact CE2-CD1 4.32Å; D210-L214 WeakPolarHBondContact O-CB 3.46Å; D210-L214 PolarHBondContact O-N 3.07Å; L214-M216 VanDerWaalsContact C-N 3.34Å; L214-M216 PolarHBondContact O-N 3.23Å; L214-N217 PolarHBondContact O-N 3.35Å; L214-L218 HydrophobicContact CD2-CD1 3.64Å; L214-L218 HydrophobicContact CD2-CG 4.39Å; L214-L218 WeakPolarHBondContact O-CG 3.12Å; L214-L218 PolarHBondContact O-N 2.97Å
215	Q	95.9	Very high	95.3	Very high	55 Å²	55	36.2 Å²	36.2	26%	0.257	19%	0.193	S	C	.	.	H	α-helix	trans	-62.4	-41.6	177.7	-72.3	176.5	56.6	0	0	111.9	S211 A212 R213 H219 G280 L282	S211-Q215 WeakPolarHBondContact O-CG 3.26Å; S211-Q215 PolarHBondContact O-N 3.23Å; S211-Q215 VanDerWaalsContact O-N 3.17Å; S211-Q215 PolarHBondContact O-NE2 3.44Å; A212-Q215 PolarHBondContact O-N 3.5Å; R213-Q215 PolarHBondContact O-N 2.75Å; Q215-H219 WeakPolarHBondContact O-CB 3.4Å; Q215-H219 PolarHBondContact O-N 3.45Å; Q215-G280 PolarHBondContact NE2-O 3.26Å; Q215-L282 HydrophobicContact CB-CD1 3.5Å; Q215-L282 HydrophobicContact CB-CG 3.86Å
216	M	96.7	Very high	95.6	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-61.4	-48.6	176.5	-178.8	-158.9	74.6	0	0	111.2	T133 A212 R213 L214 L218 H219 N220 L282 V298 H299 I300	T133-M216 HydrophobicContact CG2-CE 4.16Å; A212-M216 WeakPolarHBondContact O-CB 3.39Å; A212-M216 PolarHBondContact O-N 2.95Å; R213-M216 HydrophobicContact CG-CE 4.27Å; R213-M216 WeakPolarHBondContact O-CB 3.35Å; R213-M216 PolarHBondContact O-N 3.34Å; L214-M216 VanDerWaalsContact C-N 3.34Å; L214-M216 PolarHBondContact O-N 3.23Å; M216-L218 PolarHBondContact O-N 3.46Å; M216-H219 PolarHBondContact O-N 3.19Å; M216-N220 WeakPolarHBondContact CG-ND2 3.35Å; M216-N220 PolarHBondContact O-N 3.31Å; M216-N220 PolarHBondContact O-ND2 3.38Å; M216-N220 VanDerWaalsContact O-ND2 3.13Å; M216-L282 HydrophobicContact CB-CD1 4.22Å; M216-V298 HydrophobicContact CG-CG2 4.05Å; M216-V298 VanDerWaalsContact CG-O 3.28Å; M216-V298 WeakPolarHBondContact CG-O 3.46Å; M216-H299 HydrophobicContact SD-CB 4.48Å; M216-I300 HydrophobicContact CB-CG2 4.28Å; M216-I300 HydrophobicContact CG-CG2 4.44Å; M216-I300 HydrophobicContact SD-CB 4.47Å; M216-I300 HydrophobicContact SD-CD1 4.46Å; M216-I300 HydrophobicContact SD-CG1 3.87Å; M216-I300 HydrophobicContact SD-CG2 4.25Å
217	N	95.4	Very high	96.1	Very high	1 Å²	1	27.3 Å²	27.3	1%	0.005	15%	0.145	C	C	.	.	H	α-helix	trans	-59.6	-47.7	179.7	-70.4	-11.6	0	0	0	111.9	Y137 E199 R213 L214 H219 N220 N221	Y137-N217 HydrophobicContact CD1-CB 3.76Å; Y137-N217 HydrophobicContact CE1-CB 3.54Å; Y137-N217 WeakPolarHBondContact CE2-OD1 3.4Å; Y137-N217 HydrophobicContact CG-CB 4.46Å; Y137-N217 VanDerWaalsContact CZ-ND2 3.34Å; Y137-N217 PolarHBondContact OH-ND2 3.01Å; E199-N217 VanDerWaalsContact CD-ND2 3.28Å; E199-N217 HydrophobicContact CG-CB 4.14Å; E199-N217 PolarHBondContact OE1-ND2 3.31Å; E199-N217 PolarHBondContact OE2-ND2 3.45Å; R213-N217 WeakPolarHBondContact O-CB 3.45Å; R213-N217 PolarHBondContact O-N 3.19Å; R213-N217 PolarHBondContact O-ND2 2.93Å; R213-N217 PolarHBondContact O-OD1 2.98Å; L214-N217 PolarHBondContact O-N 3.35Å; N217-H219 VanDerWaalsContact C-N 3.35Å; N217-H219 PolarHBondContact O-N 3.42Å; N217-N220 PolarHBondContact O-N 3.03Å; N217-N221 WeakPolarHBondContact O-CB 3.5Å; N217-N221 VanDerWaalsContact O-CG 3.26Å; N217-N221 PolarHBondContact O-N 3.33Å
218	L	96.5	Very high	96.5	Very high	41 Å²	41	25.1 Å²	25.1	22%	0.215	12%	0.122	C	C	.	.	H	α-helix	trans	-63.4	-39.7	178	-69.8	178.6	0	0	0	112.2	D196 E199 R200 L214 M216 E222	D196-L218 HydrophobicContact CB-CD2 3.63Å; E199-L218 HydrophobicContact CB-CD2 3.92Å; E199-L218 HydrophobicContact CB-CG 4.29Å; R200-L218 HydrophobicContact CG-CD2 4.45Å; L214-L218 HydrophobicContact CD2-CD1 3.64Å; L214-L218 HydrophobicContact CD2-CG 4.39Å; L214-L218 WeakPolarHBondContact O-CG 3.12Å; L214-L218 PolarHBondContact O-N 2.97Å; M216-L218 PolarHBondContact O-N 3.46Å; L218-E222 WeakPolarHBondContact O-CB 3.34Å; L218-E222 PolarHBondContact O-N 3.28Å; L218-E222 VanDerWaalsContact O-N 3.13Å
219	H	98.2	Very high	96.7	Very high	49 Å²	49	25.7 Å²	25.7	23%	0.227	13%	0.126	C	C	.	.	H	α-helix	trans	-62.8	-48.2	175.8	-178.7	98.8	0	0	0	111.5	Q215 M216 N217 E222 A223 T293 D296 V298	Q215-H219 WeakPolarHBondContact O-CB 3.4Å; Q215-H219 PolarHBondContact O-N 3.45Å; M216-H219 PolarHBondContact O-N 3.19Å; N217-H219 VanDerWaalsContact C-N 3.35Å; N217-H219 PolarHBondContact O-N 3.42Å; H219-E222 WeakPolarHBondContact O-CB 3.44Å; H219-E222 PolarHBondContact O-N 3.43Å; H219-A223 PolarHBondContact O-N 2.94Å; H219-T293 PolarHBondContact CE1-O 2.77Å; H219-T293 VanDerWaalsContact CE1-O 3.22Å; H219-T293 PolarHBondContact NE2-O 3.06Å; H219-D296 PolarHBondContact CD2-O 3.05Å; H219-D296 PolarHBondContact NE2-O 2.93Å; H219-V298 HydrophobicContact CB-CG2 4.02Å; H219-V298 VanDerWaalsContact CD2-CG2 3.47Å; H219-V298 WeakPolarHBondContact CD2-CG2 3.33Å
220	N	98.3	Very high	96.9	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-69.2	-36.2	-178.3	-68.2	-35.1	0	0	0	112.5	A134 A138 M216 N217 E222 A223 G224 L297 V298	A134-N220 VanDerWaalsContact CA-ND2 3.32Å; A134-N220 WeakPolarHBondContact CA-ND2 3.45Å; A134-N220 WeakPolarHBondContact CB-ND2 3.33Å; A138-N220 VanDerWaalsContact CA-O 3.24Å; A138-N220 WeakPolarHBondContact CA-O 3.43Å; A138-N220 VanDerWaalsContact CB-O 3.3Å; A138-N220 WeakPolarHBondContact CB-O 3.42Å; M216-N220 WeakPolarHBondContact CG-ND2 3.35Å; M216-N220 PolarHBondContact O-N 3.31Å; M216-N220 PolarHBondContact O-ND2 3.38Å; M216-N220 VanDerWaalsContact O-ND2 3.13Å; N217-N220 PolarHBondContact O-N 3.03Å; N220-E222 VanDerWaalsContact C-N 3.28Å; N220-E222 PolarHBondContact O-N 3.09Å; N220-A223 PolarHBondContact O-N 2.97Å; N220-G224 PolarHBondContact O-N 2.85Å; N220-L297 HydrophobicContact CB-CD2 4.3Å; N220-L297 WeakPolarHBondContact OD1-CA 3.22Å; N220-V298 PolarHBondContact ND2-O 3.06Å; N220-V298 PolarHBondContact OD1-N 3.48Å; N220-V298 PolarHBondContact OD1-O 3.06Å
221	N	97.9	Very high	97.2	Very high	1 Å²	1	26.1 Å²	26.1	1%	0.005	14%	0.135	C	C	.	.	H	α-helix	trans	-57.2	-44.6	170	-76.8	-9.3	0	0	0	111.4	Y137 A141 D196 N217 G224 R225	Y137-N221 WeakPolarHBondContact CB-OD1 3.36Å; Y137-N221 WeakPolarHBondContact CD1-OD1 3.4Å; Y137-N221 PolarHBondContact O-OD1 3.22Å; Y137-N221 VanDerWaalsContact O-OD1 3.09Å; A141-N221 HydrophobicContact CB-CB 3.98Å; A141-N221 WeakPolarHBondContact CB-O 3.44Å; D196-N221 PolarHBondContact OD1-ND2 2.93Å; N217-N221 WeakPolarHBondContact O-CB 3.5Å; N217-N221 VanDerWaalsContact O-CG 3.26Å; N217-N221 PolarHBondContact O-N 3.33Å; N221-G224 PolarHBondContact O-N 2.86Å; N221-R225 WeakPolarHBondContact O-CG 3.43Å; N221-R225 PolarHBondContact O-N 2.71Å
222	E	98.6	Very high	97.3	Very high	36 Å²	36	26.3 Å²	26.3	17%	0.168	14%	0.137	C	C	.	.	H	α-helix	trans	-63.9	-43	177	178.1	66.4	-179.5	0	0	112.1	Y188 L218 H219 N220 G224 R225 R226	Y188-E222 PolarHBondContact OH-OE1 2.95Å; Y188-E222 PolarHBondContact OH-OE2 2.79Å; L218-E222 WeakPolarHBondContact O-CB 3.34Å; L218-E222 PolarHBondContact O-N 3.28Å; L218-E222 VanDerWaalsContact O-N 3.13Å; H219-E222 WeakPolarHBondContact O-CB 3.44Å; H219-E222 PolarHBondContact O-N 3.43Å; N220-E222 VanDerWaalsContact C-N 3.28Å; N220-E222 PolarHBondContact O-N 3.09Å; E222-G224 VanDerWaalsContact C-N 3.29Å; E222-G224 PolarHBondContact O-N 3.1Å; E222-R225 PolarHBondContact O-N 3.45Å; E222-R225 IonicContact OE2-CZ 3.98Å; E222-R225 IonicContact OE2-NE 3.33Å; E222-R225 PolarHBondContact OE2-NE 3.13Å; E222-R225 IonicContact OE2-NH2 3.69Å; E222-R226 WeakPolarHBondContact O-CB 3.45Å; E222-R226 WeakPolarHBondContact O-CG 3.47Å; E222-R226 PolarHBondContact O-N 3.06Å; E222-R226 IonicContact OE1-CZ 2.96Å; E222-R226 IonicContact OE1-NE 2.85Å; E222-R226 PolarHBondContact OE1-NE 3.29Å; E222-R226 IonicContact OE1-NH2 3.77Å; E222-R226 PolarHBondContact OE1-NH2 3.43Å
223	A	98.8	Very high	97.3	Very high	1 Å²	1	31.5 Å²	31.5	1%	0.008	16%	0.164	C	C	.	.	H	α-helix	trans	-58.7	-40.9	174.6	0	0	0	0	0	112.1	H219 N220 R226 A227 S294 L297	H219-A223 PolarHBondContact O-N 2.94Å; N220-A223 PolarHBondContact O-N 2.97Å; A223-R226 PolarHBondContact O-N 3.38Å; A223-A227 PolarHBondContact O-N 3.47Å; A223-S294 WeakPolarHBondContact CA-O 3.49Å; A223-S294 WeakPolarHBondContact CB-O 3.2Å; A223-L297 HydrophobicContact CB-CD2 3.81Å
224	G	98.7	Very high	97.4	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-59.6	-49.2	173	0	0	0	0	0	113.7	A138 A142 N220 N221 E222 R226 A227 V228	A138-G224 VanDerWaalsContact O-CA 3.25Å; A138-G224 WeakPolarHBondContact O-CA 3.35Å; A142-G224 WeakPolarHBondContact CB-O 3.43Å; N220-G224 PolarHBondContact O-N 2.85Å; N221-G224 PolarHBondContact O-N 2.86Å; E222-G224 VanDerWaalsContact C-N 3.29Å; E222-G224 PolarHBondContact O-N 3.1Å; G224-R226 VanDerWaalsContact C-N 3.31Å; G224-R226 PolarHBondContact O-N 2.87Å; G224-A227 WeakPolarHBondContact O-CB 3.38Å; G224-A227 PolarHBondContact O-N 3.27Å; G224-V228 PolarHBondContact O-N 2.93Å
225	R	98.8	Very high	97.5	Very high	3 Å²	3	33.1 Å²	33.1	1%	0.011	18%	0.178	C	C	.	.	H	α-helix	trans	-61.6	-40.8	177	-67.1	-175.6	-82.2	-99.1	4.1	111.8	A141 V145 Y188 D196 N221 E222 V228 S229	A141-R225 HydrophobicContact CB-CG 4.09Å; V145-R225 HydrophobicContact CG2-CB 4.17Å; V145-R225 HydrophobicContact CG2-CG 3.69Å; Y188-R225 HydrophobicContact CD2-CB 3.91Å; Y188-R225 HydrophobicContact CE1-CB 4.16Å; Y188-R225 HydrophobicContact CE2-CB 3.52Å; Y188-R225 HydrophobicContact CG-CB 4.4Å; D196-R225 IonicContact OD1-CZ 2.76Å; D196-R225 IonicContact OD1-NH1 2.82Å; D196-R225 PolarHBondContact OD1-NH1 2.91Å; D196-R225 IonicContact OD1-NH2 3.75Å; D196-R225 PolarHBondContact OD1-NH2 3.48Å; D196-R225 VanDerWaalsContact OD1-NH2 3.16Å; D196-R225 IonicContact OD2-CZ 3.52Å; D196-R225 IonicContact OD2-NH1 3.95Å; D196-R225 IonicContact OD2-NH2 3.49Å; D196-R225 PolarHBondContact OD2-NH2 3.49Å; N221-R225 WeakPolarHBondContact O-CG 3.43Å; N221-R225 PolarHBondContact O-N 2.71Å; E222-R225 PolarHBondContact O-N 3.45Å; E222-R225 IonicContact OE2-CZ 3.98Å; E222-R225 IonicContact OE2-NE 3.33Å; E222-R225 PolarHBondContact OE2-NE 3.13Å; E222-R225 IonicContact OE2-NH2 3.69Å; R225-V228 PolarHBondContact O-N 3.47Å; R225-S229 PolarHBondContact O-N 3.11Å
226	R	98.7	Very high	97.4	Very high	84 Å²	84	32.3 Å²	32.3	32%	0.317	18%	0.177	S	C	.	.	H	α-helix	trans	-66.5	-37.8	176.4	-73.7	179.4	174.8	-103.3	-5.6	112.7	Y188 E222 A223 G224 V228 S229 N230 S294 N295	Y188-R226 HydrophobicContact CE2-CG 4.46Å; Y188-R226 WeakPolarHBondContact OH-CG 3.3Å; E222-R226 WeakPolarHBondContact O-CB 3.45Å; E222-R226 WeakPolarHBondContact O-CG 3.47Å; E222-R226 PolarHBondContact O-N 3.06Å; E222-R226 IonicContact OE1-CZ 2.96Å; E222-R226 IonicContact OE1-NE 2.85Å; E222-R226 PolarHBondContact OE1-NE 3.29Å; E222-R226 IonicContact OE1-NH2 3.77Å; E222-R226 PolarHBondContact OE1-NH2 3.43Å; A223-R226 PolarHBondContact O-N 3.38Å; G224-R226 VanDerWaalsContact C-N 3.31Å; G224-R226 PolarHBondContact O-N 2.87Å; R226-V228 VanDerWaalsContact C-N 3.29Å; R226-V228 PolarHBondContact O-N 3.27Å; R226-S229 CarbonylContact O-C 3.36Å; R226-S229 PolarHBondContact O-N 3.2Å; R226-S229 VanDerWaalsContact O-N 3.11Å; R226-N230 VanDerWaalsContact O-CB 3.31Å; R226-N230 WeakPolarHBondContact O-CB 3.3Å; R226-N230 PolarHBondContact O-N 3.38Å; R226-N230 PolarHBondContact O-ND2 3.09Å; R226-S294 WeakPolarHBondContact CD-O 3.18Å; R226-S294 VanDerWaalsContact CZ-OG 3.29Å; R226-S294 PolarHBondContact NE-OG 3.47Å; R226-S294 PolarHBondContact NH1-OG 3.03Å; R226-N295 WeakPolarHBondContact CB-OD1 3.25Å; R226-N295 WeakPolarHBondContact CD-OD1 3.39Å
