A0A087Y0I9_POEFO Loading...

Transmembrane 7 superfamily member 3

AlphaFold DB , UniProt , Accession A0A087Y0I9, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 560 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	34.9	Very low	33.4	Very low	247 Å²	247	167.5 Å²	167.5	100%	1.217	86%	0.859	S	S	*	*				0	115.1	0	-64.3	168.8	75.5	0	0	105.9
2	S	33.5	Very low	33.4	Very low	102 Å²	102	169.1 Å²	169.1	71%	0.713	86%	0.855	S	S	*	*			cis	-164.1	120.5	7	172.8	0	0	0	0	103.1
3	H	34.3	Very low	33.4	Very low	157 Å²	157	171.8 Å²	171.8	73%	0.727	86%	0.859	S	S	*	*				49.3	136.3	103.8	-82.2	-78.2	0	0	0	114.5
4	W	33.9	Very low	33	Very low	221 Å²	221	167 Å²	167	84%	0.837	86%	0.859	S	S	*	*			cis	174.5	176.3	-2	-130.2	50.6	0	0	0	106.4
5	M	31.3	Very low	32.5	Very low	157 Å²	157	163.3 Å²	163.3	77%	0.773	85%	0.852	S	S	*	*			trans	85	104.3	165	-63	168.3	58.7	0	0	117
6	W	31.8	Very low	32.4	Very low	253 Å²	253	163.9 Å²	163.9	96%	0.958	85%	0.849	S	S	*	*				54.6	114.5	66.8	-75.2	56.7	0	0	0	115.1
7	G	29.3	Very low	32.6	Very low	74 Å²	74	160.1 Å²	160.1	76%	0.763	83%	0.834	S	S	*	*			trans	-171.4	109.5	164.3	0	0	0	0	0	110.3
8	P	38.9	Very low	33.4	Very low	122 Å²	122	160.1 Å²	160.1	79%	0.792	83%	0.83	S	S	*	*			trans	-91.7	130.6	-174.9	34.5	-29.1	0	0	0	111
9	L	35.3	Very low	34.4	Very low	171 Å²	171	154.4 Å²	154.4	90%	0.895	80%	0.803	S	S	*	*			trans	-158.5	90.9	171.8	-115.6	149.3	0	0	0	107.8
10	L	31.6	Very low	35.7	Very low	169 Å²	169	149.9 Å²	149.9	89%	0.885	78%	0.778	S	S	*	*			trans	-172.9	65.9	158.4	-98.7	156.3	0	0	0	108
11	L	32.9	Very low	37.3	Very low	169 Å²	169	147.4 Å²	147.4	89%	0.885	77%	0.769	S	S	*	*			trans	-94.6	82.9	159.8	-110.8	161.1	0	0	0	105.6
12	F	33.4	Very low	38.8	Very low	187 Å²	187	144.2 Å²	144.2	82%	0.82	75%	0.751	S	S	*	*			trans	-171.8	131.8	158.6	-98	-70.3	0	0	0	107.8
13	F	32.3	Very low	40.9	Very low	205 Å²	205	142.2 Å²	142.2	90%	0.899	73%	0.733	S	S	*	*			trans	90.1	72.1	-176.1	-63.9	-82.5	0	0	0	117.2
14	A	28.2	Very low	43.4	Very low	104 Å²	104	137.9 Å²	137.9	86%	0.86	71%	0.713	S	S	*	*			trans	-163.1	77.2	136.7	0	0	0	0	0	108
15	C	25.9	Very low	46.1	Very low	112 Å²	112	127.5 Å²	127.5	76%	0.757	67%	0.673	S	S	*	*			trans	-108.1	75.4	159.9	-156.1	0	0	0	0	105.5	V17	C15-V17 PolarHBondContact O-N 2.92Å
16	E	30.8	Very low	48.9	Very low	172 Å²	172	122 Å²	122	80%	0.804	65%	0.648	S	S	*	*			trans	-65.6	96.8	155.7	-86.9	-178.4	155.9	0	0	105.5	Q18	E16-Q18 VanDerWaalsContact C-N 3.26Å; E16-Q18 PolarHBondContact O-N 3.02Å
17	V	36	Very low	51.6	Low	99 Å²	99	110 Å²	110	60%	0.6	60%	0.603	S	S	*	*			trans	-70.9	91.4	173.9	172.1	0	0	0	0	106.5	C15 T19	C15-V17 PolarHBondContact O-N 2.92Å; V17-T19 VanDerWaalsContact C-N 3.34Å; V17-T19 HydrophobicContact CG1-CG2 3.29Å; V17-T19 PolarHBondContact O-N 3.4Å; V17-T19 VanDerWaalsContact O-N 3.08Å
18	Q	46.9	Very low	54.4	Low	160 Å²	160	109.2 Å²	109.2	75%	0.748	58%	0.581	S	S	*	*			trans	-76.7	85.8	172.8	-159	152.8	6	0	0	108.1	E16 Q20	E16-Q18 VanDerWaalsContact C-N 3.26Å; E16-Q18 PolarHBondContact O-N 3.02Å; Q18-Q20 PolarHBondContact O-N 2.99Å
19	T	52.5	Low	56.5	Low	53 Å²	53	106.7 Å²	106.7	33%	0.325	57%	0.565	S	S	.	*			trans	-95.1	55.1	179.2	45.2	0	0	0	0	111.9	V17	V17-T19 VanDerWaalsContact C-N 3.34Å; V17-T19 HydrophobicContact CG1-CG2 3.29Å; V17-T19 PolarHBondContact O-N 3.4Å; V17-T19 VanDerWaalsContact O-N 3.08Å
20	Q	60.3	Low	58.7	Low	63 Å²	63	100.3 Å²	100.3	29%	0.294	54%	0.541	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	106.2	158.5	-175.6	168.3	-4.4	0	0	107.4	Q18 V25 N36	Q18-Q20 PolarHBondContact O-N 2.99Å; Q20-V25 HydrophobicContact CB-CG2 3.9Å; Q20-V25 HydrophobicContact CG-CG2 3.61Å; Q20-N36 PolarHBondContact NE2-O 2.89Å; Q20-N36 VanDerWaalsContact OE1-N 3.08Å
21	V	69.3	Low	61.4	Low	99 Å²	99	94 Å²	94	60%	0.6	51%	0.513	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-101.4	106.2	177.5	178.9	0	0	0	0	107.7	N23 H24	V21-N23 PolarHBondContact O-N 3.4Å; V21-H24 PolarHBondContact N-O 2.64Å; V21-H24 PolarHBondContact O-N 3.08Å
22	E	65.4	Low	64.2	Low	180 Å²	180	88.3 Å²	88.3	84%	0.841	48%	0.481	S	S	*	.	T	Hydrogen-bonded Turn	trans	41.2	-30.1	174	-90.1	177.9	174.2	0	0	120.5
23	N	79.4	Confident	67	Low	60 Å²	60	81 Å²	81	32%	0.321	45%	0.449	S	S	.	.	T	Hydrogen-bonded Turn	trans	-165.4	23.9	166.6	-88.5	-47.5	0	0	0	112.2	V21 E41 V43 E44	V21-N23 PolarHBondContact O-N 3.4Å; N23-E41 PolarHBondContact OD1-OE2 2.85Å; N23-V43 WeakPolarHBondContact O-CA 3.25Å; N23-E44 PolarHBondContact O-N 3.29Å
24	H	86.5	Confident	69.9	Low	66 Å²	66	75.8 Å²	75.8	31%	0.306	43%	0.431	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	131.8	-172.8	175.9	-107.5	0	0	0	110.8	V21 T26 E44 V46	V21-H24 PolarHBondContact N-O 2.64Å; V21-H24 PolarHBondContact O-N 3.08Å; H24-T26 WeakPolarHBondContact CE1-CG2 3.43Å; H24-E44 WeakPolarHBondContact CA-O 3.32Å; H24-V46 VanDerWaalsContact CD2-CG2 3.44Å; H24-V46 WeakPolarHBondContact CD2-CG2 3.25Å; H24-V46 WeakPolarHBondContact NE2-CB 3.26Å; H24-V46 WeakPolarHBondContact NE2-CG2 3.46Å
25	V	90.5	Very high	72.9	Confident	2 Å²	2	70.9 Å²	70.9	1%	0.012	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	126.5	178.4	178.5	0	0	0	0	109.4	Q20 F27 Q33 V35 V43 E44 V46	Q20-V25 HydrophobicContact CB-CG2 3.9Å; Q20-V25 HydrophobicContact CG-CG2 3.61Å; V25-F27 HydrophobicContact CB-CE2 4.16Å; V25-F27 HydrophobicContact CG1-CD2 4.15Å; V25-F27 HydrophobicContact CG1-CE2 3.67Å; V25-F27 HydrophobicContact CG1-CZ 3.9Å; V25-Q33 VanDerWaalsContact CG1-OE1 3.25Å; V25-V35 HydrophobicContact CG1-CG2 4.1Å; V25-V35 HydrophobicContact CG2-CG1 4.09Å; V25-V35 HydrophobicContact CG2-CG2 4.23Å; V25-V43 HydrophobicContact CB-CG1 4.45Å; V25-V43 HydrophobicContact CG2-CG1 3.79Å; V25-E44 PolarHBondContact N-O 2.71Å; V25-V46 PolarHBondContact O-N 2.77Å
26	T	89.8	Confident	76	Confident	41 Å²	41	69.6 Å²	69.6	25%	0.252	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	113.6	179.7	53.6	0	0	0	0	111.6	H24 Q33 V46	H24-T26 WeakPolarHBondContact CE1-CG2 3.43Å; T26-Q33 PolarHBondContact O-NE2 2.91Å; T26-Q33 PolarHBondContact O-OE1 2.77Å; T26-V46 CarbonylContact C-O 3.57Å; T26-V46 VanDerWaalsContact CA-O 3.32Å; T26-V46 WeakPolarHBondContact CA-O 3.45Å
27	F	89.1	Confident	78.8	Confident	1 Å²	1	61.4 Å²	61.4	0%	0.004	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	144.7	177.8	-67.7	-91.9	0	0	0	112.6	V25 Q33 V35 A45 V46 T48 L59 G116 F118	V25-F27 HydrophobicContact CB-CE2 4.16Å; V25-F27 HydrophobicContact CG1-CD2 4.15Å; V25-F27 HydrophobicContact CG1-CE2 3.67Å; V25-F27 HydrophobicContact CG1-CZ 3.9Å; F27-Q33 HydrophobicContact CD1-CB 4.21Å; F27-Q33 HydrophobicContact CD1-CG 4.32Å; F27-Q33 HydrophobicContact CE1-CB 3.8Å; F27-Q33 HydrophobicContact CE1-CG 4.41Å; F27-V35 HydrophobicContact CZ-CG2 3.78Å; F27-A45 HydrophobicContact CD2-CB 4.09Å; F27-A45 HydrophobicContact CE2-CB 3.64Å; F27-V46 PolarHBondContact N-O 2.92Å; F27-T48 PolarHBondContact O-N 2.84Å; F27-L59 HydrophobicContact CD2-CD1 4.45Å; F27-G116 WeakPolarHBondContact CE1-O 3.11Å; F27-F118 HydrophobicContact CB-CD1 3.73Å; F27-F118 HydrophobicContact CB-CE1 4.22Å
28	L	86.4	Confident	81.2	Confident	58 Å²	58	58.6 Å²	58.6	30%	0.304	32%	0.322	S	S	.	.			trans	-116.3	151.2	176.4	-61.7	-175.8	0	0	0	112.2	G30 A31 R49 F118	L28-G30 PolarHBondContact O-N 3.17Å; L28-A31 HydrophobicContact CB-CB 4.03Å; L28-A31 WeakPolarHBondContact O-CB 3.46Å; L28-A31 PolarHBondContact O-N 2.52Å; L28-R49 VanDerWaalsContact CD1-NH2 3.26Å; L28-F118 WeakPolarHBondContact O-CD1 3.44Å; L28-F118 WeakPolarHBondContact O-CE1 3.33Å
29	P	83.9	Confident	83	Confident	70 Å²	70	54.8 Å²	54.8	46%	0.455	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	1.6	69.9	159.8	39.2	-25.4	0	0	0	121.5	A31 F118	P29-A31 PolarHBondContact O-N 3.4Å; P29-F118 HydrophobicContact CB-CE1 3.94Å; P29-F118 HydrophobicContact CB-CE2 3.68Å; P29-F118 HydrophobicContact CB-CZ 3.27Å; P29-F118 VanDerWaalsContact CD-CE1 3.46Å; P29-F118 HydrophobicContact CG-CE1 4.03Å; P29-F118 HydrophobicContact CG-CE2 4.06Å; P29-F118 HydrophobicContact CG-CZ 3.3Å; P29-F118 VanDerWaalsContact N-CZ 3.27Å
30	G	81.4	Confident	84.3	Confident	37 Å²	37	58.8 Å²	58.8	38%	0.381	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	63.9	18.5	-178.5	0	0	0	0	0	115.4	L28 F118	L28-G30 PolarHBondContact O-N 3.17Å; G30-F118 WeakPolarHBondContact CA-O 3.38Å; G30-F118 PolarHBondContact N-O 3.47Å
31	A	88.9	Confident	85.5	Confident	37 Å²	37	59.4 Å²	59.4	31%	0.306	33%	0.329	S	S	.	.			trans	-88.8	128.7	174	0	0	0	0	0	109.9	L28 P29	L28-A31 HydrophobicContact CB-CB 4.03Å; L28-A31 WeakPolarHBondContact O-CB 3.46Å; L28-A31 PolarHBondContact O-N 2.52Å; P29-A31 PolarHBondContact O-N 3.4Å
32	F	91.6	Very high	86.4	Confident	48 Å²	48	56.7 Å²	56.7	21%	0.211	31%	0.312	C	S	.	.			trans	-76.7	141	175	-73.8	-101.8	0	0	0	110.2	G116 V117 Q208 A211	F32-G116 WeakPolarHBondContact CA-O 3.37Å; F32-V117 HydrophobicContact CD1-CB 3.84Å; F32-V117 HydrophobicContact CD1-CG1 4.29Å; F32-V117 HydrophobicContact CD1-CG2 4.42Å; F32-V117 HydrophobicContact CD2-CB 4.32Å; F32-V117 HydrophobicContact CD2-CG2 4Å; F32-V117 HydrophobicContact CE1-CB 3.65Å; F32-V117 HydrophobicContact CE1-CG1 3.64Å; F32-V117 HydrophobicContact CE1-CG2 4.17Å; F32-V117 HydrophobicContact CE2-CB 4.14Å; F32-V117 HydrophobicContact CE2-CG2 3.72Å; F32-V117 HydrophobicContact CG-CB 4.16Å; F32-V117 HydrophobicContact CG-CG2 4.32Å; F32-V117 HydrophobicContact CZ-CB 3.79Å; F32-V117 HydrophobicContact CZ-CG1 3.76Å; F32-V117 HydrophobicContact CZ-CG2 3.79Å; F32-Q208 HydrophobicContact CD1-CB 4.31Å; F32-Q208 HydrophobicContact CD2-CB 4.28Å; F32-Q208 HydrophobicContact CD2-CG 3.7Å; F32-Q208 HydrophobicContact CE1-CB 4.11Å; F32-Q208 HydrophobicContact CE2-CB 4.08Å; F32-Q208 HydrophobicContact CE2-CG 3.66Å; F32-Q208 HydrophobicContact CG-CB 4.4Å; F32-Q208 HydrophobicContact CG-CG 4.2Å; F32-Q208 VanDerWaalsContact CZ-CA 3.46Å; F32-Q208 HydrophobicContact CZ-CB 4Å; F32-Q208 HydrophobicContact CZ-CG 4.11Å; F32-A211 HydrophobicContact CE1-CB 4.32Å; F32-A211 HydrophobicContact CE2-CB 4.43Å; F32-A211 HydrophobicContact CZ-CB 3.52Å
33	Q	91.8	Very high	87.7	Confident	34 Å²	34	48.1 Å²	48.1	16%	0.159	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138	134.3	172.8	-65.6	-173.2	30.3	0	0	110.9	V25 T26 F27 T115 G116	V25-Q33 VanDerWaalsContact CG1-OE1 3.25Å; T26-Q33 PolarHBondContact O-NE2 2.91Å; T26-Q33 PolarHBondContact O-OE1 2.77Å; F27-Q33 HydrophobicContact CD1-CB 4.21Å; F27-Q33 HydrophobicContact CD1-CG 4.32Å; F27-Q33 HydrophobicContact CE1-CB 3.8Å; F27-Q33 HydrophobicContact CE1-CG 4.41Å; Q33-T115 WeakPolarHBondContact O-CA 3.28Å; Q33-G116 PolarHBondContact N-O 3.49Å; Q33-G116 PolarHBondContact O-N 3.41Å
34	N	92.8	Very high	88.4	Confident	95 Å²	95	48.1 Å²	48.1	51%	0.508	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	129.1	170.5	-61.2	-25.4	0	0	0	108.6	G114	N34-G114 WeakPolarHBondContact CA-O 3Å
35	V	91.8	Very high	88.7	Confident	1 Å²	1	45 Å²	45	1%	0.006	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	136.1	177.5	-174.7	0	0	0	0	108.1	V25 F27 V37 V43 F61 L104 S113 G114	V25-V35 HydrophobicContact CG1-CG2 4.1Å; V25-V35 HydrophobicContact CG2-CG1 4.09Å; V25-V35 HydrophobicContact CG2-CG2 4.23Å; F27-V35 HydrophobicContact CZ-CG2 3.78Å; V35-V37 HydrophobicContact CG1-CG2 4.18Å; V35-V43 HydrophobicContact CG1-CG1 4.07Å; V35-F61 HydrophobicContact CB-CE2 3.83Å; V35-F61 HydrophobicContact CB-CZ 4.4Å; V35-F61 HydrophobicContact CG2-CE2 4.24Å; V35-L104 HydrophobicContact CG1-CD1 4.25Å; V35-S113 WeakPolarHBondContact O-CA 3.34Å; V35-S113 PolarHBondContact O-OG 3.43Å; V35-G114 PolarHBondContact N-O 2.84Å; V35-G114 PolarHBondContact O-N 3.16Å
36	N	91.5	Very high	88.8	Confident	85 Å²	85	45.3 Å²	45.3	46%	0.455	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	118.4	170.5	-168.8	19.2	0	0	0	109	Q20 V112	Q20-N36 PolarHBondContact NE2-O 2.89Å; Q20-N36 VanDerWaalsContact OE1-N 3.08Å; N36-V112 PolarHBondContact OD1-O 3.22Å
37	V	89.4	Confident	88.8	Confident	1 Å²	1	43.3 Å²	43.3	1%	0.006	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	113.2	177.6	-175.6	0	0	0	0	107.4	V35 V43 L104 P111 V112	V35-V37 HydrophobicContact CG1-CG2 4.18Å; V37-V43 HydrophobicContact CB-CG2 4.46Å; V37-V43 HydrophobicContact CG1-CG2 4.35Å; V37-V43 HydrophobicContact CG2-CG2 4.1Å; V37-L104 HydrophobicContact CG2-CB 4.1Å; V37-P111 WeakPolarHBondContact O-CA 3.41Å; V37-V112 PolarHBondContact N-O 3.16Å; V37-V112 PolarHBondContact O-N 3.1Å
38	S	86.9	Confident	88.8	Confident	39 Å²	39	45 Å²	45	27%	0.273	26%	0.256	S	S	.	.			trans	-81.1	171.7	-179.4	102	0	0	0	0	111.6	N40 E41	S38-N40 PolarHBondContact O-N 2.83Å; S38-E41 WeakPolarHBondContact CB-OE2 3.42Å; S38-E41 PolarHBondContact O-N 2.97Å; S38-E41 VanDerWaalsContact OG-CG 3.28Å; S38-E41 WeakPolarHBondContact OG-CG 3.19Å; S38-E41 PolarHBondContact OG-OE2 2.79Å
39	L	83.1	Confident	88.9	Confident	80 Å²	80	50.5 Å²	50.5	42%	0.419	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.4	128.6	-175.1	-168.5	94.2	0	0	0	111.4	E41 E109	L39-E41 PolarHBondContact O-N 2.85Å; L39-E109 HydrophobicContact CD1-CB 4.21Å; L39-E109 WeakPolarHBondContact CD1-O 3.49Å
40	N	79.9	Confident	89.1	Confident	138 Å²	138	47.5 Å²	47.5	74%	0.738	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.6	13.9	179.2	-60.3	-29.4	0	0	0	114.6	S38	S38-N40 PolarHBondContact O-N 2.83Å
41	E	85.3	Confident	89.4	Confident	76 Å²	76	47.5 Å²	47.5	36%	0.355	25%	0.246	S	C	.	.			trans	-97.8	148.1	173.6	-72	-170.4	156.5	0	0	110.7	N23 S38 L39	N23-E41 PolarHBondContact OD1-OE2 2.85Å; S38-E41 WeakPolarHBondContact CB-OE2 3.42Å; S38-E41 PolarHBondContact O-N 2.97Å; S38-E41 VanDerWaalsContact OG-CG 3.28Å; S38-E41 WeakPolarHBondContact OG-CG 3.19Å; S38-E41 PolarHBondContact OG-OE2 2.79Å; L39-E41 PolarHBondContact O-N 2.85Å
42	T	89.6	Confident	89.3	Confident	41 Å²	41	51 Å²	51	25%	0.252	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	116.4	173.1	60.2	0	0	0	0	107.9	L104	T42-L104 CarbonylContact C-O 3.44Å; T42-L104 WeakPolarHBondContact CA-O 3.17Å
43	V	92.8	Very high	89.1	Confident	0 Å²	0	53.3 Å²	53.3	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	126.4	178.5	179	0	0	0	0	108.8	N23 V25 V35 V37 L104	N23-V43 WeakPolarHBondContact O-CA 3.25Å; V25-V43 HydrophobicContact CB-CG1 4.45Å; V25-V43 HydrophobicContact CG2-CG1 3.79Å; V35-V43 HydrophobicContact CG1-CG1 4.07Å; V37-V43 HydrophobicContact CB-CG2 4.46Å; V37-V43 HydrophobicContact CG1-CG2 4.35Å; V37-V43 HydrophobicContact CG2-CG2 4.1Å; V43-L104 HydrophobicContact CB-CB 4.38Å; V43-L104 PolarHBondContact N-O 3.12Å; V43-L104 PolarHBondContact O-N 3.01Å
44	E	93.9	Very high	89.1	Confident	60 Å²	60	53.2 Å²	53.2	28%	0.28	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	114.6	174.6	-168.1	177.6	-172.5	0	0	110.1	N23 H24 V25 V46 S101 F103	N23-E44 PolarHBondContact O-N 3.29Å; H24-E44 WeakPolarHBondContact CA-O 3.32Å; V25-E44 PolarHBondContact N-O 2.71Å; E44-V46 HydrophobicContact CG-CG2 3.83Å; E44-S101 WeakPolarHBondContact OE1-CB 3.35Å; E44-F103 HydrophobicContact CB-CD1 4.28Å; E44-F103 HydrophobicContact CB-CE1 4.13Å; E44-F103 HydrophobicContact CG-CD1 4.25Å; E44-F103 HydrophobicContact CG-CE1 3.78Å; E44-F103 HydrophobicContact CG-CZ 4.36Å
45	A	93	Very high	89.1	Confident	0 Å²	0	48.7 Å²	48.7	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	104.5	174.9	0	0	0	0	0	109.4	F27 L59 L102 L104	F27-A45 HydrophobicContact CD2-CB 4.09Å; F27-A45 HydrophobicContact CE2-CB 3.64Å; A45-L59 HydrophobicContact CB-CD2 3.92Å; A45-L102 PolarHBondContact N-O 3.32Å; A45-L102 PolarHBondContact O-N 2.84Å; A45-L104 HydrophobicContact CB-CD1 4.37Å
46	V	92.6	Very high	89.3	Confident	9 Å²	9	48.7 Å²	48.7	6%	0.055	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	117.7	-178.1	-179.5	0	0	0	0	110.6	H24 V25 T26 F27 E44 T48 L99 L100	H24-V46 VanDerWaalsContact CD2-CG2 3.44Å; H24-V46 WeakPolarHBondContact CD2-CG2 3.25Å; H24-V46 WeakPolarHBondContact NE2-CB 3.26Å; H24-V46 WeakPolarHBondContact NE2-CG2 3.46Å; V25-V46 PolarHBondContact O-N 2.77Å; T26-V46 CarbonylContact C-O 3.57Å; T26-V46 VanDerWaalsContact CA-O 3.32Å; T26-V46 WeakPolarHBondContact CA-O 3.45Å; F27-V46 PolarHBondContact N-O 2.92Å; E44-V46 HydrophobicContact CG-CG2 3.83Å; V46-T48 HydrophobicContact CG1-CG2 3.93Å; V46-L99 HydrophobicContact CG1-CD1 3.82Å; V46-L99 HydrophobicContact CG1-CD2 4.05Å; V46-L99 HydrophobicContact CG1-CG 3.79Å; V46-L100 CarbonylContact C-O 3.52Å; V46-L100 WeakPolarHBondContact CA-O 3.35Å
47	V	89.5	Confident	89.4	Confident	0 Å²	0	44.7 Å²	44.7	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88	124.5	173.1	-176.8	0	0	0	0	108.6	I50 I57 L99 L100 F118	V47-I50 HydrophobicContact CG1-CD1 4.08Å; V47-I50 HydrophobicContact CG1-CG1 3.88Å; V47-I57 HydrophobicContact CB-CD1 4.33Å; V47-I57 HydrophobicContact CG1-CD1 4.18Å; V47-I57 HydrophobicContact CG2-CD1 4.21Å; V47-L99 WeakPolarHBondContact O-CA 3.48Å; V47-L100 HydrophobicContact CB-CB 4.36Å; V47-L100 PolarHBondContact N-O 3.19Å; V47-L100 PolarHBondContact O-N 3.48Å; V47-L100 VanDerWaalsContact O-N 3.16Å; V47-F118 HydrophobicContact CG1-CD1 3.98Å; V47-F118 HydrophobicContact CG1-CD2 3.94Å; V47-F118 HydrophobicContact CG1-CE1 3.63Å; V47-F118 HydrophobicContact CG1-CE2 3.73Å; V47-F118 HydrophobicContact CG1-CG 4.01Å; V47-F118 HydrophobicContact CG1-CZ 3.48Å; V47-F118 VanDerWaalsContact CG1-CZ 3.48Å; V47-F118 HydrophobicContact CG2-CB 4.38Å; V47-F118 HydrophobicContact CG2-CG 4.42Å
48	T	89.4	Confident	89.7	Confident	35 Å²	35	44.7 Å²	44.7	22%	0.215	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	161.2	-180	63.4	0	0	0	0	111.7	F27 V46 I50 L99	F27-T48 PolarHBondContact O-N 2.84Å; V46-T48 HydrophobicContact CG1-CG2 3.93Å; T48-I50 PolarHBondContact O-N 2.86Å; T48-L99 HydrophobicContact CG2-CD1 4.39Å
49	R	87.3	Confident	90.1	Very high	174 Å²	174	43 Å²	43	66%	0.657	22%	0.222	S	C	*	.			trans	60.6	42.2	176.5	-59.4	-173.1	-85.3	-155.3	-1.6	113.2	L28 P51 T98	L28-R49 VanDerWaalsContact CD1-NH2 3.26Å; R49-P51 WeakPolarHBondContact O-CD 3.41Å; R49-T98 PolarHBondContact N-O 2.8Å
50	I	88.3	Confident	90.7	Very high	8 Å²	8	39.1 Å²	39.1	4%	0.041	20%	0.202	C	C	.	.			trans	-67.7	121.6	175.8	-56.3	175.8	0	0	0	109.1	V47 T48 I57 L93 T98 L100	V47-I50 HydrophobicContact CG1-CD1 4.08Å; V47-I50 HydrophobicContact CG1-CG1 3.88Å; T48-I50 PolarHBondContact O-N 2.86Å; I50-I57 HydrophobicContact CD1-CD1 4.26Å; I50-L93 HydrophobicContact CD1-CD2 3.86Å; I50-L93 HydrophobicContact CG2-CD1 3.48Å; I50-L93 VanDerWaalsContact CG2-CD1 3.48Å; I50-L93 HydrophobicContact CG2-CD2 4.11Å; I50-L93 HydrophobicContact CG2-CG 4.45Å; I50-T98 PolarHBondContact N-O 2.81Å; I50-L100 HydrophobicContact CD1-CB 4.23Å
51	P	88.2	Confident	91.4	Very high	36 Å²	36	32.6 Å²	32.6	23%	0.234	17%	0.167	C	C	.	.			trans	-63.1	149.9	178.4	-21.7	33.4	0	0	0	112.6	R49 D53 M54 R165	R49-P51 WeakPolarHBondContact O-CD 3.41Å; P51-D53 VanDerWaalsContact C-N 3.29Å; P51-D53 WeakPolarHBondContact CB-OD1 3.43Å; P51-D53 PolarHBondContact O-N 3.39Å; P51-M54 HydrophobicContact CB-CG 3.92Å; P51-M54 HydrophobicContact CG-CE 4.44Å; P51-M54 HydrophobicContact CG-CG 4.05Å; P51-M54 PolarHBondContact O-N 3.31Å; P51-R165 PolarHBondContact O-NH1 3.21Å; P51-R165 VanDerWaalsContact O-NH1 3.15Å
52	P	85.9	Confident	92	Very high	110 Å²	110	29 Å²	29	71%	0.714	15%	0.151	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68	-28.1	-177.8	27.3	-33.7	0	0	0	113.3	M54 R165	P52-M54 VanDerWaalsContact C-N 3.31Å; P52-M54 PolarHBondContact O-N 3.03Å; P52-R165 VanDerWaalsContact CA-NH1 3.34Å; P52-R165 PolarHBondContact O-NH1 2.96Å
53	D	88.8	Confident	92.2	Very high	97 Å²	97	27.1 Å²	27.1	52%	0.519	14%	0.139	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79	-6.8	-178.1	58.6	-49.5	0	0	0	114.4	P51	P51-D53 VanDerWaalsContact C-N 3.29Å; P51-D53 WeakPolarHBondContact CB-OD1 3.43Å; P51-D53 PolarHBondContact O-N 3.39Å
54	M	91.8	Very high	92.2	Very high	32 Å²	32	28 Å²	28	16%	0.158	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	135.5	177.3	-58.8	-66.4	162.6	0	0	110.5	P51 P52 L93 Y121 R165	P51-M54 HydrophobicContact CB-CG 3.92Å; P51-M54 HydrophobicContact CG-CE 4.44Å; P51-M54 HydrophobicContact CG-CG 4.05Å; P51-M54 PolarHBondContact O-N 3.31Å; P52-M54 VanDerWaalsContact C-N 3.31Å; P52-M54 PolarHBondContact O-N 3.03Å; M54-L93 HydrophobicContact CB-CD1 3.96Å; M54-L93 WeakPolarHBondContact O-CD1 3.42Å; M54-Y121 CarbonylContact C-O 3.58Å; M54-Y121 WeakPolarHBondContact CA-O 3.42Å; M54-Y121 VanDerWaalsContact SD-C 3.52Å; M54-R165 WeakPolarHBondContact O-CD 3.32Å; M54-R165 PolarHBondContact O-NH1 2.94Å
55	A	93	Very high	92.1	Very high	0 Å²	0	28.1 Å²	28.1	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	-35.3	-178.9	0	0	0	0	0	112.9	L93 Y121 R165	A55-L93 WeakPolarHBondContact O-CB 3.35Å; A55-L93 PolarHBondContact O-N 3.02Å; A55-Y121 PolarHBondContact N-O 2.89Å; A55-R165 HydrophobicContact CB-CB 4.42Å