227	A	98.7	Very high	97.3	Very high	13 Å²	13	38.2 Å²	38.2	11%	0.107	20%	0.203	C	C	.	.	H	α-helix	trans	-57.2	-44.6	175.5	0	0	0	0	0	111.4	A223 G224 L231 V260 L264	A223-A227 PolarHBondContact O-N 3.47Å; G224-A227 WeakPolarHBondContact O-CB 3.38Å; G224-A227 PolarHBondContact O-N 3.27Å; A227-L231 WeakPolarHBondContact O-CB 3.24Å; A227-L231 WeakPolarHBondContact O-CD1 3.47Å; A227-L231 VanDerWaalsContact O-CG 3.3Å; A227-L231 WeakPolarHBondContact O-CG 3.5Å; A227-L231 PolarHBondContact O-N 3.16Å; A227-V260 HydrophobicContact CB-CG1 4.21Å; A227-L264 HydrophobicContact CB-CD1 4.38Å; A227-L264 HydrophobicContact CB-CD2 3.71Å; A227-L264 HydrophobicContact CB-CG 3.89Å
228	V	98.7	Very high	97.2	Very high	2 Å²	2	40.2 Å²	40.2	1%	0.012	22%	0.217	C	C	.	.	H	α-helix	trans	-64	-43.8	174.3	-178.9	0	0	0	0	111.3	A142 V145 L184 G224 R225 R226 A232 L254 V260	A142-V228 HydrophobicContact CB-CG2 3.62Å; V145-V228 HydrophobicContact CB-CB 4.45Å; V145-V228 HydrophobicContact CB-CG1 4.32Å; V145-V228 HydrophobicContact CB-CG2 4.42Å; V145-V228 HydrophobicContact CG1-CB 4.09Å; V145-V228 HydrophobicContact CG1-CG1 3.68Å; L184-V228 HydrophobicContact CD1-CG1 4.19Å; G224-V228 PolarHBondContact O-N 2.93Å; R225-V228 PolarHBondContact O-N 3.47Å; R226-V228 VanDerWaalsContact C-N 3.29Å; R226-V228 PolarHBondContact O-N 3.27Å; V228-A232 PolarHBondContact O-N 3.32Å; V228-L254 HydrophobicContact CG1-CD1 4.07Å; V228-L254 HydrophobicContact CG1-CD2 3.88Å; V228-V260 HydrophobicContact CG2-CG1 3.9Å; V228-V260 HydrophobicContact CG2-CG2 4.28Å
229	S	98.1	Very high	96.9	Very high	44 Å²	44	42.4 Å²	42.4	31%	0.308	23%	0.226	S	C	.	.	H	α-helix	trans	-65.6	-40.3	-178.8	-173.7	0	0	0	0	113.6	R225 R226	R225-S229 PolarHBondContact O-N 3.11Å; R226-S229 CarbonylContact O-C 3.36Å; R226-S229 PolarHBondContact O-N 3.2Å; R226-S229 VanDerWaalsContact O-N 3.11Å
230	N	98	Very high	96.5	Very high	98 Å²	98	41 Å²	41	52%	0.524	23%	0.225	S	C	.	.	H	α-helix	trans	-76.9	-25.5	-176.2	-64.7	-19.8	0	0	0	112	R226 N295	R226-N230 VanDerWaalsContact O-CB 3.31Å; R226-N230 WeakPolarHBondContact O-CB 3.3Å; R226-N230 PolarHBondContact O-N 3.38Å; R226-N230 PolarHBondContact O-ND2 3.09Å; N230-N295 PolarHBondContact ND2-OD1 2.9Å; N230-N295 VanDerWaalsContact ND2-OD1 3.15Å
231	L	98.3	Very high	96.2	Very high	60 Å²	60	47.1 Å²	47.1	31%	0.314	26%	0.261	S	S	.	.	S	Bend	trans	-93.1	-4.4	178	-67.7	170.9	0	0	0	113.1	A227 A255 V260 A263	A227-L231 WeakPolarHBondContact O-CB 3.24Å; A227-L231 WeakPolarHBondContact O-CD1 3.47Å; A227-L231 VanDerWaalsContact O-CG 3.3Å; A227-L231 WeakPolarHBondContact O-CG 3.5Å; A227-L231 PolarHBondContact O-N 3.16Å; L231-A255 HydrophobicContact CB-CB 4Å; L231-A255 WeakPolarHBondContact O-CB 3.36Å; L231-V260 HydrophobicContact CD1-CB 4.38Å; L231-V260 HydrophobicContact CD1-CG2 3.99Å; L231-A263 HydrophobicContact CD1-CB 3.82Å
232	A	96.9	Very high	95.7	Very high	19 Å²	19	53.2 Å²	53.2	16%	0.157	30%	0.304	C	S	.	.			trans	-67.2	134.2	171.9	0	0	0	0	0	109.6	L184 V228 L252 L254	L184-A232 HydrophobicContact CD2-CB 3.88Å; V228-A232 PolarHBondContact O-N 3.32Å; A232-L252 HydrophobicContact CB-CD1 4.04Å; A232-L254 HydrophobicContact CB-CD2 3.92Å
233	D	95.4	Very high	94.9	Very high	115 Å²	115	54.4 Å²	54.4	62%	0.615	33%	0.326	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-139.2	167.8	-171.3	-164.3	10.5	0	0	0	111	S235 Q253	D233-S235 PolarHBondContact O-N 2.88Å; D233-Q253 PolarHBondContact N-O 3.18Å; D233-Q253 PolarHBondContact O-N 2.95Å; D233-Q253 VanDerWaalsContact O-O 3.12Å
234	V	95.8	Very high	94.5	Very high	38 Å²	38	56.7 Å²	56.7	23%	0.23	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	117.5	176	-178.9	0	0	0	0	109.9	P168 L171 W177 C250	P168-V234 HydrophobicContact CB-CG2 4.48Å; P168-V234 HydrophobicContact CG-CG2 3.68Å; L171-V234 HydrophobicContact CD1-CG1 3.85Å; W177-V234 HydrophobicContact CZ3-CG1 4.04Å; W177-V234 HydrophobicContact CZ3-CG2 4.03Å; V234-C250 HydrophobicContact CG1-CB 3.61Å
235	S	95.1	Very high	94.2	Very high	36 Å²	36	60.6 Å²	60.6	25%	0.252	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	147.4	170	-177.4	0	0	0	0	109.8	D233 C250 W251 Q253	D233-S235 PolarHBondContact O-N 2.88Å; S235-C250 CarbonylContact O-C 3.56Å; S235-C250 WeakPolarHBondContact O-CA 3.35Å; S235-W251 PolarHBondContact N-O 2.57Å; S235-W251 PolarHBondContact O-N 2.96Å; S235-Q253 PolarHBondContact OG-OE1 3.37Å
236	C	94.5	Very high	93.7	Very high	37 Å²	37	65.4 Å²	65.4	25%	0.25	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	150.1	-174	-53.7	0	0	0	0	112.8	K248 T249 C250	C236-K248 HydrophobicContact CB-CD 4.04Å; C236-K248 HydrophobicContact CB-CG 3.81Å; C236-K248 WeakPolarHBondContact SG-CE 3.44Å; C236-T249 CarbonylContact C-O 3.56Å; C236-T249 VanDerWaalsContact CA-O 3.23Å; C236-T249 WeakPolarHBondContact CA-O 3.48Å; C236-C250 HydrophobicContact CB-CB 4.01Å; C236-C250 WeakPolarHBondContact CB-SG 3.45Å; C236-C250 WeakPolarHBondContact SG-CB 3.3Å; C236-C250 CovalentContact SG-SG 2.03Å; C236-C250 PolarHBondContact SG-SG 3.24Å
237	K	93.9	Very high	93.3	Very high	125 Å²	125	65.1 Å²	65.1	54%	0.543	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	139.9	172.5	-176.6	173.4	-177.1	178.7	0	111.1	H239 K248 T249 W251	K237-H239 PolarHBondContact O-CD2 3.23Å; K237-K248 WeakPolarHBondContact O-CA 3.39Å; K237-T249 PolarHBondContact N-O 3.02Å; K237-T249 PolarHBondContact O-N 3.04Å; K237-W251 HydrophobicContact CB-CH2 3.62Å; K237-W251 HydrophobicContact CB-CZ3 3.95Å
238	C	93.8	Very high	93.1	Very high	42 Å²	42	66.6 Å²	66.6	28%	0.284	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	136.6	177.4	-64.6	0	0	0	0	111.1	C245	C238-C245 HydrophobicContact CB-CB 3.81Å; C238-C245 WeakPolarHBondContact CB-SG 3.42Å; C238-C245 WeakPolarHBondContact SG-CB 3.29Å; C238-C245 CovalentContact SG-SG 2.03Å; C238-C245 PolarHBondContact SG-SG 3.42Å
239	H	90.6	Very high	92.9	Very high	88 Å²	88	67.6 Å²	67.6	41%	0.407	42%	0.417	S	S	.	.			trans	-128.8	64.4	-176	-60	-81.6	0	0	0	109.6	K237 L247 T249	K237-H239 PolarHBondContact O-CD2 3.23Å; H239-L247 HydrophobicContact CB-CB 4.17Å; H239-L247 HydrophobicContact CB-CD2 4.09Å; H239-L247 HydrophobicContact CB-CG 4.32Å; H239-L247 PolarHBondContact N-O 3.49Å; H239-L247 WeakPolarHBondContact O-CB 3.42Å; H239-T249 PolarHBondContact CD2-OG1 3.17Å; H239-T249 PolarHBondContact NE2-OG1 3.27Å
240	G	88.8	Confident	92.8	Very high	20 Å²	20	65.5 Å²	65.5	21%	0.206	40%	0.403	C	S	.	.	S	Bend	trans	-126.6	162	176.5	0	0	0	0	0	111.8	S242 G243 S244	G240-S242 PolarHBondContact O-N 2.88Å; G240-G243 PolarHBondContact O-N 3.08Å; G240-S244 VanDerWaalsContact C-OG 3.26Å; G240-S244 WeakPolarHBondContact CA-O 3.33Å; G240-S244 VanDerWaalsContact CA-OG 3.28Å; G240-S244 WeakPolarHBondContact CA-OG 3.44Å; G240-S244 PolarHBondContact N-O 3.09Å
241	V	92.5	Very high	92.8	Very high	127 Å²	127	63.1 Å²	63.1	77%	0.77	39%	0.386	S	S	*	.	G	3₁₀ helix	trans	-55.2	133.8	176.2	-177.2	0	0	0	0	108.7	G243 S244	V241-G243 PolarHBondContact O-N 3.49Å; V241-S244 PolarHBondContact N-OG 3.07Å; V241-S244 WeakPolarHBondContact O-CB 3.29Å; V241-S244 PolarHBondContact O-N 3.2Å; V241-S244 PolarHBondContact O-OG 3.39Å
242	S	87.1	Confident	92.7	Very high	129 Å²	129	61.6 Å²	61.6	90%	0.902	38%	0.378	S	S	*	.	G	3₁₀ helix	trans	56.3	28.3	-177	-53.6	0	0	0	0	115.1	G240	G240-S242 PolarHBondContact O-N 2.88Å
243	G	82.7	Confident	92.7	Very high	61 Å²	61	64.1 Å²	64.1	63%	0.629	39%	0.387	S	S	*	.	G	3₁₀ helix	trans	81.5	13.2	178.2	0	0	0	0	0	114.6	G240 V241	G240-G243 PolarHBondContact O-N 3.08Å; V241-G243 PolarHBondContact O-N 3.49Å
244	S	90.3	Very high	92.8	Very high	50 Å²	50	58.8 Å²	58.8	35%	0.35	36%	0.358	S	S	.	.			trans	-63.9	156.4	172.2	55	0	0	0	0	112.2	G240 V241	G240-S244 VanDerWaalsContact C-OG 3.26Å; G240-S244 WeakPolarHBondContact CA-O 3.33Å; G240-S244 VanDerWaalsContact CA-OG 3.28Å; G240-S244 WeakPolarHBondContact CA-OG 3.44Å; G240-S244 PolarHBondContact N-O 3.09Å; V241-S244 PolarHBondContact N-OG 3.07Å; V241-S244 WeakPolarHBondContact O-CB 3.29Å; V241-S244 PolarHBondContact O-N 3.2Å; V241-S244 PolarHBondContact O-OG 3.39Å
245	C	90.8	Very high	92.9	Very high	82 Å²	82	57.9 Å²	57.9	55%	0.554	36%	0.355	S	S	*	.			trans	-99.4	30.7	179.7	-64.1	0	0	0	0	113.2	C238 L247	C238-C245 HydrophobicContact CB-CB 3.81Å; C238-C245 WeakPolarHBondContact CB-SG 3.42Å; C238-C245 WeakPolarHBondContact SG-CB 3.29Å; C238-C245 CovalentContact SG-SG 2.03Å; C238-C245 PolarHBondContact SG-SG 3.42Å; C245-L247 PolarHBondContact O-N 3.21Å
246	S	89.7	Confident	93.1	Very high	103 Å²	103	61 Å²	61	72%	0.72	37%	0.368	S	S	*	.	S	Bend	trans	-62.4	-29.4	177.8	56.9	0	0	0	0	113
247	L	90.6	Very high	93.2	Very high	79 Å²	79	59.9 Å²	59.9	41%	0.414	36%	0.359	S	S	.	.	S	Bend	trans	-124.6	136.5	167	-175.6	70	0	0	0	108.1	L176 H239 C245	L176-L247 HydrophobicContact CD1-CD1 3.68Å; L176-L247 HydrophobicContact CD1-CG 4.31Å; L176-L247 HydrophobicContact CG-CD1 4.14Å; H239-L247 HydrophobicContact CB-CB 4.17Å; H239-L247 HydrophobicContact CB-CD2 4.09Å; H239-L247 HydrophobicContact CB-CG 4.32Å; H239-L247 PolarHBondContact N-O 3.49Å; H239-L247 WeakPolarHBondContact O-CB 3.42Å; C245-L247 PolarHBondContact O-N 3.21Å
248	K	93.4	Very high	93.5	Very high	43 Å²	43	57.7 Å²	57.7	19%	0.187	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	129.2	-177.3	-172.7	173.2	174.8	-174.3	0	109.7	W175 L176 C236 K237	W175-K248 HydrophobicContact CD2-CD 3.75Å; W175-K248 HydrophobicContact CE3-CD 4.09Å; W175-K248 HydrophobicContact CG-CB 4.46Å; W175-K248 HydrophobicContact CG-CD 4.1Å; W175-K248 HydrophobicContact CG-CG 4.49Å; W175-K248 HydrophobicContact CZ2-CD 4.26Å; L176-K248 WeakPolarHBondContact CB-O 3.45Å; L176-K248 PolarHBondContact N-O 2.81Å; C236-K248 HydrophobicContact CB-CD 4.04Å; C236-K248 HydrophobicContact CB-CG 3.81Å; C236-K248 WeakPolarHBondContact SG-CE 3.44Å; K237-K248 WeakPolarHBondContact O-CA 3.39Å
249	T	94.4	Very high	93.7	Very high	24 Å²	24	62 Å²	62	15%	0.147	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	131.8	176.5	-53.3	0	0	0	0	108.9	L176 C236 K237 H239 W251	L176-T249 CarbonylContact O-C 3.49Å; L176-T249 WeakPolarHBondContact O-CA 3.49Å; C236-T249 CarbonylContact C-O 3.56Å; C236-T249 VanDerWaalsContact CA-O 3.23Å; C236-T249 WeakPolarHBondContact CA-O 3.48Å; K237-T249 PolarHBondContact N-O 3.02Å; K237-T249 PolarHBondContact O-N 3.04Å; H239-T249 PolarHBondContact CD2-OG1 3.17Å; H239-T249 PolarHBondContact NE2-OG1 3.27Å; T249-W251 WeakPolarHBondContact O-CZ3 3.5Å
250	C	96.4	Very high	94.1	Very high	0 Å²	0	57.9 Å²	57.9	0%	0	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	146.3	-173.9	-59.6	0	0	0	0	111.9	L171 W175 L176 W177 G178 V234 S235 C236	L171-C250 HydrophobicContact CD2-CB 4.31Å; W175-C250 VanDerWaalsContact CE3-SG 3.58Å; L176-C250 PolarHBondContact O-N 3.36Å; W177-C250 WeakPolarHBondContact CA-O 3.34Å; W177-C250 HydrophobicContact CE3-CB 4.25Å; G178-C250 PolarHBondContact N-O 3.38Å; G178-C250 CarbonylContact O-C 3.57Å; V234-C250 HydrophobicContact CG1-CB 3.61Å; S235-C250 CarbonylContact O-C 3.56Å; S235-C250 WeakPolarHBondContact O-CA 3.35Å; C236-C250 HydrophobicContact CB-CB 4.01Å; C236-C250 WeakPolarHBondContact CB-SG 3.45Å; C236-C250 WeakPolarHBondContact SG-CB 3.3Å; C236-C250 CovalentContact SG-SG 2.03Å; C236-C250 PolarHBondContact SG-SG 3.24Å
251	W	96.8	Very high	94.5	Very high	47 Å²	47	56.9 Å²	56.9	18%	0.178	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141	165.4	176.9	53.6	88.8	0	0	0	110.9	G178 S235 K237 T249	G178-W251 WeakPolarHBondContact O-CB 3.32Å; S235-W251 PolarHBondContact N-O 2.57Å; S235-W251 PolarHBondContact O-N 2.96Å; K237-W251 HydrophobicContact CB-CH2 3.62Å; K237-W251 HydrophobicContact CB-CZ3 3.95Å; T249-W251 WeakPolarHBondContact O-CZ3 3.5Å
252	L	96.5	Very high	94.8	Very high	29 Å²	29	54 Å²	54	15%	0.152	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	127.3	170	-175.3	69.7	0	0	0	109.9	A165 W177 G181 D182 L184 A232	A165-L252 HydrophobicContact CB-CB 4.21Å; A165-L252 HydrophobicContact CB-CD2 3.84Å; W177-L252 HydrophobicContact CH2-CB 4.01Å; W177-L252 VanDerWaalsContact CH2-N 3.28Å; W177-L252 HydrophobicContact CZ2-CB 4.38Å; G181-L252 CarbonylContact C-O 3.05Å; G181-L252 WeakPolarHBondContact CA-O 3.25Å; D182-L252 PolarHBondContact N-O 3.47Å; L184-L252 HydrophobicContact CB-CD2 4.21Å; L184-L252 HydrophobicContact CD2-CD2 4.37Å; A232-L252 HydrophobicContact CB-CD1 4.04Å
253	Q	97.3	Very high	95.4	Very high	71 Å²	71	49.1 Å²	49.1	33%	0.332	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	139.2	177.6	-173.5	171.1	-28.6	0	0	110.4	D233 S235	D233-Q253 PolarHBondContact N-O 3.18Å; D233-Q253 PolarHBondContact O-N 2.95Å; D233-Q253 VanDerWaalsContact O-O 3.12Å; S235-Q253 PolarHBondContact OG-OE1 3.37Å
254	L	98.1	Very high	96.2	Very high	4 Å²	4	46.3 Å²	46.3	2%	0.021	25%	0.251	C	S	.	.	P	Polyproline II helix	trans	-70	139.8	172.2	-60.8	-173.1	0	0	0	110.2	N146 D182 L184 V228 A232	N146-L254 HydrophobicContact CB-CD1 4.48Å; D182-L254 HydrophobicContact CB-CD1 4.33Å; D182-L254 HydrophobicContact CB-CD2 4.43Å; D182-L254 HydrophobicContact CB-CG 3.72Å; D182-L254 PolarHBondContact OD2-N 2.58Å; L184-L254 HydrophobicContact CB-CD2 4.21Å; L184-L254 HydrophobicContact CD1-CD2 3.9Å; L184-L254 HydrophobicContact CG-CD2 4.42Å; V228-L254 HydrophobicContact CG1-CD1 4.07Å; V228-L254 HydrophobicContact CG1-CD2 3.88Å; A232-L254 HydrophobicContact CB-CD2 3.92Å
255	A	98.1	Very high	96.5	Very high	18 Å²	18	44.9 Å²	44.9	15%	0.149	24%	0.239	C	C	.	.	P	Polyproline II helix	trans	-55.3	161.4	170	0	0	0	0	0	112.4	R150 L231 F257 K259	R150-A255 PolarHBondContact NH2-O 3.45Å; L231-A255 HydrophobicContact CB-CB 4Å; L231-A255 WeakPolarHBondContact O-CB 3.36Å; A255-F257 PolarHBondContact O-N 3.46Å; A255-K259 HydrophobicContact CB-CB 4.36Å; A255-K259 HydrophobicContact CB-CD 4.31Å
256	D	97.9	Very high	96.9	Very high	101 Å²	101	47.5 Å²	47.5	54%	0.54	24%	0.243	S	C	.	.	P	Polyproline II helix	trans	-55.4	136.4	164.8	-167.2	-69.1	0	0	0	109.7	R258 K259 V260	D256-R258 PolarHBondContact O-N 2.03Å; D256-R258 WeakPolarHBondContact OD1-CB 3.47Å; D256-R258 PolarHBondContact OD1-N 3.21Å; D256-K259 WeakPolarHBondContact O-CB 3.46Å; D256-K259 PolarHBondContact O-N 2.65Å; D256-V260 PolarHBondContact O-N 3.35Å
257	F	98.4	Very high	97.3	Very high	14 Å²	14	45.8 Å²	45.8	6%	0.061	22%	0.222	C	C	.	.	H	α-helix	trans	-63.8	-23.9	-176.4	-162.5	-106.9	0	0	0	112.6	M97 E101 I139 A142 N146 A255 K259 V260 G261	M97-F257 HydrophobicContact CG-CB 4.4Å; M97-F257 HydrophobicContact CG-CD1 3.45Å; M97-F257 VanDerWaalsContact CG-CD1 3.45Å; M97-F257 HydrophobicContact CG-CD2 4.37Å; M97-F257 HydrophobicContact CG-CE1 3.67Å; M97-F257 HydrophobicContact CG-CG 3.82Å; M97-F257 HydrophobicContact CG-CZ 4.23Å; M97-F257 HydrophobicContact SD-CB 3.86Å; M97-F257 HydrophobicContact SD-CD1 3.8Å; M97-F257 HydrophobicContact SD-CD2 3.65Å; M97-F257 HydrophobicContact SD-CE1 4.21Å; M97-F257 HydrophobicContact SD-CE2 4.09Å; M97-F257 HydrophobicContact SD-CG 3.48Å; M97-F257 WeakPolarHBondContact SD-CG 3.47Å; M97-F257 HydrophobicContact SD-CZ 4.34Å; E101-F257 HydrophobicContact CB-CD1 3.8Å; E101-F257 HydrophobicContact CB-CE1 3.59Å; E101-F257 HydrophobicContact CG-CD1 3.9Å; E101-F257 HydrophobicContact CG-CE1 3.91Å; I139-F257 HydrophobicContact CD1-CE1 3.73Å; I139-F257 HydrophobicContact CD1-CZ 3.63Å; I139-F257 HydrophobicContact CG1-CE1 4.14Å; I139-F257 HydrophobicContact CG1-CZ 4.1Å; A142-F257 HydrophobicContact CB-CE2 4.17Å; A142-F257 HydrophobicContact CB-CZ 4.38Å; N146-F257 HydrophobicContact CB-CD2 3.89Å; N146-F257 HydrophobicContact CB-CE2 4.06Å; A255-F257 PolarHBondContact O-N 3.46Å; F257-K259 VanDerWaalsContact C-N 3.33Å; F257-K259 PolarHBondContact O-N 3.35Å; F257-V260 HydrophobicContact CD2-CB 4.28Å; F257-V260 HydrophobicContact CD2-CG2 4.47Å; F257-V260 HydrophobicContact CE2-CG1 4.35Å; F257-V260 WeakPolarHBondContact O-CB 3.17Å; F257-V260 PolarHBondContact O-N 2.96Å; F257-G261 PolarHBondContact O-N 3.41Å
258	R	98.5	Very high	97.6	Very high	79 Å²	79	42.4 Å²	42.4	30%	0.298	20%	0.204	S	C	.	.	H	α-helix	trans	-58.3	-43.6	170	-179.3	50.8	48.5	78.9	-0.4	111.9	E101 Y104 D256 V260 G261 D262	E101-R258 VanDerWaalsContact CD-NE 3.26Å; E101-R258 VanDerWaalsContact OE1-CD 3.3Å; E101-R258 WeakPolarHBondContact OE1-CD 3.32Å; E101-R258 IonicContact OE1-CZ 2.66Å; E101-R258 IonicContact OE1-NE 3.32Å; E101-R258 PolarHBondContact OE1-NE 3.28Å; E101-R258 IonicContact OE2-CZ 3.11Å; E101-R258 IonicContact OE2-NE 2.89Å; E101-R258 PolarHBondContact OE2-NE 3.15Å; E101-R258 IonicContact OE2-NH2 3.86Å; E101-R258 PolarHBondContact OE2-NH2 3.47Å; Y104-R258 VanDerWaalsContact CD1-NE 3.35Å; Y104-R258 VanDerWaalsContact CG-CZ 3.5Å; Y104-R258 VanDerWaalsContact CZ-CZ 3.44Å; Y104-R258 PolarHBondContact OH-NH1 2.98Å; D256-R258 PolarHBondContact O-N 2.03Å; D256-R258 WeakPolarHBondContact OD1-CB 3.47Å; D256-R258 PolarHBondContact OD1-N 3.21Å; R258-V260 VanDerWaalsContact C-N 3.27Å; R258-V260 PolarHBondContact O-N 3.3Å; R258-G261 WeakPolarHBondContact O-CA 3.39Å; R258-G261 PolarHBondContact O-N 2.86Å; R258-G261 VanDerWaalsContact O-N 3.12Å; R258-D262 PolarHBondContact O-N 3.4Å
259	K	98.6	Very high	97.8	Very high	132 Å²	132	44.2 Å²	44.2	57%	0.574	22%	0.216	S	C	*	.	H	α-helix	trans	-62.7	-35.7	176.7	-66.7	-174.4	175.8	-176	0	112	A255 D256 F257 A263	A255-K259 HydrophobicContact CB-CB 4.36Å; A255-K259 HydrophobicContact CB-CD 4.31Å; D256-K259 WeakPolarHBondContact O-CB 3.46Å; D256-K259 PolarHBondContact O-N 2.65Å; F257-K259 VanDerWaalsContact C-N 3.33Å; F257-K259 PolarHBondContact O-N 3.35Å; K259-A263 WeakPolarHBondContact O-CB 3.39Å; K259-A263 PolarHBondContact O-N 3.46Å
260	V	98.8	Very high	97.8	Very high	2 Å²	2	46.8 Å²	46.8	1%	0.012	24%	0.235	C	C	.	.	H	α-helix	trans	-66.5	-44.5	174.2	-179.7	0	0	0	0	110.4	A142 A227 V228 L231 D256 F257 R258 A263 L264	A142-V260 HydrophobicContact CB-CG1 4.09Å; A227-V260 HydrophobicContact CB-CG1 4.21Å; V228-V260 HydrophobicContact CG2-CG1 3.9Å; V228-V260 HydrophobicContact CG2-CG2 4.28Å; L231-V260 HydrophobicContact CD1-CB 4.38Å; L231-V260 HydrophobicContact CD1-CG2 3.99Å; D256-V260 PolarHBondContact O-N 3.35Å; F257-V260 HydrophobicContact CD2-CB 4.28Å; F257-V260 HydrophobicContact CD2-CG2 4.47Å; F257-V260 HydrophobicContact CE2-CG1 4.35Å; F257-V260 WeakPolarHBondContact O-CB 3.17Å; F257-V260 PolarHBondContact O-N 2.96Å; R258-V260 VanDerWaalsContact C-N 3.27Å; R258-V260 PolarHBondContact O-N 3.3Å; V260-A263 PolarHBondContact O-N 3.2Å; V260-L264 HydrophobicContact CG1-CD1 4.07Å; V260-L264 WeakPolarHBondContact O-CB 3.42Å; V260-L264 WeakPolarHBondContact O-CG 3.41Å; V260-L264 PolarHBondContact O-N 3.21Å
261	G	98.5	Very high	97.8	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-58.3	-46.6	174.6	0	0	0	0	0	112.7	F257 R258 L264 K265	F257-G261 PolarHBondContact O-N 3.41Å; R258-G261 WeakPolarHBondContact O-CA 3.39Å; R258-G261 PolarHBondContact O-N 2.86Å; R258-G261 VanDerWaalsContact O-N 3.12Å; G261-L264 PolarHBondContact O-N 2.75Å; G261-K265 WeakPolarHBondContact O-CB 3.34Å; G261-K265 PolarHBondContact O-N 3.02Å
262	D	98.7	Very high	97.8	Very high	67 Å²	67	46.6 Å²	46.6	36%	0.358	24%	0.243	S	C	.	.	H	α-helix	trans	-61.6	-48.7	177.9	-63.7	-28.1	0	0	0	110.9	Q105 R258 L264 K265 E266	Q105-D262 PolarHBondContact NE2-OD1 2.73Å; R258-D262 PolarHBondContact O-N 3.4Å; D262-L264 PolarHBondContact O-N 3.47Å; D262-K265 WeakPolarHBondContact O-CB 3.36Å; D262-K265 PolarHBondContact O-N 3.27Å; D262-E266 PolarHBondContact O-N 2.99Å
263	A	98.7	Very high	97.8	Very high	26 Å²	26	47.4 Å²	47.4	22%	0.215	25%	0.249	C	C	.	.	H	α-helix	trans	-62.4	-42.2	178.1	0	0	0	0	0	112.7	L231 K259 V260 K265 E266 K267	L231-A263 HydrophobicContact CD1-CB 3.82Å; K259-A263 WeakPolarHBondContact O-CB 3.39Å; K259-A263 PolarHBondContact O-N 3.46Å; V260-A263 PolarHBondContact O-N 3.2Å; A263-K265 VanDerWaalsContact C-N 3.26Å; A263-K265 PolarHBondContact O-N 2.79Å; A263-E266 PolarHBondContact O-N 3.39Å; A263-K267 WeakPolarHBondContact O-CG 3.41Å; A263-K267 PolarHBondContact O-N 2.8Å
264	L	98.8	Very high	97.8	Very high	2 Å²	2	44.7 Å²	44.7	1%	0.01	24%	0.237	C	C	.	.	H	α-helix	trans	-67.6	-29.9	174.4	-73.6	175.9	0	0	0	111.9	F135 A138 I139 A142 A227 V260 G261 D262 K267 Y268	F135-L264 HydrophobicContact CD2-CB 4.16Å; F135-L264 HydrophobicContact CE2-CB 3.68Å; F135-L264 HydrophobicContact CZ-CB 4.49Å; A138-L264 HydrophobicContact CB-CD1 4.24Å; A138-L264 HydrophobicContact CB-CD2 3.98Å; I139-L264 HydrophobicContact CB-CD1 4.26Å; I139-L264 HydrophobicContact CD1-CD1 3.76Å; A142-L264 HydrophobicContact CB-CD1 4.26Å; A227-L264 HydrophobicContact CB-CD1 4.38Å; A227-L264 HydrophobicContact CB-CD2 3.71Å; A227-L264 HydrophobicContact CB-CG 3.89Å; V260-L264 HydrophobicContact CG1-CD1 4.07Å; V260-L264 WeakPolarHBondContact O-CB 3.42Å; V260-L264 WeakPolarHBondContact O-CG 3.41Å; V260-L264 PolarHBondContact O-N 3.21Å; G261-L264 PolarHBondContact O-N 2.75Å; D262-L264 PolarHBondContact O-N 3.47Å; L264-K267 PolarHBondContact O-N 2.66Å; L264-Y268 PolarHBondContact O-N 2.82Å
265	K	98.3	Very high	97.6	Very high	20 Å²	20	49.7 Å²	49.7	9%	0.087	26%	0.258	C	S	.	.	H	α-helix	trans	-71.7	-34.1	179.5	177.5	62.7	-160.7	61.3	0	111.6	Q105 F106 F135 G261 D262 A263 Y268 D269	Q105-K265 HydrophobicContact CB-CD 4.25Å; Q105-K265 HydrophobicContact CB-CG 4.47Å; Q105-K265 HydrophobicContact CG-CB 4.34Å; F106-K265 HydrophobicContact CE2-CD 4.07Å; F106-K265 HydrophobicContact CZ-CD 4.05Å; F135-K265 HydrophobicContact CE2-CB 4.14Å; G261-K265 WeakPolarHBondContact O-CB 3.34Å; G261-K265 PolarHBondContact O-N 3.02Å; D262-K265 WeakPolarHBondContact O-CB 3.36Å; D262-K265 PolarHBondContact O-N 3.27Å; A263-K265 VanDerWaalsContact C-N 3.26Å; A263-K265 PolarHBondContact O-N 2.79Å; K265-Y268 HydrophobicContact CD-CD1 4.19Å; K265-Y268 WeakPolarHBondContact O-CB 3.29Å; K265-Y268 PolarHBondContact O-N 3.07Å; K265-D269 IonicContact NZ-OD1 2.86Å; K265-D269 PolarHBondContact NZ-OD1 3.48Å; K265-D269 IonicContact NZ-OD2 3.53Å; K265-D269 PolarHBondContact NZ-OD2 3.35Å; K265-D269 PolarHBondContact O-N 2.76Å
266	E	98.1	Very high	97.5	Very high	137 Å²	137	50.9 Å²	50.9	64%	0.64	26%	0.262	S	S	*	.	H	α-helix	trans	-62.8	-46.7	167.7	-68.3	176.1	-178.8	0	0	110.8	D262 A263 Y268 D269 S270	D262-E266 PolarHBondContact O-N 2.99Å; A263-E266 PolarHBondContact O-N 3.39Å; E266-Y268 PolarHBondContact O-N 3.11Å; E266-D269 PolarHBondContact O-N 3.41Å; E266-D269 VanDerWaalsContact O-N 3.1Å; E266-S270 PolarHBondContact O-N 3.27Å
267	K	98.3	Very high	97.3	Very high	66 Å²	66	48.5 Å²	48.5	29%	0.287	25%	0.249	S	C	.	.	H	α-helix	trans	-62.7	-28.7	176.2	-64	-57.4	-172.1	175.8	0	113.6	A263 L264 S270 A271 N295 D296 L297	A263-K267 WeakPolarHBondContact O-CG 3.41Å; A263-K267 PolarHBondContact O-N 2.8Å; L264-K267 PolarHBondContact O-N 2.66Å; K267-S270 CarbonylContact O-C 3.52Å; K267-A271 WeakPolarHBondContact O-CA 3.42Å; K267-A271 PolarHBondContact O-N 2.77Å; K267-A271 VanDerWaalsContact O-N 3.1Å; K267-N295 WeakPolarHBondContact CE-O 3.4Å; K267-D296 IonicContact NZ-OD1 3.31Å; K267-D296 PolarHBondContact NZ-OD1 3.17Å; K267-L297 HydrophobicContact CB-CD1 4.16Å; K267-L297 HydrophobicContact CB-CG 3.91Å