56	F	94.4	Very high	92	Very high	2 Å²	2	31.7 Å²	31.7	1%	0.009	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.1	161.3	177.1	64.4	-89.2	0	0	0	111	L90 S91 Y121 A125 P126 V127	F56-L90 HydrophobicContact CB-CD2 3.97Å; F56-L90 HydrophobicContact CD2-CD1 3.69Å; F56-L90 HydrophobicContact CD2-CD2 3.97Å; F56-L90 HydrophobicContact CD2-CG 3.79Å; F56-L90 HydrophobicContact CE2-CD1 3.81Å; F56-L90 HydrophobicContact CE2-CG 4.41Å; F56-L90 HydrophobicContact CG-CD2 4.18Å; F56-L90 HydrophobicContact CG-CG 4.49Å; F56-S91 WeakPolarHBondContact CA-O 3.49Å; F56-S91 WeakPolarHBondContact CB-O 3.23Å; F56-Y121 AromaticContact CD2-CD2 3.88Å; F56-Y121 HydrophobicContact CD2-CD2 3.88Å; F56-Y121 HydrophobicContact CD2-CG 4.39Å; F56-Y121 AromaticContact CE2-CD2 3.3Å; F56-Y121 HydrophobicContact CE2-CD2 3.3Å; F56-Y121 HydrophobicContact CE2-CE2 4.14Å; F56-Y121 AromaticContact CE2-CG 3.63Å; F56-Y121 HydrophobicContact CE2-CG 3.63Å; F56-Y121 AromaticContact CZ-CD2 3.94Å; F56-Y121 HydrophobicContact CZ-CD2 3.94Å; F56-Y121 AromaticContact CZ-CG 3.75Å; F56-Y121 HydrophobicContact CZ-CG 3.75Å; F56-Y121 PolarHBondContact N-O 2.88Å; F56-Y121 PolarHBondContact O-N 2.85Å; F56-A125 HydrophobicContact CE1-CB 4.46Å; F56-A125 HydrophobicContact CZ-CB 4.43Å; F56-P126 WeakPolarHBondContact CZ-O 3.33Å; F56-V127 HydrophobicContact CD1-CG2 4.23Å; F56-V127 HydrophobicContact CE1-CG2 3.78Å; F56-V127 HydrophobicContact CZ-CG2 4.24Å
57	I	94.3	Very high	92.1	Very high	1 Å²	1	34 Å²	34	1%	0.005	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	149.9	176.1	57.7	163.7	0	0	0	110.6	V47 I50 L90 S91 L93 L100 L119	V47-I57 HydrophobicContact CB-CD1 4.33Å; V47-I57 HydrophobicContact CG1-CD1 4.18Å; V47-I57 HydrophobicContact CG2-CD1 4.21Å; I50-I57 HydrophobicContact CD1-CD1 4.26Å; I57-L90 CarbonylContact O-C 3.44Å; I57-L90 WeakPolarHBondContact O-CA 3.37Å; I57-S91 PolarHBondContact N-O 3.47Å; I57-S91 PolarHBondContact O-N 3.46Å; I57-L93 HydrophobicContact CD1-CD2 4.47Å; I57-L93 HydrophobicContact CG1-CD2 4.19Å; I57-L93 HydrophobicContact CG2-CD1 4.03Å; I57-L93 HydrophobicContact CG2-CD2 4.39Å; I57-L93 HydrophobicContact CG2-CG 4.43Å; I57-L100 HydrophobicContact CD1-CB 4.04Å; I57-L100 HydrophobicContact CD1-CD2 3.27Å; I57-L100 HydrophobicContact CD1-CG 4.26Å; I57-L100 HydrophobicContact CG1-CD2 3.94Å; I57-L119 CarbonylContact C-O 3.57Å; I57-L119 VanDerWaalsContact CA-O 3.31Å; I57-L119 WeakPolarHBondContact CA-O 3.37Å
58	T	95.3	Very high	92.3	Very high	0 Å²	0	34 Å²	34	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	117.9	172.8	-51.4	0	0	0	0	108.1	Q60 L89 F118 L119 P141 V262	T58-Q60 HydrophobicContact CG2-CG 4.06Å; T58-L89 WeakPolarHBondContact CA-O 3.39Å; T58-F118 WeakPolarHBondContact O-CA 3.19Å; T58-L119 PolarHBondContact N-O 2.84Å; T58-L119 PolarHBondContact O-N 3.38Å; T58-P141 HydrophobicContact CG2-CB 4.43Å; T58-P141 HydrophobicContact CG2-CG 4.28Å; T58-V262 HydrophobicContact CG2-CG2 3.81Å
59	L	95.4	Very high	92.5	Very high	3 Å²	3	32.6 Å²	32.6	2%	0.016	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	131.9	167.6	-177.8	68.2	0	0	0	107.9	F27 A45 L70 G88 L89 L102 F118	F27-L59 HydrophobicContact CD2-CD1 4.45Å; A45-L59 HydrophobicContact CB-CD2 3.92Å; L59-L70 HydrophobicContact CD2-CD1 3.77Å; L59-G88 CarbonylContact O-C 3.55Å; L59-G88 WeakPolarHBondContact O-CA 3.27Å; L59-L89 PolarHBondContact N-O 3.4Å; L59-L89 PolarHBondContact O-N 3.3Å; L59-L102 HydrophobicContact CB-CD1 3.55Å; L59-L102 HydrophobicContact CD2-CB 3.84Å; L59-L102 HydrophobicContact CD2-CD1 3.43Å; L59-L102 VanDerWaalsContact CD2-CD1 3.43Å; L59-L102 HydrophobicContact CD2-CG 4.24Å; L59-L102 HydrophobicContact CG-CD1 4.12Å; L59-F118 HydrophobicContact CD1-CB 3.98Å
60	Q	95.6	Very high	92.9	Very high	0 Å²	0	24.3 Å²	24.3	0%	0	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	141.3	179.5	-52.1	-179.5	-7.6	0	0	108.6	T58 S87 G116 V117 V262	T58-Q60 HydrophobicContact CG2-CG 4.06Å; Q60-S87 CarbonylContact C-O 3.58Å; Q60-S87 WeakPolarHBondContact CA-O 3.41Å; Q60-G116 CarbonylContact O-C 3.57Å; Q60-G116 WeakPolarHBondContact O-CA 3.13Å; Q60-V117 HydrophobicContact CB-CG1 4.04Å; Q60-V117 PolarHBondContact N-O 2.89Å; Q60-V117 PolarHBondContact O-N 3.42Å; Q60-V262 HydrophobicContact CB-CG1 4.15Å; Q60-V262 HydrophobicContact CG-CB 4.43Å; Q60-V262 HydrophobicContact CG-CG1 3.9Å; Q60-V262 HydrophobicContact CG-CG2 4Å
61	F	95.9	Very high	93.2	Very high	1 Å²	1	24 Å²	24	0%	0.004	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	125.3	175.4	-171.8	-106.9	0	0	0	109.8	V35 T63 A68 S87 L104	V35-F61 HydrophobicContact CB-CE2 3.83Å; V35-F61 HydrophobicContact CB-CZ 4.4Å; V35-F61 HydrophobicContact CG2-CE2 4.24Å; F61-T63 HydrophobicContact CD1-CG2 4.19Å; F61-T63 HydrophobicContact CE1-CG2 3.61Å; F61-T63 HydrophobicContact CZ-CG2 4.31Å; F61-A68 HydrophobicContact CD1-CB 3.64Å; F61-A68 HydrophobicContact CE1-CB 3.56Å; F61-S87 PolarHBondContact N-O 3.01Å; F61-S87 PolarHBondContact O-N 3.24Å; F61-S87 PolarHBondContact O-OG 3.36Å; F61-L104 HydrophobicContact CB-CD2 3.9Å; F61-L104 HydrophobicContact CD1-CD2 3.84Å; F61-L104 HydrophobicContact CD2-CD1 4.02Å; F61-L104 HydrophobicContact CD2-CD2 4.22Å; F61-L104 HydrophobicContact CE1-CD2 4.44Å; F61-L104 HydrophobicContact CE2-CD1 4.25Å; F61-L104 HydrophobicContact CG-CD1 4.34Å; F61-L104 HydrophobicContact CG-CD2 3.7Å
62	H	96.4	Very high	93.5	Very high	1 Å²	1	25.2 Å²	25.2	1%	0.005	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	131.7	-172.4	-57.7	-79.6	0	0	0	110.5	D86 G114 T115 L207 P263	H62-D86 IonicContact CE1-OD1 3.81Å; H62-D86 IonicContact CG-OD1 3.58Å; H62-D86 IonicContact ND1-OD1 2.75Å; H62-D86 PolarHBondContact ND1-OD1 2.9Å; H62-G114 CarbonylContact O-C 3.35Å; H62-G114 WeakPolarHBondContact O-CA 3.27Å; H62-T115 HydrophobicContact CB-CG2 4.21Å; H62-T115 PolarHBondContact N-O 2.95Å; H62-T115 PolarHBondContact O-N 3.11Å; H62-L207 HydrophobicContact CB-CD1 3.49Å; H62-L207 VanDerWaalsContact CB-CD1 3.49Å; H62-P263 PolarHBondContact CE1-O 2.89Å; H62-P263 VanDerWaalsContact CE1-O 3.24Å
63	T	95	Very high	93.9	Very high	1 Å²	1	22.2 Å²	22.2	1%	0.006	11%	0.108	C	C	.	.			trans	-117.5	175.6	172.8	72.9	0	0	0	0	109.1	F61 R66 A68 V85 V112 H265	F61-T63 HydrophobicContact CD1-CG2 4.19Å; F61-T63 HydrophobicContact CE1-CG2 3.61Å; F61-T63 HydrophobicContact CZ-CG2 4.31Å; T63-R66 WeakPolarHBondContact CB-O 3.18Å; T63-R66 PolarHBondContact OG1-O 2.87Å; T63-A68 HydrophobicContact CG2-CB 4.05Å; T63-V85 PolarHBondContact N-O 3.47Å; T63-V85 WeakPolarHBondContact O-CG1 3.34Å; T63-V85 WeakPolarHBondContact OG1-CG1 3.33Å; T63-V85 PolarHBondContact OG1-O 3.17Å; T63-V112 HydrophobicContact CG2-CG1 3.48Å; T63-V112 VanDerWaalsContact CG2-CG1 3.48Å; T63-H265 PolarHBondContact O-CE1 3.15Å
64	L	92.8	Very high	94	Very high	17 Å²	17	24.9 Å²	24.9	9%	0.089	11%	0.111	C	C	.	.	S	Bend	trans	-80.2	-42	177.1	176.4	63.4	0	0	0	113.6	E200 L203 H265 Y267 F271	L64-E200 HydrophobicContact CB-CG 3.96Å; L64-E200 HydrophobicContact CD2-CG 3.65Å; L64-E200 HydrophobicContact CG-CG 4.33Å; L64-L203 HydrophobicContact CB-CD2 4.3Å; L64-L203 HydrophobicContact CD1-CD2 3.66Å; L64-H265 PolarHBondContact O-NE2 3.14Å; L64-H265 VanDerWaalsContact O-NE2 3.13Å; L64-Y267 HydrophobicContact CD1-CE2 4Å; L64-F271 HydrophobicContact CD1-CE1 4.37Å; L64-F271 HydrophobicContact CD1-CZ 4Å; L64-F271 HydrophobicContact CD2-CE1 4.28Å; L64-F271 HydrophobicContact CG-CE1 4.39Å; L64-F271 HydrophobicContact CG-CZ 4.35Å
65	H	91.1	Very high	94	Very high	63 Å²	63	29.4 Å²	29.4	29%	0.292	13%	0.134	S	C	.	.	S	Bend	trans	-157.6	-6.2	-175.7	65.5	-83.7	0	0	0	114.6	F271	H65-F271 HydrophobicContact CB-CB 3.78Å; H65-F271 HydrophobicContact CB-CD2 3.7Å; H65-F271 HydrophobicContact CB-CG 3.87Å
66	R	91.6	Very high	93.8	Very high	76 Å²	76	31.9 Å²	31.9	29%	0.287	15%	0.15	S	C	.	.	S	Bend	trans	-98.9	133.2	-175.7	-64.5	-178.7	177.4	-132.7	-20.2	109.6	T63 A68 E110 P111 V112	T63-R66 WeakPolarHBondContact CB-O 3.18Å; T63-R66 PolarHBondContact OG1-O 2.87Å; R66-A68 PolarHBondContact O-N 2.67Å; R66-E110 IonicContact CZ-OE2 2.98Å; R66-E110 VanDerWaalsContact NH1-CB 3.34Å; R66-E110 IonicContact NH1-OE2 2.74Å; R66-E110 PolarHBondContact NH1-OE2 2.84Å; R66-E110 IonicContact NH2-OE2 2.67Å; R66-E110 PolarHBondContact NH2-OE2 3.4Å; R66-P111 PolarHBondContact NH1-O 3.02Å; R66-V112 HydrophobicContact CB-CG1 4.25Å; R66-V112 HydrophobicContact CB-CG2 4.03Å
67	N	93.4	Very high	93.6	Very high	57 Å²	57	36 Å²	36	31%	0.305	17%	0.173	S	C	.	.			trans	-67.1	136.3	177.6	-67.2	-30.6	0	0	0	110.2	T83 V85 P107	N67-T83 HydrophobicContact CB-CG2 3.88Å; N67-V85 WeakPolarHBondContact OD1-CG2 3.48Å; N67-V85 PolarHBondContact OD1-N 3.2Å; N67-P107 HydrophobicContact CB-CG 4.04Å; N67-P107 WeakPolarHBondContact O-CD 3.34Å; N67-P107 WeakPolarHBondContact O-CG 3.33Å
68	A	93.4	Very high	93.3	Very high	1 Å²	1	44.8 Å²	44.8	1%	0.008	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	147.4	168.7	0	0	0	0	0	108.8	F61 T63 R66 T83 A84 V112	F61-A68 HydrophobicContact CD1-CB 3.64Å; F61-A68 HydrophobicContact CE1-CB 3.56Å; T63-A68 HydrophobicContact CG2-CB 4.05Å; R66-A68 PolarHBondContact O-N 2.67Å; A68-T83 WeakPolarHBondContact O-CA 3.38Å; A68-A84 PolarHBondContact N-O 2.97Å; A68-A84 PolarHBondContact O-N 2.9Å; A68-A84 VanDerWaalsContact O-O 3.11Å; A68-V112 HydrophobicContact CB-CG1 4.14Å
69	T	94.4	Very high	93	Very high	5 Å²	5	45.7 Å²	45.7	3%	0.031	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102	120.3	175.6	-57.3	0	0	0	0	109.3	P76 L82 T83 L104 S105	T69-P76 HydrophobicContact CG2-CB 3.98Å; T69-P76 HydrophobicContact CG2-CG 3.92Å; T69-L82 WeakPolarHBondContact CA-O 3.39Å; T69-T83 PolarHBondContact OG1-OG1 2.85Å; T69-L104 WeakPolarHBondContact O-CA 3.32Å; T69-S105 WeakPolarHBondContact CB-OG 3.31Å; T69-S105 PolarHBondContact N-O 2.84Å; T69-S105 PolarHBondContact O-N 3.43Å
70	L	95.1	Very high	92.8	Very high	0 Å²	0	49 Å²	49	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	129.3	171.3	179.9	64.4	0	0	0	108.8	L59 S81 L82 L89 L102 L104	L59-L70 HydrophobicContact CD2-CD1 3.77Å; L70-S81 CarbonylContact O-C 3.55Å; L70-S81 VanDerWaalsContact O-CA 3.27Å; L70-S81 WeakPolarHBondContact O-CA 3.46Å; L70-L82 PolarHBondContact N-O 2.77Å; L70-L82 PolarHBondContact O-N 2.89Å; L70-L89 HydrophobicContact CD2-CB 4.05Å; L70-L89 HydrophobicContact CD2-CD1 4.27Å; L70-L89 HydrophobicContact CD2-CG 3.78Å; L70-L89 HydrophobicContact CG-CB 4.44Å; L70-L89 HydrophobicContact CG-CD1 3.76Å; L70-L89 HydrophobicContact CG-CG 3.79Å; L70-L102 HydrophobicContact CD1-CB 4.38Å; L70-L104 HydrophobicContact CB-CD2 4.09Å; L70-L104 HydrophobicContact CD1-CD2 3.48Å; L70-L104 VanDerWaalsContact CD1-CD2 3.48Å; L70-L104 HydrophobicContact CD1-CG 4Å; L70-L104 HydrophobicContact CG-CD2 4.31Å
71	S	95.7	Very high	92.8	Very high	1 Å²	1	49.8 Å²	49.8	1%	0.007	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	147.6	-170.9	-178.2	0	0	0	0	113	T73 L80 F103	S71-T73 VanDerWaalsContact C-N 3.29Å; S71-T73 VanDerWaalsContact CB-O 3.25Å; S71-T73 WeakPolarHBondContact CB-O 3.34Å; S71-T73 PolarHBondContact OG-N 2.92Å; S71-T73 VanDerWaalsContact OG-N 3.12Å; S71-T73 PolarHBondContact OG-O 2.87Å; S71-T73 PolarHBondContact OG-OG1 3.33Å; S71-L80 WeakPolarHBondContact CA-O 3.25Å; S71-F103 PolarHBondContact N-O 3.13Å; S71-F103 PolarHBondContact O-N 3.03Å
72	Y	95.1	Very high	92.7	Very high	62 Å²	62	50.5 Å²	50.5	24%	0.243	25%	0.25	C	C	.	.	S	Bend	trans	-70.7	-27.1	168.7	-64.3	-69.6	0	0	0	112.5	L80 L89 L90 L102	Y72-L80 HydrophobicContact CD2-CB 4.15Å; Y72-L80 HydrophobicContact CD2-CD2 3.96Å; Y72-L80 WeakPolarHBondContact CD2-O 3.2Å; Y72-L80 PolarHBondContact N-O 2.7Å; Y72-L89 HydrophobicContact CD1-CD1 4.17Å; Y72-L89 HydrophobicContact CD2-CD1 4.08Å; Y72-L89 HydrophobicContact CE1-CB 4Å; Y72-L89 HydrophobicContact CE1-CD1 4.08Å; Y72-L89 HydrophobicContact CE2-CD1 4Å; Y72-L89 HydrophobicContact CE2-CD2 3.91Å; Y72-L89 HydrophobicContact CE2-CG 4.38Å; Y72-L89 HydrophobicContact CG-CD1 4.15Å; Y72-L90 PolarHBondContact OH-N 3.49Å; Y72-L90 PolarHBondContact OH-O 2.84Å; Y72-L102 HydrophobicContact CD1-CD2 3.46Å; Y72-L102 VanDerWaalsContact CD1-CD2 3.46Å; Y72-L102 HydrophobicContact CE1-CD2 4.02Å; Y72-L102 HydrophobicContact CG-CD2 4.31Å
73	T	94.3	Very high	92.6	Very high	46 Å²	46	53.8 Å²	53.8	28%	0.282	27%	0.27	S	S	.	.	S	Bend	trans	-116.4	152.1	-176.6	48.8	0	0	0	0	111.1	S71 I75 L80	S71-T73 VanDerWaalsContact C-N 3.29Å; S71-T73 VanDerWaalsContact CB-O 3.25Å; S71-T73 WeakPolarHBondContact CB-O 3.34Å; S71-T73 PolarHBondContact OG-N 2.92Å; S71-T73 VanDerWaalsContact OG-N 3.12Å; S71-T73 PolarHBondContact OG-O 2.87Å; S71-T73 PolarHBondContact OG-OG1 3.33Å; T73-I75 VanDerWaalsContact C-N 3.26Å; T73-I75 WeakPolarHBondContact CB-O 3.09Å; T73-I75 PolarHBondContact O-N 2.72Å; T73-I75 PolarHBondContact OG1-O 2.71Å; T73-L80 HydrophobicContact CG2-CD1 4.29Å
74	R	90.9	Very high	92.6	Very high	154 Å²	154	54.7 Å²	54.7	58%	0.581	28%	0.278	S	S	*	.	S	Bend	trans	-58.7	-39.2	178.8	174.4	177.3	-88.7	-175.5	-4.8	112.5	F103	R74-F103 HydrophobicContact CB-CD1 4.02Å; R74-F103 HydrophobicContact CB-CD2 4.38Å; R74-F103 HydrophobicContact CB-CE1 3.98Å; R74-F103 HydrophobicContact CB-CE2 4.33Å; R74-F103 HydrophobicContact CB-CG 4.22Å; R74-F103 HydrophobicContact CB-CZ 4.14Å; R74-F103 HydrophobicContact CG-CD1 4.45Å; R74-F103 VanDerWaalsContact N-CD2 3.26Å
75	I	90.5	Very high	92.6	Very high	126 Å²	126	55.5 Å²	55.5	65%	0.646	28%	0.283	S	S	*	.	S	Bend	trans	-96.8	118.4	172.5	-58.6	172.2	0	0	0	106.1	T73 D77	T73-I75 VanDerWaalsContact C-N 3.26Å; T73-I75 WeakPolarHBondContact CB-O 3.09Å; T73-I75 PolarHBondContact O-N 2.72Å; T73-I75 PolarHBondContact OG1-O 2.71Å; I75-D77 PolarHBondContact O-N 3.34Å
76	P	90.1	Very high	92.8	Very high	53 Å²	53	53.4 Å²	53.4	34%	0.344	27%	0.274	S	S	.	.			trans	-63.8	124.2	-179.6	-20.4	32.2	0	0	0	110.9	T69	T69-P76 HydrophobicContact CG2-CB 3.98Å; T69-P76 HydrophobicContact CG2-CG 3.92Å
77	D	90	Very high	93	Very high	89 Å²	89	49.8 Å²	49.8	48%	0.476	26%	0.26	S	S	.	.			trans	-113.5	156.8	174	-75.8	-37.9	0	0	0	110.4	I75 G79 L80 S81	I75-D77 PolarHBondContact O-N 3.34Å; D77-G79 PolarHBondContact O-N 3.12Å; D77-L80 HydrophobicContact CB-CB 4.41Å; D77-L80 HydrophobicContact CB-CD1 4.3Å; D77-L80 PolarHBondContact O-N 2.74Å; D77-L80 VanDerWaalsContact O-N 3.14Å; D77-S81 PolarHBondContact O-N 3.12Å; D77-S81 PolarHBondContact O-OG 3.33Å
78	E	87.3	Confident	93.1	Very high	185 Å²	185	47.1 Å²	47.1	86%	0.864	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.6	131.6	177	-166.2	177.8	-177.2	0	0	110.5	L80	E78-L80 PolarHBondContact O-N 2.96Å
79	G	87.9	Confident	93.2	Very high	19 Å²	19	47 Å²	47	20%	0.196	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	76.7	-4.4	-176.3	0	0	0	0	0	115.6	D77 S136	D77-G79 PolarHBondContact O-N 3.12Å; G79-S136 WeakPolarHBondContact CA-O 3.41Å
80	L	92.9	Very high	93.3	Very high	71 Å²	71	47.2 Å²	47.2	37%	0.372	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-114.8	1	173.9	-64.7	178.4	0	0	0	113.5	S71 Y72 T73 D77 E78	S71-L80 WeakPolarHBondContact CA-O 3.25Å; Y72-L80 HydrophobicContact CD2-CB 4.15Å; Y72-L80 HydrophobicContact CD2-CD2 3.96Å; Y72-L80 WeakPolarHBondContact CD2-O 3.2Å; Y72-L80 PolarHBondContact N-O 2.7Å; T73-L80 HydrophobicContact CG2-CD1 4.29Å; D77-L80 HydrophobicContact CB-CB 4.41Å; D77-L80 HydrophobicContact CB-CD1 4.3Å; D77-L80 PolarHBondContact O-N 2.74Å; D77-L80 VanDerWaalsContact O-N 3.14Å; E78-L80 PolarHBondContact O-N 2.96Å
81	S	94.3	Very high	93.2	Very high	18 Å²	18	48 Å²	48	13%	0.126	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	155.3	-178.2	62	0	0	0	0	111.9	L70 D77	L70-S81 CarbonylContact O-C 3.55Å; L70-S81 VanDerWaalsContact O-CA 3.27Å; L70-S81 WeakPolarHBondContact O-CA 3.46Å; D77-S81 PolarHBondContact O-N 3.12Å; D77-S81 PolarHBondContact O-OG 3.33Å
82	L	94.8	Very high	93.1	Very high	16 Å²	16	50 Å²	50	8%	0.084	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	131.4	174.1	177.9	66.9	0	0	0	109.7	T69 L70 A84 L137 N142	T69-L82 WeakPolarHBondContact CA-O 3.39Å; L70-L82 PolarHBondContact N-O 2.77Å; L70-L82 PolarHBondContact O-N 2.89Å; L82-A84 HydrophobicContact CG-CB 4.46Å; L82-L137 HydrophobicContact CB-CD1 4.05Å; L82-L137 HydrophobicContact CD2-CD1 4.28Å; L82-N142 HydrophobicContact CD2-CB 4.25Å; L82-N142 VanDerWaalsContact CD2-CG 3.45Å; L82-N142 WeakPolarHBondContact CD2-ND2 3.43Å
83	T	94.3	Very high	93.1	Very high	69 Å²	69	47 Å²	47	42%	0.423	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	111.9	175.3	-56.4	0	0	0	0	109.5	N67 A68 T69 P107	N67-T83 HydrophobicContact CB-CG2 3.88Å; A68-T83 WeakPolarHBondContact O-CA 3.38Å; T69-T83 PolarHBondContact OG1-OG1 2.85Å; T83-P107 HydrophobicContact CG2-CB 3.9Å; T83-P107 HydrophobicContact CG2-CG 3.69Å
84	A	93.8	Very high	93	Very high	21 Å²	21	50.2 Å²	50.2	17%	0.174	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.4	167.9	-179.6	0	0	0	0	0	111.6	A68 L82 D86	A68-A84 PolarHBondContact N-O 2.97Å; A68-A84 PolarHBondContact O-N 2.9Å; A68-A84 VanDerWaalsContact O-O 3.11Å; L82-A84 HydrophobicContact CG-CB 4.46Å; A84-D86 VanDerWaalsContact CB-O 3.27Å; A84-D86 WeakPolarHBondContact CB-O 3.07Å
85	V	94	Very high	92.9	Very high	34 Å²	34	47.2 Å²	47.2	21%	0.206	27%	0.269	C	S	.	.	S	Bend	trans	-68.7	-43.7	171.1	-175.3	0	0	0	0	110.5	T63 N67	T63-V85 PolarHBondContact N-O 3.47Å; T63-V85 WeakPolarHBondContact O-CG1 3.34Å; T63-V85 WeakPolarHBondContact OG1-CG1 3.33Å; T63-V85 PolarHBondContact OG1-O 3.17Å; N67-V85 WeakPolarHBondContact OD1-CG2 3.48Å; N67-V85 PolarHBondContact OD1-N 3.2Å
86	D	95.9	Very high	92.7	Very high	19 Å²	19	45.6 Å²	45.6	10%	0.102	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	114.1	169.8	-59.1	-62.9	0	0	0	108	H62 A84 A264 H265	H62-D86 IonicContact CE1-OD1 3.81Å; H62-D86 IonicContact CG-OD1 3.58Å; H62-D86 IonicContact ND1-OD1 2.75Å; H62-D86 PolarHBondContact ND1-OD1 2.9Å; A84-D86 VanDerWaalsContact CB-O 3.27Å; A84-D86 WeakPolarHBondContact CB-O 3.07Å; D86-A264 HydrophobicContact CB-CB 4.25Å; D86-A264 WeakPolarHBondContact OD2-CA 3.44Å; D86-H265 IonicContact OD1-CE1 3.52Å; D86-H265 IonicContact OD1-ND1 2.9Å; D86-H265 PolarHBondContact OD1-ND1 2.83Å; D86-H265 IonicContact OD2-CE1 3.55Å; D86-H265 IonicContact OD2-CG 3.68Å; D86-H265 PolarHBondContact OD2-N 2.78Å; D86-H265 IonicContact OD2-ND1 2.82Å; D86-H265 PolarHBondContact OD2-ND1 2.84Å
87	S	94.8	Very high	92.7	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	145.1	-175.8	61.8	0	0	0	0	110.6	Q60 F61	Q60-S87 CarbonylContact C-O 3.58Å; Q60-S87 WeakPolarHBondContact CA-O 3.41Å; F61-S87 PolarHBondContact N-O 3.01Å; F61-S87 PolarHBondContact O-N 3.24Å; F61-S87 PolarHBondContact O-OG 3.36Å
88	G	95.6	Very high	92.7	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.5	149.5	171	0	0	0	0	0	113.2	L59 N142	L59-G88 CarbonylContact O-C 3.55Å; L59-G88 WeakPolarHBondContact O-CA 3.27Å; G88-N142 WeakPolarHBondContact CA-OD1 3.09Å; G88-N142 PolarHBondContact N-OD1 3Å; G88-N142 PolarHBondContact O-ND2 2.57Å; G88-N142 PolarHBondContact O-OD1 2.92Å
89	L	96.5	Very high	92.8	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	140	-180	-70.4	-174.9	0	0	0	109.8	T58 L59 L70 Y72 L102 L137	T58-L89 WeakPolarHBondContact CA-O 3.39Å; L59-L89 PolarHBondContact N-O 3.4Å; L59-L89 PolarHBondContact O-N 3.3Å; L70-L89 HydrophobicContact CD2-CB 4.05Å; L70-L89 HydrophobicContact CD2-CD1 4.27Å; L70-L89 HydrophobicContact CD2-CG 3.78Å; L70-L89 HydrophobicContact CG-CB 4.44Å; L70-L89 HydrophobicContact CG-CD1 3.76Å; L70-L89 HydrophobicContact CG-CG 3.79Å; Y72-L89 HydrophobicContact CD1-CD1 4.17Å; Y72-L89 HydrophobicContact CD2-CD1 4.08Å; Y72-L89 HydrophobicContact CE1-CB 4Å; Y72-L89 HydrophobicContact CE1-CD1 4.08Å; Y72-L89 HydrophobicContact CE2-CD1 4Å; Y72-L89 HydrophobicContact CE2-CD2 3.91Å; Y72-L89 HydrophobicContact CE2-CG 4.38Å; Y72-L89 HydrophobicContact CG-CD1 4.15Å; L89-L102 HydrophobicContact CD1-CD2 4.44Å; L89-L137 HydrophobicContact CD2-CD1 3.85Å; L89-L137 HydrophobicContact CD2-CD2 3.83Å
90	L	95.4	Very high	93.1	Very high	8 Å²	8	41.1 Å²	41.1	4%	0.042	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	115.2	178.2	-171.7	156.8	0	0	0	109.8	F56 I57 Y72 V127 V139 P141	F56-L90 HydrophobicContact CB-CD2 3.97Å; F56-L90 HydrophobicContact CD2-CD1 3.69Å; F56-L90 HydrophobicContact CD2-CD2 3.97Å; F56-L90 HydrophobicContact CD2-CG 3.79Å; F56-L90 HydrophobicContact CE2-CD1 3.81Å; F56-L90 HydrophobicContact CE2-CG 4.41Å; F56-L90 HydrophobicContact CG-CD2 4.18Å; F56-L90 HydrophobicContact CG-CG 4.49Å; I57-L90 CarbonylContact O-C 3.44Å; I57-L90 WeakPolarHBondContact O-CA 3.37Å; Y72-L90 PolarHBondContact OH-N 3.49Å; Y72-L90 PolarHBondContact OH-O 2.84Å; L90-V127 HydrophobicContact CD1-CG1 3.76Å; L90-V127 HydrophobicContact CD2-CG1 4.23Å; L90-V139 HydrophobicContact CB-CG1 4.08Å; L90-V139 HydrophobicContact CD1-CG1 4.04Å; L90-V139 HydrophobicContact CD2-CG1 4.1Å; L90-V139 HydrophobicContact CG-CG1 4.29Å; L90-P141 HydrophobicContact CB-CB 4.4Å; L90-P141 HydrophobicContact CB-CG 4.01Å; L90-P141 HydrophobicContact CD1-CB 4.43Å
91	S	94.1	Very high	93.1	Very high	17 Å²	17	39.8 Å²	39.8	12%	0.119	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	122.2	177.8	-167.5	0	0	0	0	111	F56 I57 L100	F56-S91 WeakPolarHBondContact CA-O 3.49Å; F56-S91 WeakPolarHBondContact CB-O 3.23Å; I57-S91 PolarHBondContact N-O 3.47Å; I57-S91 PolarHBondContact O-N 3.46Å; S91-L100 VanDerWaalsContact CB-CD2 3.45Å
92	A	93.3	Very high	93.1	Very high	43 Å²	43	39 Å²	39	36%	0.355	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	130.3	170.8	0	0	0	0	0	110.1	Y163	A92-Y163 HydrophobicContact CB-CE2 4.49Å; A92-Y163 VanDerWaalsContact CB-OH 3.27Å; A92-Y163 WeakPolarHBondContact CB-OH 3.45Å