268	Y	97.9	Very high	96.9	Very high	9 Å²	9	54.5 Å²	54.5	4%	0.035	29%	0.293	C	S	.	.	H	α-helix	trans	-67.6	-41.9	172.8	161.8	-84.9	0	0	0	112.1	F106 R131 E132 F135 L264 K265 E266 S270 A271	F106-Y268 HydrophobicContact CE1-CD1 4.28Å; F106-Y268 HydrophobicContact CE1-CD2 4.36Å; F106-Y268 AromaticContact CE1-CE1 3.77Å; F106-Y268 HydrophobicContact CE1-CE1 3.77Å; F106-Y268 AromaticContact CE1-CE2 3.83Å; F106-Y268 HydrophobicContact CE1-CE2 3.83Å; F106-Y268 AromaticContact CE1-CZ 3.53Å; F106-Y268 AromaticContact CZ-CD1 3.96Å; F106-Y268 HydrophobicContact CZ-CD1 3.96Å; F106-Y268 AromaticContact CZ-CD2 3.78Å; F106-Y268 HydrophobicContact CZ-CD2 3.78Å; F106-Y268 AromaticContact CZ-CE1 3.91Å; F106-Y268 HydrophobicContact CZ-CE1 3.91Å; F106-Y268 AromaticContact CZ-CE2 3.72Å; F106-Y268 HydrophobicContact CZ-CE2 3.72Å; F106-Y268 AromaticContact CZ-CG 3.9Å; F106-Y268 HydrophobicContact CZ-CG 3.9Å; F106-Y268 AromaticContact CZ-CZ 3.8Å; R131-Y268 HydrophobicContact CB-CD2 4.02Å; R131-Y268 HydrophobicContact CB-CE2 3.58Å; R131-Y268 WeakPolarHBondContact O-CD2 3.29Å; E132-Y268 HydrophobicContact CG-CE2 4.19Å; E132-Y268 PolarHBondContact OE1-OH 3.38Å; F135-Y268 HydrophobicContact CB-CD2 3.87Å; F135-Y268 HydrophobicContact CB-CG 4.45Å; L264-Y268 PolarHBondContact O-N 2.82Å; K265-Y268 HydrophobicContact CD-CD1 4.19Å; K265-Y268 WeakPolarHBondContact O-CB 3.29Å; K265-Y268 PolarHBondContact O-N 3.07Å; E266-Y268 PolarHBondContact O-N 3.11Å; Y268-S270 PolarHBondContact O-N 2.88Å; Y268-A271 WeakPolarHBondContact O-CB 3.23Å; Y268-A271 PolarHBondContact O-N 3.38Å
269	D	96	Very high	96.6	Very high	81 Å²	81	61.4 Å²	61.4	43%	0.433	32%	0.319	S	S	.	.	H	α-helix	trans	-66.4	-30.1	-179.7	-70.6	-35.5	0	0	0	111.3	R109 K265 E266	R109-D269 IonicContact NH2-OD1 2.67Å; R109-D269 PolarHBondContact NH2-OD1 3.23Å; R109-D269 VanDerWaalsContact NH2-OD1 3.11Å; K265-D269 IonicContact NZ-OD1 2.86Å; K265-D269 PolarHBondContact NZ-OD1 3.48Å; K265-D269 IonicContact NZ-OD2 3.53Å; K265-D269 PolarHBondContact NZ-OD2 3.35Å; K265-D269 PolarHBondContact O-N 2.76Å; E266-D269 PolarHBondContact O-N 3.41Å; E266-D269 VanDerWaalsContact O-N 3.1Å
270	S	95.4	Very high	96.3	Very high	78 Å²	78	55.7 Å²	55.7	55%	0.545	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.7	19.6	177	74.6	0	0	0	0	114.6	E266 K267 Y268	E266-S270 PolarHBondContact O-N 3.27Å; K267-S270 CarbonylContact O-C 3.52Å; Y268-S270 PolarHBondContact O-N 2.88Å
271	A	97.1	Very high	96.1	Very high	15 Å²	15	62.2 Å²	62.2	12%	0.124	33%	0.325	C	S	.	.	P	Polyproline II helix	trans	-64.1	137.4	-175.1	0	0	0	0	0	112.2	R131 K267 Y268 L297	R131-A271 HydrophobicContact CG-CB 4.18Å; K267-A271 WeakPolarHBondContact O-CA 3.42Å; K267-A271 PolarHBondContact O-N 2.77Å; K267-A271 VanDerWaalsContact O-N 3.1Å; Y268-A271 WeakPolarHBondContact O-CB 3.23Å; Y268-A271 PolarHBondContact O-N 3.38Å; A271-L297 CarbonylContact C-O 3.49Å; A271-L297 VanDerWaalsContact CA-O 3.31Å; A271-L297 WeakPolarHBondContact CA-O 3.44Å; A271-L297 HydrophobicContact CB-CB 3.97Å
272	A	96.6	Very high	95.9	Very high	28 Å²	28	63.2 Å²	63.2	23%	0.231	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	133.8	-175.4	0	0	0	0	0	112.5	M274 P292 L297 V298 H299	A272-M274 HydrophobicContact CB-SD 4.2Å; A272-P292 HydrophobicContact CB-CB 4.22Å; A272-P292 HydrophobicContact CB-CG 4.25Å; A272-L297 PolarHBondContact N-O 3.1Å; A272-V298 HydrophobicContact CB-CG1 4.44Å; A272-V298 WeakPolarHBondContact O-CA 3.1Å; A272-H299 PolarHBondContact O-CD2 2.9Å; A272-H299 PolarHBondContact O-N 3.14Å
273	V	96.3	Very high	95.7	Very high	46 Å²	46	61.8 Å²	61.8	28%	0.279	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	127.2	171.7	-165.7	0	0	0	0	109.2	M285 H299	V273-M285 HydrophobicContact CB-CB 4.15Å; V273-M285 HydrophobicContact CG1-CB 4.06Å; V273-M285 HydrophobicContact CG1-SD 3.68Å; V273-M285 WeakPolarHBondContact O-CB 3.06Å; V273-M285 PolarHBondContact O-N 2.9Å; V273-H299 CarbonylContact C-O 3.49Å; V273-H299 WeakPolarHBondContact CA-O 3.17Å; V273-H299 VanDerWaalsContact CG2-NE2 3.32Å; V273-H299 WeakPolarHBondContact CG2-NE2 3.31Å
274	M	96.6	Very high	95.5	Very high	14 Å²	14	62.2 Å²	62.2	7%	0.069	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	153.7	-175.7	-54.6	-60.7	-81.7	0	0	111.8	A272 L282 V283 P284 P292 V298 H299 I300	A272-M274 HydrophobicContact CB-SD 4.2Å; M274-L282 HydrophobicContact CB-CB 4.49Å; M274-L282 HydrophobicContact CB-CD2 4.1Å; M274-L282 HydrophobicContact CE-CB 4.12Å; M274-V283 CarbonylContact C-O 3.56Å; M274-V283 WeakPolarHBondContact CA-O 3.49Å; M274-V283 VanDerWaalsContact CE-C 3.45Å; M274-P284 HydrophobicContact CE-CG 4.44Å; M274-P284 HydrophobicContact SD-CG 4.39Å; M274-P292 HydrophobicContact CE-CG 3.75Å; M274-P292 HydrophobicContact SD-CG 3.83Å; M274-V298 HydrophobicContact CG-CB 3.63Å; M274-V298 HydrophobicContact CG-CG1 3.95Å; M274-V298 HydrophobicContact CG-CG2 4.42Å; M274-V298 HydrophobicContact SD-CB 4.48Å; M274-V298 HydrophobicContact SD-CG1 4.15Å; M274-H299 PolarHBondContact N-O 3.24Å; M274-I300 HydrophobicContact CB-CG2 4.29Å
275	K	94.9	Very high	95.2	Very high	109 Å²	109	66.3 Å²	66.3	47%	0.474	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	161.9	170.3	68.4	-174.9	177.7	-162.3	0	110.4	L282 V283 M285	K275-L282 WeakPolarHBondContact O-CA 3.46Å; K275-V283 HydrophobicContact CG-CG2 3.97Å; K275-V283 PolarHBondContact N-O 3.4Å; K275-V283 WeakPolarHBondContact O-CG2 3.31Å; K275-V283 PolarHBondContact O-N 3.23Å; K275-M285 HydrophobicContact CD-CG 4.39Å; K275-M285 PolarHBondContact NZ-O 3.39Å
276	L	95	Very high	94.8	Very high	43 Å²	43	70 Å²	70	23%	0.225	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	137.2	170.5	-69	178	0	0	0	110.7	G207 S208 A212 G280 L282	G207-L276 WeakPolarHBondContact O-CD1 3.06Å; S208-L276 WeakPolarHBondContact O-CD1 3.44Å; A212-L276 HydrophobicContact CB-CD1 3.73Å; A212-L276 HydrophobicContact CB-CD2 3.97Å; A212-L276 HydrophobicContact CB-CG 3.7Å; L276-G280 WeakPolarHBondContact CD2-O 3.34Å; L276-L282 HydrophobicContact CD2-CD2 3.88Å; L276-L282 HydrophobicContact CD2-CG 4.35Å; L276-L282 HydrophobicContact CG-CD2 4.46Å
277	N	93.6	Very high	94.1	Very high	51 Å²	51	69.3 Å²	69.3	27%	0.273	37%	0.372	S	S	.	.			trans	-84.2	174.5	164.9	71	10.7	0	0	0	111.2	R279 G280 K281 V283	N277-R279 PolarHBondContact O-N 3.2Å; N277-R279 WeakPolarHBondContact OD1-CA 3.3Å; N277-R279 WeakPolarHBondContact OD1-CB 3.37Å; N277-R279 PolarHBondContact OD1-N 3.22Å; N277-G280 PolarHBondContact O-N 3.34Å; N277-G280 PolarHBondContact OD1-N 3.23Å; N277-G280 VanDerWaalsContact OD1-N 3.09Å; N277-K281 PolarHBondContact N-O 2.94Å; N277-K281 PolarHBondContact OD1-N 2.96Å; N277-K281 PolarHBondContact OD1-O 3.43Å; N277-V283 HydrophobicContact CB-CG1 4.14Å; N277-V283 HydrophobicContact CB-CG2 4.02Å
278	S	91.3	Very high	93.6	Very high	139 Å²	139	72 Å²	72	97%	0.972	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.9	-16.7	178.1	-41.1	0	0	0	0	114.2
279	R	92.1	Very high	93	Very high	225 Å²	225	77.9 Å²	77.9	85%	0.849	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92	1.8	175.6	-57.9	-177.1	-173.5	166.4	2.5	112.8	N277	N277-R279 PolarHBondContact O-N 3.2Å; N277-R279 WeakPolarHBondContact OD1-CA 3.3Å; N277-R279 WeakPolarHBondContact OD1-CB 3.37Å; N277-R279 PolarHBondContact OD1-N 3.22Å
280	G	92.4	Very high	92.6	Very high	11 Å²	11	81.7 Å²	81.7	11%	0.113	44%	0.436	C	S	.	.	S	Bend	trans	73.2	21.1	-178.3	0	0	0	0	0	114.6	Q215 L276 N277	Q215-G280 PolarHBondContact NE2-O 3.26Å; L276-G280 WeakPolarHBondContact CD2-O 3.34Å; N277-G280 PolarHBondContact O-N 3.34Å; N277-G280 PolarHBondContact OD1-N 3.23Å; N277-G280 VanDerWaalsContact OD1-N 3.09Å
281	K	93.3	Very high	92.4	Very high	139 Å²	139	81.5 Å²	81.5	60%	0.604	44%	0.44	S	S	*	.			trans	-98.1	139.8	174.2	-173.5	-176	176.1	-178	0	110.2	N277 V283	N277-K281 PolarHBondContact N-O 2.94Å; N277-K281 PolarHBondContact OD1-N 2.96Å; N277-K281 PolarHBondContact OD1-O 3.43Å; K281-V283 PolarHBondContact O-N 3.42Å
282	L	94.3	Very high	92.3	Very high	21 Å²	21	82.2 Å²	82.2	11%	0.11	44%	0.443	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.3	126.7	168.5	-70.5	-179.2	0	0	0	111.2	A212 Q215 M216 M274 K275 L276 I300	A212-L282 HydrophobicContact CB-CD2 4.07Å; Q215-L282 HydrophobicContact CB-CD1 3.5Å; Q215-L282 HydrophobicContact CB-CG 3.86Å; M216-L282 HydrophobicContact CB-CD1 4.22Å; M274-L282 HydrophobicContact CB-CB 4.49Å; M274-L282 HydrophobicContact CB-CD2 4.1Å; M274-L282 HydrophobicContact CE-CB 4.12Å; K275-L282 WeakPolarHBondContact O-CA 3.46Å; L276-L282 HydrophobicContact CD2-CD2 3.88Å; L276-L282 HydrophobicContact CD2-CG 4.35Å; L276-L282 HydrophobicContact CG-CD2 4.46Å; L282-I300 HydrophobicContact CD2-CG2 3.94Å
283	V	94.7	Very high	92.3	Very high	38 Å²	38	84.2 Å²	84.2	23%	0.23	45%	0.452	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	154	174.1	-63.4	0	0	0	0	109.5	M274 K275 N277 K281 M285	M274-V283 CarbonylContact C-O 3.56Å; M274-V283 WeakPolarHBondContact CA-O 3.49Å; M274-V283 VanDerWaalsContact CE-C 3.45Å; K275-V283 HydrophobicContact CG-CG2 3.97Å; K275-V283 PolarHBondContact N-O 3.4Å; K275-V283 WeakPolarHBondContact O-CG2 3.31Å; K275-V283 PolarHBondContact O-N 3.23Å; N277-V283 HydrophobicContact CB-CG1 4.14Å; N277-V283 HydrophobicContact CB-CG2 4.02Å; K281-V283 PolarHBondContact O-N 3.42Å; V283-M285 PolarHBondContact O-N 3.33Å
284	P	95.3	Very high	92.3	Very high	34 Å²	34	84 Å²	84	22%	0.221	45%	0.453	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-52.8	137.3	174.1	-26.4	35.5	0	0	0	111.5	M274 H286	M274-P284 HydrophobicContact CE-CG 4.44Å; M274-P284 HydrophobicContact SD-CG 4.39Å; P284-H286 PolarHBondContact O-N 3.27Å
285	M	92.8	Very high	92.3	Very high	88 Å²	88	85.9 Å²	85.9	43%	0.433	46%	0.463	S	S	.	.	S	Bend	trans	-61.9	-39	177	-177.2	169.2	-178.9	0	0	111.1	V273 K275 V283	V273-M285 HydrophobicContact CB-CB 4.15Å; V273-M285 HydrophobicContact CG1-CB 4.06Å; V273-M285 HydrophobicContact CG1-SD 3.68Å; V273-M285 WeakPolarHBondContact O-CB 3.06Å; V273-M285 PolarHBondContact O-N 2.9Å; K275-M285 HydrophobicContact CD-CG 4.39Å; K275-M285 PolarHBondContact NZ-O 3.39Å; V283-M285 PolarHBondContact O-N 3.33Å
286	H	89.7	Confident	92.5	Very high	97 Å²	97	82.2 Å²	82.2	45%	0.449	45%	0.449	S	S	.	.	S	Bend	trans	-109.3	119.5	-179.2	-61.3	-71.8	0	0	0	110	P284 N288 F289	P284-H286 PolarHBondContact O-N 3.27Å; H286-N288 VanDerWaalsContact C-N 3.3Å; H286-N288 WeakPolarHBondContact CB-OD1 3.34Å; H286-N288 PolarHBondContact O-N 3.11Å; H286-F289 HydrophobicContact CB-CD2 3.52Å; H286-F289 HydrophobicContact CB-CE2 3.75Å; H286-F289 PolarHBondContact O-N 3.03Å
287	S	83.8	Confident	92.7	Very high	123 Å²	123	80.2 Å²	80.2	86%	0.86	44%	0.438	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.5	-12.4	-171.6	53	0	0	0	0	114.9	F289	S287-F289 VanDerWaalsContact C-N 3.26Å
288	N	86.3	Confident	92.9	Very high	123 Å²	123	77.9 Å²	77.9	66%	0.658	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.3	-8.7	176.8	60	-48.2	0	0	0	113.2	H286	H286-N288 VanDerWaalsContact C-N 3.3Å; H286-N288 WeakPolarHBondContact CB-OD1 3.34Å; H286-N288 PolarHBondContact O-N 3.11Å
289	F	85	Confident	93.2	Very high	133 Å²	133	71.7 Å²	71.7	58%	0.583	38%	0.382	S	S	*	.	S	Bend	trans	-97.7	147.2	176.3	-64.8	-85	0	0	0	111.3	H286 S287	H286-F289 HydrophobicContact CB-CD2 3.52Å; H286-F289 HydrophobicContact CB-CE2 3.75Å; H286-F289 PolarHBondContact O-N 3.03Å; S287-F289 VanDerWaalsContact C-N 3.26Å
290	N	87.9	Confident	93.4	Very high	160 Å²	160	62.1 Å²	62.1	86%	0.856	35%	0.347	S	S	*	.	P	Polyproline II helix	trans	-59.9	144.5	172	-69.5	-32.8	0	0	0	110.4
291	A	91.3	Very high	93.5	Very high	75 Å²	75	63.5 Å²	63.5	62%	0.62	35%	0.352	S	S	*	.	P	Polyproline II helix	trans	-61.8	134.4	174.1	0	0	0	0	0	109.9
292	P	94.8	Very high	93.5	Very high	29 Å²	29	64.9 Å²	64.9	19%	0.188	36%	0.36	C	S	.	.	P	Polyproline II helix	trans	-63.3	140.8	179.9	25.1	-33.2	0	0	0	110.6	A272 M274 D296 V298	A272-P292 HydrophobicContact CB-CB 4.22Å; A272-P292 HydrophobicContact CB-CG 4.25Å; M274-P292 HydrophobicContact CE-CG 3.75Å; M274-P292 HydrophobicContact SD-CG 3.83Å; P292-D296 HydrophobicContact CB-CB 3.96Å; P292-V298 HydrophobicContact CB-CG1 3.85Å; P292-V298 HydrophobicContact CG-CG1 3.64Å
293	T	96.6	Very high	93.5	Very high	70 Å²	70	65.5 Å²	65.5	43%	0.429	37%	0.367	S	S	.	.	P	Polyproline II helix	trans	-78.6	172.9	172.7	72.2	0	0	0	0	110.6	H219 N295 D296	H219-T293 PolarHBondContact CE1-O 2.77Å; H219-T293 VanDerWaalsContact CE1-O 3.22Å; H219-T293 PolarHBondContact NE2-O 3.06Å; T293-N295 PolarHBondContact O-N 3.43Å; T293-N295 PolarHBondContact OG1-N 2.9Å; T293-D296 WeakPolarHBondContact CA-OD2 3.44Å; T293-D296 WeakPolarHBondContact CB-OD2 3.49Å; T293-D296 PolarHBondContact N-OD2 3.13Å; T293-D296 PolarHBondContact O-N 3.23Å; T293-D296 VanDerWaalsContact O-N 3.14Å; T293-D296 VanDerWaalsContact OG1-CG 3.29Å; T293-D296 PolarHBondContact OG1-OD2 3.4Å
294	S	96.7	Very high	93.3	Very high	42 Å²	42	65.1 Å²	65.1	29%	0.294	37%	0.365	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.3	-9.3	172.5	50.1	0	0	0	0	114	A223 R226	A223-S294 WeakPolarHBondContact CA-O 3.49Å; A223-S294 WeakPolarHBondContact CB-O 3.2Å; R226-S294 WeakPolarHBondContact CD-O 3.18Å; R226-S294 VanDerWaalsContact CZ-OG 3.29Å; R226-S294 PolarHBondContact NE-OG 3.47Å; R226-S294 PolarHBondContact NH1-OG 3.03Å
295	N	97.6	Very high	93.1	Very high	53 Å²	53	67.9 Å²	67.9	28%	0.283	38%	0.378	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.5	-9.6	174.1	-63.1	-30.6	0	0	0	112.7	R226 N230 K267 T293	R226-N295 WeakPolarHBondContact CB-OD1 3.25Å; R226-N295 WeakPolarHBondContact CD-OD1 3.39Å; N230-N295 PolarHBondContact ND2-OD1 2.9Å; N230-N295 VanDerWaalsContact ND2-OD1 3.15Å; K267-N295 WeakPolarHBondContact CE-O 3.4Å; T293-N295 PolarHBondContact O-N 3.43Å; T293-N295 PolarHBondContact OG1-N 2.9Å
296	D	98.1	Very high	93.1	Very high	32 Å²	32	64.5 Å²	64.5	17%	0.171	36%	0.36	C	S	.	.	S	Bend	trans	-96.1	147.8	-176	-57.3	-46.7	0	0	0	110.5	H219 K267 P292 T293	H219-D296 PolarHBondContact CD2-O 3.05Å; H219-D296 PolarHBondContact NE2-O 2.93Å; K267-D296 IonicContact NZ-OD1 3.31Å; K267-D296 PolarHBondContact NZ-OD1 3.17Å; P292-D296 HydrophobicContact CB-CB 3.96Å; T293-D296 WeakPolarHBondContact CA-OD2 3.44Å; T293-D296 WeakPolarHBondContact CB-OD2 3.49Å; T293-D296 PolarHBondContact N-OD2 3.13Å; T293-D296 PolarHBondContact O-N 3.23Å; T293-D296 VanDerWaalsContact O-N 3.14Å; T293-D296 VanDerWaalsContact OG1-CG 3.29Å; T293-D296 PolarHBondContact OG1-OD2 3.4Å
297	L	98.5	Very high	93.3	Very high	1 Å²	1	60.2 Å²	60.2	1%	0.005	34%	0.341	C	S	.	.			trans	-85	145.6	174.8	-62.2	-176.9	0	0	0	110.7	A134 F135 A138 N220 A223 K267 A271 A272	A134-L297 HydrophobicContact CB-CB 4.31Å; F135-L297 HydrophobicContact CB-CD1 4.29Å; F135-L297 HydrophobicContact CD2-CD1 4.43Å; A138-L297 HydrophobicContact CB-CD2 3.54Å; N220-L297 HydrophobicContact CB-CD2 4.3Å; N220-L297 WeakPolarHBondContact OD1-CA 3.22Å; A223-L297 HydrophobicContact CB-CD2 3.81Å; K267-L297 HydrophobicContact CB-CD1 4.16Å; K267-L297 HydrophobicContact CB-CG 3.91Å; A271-L297 CarbonylContact C-O 3.49Å; A271-L297 VanDerWaalsContact CA-O 3.31Å; A271-L297 WeakPolarHBondContact CA-O 3.44Å; A271-L297 HydrophobicContact CB-CB 3.97Å; A272-L297 PolarHBondContact N-O 3.1Å
298	V	98	Very high	93.7	Very high	2 Å²	2	59.4 Å²	59.4	1%	0.012	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	146.3	179.3	-59.9	0	0	0	0	111.1	A134 M216 H219 N220 A272 M274 P292	A134-V298 VanDerWaalsContact CB-O 3.25Å; A134-V298 WeakPolarHBondContact CB-O 3.39Å; M216-V298 HydrophobicContact CG-CG2 4.05Å; M216-V298 VanDerWaalsContact CG-O 3.28Å; M216-V298 WeakPolarHBondContact CG-O 3.46Å; H219-V298 HydrophobicContact CB-CG2 4.02Å; H219-V298 VanDerWaalsContact CD2-CG2 3.47Å; H219-V298 WeakPolarHBondContact CD2-CG2 3.33Å; N220-V298 PolarHBondContact ND2-O 3.06Å; N220-V298 PolarHBondContact OD1-N 3.48Å; N220-V298 PolarHBondContact OD1-O 3.06Å; A272-V298 HydrophobicContact CB-CG1 4.44Å; A272-V298 WeakPolarHBondContact O-CA 3.1Å; M274-V298 HydrophobicContact CG-CB 3.63Å; M274-V298 HydrophobicContact CG-CG1 3.95Å; M274-V298 HydrophobicContact CG-CG2 4.42Å; M274-V298 HydrophobicContact SD-CB 4.48Å; M274-V298 HydrophobicContact SD-CG1 4.15Å; P292-V298 HydrophobicContact CB-CG1 3.85Å; P292-V298 HydrophobicContact CG-CG1 3.64Å
299	H	97.3	Very high	93.8	Very high	9 Å²	9	60.8 Å²	60.8	4%	0.042	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	156.8	176.6	75.4	101.2	0	0	0	111	G129 R131 A134 M216 A272 V273 M274 D301	G129-H299 WeakPolarHBondContact O-CB 3.44Å; R131-H299 HydrophobicContact CG-CB 4.3Å; R131-H299 WeakPolarHBondContact CG-CD2 3.17Å; R131-H299 WeakPolarHBondContact CG-NE2 3.23Å; A134-H299 HydrophobicContact CB-CB 4.45Å; M216-H299 HydrophobicContact SD-CB 4.48Å; A272-H299 PolarHBondContact O-CD2 2.9Å; A272-H299 PolarHBondContact O-N 3.14Å; V273-H299 CarbonylContact C-O 3.49Å; V273-H299 WeakPolarHBondContact CA-O 3.17Å; V273-H299 VanDerWaalsContact CG2-NE2 3.32Å; V273-H299 WeakPolarHBondContact CG2-NE2 3.31Å; M274-H299 PolarHBondContact N-O 3.24Å; H299-D301 PolarHBondContact CE1-O 2.87Å; H299-D301 PolarHBondContact ND1-O 3.07Å
300	I	96.7	Very high	93.8	Very high	25 Å²	25	57.7 Å²	57.7	13%	0.128	32%	0.316	C	S	.	.	S	Bend	trans	-114.3	-19.8	-175.6	61.6	175.2	0	0	0	113.1	G129 Y209 A212 R213 M216 M274 L282	G129-I300 PolarHBondContact O-N 3.19Å; Y209-I300 HydrophobicContact CD2-CD1 4.27Å; Y209-I300 HydrophobicContact CE2-CD1 3.74Å; Y209-I300 HydrophobicContact CE2-CG1 4.38Å; A212-I300 HydrophobicContact CB-CD1 3.98Å; A212-I300 HydrophobicContact CB-CG2 4.41Å; R213-I300 HydrophobicContact CB-CD1 3.9Å; M216-I300 HydrophobicContact CB-CG2 4.28Å; M216-I300 HydrophobicContact CG-CG2 4.44Å; M216-I300 HydrophobicContact SD-CB 4.47Å; M216-I300 HydrophobicContact SD-CD1 4.46Å; M216-I300 HydrophobicContact SD-CG1 3.87Å; M216-I300 HydrophobicContact SD-CG2 4.25Å; M274-I300 HydrophobicContact CB-CG2 4.29Å; L282-I300 HydrophobicContact CD2-CG2 3.94Å
301	D	94.9	Very high	93.4	Very high	40 Å²	40	56.2 Å²	56.2	21%	0.214	30%	0.304	C	S	.	.	S	Bend	trans	-118.3	151.8	179.2	-62.2	-46.7	0	0	0	111.3	I128 G129 Y209 H299	I128-D301 HydrophobicContact CB-CB 4.26Å; G129-D301 PolarHBondContact N-OD2 3.16Å; G129-D301 PolarHBondContact O-N 3.33Å; Y209-D301 WeakPolarHBondContact CE2-OD2 3.39Å; Y209-D301 PolarHBondContact OH-OD2 2.96Å; H299-D301 PolarHBondContact CE1-O 2.87Å; H299-D301 PolarHBondContact ND1-O 3.07Å
302	Q	94.3	Very high	92.7	Very high	167 Å²	167	57 Å²	57	78%	0.78	31%	0.305	S	S	*	.	P	Polyproline II helix	trans	-69.3	145	170.4	-67	-170.7	-0.1	0	0	110.7
303	S	93.1	Very high	91.9	Very high	35 Å²	35	56.8 Å²	56.8	25%	0.245	30%	0.303	C	S	.	.	P	Polyproline II helix	trans	-62.3	133.9	171.7	-62.1	0	0	0	0	109.5	E132	E132-S303 PolarHBondContact OE1-OG 3.22Å; E132-S303 WeakPolarHBondContact OE2-CB 3.14Å; E132-S303 PolarHBondContact OE2-OG 2.82Å
304	P	91.8	Very high	90.9	Very high	29 Å²	29	53.8 Å²	53.8	19%	0.188	29%	0.287	C	S	.	.	P	Polyproline II helix	trans	-74	173	179.9	36	-36	0	0	0	109.9	I128 Y306 T313	I128-P304 HydrophobicContact CD1-CB 4.18Å; I128-P304 VanDerWaalsContact CD1-CD 3.43Å; I128-P304 HydrophobicContact CD1-CG 3.64Å; P304-Y306 VanDerWaalsContact CD-CZ 3.5Å; P304-Y306 WeakPolarHBondContact CD-OH 3.36Å; P304-Y306 HydrophobicContact CG-CD1 4.17Å; P304-Y306 HydrophobicContact CG-CE1 3.61Å; P304-Y306 HydrophobicContact CG-CE2 4.16Å; P304-Y306 WeakPolarHBondContact O-CD2 3.4Å; P304-Y306 PolarHBondContact O-N 3.37Å; P304-T313 HydrophobicContact CB-CG2 3.85Å; P304-T313 HydrophobicContact CG-CG2 4.41Å
305	D	91.1	Very high	90.4	Very high	92 Å²	92	51.9 Å²	51.9	49%	0.492	27%	0.273	S	S	.	.			trans	-73.2	115	166.3	-174.5	12.3	0	0	0	110.7	C307	D305-C307 VanDerWaalsContact C-N 3.32Å; D305-C307 WeakPolarHBondContact OD1-CB 3.37Å; D305-C307 PolarHBondContact OD1-N 2.9Å; D305-C307 PolarHBondContact OD1-SG 3.09Å
306	Y	92.7	Very high	89.9	Confident	17 Å²	17	53 Å²	53	7%	0.067	28%	0.279	C	S	.	.			trans	-87.4	2	177.7	-65.1	-68	0	0	0	113.7	W111 M126 E132 P304 S315 G317	W111-Y306 HydrophobicContact CB-CD1 3.85Å; W111-Y306 HydrophobicContact CB-CD2 3.82Å; W111-Y306 HydrophobicContact CB-CE1 3.94Å; W111-Y306 HydrophobicContact CB-CE2 3.9Å; W111-Y306 HydrophobicContact CB-CG 3.79Å; W111-Y306 AromaticContact CD1-CD1 3.96Å; W111-Y306 AromaticContact CD1-CE1 3.59Å; W111-Y306 HydrophobicContact CG-CD1 4.24Å; W111-Y306 AromaticContact CG-CE1 3.95Å; W111-Y306 HydrophobicContact CG-CE1 3.95Å; W111-Y306 HydrophobicContact CG-CE2 4.46Å; M126-Y306 VanDerWaalsContact CE-OH 3.3Å; M126-Y306 WeakPolarHBondContact CE-OH 3.5Å; E132-Y306 VanDerWaalsContact CD-OH 3.23Å; E132-Y306 HydrophobicContact CG-CE2 4.1Å; E132-Y306 WeakPolarHBondContact CG-OH 3.34Å; E132-Y306 PolarHBondContact OE2-OH 3.47Å; P304-Y306 VanDerWaalsContact CD-CZ 3.5Å; P304-Y306 WeakPolarHBondContact CD-OH 3.36Å; P304-Y306 HydrophobicContact CG-CD1 4.17Å; P304-Y306 HydrophobicContact CG-CE1 3.61Å; P304-Y306 HydrophobicContact CG-CE2 4.16Å; P304-Y306 WeakPolarHBondContact O-CD2 3.4Å; P304-Y306 PolarHBondContact O-N 3.37Å; Y306-S315 WeakPolarHBondContact CA-OG 3.42Å; Y306-S315 PolarHBondContact O-OG 2.99Å; Y306-G317 WeakPolarHBondContact O-CA 3.42Å
307	C	93.4	Very high	89.6	Confident	7 Å²	7	51.9 Å²	51.9	5%	0.047	28%	0.275	C	S	.	.	S	Bend	trans	-66.7	-39.6	179	-69.8	0	0	0	0	112.8	D305 G317 T318 C338 R340	D305-C307 VanDerWaalsContact C-N 3.32Å; D305-C307 WeakPolarHBondContact OD1-CB 3.37Å; D305-C307 PolarHBondContact OD1-N 2.9Å; D305-C307 PolarHBondContact OD1-SG 3.09Å; C307-G317 WeakPolarHBondContact O-CA 3.43Å; C307-T318 PolarHBondContact O-N 2.85Å; C307-T318 PolarHBondContact O-OG1 2.83Å; C307-C338 VanDerWaalsContact CA-SG 3.6Å; C307-C338 HydrophobicContact CB-CB 3.65Å; C307-C338 WeakPolarHBondContact CB-SG 3.03Å; C307-C338 WeakPolarHBondContact SG-CB 3.05Å; C307-C338 CovalentContact SG-SG 2.01Å; C307-C338 PolarHBondContact SG-SG 3.01Å; C307-R340 PolarHBondContact O-NH1 2.86Å
308	L	90.9	Very high	89.4	Confident	106 Å²	106	51.9 Å²	51.9	56%	0.555	28%	0.275	S	S	*	.	S	Bend	trans	-105.5	149.1	-176.9	-59.9	178.5	0	0	0	111	N310 S315	L308-N310 PolarHBondContact O-N 2.97Å; L308-S315 WeakPolarHBondContact O-CB 3.26Å; L308-S315 PolarHBondContact O-OG 2.86Å
309	K	88.9	Confident	89.2	Confident	153 Å²	153	56.2 Å²	56.2	67%	0.665	30%	0.301	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-67	125.9	172.1	-172.4	175.6	179	179.7	0	109.1	S315 I316	K309-S315 CarbonylContact C-O 3.26Å; K309-S315 WeakPolarHBondContact CA-O 3.47Å; K309-I316 WeakPolarHBondContact CB-O 3.42Å
310	N	85.1	Confident	89	Confident	68 Å²	68	58.2 Å²	58.2	36%	0.364	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.8	113.2	177.8	-177.7	-25.7	0	0	0	109.3	L308 S312 T313 G314 S315	L308-N310 PolarHBondContact O-N 2.97Å; N310-S312 WeakPolarHBondContact OD1-CB 3.41Å; N310-S312 PolarHBondContact OD1-N 3.17Å; N310-T313 WeakPolarHBondContact CB-OG1 3.45Å; N310-T313 PolarHBondContact O-OG1 3.01Å; N310-T313 PolarHBondContact OD1-N 3Å; N310-G314 CarbonylContact O-C 3.6Å; N310-G314 PolarHBondContact O-N 3.08Å; N310-S315 PolarHBondContact N-O 3.46Å; N310-S315 PolarHBondContact O-N 3.09Å
311	Q	80.1	Confident	88.8	Confident	128 Å²	128	58.7 Å²	58.7	60%	0.598	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70	-32.4	-176.6	-165.1	166.8	19.2	0	0	112.5	V116 T313 G314	V116-Q311 HydrophobicContact CG1-CG 4.28Å; Q311-T313 PolarHBondContact O-N 2.88Å; Q311-G314 PolarHBondContact O-N 2.86Å
312	S	76.9	Confident	88.8	Confident	92 Å²	92	61.7 Å²	61.7	64%	0.643	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68	-35.8	179.8	-53.2	0	0	0	0	112.5	N310	N310-S312 WeakPolarHBondContact OD1-CB 3.41Å; N310-S312 PolarHBondContact OD1-N 3.17Å