93	L	93.9	Very high	93.1	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	24%	0.242	C	C	.	.	P	Polyproline II helix	trans	-85.2	133.3	-175.9	-64.4	170.5	0	0	0	111.4	I50 M54 A55 I57 R165 G166	I50-L93 HydrophobicContact CD1-CD2 3.86Å; I50-L93 HydrophobicContact CG2-CD1 3.48Å; I50-L93 VanDerWaalsContact CG2-CD1 3.48Å; I50-L93 HydrophobicContact CG2-CD2 4.11Å; I50-L93 HydrophobicContact CG2-CG 4.45Å; M54-L93 HydrophobicContact CB-CD1 3.96Å; M54-L93 WeakPolarHBondContact O-CD1 3.42Å; A55-L93 WeakPolarHBondContact O-CB 3.35Å; A55-L93 PolarHBondContact O-N 3.02Å; I57-L93 HydrophobicContact CD1-CD2 4.47Å; I57-L93 HydrophobicContact CG1-CD2 4.19Å; I57-L93 HydrophobicContact CG2-CD1 4.03Å; I57-L93 HydrophobicContact CG2-CD2 4.39Å; I57-L93 HydrophobicContact CG2-CG 4.43Å; L93-R165 HydrophobicContact CB-CG 4.2Å; L93-R165 VanDerWaalsContact O-CG 3.27Å; L93-R165 WeakPolarHBondContact O-CG 3.44Å; L93-G166 PolarHBondContact O-N 3.18Å; L93-G166 VanDerWaalsContact O-N 3.14Å
94	Q	92.4	Very high	93.1	Very high	113 Å²	113	36.2 Å²	36.2	53%	0.528	22%	0.223	S	C	.	.	P	Polyproline II helix	trans	-77.6	157.2	170.7	-64.7	-60.4	-29.1	0	0	111.3	A96 Q97 R165	Q94-A96 PolarHBondContact O-N 3.3Å; Q94-Q97 HydrophobicContact CB-CB 4.25Å; Q94-Q97 VanDerWaalsContact O-CB 3.25Å; Q94-Q97 WeakPolarHBondContact O-CB 3.27Å; Q94-Q97 PolarHBondContact O-N 3.14Å; Q94-Q97 VanDerWaalsContact O-N 3.16Å; Q94-R165 VanDerWaalsContact O-CZ 3.3Å; Q94-R165 PolarHBondContact O-NE 3.46Å; Q94-R165 PolarHBondContact O-NH2 3.16Å
95	P	89.4	Confident	93.1	Very high	90 Å²	90	36 Å²	36	58%	0.584	22%	0.22	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54.5	135.4	174.4	-24.4	34.8	0	0	0	111.4	Q97	P95-Q97 PolarHBondContact O-N 2.93Å; P95-Q97 VanDerWaalsContact O-N 3.1Å
96	A	86.3	Confident	92.9	Very high	92 Å²	92	35.1 Å²	35.1	76%	0.76	22%	0.216	S	C	*	.	T	Hydrogen-bonded Turn	trans	61.5	7.3	-177.7	0	0	0	0	0	116.9	Q94 T98	Q94-A96 PolarHBondContact O-N 3.3Å; A96-T98 PolarHBondContact O-N 3.45Å
97	Q	90.6	Very high	92.4	Very high	45 Å²	45	37.1 Å²	37.1	21%	0.21	23%	0.229	C	C	.	.			trans	-68.9	113.4	176	-172.6	177.7	0.8	0	0	112.1	Q94 P95 L99 R165	Q94-Q97 HydrophobicContact CB-CB 4.25Å; Q94-Q97 VanDerWaalsContact O-CB 3.25Å; Q94-Q97 WeakPolarHBondContact O-CB 3.27Å; Q94-Q97 PolarHBondContact O-N 3.14Å; Q94-Q97 VanDerWaalsContact O-N 3.16Å; P95-Q97 PolarHBondContact O-N 2.93Å; P95-Q97 VanDerWaalsContact O-N 3.1Å; Q97-L99 VanDerWaalsContact CG-O 3.26Å; Q97-L99 WeakPolarHBondContact CG-O 3.48Å; Q97-L99 PolarHBondContact NE2-O 2.81Å; Q97-L99 VanDerWaalsContact NE2-O 3.12Å; Q97-R165 VanDerWaalsContact N-NH2 3.17Å; Q97-R165 PolarHBondContact O-NH2 3.18Å
98	T	88.7	Confident	91.3	Very high	95 Å²	95	41.5 Å²	41.5	58%	0.583	25%	0.25	S	C	*	.			trans	-106.5	-4.7	179.1	55.9	0	0	0	0	113.7	R49 I50 A96	R49-T98 PolarHBondContact N-O 2.8Å; I50-T98 PolarHBondContact N-O 2.81Å; A96-T98 PolarHBondContact O-N 3.45Å
99	L	91.2	Very high	90.3	Very high	93 Å²	93	49.9 Å²	49.9	49%	0.487	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	138.8	-175.9	-172.1	145.7	0	0	0	110.6	V46 V47 T48 Q97	V46-L99 HydrophobicContact CG1-CD1 3.82Å; V46-L99 HydrophobicContact CG1-CD2 4.05Å; V46-L99 HydrophobicContact CG1-CG 3.79Å; V47-L99 WeakPolarHBondContact O-CA 3.48Å; T48-L99 HydrophobicContact CG2-CD1 4.39Å; Q97-L99 VanDerWaalsContact CG-O 3.26Å; Q97-L99 WeakPolarHBondContact CG-O 3.48Å; Q97-L99 PolarHBondContact NE2-O 2.81Å; Q97-L99 VanDerWaalsContact NE2-O 3.12Å
100	L	92.4	Very high	89.7	Confident	19 Å²	19	54.2 Å²	54.2	10%	0.099	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	136.6	171.1	-176.6	76.8	0	0	0	109.1	V46 V47 I50 I57 S91 L102	V46-L100 CarbonylContact C-O 3.52Å; V46-L100 WeakPolarHBondContact CA-O 3.35Å; V47-L100 HydrophobicContact CB-CB 4.36Å; V47-L100 PolarHBondContact N-O 3.19Å; V47-L100 PolarHBondContact O-N 3.48Å; V47-L100 VanDerWaalsContact O-N 3.16Å; I50-L100 HydrophobicContact CD1-CB 4.23Å; I57-L100 HydrophobicContact CD1-CB 4.04Å; I57-L100 HydrophobicContact CD1-CD2 3.27Å; I57-L100 HydrophobicContact CD1-CG 4.26Å; I57-L100 HydrophobicContact CG1-CD2 3.94Å; S91-L100 VanDerWaalsContact CB-CD2 3.45Å; L100-L102 HydrophobicContact CD2-CD1 3.94Å; L100-L102 HydrophobicContact CD2-CD2 4.33Å; L100-L102 HydrophobicContact CD2-CG 4Å; L100-L102 HydrophobicContact CG-CG 4.38Å
101	S	93.7	Very high	89.4	Confident	43 Å²	43	57.1 Å²	57.1	30%	0.301	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	130	172.9	53.6	0	0	0	0	109.9	E44	E44-S101 WeakPolarHBondContact OE1-CB 3.35Å
102	L	94.8	Very high	89.2	Confident	2 Å²	2	56.5 Å²	56.5	1%	0.01	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	163.8	170.7	-65.1	170.4	0	0	0	108.6	A45 L59 L70 Y72 L89 L100	A45-L102 PolarHBondContact N-O 3.32Å; A45-L102 PolarHBondContact O-N 2.84Å; L59-L102 HydrophobicContact CB-CD1 3.55Å; L59-L102 HydrophobicContact CD2-CB 3.84Å; L59-L102 HydrophobicContact CD2-CD1 3.43Å; L59-L102 VanDerWaalsContact CD2-CD1 3.43Å; L59-L102 HydrophobicContact CD2-CG 4.24Å; L59-L102 HydrophobicContact CG-CD1 4.12Å; L70-L102 HydrophobicContact CD1-CB 4.38Å; Y72-L102 HydrophobicContact CD1-CD2 3.46Å; Y72-L102 VanDerWaalsContact CD1-CD2 3.46Å; Y72-L102 HydrophobicContact CE1-CD2 4.02Å; Y72-L102 HydrophobicContact CG-CD2 4.31Å; L89-L102 HydrophobicContact CD1-CD2 4.44Å; L100-L102 HydrophobicContact CD2-CD1 3.94Å; L100-L102 HydrophobicContact CD2-CD2 4.33Å; L100-L102 HydrophobicContact CD2-CG 4Å; L100-L102 HydrophobicContact CG-CG 4.38Å
103	F	94.9	Very high	89.2	Confident	24 Å²	24	57 Å²	57	11%	0.105	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	134	-174.4	-59.2	-85.7	0	0	0	111.2	E44 S71 R74	E44-F103 HydrophobicContact CB-CD1 4.28Å; E44-F103 HydrophobicContact CB-CE1 4.13Å; E44-F103 HydrophobicContact CG-CD1 4.25Å; E44-F103 HydrophobicContact CG-CE1 3.78Å; E44-F103 HydrophobicContact CG-CZ 4.36Å; S71-F103 PolarHBondContact N-O 3.13Å; S71-F103 PolarHBondContact O-N 3.03Å; R74-F103 HydrophobicContact CB-CD1 4.02Å; R74-F103 HydrophobicContact CB-CD2 4.38Å; R74-F103 HydrophobicContact CB-CE1 3.98Å; R74-F103 HydrophobicContact CB-CE2 4.33Å; R74-F103 HydrophobicContact CB-CG 4.22Å; R74-F103 HydrophobicContact CB-CZ 4.14Å; R74-F103 HydrophobicContact CG-CD1 4.45Å; R74-F103 VanDerWaalsContact N-CD2 3.26Å
104	L	94.3	Very high	89.2	Confident	3 Å²	3	57 Å²	57	2%	0.016	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	130.9	174.1	-71.8	167.2	0	0	0	108.9	V35 V37 T42 V43 A45 F61 T69 L70	V35-L104 HydrophobicContact CG1-CD1 4.25Å; V37-L104 HydrophobicContact CG2-CB 4.1Å; T42-L104 CarbonylContact C-O 3.44Å; T42-L104 WeakPolarHBondContact CA-O 3.17Å; V43-L104 HydrophobicContact CB-CB 4.38Å; V43-L104 PolarHBondContact N-O 3.12Å; V43-L104 PolarHBondContact O-N 3.01Å; A45-L104 HydrophobicContact CB-CD1 4.37Å; F61-L104 HydrophobicContact CB-CD2 3.9Å; F61-L104 HydrophobicContact CD1-CD2 3.84Å; F61-L104 HydrophobicContact CD2-CD1 4.02Å; F61-L104 HydrophobicContact CD2-CD2 4.22Å; F61-L104 HydrophobicContact CE1-CD2 4.44Å; F61-L104 HydrophobicContact CE2-CD1 4.25Å; F61-L104 HydrophobicContact CG-CD1 4.34Å; F61-L104 HydrophobicContact CG-CD2 3.7Å; T69-L104 WeakPolarHBondContact O-CA 3.32Å; L70-L104 HydrophobicContact CB-CD2 4.09Å; L70-L104 HydrophobicContact CD1-CD2 3.48Å; L70-L104 VanDerWaalsContact CD1-CD2 3.48Å; L70-L104 HydrophobicContact CD1-CG 4Å; L70-L104 HydrophobicContact CG-CD2 4.31Å
105	S	92.7	Very high	89.3	Confident	17 Å²	17	51.8 Å²	51.8	12%	0.119	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	154.2	176.1	66.3	0	0	0	0	111.6	T69	T69-S105 WeakPolarHBondContact CB-OG 3.31Å; T69-S105 PolarHBondContact N-O 2.84Å; T69-S105 PolarHBondContact O-N 3.43Å
106	S	91.1	Very high	89.5	Confident	15 Å²	15	47.6 Å²	47.6	11%	0.105	27%	0.274	C	S	.	.			trans	-85.4	123.8	169.8	-172	0	0	0	0	109.5	E108 E110 V112	S106-E108 PolarHBondContact OG-O 3.45Å; S106-E108 VanDerWaalsContact OG-O 3.12Å; S106-E110 PolarHBondContact OG-O 3.5Å; S106-V112 WeakPolarHBondContact OG-CG2 3.36Å
107	P	83.9	Confident	89.9	Confident	60 Å²	60	43.2 Å²	43.2	39%	0.39	24%	0.237	S	C	.	.	S	Bend	trans	-76	-24.4	175.2	30.8	-35	0	0	0	113.1	N67 T83	N67-P107 HydrophobicContact CB-CG 4.04Å; N67-P107 WeakPolarHBondContact O-CD 3.34Å; N67-P107 WeakPolarHBondContact O-CG 3.33Å; T83-P107 HydrophobicContact CG2-CB 3.9Å; T83-P107 HydrophobicContact CG2-CG 3.69Å
108	E	72.9	Confident	90	Very high	93 Å²	93	41 Å²	41	44%	0.435	23%	0.227	S	C	.	.	S	Bend	trans	-102.6	158.7	-175.9	-69	175.7	-167.3	0	0	110.2	S106 E110	S106-E108 PolarHBondContact OG-O 3.45Å; S106-E108 VanDerWaalsContact OG-O 3.12Å; E108-E110 PolarHBondContact O-N 2.84Å
109	E	74.5	Confident	90.2	Very high	176 Å²	176	37.3 Å²	37.3	82%	0.822	20%	0.204	S	C	*	.	S	Bend	trans	-71.4	37.6	174.4	-66	-171.5	179.5	0	0	112.6	L39	L39-E109 HydrophobicContact CD1-CB 4.21Å; L39-E109 WeakPolarHBondContact CD1-O 3.49Å
110	E	82.8	Confident	90.4	Very high	91 Å²	91	34.5 Å²	34.5	43%	0.425	19%	0.192	S	C	.	.	S	Bend	trans	-137.4	147.8	176	-59	-164.6	-179.8	0	0	111.3	R66 S106 E108	R66-E110 IonicContact CZ-OE2 2.98Å; R66-E110 VanDerWaalsContact NH1-CB 3.34Å; R66-E110 IonicContact NH1-OE2 2.74Å; R66-E110 PolarHBondContact NH1-OE2 2.84Å; R66-E110 IonicContact NH2-OE2 2.67Å; R66-E110 PolarHBondContact NH2-OE2 3.4Å; S106-E110 PolarHBondContact OG-O 3.5Å; E108-E110 PolarHBondContact O-N 2.84Å
111	P	89	Confident	90.5	Very high	69 Å²	69	34.5 Å²	34.5	45%	0.448	19%	0.191	S	C	.	.			trans	-67.7	149.8	173.9	29.3	-34.8	0	0	0	111.1	V37 R66	V37-P111 WeakPolarHBondContact O-CA 3.41Å; R66-P111 PolarHBondContact NH1-O 3.02Å
112	V	91.4	Very high	90.5	Very high	4 Å²	4	34.4 Å²	34.4	2%	0.024	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	123.7	-178.2	178.8	0	0	0	0	109.6	N36 V37 T63 R66 A68 S106	N36-V112 PolarHBondContact OD1-O 3.22Å; V37-V112 PolarHBondContact N-O 3.16Å; V37-V112 PolarHBondContact O-N 3.1Å; T63-V112 HydrophobicContact CG2-CG1 3.48Å; T63-V112 VanDerWaalsContact CG2-CG1 3.48Å; R66-V112 HydrophobicContact CB-CG1 4.25Å; R66-V112 HydrophobicContact CB-CG2 4.03Å; A68-V112 HydrophobicContact CB-CG1 4.14Å; S106-V112 WeakPolarHBondContact OG-CG2 3.36Å
113	S	92.2	Very high	90.4	Very high	54 Å²	54	35.7 Å²	35.7	38%	0.378	20%	0.199	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	143.2	170.7	-165.7	0	0	0	0	110.1	V35	V35-S113 WeakPolarHBondContact O-CA 3.34Å; V35-S113 PolarHBondContact O-OG 3.43Å
114	G	93.6	Very high	90.4	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-163.7	179.7	-179.4	0	0	0	0	0	111.9	N34 V35 H62	N34-G114 WeakPolarHBondContact CA-O 3Å; V35-G114 PolarHBondContact N-O 2.84Å; V35-G114 PolarHBondContact O-N 3.16Å; H62-G114 CarbonylContact O-C 3.35Å; H62-G114 WeakPolarHBondContact O-CA 3.27Å
115	T	94.9	Very high	90.4	Very high	3 Å²	3	37.4 Å²	37.4	2%	0.018	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	133.8	174.2	-173	0	0	0	0	110.3	Q33 H62 F204	Q33-T115 WeakPolarHBondContact O-CA 3.28Å; H62-T115 HydrophobicContact CB-CG2 4.21Å; H62-T115 PolarHBondContact N-O 2.95Å; H62-T115 PolarHBondContact O-N 3.11Å; T115-F204 HydrophobicContact CG2-CB 4.1Å; T115-F204 HydrophobicContact CG2-CD1 3.51Å; T115-F204 HydrophobicContact CG2-CD2 4.42Å; T115-F204 HydrophobicContact CG2-CE1 4.01Å; T115-F204 HydrophobicContact CG2-CG 3.75Å
116	G	94.4	Very high	90.6	Very high	1 Å²	1	36.6 Å²	36.6	1%	0.01	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	149.3	172.6	0	0	0	0	0	111.9	F27 F32 Q33 Q60	F27-G116 WeakPolarHBondContact CE1-O 3.11Å; F32-G116 WeakPolarHBondContact CA-O 3.37Å; Q33-G116 PolarHBondContact N-O 3.49Å; Q33-G116 PolarHBondContact O-N 3.41Å; Q60-G116 CarbonylContact O-C 3.57Å; Q60-G116 WeakPolarHBondContact O-CA 3.13Å
117	V	94.8	Very high	90.8	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	148.5	168.9	63.6	0	0	0	0	109.3	F32 Q60 L119 A211	F32-V117 HydrophobicContact CD1-CB 3.84Å; F32-V117 HydrophobicContact CD1-CG1 4.29Å; F32-V117 HydrophobicContact CD1-CG2 4.42Å; F32-V117 HydrophobicContact CD2-CB 4.32Å; F32-V117 HydrophobicContact CD2-CG2 4Å; F32-V117 HydrophobicContact CE1-CB 3.65Å; F32-V117 HydrophobicContact CE1-CG1 3.64Å; F32-V117 HydrophobicContact CE1-CG2 4.17Å; F32-V117 HydrophobicContact CE2-CB 4.14Å; F32-V117 HydrophobicContact CE2-CG2 3.72Å; F32-V117 HydrophobicContact CG-CB 4.16Å; F32-V117 HydrophobicContact CG-CG2 4.32Å; F32-V117 HydrophobicContact CZ-CB 3.79Å; F32-V117 HydrophobicContact CZ-CG1 3.76Å; F32-V117 HydrophobicContact CZ-CG2 3.79Å; Q60-V117 HydrophobicContact CB-CG1 4.04Å; Q60-V117 PolarHBondContact N-O 2.89Å; Q60-V117 PolarHBondContact O-N 3.42Å; V117-L119 HydrophobicContact CG2-CD2 4.34Å; V117-A211 HydrophobicContact CG1-CB 4.42Å
118	F	91.9	Very high	91.4	Very high	0 Å²	0	33 Å²	33	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	142.8	168	92.7	-97.7	0	0	0	111.7	F27 L28 P29 G30 V47 T58 L59	F27-F118 HydrophobicContact CB-CD1 3.73Å; F27-F118 HydrophobicContact CB-CE1 4.22Å; L28-F118 WeakPolarHBondContact O-CD1 3.44Å; L28-F118 WeakPolarHBondContact O-CE1 3.33Å; P29-F118 HydrophobicContact CB-CE1 3.94Å; P29-F118 HydrophobicContact CB-CE2 3.68Å; P29-F118 HydrophobicContact CB-CZ 3.27Å; P29-F118 VanDerWaalsContact CD-CE1 3.46Å; P29-F118 HydrophobicContact CG-CE1 4.03Å; P29-F118 HydrophobicContact CG-CE2 4.06Å; P29-F118 HydrophobicContact CG-CZ 3.3Å; P29-F118 VanDerWaalsContact N-CZ 3.27Å; G30-F118 WeakPolarHBondContact CA-O 3.38Å; G30-F118 PolarHBondContact N-O 3.47Å; V47-F118 HydrophobicContact CG1-CD1 3.98Å; V47-F118 HydrophobicContact CG1-CD2 3.94Å; V47-F118 HydrophobicContact CG1-CE1 3.63Å; V47-F118 HydrophobicContact CG1-CE2 3.73Å; V47-F118 HydrophobicContact CG1-CG 4.01Å; V47-F118 HydrophobicContact CG1-CZ 3.48Å; V47-F118 VanDerWaalsContact CG1-CZ 3.48Å; V47-F118 HydrophobicContact CG2-CB 4.38Å; V47-F118 HydrophobicContact CG2-CG 4.42Å; T58-F118 WeakPolarHBondContact O-CA 3.19Å; L59-F118 HydrophobicContact CD1-CB 3.98Å
119	L	93.8	Very high	92.4	Very high	17 Å²	17	28.6 Å²	28.6	9%	0.089	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	140.5	177	-57.5	176	0	0	0	109.2	I57 T58 V117 Y121 A211 N212	I57-L119 CarbonylContact C-O 3.57Å; I57-L119 VanDerWaalsContact CA-O 3.31Å; I57-L119 WeakPolarHBondContact CA-O 3.37Å; T58-L119 PolarHBondContact N-O 2.84Å; T58-L119 PolarHBondContact O-N 3.38Å; V117-L119 HydrophobicContact CG2-CD2 4.34Å; L119-Y121 HydrophobicContact CB-CE2 3.97Å; L119-A211 WeakPolarHBondContact CD1-O 3.02Å; L119-N212 HydrophobicContact CD1-CB 4.41Å; L119-N212 HydrophobicContact CD2-CB 4.17Å
120	S	93.4	Very high	93.4	Very high	33 Å²	33	20.9 Å²	20.9	23%	0.231	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	139.6	179.8	60.6	0	0	0	0	110.9
121	Y	94.4	Very high	93.8	Very high	20 Å²	20	16.9 Å²	16.9	8%	0.078	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	141.4	-175.8	-62.9	-82.1	0	0	0	111.5	M54 A55 F56 L119 A125 A259 S260	M54-Y121 CarbonylContact C-O 3.58Å; M54-Y121 WeakPolarHBondContact CA-O 3.42Å; M54-Y121 VanDerWaalsContact SD-C 3.52Å; A55-Y121 PolarHBondContact N-O 2.89Å; F56-Y121 AromaticContact CD2-CD2 3.88Å; F56-Y121 HydrophobicContact CD2-CD2 3.88Å; F56-Y121 HydrophobicContact CD2-CG 4.39Å; F56-Y121 AromaticContact CE2-CD2 3.3Å; F56-Y121 HydrophobicContact CE2-CD2 3.3Å; F56-Y121 HydrophobicContact CE2-CE2 4.14Å; F56-Y121 AromaticContact CE2-CG 3.63Å; F56-Y121 HydrophobicContact CE2-CG 3.63Å; F56-Y121 AromaticContact CZ-CD2 3.94Å; F56-Y121 HydrophobicContact CZ-CD2 3.94Å; F56-Y121 AromaticContact CZ-CG 3.75Å; F56-Y121 HydrophobicContact CZ-CG 3.75Å; F56-Y121 PolarHBondContact N-O 2.88Å; F56-Y121 PolarHBondContact O-N 2.85Å; L119-Y121 HydrophobicContact CB-CE2 3.97Å; Y121-A125 HydrophobicContact CD1-CB 4.36Å; Y121-A259 HydrophobicContact CD1-CB 3.87Å; Y121-A259 HydrophobicContact CE1-CB 3.77Å; Y121-A259 HydrophobicContact CG-CB 4.47Å; Y121-S260 WeakPolarHBondContact OH-CB 3.37Å; Y121-S260 PolarHBondContact OH-N 2.03Å; Y121-S260 PolarHBondContact OH-O 2.98Å
122	S	94	Very high	93.9	Very high	41 Å²	41	14.7 Å²	14.7	29%	0.287	10%	0.095	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	163.7	178.8	55.2	0	0	0	0	112.6	T124 A125	S122-T124 PolarHBondContact O-N 2.86Å; S122-T124 PolarHBondContact OG-OG1 2.88Å; S122-A125 WeakPolarHBondContact O-CB 3.36Å; S122-A125 PolarHBondContact O-N 3.35Å
123	S	93.7	Very high	93.5	Very high	29 Å²	29	21.8 Å²	21.8	20%	0.203	13%	0.132	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.8	-11.5	176.4	57.8	0	0	0	0	115.7	A162 Y163 E164	S123-A162 WeakPolarHBondContact O-CB 3.45Å; S123-Y163 WeakPolarHBondContact CA-O 3.42Å; S123-Y163 WeakPolarHBondContact CB-O 3.39Å; S123-Y163 PolarHBondContact O-N 3.35Å; S123-E164 VanDerWaalsContact CB-OE2 3.23Å; S123-E164 WeakPolarHBondContact CB-OE2 3.18Å; S123-E164 PolarHBondContact OG-OE2 2.64Å
124	T	93.9	Very high	93.1	Very high	59 Å²	59	26.5 Å²	26.5	36%	0.362	15%	0.148	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.4	-6.1	175.2	55.5	0	0	0	0	113.5	S122 A162 T257	S122-T124 PolarHBondContact O-N 2.86Å; S122-T124 PolarHBondContact OG-OG1 2.88Å; T124-A162 WeakPolarHBondContact O-CB 3.21Å; T124-T257 WeakPolarHBondContact O-CB 3.34Å; T124-T257 PolarHBondContact O-OG1 3.05Å
125	A	95.1	Very high	92.7	Very high	3 Å²	3	28.2 Å²	28.2	3%	0.025	16%	0.16	C	C	.	.	S	Bend	trans	-82.4	135.2	-179.1	0	0	0	0	0	110.8	F56 Y121 S122 A162	F56-A125 HydrophobicContact CE1-CB 4.46Å; F56-A125 HydrophobicContact CZ-CB 4.43Å; Y121-A125 HydrophobicContact CD1-CB 4.36Å; S122-A125 WeakPolarHBondContact O-CB 3.36Å; S122-A125 PolarHBondContact O-N 3.35Å; A125-A162 WeakPolarHBondContact O-CA 3.27Å; A125-A162 WeakPolarHBondContact O-CB 3.47Å
126	P	96	Very high	92.3	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	18%	0.182	C	C	.	.			trans	-60.4	153.8	173.8	27.4	-34.9	0	0	0	110.8	F56 P128 L184 V250 A259	F56-P126 WeakPolarHBondContact CZ-O 3.33Å; P126-P128 WeakPolarHBondContact O-CD 3.47Å; P126-L184 HydrophobicContact CB-CD1 4.33Å; P126-L184 HydrophobicContact CB-CD2 3.98Å; P126-V250 HydrophobicContact CB-CG1 4.12Å; P126-V250 HydrophobicContact CB-CG2 3.87Å; P126-V250 HydrophobicContact CG-CB 4.38Å; P126-V250 HydrophobicContact CG-CG1 3.86Å; P126-V250 HydrophobicContact CG-CG2 3.95Å; P126-A259 HydrophobicContact CG-CB 4.33Å; P126-A259 WeakPolarHBondContact O-CB 3.49Å
127	V	96.3	Very high	92.2	Very high	1 Å²	1	31.4 Å²	31.4	1%	0.006	18%	0.182	C	C	.	.	B	Isolated β-bridge	trans	-105.8	107.1	-171.2	-172.5	0	0	0	0	108.9	F56 L90 G129 A130 V139 A159 N160 Y163	F56-V127 HydrophobicContact CD1-CG2 4.23Å; F56-V127 HydrophobicContact CE1-CG2 3.78Å; F56-V127 HydrophobicContact CZ-CG2 4.24Å; L90-V127 HydrophobicContact CD1-CG1 3.76Å; L90-V127 HydrophobicContact CD2-CG1 4.23Å; V127-G129 PolarHBondContact O-N 3.48Å; V127-A130 HydrophobicContact CB-CB 3.89Å; V127-A130 HydrophobicContact CG1-CB 3.6Å; V127-V139 HydrophobicContact CG1-CG1 4.48Å; V127-A159 VanDerWaalsContact O-CA 3.26Å; V127-A159 WeakPolarHBondContact O-CA 3.18Å; V127-A159 VanDerWaalsContact O-CB 3.28Å; V127-A159 WeakPolarHBondContact O-CB 3.36Å; V127-N160 PolarHBondContact N-O 3.41Å; V127-N160 PolarHBondContact O-N 3.18Å; V127-Y163 HydrophobicContact CB-CE1 4.45Å; V127-Y163 HydrophobicContact CG1-CE1 4.36Å; V127-Y163 HydrophobicContact CG2-CD1 3.75Å; V127-Y163 HydrophobicContact CG2-CE1 3.47Å; V127-Y163 VanDerWaalsContact CG2-CE1 3.47Å
128	P	96.1	Very high	91.9	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	22%	0.218	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.9	132.9	-179.5	-23.7	34.9	0	0	0	111.7	P126 A130 P141 V250 A259 Y261	P126-P128 WeakPolarHBondContact O-CD 3.47Å; P128-A130 PolarHBondContact O-N 3Å; P128-A130 VanDerWaalsContact O-N 3.13Å; P128-P141 HydrophobicContact CB-CB 4.16Å; P128-V250 HydrophobicContact CG-CG1 4.09Å; P128-A259 HydrophobicContact CG-CB 3.83Å; P128-Y261 HydrophobicContact CB-CD1 3.91Å; P128-Y261 HydrophobicContact CB-CD2 3.82Å; P128-Y261 HydrophobicContact CB-CE1 3.84Å; P128-Y261 HydrophobicContact CB-CE2 3.75Å; P128-Y261 HydrophobicContact CB-CG 3.89Å; P128-Y261 HydrophobicContact CG-CD2 4.4Å; P128-Y261 HydrophobicContact CG-CE2 4.48Å
129	G	94.4	Very high	92	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	69.6	6.9	171.5	0	0	0	0	0	116.9	V127 C131 N132 D140 P158 Y261	V127-G129 PolarHBondContact O-N 3.48Å; G129-C131 PolarHBondContact O-N 3.45Å; G129-N132 VanDerWaalsContact O-CB 3.31Å; G129-N132 WeakPolarHBondContact O-CB 3.39Å; G129-N132 PolarHBondContact O-N 3.45Å; G129-D140 WeakPolarHBondContact CA-O 3.46Å; G129-D140 PolarHBondContact O-N 2.97Å; G129-D140 VanDerWaalsContact O-N 3.15Å; G129-P158 CarbonylContact C-O 3.53Å; G129-P158 WeakPolarHBondContact CA-O 3.31Å; G129-Y261 PolarHBondContact N-OH 3.33Å
130	A	94.5	Very high	92	Very high	14 Å²	14	38.9 Å²	38.9	12%	0.116	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.2	-3.7	-177.1	0	0	0	0	0	114.8	V127 P128 V139 P158 N160	V127-A130 HydrophobicContact CB-CB 3.89Å; V127-A130 HydrophobicContact CG1-CB 3.6Å; P128-A130 PolarHBondContact O-N 3Å; P128-A130 VanDerWaalsContact O-N 3.13Å; A130-V139 HydrophobicContact CB-CG1 4.1Å; A130-V139 HydrophobicContact CB-CG2 4.32Å; A130-P158 PolarHBondContact N-O 3.07Å; A130-N160 HydrophobicContact CB-CB 3.58Å