313	T	77.4	Confident	88.8	Confident	24 Å²	24	54.4 Å²	54.4	15%	0.147	31%	0.307	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.7	-8.9	176.5	63.7	0	0	0	0	113.1	P304 N310 Q311 S315	P304-T313 HydrophobicContact CB-CG2 3.85Å; P304-T313 HydrophobicContact CG-CG2 4.41Å; N310-T313 WeakPolarHBondContact CB-OG1 3.45Å; N310-T313 PolarHBondContact O-OG1 3.01Å; N310-T313 PolarHBondContact OD1-N 3Å; Q311-T313 PolarHBondContact O-N 2.88Å; T313-S315 VanDerWaalsContact C-N 3.33Å
314	G	76.3	Confident	88.9	Confident	8 Å²	8	55.7 Å²	55.7	8%	0.082	31%	0.311	C	S	.	.	T	Hydrogen-bonded Turn	trans	76.8	15.5	-175.8	0	0	0	0	0	114.2	N310 Q311	N310-G314 CarbonylContact O-C 3.6Å; N310-G314 PolarHBondContact O-N 3.08Å; Q311-G314 PolarHBondContact O-N 2.86Å
315	S	85.5	Confident	89	Confident	1 Å²	1	59.7 Å²	59.7	1%	0.007	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	129.8	177.4	-179.5	0	0	0	0	111.6	V116 Y306 L308 K309 N310 T313 G317	V116-S315 WeakPolarHBondContact CG2-O 3.35Å; Y306-S315 WeakPolarHBondContact CA-OG 3.42Å; Y306-S315 PolarHBondContact O-OG 2.99Å; L308-S315 WeakPolarHBondContact O-CB 3.26Å; L308-S315 PolarHBondContact O-OG 2.86Å; K309-S315 CarbonylContact C-O 3.26Å; K309-S315 WeakPolarHBondContact CA-O 3.47Å; N310-S315 PolarHBondContact N-O 3.46Å; N310-S315 PolarHBondContact O-N 3.09Å; T313-S315 VanDerWaalsContact C-N 3.33Å; S315-G317 PolarHBondContact OG-N 2.96Å
316	I	87.4	Confident	89.1	Confident	77 Å²	77	61.3 Å²	61.3	40%	0.395	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	-18.7	172.5	-62.3	-179.9	0	0	0	111.6	V116 K309	V116-I316 HydrophobicContact CG2-CG1 4.06Å; K309-I316 WeakPolarHBondContact CB-O 3.42Å
317	G	91.1	Very high	89.2	Confident	9 Å²	9	62 Å²	62	9%	0.093	35%	0.347	C	S	.	.			trans	82.3	172.9	-170.2	0	0	0	0	0	113	Y306 C307 S315	Y306-G317 WeakPolarHBondContact O-CA 3.42Å; C307-G317 WeakPolarHBondContact O-CA 3.43Å; S315-G317 PolarHBondContact OG-N 2.96Å
318	T	94.4	Very high	89.2	Confident	0 Å²	0	70.9 Å²	70.9	0%	0	39%	0.387	C	S	.	.	S	Bend	trans	-107.9	-0.5	-178.9	61.1	0	0	0	0	114.6	R110 C307 G320 R321 M336 R340 C377	R110-T318 HydrophobicContact CB-CG2 3.91Å; R110-T318 HydrophobicContact CG-CG2 4.02Å; C307-T318 PolarHBondContact O-N 2.85Å; C307-T318 PolarHBondContact O-OG1 2.83Å; T318-G320 PolarHBondContact O-N 3Å; T318-R321 VanDerWaalsContact O-CB 3.27Å; T318-R321 WeakPolarHBondContact O-CB 3.31Å; T318-R321 WeakPolarHBondContact O-CG 3.45Å; T318-R321 PolarHBondContact O-N 2.83Å; T318-M336 WeakPolarHBondContact CB-O 3.37Å; T318-M336 WeakPolarHBondContact CG2-O 3.36Å; T318-M336 PolarHBondContact OG1-O 2.87Å; T318-R340 PolarHBondContact OG1-NH2 3.33Å; T318-C377 VanDerWaalsContact O-CB 3.24Å; T318-C377 WeakPolarHBondContact O-CB 3.28Å
319	V	94.3	Very high	89.2	Confident	93 Å²	93	67.3 Å²	67.3	56%	0.564	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.6	134.3	174.2	178.3	0	0	0	0	109.7	R321 K378	V319-R321 VanDerWaalsContact C-N 3.26Å; V319-R321 PolarHBondContact O-N 3.43Å; V319-K378 WeakPolarHBondContact CG1-OXT 3.44Å
320	G	92.9	Very high	89.3	Confident	51 Å²	51	63.9 Å²	63.9	53%	0.526	36%	0.363	S	S	.	.	T	Hydrogen-bonded Turn	trans	78.3	3.6	179.7	0	0	0	0	0	114.8	T318 V376 C377	T318-G320 PolarHBondContact O-N 3Å; G320-V376 VanDerWaalsContact C-CG1 3.48Å; G320-V376 VanDerWaalsContact CA-CG1 3.48Å; G320-C377 PolarHBondContact N-O 3.26Å
321	R	93.4	Very high	89.7	Confident	36 Å²	36	62.3 Å²	62.3	14%	0.136	36%	0.355	C	S	.	.			trans	-84.6	141.7	178.3	-68.1	-166.6	61.5	-170.9	-5.8	112.8	R107 R109 R110 T318 V319 M336 V376 C377	R107-R321 PolarHBondContact O-NH2 3.24Å; R107-R321 VanDerWaalsContact O-NH2 3.16Å; R109-R321 VanDerWaalsContact O-CZ 3.23Å; R109-R321 PolarHBondContact O-NH1 2.98Å; R109-R321 PolarHBondContact O-NH2 3.36Å; R110-R321 VanDerWaalsContact CA-NH1 3.28Å; R110-R321 PolarHBondContact O-NH1 3.4Å; T318-R321 VanDerWaalsContact O-CB 3.27Å; T318-R321 WeakPolarHBondContact O-CB 3.31Å; T318-R321 WeakPolarHBondContact O-CG 3.45Å; T318-R321 PolarHBondContact O-N 2.83Å; V319-R321 VanDerWaalsContact C-N 3.26Å; V319-R321 PolarHBondContact O-N 3.43Å; R321-M336 HydrophobicContact CB-SD 4.41Å; R321-V376 CarbonylContact O-C 3.58Å; R321-V376 VanDerWaalsContact O-CA 3.31Å; R321-V376 WeakPolarHBondContact O-CA 3.49Å; R321-C377 PolarHBondContact O-N 3.17Å
322	L	93.8	Very high	90.5	Very high	102 Å²	102	56.3 Å²	56.3	53%	0.534	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.5	135.9	169.1	-71	167	0	0	0	110.6	F345 Q374 F375 V376	L322-F345 HydrophobicContact CD2-CZ 4.32Å; L322-Q374 HydrophobicContact CD2-CB 4.13Å; L322-Q374 HydrophobicContact CD2-CG 4.41Å; L322-F375 WeakPolarHBondContact CA-O 3.46Å; L322-V376 HydrophobicContact CD2-CG2 3.7Å; L322-V376 HydrophobicContact CG-CG2 4.31Å
323	C	95.1	Very high	91.4	Very high	15 Å²	15	52.2 Å²	52.2	10%	0.101	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	161.8	174.2	67.2	0	0	0	0	111.3	C333 M336 C337 F375	C323-C333 HydrophobicContact CB-CB 3.82Å; C323-C333 WeakPolarHBondContact CB-SG 3.13Å; C323-C333 WeakPolarHBondContact SG-CA 3.21Å; C323-C333 WeakPolarHBondContact SG-CB 3.31Å; C323-C333 CovalentContact SG-SG 2.04Å; C323-C333 PolarHBondContact SG-SG 2.9Å; C323-M336 HydrophobicContact CB-CB 4.13Å; C323-M336 HydrophobicContact CB-CG 4.4Å; C323-M336 HydrophobicContact CB-SD 4.5Å; C323-C337 VanDerWaalsContact SG-SG 3.61Å; C323-F375 PolarHBondContact N-O 3.04Å
324	N	94.9	Very high	92.2	Very high	62 Å²	62	58.7 Å²	58.7	33%	0.332	33%	0.327	S	S	.	.	B	Isolated β-bridge	trans	-103.7	114.1	179.9	-172.8	-8.4	0	0	0	110	T326 S327 D331 G332 C333	N324-T326 VanDerWaalsContact C-N 3.3Å; N324-T326 PolarHBondContact O-N 2.88Å; N324-T326 PolarHBondContact OD1-N 2.03Å; N324-T326 PolarHBondContact OD1-OG1 2.84Å; N324-S327 PolarHBondContact O-N 2.89Å; N324-D331 HydrophobicContact CB-CB 4.45Å; N324-D331 WeakPolarHBondContact CB-OD2 3.48Å; N324-D331 PolarHBondContact N-O 3.2Å; N324-D331 PolarHBondContact ND2-OD2 3.05Å; N324-G332 VanDerWaalsContact O-CA 3.26Å; N324-G332 WeakPolarHBondContact O-CA 3.43Å; N324-C333 VanDerWaalsContact C-SG 3.57Å; N324-C333 PolarHBondContact O-N 3.19Å; N324-C333 VanDerWaalsContact O-N 3.09Å
325	K	93.9	Very high	93	Very high	112 Å²	112	61.5 Å²	61.5	49%	0.487	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.2	-29.5	-178.5	-179.6	175.6	177.5	-177.7	0	113.1	Y342 F375	K325-Y342 HydrophobicContact CD-CE2 4.31Å; K325-Y342 WeakPolarHBondContact CE-OH 3.22Å; K325-F375 HydrophobicContact CB-CD1 4.33Å; K325-F375 HydrophobicContact CB-CD2 3.7Å; K325-F375 HydrophobicContact CB-CE1 4.19Å; K325-F375 HydrophobicContact CB-CE2 3.56Å; K325-F375 HydrophobicContact CB-CG 4.09Å; K325-F375 HydrophobicContact CB-CZ 3.82Å; K325-F375 HydrophobicContact CD-CD1 4.28Å; K325-F375 HydrophobicContact CD-CE1 3.57Å; K325-F375 HydrophobicContact CD-CE2 4.19Å; K325-F375 HydrophobicContact CD-CZ 3.53Å; K325-F375 HydrophobicContact CG-CE1 4.48Å; K325-F375 HydrophobicContact CG-CZ 4.31Å
326	T	93.1	Very high	93.5	Very high	127 Å²	127	61.6 Å²	61.6	78%	0.779	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.9	-8.2	-176.5	58.3	0	0	0	0	113.4	N324	N324-T326 VanDerWaalsContact C-N 3.3Å; N324-T326 PolarHBondContact O-N 2.88Å; N324-T326 PolarHBondContact OD1-N 2.03Å; N324-T326 PolarHBondContact OD1-OG1 2.84Å
327	S	94.6	Very high	93.9	Very high	32 Å²	32	58 Å²	58	22%	0.224	32%	0.322	C	S	.	.			trans	-88.6	133	179.4	-175.4	0	0	0	0	110.9	N324 G329 D331 G332	N324-S327 PolarHBondContact O-N 2.89Å; S327-G329 VanDerWaalsContact C-N 3.3Å; S327-G329 PolarHBondContact OG-N 3.41Å; S327-D331 WeakPolarHBondContact CB-OD1 3.47Å; S327-D331 WeakPolarHBondContact CB-OD2 3.05Å; S327-D331 VanDerWaalsContact OG-CG 3.28Å; S327-D331 PolarHBondContact OG-OD1 2.93Å; S327-D331 PolarHBondContact OG-OD2 2.86Å; S327-G332 WeakPolarHBondContact O-CA 3.12Å
328	E	92.5	Very high	94.1	Very high	193 Å²	193	59.3 Å²	59.3	90%	0.902	33%	0.329	S	S	*	.			trans	-87.1	-5.4	167.2	-61	-178.8	174.3	0	0	111.9
329	G	91.7	Very high	94.1	Very high	31 Å²	31	62.7 Å²	62.7	32%	0.32	36%	0.364	S	S	.	.	S	Bend	trans	-78.6	-172.3	178.7	0	0	0	0	0	113.4	S327 D331 G332	S327-G329 VanDerWaalsContact C-N 3.3Å; S327-G329 PolarHBondContact OG-N 3.41Å; G329-D331 PolarHBondContact O-N 2.98Å; G329-G332 VanDerWaalsContact O-CA 3.3Å; G329-G332 WeakPolarHBondContact O-CA 3.23Å; G329-G332 PolarHBondContact O-N 3.27Å
330	M	91.8	Very high	94.1	Very high	81 Å²	81	61.8 Å²	61.8	40%	0.399	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.6	-20.5	-178.8	-79.5	170.1	-74.9	0	0	114.7	H108 R109 L335 M336	H108-M330 CarbonylContact O-C 3.57Å; R109-M330 WeakPolarHBondContact CD-SD 3.05Å; R109-M330 PolarHBondContact NE-SD 2.97Å; R109-M330 VanDerWaalsContact NE-SD 3.43Å; R109-M330 VanDerWaalsContact NH1-CE 3.25Å; R109-M330 PolarHBondContact NH1-SD 3.25Å; M330-L335 HydrophobicContact CG-CD1 4.39Å; M330-M336 WeakPolarHBondContact O-CE 3.04Å
331	D	93.3	Very high	94.2	Very high	35 Å²	35	60.8 Å²	60.8	19%	0.187	34%	0.34	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.1	-13.2	167.8	62.8	-43	0	0	0	112.8	H108 N324 S327 G329	H108-D331 HydrophobicContact CB-CB 3.94Å; H108-D331 PolarHBondContact O-N 3.15Å; N324-D331 HydrophobicContact CB-CB 4.45Å; N324-D331 WeakPolarHBondContact CB-OD2 3.48Å; N324-D331 PolarHBondContact N-O 3.2Å; N324-D331 PolarHBondContact ND2-OD2 3.05Å; S327-D331 WeakPolarHBondContact CB-OD1 3.47Å; S327-D331 WeakPolarHBondContact CB-OD2 3.05Å; S327-D331 VanDerWaalsContact OG-CG 3.28Å; S327-D331 PolarHBondContact OG-OD1 2.93Å; S327-D331 PolarHBondContact OG-OD2 2.86Å; G329-D331 PolarHBondContact O-N 2.98Å
332	G	96.2	Very high	94.3	Very high	1 Å²	1	62.8 Å²	62.8	1%	0.01	35%	0.348	C	S	.	.	B	Isolated β-bridge	trans	-56.4	139.4	175.4	0	0	0	0	0	112.5	N324 S327 G329 E334 L335 M336	N324-G332 VanDerWaalsContact O-CA 3.26Å; N324-G332 WeakPolarHBondContact O-CA 3.43Å; S327-G332 WeakPolarHBondContact O-CA 3.12Å; G329-G332 VanDerWaalsContact O-CA 3.3Å; G329-G332 WeakPolarHBondContact O-CA 3.23Å; G329-G332 PolarHBondContact O-N 3.27Å; G332-E334 PolarHBondContact O-N 3.34Å; G332-L335 PolarHBondContact O-N 2.03Å; G332-M336 VanDerWaalsContact O-CB 3.31Å; G332-M336 WeakPolarHBondContact O-CB 3.16Å; G332-M336 PolarHBondContact O-N 3.16Å
333	C	95.8	Very high	94.4	Very high	6 Å²	6	62 Å²	62	4%	0.041	34%	0.344	C	S	.	.	H	α-helix	trans	-60.7	-31	-179.5	-67.8	0	0	0	0	113.7	C323 N324 C337 Y342	C323-C333 HydrophobicContact CB-CB 3.82Å; C323-C333 WeakPolarHBondContact CB-SG 3.13Å; C323-C333 WeakPolarHBondContact SG-CA 3.21Å; C323-C333 WeakPolarHBondContact SG-CB 3.31Å; C323-C333 CovalentContact SG-SG 2.04Å; C323-C333 PolarHBondContact SG-SG 2.9Å; N324-C333 VanDerWaalsContact C-SG 3.57Å; N324-C333 PolarHBondContact O-N 3.19Å; N324-C333 VanDerWaalsContact O-N 3.09Å; C333-C337 WeakPolarHBondContact O-CB 3.3Å; C333-C337 PolarHBondContact O-N 2.94Å; C333-C337 VanDerWaalsContact O-N 3.12Å; C333-C337 PolarHBondContact O-SG 3.39Å; C333-Y342 HydrophobicContact CB-CD1 3.38Å; C333-Y342 HydrophobicContact CB-CE1 3.52Å; C333-Y342 HydrophobicContact CB-CG 4.03Å
334	E	93.9	Very high	94.4	Very high	161 Å²	161	66.4 Å²	66.4	75%	0.752	36%	0.364	S	S	*	.	H	α-helix	trans	-62.2	-49.3	175.1	-174.8	174.6	-176.5	0	0	111.8	G332 C338 G339	G332-E334 PolarHBondContact O-N 3.34Å; E334-C338 PolarHBondContact O-N 3.21Å; E334-G339 PolarHBondContact O-N 3.12Å
335	L	94.2	Very high	94.3	Very high	67 Å²	67	67.3 Å²	67.3	35%	0.351	37%	0.365	S	S	.	.	H	α-helix	trans	-80.3	-39.8	-177.4	-66.5	-176.6	0	0	0	113	R110 M330 G332	R110-L335 VanDerWaalsContact CZ-O 3.25Å; R110-L335 PolarHBondContact NE-O 3.29Å; R110-L335 PolarHBondContact NH2-O 3.28Å; M330-L335 HydrophobicContact CG-CD1 4.39Å; G332-L335 PolarHBondContact O-N 2.03Å