131	C	92.9	Very high	92.2	Very high	6 Å²	6	37.3 Å²	37.3	4%	0.041	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	-117.3	43.6	169.9	-67	0	0	0	0	110.5	G129 P158 N160 C172 R181	G129-C131 PolarHBondContact O-N 3.45Å; C131-P158 HydrophobicContact CB-CB 4.3Å; C131-P158 PolarHBondContact N-O 3Å; C131-N160 VanDerWaalsContact SG-CG 3.58Å; C131-C172 WeakPolarHBondContact CA-SG 3.32Å; C131-C172 HydrophobicContact CB-CB 3.72Å; C131-C172 WeakPolarHBondContact CB-SG 3.44Å; C131-C172 WeakPolarHBondContact SG-CB 3.36Å; C131-C172 CovalentContact SG-SG 2.03Å; C131-C172 PolarHBondContact SG-SG 2.99Å; C131-R181 WeakPolarHBondContact SG-CD 3.09Å
132	N	89.7	Confident	92.3	Very high	23 Å²	23	36.5 Å²	36.5	12%	0.123	21%	0.209	C	C	.	.			trans	-73	138.3	176.9	176.4	47.9	0	0	0	111.4	G129 E134 S135 L137 D140	G129-N132 VanDerWaalsContact O-CB 3.31Å; G129-N132 WeakPolarHBondContact O-CB 3.39Å; G129-N132 PolarHBondContact O-N 3.45Å; N132-E134 PolarHBondContact OD1-N 2.98Å; N132-E134 VanDerWaalsContact OD1-N 3.13Å; N132-S135 PolarHBondContact ND2-N 3.45Å; N132-S135 PolarHBondContact ND2-O 2.87Å; N132-S135 PolarHBondContact ND2-OG 2.84Å; N132-S135 PolarHBondContact OD1-N 3.26Å; N132-L137 PolarHBondContact ND2-O 2.95Å; N132-D140 HydrophobicContact CB-CB 4.14Å
133	L	84.6	Confident	92.4	Very high	153 Å²	153	35 Å²	35	80%	0.801	20%	0.198	S	C	*	.			trans	-131.8	-7.6	176	-62.5	174.2	0	0	0	112.2
134	E	83.8	Confident	92.5	Very high	153 Å²	153	37.6 Å²	37.6	72%	0.715	20%	0.204	S	C	*	.	S	Bend	trans	-103.6	-33.3	-171.7	-66.1	-167.2	170.9	0	0	112.7	N132 R155	N132-E134 PolarHBondContact OD1-N 2.98Å; N132-E134 VanDerWaalsContact OD1-N 3.13Å; E134-R155 IonicContact OE1-NH2 3.18Å; E134-R155 IonicContact OE2-CZ 3.11Å; E134-R155 IonicContact OE2-NH2 2.97Å; E134-R155 PolarHBondContact OE2-NH2 3.41Å; E134-R155 VanDerWaalsContact OE2-NH2 3.08Å
135	S	84.4	Confident	92.6	Very high	36 Å²	36	36.8 Å²	36.8	25%	0.252	20%	0.197	S	C	.	.	S	Bend	trans	-102.7	169.5	-176.6	81	0	0	0	0	113.4	N132 D140	N132-S135 PolarHBondContact ND2-N 3.45Å; N132-S135 PolarHBondContact ND2-O 2.87Å; N132-S135 PolarHBondContact ND2-OG 2.84Å; N132-S135 PolarHBondContact OD1-N 3.26Å; S135-D140 WeakPolarHBondContact CB-OD2 3.3Å; S135-D140 WeakPolarHBondContact OG-CB 3.49Å; S135-D140 PolarHBondContact OG-OD2 3.24Å
136	S	87.2	Confident	92.5	Very high	69 Å²	69	39.9 Å²	39.9	48%	0.483	22%	0.218	S	C	.	.	S	Bend	trans	-73.3	-26.6	-178.3	53.1	0	0	0	0	113.6	G79	G79-S136 WeakPolarHBondContact CA-O 3.41Å
137	L	91.6	Very high	92.3	Very high	3 Å²	3	44.5 Å²	44.5	2%	0.016	24%	0.237	C	C	.	.	S	Bend	trans	-73	132.3	177.3	-70.2	177.4	0	0	0	110.5	L82 L89 N132 V139 D140	L82-L137 HydrophobicContact CB-CD1 4.05Å; L82-L137 HydrophobicContact CD2-CD1 4.28Å; L89-L137 HydrophobicContact CD2-CD1 3.85Å; L89-L137 HydrophobicContact CD2-CD2 3.83Å; N132-L137 PolarHBondContact ND2-O 2.95Å; L137-V139 VanDerWaalsContact C-N 3.35Å; L137-V139 PolarHBondContact O-N 3.01Å; L137-D140 HydrophobicContact CB-CB 4.03Å; L137-D140 HydrophobicContact CD1-CB 4.46Å
138	D	88.4	Confident	92.1	Very high	140 Å²	140	47.6 Å²	47.6	75%	0.749	25%	0.253	S	S	*	.	S	Bend	trans	-60.7	-44.6	176.4	-171.8	36.7	0	0	0	111.8
139	V	93.1	Very high	91.6	Very high	33 Å²	33	53.3 Å²	53.3	20%	0.2	28%	0.283	C	S	.	.	S	Bend	trans	-117.6	114.1	169.7	-179.3	0	0	0	0	108.8	L90 V127 A130 L137 P141	L90-V139 HydrophobicContact CB-CG1 4.08Å; L90-V139 HydrophobicContact CD1-CG1 4.04Å; L90-V139 HydrophobicContact CD2-CG1 4.1Å; L90-V139 HydrophobicContact CG-CG1 4.29Å; V127-V139 HydrophobicContact CG1-CG1 4.48Å; A130-V139 HydrophobicContact CB-CG1 4.1Å; A130-V139 HydrophobicContact CB-CG2 4.32Å; L137-V139 VanDerWaalsContact C-N 3.35Å; L137-V139 PolarHBondContact O-N 3.01Å; V139-P141 WeakPolarHBondContact O-CD 3.44Å
140	D	95.4	Very high	91.3	Very high	1 Å²	1	56 Å²	56	1%	0.005	29%	0.294	C	S	.	.			trans	-116.5	91	-173.7	-169.6	-4.4	0	0	0	112.7	G129 N132 S135 L137 N142 Y144	G129-D140 WeakPolarHBondContact CA-O 3.46Å; G129-D140 PolarHBondContact O-N 2.97Å; G129-D140 VanDerWaalsContact O-N 3.15Å; N132-D140 HydrophobicContact CB-CB 4.14Å; S135-D140 WeakPolarHBondContact CB-OD2 3.3Å; S135-D140 WeakPolarHBondContact OG-CB 3.49Å; S135-D140 PolarHBondContact OG-OD2 3.24Å; L137-D140 HydrophobicContact CB-CB 4.03Å; L137-D140 HydrophobicContact CD1-CB 4.46Å; D140-N142 PolarHBondContact O-N 2.91Å; D140-N142 VanDerWaalsContact O-N 3.13Å; D140-N142 VanDerWaalsContact OD1-CB 3.26Å; D140-N142 WeakPolarHBondContact OD1-CB 3.14Å; D140-N142 PolarHBondContact OD1-N 2.79Å; D140-N142 VanDerWaalsContact OD1-N 3.1Å; D140-N142 PolarHBondContact OD1-ND2 3.43Å; D140-Y144 PolarHBondContact OD1-OH 2.91Å; D140-Y144 WeakPolarHBondContact OD2-CE2 3.4Å; D140-Y144 VanDerWaalsContact OD2-CZ 3.25Å; D140-Y144 PolarHBondContact OD2-OH 2.9Å
141	P	96.1	Very high	91.2	Very high	0 Å²	0	56.1 Å²	56.1	0%	0	29%	0.292	C	S	.	.			trans	-76.8	7.9	-178	37.2	-40.7	0	0	0	113.3	T58 L90 P128 V139 Y261 V262	T58-P141 HydrophobicContact CG2-CB 4.43Å; T58-P141 HydrophobicContact CG2-CG 4.28Å; L90-P141 HydrophobicContact CB-CB 4.4Å; L90-P141 HydrophobicContact CB-CG 4.01Å; L90-P141 HydrophobicContact CD1-CB 4.43Å; P128-P141 HydrophobicContact CB-CB 4.16Å; V139-P141 WeakPolarHBondContact O-CD 3.44Å; P141-Y261 WeakPolarHBondContact O-CA 3.39Å; P141-Y261 WeakPolarHBondContact O-CB 3.43Å; P141-Y261 WeakPolarHBondContact O-CD1 3.15Å; P141-V262 HydrophobicContact CB-CG2 4.04Å; P141-V262 HydrophobicContact CG-CG2 3.93Å; P141-V262 WeakPolarHBondContact O-CG2 3.41Å; P141-V262 PolarHBondContact O-N 3.36Å
142	N	96.7	Very high	91.3	Very high	3 Å²	3	55.9 Å²	55.9	2%	0.016	29%	0.29	C	S	.	.	B	Isolated β-bridge	trans	-90	146.9	-169.5	-58.6	-79	0	0	0	113.3	L82 G88 D140 Y144	L82-N142 HydrophobicContact CD2-CB 4.25Å; L82-N142 VanDerWaalsContact CD2-CG 3.45Å; L82-N142 WeakPolarHBondContact CD2-ND2 3.43Å; G88-N142 WeakPolarHBondContact CA-OD1 3.09Å; G88-N142 PolarHBondContact N-OD1 3Å; G88-N142 PolarHBondContact O-ND2 2.57Å; G88-N142 PolarHBondContact O-OD1 2.92Å; D140-N142 PolarHBondContact O-N 2.91Å; D140-N142 VanDerWaalsContact O-N 3.13Å; D140-N142 VanDerWaalsContact OD1-CB 3.26Å; D140-N142 WeakPolarHBondContact OD1-CB 3.14Å; D140-N142 PolarHBondContact OD1-N 2.79Å; D140-N142 VanDerWaalsContact OD1-N 3.1Å; D140-N142 PolarHBondContact OD1-ND2 3.43Å; N142-Y144 HydrophobicContact CB-CE2 4.26Å
143	V	96.4	Very high	91.5	Very high	8 Å²	8	56.5 Å²	56.5	5%	0.048	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	123.8	168.3	177.3	0	0	0	0	108.2	V154 F156 V248 Y261 V262 A264	V143-V154 HydrophobicContact CG1-CG1 3.38Å; V143-F156 HydrophobicContact CG2-CB 4.43Å; V143-V248 HydrophobicContact CG2-CG2 4.06Å; V143-Y261 HydrophobicContact CG2-CG 4.49Å; V143-V262 WeakPolarHBondContact CG2-O 3.18Å; V143-V262 PolarHBondContact N-O 3.36Å; V143-A264 HydrophobicContact CB-CB 4.09Å; V143-A264 HydrophobicContact CG1-CB 4.29Å; V143-A264 WeakPolarHBondContact O-CB 3.23Å
144	Y	95.5	Very high	92.1	Very high	84 Å²	84	49.2 Å²	49.2	33%	0.329	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	131.1	177.5	-65.6	-81.5	0	0	0	110.6	D140 N142 V154 R155	D140-Y144 PolarHBondContact OD1-OH 2.91Å; D140-Y144 WeakPolarHBondContact OD2-CE2 3.4Å; D140-Y144 VanDerWaalsContact OD2-CZ 3.25Å; D140-Y144 PolarHBondContact OD2-OH 2.9Å; N142-Y144 HydrophobicContact CB-CE2 4.26Å; Y144-V154 CarbonylContact O-C 3.56Å; Y144-V154 WeakPolarHBondContact O-CA 3.29Å; Y144-R155 PolarHBondContact N-O 2.78Å; Y144-R155 PolarHBondContact O-N 3.22Å
145	I	95.4	Very high	92.7	Very high	43 Å²	43	46.7 Å²	46.7	22%	0.221	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	131.3	177.9	-58.8	173.1	0	0	0	108.8	T152 T153 V154 Y246 A264 T266	I145-T152 HydrophobicContact CG2-CG2 3.58Å; I145-T153 WeakPolarHBondContact CA-O 3.34Å; I145-V154 HydrophobicContact CG1-CG2 4.49Å; I145-Y246 HydrophobicContact CD1-CD2 3.72Å; I145-Y246 HydrophobicContact CG1-CD2 4.39Å; I145-A264 HydrophobicContact CD1-CB 3.42Å; I145-A264 VanDerWaalsContact CD1-CB 3.42Å; I145-A264 WeakPolarHBondContact CD1-O 3.5Å; I145-A264 HydrophobicContact CG1-CB 3.84Å; I145-T266 HydrophobicContact CD1-CG2 4.42Å; I145-T266 HydrophobicContact CG2-CG2 3.93Å
146	S	94.2	Very high	93.2	Very high	67 Å²	67	45.4 Å²	45.4	47%	0.469	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	135.5	165.3	76.3	0	0	0	0	109.9	T153	S146-T153 PolarHBondContact N-O 3.07Å; S146-T153 PolarHBondContact O-N 2.9Å; S146-T153 PolarHBondContact O-OG1 3.27Å; S146-T153 PolarHBondContact OG-OG1 3.23Å
147	Y	92.5	Very high	93.5	Very high	97 Å²	97	42.5 Å²	42.5	38%	0.38	21%	0.212	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	153.7	-174.2	66.3	-93.8	0	0	0	111.8	E151 A268 C269	Y147-E151 WeakPolarHBondContact CA-O 3.2Å; Y147-A268 HydrophobicContact CD2-CB 4.27Å; Y147-A268 HydrophobicContact CG-CB 4.37Å; Y147-C269 PolarHBondContact OH-O 3.35Å; Y147-C269 VanDerWaalsContact OH-O 3.05Å
148	N	90.3	Very high	93.7	Very high	66 Å²	66	43.8 Å²	43.8	35%	0.353	22%	0.22	S	C	.	.			trans	-131.5	-173.6	165.2	65.5	47.5	0	0	0	109.6	Y150 E151 S238	N148-Y150 PolarHBondContact O-N 2.98Å; N148-Y150 VanDerWaalsContact O-N 3.17Å; N148-Y150 WeakPolarHBondContact OD1-CA 3.48Å; N148-Y150 WeakPolarHBondContact OD1-CB 3.38Å; N148-Y150 PolarHBondContact OD1-N 2.9Å; N148-E151 PolarHBondContact N-O 2.81Å; N148-E151 PolarHBondContact OD1-N 2.67Å; N148-E151 PolarHBondContact OD1-O 2.84Å; N148-S238 WeakPolarHBondContact O-CB 3.28Å; N148-S238 PolarHBondContact O-OG 3.44Å
149	L	85.6	Confident	94.1	Very high	120 Å²	120	37.1 Å²	37.1	63%	0.628	18%	0.184	S	C	*	.	S	Bend	trans	-58.7	-27.8	-179.8	-174	67.6	0	0	0	113.7	K457	L149-K457 PolarHBondContact O-NZ 3.37Å
150	Y	89.1	Confident	94.2	Very high	57 Å²	57	35.8 Å²	35.8	22%	0.224	18%	0.176	C	C	.	.	S	Bend	trans	-97.6	-54.7	-173.6	-54.6	-76.8	0	0	0	111.6	N148 S238 K457 L460 N461 F464	N148-Y150 PolarHBondContact O-N 2.98Å; N148-Y150 VanDerWaalsContact O-N 3.17Å; N148-Y150 WeakPolarHBondContact OD1-CA 3.48Å; N148-Y150 WeakPolarHBondContact OD1-CB 3.38Å; N148-Y150 PolarHBondContact OD1-N 2.9Å; Y150-S238 PolarHBondContact O-N 3.1Å; Y150-K457 HydrophobicContact CD1-CB 4.2Å; Y150-K457 HydrophobicContact CD1-CG 4.02Å; Y150-K457 PolarHBondContact O-NZ 2.96Å; Y150-L460 HydrophobicContact CE1-CB 3.74Å; Y150-L460 HydrophobicContact CE1-CD1 4.08Å; Y150-N461 HydrophobicContact CD1-CB 4.06Å; Y150-N461 HydrophobicContact CD2-CB 4.14Å; Y150-N461 HydrophobicContact CG-CB 3.85Å; Y150-F464 WeakPolarHBondContact O-CE2 3.37Å
151	E	92.3	Very high	94.1	Very high	17 Å²	17	36.8 Å²	36.8	8%	0.079	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	148.5	-169.3	72.3	-166.5	167.2	0	0	113.5	Y147 N148 T153 F236 S238	Y147-E151 WeakPolarHBondContact CA-O 3.2Å; N148-E151 PolarHBondContact N-O 2.81Å; N148-E151 PolarHBondContact OD1-N 2.67Å; N148-E151 PolarHBondContact OD1-O 2.84Å; E151-T153 HydrophobicContact CG-CG2 4.35Å; E151-F236 CarbonylContact C-O 3.49Å; E151-F236 WeakPolarHBondContact CA-O 3.16Å; E151-S238 WeakPolarHBondContact CA-OG 3.2Å; E151-S238 PolarHBondContact N-OG 3.48Å; E151-S238 PolarHBondContact O-OG 3.49Å
152	T	94.5	Very high	93.9	Very high	1 Å²	1	38 Å²	38	1%	0.006	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	119.7	172.3	-65.3	0	0	0	0	107.5	I145 A235 F236 S238 Y246 T266	I145-T152 HydrophobicContact CG2-CG2 3.58Å; T152-A235 CarbonylContact O-C 3.57Å; T152-A235 WeakPolarHBondContact O-CA 3.37Å; T152-F236 PolarHBondContact N-O 2.65Å; T152-F236 PolarHBondContact O-N 3.11Å; T152-S238 PolarHBondContact N-OG 3.5Å; T152-S238 VanDerWaalsContact N-OG 3.12Å; T152-S238 PolarHBondContact OG1-OG 3.48Å; T152-Y246 HydrophobicContact CG2-CE2 3.95Å; T152-T266 HydrophobicContact CG2-CG2 4.04Å
153	T	95.2	Very high	93.7	Very high	35 Å²	35	39.1 Å²	39.1	22%	0.215	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	132.6	178.8	61.8	0	0	0	0	110.2	I145 S146 E151 M234	I145-T153 WeakPolarHBondContact CA-O 3.34Å; S146-T153 PolarHBondContact N-O 3.07Å; S146-T153 PolarHBondContact O-N 2.9Å; S146-T153 PolarHBondContact O-OG1 3.27Å; S146-T153 PolarHBondContact OG-OG1 3.23Å; E151-T153 HydrophobicContact CG-CG2 4.35Å; T153-M234 CarbonylContact C-O 3.57Å; T153-M234 VanDerWaalsContact CA-O 3.25Å; T153-M234 WeakPolarHBondContact CA-O 3.17Å
154	V	96	Very high	93.5	Very high	1 Å²	1	43.9 Å²	43.9	1%	0.006	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	126	-179.9	178.8	0	0	0	0	107.4	V143 Y144 I145 A233 M234 F236 Y246	V143-V154 HydrophobicContact CG1-CG1 3.38Å; Y144-V154 CarbonylContact O-C 3.56Å; Y144-V154 WeakPolarHBondContact O-CA 3.29Å; I145-V154 HydrophobicContact CG1-CG2 4.49Å; V154-A233 CarbonylContact O-C 3.59Å; V154-A233 VanDerWaalsContact O-CA 3.27Å; V154-A233 WeakPolarHBondContact O-CA 3.31Å; V154-M234 PolarHBondContact N-O 2.67Å; V154-M234 PolarHBondContact O-N 3.11Å; V154-F236 HydrophobicContact CB-CD2 4.3Å; V154-F236 HydrophobicContact CB-CE2 3.92Å; V154-F236 HydrophobicContact CG2-CD2 3.63Å; V154-F236 HydrophobicContact CG2-CE2 3.59Å; V154-Y246 HydrophobicContact CG2-CD1 3.77Å; V154-Y246 HydrophobicContact CG2-CD2 3.87Å; V154-Y246 HydrophobicContact CG2-CE1 4.11Å; V154-Y246 HydrophobicContact CG2-CE2 4.2Å; V154-Y246 HydrophobicContact CG2-CG 3.62Å
155	R	95.7	Very high	93.4	Very high	99 Å²	99	41.9 Å²	41.9	37%	0.374	21%	0.209	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	146.6	-176.5	-57.9	-179.2	68.6	133.2	-5.4	110.3	E134 Y144 T232 A233	E134-R155 IonicContact OE1-NH2 3.18Å; E134-R155 IonicContact OE2-CZ 3.11Å; E134-R155 IonicContact OE2-NH2 2.97Å; E134-R155 PolarHBondContact OE2-NH2 3.41Å; E134-R155 VanDerWaalsContact OE2-NH2 3.08Å; Y144-R155 PolarHBondContact N-O 2.78Å; Y144-R155 PolarHBondContact O-N 3.22Å; R155-T232 WeakPolarHBondContact CA-O 3.27Å; R155-A233 HydrophobicContact CG-CB 3.9Å
156	F	95.6	Very high	93.1	Very high	10 Å²	10	41.6 Å²	41.6	4%	0.044	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.3	153.5	176.6	58.3	-85.3	0	0	0	111.2	V143 Y186 V188 L226 T232 V248 Y261	V143-F156 HydrophobicContact CG2-CB 4.43Å; F156-Y186 HydrophobicContact CD2-CD1 4.39Å; F156-Y186 AromaticContact CE2-CD1 3.53Å; F156-Y186 HydrophobicContact CE2-CD1 3.53Å; F156-Y186 HydrophobicContact CE2-CE1 4.03Å; F156-Y186 AromaticContact CE2-CG 3.87Å; F156-Y186 HydrophobicContact CE2-CG 3.87Å; F156-Y186 HydrophobicContact CZ-CD1 4.27Å; F156-Y186 HydrophobicContact CZ-CG 4.19Å; F156-V188 HydrophobicContact CE1-CG2 4.36Å; F156-L226 HydrophobicContact CE1-CD1 4.32Å; F156-L226 HydrophobicContact CZ-CD1 4.04Å; F156-T232 HydrophobicContact CD2-CG2 4.16Å; F156-T232 HydrophobicContact CE2-CG2 3.62Å; F156-T232 HydrophobicContact CZ-CG2 3.96Å; F156-T232 PolarHBondContact N-O 3.22Å; F156-T232 VanDerWaalsContact N-O 3.14Å; F156-T232 WeakPolarHBondContact O-CB 3.44Å; F156-T232 PolarHBondContact O-OG1 3.15Å; F156-V248 HydrophobicContact CD1-CG2 3.67Å; F156-V248 HydrophobicContact CD2-CG1 4.26Å; F156-V248 HydrophobicContact CE1-CG1 4.22Å; F156-V248 HydrophobicContact CE1-CG2 3.79Å; F156-V248 HydrophobicContact CE2-CG1 3.95Å; F156-V248 HydrophobicContact CG-CG2 4.11Å; F156-V248 HydrophobicContact CZ-CG1 3.92Å; F156-V248 HydrophobicContact CZ-CG2 4.34Å; F156-Y261 HydrophobicContact CB-CD1 4.2Å; F156-Y261 HydrophobicContact CB-CE1 4.11Å; F156-Y261 HydrophobicContact CD2-CE1 4.09Å; F156-Y261 HydrophobicContact CD2-CE2 4.47Å; F156-Y261 AromaticContact CD2-CZ 3.96Å
157	G	94.5	Very high	92.9	Very high	8 Å²	8	44.6 Å²	44.6	8%	0.082	22%	0.224	C	C	.	.	P	Polyproline II helix	trans	-75	144.4	176.7	0	0	0	0	0	111.8	Y261	G157-Y261 VanDerWaalsContact O-CE1 3.29Å; G157-Y261 WeakPolarHBondContact O-CE1 3Å; G157-Y261 PolarHBondContact O-OH 3.45Å
158	P	95.4	Very high	92.6	Very high	29 Å²	29	44.7 Å²	44.7	19%	0.188	24%	0.238	C	C	.	.	P	Polyproline II helix	trans	-63	145.9	177	-16.9	28	0	0	0	113.2	G129 A130 C131 T232	G129-P158 CarbonylContact C-O 3.53Å; G129-P158 WeakPolarHBondContact CA-O 3.31Å; A130-P158 PolarHBondContact N-O 3.07Å; C131-P158 HydrophobicContact CB-CB 4.3Å; C131-P158 PolarHBondContact N-O 3Å; P158-T232 HydrophobicContact CG-CG2 4.42Å
159	A	95.8	Very high	92.4	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	24%	0.239	C	C	.	.	P	Polyproline II helix	trans	-84.7	165.6	178.2	0	0	0	0	0	112.3	V127 L184 Y186 V250 Y261	V127-A159 VanDerWaalsContact O-CA 3.26Å; V127-A159 WeakPolarHBondContact O-CA 3.18Å; V127-A159 VanDerWaalsContact O-CB 3.28Å; V127-A159 WeakPolarHBondContact O-CB 3.36Å; A159-L184 HydrophobicContact CB-CD1 3.95Å; A159-Y186 HydrophobicContact CB-CE1 3.79Å; A159-Y186 PolarHBondContact N-OH 3.12Å; A159-V250 HydrophobicContact CB-CB 4.16Å; A159-V250 HydrophobicContact CB-CG1 4.16Å; A159-V250 HydrophobicContact CB-CG2 3.73Å; A159-Y261 WeakPolarHBondContact CB-OH 3.34Å; A159-Y261 PolarHBondContact N-OH 2.7Å
160	N	95	Very high	92.6	Very high	5 Å²	5	41.3 Å²	41.3	3%	0.027	23%	0.232	C	C	.	.	B	Isolated β-bridge	trans	-119	166.5	172	-155.1	-7.1	0	0	0	111.6	V127 A130 C131 A170	V127-N160 PolarHBondContact N-O 3.41Å; V127-N160 PolarHBondContact O-N 3.18Å; A130-N160 HydrophobicContact CB-CB 3.58Å; C131-N160 VanDerWaalsContact SG-CG 3.58Å; N160-A170 PolarHBondContact ND2-O 2.65Å
161	L	94.4	Very high	92.6	Very high	22 Å²	22	42 Å²	42	12%	0.115	25%	0.25	C	S	.	.			trans	-65.5	157.5	176.1	-63.4	-177	0	0	0	111.7	N179 R183 L184	L161-N179 WeakPolarHBondContact CD1-O 3.29Å; L161-R183 HydrophobicContact CD2-CG 4.26Å; L161-L184 HydrophobicContact CD2-CD1 4.3Å; L161-L184 HydrophobicContact CD2-CD2 3.99Å; L161-L184 HydrophobicContact CD2-CG 4.1Å
162	A	92.8	Very high	92.4	Very high	27 Å²	27	43.5 Å²	43.5	22%	0.223	26%	0.262	C	S	.	.			trans	-63.6	150.1	175.5	0	0	0	0	0	111.6	S123 T124 A125	S123-A162 WeakPolarHBondContact O-CB 3.45Å; T124-A162 WeakPolarHBondContact O-CB 3.21Å; A125-A162 WeakPolarHBondContact O-CA 3.27Å; A125-A162 WeakPolarHBondContact O-CB 3.47Å
163	Y	92.3	Very high	92	Very high	25 Å²	25	47 Å²	47	10%	0.098	28%	0.28	C	S	.	.			trans	-141.7	155.7	177.2	62.1	-91.4	0	0	0	111	A92 S123 V127 Q167 P169	A92-Y163 HydrophobicContact CB-CE2 4.49Å; A92-Y163 VanDerWaalsContact CB-OH 3.27Å; A92-Y163 WeakPolarHBondContact CB-OH 3.45Å; S123-Y163 WeakPolarHBondContact CA-O 3.42Å; S123-Y163 WeakPolarHBondContact CB-O 3.39Å; S123-Y163 PolarHBondContact O-N 3.35Å; V127-Y163 HydrophobicContact CB-CE1 4.45Å; V127-Y163 HydrophobicContact CG1-CE1 4.36Å; V127-Y163 HydrophobicContact CG2-CD1 3.75Å; V127-Y163 HydrophobicContact CG2-CE1 3.47Å; V127-Y163 VanDerWaalsContact CG2-CE1 3.47Å; Y163-Q167 WeakPolarHBondContact CD2-O 3.35Å; Y163-Q167 VanDerWaalsContact CE2-O 3.27Å; Y163-Q167 WeakPolarHBondContact CE2-O 3.22Å; Y163-P169 HydrophobicContact CD1-CB 3.82Å; Y163-P169 HydrophobicContact CE1-CB 3.98Å
164	E	92.1	Very high	91.4	Very high	108 Å²	108	50.3 Å²	50.3	51%	0.505	30%	0.301	S	S	.	.			trans	-69.6	148.3	179.6	-70.9	-62.1	164	0	0	112.1	S123 G166 Q167	S123-E164 VanDerWaalsContact CB-OE2 3.23Å; S123-E164 WeakPolarHBondContact CB-OE2 3.18Å; S123-E164 PolarHBondContact OG-OE2 2.64Å; E164-G166 PolarHBondContact O-N 3.34Å; E164-Q167 HydrophobicContact CB-CG 4.08Å; E164-Q167 WeakPolarHBondContact O-CB 3.27Å; E164-Q167 PolarHBondContact O-N 3.05Å
165	R	92.8	Very high	91	Very high	43 Å²	43	52.9 Å²	52.9	16%	0.162	32%	0.319	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.4	130.2	179.1	-174	-177.7	179.9	147	6.4	111.3	P51 P52 M54 A55 L93 Q94 Q97 Q167	P51-R165 PolarHBondContact O-NH1 3.21Å; P51-R165 VanDerWaalsContact O-NH1 3.15Å; P52-R165 VanDerWaalsContact CA-NH1 3.34Å; P52-R165 PolarHBondContact O-NH1 2.96Å; M54-R165 WeakPolarHBondContact O-CD 3.32Å; M54-R165 PolarHBondContact O-NH1 2.94Å; A55-R165 HydrophobicContact CB-CB 4.42Å; L93-R165 HydrophobicContact CB-CG 4.2Å; L93-R165 VanDerWaalsContact O-CG 3.27Å; L93-R165 WeakPolarHBondContact O-CG 3.44Å; Q94-R165 VanDerWaalsContact O-CZ 3.3Å; Q94-R165 PolarHBondContact O-NE 3.46Å; Q94-R165 PolarHBondContact O-NH2 3.16Å; Q97-R165 VanDerWaalsContact N-NH2 3.17Å; Q97-R165 PolarHBondContact O-NH2 3.18Å; R165-Q167 VanDerWaalsContact C-N 3.26Å; R165-Q167 PolarHBondContact O-N 3.11Å
166	G	88.4	Confident	90.5	Very high	37 Å²	37	53.4 Å²	53.4	38%	0.381	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	77.5	1.6	-177.2	0	0	0	0	0	115.2	L93 E164	L93-G166 PolarHBondContact O-N 3.18Å; L93-G166 VanDerWaalsContact O-N 3.14Å; E164-G166 PolarHBondContact O-N 3.34Å
167	Q	90.2	Very high	90	Very high	130 Å²	130	54.8 Å²	54.8	61%	0.607	35%	0.347	S	S	*	.	S	Bend	trans	-94.9	162	170.7	-61.8	-149.6	-4	0	0	112.2	Y163 E164 R165	Y163-Q167 WeakPolarHBondContact CD2-O 3.35Å; Y163-Q167 VanDerWaalsContact CE2-O 3.27Å; Y163-Q167 WeakPolarHBondContact CE2-O 3.22Å; E164-Q167 HydrophobicContact CB-CG 4.08Å; E164-Q167 WeakPolarHBondContact O-CB 3.27Å; E164-Q167 PolarHBondContact O-N 3.05Å; R165-Q167 VanDerWaalsContact C-N 3.26Å; R165-Q167 PolarHBondContact O-N 3.11Å
168	S	85.6	Confident	89.4	Confident	98 Å²	98	58.8 Å²	58.8	69%	0.685	37%	0.373	S	S	*	.	P	Polyproline II helix	trans	-83.6	144.2	172.3	56.3	0	0	0	0	111.1
169	P	87.6	Confident	89	Confident	56 Å²	56	62.7 Å²	62.7	36%	0.364	39%	0.393	S	S	.	.	P	Polyproline II helix	trans	-63.5	157.2	174.1	27.7	-34.5	0	0	0	111.7	Y163	Y163-P169 HydrophobicContact CD1-CB 3.82Å; Y163-P169 HydrophobicContact CE1-CB 3.98Å