336	M	95.4	Very high	94.3	Very high	3 Å²	3	69.7 Å²	69.7	2%	0.015	38%	0.375	C	S	.	.	H	α-helix	trans	-70.8	-38.9	-178.6	-173.8	148.5	-71.1	0	0	112	H108 T318 R321 C323 M330 G332 C338	H108-M336 VanDerWaalsContact O-CE 3.28Å; H108-M336 WeakPolarHBondContact O-CE 3.37Å; T318-M336 WeakPolarHBondContact CB-O 3.37Å; T318-M336 WeakPolarHBondContact CG2-O 3.36Å; T318-M336 PolarHBondContact OG1-O 2.87Å; R321-M336 HydrophobicContact CB-SD 4.41Å; C323-M336 HydrophobicContact CB-CB 4.13Å; C323-M336 HydrophobicContact CB-CG 4.4Å; C323-M336 HydrophobicContact CB-SD 4.5Å; M330-M336 WeakPolarHBondContact O-CE 3.04Å; G332-M336 VanDerWaalsContact O-CB 3.31Å; G332-M336 WeakPolarHBondContact O-CB 3.16Å; G332-M336 PolarHBondContact O-N 3.16Å; M336-C338 VanDerWaalsContact C-N 3.32Å
337	C	96.3	Very high	94.2	Very high	1 Å²	1	64.4 Å²	64.4	1%	0.007	34%	0.344	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.2	1.1	-178.3	-47.9	0	0	0	0	113.5	C323 C333 G339 R340 G341 C377	C323-C337 VanDerWaalsContact SG-SG 3.61Å; C333-C337 WeakPolarHBondContact O-CB 3.3Å; C333-C337 PolarHBondContact O-N 2.94Å; C333-C337 VanDerWaalsContact O-N 3.12Å; C333-C337 PolarHBondContact O-SG 3.39Å; C337-G339 VanDerWaalsContact C-N 3.26Å; C337-G339 PolarHBondContact O-N 3.42Å; C337-R340 WeakPolarHBondContact O-CB 3.32Å; C337-R340 PolarHBondContact O-N 3.41Å; C337-G341 WeakPolarHBondContact CB-O 3.42Å; C337-C377 WeakPolarHBondContact CA-SG 3.36Å; C337-C377 HydrophobicContact CB-CB 3.58Å; C337-C377 WeakPolarHBondContact CB-SG 3.14Å; C337-C377 PolarHBondContact N-SG 3.39Å; C337-C377 VanDerWaalsContact N-SG 3.45Å; C337-C377 WeakPolarHBondContact SG-CA 3.37Å; C337-C377 WeakPolarHBondContact SG-CB 3.45Å; C337-C377 CovalentContact SG-SG 2.04Å; C337-C377 PolarHBondContact SG-SG 2.92Å
338	C	95.3	Very high	94.2	Very high	37 Å²	37	67.4 Å²	67.4	25%	0.25	36%	0.361	C	S	.	.	T	Hydrogen-bonded Turn	trans	55.1	40	172.9	-48	0	0	0	0	113.2	C307 E334 M336 R340	C307-C338 VanDerWaalsContact CA-SG 3.6Å; C307-C338 HydrophobicContact CB-CB 3.65Å; C307-C338 WeakPolarHBondContact CB-SG 3.03Å; C307-C338 WeakPolarHBondContact SG-CB 3.05Å; C307-C338 CovalentContact SG-SG 2.01Å; C307-C338 PolarHBondContact SG-SG 3.01Å; E334-C338 PolarHBondContact O-N 3.21Å; M336-C338 VanDerWaalsContact C-N 3.32Å; C338-R340 PolarHBondContact O-N 3.31Å
339	G	93.1	Very high	94.2	Very high	71 Å²	71	61.9 Å²	61.9	73%	0.732	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	74.5	-1.2	-179.1	0	0	0	0	0	116.1	E334 C337 G341	E334-G339 PolarHBondContact O-N 3.12Å; C337-G339 VanDerWaalsContact C-N 3.26Å; C337-G339 PolarHBondContact O-N 3.42Å; G339-G341 PolarHBondContact O-N 2.65Å
340	R	94.9	Very high	94.3	Very high	74 Å²	74	64.8 Å²	64.8	28%	0.279	35%	0.349	S	S	.	.	S	Bend	trans	-73.5	-8.1	178.3	-59.6	-169.1	-57.5	-83.5	-4.9	114.1	C307 T318 C337 C338 K378	C307-R340 PolarHBondContact O-NH1 2.86Å; T318-R340 PolarHBondContact OG1-NH2 3.33Å; C337-R340 WeakPolarHBondContact O-CB 3.32Å; C337-R340 PolarHBondContact O-N 3.41Å; C338-R340 PolarHBondContact O-N 3.31Å; R340-K378 HydrophobicContact CB-CB 4.46Å; R340-K378 PolarHBondContact NE-O 3.16Å; R340-K378 PolarHBondContact NH2-O 3.33Å
341	G	94.8	Very high	94.4	Very high	29 Å²	29	64.2 Å²	64.2	30%	0.299	35%	0.345	S	S	.	.			trans	78.5	-175.2	-171.1	0	0	0	0	0	112.7	C337 G339 K378	C337-G341 WeakPolarHBondContact CB-O 3.42Å; G339-G341 PolarHBondContact O-N 2.65Å; G341-K378 PolarHBondContact O-N 3.46Å
342	Y	96.4	Very high	94.5	Very high	79 Å²	79	72.2 Å²	72.2	31%	0.31	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.7	152.6	-175.8	52.1	-90.1	0	0	0	110.6	K325 C333 F375 V376	K325-Y342 HydrophobicContact CD-CE2 4.31Å; K325-Y342 WeakPolarHBondContact CE-OH 3.22Å; C333-Y342 HydrophobicContact CB-CD1 3.38Å; C333-Y342 HydrophobicContact CB-CE1 3.52Å; C333-Y342 HydrophobicContact CB-CG 4.03Å; Y342-F375 HydrophobicContact CD2-CB 3.93Å; Y342-F375 AromaticContact CD2-CD1 3.57Å; Y342-F375 HydrophobicContact CD2-CD1 3.57Å; Y342-F375 HydrophobicContact CD2-CG 4.14Å; Y342-F375 HydrophobicContact CE2-CB 4.47Å; Y342-F375 AromaticContact CE2-CD1 3.47Å; Y342-F375 HydrophobicContact CE2-CD1 3.47Å; Y342-F375 VanDerWaalsContact CE2-CD1 3.47Å; Y342-F375 HydrophobicContact CE2-CE1 4.04Å; Y342-F375 HydrophobicContact CE2-CG 4.23Å; Y342-F375 HydrophobicContact CG-CB 4.47Å; Y342-V376 CarbonylContact C-O 3.56Å; Y342-V376 WeakPolarHBondContact CA-O 3.36Å; Y342-V376 VanDerWaalsContact CB-O 3.3Å; Y342-V376 WeakPolarHBondContact CB-O 3.22Å
343	D	95.8	Very high	94.5	Very high	85 Å²	85	73 Å²	73	46%	0.455	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	144.3	170.1	-67.6	-46.9	0	0	0	110.2	F375 V376 K378	D343-F375 CarbonylContact O-C 3.58Å; D343-F375 VanDerWaalsContact O-CA 3.31Å; D343-F375 WeakPolarHBondContact O-CA 3.3Å; D343-V376 PolarHBondContact N-O 2.83Å; D343-V376 PolarHBondContact O-N 2.03Å; D343-K378 VanDerWaalsContact CG-CE 3.42Å; D343-K378 WeakPolarHBondContact OD1-CE 3Å; D343-K378 IonicContact OD1-NZ 3.98Å; D343-K378 PolarHBondContact OD1-NZ 2.9Å
344	Q	94.6	Very high	94.5	Very high	108 Å²	108	78 Å²	78	51%	0.505	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	130.4	176.2	179.6	179.4	-14.8	0	0	109.6	D373 Q374 F375	Q344-D373 HydrophobicContact CG-CB 4.49Å; Q344-D373 PolarHBondContact NE2-OD1 2.95Å; Q344-Q374 WeakPolarHBondContact CA-O 3.04Å; Q344-F375 HydrophobicContact CB-CD1 3.94Å; Q344-F375 HydrophobicContact CB-CE1 3.94Å; Q344-F375 HydrophobicContact CG-CD1 4.03Å; Q344-F375 HydrophobicContact CG-CE1 3.63Å; Q344-F375 HydrophobicContact CG-CZ 4.38Å
345	F	93.1	Very high	94.6	Very high	81 Å²	81	73.6 Å²	73.6	36%	0.355	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	149.2	172.3	55.9	-80.3	0	0	0	110.7	L322 A347 Q374 V376	L322-F345 HydrophobicContact CD2-CZ 4.32Å; F345-A347 HydrophobicContact CD2-CB 4.37Å; F345-A347 HydrophobicContact CE2-CB 4.32Å; F345-Q374 HydrophobicContact CD1-CB 4.39Å; F345-Q374 HydrophobicContact CD2-CB 3.95Å; F345-Q374 HydrophobicContact CE1-CB 3.87Å; F345-Q374 HydrophobicContact CE2-CB 3.43Å; F345-Q374 VanDerWaalsContact CE2-CB 3.43Å; F345-Q374 HydrophobicContact CE2-CG 4.1Å; F345-Q374 HydrophobicContact CG-CB 4.41Å; F345-Q374 HydrophobicContact CZ-CB 3.36Å; F345-Q374 HydrophobicContact CZ-CG 4.33Å; F345-Q374 VanDerWaalsContact CZ-OE1 3.28Å; F345-Q374 PolarHBondContact N-O 2.66Å; F345-Q374 PolarHBondContact O-N 3.16Å; F345-V376 HydrophobicContact CE1-CB 3.77Å; F345-V376 HydrophobicContact CE1-CG2 3.31Å; F345-V376 HydrophobicContact CZ-CG2 3.59Å
346	K	93.9	Very high	94.6	Very high	161 Å²	161	77.5 Å²	77.5	70%	0.7	41%	0.405	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84.7	119.1	173.5	-70.4	-173.7	176.9	-172.6	0	108.8	I371	K346-I371 HydrophobicContact CB-CG2 3.87Å; K346-I371 HydrophobicContact CD-CG2 4.02Å; K346-I371 HydrophobicContact CG-CG2 4.18Å
347	A	91.1	Very high	94.7	Very high	17 Å²	17	83.5 Å²	83.5	14%	0.14	43%	0.431	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	141.9	174.7	0	0	0	0	0	110.3	F345 L349 I371 V372 Q374	F345-A347 HydrophobicContact CD2-CB 4.37Å; F345-A347 HydrophobicContact CE2-CB 4.32Å; A347-L349 PolarHBondContact O-N 3.3Å; A347-I371 WeakPolarHBondContact O-CA 3.5Å; A347-V372 HydrophobicContact CB-CG2 4.33Å; A347-V372 PolarHBondContact N-O 3.21Å; A347-V372 PolarHBondContact O-N 2.7Å; A347-Q374 VanDerWaalsContact CB-CD 3.4Å; A347-Q374 HydrophobicContact CB-CG 3.78Å; A347-Q374 VanDerWaalsContact CB-NE2 3.29Å
348	T	93.9	Very high	94.6	Very high	94 Å²	94	86.6 Å²	86.6	58%	0.577	45%	0.445	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87.4	105.7	171.8	-57	0	0	0	0	108.6	V350 T369 K370	T348-V350 HydrophobicContact CG2-CG2 4.42Å; T348-T369 HydrophobicContact CG2-CG2 4.29Å; T348-K370 CarbonylContact C-O 3.45Å
349	L	92.1	Very high	94.2	Very high	77 Å²	77	95.2 Å²	95.2	40%	0.403	47%	0.472	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	117.1	172.3	-178.2	65.3	0	0	0	109	A347 T369 K370 V372	A347-L349 PolarHBondContact O-N 3.3Å; L349-T369 WeakPolarHBondContact O-CA 3.39Å; L349-K370 PolarHBondContact N-O 3.4Å; L349-K370 PolarHBondContact O-N 3.14Å; L349-V372 HydrophobicContact CB-CG1 4.28Å; L349-V372 HydrophobicContact CB-CG2 4Å; L349-V372 HydrophobicContact CD2-CG1 4.39Å
350	V	94.7	Very high	93.7	Very high	93 Å²	93	95.6 Å²	95.6	56%	0.564	46%	0.463	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98.1	117.3	174.5	-172.9	0	0	0	0	108.2	T348 V367 C368 T369	T348-V350 HydrophobicContact CG2-CG2 4.42Å; V350-V367 HydrophobicContact CG1-CG1 3.39Å; V350-C368 WeakPolarHBondContact CA-O 3.4Å; V350-T369 HydrophobicContact CG2-CG2 4.24Å
351	E	94.5	Very high	93.5	Very high	68 Å²	68	97.3 Å²	97.3	32%	0.318	49%	0.485	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	157.2	-180	68.2	177.8	175.2	0	0	112.2	C368 K370	E351-C368 HydrophobicContact CG-CB 4.35Å; E351-C368 PolarHBondContact N-O 3.45Å; E351-C368 PolarHBondContact O-N 2.78Å; E351-K370 WeakPolarHBondContact OE1-CD 3.44Å; E351-K370 WeakPolarHBondContact OE1-CE 3.44Å; E351-K370 IonicContact OE1-NZ 3.39Å; E351-K370 PolarHBondContact OE1-NZ 3.17Å
352	R	95.3	Very high	93.5	Very high	204 Å²	204	101.7 Å²	101.7	77%	0.77	49%	0.493	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.2	119.7	169.4	-73.2	-177.1	172	172.9	-1.5	108.6	C365 K366	R352-C365 HydrophobicContact CB-CB 3.84Å; R352-C365 HydrophobicContact CG-CB 4.18Å; R352-K366 WeakPolarHBondContact CA-O 3.28Å
353	C	95.2	Very high	93.4	Very high	16 Å²	16	102 Å²	102	11%	0.108	50%	0.503	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	167.1	-176.4	65.7	0	0	0	0	110.5	C355 K366 C368	C353-C355 PolarHBondContact O-N 3.44Å; C353-C355 VanDerWaalsContact O-N 3.12Å; C353-K366 PolarHBondContact N-O 2.03Å; C353-K366 PolarHBondContact O-N 2.84Å; C353-K366 PolarHBondContact SG-O 3.42Å; C353-C368 HydrophobicContact CB-CB 3.58Å; C353-C368 WeakPolarHBondContact CB-SG 3.41Å; C353-C368 WeakPolarHBondContact SG-CB 3.44Å; C353-C368 PolarHBondContact SG-N 2.89Å; C353-C368 CovalentContact SG-SG 1.99Å; C353-C368 PolarHBondContact SG-SG 3.31Å
354	N	95.6	Very high	93.4	Very high	113 Å²	113	104.7 Å²	104.7	60%	0.604	51%	0.511	S	S	*	.	E	Extended strand (participates in β ladder)	trans	50.3	41.8	174.4	-61.1	-52.1	0	0	0	112.6	K356 K366	N354-K356 PolarHBondContact O-N 2.79Å; N354-K366 HydrophobicContact CB-CD 4.45Å
355	C	96.1	Very high	93.6	Very high	67 Å²	67	101.4 Å²	101.4	45%	0.453	50%	0.499	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.2	124.3	-178	-65	0	0	0	0	110.5	C353 V363 C365	C353-C355 PolarHBondContact O-N 3.44Å; C353-C355 VanDerWaalsContact O-N 3.12Å; C355-V363 HydrophobicContact CB-CG1 3.74Å; C355-C365 HydrophobicContact CB-CB 4.1Å; C355-C365 WeakPolarHBondContact CB-SG 3.4Å; C355-C365 WeakPolarHBondContact SG-CB 3.44Å; C355-C365 CovalentContact SG-SG 2.04Å; C355-C365 PolarHBondContact SG-SG 2.98Å
356	K	95.4	Very high	93.7	Very high	150 Å²	150	104.4 Å²	104.4	65%	0.652	51%	0.512	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-111.4	126.9	174.2	-65.3	-171.4	177.9	-171.1	0	109.4	N354 H358 V363 K364	N354-K356 PolarHBondContact O-N 2.79Å; K356-H358 PolarHBondContact O-CD2 3.33Å; K356-V363 WeakPolarHBondContact O-CA 3.05Å; K356-K364 PolarHBondContact N-O 3.4Å; K356-K364 PolarHBondContact O-N 3.37Å
357	F	95.8	Very high	93.8	Very high	128 Å²	128	101.9 Å²	101.9	56%	0.561	51%	0.51	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76	125.4	168.8	-179.6	-106.6	0	0	0	108.8	W359 V363	F357-W359 HydrophobicContact CE1-CB 4.38Å; F357-W359 HydrophobicContact CE1-CD2 4.31Å; F357-W359 AromaticContact CE1-CE3 3.68Å; F357-W359 HydrophobicContact CE1-CE3 3.68Å; F357-W359 HydrophobicContact CE1-CZ3 4.45Å; F357-W359 AromaticContact CZ-CE3 3.8Å; F357-W359 HydrophobicContact CZ-CE3 3.8Å; F357-W359 HydrophobicContact CZ-CZ3 4.25Å; F357-V363 HydrophobicContact CD2-CG2 3.99Å
358	H	94.3	Very high	94.1	Very high	66 Å²	66	102.7 Å²	102.7	31%	0.306	51%	0.514	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	129.8	170.5	-70.7	-93.7	0	0	0	107.7	K356 C360 C361 Y362	K356-H358 PolarHBondContact O-CD2 3.33Å; H358-C360 PolarHBondContact O-N 3.24Å; H358-C361 PolarHBondContact O-N 2.76Å; H358-Y362 HydrophobicContact CB-CD2 4.08Å; H358-Y362 HydrophobicContact CB-CE1 4.17Å; H358-Y362 HydrophobicContact CB-CE2 3.64Å; H358-Y362 HydrophobicContact CB-CG 4.48Å; H358-Y362 AromaticContact CD2-CE2 3.48Å; H358-Y362 VanDerWaalsContact CD2-CE2 3.48Å; H358-Y362 WeakPolarHBondContact CD2-CE2 3.31Å; H358-Y362 AromaticContact CG-CE2 3.55Å; H358-Y362 AromaticContact CG-CZ 3.84Å; H358-Y362 PolarHBondContact N-O 2.78Å
359	W	86.9	Confident	94.2	Very high	219 Å²	219	103 Å²	103	83%	0.83	52%	0.516	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.5	39.2	-171.8	-170.4	-158.5	0	0	0	114.7	F357	F357-W359 HydrophobicContact CE1-CB 4.38Å; F357-W359 HydrophobicContact CE1-CD2 4.31Å; F357-W359 AromaticContact CE1-CE3 3.68Å; F357-W359 HydrophobicContact CE1-CE3 3.68Å; F357-W359 HydrophobicContact CE1-CZ3 4.45Å; F357-W359 AromaticContact CZ-CE3 3.8Å; F357-W359 HydrophobicContact CZ-CE3 3.8Å; F357-W359 HydrophobicContact CZ-CZ3 4.25Å
360	C	83.4	Confident	94.3	Very high	79 Å²	79	104.6 Å²	104.6	53%	0.534	52%	0.52	S	S	.	.	T	Hydrogen-bonded Turn	trans	-137.4	30.2	173.3	54	0	0	0	0	109.7	H358 Y362	H358-C360 PolarHBondContact O-N 3.24Å; C360-Y362 WeakPolarHBondContact SG-CE1 3.29Å
361	C	91.3	Very high	94.3	Very high	109 Å²	109	106.2 Å²	106.2	74%	0.736	52%	0.524	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.2	26.7	168	-50.1	0	0	0	0	117.4	H358	H358-C361 PolarHBondContact O-N 2.76Å
362	Y	93.1	Very high	94.2	Very high	121 Å²	121	105.1 Å²	105.1	48%	0.475	52%	0.522	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	152.3	170.7	66.3	-95.9	0	0	0	113.2	H358 C360 K364	H358-Y362 HydrophobicContact CB-CD2 4.08Å; H358-Y362 HydrophobicContact CB-CE1 4.17Å; H358-Y362 HydrophobicContact CB-CE2 3.64Å; H358-Y362 HydrophobicContact CB-CG 4.48Å; H358-Y362 AromaticContact CD2-CE2 3.48Å; H358-Y362 VanDerWaalsContact CD2-CE2 3.48Å; H358-Y362 WeakPolarHBondContact CD2-CE2 3.31Å; H358-Y362 AromaticContact CG-CE2 3.55Å; H358-Y362 AromaticContact CG-CZ 3.84Å; H358-Y362 PolarHBondContact N-O 2.78Å; C360-Y362 WeakPolarHBondContact SG-CE1 3.29Å; Y362-K364 HydrophobicContact CD2-CB 4.45Å; Y362-K364 HydrophobicContact CE2-CB 4.32Å
363	V	95.8	Very high	94.1	Very high	87 Å²	87	99.2 Å²	99.2	53%	0.527	51%	0.506	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	121.9	173.5	-179.5	0	0	0	0	108.2	C355 K356 F357	C355-V363 HydrophobicContact CB-CG1 3.74Å; K356-V363 WeakPolarHBondContact O-CA 3.05Å; F357-V363 HydrophobicContact CD2-CG2 3.99Å
364	K	95.8	Very high	94.1	Very high	140 Å²	140	101.2 Å²	101.2	61%	0.609	51%	0.513	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-101.8	113.2	173	-168.6	173.3	-177.5	173.8	0	108.8	K356 Y362	K356-K364 PolarHBondContact N-O 3.4Å; K356-K364 PolarHBondContact O-N 3.37Å; Y362-K364 HydrophobicContact CD2-CB 4.45Å; Y362-K364 HydrophobicContact CE2-CB 4.32Å
365	C	97.3	Very high	94.1	Very high	39 Å²	39	97.1 Å²	97.1	26%	0.264	49%	0.49	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	151.7	174.5	-55.3	0	0	0	0	110.7	R352 C355	R352-C365 HydrophobicContact CB-CB 3.84Å; R352-C365 HydrophobicContact CG-CB 4.18Å; C355-C365 HydrophobicContact CB-CB 4.1Å; C355-C365 WeakPolarHBondContact CB-SG 3.4Å; C355-C365 WeakPolarHBondContact SG-CB 3.44Å; C355-C365 CovalentContact SG-SG 2.04Å; C355-C365 PolarHBondContact SG-SG 2.98Å
366	K	96.9	Very high	94.1	Very high	145 Å²	145	95.2 Å²	95.2	63%	0.63	48%	0.477	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84.4	154.6	162.8	-64.7	-176.9	178.9	-176.9	0	108.7	R352 C353 N354	R352-K366 WeakPolarHBondContact CA-O 3.28Å; C353-K366 PolarHBondContact N-O 2.03Å; C353-K366 PolarHBondContact O-N 2.84Å; C353-K366 PolarHBondContact SG-O 3.42Å; N354-K366 HydrophobicContact CB-CD 4.45Å
367	V	96.3	Very high	94.1	Very high	108 Å²	108	88.2 Å²	88.2	66%	0.655	45%	0.447	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.1	119.7	168.1	-179.5	0	0	0	0	107.1	V350	V350-V367 HydrophobicContact CG1-CG1 3.39Å
368	C	96.1	Very high	94.1	Very high	34 Å²	34	88 Å²	88	23%	0.23	45%	0.445	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	142.2	172.2	-77.2	0	0	0	0	109.7	V350 E351 C353	V350-C368 WeakPolarHBondContact CA-O 3.4Å; E351-C368 HydrophobicContact CG-CB 4.35Å; E351-C368 PolarHBondContact N-O 3.45Å; E351-C368 PolarHBondContact O-N 2.78Å; C353-C368 HydrophobicContact CB-CB 3.58Å; C353-C368 WeakPolarHBondContact CB-SG 3.41Å; C353-C368 WeakPolarHBondContact SG-CB 3.44Å; C353-C368 PolarHBondContact SG-N 2.89Å; C353-C368 CovalentContact SG-SG 1.99Å; C353-C368 PolarHBondContact SG-SG 3.31Å
369	T	95.6	Very high	94.1	Very high	100 Å²	100	89.1 Å²	89.1	61%	0.613	45%	0.452	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-112.1	124.6	171.3	53.4	0	0	0	0	108.6	T348 L349 V350	T348-T369 HydrophobicContact CG2-CG2 4.29Å; L349-T369 WeakPolarHBondContact O-CA 3.39Å; V350-T369 HydrophobicContact CG2-CG2 4.24Å
370	K	94.6	Very high	94.4	Very high	111 Å²	111	82.3 Å²	82.3	48%	0.483	43%	0.432	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	137	173.4	-69.1	177.4	178.1	165.6	0	108.9	T348 L349 E351 V372	T348-K370 CarbonylContact C-O 3.45Å; L349-K370 PolarHBondContact N-O 3.4Å; L349-K370 PolarHBondContact O-N 3.14Å; E351-K370 WeakPolarHBondContact OE1-CD 3.44Å; E351-K370 WeakPolarHBondContact OE1-CE 3.44Å; E351-K370 IonicContact OE1-NZ 3.39Å; E351-K370 PolarHBondContact OE1-NZ 3.17Å; K370-V372 HydrophobicContact CB-CG1 4.44Å
371	I	94.3	Very high	95	Very high	126 Å²	126	82.4 Å²	82.4	65%	0.646	43%	0.427	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87.2	118.5	171.3	-57.4	175.2	0	0	0	106.6	K346 A347	K346-I371 HydrophobicContact CB-CG2 3.87Å; K346-I371 HydrophobicContact CD-CG2 4.02Å; K346-I371 HydrophobicContact CG-CG2 4.18Å; A347-I371 WeakPolarHBondContact O-CA 3.5Å
372	V	93.7	Very high	95.3	Very high	45 Å²	45	80.9 Å²	80.9	27%	0.273	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	142.3	179.5	-62.4	0	0	0	0	109.8	A347 L349 K370 Q374	A347-V372 HydrophobicContact CB-CG2 4.33Å; A347-V372 PolarHBondContact N-O 3.21Å; A347-V372 PolarHBondContact O-N 2.7Å; L349-V372 HydrophobicContact CB-CG1 4.28Å; L349-V372 HydrophobicContact CB-CG2 4Å; L349-V372 HydrophobicContact CD2-CG1 4.39Å; K370-V372 HydrophobicContact CB-CG1 4.44Å; V372-Q374 HydrophobicContact CG2-CG 4.37Å
373	D	93.4	Very high	95.4	Very high	80 Å²	80	78.4 Å²	78.4	43%	0.428	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	127.1	169.5	-68.3	-54.6	0	0	0	109.2	Q344 F375	Q344-D373 HydrophobicContact CG-CB 4.49Å; Q344-D373 PolarHBondContact NE2-OD1 2.95Å; D373-F375 HydrophobicContact CB-CE2 4.15Å; D373-F375 HydrophobicContact CB-CZ 3.96Å
374	Q	94.3	Very high	95.4	Very high	58 Å²	58	77.8 Å²	77.8	27%	0.271	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	140.4	171.3	-70	-170.7	7.6	0	0	109.4	L322 Q344 F345 A347 V372	L322-Q374 HydrophobicContact CD2-CB 4.13Å; L322-Q374 HydrophobicContact CD2-CG 4.41Å; Q344-Q374 WeakPolarHBondContact CA-O 3.04Å; F345-Q374 HydrophobicContact CD1-CB 4.39Å; F345-Q374 HydrophobicContact CD2-CB 3.95Å; F345-Q374 HydrophobicContact CE1-CB 3.87Å; F345-Q374 HydrophobicContact CE2-CB 3.43Å; F345-Q374 VanDerWaalsContact CE2-CB 3.43Å; F345-Q374 HydrophobicContact CE2-CG 4.1Å; F345-Q374 HydrophobicContact CG-CB 4.41Å; F345-Q374 HydrophobicContact CZ-CB 3.36Å; F345-Q374 HydrophobicContact CZ-CG 4.33Å; F345-Q374 VanDerWaalsContact CZ-OE1 3.28Å; F345-Q374 PolarHBondContact N-O 2.66Å; F345-Q374 PolarHBondContact O-N 3.16Å; A347-Q374 VanDerWaalsContact CB-CD 3.4Å; A347-Q374 HydrophobicContact CB-CG 3.78Å; A347-Q374 VanDerWaalsContact CB-NE2 3.29Å; V372-Q374 HydrophobicContact CG2-CG 4.37Å
375	F	95.9	Very high	95.3	Very high	27 Å²	27	73.4 Å²	73.4	12%	0.118	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	126.4	-179.9	-53.9	-81.5	0	0	0	108.7	L322 C323 K325 Y342 D343 Q344 D373	L322-F375 WeakPolarHBondContact CA-O 3.46Å; C323-F375 PolarHBondContact N-O 3.04Å; K325-F375 HydrophobicContact CB-CD1 4.33Å; K325-F375 HydrophobicContact CB-CD2 3.7Å; K325-F375 HydrophobicContact CB-CE1 4.19Å; K325-F375 HydrophobicContact CB-CE2 3.56Å; K325-F375 HydrophobicContact CB-CG 4.09Å; K325-F375 HydrophobicContact CB-CZ 3.82Å; K325-F375 HydrophobicContact CD-CD1 4.28Å; K325-F375 HydrophobicContact CD-CE1 3.57Å; K325-F375 HydrophobicContact CD-CE2 4.19Å; K325-F375 HydrophobicContact CD-CZ 3.53Å; K325-F375 HydrophobicContact CG-CE1 4.48Å; K325-F375 HydrophobicContact CG-CZ 4.31Å; Y342-F375 HydrophobicContact CD2-CB 3.93Å; Y342-F375 AromaticContact CD2-CD1 3.57Å; Y342-F375 HydrophobicContact CD2-CD1 3.57Å; Y342-F375 HydrophobicContact CD2-CG 4.14Å; Y342-F375 HydrophobicContact CE2-CB 4.47Å; Y342-F375 AromaticContact CE2-CD1 3.47Å; Y342-F375 HydrophobicContact CE2-CD1 3.47Å; Y342-F375 VanDerWaalsContact CE2-CD1 3.47Å; Y342-F375 HydrophobicContact CE2-CE1 4.04Å; Y342-F375 HydrophobicContact CE2-CG 4.23Å; Y342-F375 HydrophobicContact CG-CB 4.47Å; D343-F375 CarbonylContact O-C 3.58Å; D343-F375 VanDerWaalsContact O-CA 3.31Å; D343-F375 WeakPolarHBondContact O-CA 3.3Å; Q344-F375 HydrophobicContact CB-CD1 3.94Å; Q344-F375 HydrophobicContact CB-CE1 3.94Å; Q344-F375 HydrophobicContact CG-CD1 4.03Å; Q344-F375 HydrophobicContact CG-CE1 3.63Å; Q344-F375 HydrophobicContact CG-CZ 4.38Å; D373-F375 HydrophobicContact CB-CE2 4.15Å; D373-F375 HydrophobicContact CB-CZ 3.96Å
376	V	95.9	Very high	95.2	Very high	28 Å²	28	76 Å²	76	17%	0.17	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	133	-178.8	165	0	0	0	0	110.5	G320 R321 L322 Y342 D343 F345	G320-V376 VanDerWaalsContact C-CG1 3.48Å; G320-V376 VanDerWaalsContact CA-CG1 3.48Å; R321-V376 CarbonylContact O-C 3.58Å; R321-V376 VanDerWaalsContact O-CA 3.31Å; R321-V376 WeakPolarHBondContact O-CA 3.49Å; L322-V376 HydrophobicContact CD2-CG2 3.7Å; L322-V376 HydrophobicContact CG-CG2 4.31Å; Y342-V376 CarbonylContact C-O 3.56Å; Y342-V376 WeakPolarHBondContact CA-O 3.36Å; Y342-V376 VanDerWaalsContact CB-O 3.3Å; Y342-V376 WeakPolarHBondContact CB-O 3.22Å; D343-V376 PolarHBondContact N-O 2.83Å; D343-V376 PolarHBondContact O-N 2.03Å; F345-V376 HydrophobicContact CE1-CB 3.77Å; F345-V376 HydrophobicContact CE1-CG2 3.31Å; F345-V376 HydrophobicContact CZ-CG2 3.59Å
377	C	96	Very high	95.1	Very high	3 Å²	3	70.3 Å²	70.3	2%	0.02	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.6	137.2	179.6	-62.5	0	0	0	0	112.6	T318 G320 R321 C337	T318-C377 VanDerWaalsContact O-CB 3.24Å; T318-C377 WeakPolarHBondContact O-CB 3.28Å; G320-C377 PolarHBondContact N-O 3.26Å; R321-C377 PolarHBondContact O-N 3.17Å; C337-C377 WeakPolarHBondContact CA-SG 3.36Å; C337-C377 HydrophobicContact CB-CB 3.58Å; C337-C377 WeakPolarHBondContact CB-SG 3.14Å; C337-C377 PolarHBondContact N-SG 3.39Å; C337-C377 VanDerWaalsContact N-SG 3.45Å; C337-C377 WeakPolarHBondContact SG-CA 3.37Å; C337-C377 WeakPolarHBondContact SG-CB 3.45Å; C337-C377 CovalentContact SG-SG 2.04Å; C337-C377 PolarHBondContact SG-SG 2.92Å
378	K	94.6	Very high	94.9	Very high	123 Å²	123	66.8 Å²	66.8	54%	0.535	34%	0.344	S	S	.	.			trans	-71.2	0	172.8	-68	179.8	175.9	-176.4	0	112.8	V319 R340 G341 D343	V319-K378 WeakPolarHBondContact CG1-OXT 3.44Å; R340-K378 HydrophobicContact CB-CB 4.46Å; R340-K378 PolarHBondContact NE-O 3.16Å; R340-K378 PolarHBondContact NH2-O 3.33Å; G341-K378 PolarHBondContact O-N 3.46Å; D343-K378 VanDerWaalsContact CG-CE 3.42Å; D343-K378 WeakPolarHBondContact OD1-CE 3Å; D343-K378 IonicContact OD1-NZ 3.98Å; D343-K378 PolarHBondContact OD1-NZ 2.9Å

Retrieved 378 of 378 residues in 113 ms (Link to these results)

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