170	A	88.9	Confident	88.8	Confident	60 Å²	60	63.6 Å²	63.6	50%	0.496	40%	0.398	S	S	.	.	P	Polyproline II helix	trans	-65.5	151.4	173.9	0	0	0	0	0	111.3	N160 C172	N160-A170 PolarHBondContact ND2-O 2.65Å; A170-C172 PolarHBondContact O-N 3.45Å
171	A	88.9	Confident	88.6	Confident	72 Å²	72	64 Å²	64	60%	0.595	40%	0.399	S	S	*	.	P	Polyproline II helix	trans	-65.7	133.5	177.1	0	0	0	0	0	111.9	T174	A171-T174 HydrophobicContact CB-CG2 3.66Å
172	C	89.8	Confident	88.5	Confident	48 Å²	48	66.4 Å²	66.4	32%	0.324	41%	0.407	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.7	144.5	178.2	-59.3	0	0	0	0	111.5	C131 A170 T174	C131-C172 WeakPolarHBondContact CA-SG 3.32Å; C131-C172 HydrophobicContact CB-CB 3.72Å; C131-C172 WeakPolarHBondContact CB-SG 3.44Å; C131-C172 WeakPolarHBondContact SG-CB 3.36Å; C131-C172 CovalentContact SG-SG 2.03Å; C131-C172 PolarHBondContact SG-SG 2.99Å; A170-C172 PolarHBondContact O-N 3.45Å; C172-T174 PolarHBondContact O-N 3.24Å
173	D	84.1	Confident	88.6	Confident	73 Å²	73	67.6 Å²	67.6	39%	0.39	41%	0.405	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.8	28.1	169.3	-58.9	-32	0	0	0	117	S175 R181 W182	D173-S175 VanDerWaalsContact C-N 3.32Å; D173-R181 IonicContact OD1-CZ 3.24Å; D173-R181 IonicContact OD1-NE 3.59Å; D173-R181 PolarHBondContact OD1-NE 3.37Å; D173-R181 IonicContact OD1-NH2 2.67Å; D173-R181 PolarHBondContact OD1-NH2 2.79Å; D173-R181 IonicContact OD2-NE 3.64Å; D173-R181 IonicContact OD2-NH2 3.06Å; D173-W182 WeakPolarHBondContact OD1-CZ2 3.36Å; D173-W182 PolarHBondContact OD1-NE1 3.44Å
174	T	84.2	Confident	88.7	Confident	106 Å²	106	66.4 Å²	66.4	65%	0.65	40%	0.401	S	S	*	.	S	Bend	trans	-69.4	-29.2	171.5	51.6	0	0	0	0	113.2	A171 C172	A171-T174 HydrophobicContact CB-CG2 3.66Å; C172-T174 PolarHBondContact O-N 3.24Å
175	S	86.2	Confident	89	Confident	55 Å²	55	63.6 Å²	63.6	39%	0.385	39%	0.388	S	S	.	.			trans	-159.1	157.5	178	173.4	0	0	0	0	109.9	D173 A177 T180 W182	D173-S175 VanDerWaalsContact C-N 3.32Å; S175-A177 WeakPolarHBondContact OG-CB 3.17Å; S175-A177 PolarHBondContact OG-N 2.86Å; S175-A177 VanDerWaalsContact OG-N 3.11Å; S175-T180 WeakPolarHBondContact O-CG2 3.06Å; S175-T180 PolarHBondContact O-OG1 3.31Å; S175-T180 VanDerWaalsContact O-OG1 3.12Å; S175-W182 PolarHBondContact O-NE1 2.75Å
176	T	85.8	Confident	89.2	Confident	109 Å²	109	61.6 Å²	61.6	67%	0.669	38%	0.38	S	S	*	.			trans	-95.3	10	172.4	54.3	0	0	0	0	113.1	W182	T176-W182 HydrophobicContact CG2-CD2 4.01Å; T176-W182 HydrophobicContact CG2-CG 4.29Å; T176-W182 HydrophobicContact CG2-CZ2 4.2Å
177	A	85.8	Confident	89.6	Confident	40 Å²	40	60.7 Å²	60.7	33%	0.331	37%	0.367	S	S	.	.	S	Bend	trans	-66.6	158.5	179.5	0	0	0	0	0	112.8	S175 N179 T180	S175-A177 WeakPolarHBondContact OG-CB 3.17Å; S175-A177 PolarHBondContact OG-N 2.86Å; S175-A177 VanDerWaalsContact OG-N 3.11Å; A177-N179 VanDerWaalsContact CB-OD1 3.24Å; A177-N179 WeakPolarHBondContact CB-OD1 3.13Å; A177-N179 PolarHBondContact O-N 2.82Å; A177-N179 VanDerWaalsContact O-N 3.07Å; A177-T180 WeakPolarHBondContact O-CB 3.28Å; A177-T180 PolarHBondContact O-N 2.9Å; A177-T180 PolarHBondContact O-OG1 3.13Å
178	S	81.9	Confident	89.9	Confident	92 Å²	92	54.6 Å²	54.6	64%	0.643	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.8	-12.6	-175.7	57.4	0	0	0	0	115.2	T180 R183	S178-T180 VanDerWaalsContact C-N 3.3Å; S178-R183 WeakPolarHBondContact O-CD 3.46Å
179	N	86.6	Confident	90.4	Very high	111 Å²	111	51.1 Å²	51.1	59%	0.594	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.3	5	174.5	66.7	-29.6	0	0	0	113.4	L161 A177	L161-N179 WeakPolarHBondContact CD1-O 3.29Å; A177-N179 VanDerWaalsContact CB-OD1 3.24Å; A177-N179 WeakPolarHBondContact CB-OD1 3.13Å; A177-N179 PolarHBondContact O-N 2.82Å; A177-N179 VanDerWaalsContact O-N 3.07Å
180	T	91.3	Very high	90.8	Very high	18 Å²	18	48.8 Å²	48.8	11%	0.11	30%	0.295	C	S	.	.	S	Bend	trans	-110.6	178.9	179.8	70.5	0	0	0	0	111	S175 A177 S178 W182 R183	S175-T180 WeakPolarHBondContact O-CG2 3.06Å; S175-T180 PolarHBondContact O-OG1 3.31Å; S175-T180 VanDerWaalsContact O-OG1 3.12Å; A177-T180 WeakPolarHBondContact O-CB 3.28Å; A177-T180 PolarHBondContact O-N 2.9Å; A177-T180 PolarHBondContact O-OG1 3.13Å; S178-T180 VanDerWaalsContact C-N 3.3Å; T180-W182 PolarHBondContact O-N 2.84Å; T180-W182 VanDerWaalsContact OG1-CD1 3.3Å; T180-W182 PolarHBondContact OG1-N 2.73Å; T180-R183 WeakPolarHBondContact O-CG 3.13Å; T180-R183 PolarHBondContact O-N 3.27Å
181	R	91.6	Very high	91.1	Very high	14 Å²	14	48.9 Å²	48.9	5%	0.053	28%	0.282	C	S	.	.	G	3₁₀ helix	trans	-53.7	-21.7	175.9	75.1	173.4	-152.3	80.9	4.9	113.9	C131 D173 R183 L184 S228	C131-R181 WeakPolarHBondContact SG-CD 3.09Å; D173-R181 IonicContact OD1-CZ 3.24Å; D173-R181 IonicContact OD1-NE 3.59Å; D173-R181 PolarHBondContact OD1-NE 3.37Å; D173-R181 IonicContact OD1-NH2 2.67Å; D173-R181 PolarHBondContact OD1-NH2 2.79Å; D173-R181 IonicContact OD2-NE 3.64Å; D173-R181 IonicContact OD2-NH2 3.06Å; R181-R183 PolarHBondContact O-N 3.28Å; R181-L184 HydrophobicContact CB-CD1 4.27Å; R181-L184 VanDerWaalsContact O-CB 3.26Å; R181-L184 WeakPolarHBondContact O-CB 3.22Å; R181-L184 VanDerWaalsContact O-CG 3.26Å; R181-L184 WeakPolarHBondContact O-CG 3.39Å; R181-L184 PolarHBondContact O-N 3.14Å; R181-S228 PolarHBondContact O-OG 3.28Å
182	W	92.4	Very high	91.3	Very high	72 Å²	72	46.9 Å²	46.9	27%	0.273	26%	0.26	S	S	.	.	G	3₁₀ helix	trans	-64.2	-12.9	-177.6	-69.5	87.9	0	0	0	114.1	D173 S175 T176 T180 L184 S228 T229	D173-W182 WeakPolarHBondContact OD1-CZ2 3.36Å; D173-W182 PolarHBondContact OD1-NE1 3.44Å; S175-W182 PolarHBondContact O-NE1 2.75Å; T176-W182 HydrophobicContact CG2-CD2 4.01Å; T176-W182 HydrophobicContact CG2-CG 4.29Å; T176-W182 HydrophobicContact CG2-CZ2 4.2Å; T180-W182 PolarHBondContact O-N 2.84Å; T180-W182 VanDerWaalsContact OG1-CD1 3.3Å; T180-W182 PolarHBondContact OG1-N 2.73Å; W182-L184 VanDerWaalsContact C-N 3.32Å; W182-S228 VanDerWaalsContact CZ3-O 3.23Å; W182-S228 WeakPolarHBondContact CZ3-O 2.97Å; W182-T229 HydrophobicContact CE3-CG2 3.92Å; W182-T229 HydrophobicContact CZ3-CG2 3.88Å
183	R	94.1	Very high	91.5	Very high	52 Å²	52	44.7 Å²	44.7	20%	0.196	25%	0.245	C	C	.	.	G	3₁₀ helix	trans	-76.6	-16.3	170.8	80.8	-174.5	-172.4	-164.1	-6.4	114.2	L161 S178 T180 R181 D252 P253 M254	L161-R183 HydrophobicContact CD2-CG 4.26Å; S178-R183 WeakPolarHBondContact O-CD 3.46Å; T180-R183 WeakPolarHBondContact O-CG 3.13Å; T180-R183 PolarHBondContact O-N 3.27Å; R181-R183 PolarHBondContact O-N 3.28Å; R183-D252 IonicContact CZ-OD1 3.78Å; R183-D252 IonicContact CZ-OD2 3.2Å; R183-D252 VanDerWaalsContact CZ-OD2 3.24Å; R183-D252 IonicContact NE-OD1 3.08Å; R183-D252 PolarHBondContact NE-OD1 3.16Å; R183-D252 VanDerWaalsContact NE-OD1 3.11Å; R183-D252 IonicContact NE-OD2 2.75Å; R183-D252 PolarHBondContact NE-OD2 2.84Å; R183-D252 IonicContact NH2-OD1 3.95Å; R183-D252 IonicContact NH2-OD2 3.73Å; R183-D252 PolarHBondContact NH2-OD2 3.17Å; R183-P253 VanDerWaalsContact O-CD 3.29Å; R183-P253 WeakPolarHBondContact O-CD 3.45Å; R183-P253 VanDerWaalsContact O-CG 3.28Å; R183-P253 WeakPolarHBondContact O-CG 3.48Å; R183-M254 PolarHBondContact NH1-SD 3.01Å
184	L	95.6	Very high	91.9	Very high	1 Å²	1	44.2 Å²	44.2	1%	0.005	25%	0.246	C	C	.	.			trans	-72	143.4	-175.1	-62.1	176.2	0	0	0	110.6	P126 A159 L161 R181 W182 S228 V250 D252	P126-L184 HydrophobicContact CB-CD1 4.33Å; P126-L184 HydrophobicContact CB-CD2 3.98Å; A159-L184 HydrophobicContact CB-CD1 3.95Å; L161-L184 HydrophobicContact CD2-CD1 4.3Å; L161-L184 HydrophobicContact CD2-CD2 3.99Å; L161-L184 HydrophobicContact CD2-CG 4.1Å; R181-L184 HydrophobicContact CB-CD1 4.27Å; R181-L184 VanDerWaalsContact O-CB 3.26Å; R181-L184 WeakPolarHBondContact O-CB 3.22Å; R181-L184 VanDerWaalsContact O-CG 3.26Å; R181-L184 WeakPolarHBondContact O-CG 3.39Å; R181-L184 PolarHBondContact O-N 3.14Å; W182-L184 VanDerWaalsContact C-N 3.32Å; L184-S228 PolarHBondContact O-N 2.66Å; L184-S228 PolarHBondContact O-OG 2.89Å; L184-V250 HydrophobicContact CB-CG2 4.07Å; L184-V250 HydrophobicContact CD1-CG2 4.07Å; L184-V250 HydrophobicContact CD2-CG2 4.29Å; L184-V250 HydrophobicContact CG-CG2 4.37Å; L184-D252 HydrophobicContact CD2-CB 3.84Å
185	E	96.8	Very high	92	Very high	48 Å²	48	40 Å²	40	22%	0.224	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	148.4	175.2	-65.5	179.1	174.3	0	0	109.6	T225 L226 V250 R251	E185-T225 HydrophobicContact CB-CG2 4.1Å; E185-L226 CarbonylContact C-O 3.53Å; E185-L226 WeakPolarHBondContact CA-O 3.43Å; E185-V250 WeakPolarHBondContact O-CA 3.37Å; E185-R251 PolarHBondContact N-O 3.49Å; E185-R251 VanDerWaalsContact N-O 3.11Å; E185-R251 PolarHBondContact O-N 3.39Å; E185-R251 IonicContact OE2-CZ 3.6Å; E185-R251 IonicContact OE2-NE 3.78Å; E185-R251 IonicContact OE2-NH2 2.66Å; E185-R251 PolarHBondContact OE2-NH2 2.78Å
186	Y	97.5	Very high	91.9	Very high	1 Å²	1	41.1 Å²	41.1	0%	0.004	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	111.7	-177.1	-52.6	-96.1	0	0	0	109.7	F156 A159 T225 L226 V248 I249 V250 Y261	F156-Y186 HydrophobicContact CD2-CD1 4.39Å; F156-Y186 AromaticContact CE2-CD1 3.53Å; F156-Y186 HydrophobicContact CE2-CD1 3.53Å; F156-Y186 HydrophobicContact CE2-CE1 4.03Å; F156-Y186 AromaticContact CE2-CG 3.87Å; F156-Y186 HydrophobicContact CE2-CG 3.87Å; F156-Y186 HydrophobicContact CZ-CD1 4.27Å; F156-Y186 HydrophobicContact CZ-CG 4.19Å; A159-Y186 HydrophobicContact CB-CE1 3.79Å; A159-Y186 PolarHBondContact N-OH 3.12Å; Y186-T225 CarbonylContact O-C 3.39Å; Y186-T225 WeakPolarHBondContact O-CA 3.2Å; Y186-L226 PolarHBondContact N-O 3.43Å; Y186-L226 PolarHBondContact O-N 3.15Å; Y186-V248 HydrophobicContact CD1-CG1 4.21Å; Y186-I249 WeakPolarHBondContact CA-O 3.42Å; Y186-V250 HydrophobicContact CD1-CB 4.02Å; Y186-V250 HydrophobicContact CD1-CG2 4.25Å; Y186-V250 HydrophobicContact CE1-CB 4.13Å; Y186-V250 HydrophobicContact CE1-CG2 4.02Å; Y186-Y261 HydrophobicContact CD1-CE2 4.2Å; Y186-Y261 HydrophobicContact CE1-CE2 4.32Å
187	D	97.1	Very high	92	Very high	19 Å²	19	38.3 Å²	38.3	10%	0.102	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	114.3	175.5	-67.1	-28.8	0	0	0	108.7	Y189 L222 T225 V248 I249	D187-Y189 HydrophobicContact CB-CD2 4.22Å; D187-Y189 HydrophobicContact CB-CE2 3.49Å; D187-Y189 VanDerWaalsContact CB-CE2 3.49Å; D187-Y189 WeakPolarHBondContact O-CD2 3.43Å; D187-L222 HydrophobicContact CB-CD1 3.73Å; D187-T225 WeakPolarHBondContact OD1-CB 3.47Å; D187-T225 WeakPolarHBondContact OD1-CG2 3.38Å; D187-T225 PolarHBondContact OD1-OG1 3.44Å; D187-V248 WeakPolarHBondContact O-CA 3.42Å; D187-I249 HydrophobicContact CB-CB 4.42Å; D187-I249 PolarHBondContact N-O 3.02Å; D187-I249 PolarHBondContact O-N 2.99Å
188	V	96.6	Very high	92.2	Very high	1 Å²	1	38.5 Å²	38.5	1%	0.006	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	122.2	179.5	-175.1	0	0	0	0	109.2	F156 V223 V224 L226 F236 V248	F156-V188 HydrophobicContact CE1-CG2 4.36Å; V188-V223 PolarHBondContact O-N 3.05Å; V188-V224 HydrophobicContact CB-CG1 3.93Å; V188-V224 HydrophobicContact CG2-CG1 4.17Å; V188-V224 PolarHBondContact N-O 3.33Å; V188-L226 HydrophobicContact CG2-CD1 3.92Å; V188-L226 HydrophobicContact CG2-CG 4.37Å; V188-F236 HydrophobicContact CG1-CZ 4.03Å; V188-V248 HydrophobicContact CG2-CG2 4.32Å
189	Y	96.3	Very high	92.8	Very high	26 Å²	26	36 Å²	36	10%	0.102	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	151	-179.3	-71.2	-98.5	0	0	0	111.6	D187 M216 R221 L222 S247 I249	D187-Y189 HydrophobicContact CB-CD2 4.22Å; D187-Y189 HydrophobicContact CB-CE2 3.49Å; D187-Y189 VanDerWaalsContact CB-CE2 3.49Å; D187-Y189 WeakPolarHBondContact O-CD2 3.43Å; Y189-M216 WeakPolarHBondContact CB-SD 3.2Å; Y189-M216 HydrophobicContact CD1-CG 3.73Å; Y189-M216 HydrophobicContact CD1-SD 4.09Å; Y189-M216 HydrophobicContact CD2-CG 3.81Å; Y189-M216 HydrophobicContact CE1-CG 4.29Å; Y189-M216 HydrophobicContact CE2-CG 4.35Å; Y189-M216 HydrophobicContact CG-CG 3.48Å; Y189-M216 VanDerWaalsContact CG-CG 3.48Å; Y189-M216 HydrophobicContact CG-SD 3.82Å; Y189-R221 WeakPolarHBondContact CA-O 3.26Å; Y189-L222 HydrophobicContact CD1-CB 4.21Å; Y189-L222 HydrophobicContact CD2-CD1 4.41Å; Y189-L222 HydrophobicContact CE1-CB 3.74Å; Y189-L222 HydrophobicContact CE1-CD1 4.31Å; Y189-L222 HydrophobicContact CE2-CD1 3.99Å; Y189-S247 PolarHBondContact N-O 2.84Å; Y189-S247 PolarHBondContact O-N 2.83Å; Y189-S247 VanDerWaalsContact O-N 3.17Å; Y189-I249 HydrophobicContact CD2-CD1 4.09Å; Y189-I249 HydrophobicContact CD2-CG1 4.19Å; Y189-I249 HydrophobicContact CE2-CB 4.28Å; Y189-I249 HydrophobicContact CE2-CD1 3.66Å; Y189-I249 HydrophobicContact CE2-CG1 4.05Å
190	Q	94.9	Very high	93.1	Very high	7 Å²	7	34.7 Å²	34.7	3%	0.033	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	141.5	167.7	70	-171.6	16.9	0	0	110.1	F192 R221 V223 V244 I245 Y246	Q190-F192 HydrophobicContact CG-CD2 4.49Å; Q190-F192 HydrophobicContact CG-CE2 3.89Å; Q190-R221 HydrophobicContact CG-CB 4.28Å; Q190-R221 PolarHBondContact N-O 2.86Å; Q190-R221 PolarHBondContact O-N 3.3Å; Q190-V223 HydrophobicContact CB-CG2 4.01Å; Q190-V223 VanDerWaalsContact CD-CG2 3.42Å; Q190-V223 HydrophobicContact CG-CG2 3.5Å; Q190-V223 VanDerWaalsContact CG-CG2 3.5Å; Q190-V244 HydrophobicContact CB-CG1 4.43Å; Q190-I245 WeakPolarHBondContact CA-O 3.42Å; Q190-Y246 HydrophobicContact CB-CD1 4.18Å; Q190-Y246 HydrophobicContact CB-CE1 4.15Å
191	Y	95.3	Very high	93.2	Very high	61 Å²	61	37.9 Å²	37.9	24%	0.239	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	121	174.1	-179.2	-98.8	0	0	0	109.4	L193 V210 S219 V244 I245	Y191-L193 HydrophobicContact CD1-CD2 4.37Å; Y191-L193 HydrophobicContact CE1-CD2 4.06Å; Y191-V210 HydrophobicContact CD1-CG1 4.04Å; Y191-V210 HydrophobicContact CD2-CG1 3.86Å; Y191-V210 HydrophobicContact CE1-CG1 4.47Å; Y191-V210 HydrophobicContact CE2-CG1 4.32Å; Y191-V210 HydrophobicContact CG-CG1 3.7Å; Y191-S219 VanDerWaalsContact CD2-O 3.3Å; Y191-S219 WeakPolarHBondContact CD2-O 3.46Å; Y191-V244 WeakPolarHBondContact O-CA 3.39Å; Y191-I245 HydrophobicContact CD1-CD1 4.14Å; Y191-I245 PolarHBondContact N-O 3.25Å; Y191-I245 PolarHBondContact O-N 3.5Å
192	F	93.8	Very high	93.3	Very high	31 Å²	31	37.6 Å²	37.6	14%	0.136	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90	132.4	-179.9	-70.6	-97.8	0	0	0	110.3	Q190 I239 Q242 V244 P472	Q190-F192 HydrophobicContact CG-CD2 4.49Å; Q190-F192 HydrophobicContact CG-CE2 3.89Å; F192-I239 HydrophobicContact CE1-CD1 4.34Å; F192-Q242 HydrophobicContact CD1-CG 4.06Å; F192-V244 HydrophobicContact CD1-CG2 3.65Å; F192-V244 HydrophobicContact CE1-CG1 4.47Å; F192-V244 HydrophobicContact CE1-CG2 3.67Å; F192-V244 HydrophobicContact CG-CG2 4.48Å; F192-P472 HydrophobicContact CB-CG 3.69Å; F192-P472 HydrophobicContact CD1-CG 3.99Å; F192-P472 HydrophobicContact CD2-CG 3.39Å; F192-P472 HydrophobicContact CE1-CG 4.48Å; F192-P472 HydrophobicContact CE2-CG 3.93Å; F192-P472 HydrophobicContact CG-CG 3.41Å; F192-P472 VanDerWaalsContact CG-CG 3.41Å; F192-P472 HydrophobicContact CZ-CG 4.45Å
193	L	94.3	Very high	93.5	Very high	2 Å²	2	34.2 Å²	34.2	1%	0.01	19%	0.186	C	C	.	.	P	Polyproline II helix	trans	-76.7	165	170.8	-65.3	177	0	0	0	110.8	Y191 E195 L203 Q242 G243 I245 Y267 Q474	Y191-L193 HydrophobicContact CD1-CD2 4.37Å; Y191-L193 HydrophobicContact CE1-CD2 4.06Å; L193-E195 PolarHBondContact O-N 3.05Å; L193-L203 HydrophobicContact CD1-CB 4.28Å; L193-L203 HydrophobicContact CD1-CD1 3.82Å; L193-Q242 PolarHBondContact O-NE2 3.08Å; L193-G243 PolarHBondContact N-O 2.88Å; L193-I245 HydrophobicContact CD2-CD1 4.09Å; L193-Y267 HydrophobicContact CD1-CE1 4.5Å; L193-Y267 WeakPolarHBondContact CD1-OH 3.45Å; L193-Q474 PolarHBondContact O-NE2 2.97Å
194	P	91.5	Very high	93.6	Very high	63 Å²	63	33 Å²	33	41%	0.409	18%	0.182	S	C	.	.	P	Polyproline II helix	trans	-56	138.6	174.5	-25	35.3	0	0	0	112.5	D197	P194-D197 HydrophobicContact CB-CB 4.12Å; P194-D197 PolarHBondContact O-N 3.23Å
195	E	86.9	Confident	93.5	Very high	17 Å²	17	36.1 Å²	36.1	8%	0.079	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.9	142	176.9	-79.4	175	180	0	0	111.8	L193 D197 Q242 Y445 Q474 I476 D477	L193-E195 PolarHBondContact O-N 3.05Å; E195-D197 PolarHBondContact O-N 2.92Å; E195-D197 VanDerWaalsContact O-N 3.11Å; E195-Q242 VanDerWaalsContact CG-OE1 3.25Å; E195-Y445 HydrophobicContact CB-CD1 3.89Å; E195-Y445 HydrophobicContact CB-CE1 4.36Å; E195-Y445 HydrophobicContact CG-CD1 3.52Å; E195-Y445 HydrophobicContact CG-CE1 3.51Å; E195-Q474 HydrophobicContact CG-CB 4.3Å; E195-Q474 VanDerWaalsContact CG-CD 3.45Å; E195-Q474 HydrophobicContact CG-CG 4.06Å; E195-Q474 VanDerWaalsContact CG-OE1 3.27Å; E195-I476 HydrophobicContact CB-CD1 4.49Å; E195-D477 VanDerWaalsContact OE1-OD2 3.14Å
196	S	82.9	Confident	93.5	Very high	79 Å²	79	33.9 Å²	33.9	55%	0.552	20%	0.195	S	C	*	.	T	Hydrogen-bonded Turn	trans	61.2	12.5	178.8	-168.7	0	0	0	0	115.2
197	D	88.8	Confident	93.4	Very high	49 Å²	49	33.9 Å²	33.9	26%	0.262	20%	0.195	S	C	.	.			trans	-105.7	116.8	175.1	-169.2	-17.8	0	0	0	110.2	P194 E195 S199 S202	P194-D197 HydrophobicContact CB-CB 4.12Å; P194-D197 PolarHBondContact O-N 3.23Å; E195-D197 PolarHBondContact O-N 2.92Å; E195-D197 VanDerWaalsContact O-N 3.11Å; D197-S199 WeakPolarHBondContact OD1-CB 3.5Å; D197-S199 PolarHBondContact OD1-N 2.79Å; D197-S199 PolarHBondContact OD1-OG 2.87Å; D197-S202 VanDerWaalsContact CG-OG 3.22Å; D197-S202 PolarHBondContact OD1-OG 2.92Å; D197-S202 VanDerWaalsContact OD1-OG 3.05Å; D197-S202 WeakPolarHBondContact OD2-CB 3.45Å; D197-S202 PolarHBondContact OD2-OG 2.98Å
198	L	91.1	Very high	93.3	Very high	45 Å²	45	38.4 Å²	38.4	24%	0.236	22%	0.215	C	C	.	.			trans	-113.3	16.7	178.4	-58.8	-179.4	0	0	0	111.9	Y267 F271 C278 Q279	L198-Y267 HydrophobicContact CD2-CD1 3.32Å; L198-Y267 HydrophobicContact CD2-CE1 3.47Å; L198-Y267 VanDerWaalsContact CD2-CE1 3.47Å; L198-Y267 HydrophobicContact CD2-CG 4.16Å; L198-F271 HydrophobicContact CB-CE1 4.1Å; L198-F271 HydrophobicContact CD1-CE1 4.46Å; L198-F271 HydrophobicContact CD2-CZ 4.34Å; L198-C278 HydrophobicContact CD1-CB 3.92Å; L198-C278 HydrophobicContact CD2-CB 4.49Å; L198-Q279 HydrophobicContact CD1-CG 4.29Å
199	S	92.8	Very high	93.2	Very high	38 Å²	38	40 Å²	40	27%	0.266	23%	0.228	S	C	.	.			trans	-78.4	150	-175.6	69.3	0	0	0	0	112.8	D197 S201 S202 L203	D197-S199 WeakPolarHBondContact OD1-CB 3.5Å; D197-S199 PolarHBondContact OD1-N 2.79Å; D197-S199 PolarHBondContact OD1-OG 2.87Å; S199-S201 VanDerWaalsContact C-N 3.25Å; S199-S201 PolarHBondContact O-N 2.9Å; S199-S201 PolarHBondContact OG-OG 2.75Å; S199-S202 PolarHBondContact O-N 3.48Å; S199-S202 PolarHBondContact O-OG 3.17Å; S199-S202 PolarHBondContact OG-N 2.88Å; S199-S202 PolarHBondContact OG-OG 2.84Å; S199-L203 PolarHBondContact O-N 3.44Å
200	E	93.3	Very high	93.1	Very high	84 Å²	84	38.8 Å²	38.8	39%	0.393	22%	0.223	S	C	.	.	H	α-helix	trans	-61.9	-36.6	173.4	-61.7	-171.2	162.2	0	0	111.6	L64 S202 L203 F204	L64-E200 HydrophobicContact CB-CG 3.96Å; L64-E200 HydrophobicContact CD2-CG 3.65Å; L64-E200 HydrophobicContact CG-CG 4.33Å; E200-S202 PolarHBondContact O-N 2.82Å; E200-L203 PolarHBondContact O-N 3.24Å; E200-F204 HydrophobicContact CB-CD2 4.18Å; E200-F204 HydrophobicContact CB-CE2 3.78Å; E200-F204 HydrophobicContact CB-CZ 4.22Å; E200-F204 WeakPolarHBondContact O-CB 3.29Å; E200-F204 WeakPolarHBondContact O-CD2 3.35Å; E200-F204 WeakPolarHBondContact O-CG 3.47Å; E200-F204 PolarHBondContact O-N 3.13Å
201	S	93.5	Very high	92.9	Very high	86 Å²	86	38.6 Å²	38.6	60%	0.601	22%	0.223	S	C	*	.	H	α-helix	trans	-61	-43.7	180	44.3	0	0	0	0	113	S199 S205	S199-S201 VanDerWaalsContact C-N 3.25Å; S199-S201 PolarHBondContact O-N 2.9Å; S199-S201 PolarHBondContact OG-OG 2.75Å; S201-S205 VanDerWaalsContact O-CB 3.27Å; S201-S205 WeakPolarHBondContact O-CB 3.49Å; S201-S205 PolarHBondContact O-N 2.92Å; S201-S205 PolarHBondContact O-OG 2.9Å
202	S	94.6	Very high	92.7	Very high	8 Å²	8	38.8 Å²	38.8	6%	0.056	23%	0.228	C	C	.	.	H	α-helix	trans	-69.5	-43.4	-179.4	64	0	0	0	0	110.7	D197 S199 E200 S205 G206	D197-S202 VanDerWaalsContact CG-OG 3.22Å; D197-S202 PolarHBondContact OD1-OG 2.92Å; D197-S202 VanDerWaalsContact OD1-OG 3.05Å; D197-S202 WeakPolarHBondContact OD2-CB 3.45Å; D197-S202 PolarHBondContact OD2-OG 2.98Å; S199-S202 PolarHBondContact O-N 3.48Å; S199-S202 PolarHBondContact O-OG 3.17Å; S199-S202 PolarHBondContact OG-N 2.88Å; S199-S202 PolarHBondContact OG-OG 2.84Å; E200-S202 PolarHBondContact O-N 2.82Å; S202-S205 PolarHBondContact O-N 2.86Å; S202-S205 PolarHBondContact O-OG 2.79Å; S202-G206 PolarHBondContact O-N 2.79Å
203	L	95.8	Very high	92.7	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-57.7	-53.2	174.2	173.7	62.8	0	0	0	112	L64 L193 S199 E200 S205 G206 L207 I245 H265	L64-L203 HydrophobicContact CB-CD2 4.3Å; L64-L203 HydrophobicContact CD1-CD2 3.66Å; L193-L203 HydrophobicContact CD1-CB 4.28Å; L193-L203 HydrophobicContact CD1-CD1 3.82Å; S199-L203 PolarHBondContact O-N 3.44Å; E200-L203 PolarHBondContact O-N 3.24Å; L203-S205 VanDerWaalsContact C-N 3.35Å; L203-S205 PolarHBondContact O-N 2.74Å; L203-G206 WeakPolarHBondContact O-CA 3.28Å; L203-G206 PolarHBondContact O-N 2.92Å; L203-G206 VanDerWaalsContact O-N 3.11Å; L203-L207 HydrophobicContact CD1-CD1 3.98Å; L203-L207 HydrophobicContact CD1-CG 4.22Å; L203-L207 HydrophobicContact CG-CD1 3.99Å; L203-L207 PolarHBondContact O-N 3.1Å; L203-I245 HydrophobicContact CD1-CD1 4.41Å; L203-I245 HydrophobicContact CD1-CG1 4.49Å; L203-H265 HydrophobicContact CD1-CB 3.81Å; L203-H265 WeakPolarHBondContact CD2-NE2 3.42Å
204	F	95.6	Very high	92.6	Very high	26 Å²	26	48.6 Å²	48.6	11%	0.114	27%	0.268	C	S	.	.	H	α-helix	trans	-67.6	-35.5	-176.2	-62.3	-23	0	0	0	112.2	T115 E200 G206 L207 Q208	T115-F204 HydrophobicContact CG2-CB 4.1Å; T115-F204 HydrophobicContact CG2-CD1 3.51Å; T115-F204 HydrophobicContact CG2-CD2 4.42Å; T115-F204 HydrophobicContact CG2-CE1 4.01Å; T115-F204 HydrophobicContact CG2-CG 3.75Å; E200-F204 HydrophobicContact CB-CD2 4.18Å; E200-F204 HydrophobicContact CB-CE2 3.78Å; E200-F204 HydrophobicContact CB-CZ 4.22Å; E200-F204 WeakPolarHBondContact O-CB 3.29Å; E200-F204 WeakPolarHBondContact O-CD2 3.35Å; E200-F204 WeakPolarHBondContact O-CG 3.47Å; E200-F204 PolarHBondContact O-N 3.13Å; F204-G206 VanDerWaalsContact C-N 3.32Å; F204-G206 PolarHBondContact O-N 3.49Å; F204-L207 HydrophobicContact CD1-CD1 4.18Å; F204-L207 PolarHBondContact O-N 3.13Å; F204-Q208 WeakPolarHBondContact O-CB 3.32Å; F204-Q208 PolarHBondContact O-N 2.98Å
205	S	95.3	Very high	92.6	Very high	68 Å²	68	46.4 Å²	46.4	48%	0.476	26%	0.257	S	S	.	.	H	α-helix	trans	-63.9	-38.5	171.1	74.3	0	0	0	0	112.2	S201 S202 L203 Q208 A209	S201-S205 VanDerWaalsContact O-CB 3.27Å; S201-S205 WeakPolarHBondContact O-CB 3.49Å; S201-S205 PolarHBondContact O-N 2.92Å; S201-S205 PolarHBondContact O-OG 2.9Å; S202-S205 PolarHBondContact O-N 2.86Å; S202-S205 PolarHBondContact O-OG 2.79Å; L203-S205 VanDerWaalsContact C-N 3.35Å; L203-S205 PolarHBondContact O-N 2.74Å; S205-Q208 PolarHBondContact O-N 2.94Å; S205-A209 PolarHBondContact O-N 2.98Å
206	G	95.4	Very high	92.9	Very high	1 Å²	1	45.6 Å²	45.6	1%	0.01	25%	0.253	C	S	.	.	H	α-helix	trans	-64.4	-48.9	174.6	0	0	0	0	0	112	S202 L203 F204 Q208 A209 V210	S202-G206 PolarHBondContact O-N 2.79Å; L203-G206 WeakPolarHBondContact O-CA 3.28Å; L203-G206 PolarHBondContact O-N 2.92Å; L203-G206 VanDerWaalsContact O-N 3.11Å; F204-G206 VanDerWaalsContact C-N 3.32Å; F204-G206 PolarHBondContact O-N 3.49Å; G206-Q208 VanDerWaalsContact C-N 3.29Å; G206-Q208 PolarHBondContact O-N 3.27Å; G206-A209 WeakPolarHBondContact O-CB 3.29Å; G206-A209 PolarHBondContact O-N 2.85Å; G206-A209 VanDerWaalsContact O-N 3.13Å; G206-V210 WeakPolarHBondContact O-CG2 3.26Å; G206-V210 PolarHBondContact O-N 3.11Å
207	L	95.4	Very high	93.4	Very high	1 Å²	1	44.9 Å²	44.9	1%	0.005	25%	0.252	C	S	.	.	H	α-helix	trans	-58.4	-41.6	175.1	-76.6	165.9	0	0	0	111.3	H62 L203 F204 A209 V210 A211 I245 P263	H62-L207 HydrophobicContact CB-CD1 3.49Å; H62-L207 VanDerWaalsContact CB-CD1 3.49Å; L203-L207 HydrophobicContact CD1-CD1 3.98Å; L203-L207 HydrophobicContact CD1-CG 4.22Å; L203-L207 HydrophobicContact CG-CD1 3.99Å; L203-L207 PolarHBondContact O-N 3.1Å; F204-L207 HydrophobicContact CD1-CD1 4.18Å; F204-L207 PolarHBondContact O-N 3.13Å; L207-A209 VanDerWaalsContact C-N 3.33Å; L207-A209 PolarHBondContact O-N 3.06Å; L207-V210 CarbonylContact O-C 3.51Å; L207-V210 PolarHBondContact O-N 3.11Å; L207-V210 VanDerWaalsContact O-N 3.16Å; L207-A211 WeakPolarHBondContact O-CB 3.5Å; L207-A211 PolarHBondContact O-N 3.15Å; L207-I245 HydrophobicContact CD2-CD1 4.03Å; L207-I245 HydrophobicContact CD2-CG2 4.07Å; L207-I245 HydrophobicContact CG-CD1 3.89Å; L207-P263 HydrophobicContact CD2-CB 4.25Å; L207-P263 HydrophobicContact CD2-CG 3.92Å
208	Q	94.6	Very high	93.7	Very high	114 Å²	114	46.6 Å²	46.6	53%	0.533	27%	0.273	S	S	.	.	H	α-helix	trans	-61.5	-40.3	175.6	-179.2	171.8	30.9	0	0	112.9	F32 F204 S205 G206 V210	F32-Q208 HydrophobicContact CD1-CB 4.31Å; F32-Q208 HydrophobicContact CD2-CB 4.28Å; F32-Q208 HydrophobicContact CD2-CG 3.7Å; F32-Q208 HydrophobicContact CE1-CB 4.11Å; F32-Q208 HydrophobicContact CE2-CB 4.08Å; F32-Q208 HydrophobicContact CE2-CG 3.66Å; F32-Q208 HydrophobicContact CG-CB 4.4Å; F32-Q208 HydrophobicContact CG-CG 4.2Å; F32-Q208 VanDerWaalsContact CZ-CA 3.46Å; F32-Q208 HydrophobicContact CZ-CB 4Å; F32-Q208 HydrophobicContact CZ-CG 4.11Å; F204-Q208 WeakPolarHBondContact O-CB 3.32Å; F204-Q208 PolarHBondContact O-N 2.98Å; S205-Q208 PolarHBondContact O-N 2.94Å; G206-Q208 VanDerWaalsContact C-N 3.29Å; G206-Q208 PolarHBondContact O-N 3.27Å; Q208-V210 PolarHBondContact O-N 3.24Å
209	A	94.4	Very high	93.8	Very high	34 Å²	34	47.1 Å²	47.1	28%	0.281	28%	0.28	S	S	.	.	H	α-helix	trans	-66	-26.6	177.5	0	0	0	0	0	112.8	S205 G206 L207 G215	S205-A209 PolarHBondContact O-N 2.98Å; G206-A209 WeakPolarHBondContact O-CB 3.29Å; G206-A209 PolarHBondContact O-N 2.85Å; G206-A209 VanDerWaalsContact O-N 3.13Å; L207-A209 VanDerWaalsContact C-N 3.33Å; L207-A209 PolarHBondContact O-N 3.06Å; A209-G215 CarbonylContact O-C 3.56Å; A209-G215 WeakPolarHBondContact O-CA 3.18Å
210	V	94.9	Very high	93.7	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-120.7	4.2	-169	-50	0	0	0	0	114.7	Y191 G206 L207 Q208 N212 M216 I245	Y191-V210 HydrophobicContact CD1-CG1 4.04Å; Y191-V210 HydrophobicContact CD2-CG1 3.86Å; Y191-V210 HydrophobicContact CE1-CG1 4.47Å; Y191-V210 HydrophobicContact CE2-CG1 4.32Å; Y191-V210 HydrophobicContact CG-CG1 3.7Å; G206-V210 WeakPolarHBondContact O-CG2 3.26Å; G206-V210 PolarHBondContact O-N 3.11Å; L207-V210 CarbonylContact O-C 3.51Å; L207-V210 PolarHBondContact O-N 3.11Å; L207-V210 VanDerWaalsContact O-N 3.16Å; Q208-V210 PolarHBondContact O-N 3.24Å; V210-N212 VanDerWaalsContact C-N 3.34Å; V210-N212 PolarHBondContact O-N 3.29Å; V210-M216 HydrophobicContact CB-CE 3.52Å; V210-M216 HydrophobicContact CB-SD 4.03Å; V210-M216 HydrophobicContact CG1-CE 4.45Å; V210-M216 HydrophobicContact CG1-SD 4.4Å; V210-M216 HydrophobicContact CG2-CE 3.88Å; V210-M216 VanDerWaalsContact O-CE 3.29Å; V210-M216 WeakPolarHBondContact O-CE 3.32Å; V210-I245 HydrophobicContact CG2-CB 4.46Å; V210-I245 HydrophobicContact CG2-CD1 4.18Å; V210-I245 HydrophobicContact CG2-CG2 3.85Å
211	A	90.9	Very high	93.7	Very high	3 Å²	3	47 Å²	47	3%	0.025	28%	0.275	C	S	.	.	S	Bend	trans	-66.6	-29.6	-174.7	0	0	0	0	0	115.3	F32 V117 L119 L207	F32-A211 HydrophobicContact CE1-CB 4.32Å; F32-A211 HydrophobicContact CE2-CB 4.43Å; F32-A211 HydrophobicContact CZ-CB 3.52Å; V117-A211 HydrophobicContact CG1-CB 4.42Å; L119-A211 WeakPolarHBondContact CD1-O 3.02Å; L207-A211 WeakPolarHBondContact O-CB 3.5Å; L207-A211 PolarHBondContact O-N 3.15Å
212	N	91.4	Very high	93.8	Very high	66 Å²	66	46.8 Å²	46.8	35%	0.353	27%	0.267	S	S	.	.	S	Bend	trans	-113.8	165.1	-179.1	72.4	41.3	0	0	0	112.1	L119 V210 R214 G215 M216	L119-N212 HydrophobicContact CD1-CB 4.41Å; L119-N212 HydrophobicContact CD2-CB 4.17Å; V210-N212 VanDerWaalsContact C-N 3.34Å; V210-N212 PolarHBondContact O-N 3.29Å; N212-R214 VanDerWaalsContact C-N 3.27Å; N212-R214 PolarHBondContact O-N 3.05Å; N212-R214 PolarHBondContact OD1-N 2.56Å; N212-R214 VanDerWaalsContact OD1-N 3.15Å; N212-G215 PolarHBondContact O-N 2.54Å; N212-G215 PolarHBondContact OD1-N 2.72Å; N212-M216 WeakPolarHBondContact O-CB 3.38Å; N212-M216 PolarHBondContact O-N 3.35Å
213	T	92.6	Very high	93.7	Very high	31 Å²	31	48 Å²	48	19%	0.19	27%	0.274	C	S	.	.	H	α-helix	trans	-58.3	-36.3	-175.4	55.7	0	0	0	0	113.5	A217 I249	T213-A217 WeakPolarHBondContact O-CB 3.35Å; T213-A217 PolarHBondContact O-N 3.4Å; T213-A217 VanDerWaalsContact O-N 3.07Å; T213-I249 HydrophobicContact CG2-CD1 4.27Å; T213-I249 HydrophobicContact CG2-CG1 4.39Å; T213-I249 HydrophobicContact CG2-CG2 4Å
214	R	92.9	Very high	93.6	Very high	208 Å²	208	49.4 Å²	49.4	79%	0.785	28%	0.282	S	S	*	.	H	α-helix	trans	-72.4	-44.7	178.3	-79.2	-173.8	-85.3	168.8	-7.1	112.4	N212 A217 A218	N212-R214 VanDerWaalsContact C-N 3.27Å; N212-R214 PolarHBondContact O-N 3.05Å; N212-R214 PolarHBondContact OD1-N 2.56Å; N212-R214 VanDerWaalsContact OD1-N 3.15Å; R214-A217 PolarHBondContact O-N 3.44Å; R214-A218 WeakPolarHBondContact O-CB 3.44Å; R214-A218 PolarHBondContact O-N 3.18Å; R214-A218 VanDerWaalsContact O-N 3.07Å
215	G	92.1	Very high	93.6	Very high	17 Å²	17	51 Å²	51	18%	0.175	30%	0.295	C	S	.	.	H	α-helix	trans	-63.5	-43.7	178.4	0	0	0	0	0	111.4	A209 N212 A218 S219	A209-G215 CarbonylContact O-C 3.56Å; A209-G215 WeakPolarHBondContact O-CA 3.18Å; N212-G215 PolarHBondContact O-N 2.54Å; N212-G215 PolarHBondContact OD1-N 2.72Å; G215-A218 PolarHBondContact O-N 2.77Å; G215-S219 WeakPolarHBondContact O-CB 3.46Å; G215-S219 PolarHBondContact O-N 2.81Å; G215-S219 PolarHBondContact O-OG 3.5Å
216	M	93.6	Very high	93.6	Very high	0 Å²	0	48.3 Å²	48.3	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-62.5	-46	174.7	-175.2	62.8	70.4	0	0	112.5	Y189 V210 N212 A218 S219 G220 S247 I249	Y189-M216 WeakPolarHBondContact CB-SD 3.2Å; Y189-M216 HydrophobicContact CD1-CG 3.73Å; Y189-M216 HydrophobicContact CD1-SD 4.09Å; Y189-M216 HydrophobicContact CD2-CG 3.81Å; Y189-M216 HydrophobicContact CE1-CG 4.29Å; Y189-M216 HydrophobicContact CE2-CG 4.35Å; Y189-M216 HydrophobicContact CG-CG 3.48Å; Y189-M216 VanDerWaalsContact CG-CG 3.48Å; Y189-M216 HydrophobicContact CG-SD 3.82Å; V210-M216 HydrophobicContact CB-CE 3.52Å; V210-M216 HydrophobicContact CB-SD 4.03Å; V210-M216 HydrophobicContact CG1-CE 4.45Å; V210-M216 HydrophobicContact CG1-SD 4.4Å; V210-M216 HydrophobicContact CG2-CE 3.88Å; V210-M216 VanDerWaalsContact O-CE 3.29Å; V210-M216 WeakPolarHBondContact O-CE 3.32Å; N212-M216 WeakPolarHBondContact O-CB 3.38Å; N212-M216 PolarHBondContact O-N 3.35Å; M216-A218 PolarHBondContact O-N 3.45Å; M216-S219 PolarHBondContact O-N 3.2Å; M216-G220 WeakPolarHBondContact O-CA 3.14Å; M216-G220 PolarHBondContact O-N 2.02Å; M216-S247 WeakPolarHBondContact CE-OG 3.31Å; M216-I249 HydrophobicContact CB-CD1 3.95Å; M216-I249 HydrophobicContact CG-CD1 3.91Å
217	A	92.6	Very high	93.5	Very high	64 Å²	64	54.3 Å²	54.3	53%	0.529	30%	0.3	S	S	.	.	H	α-helix	trans	-64.5	-25.9	177.9	0	0	0	0	0	113	T213 R214	T213-A217 WeakPolarHBondContact O-CB 3.35Å; T213-A217 PolarHBondContact O-N 3.4Å; T213-A217 VanDerWaalsContact O-N 3.07Å; R214-A217 PolarHBondContact O-N 3.44Å
218	A	94.2	Very high	93.3	Very high	85 Å²	85	54.8 Å²	54.8	70%	0.702	30%	0.304	S	S	*	.	H	α-helix	trans	-85.7	-38.2	179.4	0	0	0	0	0	113.5	R214 G215 M216	R214-A218 WeakPolarHBondContact O-CB 3.44Å; R214-A218 PolarHBondContact O-N 3.18Å; R214-A218 VanDerWaalsContact O-N 3.07Å; G215-A218 PolarHBondContact O-N 2.77Å; M216-A218 PolarHBondContact O-N 3.45Å
219	S	93.3	Very high	93.1	Very high	56 Å²	56	54.1 Å²	54.1	39%	0.392	31%	0.308	S	S	.	.	H	α-helix	trans	-111.6	-30.8	-169.9	-44.2	0	0	0	0	113.1	Y191 G215 M216	Y191-S219 VanDerWaalsContact CD2-O 3.3Å; Y191-S219 WeakPolarHBondContact CD2-O 3.46Å; G215-S219 WeakPolarHBondContact O-CB 3.46Å; G215-S219 PolarHBondContact O-N 2.81Å; G215-S219 PolarHBondContact O-OG 3.5Å; M216-S219 PolarHBondContact O-N 3.2Å
220	G	92.4	Very high	93	Very high	16 Å²	16	55.8 Å²	55.8	17%	0.165	31%	0.312	C	S	.	.	S	Bend	trans	-80.9	158.7	-179.3	0	0	0	0	0	112.7	M216	M216-G220 WeakPolarHBondContact O-CA 3.14Å; M216-G220 PolarHBondContact O-N 2.02Å
221	R	92.7	Very high	92.8	Very high	104 Å²	104	63 Å²	63	39%	0.392	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	121.8	173.8	178.7	178.1	173.5	174.8	-0	110	Y189 Q190 V223 D470	Y189-R221 WeakPolarHBondContact CA-O 3.26Å; Q190-R221 HydrophobicContact CG-CB 4.28Å; Q190-R221 PolarHBondContact N-O 2.86Å; Q190-R221 PolarHBondContact O-N 3.3Å; R221-V223 PolarHBondContact O-N 2.78Å; R221-D470 IonicContact CZ-OD1 2.97Å; R221-D470 IonicContact CZ-OD2 3.06Å; R221-D470 IonicContact NH1-OD1 2.71Å; R221-D470 PolarHBondContact NH1-OD1 3.29Å; R221-D470 IonicContact NH1-OD2 3.5Å; R221-D470 PolarHBondContact NH1-OD2 2.88Å; R221-D470 IonicContact NH2-OD1 3.93Å; R221-D470 IonicContact NH2-OD2 3.27Å; R221-D470 PolarHBondContact NH2-OD2 3.49Å
222	L	94.4	Very high	92.9	Very high	81 Å²	81	64.5 Å²	64.5	42%	0.424	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.1	122.4	169.4	179.5	62.3	0	0	0	109.4	D187 Y189	D187-L222 HydrophobicContact CB-CD1 3.73Å; Y189-L222 HydrophobicContact CD1-CB 4.21Å; Y189-L222 HydrophobicContact CD2-CD1 4.41Å; Y189-L222 HydrophobicContact CE1-CB 3.74Å; Y189-L222 HydrophobicContact CE1-CD1 4.31Å; Y189-L222 HydrophobicContact CE2-CD1 3.99Å
223	V	92.9	Very high	92.9	Very high	33 Å²	33	62.3 Å²	62.3	20%	0.2	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	-47.3	179.1	-176.6	0	0	0	0	110.2	V188 Q190 R221 F236 F468	V188-V223 PolarHBondContact O-N 3.05Å; Q190-V223 HydrophobicContact CB-CG2 4.01Å; Q190-V223 VanDerWaalsContact CD-CG2 3.42Å; Q190-V223 HydrophobicContact CG-CG2 3.5Å; Q190-V223 VanDerWaalsContact CG-CG2 3.5Å; R221-V223 PolarHBondContact O-N 2.78Å; V223-F236 HydrophobicContact CB-CE1 4.42Å; V223-F236 HydrophobicContact CG1-CE1 3.97Å; V223-F236 HydrophobicContact CG2-CE1 4.13Å; V223-F468 HydrophobicContact CG1-CB 4.38Å; V223-F468 HydrophobicContact CG1-CD1 3.54Å; V223-F468 HydrophobicContact CG1-CD2 3.82Å; V223-F468 HydrophobicContact CG1-CE1 3.57Å; V223-F468 HydrophobicContact CG1-CE2 3.87Å; V223-F468 HydrophobicContact CG1-CG 3.65Å; V223-F468 HydrophobicContact CG1-CZ 3.73Å
224	V	93.3	Very high	92.9	Very high	29 Å²	29	62.1 Å²	62.1	18%	0.176	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-163.1	145.8	-171.6	60.2	0	0	0	0	110.4	V188 L226 M234 F468	V188-V224 HydrophobicContact CB-CG1 3.93Å; V188-V224 HydrophobicContact CG2-CG1 4.17Å; V188-V224 PolarHBondContact N-O 3.33Å; V224-L226 HydrophobicContact CG2-CD2 4.25Å; V224-M234 HydrophobicContact CB-CE 4.18Å; V224-M234 HydrophobicContact CG1-CE 3.39Å; V224-M234 HydrophobicContact CG2-CE 3.89Å; V224-F468 HydrophobicContact CB-CZ 3.93Å; V224-F468 HydrophobicContact CG1-CE2 4.2Å; V224-F468 HydrophobicContact CG1-CZ 3.92Å; V224-F468 HydrophobicContact CG2-CZ 4.43Å
225	T	95.5	Very high	92.9	Very high	61 Å²	61	52.9 Å²	52.9	37%	0.374	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	120.3	169.6	-59.4	0	0	0	0	108.8	E185 Y186 D187	E185-T225 HydrophobicContact CB-CG2 4.1Å; Y186-T225 CarbonylContact O-C 3.39Å; Y186-T225 WeakPolarHBondContact O-CA 3.2Å; D187-T225 WeakPolarHBondContact OD1-CB 3.47Å; D187-T225 WeakPolarHBondContact OD1-CG2 3.38Å; D187-T225 PolarHBondContact OD1-OG1 3.44Å
226	L	95.3	Very high	93	Very high	10 Å²	10	52.2 Å²	52.2	5%	0.052	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	141.6	178.3	-64.2	175.4	0	0	0	110.4	F156 E185 Y186 V188 V224 D230 M234	F156-L226 HydrophobicContact CE1-CD1 4.32Å; F156-L226 HydrophobicContact CZ-CD1 4.04Å; E185-L226 CarbonylContact C-O 3.53Å; E185-L226 WeakPolarHBondContact CA-O 3.43Å; Y186-L226 PolarHBondContact N-O 3.43Å; Y186-L226 PolarHBondContact O-N 3.15Å; V188-L226 HydrophobicContact CG2-CD1 3.92Å; V188-L226 HydrophobicContact CG2-CG 4.37Å; V224-L226 HydrophobicContact CG2-CD2 4.25Å; L226-D230 HydrophobicContact CB-CB 4.29Å; L226-D230 HydrophobicContact CD2-CB 3.9Å; L226-M234 HydrophobicContact CD1-CE 4.17Å; L226-M234 HydrophobicContact CD1-CG 4.15Å; L226-M234 HydrophobicContact CD1-SD 4.3Å; L226-M234 HydrophobicContact CD2-CE 3.41Å; L226-M234 VanDerWaalsContact CD2-CE 3.41Å; L226-M234 HydrophobicContact CD2-SD 4.2Å; L226-M234 HydrophobicContact CG-CE 4.09Å
227	K	94.5	Very high	92.9	Very high	128 Å²	128	52.6 Å²	52.6	56%	0.557	30%	0.303	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85	161.3	166.5	-64.6	179.5	-178.8	176.5	0	109.8	T229 D230	K227-T229 PolarHBondContact O-N 3.07Å; K227-D230 PolarHBondContact N-OD2 3.07Å; K227-D230 WeakPolarHBondContact O-CB 3.07Å; K227-D230 PolarHBondContact O-N 3.34Å
228	S	91.1	Very high	92.9	Very high	10 Å²	10	49.6 Å²	49.6	7%	0.07	28%	0.278	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60	-17.1	173.1	-69.4	0	0	0	0	114.6	R181 W182 L184	R181-S228 PolarHBondContact O-OG 3.28Å; W182-S228 VanDerWaalsContact CZ3-O 3.23Å; W182-S228 WeakPolarHBondContact CZ3-O 2.97Å; L184-S228 PolarHBondContact O-N 2.66Å; L184-S228 PolarHBondContact O-OG 2.89Å
229	T	90.6	Very high	92.6	Very high	101 Å²	101	45.9 Å²	45.9	62%	0.62	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	-80.6	-18.5	172.4	52.8	0	0	0	0	114.4	W182 K227	W182-T229 HydrophobicContact CE3-CG2 3.92Å; W182-T229 HydrophobicContact CZ3-CG2 3.88Å; K227-T229 PolarHBondContact O-N 3.07Å
230	D	92.2	Very high	92.4	Very high	68 Å²	68	45.8 Å²	45.8	36%	0.364	24%	0.244	S	C	.	.	S	Bend	trans	-82.8	157.4	-178.2	-55.9	-29.9	0	0	0	109.7	L226 K227 T232	L226-D230 HydrophobicContact CB-CB 4.29Å; L226-D230 HydrophobicContact CD2-CB 3.9Å; K227-D230 PolarHBondContact N-OD2 3.07Å; K227-D230 WeakPolarHBondContact O-CB 3.07Å; K227-D230 PolarHBondContact O-N 3.34Å; D230-T232 PolarHBondContact O-N 3.15Å
231	K	90.8	Very high	92.1	Very high	153 Å²	153	45.7 Å²	45.7	67%	0.665	24%	0.243	S	C	*	.			trans	-67.9	129.6	177.1	-167.2	-179.2	-178.1	-178.4	0	109.4	A233	K231-A233 HydrophobicContact CD-CB 4.1Å; K231-A233 HydrophobicContact CG-CB 4.01Å; K231-A233 PolarHBondContact O-N 2.65Å
232	T	92.6	Very high	92	Very high	33 Å²	33	40.9 Å²	40.9	20%	0.202	23%	0.225	C	C	.	.	S	Bend	trans	-77.3	38.9	175.2	58.4	0	0	0	0	112.5	R155 F156 P158 D230	R155-T232 WeakPolarHBondContact CA-O 3.27Å; F156-T232 HydrophobicContact CD2-CG2 4.16Å; F156-T232 HydrophobicContact CE2-CG2 3.62Å; F156-T232 HydrophobicContact CZ-CG2 3.96Å; F156-T232 PolarHBondContact N-O 3.22Å; F156-T232 VanDerWaalsContact N-O 3.14Å; F156-T232 WeakPolarHBondContact O-CB 3.44Å; F156-T232 PolarHBondContact O-OG1 3.15Å; P158-T232 HydrophobicContact CG-CG2 4.42Å; D230-T232 PolarHBondContact O-N 3.15Å
233	A	92.3	Very high	91.9	Very high	21 Å²	21	37.1 Å²	37.1	17%	0.174	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	124.9	179.4	0	0	0	0	0	109.9	V154 R155 K231	V154-A233 CarbonylContact O-C 3.59Å; V154-A233 VanDerWaalsContact O-CA 3.27Å; V154-A233 WeakPolarHBondContact O-CA 3.31Å; R155-A233 HydrophobicContact CG-CB 3.9Å; K231-A233 HydrophobicContact CD-CB 4.1Å; K231-A233 HydrophobicContact CG-CB 4.01Å; K231-A233 PolarHBondContact O-N 2.65Å
234	M	92.3	Very high	92	Very high	26 Å²	26	35.9 Å²	35.9	13%	0.128	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	151.7	-179.5	-63.9	-56.4	-121.1	0	0	111	T153 V154 V224 L226 F236 F468	T153-M234 CarbonylContact C-O 3.57Å; T153-M234 VanDerWaalsContact CA-O 3.25Å; T153-M234 WeakPolarHBondContact CA-O 3.17Å; V154-M234 PolarHBondContact N-O 2.67Å; V154-M234 PolarHBondContact O-N 3.11Å; V224-M234 HydrophobicContact CB-CE 4.18Å; V224-M234 HydrophobicContact CG1-CE 3.39Å; V224-M234 HydrophobicContact CG2-CE 3.89Å; L226-M234 HydrophobicContact CD1-CE 4.17Å; L226-M234 HydrophobicContact CD1-CG 4.15Å; L226-M234 HydrophobicContact CD1-SD 4.3Å; L226-M234 HydrophobicContact CD2-CE 3.41Å; L226-M234 VanDerWaalsContact CD2-CE 3.41Å; L226-M234 HydrophobicContact CD2-SD 4.2Å; L226-M234 HydrophobicContact CG-CE 4.09Å; M234-F236 HydrophobicContact CB-CE2 3.75Å; M234-F236 HydrophobicContact CB-CZ 4.26Å; M234-F468 HydrophobicContact CE-CE2 3.9Å; M234-F468 HydrophobicContact CE-CZ 4.09Å
235	A	92.9	Very high	92.2	Very high	14 Å²	14	34.5 Å²	34.5	12%	0.116	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	141.1	174.4	0	0	0	0	0	110.1	T152 A467 F468	T152-A235 CarbonylContact O-C 3.57Å; T152-A235 WeakPolarHBondContact O-CA 3.37Å; A235-A467 HydrophobicContact CB-CB 4.11Å; A235-A467 VanDerWaalsContact O-CA 3.27Å; A235-A467 WeakPolarHBondContact O-CA 3.43Å; A235-F468 WeakPolarHBondContact O-CD2 3.38Å; A235-F468 PolarHBondContact O-N 3.06Å
236	F	93.8	Very high	92.3	Very high	3 Å²	3	31.8 Å²	31.8	1%	0.013	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	158.4	178.7	-64.7	-91.2	0	0	0	108.9	E151 T152 V154 V188 V223 M234 S238 Y246 F468	E151-F236 CarbonylContact C-O 3.49Å; E151-F236 WeakPolarHBondContact CA-O 3.16Å; T152-F236 PolarHBondContact N-O 2.65Å; T152-F236 PolarHBondContact O-N 3.11Å; V154-F236 HydrophobicContact CB-CD2 4.3Å; V154-F236 HydrophobicContact CB-CE2 3.92Å; V154-F236 HydrophobicContact CG2-CD2 3.63Å; V154-F236 HydrophobicContact CG2-CE2 3.59Å; V188-F236 HydrophobicContact CG1-CZ 4.03Å; V223-F236 HydrophobicContact CB-CE1 4.42Å; V223-F236 HydrophobicContact CG1-CE1 3.97Å; V223-F236 HydrophobicContact CG2-CE1 4.13Å; M234-F236 HydrophobicContact CB-CE2 3.75Å; M234-F236 HydrophobicContact CB-CZ 4.26Å; F236-S238 PolarHBondContact O-N 3.04Å; F236-Y246 HydrophobicContact CB-CE1 4.19Å; F236-Y246 WeakPolarHBondContact CB-OH 3.47Å; F236-Y246 AromaticContact CD1-CE1 3.67Å; F236-Y246 HydrophobicContact CD1-CE1 3.67Å; F236-Y246 HydrophobicContact CD2-CD1 4.23Å; F236-Y246 AromaticContact CD2-CE1 3.62Å; F236-Y246 HydrophobicContact CD2-CE1 3.62Å; F236-Y246 HydrophobicContact CE1-CD1 4.39Å; F236-Y246 AromaticContact CE1-CE1 3.86Å; F236-Y246 HydrophobicContact CE1-CE1 3.86Å; F236-Y246 HydrophobicContact CE2-CD1 4.02Å; F236-Y246 AromaticContact CE2-CE1 3.82Å; F236-Y246 HydrophobicContact CE2-CE1 3.82Å; F236-Y246 AromaticContact CG-CE1 3.55Å; F236-Y246 HydrophobicContact CG-CE1 3.55Å; F236-Y246 AromaticContact CG-CZ 3.94Å; F236-Y246 HydrophobicContact CZ-CD1 4.11Å; F236-Y246 AromaticContact CZ-CE1 3.94Å; F236-Y246 HydrophobicContact CZ-CE1 3.94Å; F236-F468 HydrophobicContact CD1-CB 3.85Å; F236-F468 HydrophobicContact CD1-CD2 4.03Å; F236-F468 HydrophobicContact CD1-CG 4.34Å; F236-F468 HydrophobicContact CE1-CB 4.21Å; F236-F468 AromaticContact CE1-CD2 3.77Å; F236-F468 HydrophobicContact CE1-CD2 3.77Å; F236-F468 HydrophobicContact CE1-CG 4.26Å; F236-F468 HydrophobicContact CZ-CD2 4.19Å
237	N	92.1	Very high	92.3	Very high	9 Å²	9	31.3 Å²	31.3	5%	0.048	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.6	125.5	174.7	-171.1	22.3	0	0	0	110.8	I239 Y450 N454 K457 F464 F468	N237-I239 PolarHBondContact O-N 3.2Å; N237-Y450 WeakPolarHBondContact ND2-CD1 3.35Å; N237-N454 PolarHBondContact ND2-OD1 3.41Å; N237-K457 WeakPolarHBondContact OD1-CD 3.41Å; N237-K457 PolarHBondContact OD1-NZ 3.24Å; N237-F464 HydrophobicContact CB-CE2 4.42Å; N237-F464 HydrophobicContact CB-CZ 4.5Å; N237-F464 WeakPolarHBondContact OD1-CE2 3.29Å; N237-F468 WeakPolarHBondContact CB-O 3.35Å; N237-F468 PolarHBondContact N-O 2.99Å
238	S	91.4	Very high	92.4	Very high	0 Å²	0	25.2 Å²	25.2	0%	0	14%	0.144	C	C	.	.			trans	-74.8	125.9	172.9	-79.1	0	0	0	0	110.9	N148 Y150 E151 T152 F236 K457	N148-S238 WeakPolarHBondContact O-CB 3.28Å; N148-S238 PolarHBondContact O-OG 3.44Å; Y150-S238 PolarHBondContact O-N 3.1Å; E151-S238 WeakPolarHBondContact CA-OG 3.2Å; E151-S238 PolarHBondContact N-OG 3.48Å; E151-S238 PolarHBondContact O-OG 3.49Å; T152-S238 PolarHBondContact N-OG 3.5Å; T152-S238 VanDerWaalsContact N-OG 3.12Å; T152-S238 PolarHBondContact OG1-OG 3.48Å; F236-S238 PolarHBondContact O-N 3.04Å; S238-K457 PolarHBondContact O-NZ 3.37Å
239	I	89.1	Confident	92.7	Very high	7 Å²	7	25.1 Å²	25.1	4%	0.036	14%	0.142	C	C	.	.			trans	-125.3	92.6	179.8	-52.9	167.9	0	0	0	109.8	F192 N237 G241 Q242 Y445 Y450 T471	F192-I239 HydrophobicContact CE1-CD1 4.34Å; N237-I239 PolarHBondContact O-N 3.2Å; I239-G241 PolarHBondContact O-N 3.36Å; I239-Q242 HydrophobicContact CB-CB 4.01Å; I239-Q242 HydrophobicContact CG2-CB 3.64Å; I239-Q242 HydrophobicContact CG2-CG 4.38Å; I239-Q242 PolarHBondContact O-N 3.01Å; I239-Q242 VanDerWaalsContact O-N 3.11Å; I239-Y445 HydrophobicContact CG2-CE2 3.51Å; I239-Y445 WeakPolarHBondContact CG2-OH 3.32Å; I239-Y450 WeakPolarHBondContact CA-OH 3.45Å; I239-Y450 HydrophobicContact CG1-CE1 4.07Å; I239-Y450 HydrophobicContact CG1-CE2 4.45Å; I239-Y450 HydrophobicContact CG2-CE1 4.43Å; I239-Y450 HydrophobicContact CG2-CE2 3.63Å; I239-Y450 VanDerWaalsContact CG2-OH 3.23Å; I239-Y450 WeakPolarHBondContact CG2-OH 3.33Å; I239-T471 HydrophobicContact CD1-CG2 3.36Å
240	P	88.4	Confident	93	Very high	54 Å²	54	20.3 Å²	20.3	35%	0.351	11%	0.113	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.1	128.1	-176.3	-25.4	35.3	0	0	0	111.9	Q242 Y267 C269 Y450	P240-Q242 VanDerWaalsContact C-N 3.32Å; P240-Y267 CarbonylContact C-O 3.57Å; P240-Y267 WeakPolarHBondContact CA-O 3.03Å; P240-C269 HydrophobicContact CB-CB 4.44Å; P240-Y450 WeakPolarHBondContact CD-OH 3.32Å
241	G	87.1	Confident	93.2	Very high	14 Å²	14	20.9 Å²	20.9	14%	0.144	11%	0.11	C	C	.	.	T	Hydrogen-bonded Turn	trans	85.8	-4.3	179	0	0	0	0	0	114.8	I239 Y267 C269	I239-G241 PolarHBondContact O-N 3.36Å; G241-Y267 PolarHBondContact N-O 3.28Å; G241-C269 PolarHBondContact N-SG 2.92Å; G241-C269 VanDerWaalsContact N-SG 3.4Å
242	Q	90.1	Very high	93.5	Very high	4 Å²	4	13.6 Å²	13.6	2%	0.019	8%	0.078	C	C	.	.			trans	-99.2	119.9	173.9	176.9	55.2	49	0	0	110.2	F192 L193 E195 I239 P240 V244 Y267 Y445	F192-Q242 HydrophobicContact CD1-CG 4.06Å; L193-Q242 PolarHBondContact O-NE2 3.08Å; E195-Q242 VanDerWaalsContact CG-OE1 3.25Å; I239-Q242 HydrophobicContact CB-CB 4.01Å; I239-Q242 HydrophobicContact CG2-CB 3.64Å; I239-Q242 HydrophobicContact CG2-CG 4.38Å; I239-Q242 PolarHBondContact O-N 3.01Å; I239-Q242 VanDerWaalsContact O-N 3.11Å; P240-Q242 VanDerWaalsContact C-N 3.32Å; Q242-V244 HydrophobicContact CG-CG2 4.28Å; Q242-Y267 WeakPolarHBondContact O-CA 3.37Å; Q242-Y445 HydrophobicContact CB-CE1 4.46Å; Q242-Y445 HydrophobicContact CB-CE2 3.9Å; Q242-Y445 WeakPolarHBondContact CB-OH 3.48Å
243	G	92.6	Very high	93.5	Very high	1 Å²	1	14.6 Å²	14.6	1%	0.01	9%	0.085	C	C	.	.			trans	-71.5	129.4	176.3	0	0	0	0	0	111.7	L193 Y267	L193-G243 PolarHBondContact N-O 2.88Å; G243-Y267 VanDerWaalsContact N-CD1 3.27Å
244	V	95.2	Very high	93.5	Very high	7 Å²	7	19.6 Å²	19.6	4%	0.042	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135	132	174.5	-169.5	0	0	0	0	109.2	Q190 Y191 F192 Q242 Y246 H265 T266	Q190-V244 HydrophobicContact CB-CG1 4.43Å; Y191-V244 WeakPolarHBondContact O-CA 3.39Å; F192-V244 HydrophobicContact CD1-CG2 3.65Å; F192-V244 HydrophobicContact CE1-CG1 4.47Å; F192-V244 HydrophobicContact CE1-CG2 3.67Å; F192-V244 HydrophobicContact CG-CG2 4.48Å; Q242-V244 HydrophobicContact CG-CG2 4.28Å; V244-Y246 HydrophobicContact CB-CE2 3.98Å; V244-Y246 HydrophobicContact CG1-CD1 4.47Å; V244-Y246 HydrophobicContact CG1-CD2 4.25Å; V244-Y246 HydrophobicContact CG1-CE1 3.97Å; V244-Y246 HydrophobicContact CG1-CE2 3.73Å; V244-H265 CarbonylContact O-C 3.57Å; V244-H265 VanDerWaalsContact O-CA 3.29Å; V244-H265 WeakPolarHBondContact O-CA 3.48Å; V244-T266 PolarHBondContact N-O 2.91Å; V244-T266 PolarHBondContact O-N 2.82Å
245	I	96.9	Very high	93.5	Very high	0 Å²	0	22.4 Å²	22.4	0%	0	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	123	172	-54.1	174.6	0	0	0	107.9	Q190 Y191 L193 L203 L207 V210 P263 A264 H265	Q190-I245 WeakPolarHBondContact CA-O 3.42Å; Y191-I245 HydrophobicContact CD1-CD1 4.14Å; Y191-I245 PolarHBondContact N-O 3.25Å; Y191-I245 PolarHBondContact O-N 3.5Å; L193-I245 HydrophobicContact CD2-CD1 4.09Å; L203-I245 HydrophobicContact CD1-CD1 4.41Å; L203-I245 HydrophobicContact CD1-CG1 4.49Å; L207-I245 HydrophobicContact CD2-CD1 4.03Å; L207-I245 HydrophobicContact CD2-CG2 4.07Å; L207-I245 HydrophobicContact CG-CD1 3.89Å; V210-I245 HydrophobicContact CG2-CB 4.46Å; V210-I245 HydrophobicContact CG2-CD1 4.18Å; V210-I245 HydrophobicContact CG2-CG2 3.85Å; I245-P263 HydrophobicContact CG2-CB 3.79Å; I245-A264 WeakPolarHBondContact CA-O 3.32Å; I245-H265 HydrophobicContact CG1-CB 3.95Å
246	Y	96.9	Very high	93.6	Very high	5 Å²	5	28 Å²	28	2%	0.02	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	142.4	173.4	-63.1	-80.5	0	0	0	109.9	I145 T152 V154 Q190 F236 V244 P263 A264 T266	I145-Y246 HydrophobicContact CD1-CD2 3.72Å; I145-Y246 HydrophobicContact CG1-CD2 4.39Å; T152-Y246 HydrophobicContact CG2-CE2 3.95Å; V154-Y246 HydrophobicContact CG2-CD1 3.77Å; V154-Y246 HydrophobicContact CG2-CD2 3.87Å; V154-Y246 HydrophobicContact CG2-CE1 4.11Å; V154-Y246 HydrophobicContact CG2-CE2 4.2Å; V154-Y246 HydrophobicContact CG2-CG 3.62Å; Q190-Y246 HydrophobicContact CB-CD1 4.18Å; Q190-Y246 HydrophobicContact CB-CE1 4.15Å; F236-Y246 HydrophobicContact CB-CE1 4.19Å; F236-Y246 WeakPolarHBondContact CB-OH 3.47Å; F236-Y246 AromaticContact CD1-CE1 3.67Å; F236-Y246 HydrophobicContact CD1-CE1 3.67Å; F236-Y246 HydrophobicContact CD2-CD1 4.23Å; F236-Y246 AromaticContact CD2-CE1 3.62Å; F236-Y246 HydrophobicContact CD2-CE1 3.62Å; F236-Y246 HydrophobicContact CE1-CD1 4.39Å; F236-Y246 AromaticContact CE1-CE1 3.86Å; F236-Y246 HydrophobicContact CE1-CE1 3.86Å; F236-Y246 HydrophobicContact CE2-CD1 4.02Å; F236-Y246 AromaticContact CE2-CE1 3.82Å; F236-Y246 HydrophobicContact CE2-CE1 3.82Å; F236-Y246 AromaticContact CG-CE1 3.55Å; F236-Y246 HydrophobicContact CG-CE1 3.55Å; F236-Y246 AromaticContact CG-CZ 3.94Å; F236-Y246 HydrophobicContact CZ-CD1 4.11Å; F236-Y246 AromaticContact CZ-CE1 3.94Å; F236-Y246 HydrophobicContact CZ-CE1 3.94Å; V244-Y246 HydrophobicContact CB-CE2 3.98Å; V244-Y246 HydrophobicContact CG1-CD1 4.47Å; V244-Y246 HydrophobicContact CG1-CD2 4.25Å; V244-Y246 HydrophobicContact CG1-CE1 3.97Å; V244-Y246 HydrophobicContact CG1-CE2 3.73Å; Y246-P263 CarbonylContact O-C 3.48Å; Y246-P263 VanDerWaalsContact O-CA 3.31Å; Y246-P263 WeakPolarHBondContact O-CA 3.34Å; Y246-A264 PolarHBondContact N-O 3.19Å; Y246-A264 PolarHBondContact O-N 3.34Å; Y246-T266 HydrophobicContact CE2-CG2 3.97Å
247	S	95.8	Very high	93.6	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.4	158.9	176.6	-175.3	0	0	0	0	110.2	Y189 M216	Y189-S247 PolarHBondContact N-O 2.84Å; Y189-S247 PolarHBondContact O-N 2.83Å; Y189-S247 VanDerWaalsContact O-N 3.17Å; M216-S247 WeakPolarHBondContact CE-OG 3.31Å
248	V	97.2	Very high	93.8	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	131.7	-178.5	-176.8	0	0	0	0	107.9	V143 F156 Y186 D187 V188 Y261	V143-V248 HydrophobicContact CG2-CG2 4.06Å; F156-V248 HydrophobicContact CD1-CG2 3.67Å; F156-V248 HydrophobicContact CD2-CG1 4.26Å; F156-V248 HydrophobicContact CE1-CG1 4.22Å; F156-V248 HydrophobicContact CE1-CG2 3.79Å; F156-V248 HydrophobicContact CE2-CG1 3.95Å; F156-V248 HydrophobicContact CG-CG2 4.11Å; F156-V248 HydrophobicContact CZ-CG1 3.92Å; F156-V248 HydrophobicContact CZ-CG2 4.34Å; Y186-V248 HydrophobicContact CD1-CG1 4.21Å; D187-V248 WeakPolarHBondContact O-CA 3.42Å; V188-V248 HydrophobicContact CG2-CG2 4.32Å; V248-Y261 HydrophobicContact CB-CD2 3.8Å; V248-Y261 HydrophobicContact CB-CE2 4.48Å; V248-Y261 HydrophobicContact CB-CG 4.07Å; V248-Y261 HydrophobicContact CG1-CD2 3.89Å; V248-Y261 HydrophobicContact CG1-CE2 4.13Å; V248-Y261 WeakPolarHBondContact O-CB 3.26Å; V248-Y261 WeakPolarHBondContact O-CD2 3.26Å; V248-Y261 PolarHBondContact O-N 2.82Å
249	I	97.4	Very high	94.1	Very high	7 Å²	7	30.8 Å²	30.8	4%	0.036	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	120.4	171.3	-61.2	179.5	0	0	0	107.3	Y186 D187 Y189 T213 M216 A259	Y186-I249 WeakPolarHBondContact CA-O 3.42Å; D187-I249 HydrophobicContact CB-CB 4.42Å; D187-I249 PolarHBondContact N-O 3.02Å; D187-I249 PolarHBondContact O-N 2.99Å; Y189-I249 HydrophobicContact CD2-CD1 4.09Å; Y189-I249 HydrophobicContact CD2-CG1 4.19Å; Y189-I249 HydrophobicContact CE2-CB 4.28Å; Y189-I249 HydrophobicContact CE2-CD1 3.66Å; Y189-I249 HydrophobicContact CE2-CG1 4.05Å; T213-I249 HydrophobicContact CG2-CD1 4.27Å; T213-I249 HydrophobicContact CG2-CG1 4.39Å; T213-I249 HydrophobicContact CG2-CG2 4Å; M216-I249 HydrophobicContact CB-CD1 3.95Å; M216-I249 HydrophobicContact CG-CD1 3.91Å; I249-A259 WeakPolarHBondContact CA-O 2.79Å
250	V	97.2	Very high	94.4	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	133.6	169.2	51.4	0	0	0	0	109.4	P126 P128 A159 L184 E185 Y186 S258 A259 Y261	P126-V250 HydrophobicContact CB-CG1 4.12Å; P126-V250 HydrophobicContact CB-CG2 3.87Å; P126-V250 HydrophobicContact CG-CB 4.38Å; P126-V250 HydrophobicContact CG-CG1 3.86Å; P126-V250 HydrophobicContact CG-CG2 3.95Å; P128-V250 HydrophobicContact CG-CG1 4.09Å; A159-V250 HydrophobicContact CB-CB 4.16Å; A159-V250 HydrophobicContact CB-CG1 4.16Å; A159-V250 HydrophobicContact CB-CG2 3.73Å; L184-V250 HydrophobicContact CB-CG2 4.07Å; L184-V250 HydrophobicContact CD1-CG2 4.07Å; L184-V250 HydrophobicContact CD2-CG2 4.29Å; L184-V250 HydrophobicContact CG-CG2 4.37Å; E185-V250 WeakPolarHBondContact O-CA 3.37Å; Y186-V250 HydrophobicContact CD1-CB 4.02Å; Y186-V250 HydrophobicContact CD1-CG2 4.25Å; Y186-V250 HydrophobicContact CE1-CB 4.13Å; Y186-V250 HydrophobicContact CE1-CG2 4.02Å; V250-S258 CarbonylContact O-C 3.34Å; V250-S258 WeakPolarHBondContact O-CA 3.04Å; V250-S258 VanDerWaalsContact O-CB 3.29Å; V250-S258 WeakPolarHBondContact O-CB 3.45Å; V250-A259 HydrophobicContact CG1-CB 4.12Å; V250-A259 WeakPolarHBondContact CG1-O 3.38Å; V250-A259 PolarHBondContact N-O 3.45Å; V250-A259 PolarHBondContact O-N 3.01Å; V250-Y261 HydrophobicContact CB-CE2 4.04Å; V250-Y261 HydrophobicContact CG1-CD2 4.45Å; V250-Y261 HydrophobicContact CG1-CE2 3.93Å
251	R	96.2	Very high	94.8	Very high	80 Å²	80	27.9 Å²	27.9	30%	0.302	15%	0.151	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	135.3	-179.7	-168.1	176	72.2	105.1	-0.9	110.6	E185 P253	E185-R251 PolarHBondContact N-O 3.49Å; E185-R251 VanDerWaalsContact N-O 3.11Å; E185-R251 PolarHBondContact O-N 3.39Å; E185-R251 IonicContact OE2-CZ 3.6Å; E185-R251 IonicContact OE2-NE 3.78Å; E185-R251 IonicContact OE2-NH2 2.66Å; E185-R251 PolarHBondContact OE2-NH2 2.78Å; R251-P253 WeakPolarHBondContact O-CD 3.45Å
252	D	95.4	Very high	95.3	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96	107.4	166.9	-169.1	-34.5	0	0	0	109.3	R183 L184 M254 L255 N256 T257	R183-D252 IonicContact CZ-OD1 3.78Å; R183-D252 IonicContact CZ-OD2 3.2Å; R183-D252 VanDerWaalsContact CZ-OD2 3.24Å; R183-D252 IonicContact NE-OD1 3.08Å; R183-D252 PolarHBondContact NE-OD1 3.16Å; R183-D252 VanDerWaalsContact NE-OD1 3.11Å; R183-D252 IonicContact NE-OD2 2.75Å; R183-D252 PolarHBondContact NE-OD2 2.84Å; R183-D252 IonicContact NH2-OD1 3.95Å; R183-D252 IonicContact NH2-OD2 3.73Å; R183-D252 PolarHBondContact NH2-OD2 3.17Å; L184-D252 HydrophobicContact CD2-CB 3.84Å; D252-M254 PolarHBondContact O-N 2.65Å; D252-M254 WeakPolarHBondContact OD1-CB 3.35Å; D252-M254 PolarHBondContact OD1-N 2.84Å; D252-L255 HydrophobicContact CB-CB 4.3Å; D252-L255 PolarHBondContact O-N 3.42Å; D252-L255 PolarHBondContact OD1-N 2.86Å; D252-N256 VanDerWaalsContact O-CA 3.28Å; D252-N256 WeakPolarHBondContact O-CA 3.39Å; D252-N256 PolarHBondContact O-N 3.23Å; D252-T257 PolarHBondContact N-O 3.04Å
253	P	93.4	Very high	95.6	Very high	54 Å²	54	27.1 Å²	27.1	35%	0.351	14%	0.143	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.9	-18.8	-178.2	28	-34.6	0	0	0	113.3	R183 R251	R183-P253 VanDerWaalsContact O-CD 3.29Å; R183-P253 WeakPolarHBondContact O-CD 3.45Å; R183-P253 VanDerWaalsContact O-CG 3.28Å; R183-P253 WeakPolarHBondContact O-CG 3.48Å; R251-P253 WeakPolarHBondContact O-CD 3.45Å
254	M	93.3	Very high	95.8	Very high	126 Å²	126	27.3 Å²	27.3	62%	0.621	15%	0.145	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83.6	-40.6	178.5	-67	-168.6	70.4	0	0	112.2	R183 D252	R183-M254 PolarHBondContact NH1-SD 3.01Å; D252-M254 PolarHBondContact O-N 2.65Å; D252-M254 WeakPolarHBondContact OD1-CB 3.35Å; D252-M254 PolarHBondContact OD1-N 2.84Å
255	L	91.7	Very high	95.8	Very high	86 Å²	86	27.7 Å²	27.7	45%	0.45	15%	0.146	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.4	-11	-180	-61.8	179.6	0	0	0	113	D252 T257	D252-L255 HydrophobicContact CB-CB 4.3Å; D252-L255 PolarHBondContact O-N 3.42Å; D252-L255 PolarHBondContact OD1-N 2.86Å; L255-T257 HydrophobicContact CB-CG2 4.32Å; L255-T257 PolarHBondContact O-N 2.62Å
256	N	94.3	Very high	95.7	Very high	131 Å²	131	28.4 Å²	28.4	70%	0.701	15%	0.15	S	C	*	.	T	Hydrogen-bonded Turn	trans	53.4	38.9	-175	-163	34.1	0	0	0	112.9	D252	D252-N256 VanDerWaalsContact O-CA 3.28Å; D252-N256 WeakPolarHBondContact O-CA 3.39Å; D252-N256 PolarHBondContact O-N 3.23Å
257	T	94.9	Very high	95.6	Very high	27 Å²	27	28.4 Å²	28.4	17%	0.166	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	155.6	178.9	50.7	0	0	0	0	109.7	T124 D252 L255	T124-T257 WeakPolarHBondContact O-CB 3.34Å; T124-T257 PolarHBondContact O-OG1 3.05Å; D252-T257 PolarHBondContact N-O 3.04Å; L255-T257 HydrophobicContact CB-CG2 4.32Å; L255-T257 PolarHBondContact O-N 2.62Å
258	S	96.4	Very high	95.4	Very high	43 Å²	43	28.9 Å²	28.9	30%	0.301	15%	0.154	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-144	154.7	179.6	60.1	0	0	0	0	112.1	V250	V250-S258 CarbonylContact O-C 3.34Å; V250-S258 WeakPolarHBondContact O-CA 3.04Å; V250-S258 VanDerWaalsContact O-CB 3.29Å; V250-S258 WeakPolarHBondContact O-CB 3.45Å
259	A	96.3	Very high	95	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	146.9	173	0	0	0	0	0	109.9	Y121 P126 P128 I249 V250	Y121-A259 HydrophobicContact CD1-CB 3.87Å; Y121-A259 HydrophobicContact CE1-CB 3.77Å; Y121-A259 HydrophobicContact CG-CB 4.47Å; P126-A259 HydrophobicContact CG-CB 4.33Å; P126-A259 WeakPolarHBondContact O-CB 3.49Å; P128-A259 HydrophobicContact CG-CB 3.83Å; I249-A259 WeakPolarHBondContact CA-O 2.79Å; V250-A259 HydrophobicContact CG1-CB 4.12Å; V250-A259 WeakPolarHBondContact CG1-O 3.38Å; V250-A259 PolarHBondContact N-O 3.45Å; V250-A259 PolarHBondContact O-N 3.01Å
260	S	95.7	Very high	94.6	Very high	0 Å²	0	31 Å²	31	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	136.4	177.8	-166.9	0	0	0	0	110.1	Y121	Y121-S260 WeakPolarHBondContact OH-CB 3.37Å; Y121-S260 PolarHBondContact OH-N 2.03Å; Y121-S260 PolarHBondContact OH-O 2.98Å
261	Y	96.9	Very high	94.2	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	18%	0.181	C	C	.	.	P	Polyproline II helix	trans	-67	161.6	157.8	-75.6	-106.2	0	0	0	109.8	P128 G129 P141 V143 F156 G157 A159 Y186 V248 V250	P128-Y261 HydrophobicContact CB-CD1 3.91Å; P128-Y261 HydrophobicContact CB-CD2 3.82Å; P128-Y261 HydrophobicContact CB-CE1 3.84Å; P128-Y261 HydrophobicContact CB-CE2 3.75Å; P128-Y261 HydrophobicContact CB-CG 3.89Å; P128-Y261 HydrophobicContact CG-CD2 4.4Å; P128-Y261 HydrophobicContact CG-CE2 4.48Å; G129-Y261 PolarHBondContact N-OH 3.33Å; P141-Y261 WeakPolarHBondContact O-CA 3.39Å; P141-Y261 WeakPolarHBondContact O-CB 3.43Å; P141-Y261 WeakPolarHBondContact O-CD1 3.15Å; V143-Y261 HydrophobicContact CG2-CG 4.49Å; F156-Y261 HydrophobicContact CB-CD1 4.2Å; F156-Y261 HydrophobicContact CB-CE1 4.11Å; F156-Y261 HydrophobicContact CD2-CE1 4.09Å; F156-Y261 HydrophobicContact CD2-CE2 4.47Å; F156-Y261 AromaticContact CD2-CZ 3.96Å; G157-Y261 VanDerWaalsContact O-CE1 3.29Å; G157-Y261 WeakPolarHBondContact O-CE1 3Å; G157-Y261 PolarHBondContact O-OH 3.45Å; A159-Y261 WeakPolarHBondContact CB-OH 3.34Å; A159-Y261 PolarHBondContact N-OH 2.7Å; Y186-Y261 HydrophobicContact CD1-CE2 4.2Å; Y186-Y261 HydrophobicContact CE1-CE2 4.32Å; V248-Y261 HydrophobicContact CB-CD2 3.8Å; V248-Y261 HydrophobicContact CB-CE2 4.48Å; V248-Y261 HydrophobicContact CB-CG 4.07Å; V248-Y261 HydrophobicContact CG1-CD2 3.89Å; V248-Y261 HydrophobicContact CG1-CE2 4.13Å; V248-Y261 WeakPolarHBondContact O-CB 3.26Å; V248-Y261 WeakPolarHBondContact O-CD2 3.26Å; V248-Y261 PolarHBondContact O-N 2.82Å; V250-Y261 HydrophobicContact CB-CE2 4.04Å; V250-Y261 HydrophobicContact CG1-CD2 4.45Å; V250-Y261 HydrophobicContact CG1-CE2 3.93Å
262	V	96.8	Very high	93.6	Very high	1 Å²	1	34.9 Å²	34.9	1%	0.006	20%	0.198	C	C	.	.	B	Isolated β-bridge	trans	-67	120	172.9	-174.9	0	0	0	0	107.7	T58 Q60 P141 V143	T58-V262 HydrophobicContact CG2-CG2 3.81Å; Q60-V262 HydrophobicContact CB-CG1 4.15Å; Q60-V262 HydrophobicContact CG-CB 4.43Å; Q60-V262 HydrophobicContact CG-CG1 3.9Å; Q60-V262 HydrophobicContact CG-CG2 4Å; P141-V262 HydrophobicContact CB-CG2 4.04Å; P141-V262 HydrophobicContact CG-CG2 3.93Å; P141-V262 WeakPolarHBondContact O-CG2 3.41Å; P141-V262 PolarHBondContact O-N 3.36Å; V143-V262 WeakPolarHBondContact CG2-O 3.18Å; V143-V262 PolarHBondContact N-O 3.36Å
263	P	96.8	Very high	92.9	Very high	1 Å²	1	37.2 Å²	37.2	1%	0.006	21%	0.214	C	C	.	.	P	Polyproline II helix	trans	-65.4	148.9	178.7	28.9	-33.7	0	0	0	110	H62 L207 I245 Y246	H62-P263 PolarHBondContact CE1-O 2.89Å; H62-P263 VanDerWaalsContact CE1-O 3.24Å; L207-P263 HydrophobicContact CD2-CB 4.25Å; L207-P263 HydrophobicContact CD2-CG 3.92Å; I245-P263 HydrophobicContact CG2-CB 3.79Å; Y246-P263 CarbonylContact O-C 3.48Å; Y246-P263 VanDerWaalsContact O-CA 3.31Å; Y246-P263 WeakPolarHBondContact O-CA 3.34Å
264	A	96.6	Very high	91.7	Very high	5 Å²	5	41 Å²	41	4%	0.041	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	144.9	174.9	0	0	0	0	0	109.6	D86 V143 I145 I245 Y246	D86-A264 HydrophobicContact CB-CB 4.25Å; D86-A264 WeakPolarHBondContact OD2-CA 3.44Å; V143-A264 HydrophobicContact CB-CB 4.09Å; V143-A264 HydrophobicContact CG1-CB 4.29Å; V143-A264 WeakPolarHBondContact O-CB 3.23Å; I145-A264 HydrophobicContact CD1-CB 3.42Å; I145-A264 VanDerWaalsContact CD1-CB 3.42Å; I145-A264 WeakPolarHBondContact CD1-O 3.5Å; I145-A264 HydrophobicContact CG1-CB 3.84Å; I245-A264 WeakPolarHBondContact CA-O 3.32Å; Y246-A264 PolarHBondContact N-O 3.19Å; Y246-A264 PolarHBondContact O-N 3.34Å
265	H	96.3	Very high	90.1	Very high	16 Å²	16	42 Å²	42	7%	0.074	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	157.4	-176.9	79.6	-79.5	0	0	0	112.1	T63 L64 D86 L203 V244 I245 Y267	T63-H265 PolarHBondContact O-CE1 3.15Å; L64-H265 PolarHBondContact O-NE2 3.14Å; L64-H265 VanDerWaalsContact O-NE2 3.13Å; D86-H265 IonicContact OD1-CE1 3.52Å; D86-H265 IonicContact OD1-ND1 2.9Å; D86-H265 PolarHBondContact OD1-ND1 2.83Å; D86-H265 IonicContact OD2-CE1 3.55Å; D86-H265 IonicContact OD2-CG 3.68Å; D86-H265 PolarHBondContact OD2-N 2.78Å; D86-H265 IonicContact OD2-ND1 2.82Å; D86-H265 PolarHBondContact OD2-ND1 2.84Å; L203-H265 HydrophobicContact CD1-CB 3.81Å; L203-H265 WeakPolarHBondContact CD2-NE2 3.42Å; V244-H265 CarbonylContact O-C 3.57Å; V244-H265 VanDerWaalsContact O-CA 3.29Å; V244-H265 WeakPolarHBondContact O-CA 3.48Å; I245-H265 HydrophobicContact CG1-CB 3.95Å; H265-Y267 AromaticContact CD2-CE2 3.93Å
266	T	95.1	Very high	88.9	Confident	14 Å²	14	42.3 Å²	42.3	9%	0.086	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.1	153.9	172.4	-171	0	0	0	0	110.9	I145 T152 V244 Y246 A268	I145-T266 HydrophobicContact CD1-CG2 4.42Å; I145-T266 HydrophobicContact CG2-CG2 3.93Å; T152-T266 HydrophobicContact CG2-CG2 4.04Å; V244-T266 PolarHBondContact N-O 2.91Å; V244-T266 PolarHBondContact O-N 2.82Å; Y246-T266 HydrophobicContact CE2-CG2 3.97Å; T266-A268 PolarHBondContact OG1-N 2.94Å
267	Y	93	Very high	88.4	Confident	5 Å²	5	36.4 Å²	36.4	2%	0.02	22%	0.216	C	C	.	.			trans	-107.9	7.4	167.7	-68.8	-96.8	0	0	0	111.9	L64 L193 L198 P240 G241 Q242 G243 H265 C269 F271	L64-Y267 HydrophobicContact CD1-CE2 4Å; L193-Y267 HydrophobicContact CD1-CE1 4.5Å; L193-Y267 WeakPolarHBondContact CD1-OH 3.45Å; L198-Y267 HydrophobicContact CD2-CD1 3.32Å; L198-Y267 HydrophobicContact CD2-CE1 3.47Å; L198-Y267 VanDerWaalsContact CD2-CE1 3.47Å; L198-Y267 HydrophobicContact CD2-CG 4.16Å; P240-Y267 CarbonylContact C-O 3.57Å; P240-Y267 WeakPolarHBondContact CA-O 3.03Å; G241-Y267 PolarHBondContact N-O 3.28Å; Q242-Y267 WeakPolarHBondContact O-CA 3.37Å; G243-Y267 VanDerWaalsContact N-CD1 3.27Å; H265-Y267 AromaticContact CD2-CE2 3.93Å; Y267-C269 VanDerWaalsContact CB-SG 3.56Å; Y267-C269 PolarHBondContact O-N 3.1Å; Y267-C269 PolarHBondContact O-SG 3.27Å; Y267-F271 HydrophobicContact CD1-CZ 4.44Å; Y267-F271 AromaticContact CD2-CE2 3.51Å; Y267-F271 HydrophobicContact CD2-CE2 3.51Å; Y267-F271 AromaticContact CD2-CZ 3.55Å; Y267-F271 HydrophobicContact CD2-CZ 3.55Å; Y267-F271 HydrophobicContact CE2-CE2 4.1Å; Y267-F271 AromaticContact CE2-CZ 3.8Å; Y267-F271 HydrophobicContact CE2-CZ 3.8Å; Y267-F271 AromaticContact CG-CE2 4Å; Y267-F271 HydrophobicContact CG-CE2 4Å; Y267-F271 AromaticContact CG-CZ 3.89Å; Y267-F271 HydrophobicContact CG-CZ 3.89Å
268	A	91.8	Very high	87.9	Confident	10 Å²	10	35.7 Å²	35.7	8%	0.083	21%	0.212	C	C	.	.	S	Bend	trans	50.5	29.7	-174.2	0	0	0	0	0	114.1	Y147 T266	Y147-A268 HydrophobicContact CD2-CB 4.27Å; Y147-A268 HydrophobicContact CG-CB 4.37Å; T266-A268 PolarHBondContact OG1-N 2.94Å
269	C	90.5	Very high	87.1	Confident	17 Å²	17	41.4 Å²	41.4	12%	0.115	23%	0.234	C	C	.	.	S	Bend	trans	-153.6	164.4	178.4	54.1	0	0	0	0	109.7	Y147 P240 G241 Y267 C278	Y147-C269 PolarHBondContact OH-O 3.35Å; Y147-C269 VanDerWaalsContact OH-O 3.05Å; P240-C269 HydrophobicContact CB-CB 4.44Å; G241-C269 PolarHBondContact N-SG 2.92Å; G241-C269 VanDerWaalsContact N-SG 3.4Å; Y267-C269 VanDerWaalsContact CB-SG 3.56Å; Y267-C269 PolarHBondContact O-N 3.1Å; Y267-C269 PolarHBondContact O-SG 3.27Å; C269-C278 HydrophobicContact CB-CB 4.06Å; C269-C278 WeakPolarHBondContact CB-SG 3.44Å; C269-C278 PolarHBondContact O-SG 3.02Å; C269-C278 WeakPolarHBondContact SG-CA 3.37Å; C269-C278 WeakPolarHBondContact SG-CB 3.24Å; C269-C278 CovalentContact SG-SG 2.02Å; C269-C278 PolarHBondContact SG-SG 3.07Å
270	S	88.9	Confident	86.1	Confident	34 Å²	34	44.5 Å²	44.5	24%	0.238	25%	0.253	C	S	.	.	B	Isolated β-bridge	trans	-94.4	137.3	177.6	170	0	0	0	0	111.3	T272 S273 G277 C278	S270-T272 PolarHBondContact OG-N 3.14Å; S270-T272 VanDerWaalsContact OG-N 3.12Å; S270-T272 PolarHBondContact OG-OG1 2.93Å; S270-S273 PolarHBondContact OG-N 3.48Å; S270-S273 VanDerWaalsContact OG-N 3.07Å; S270-G277 CarbonylContact O-C 3.54Å; S270-G277 WeakPolarHBondContact O-CA 2.79Å; S270-C278 PolarHBondContact O-N 3.13Å
271	F	87.6	Confident	85	Confident	53 Å²	53	47.7 Å²	47.7	23%	0.232	27%	0.27	C	S	.	.	S	Bend	trans	-81.2	-19.1	171	-75.1	-92.9	0	0	0	113.2	L64 H65 L198 Y267 C278	L64-F271 HydrophobicContact CD1-CE1 4.37Å; L64-F271 HydrophobicContact CD1-CZ 4Å; L64-F271 HydrophobicContact CD2-CE1 4.28Å; L64-F271 HydrophobicContact CG-CE1 4.39Å; L64-F271 HydrophobicContact CG-CZ 4.35Å; H65-F271 HydrophobicContact CB-CB 3.78Å; H65-F271 HydrophobicContact CB-CD2 3.7Å; H65-F271 HydrophobicContact CB-CG 3.87Å; L198-F271 HydrophobicContact CB-CE1 4.1Å; L198-F271 HydrophobicContact CD1-CE1 4.46Å; L198-F271 HydrophobicContact CD2-CZ 4.34Å; Y267-F271 HydrophobicContact CD1-CZ 4.44Å; Y267-F271 AromaticContact CD2-CE2 3.51Å; Y267-F271 HydrophobicContact CD2-CE2 3.51Å; Y267-F271 AromaticContact CD2-CZ 3.55Å; Y267-F271 HydrophobicContact CD2-CZ 3.55Å; Y267-F271 HydrophobicContact CE2-CE2 4.1Å; Y267-F271 AromaticContact CE2-CZ 3.8Å; Y267-F271 HydrophobicContact CE2-CZ 3.8Å; Y267-F271 AromaticContact CG-CE2 4Å; Y267-F271 HydrophobicContact CG-CE2 4Å; Y267-F271 AromaticContact CG-CZ 3.89Å; Y267-F271 HydrophobicContact CG-CZ 3.89Å; F271-C278 HydrophobicContact CD1-CB 4.37Å; F271-C278 HydrophobicContact CE1-CB 4.29Å; F271-C278 HydrophobicContact CZ-CB 4.4Å
272	T	84.1	Confident	84	Confident	110 Å²	110	50 Å²	50	68%	0.675	29%	0.294	S	S	*	.	S	Bend	trans	-97	-22.7	-175.5	55	0	0	0	0	113	S270 T274	S270-T272 PolarHBondContact OG-N 3.14Å; S270-T272 VanDerWaalsContact OG-N 3.12Å; S270-T272 PolarHBondContact OG-OG1 2.93Å; T272-T274 PolarHBondContact O-N 2.85Å
273	S	80.9	Confident	83.3	Confident	48 Å²	48	52.8 Å²	52.8	34%	0.336	31%	0.306	S	S	.	.			trans	-67.2	127.7	178.9	-177	0	0	0	0	111.8	S270 D276 G277	S270-S273 PolarHBondContact OG-N 3.48Å; S270-S273 VanDerWaalsContact OG-N 3.07Å; S273-D276 PolarHBondContact OG-N 3.22Å; S273-G277 WeakPolarHBondContact O-CA 3.47Å
274	T	67	Low	82.9	Confident	135 Å²	135	59 Å²	59	83%	0.828	34%	0.337	S	S	*	.	S	Bend	trans	-85.3	-19.6	178	53.3	0	0	0	0	113.7	T272	T272-T274 PolarHBondContact O-N 2.85Å
275	L	61	Low	82.6	Confident	146 Å²	146	60.1 Å²	60.1	76%	0.764	35%	0.345	S	S	*	.	S	Bend	trans	-98.1	-40.1	-175.7	-70.5	171.7	0	0	0	113.3
276	D	67	Low	82.3	Confident	92 Å²	92	60.5 Å²	60.5	49%	0.492	35%	0.349	S	S	.	.	S	Bend	trans	-136.7	61.5	-179	-75	-39.2	0	0	0	108.7	S273 K283	S273-D276 PolarHBondContact OG-N 3.22Å; D276-K283 WeakPolarHBondContact OD1-CE 3.29Å
277	G	82	Confident	82.2	Confident	8 Å²	8	62.2 Å²	62.2	8%	0.082	36%	0.355	C	S	.	.	B	Isolated β-bridge	trans	-90.6	166.6	-178.2	0	0	0	0	0	113.4	S270 S273 Q279 T280	S270-G277 CarbonylContact O-C 3.54Å; S270-G277 WeakPolarHBondContact O-CA 2.79Å; S273-G277 WeakPolarHBondContact O-CA 3.47Å; G277-Q279 PolarHBondContact O-N 2.65Å; G277-T280 PolarHBondContact N-OG1 3.46Å; G277-T280 VanDerWaalsContact N-OG1 3.15Å; G277-T280 PolarHBondContact O-N 3.24Å; G277-T280 PolarHBondContact O-OG1 3.45Å
278	C	84.8	Confident	82.2	Confident	11 Å²	11	66.3 Å²	66.3	7%	0.074	38%	0.376	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.2	-27.7	176.3	-67	0	0	0	0	113.6	L198 C269 S270 F271 T280	L198-C278 HydrophobicContact CD1-CB 3.92Å; L198-C278 HydrophobicContact CD2-CB 4.49Å; C269-C278 HydrophobicContact CB-CB 4.06Å; C269-C278 WeakPolarHBondContact CB-SG 3.44Å; C269-C278 PolarHBondContact O-SG 3.02Å; C269-C278 WeakPolarHBondContact SG-CA 3.37Å; C269-C278 WeakPolarHBondContact SG-CB 3.24Å; C269-C278 CovalentContact SG-SG 2.02Å; C269-C278 PolarHBondContact SG-SG 3.07Å; S270-C278 PolarHBondContact O-N 3.13Å; F271-C278 HydrophobicContact CD1-CB 4.37Å; F271-C278 HydrophobicContact CE1-CB 4.29Å; F271-C278 HydrophobicContact CZ-CB 4.4Å; C278-T280 VanDerWaalsContact C-N 3.3Å; C278-T280 PolarHBondContact O-N 3.21Å
279	Q	80.9	Confident	82.4	Confident	163 Å²	163	67.8 Å²	67.8	76%	0.762	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.6	-16.1	179.2	-62.6	-179.3	-3.8	0	0	113	L198 G277	L198-Q279 HydrophobicContact CD1-CG 4.29Å; G277-Q279 PolarHBondContact O-N 2.65Å
280	T	74.9	Confident	82.6	Confident	65 Å²	65	69.5 Å²	69.5	40%	0.399	39%	0.386	S	S	.	.	S	Bend	trans	-92.9	102.9	178	54.3	0	0	0	0	110.1	G277 C278 G282	G277-T280 PolarHBondContact N-OG1 3.46Å; G277-T280 VanDerWaalsContact N-OG1 3.15Å; G277-T280 PolarHBondContact O-N 3.24Å; G277-T280 PolarHBondContact O-OG1 3.45Å; C278-T280 VanDerWaalsContact C-N 3.3Å; C278-T280 PolarHBondContact O-N 3.21Å; T280-G282 PolarHBondContact O-N 2.87Å
281	L	71.2	Confident	82.9	Confident	68 Å²	68	69.7 Å²	69.7	36%	0.356	39%	0.386	S	S	.	.			trans	-69.2	78.3	170.5	-76.8	109.1	0	0	0	110.6	K287	L281-K287 WeakPolarHBondContact O-CE 3.46Å; L281-K287 PolarHBondContact O-NZ 2.91Å
282	G	75.9	Confident	83.3	Confident	48 Å²	48	72.4 Å²	72.4	50%	0.495	40%	0.402	S	S	.	.	S	Bend	trans	68	170.3	177.2	0	0	0	0	0	115.4	T280	T280-G282 PolarHBondContact O-N 2.87Å
283	K	83.8	Confident	83.9	Confident	60 Å²	60	68.5 Å²	68.5	26%	0.261	38%	0.381	S	S	.	.			trans	-73.6	150.5	-177.6	-65	-172	174.8	-167.3	0	112	D276 S285 T286 K287 Y336	D276-K283 WeakPolarHBondContact OD1-CE 3.29Å; K283-S285 PolarHBondContact O-N 3.48Å; K283-T286 WeakPolarHBondContact O-CB 3.32Å; K283-T286 PolarHBondContact O-N 3.45Å; K283-T286 VanDerWaalsContact O-N 3.11Å; K283-K287 PolarHBondContact O-N 3.45Å; K283-K287 VanDerWaalsContact O-N 3.16Å; K283-Y336 HydrophobicContact CB-CE1 4.49Å; K283-Y336 HydrophobicContact CD-CD1 3.73Å; K283-Y336 HydrophobicContact CD-CE1 4.28Å; K283-Y336 HydrophobicContact CD-CG 4.41Å
284	I	88.4	Confident	84.6	Confident	130 Å²	130	66.4 Å²	66.4	67%	0.667	37%	0.367	S	S	*	.	H	α-helix	trans	-58.4	-38.6	177.7	-63.9	169.7	0	0	0	110.9	T286 K287 I288	I284-T286 VanDerWaalsContact C-N 3.33Å; I284-T286 PolarHBondContact O-N 2.93Å; I284-K287 WeakPolarHBondContact O-CB 3.24Å; I284-K287 PolarHBondContact O-N 2.97Å; I284-I288 HydrophobicContact CG2-CD1 3.82Å; I284-I288 HydrophobicContact CG2-CG1 4.34Å; I284-I288 WeakPolarHBondContact O-CG1 3.42Å; I284-I288 PolarHBondContact O-N 2.8Å
285	S	89.6	Confident	86	Confident	30 Å²	30	65.9 Å²	65.9	21%	0.21	36%	0.359	C	S	.	.	H	α-helix	trans	-57.1	-44.8	175.9	55.1	0	0	0	0	112.2	K283 I288 F289 D337	K283-S285 PolarHBondContact O-N 3.48Å; S285-I288 PolarHBondContact O-N 2.78Å; S285-F289 WeakPolarHBondContact O-CB 3.2Å; S285-F289 PolarHBondContact O-N 2.91Å; S285-D337 VanDerWaalsContact CB-OD1 3.26Å; S285-D337 WeakPolarHBondContact CB-OD1 3.21Å; S285-D337 PolarHBondContact OG-OD1 3.45Å
286	T	90	Very high	87.7	Confident	24 Å²	24	60.6 Å²	60.6	15%	0.147	34%	0.336	C	S	.	.	H	α-helix	trans	-62.2	-42.5	175.7	-46.1	0	0	0	0	111.8	K283 I284 F289 F290 Y336	K283-T286 WeakPolarHBondContact O-CB 3.32Å; K283-T286 PolarHBondContact O-N 3.45Å; K283-T286 VanDerWaalsContact O-N 3.11Å; I284-T286 VanDerWaalsContact C-N 3.33Å; I284-T286 PolarHBondContact O-N 2.93Å; T286-F289 PolarHBondContact O-N 3.47Å; T286-F290 HydrophobicContact CG2-CD2 3.54Å; T286-F290 HydrophobicContact CG2-CE2 3.56Å; T286-F290 WeakPolarHBondContact O-CD2 3.38Å; T286-F290 PolarHBondContact O-N 3.06Å; T286-Y336 WeakPolarHBondContact OG1-CE1 3.36Å; T286-Y336 PolarHBondContact OG1-OH 3.24Å
287	K	92.3	Very high	89.1	Confident	49 Å²	49	56.6 Å²	56.6	21%	0.213	32%	0.316	C	S	.	.	H	α-helix	trans	-61.9	-47.8	176.8	-64.7	-179.5	-176.9	-177.8	0	111.8	L281 K283 I284 F289 T291 A442 Y443	L281-K287 WeakPolarHBondContact O-CE 3.46Å; L281-K287 PolarHBondContact O-NZ 2.91Å; K283-K287 PolarHBondContact O-N 3.45Å; K283-K287 VanDerWaalsContact O-N 3.16Å; I284-K287 WeakPolarHBondContact O-CB 3.24Å; I284-K287 PolarHBondContact O-N 2.97Å; K287-F289 VanDerWaalsContact C-N 3.33Å; K287-F289 PolarHBondContact O-N 2.61Å; K287-T291 WeakPolarHBondContact O-CB 3.43Å; K287-T291 WeakPolarHBondContact O-CG2 3.25Å; K287-T291 PolarHBondContact O-N 2.82Å; K287-T291 PolarHBondContact O-OG1 2.94Å; K287-A442 VanDerWaalsContact CE-O 3.29Å; K287-A442 WeakPolarHBondContact CE-O 3.36Å; K287-A442 HydrophobicContact CG-CB 4.21Å; K287-Y443 HydrophobicContact CD-CE1 4.15Å
288	I	94	Very high	89.9	Confident	92 Å²	92	59.4 Å²	59.4	47%	0.472	33%	0.329	S	S	.	.	H	α-helix	trans	-62.1	-43.9	177.7	-65.2	168.3	0	0	0	110.4	I284 S285 T291 I292	I284-I288 HydrophobicContact CG2-CD1 3.82Å; I284-I288 HydrophobicContact CG2-CG1 4.34Å; I284-I288 WeakPolarHBondContact O-CG1 3.42Å; I284-I288 PolarHBondContact O-N 2.8Å; S285-I288 PolarHBondContact O-N 2.78Å; I288-T291 WeakPolarHBondContact CA-OG1 3.28Å; I288-T291 PolarHBondContact O-OG1 3.06Å; I288-I292 HydrophobicContact CG2-CD1 3.9Å; I288-I292 VanDerWaalsContact O-CG1 3.32Å; I288-I292 WeakPolarHBondContact O-CG1 3.4Å; I288-I292 PolarHBondContact O-N 3.25Å
289	F	94.6	Very high	90.5	Very high	40 Å²	40	62.5 Å²	62.5	18%	0.175	34%	0.341	C	S	.	.	H	α-helix	trans	-62.2	-52.1	179.7	-179.6	-93.1	0	0	0	112.1	S285 T286 K287 T291 I292 A293 F317 V321 L340 A344	S285-F289 WeakPolarHBondContact O-CB 3.2Å; S285-F289 PolarHBondContact O-N 2.91Å; T286-F289 PolarHBondContact O-N 3.47Å; K287-F289 VanDerWaalsContact C-N 3.33Å; K287-F289 PolarHBondContact O-N 2.61Å; F289-T291 PolarHBondContact O-N 3.15Å; F289-I292 PolarHBondContact O-N 2.98Å; F289-A293 WeakPolarHBondContact O-CB 3.37Å; F289-A293 PolarHBondContact O-N 3.4Å; F289-F317 HydrophobicContact CE2-CE1 4.18Å; F289-F317 AromaticContact CE2-CZ 3.95Å; F289-F317 HydrophobicContact CE2-CZ 3.95Å; F289-F317 HydrophobicContact CZ-CE1 4.11Å; F289-F317 HydrophobicContact CZ-CZ 4.33Å; F289-V321 HydrophobicContact CZ-CG1 3.94Å; F289-L340 HydrophobicContact CB-CD2 4.05Å; F289-L340 HydrophobicContact CD1-CD1 4.28Å; F289-L340 HydrophobicContact CD2-CD1 4.05Å; F289-L340 HydrophobicContact CD2-CG 4.45Å; F289-L340 HydrophobicContact CE2-CD1 4.36Å; F289-L340 HydrophobicContact CG-CD1 4.02Å; F289-L340 HydrophobicContact CG-CD2 4.41Å; F289-L340 HydrophobicContact CG-CG 4.5Å; F289-A344 HydrophobicContact CE2-CB 4.23Å
290	F	94.9	Very high	91.2	Very high	53 Å²	53	54.9 Å²	54.9	23%	0.232	31%	0.306	C	S	.	.	H	α-helix	trans	-72	-28.1	-177.4	-77.7	-63.5	0	0	0	113.4	T286 A293 G294 L438 A439 A442	T286-F290 HydrophobicContact CG2-CD2 3.54Å; T286-F290 HydrophobicContact CG2-CE2 3.56Å; T286-F290 WeakPolarHBondContact O-CD2 3.38Å; T286-F290 PolarHBondContact O-N 3.06Å; F290-A293 PolarHBondContact O-N 2.8Å; F290-G294 PolarHBondContact O-N 3.12Å; F290-L438 HydrophobicContact CD1-CB 3.89Å; F290-L438 HydrophobicContact CD1-CD1 4.4Å; F290-L438 HydrophobicContact CE1-CB 4.14Å; F290-L438 HydrophobicContact CE1-CD1 3.95Å; F290-A439 VanDerWaalsContact O-CB 3.26Å; F290-A439 WeakPolarHBondContact O-CB 3.36Å; F290-A442 HydrophobicContact CB-CB 4.33Å
291	T	95.9	Very high	92.2	Very high	39 Å²	39	51.8 Å²	51.8	24%	0.239	29%	0.287	C	S	.	.	H	α-helix	trans	-64.4	-47	171.3	42.8	0	0	0	0	112.5	K287 I288 F289 A293 G294 L295 Y443	K287-T291 WeakPolarHBondContact O-CB 3.43Å; K287-T291 WeakPolarHBondContact O-CG2 3.25Å; K287-T291 PolarHBondContact O-N 2.82Å; K287-T291 PolarHBondContact O-OG1 2.94Å; I288-T291 WeakPolarHBondContact CA-OG1 3.28Å; I288-T291 PolarHBondContact O-OG1 3.06Å; F289-T291 PolarHBondContact O-N 3.15Å; T291-A293 VanDerWaalsContact C-N 3.32Å; T291-A293 PolarHBondContact O-N 3.39Å; T291-G294 PolarHBondContact O-N 3.41Å; T291-L295 WeakPolarHBondContact O-CG 3.28Å; T291-L295 PolarHBondContact O-N 2.87Å; T291-Y443 HydrophobicContact CG2-CE2 3.38Å; T291-Y443 WeakPolarHBondContact CG2-OH 3.45Å
292	I	96.1	Very high	93.4	Very high	109 Å²	109	50.8 Å²	50.8	56%	0.559	28%	0.28	S	S	*	.	H	α-helix	trans	-62.3	-44.1	176.6	-64.5	168.6	0	0	0	109.9	I288 F289 G294 L295 A296	I288-I292 HydrophobicContact CG2-CD1 3.9Å; I288-I292 VanDerWaalsContact O-CG1 3.32Å; I288-I292 WeakPolarHBondContact O-CG1 3.4Å; I288-I292 PolarHBondContact O-N 3.25Å; F289-I292 PolarHBondContact O-N 2.98Å; I292-G294 VanDerWaalsContact C-N 3.34Å; I292-G294 PolarHBondContact O-N 2.9Å; I292-L295 PolarHBondContact O-N 3.46Å; I292-A296 WeakPolarHBondContact O-CB 3.29Å; I292-A296 PolarHBondContact O-N 2.96Å
293	A	95.8	Very high	94.2	Very high	28 Å²	28	51.8 Å²	51.8	23%	0.231	27%	0.271	C	S	.	.	H	α-helix	trans	-62.6	-39.1	176.6	0	0	0	0	0	112.4	F289 F290 T291 A296 G297	F289-A293 WeakPolarHBondContact O-CB 3.37Å; F289-A293 PolarHBondContact O-N 3.4Å; F290-A293 PolarHBondContact O-N 2.8Å; T291-A293 VanDerWaalsContact C-N 3.32Å; T291-A293 PolarHBondContact O-N 3.39Å; A293-A296 PolarHBondContact O-N 3.03Å; A293-G297 WeakPolarHBondContact O-CA 3.37Å; A293-G297 PolarHBondContact O-N 3.2Å
294	G	96.6	Very high	94.6	Very high	5 Å²	5	49 Å²	49	5%	0.052	26%	0.258	C	S	.	.	H	α-helix	trans	-66.7	-41.9	176.5	0	0	0	0	0	112.9	F290 T291 I292 G297 L298 A435	F290-G294 PolarHBondContact O-N 3.12Å; T291-G294 PolarHBondContact O-N 3.41Å; I292-G294 VanDerWaalsContact C-N 3.34Å; I292-G294 PolarHBondContact O-N 2.9Å; G294-G297 PolarHBondContact O-N 2.75Å; G294-L298 WeakPolarHBondContact O-CB 3.42Å; G294-L298 PolarHBondContact O-N 2.97Å; G294-A435 WeakPolarHBondContact CA-O 3.41Å
295	L	97.3	Very high	94.7	Very high	124 Å²	124	43.1 Å²	43.1	65%	0.649	23%	0.228	S	C	*	.	H	α-helix	trans	-64.1	-44.1	174.5	-70.3	173.5	0	0	0	111.6	T291 I292 G297 L298 F299	T291-L295 WeakPolarHBondContact O-CG 3.28Å; T291-L295 PolarHBondContact O-N 2.87Å; I292-L295 PolarHBondContact O-N 3.46Å; L295-G297 VanDerWaalsContact C-N 3.35Å; L295-L298 PolarHBondContact O-N 3.15Å; L295-F299 PolarHBondContact O-N 2.99Å; L295-F299 VanDerWaalsContact O-N 3.09Å
296	A	96.6	Very high	94.7	Very high	35 Å²	35	47.2 Å²	47.2	29%	0.289	24%	0.239	S	C	.	.	H	α-helix	trans	-63.4	-41.9	173.9	0	0	0	0	0	111.5	I292 A293 F299 V300	I292-A296 WeakPolarHBondContact O-CB 3.29Å; I292-A296 PolarHBondContact O-N 2.96Å; A293-A296 PolarHBondContact O-N 3.03Å; A296-F299 WeakPolarHBondContact O-CB 3.43Å; A296-F299 PolarHBondContact O-N 3.5Å; A296-V300 WeakPolarHBondContact O-CG2 3.35Å; A296-V300 PolarHBondContact O-N 3.37Å
297	G	96.6	Very high	94.8	Very high	7 Å²	7	50.4 Å²	50.4	7%	0.072	25%	0.251	C	S	.	.	H	α-helix	trans	-62.3	-42.6	176.6	0	0	0	0	0	112.8	A293 G294 L295 F299 V300 C301 G432	A293-G297 WeakPolarHBondContact O-CA 3.37Å; A293-G297 PolarHBondContact O-N 3.2Å; G294-G297 PolarHBondContact O-N 2.75Å; L295-G297 VanDerWaalsContact C-N 3.35Å; G297-F299 VanDerWaalsContact C-N 3.34Å; G297-F299 PolarHBondContact O-N 3.04Å; G297-V300 PolarHBondContact O-N 3.27Å; G297-C301 VanDerWaalsContact O-CB 3.23Å; G297-C301 WeakPolarHBondContact O-CB 3.49Å; G297-C301 PolarHBondContact O-N 3.04Å; G297-G432 CarbonylContact C-O 3.13Å; G297-G432 CarbonylContact O-C 3.56Å; G297-G432 VanDerWaalsContact O-CA 3.28Å; G297-G432 WeakPolarHBondContact O-CA 3.41Å
298	L	97.3	Very high	94.6	Very high	67 Å²	67	48.2 Å²	48.2	35%	0.351	24%	0.242	S	C	.	.	H	α-helix	trans	-61.6	-42.7	174.2	-172.9	69	0	0	0	111.3	G294 L295 C301 F302 V436 L487	G294-L298 WeakPolarHBondContact O-CB 3.42Å; G294-L298 PolarHBondContact O-N 2.97Å; L295-L298 PolarHBondContact O-N 3.15Å; L298-C301 WeakPolarHBondContact O-CB 3.34Å; L298-C301 PolarHBondContact O-N 3.45Å; L298-F302 HydrophobicContact CD1-CD2 4.14Å; L298-F302 HydrophobicContact CD1-CE2 3.7Å; L298-F302 HydrophobicContact CG-CD2 4.47Å; L298-F302 HydrophobicContact CG-CE2 4.46Å; L298-F302 WeakPolarHBondContact O-CD2 3.41Å; L298-F302 PolarHBondContact O-N 2.9Å; L298-V436 HydrophobicContact CB-CG2 3.93Å; L298-V436 HydrophobicContact CD1-CG2 4.06Å; L298-L487 HydrophobicContact CD1-CD2 4.47Å
299	F	97	Very high	94.5	Very high	76 Å²	76	49.7 Å²	49.7	33%	0.333	25%	0.245	S	C	.	.	H	α-helix	trans	-62.1	-47.3	174.7	178	-94.4	0	0	0	111.7	L295 A296 G297 C301 F302 F303 F307 C310	L295-F299 PolarHBondContact O-N 2.99Å; L295-F299 VanDerWaalsContact O-N 3.09Å; A296-F299 WeakPolarHBondContact O-CB 3.43Å; A296-F299 PolarHBondContact O-N 3.5Å; G297-F299 VanDerWaalsContact C-N 3.34Å; G297-F299 PolarHBondContact O-N 3.04Å; F299-C301 VanDerWaalsContact C-N 3.3Å; F299-C301 PolarHBondContact O-N 3.25Å; F299-F302 PolarHBondContact O-N 3.17Å; F299-F303 HydrophobicContact CD2-CB 4.46Å; F299-F303 AromaticContact CD2-CD2 3.95Å; F299-F303 HydrophobicContact CD2-CD2 3.95Å; F299-F303 HydrophobicContact CE1-CB 4.47Å; F299-F303 HydrophobicContact CE2-CB 4.11Å; F299-F303 HydrophobicContact CE2-CD2 4.14Å; F299-F303 HydrophobicContact CE2-CG 4.34Å; F299-F303 HydrophobicContact CZ-CB 4.13Å; F299-F303 WeakPolarHBondContact O-CA 3.41Å; F299-F303 WeakPolarHBondContact O-CB 3.27Å; F299-F303 PolarHBondContact O-N 3.23Å; F299-F307 HydrophobicContact CE1-CB 4.27Å; F299-F307 HydrophobicContact CE1-CD2 4.25Å; F299-F307 HydrophobicContact CE2-CD2 4.38Å; F299-F307 HydrophobicContact CZ-CB 4.29Å; F299-F307 AromaticContact CZ-CD2 3.56Å; F299-F307 HydrophobicContact CZ-CD2 3.56Å; F299-F307 HydrophobicContact CZ-CE2 4.05Å; F299-F307 HydrophobicContact CZ-CG 4.05Å; F299-C310 HydrophobicContact CE1-CB 4.15Å
300	V	95.9	Very high	94.4	Very high	4 Å²	4	50 Å²	50	2%	0.024	25%	0.251	C	S	.	.	H	α-helix	trans	-62.7	-37.3	177.1	171.3	0	0	0	0	111.3	A296 G297 F302 G304 C314 M315 C428 Q495	A296-V300 WeakPolarHBondContact O-CG2 3.35Å; A296-V300 PolarHBondContact O-N 3.37Å; G297-V300 PolarHBondContact O-N 3.27Å; V300-F302 VanDerWaalsContact C-N 3.31Å; V300-F302 PolarHBondContact O-N 3.31Å; V300-G304 VanDerWaalsContact O-CA 3.24Å; V300-G304 WeakPolarHBondContact O-CA 3.44Å; V300-G304 PolarHBondContact O-N 2.92Å; V300-C314 HydrophobicContact CG2-CB 3.91Å; V300-M315 HydrophobicContact CG1-CE 4.05Å; V300-C428 HydrophobicContact CG1-CB 4.09Å; V300-Q495 PolarHBondContact O-NE2 3.4Å
301	C	96.6	Very high	94.3	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-60	-35.7	179	-177.5	0	0	0	0	113.3	G297 L298 F299 C428 G429 L487 G491 Q495	G297-C301 VanDerWaalsContact O-CB 3.23Å; G297-C301 WeakPolarHBondContact O-CB 3.49Å; G297-C301 PolarHBondContact O-N 3.04Å; L298-C301 WeakPolarHBondContact O-CB 3.34Å; L298-C301 PolarHBondContact O-N 3.45Å; F299-C301 VanDerWaalsContact C-N 3.3Å; F299-C301 PolarHBondContact O-N 3.25Å; C301-C428 WeakPolarHBondContact CA-O 2.95Å; C301-G429 PolarHBondContact SG-O 3.47Å; C301-L487 PolarHBondContact SG-O 3.33Å; C301-G491 VanDerWaalsContact O-CA 3.25Å; C301-G491 WeakPolarHBondContact O-CA 3.36Å; C301-Q495 VanDerWaalsContact C-NE2 3.26Å; C301-Q495 PolarHBondContact O-NE2 2.85Å
302	F	95.6	Very high	94.1	Very high	47 Å²	47	45.6 Å²	45.6	21%	0.206	23%	0.229	C	C	.	.	H	α-helix	trans	-104.9	-25.4	-179.3	-70	-69.3	0	0	0	114.7	L298 F299 V300 L487 C490 L494 Q495	L298-F302 HydrophobicContact CD1-CD2 4.14Å; L298-F302 HydrophobicContact CD1-CE2 3.7Å; L298-F302 HydrophobicContact CG-CD2 4.47Å; L298-F302 HydrophobicContact CG-CE2 4.46Å; L298-F302 WeakPolarHBondContact O-CD2 3.41Å; L298-F302 PolarHBondContact O-N 2.9Å; F299-F302 PolarHBondContact O-N 3.17Å; V300-F302 VanDerWaalsContact C-N 3.31Å; V300-F302 PolarHBondContact O-N 3.31Å; F302-L487 HydrophobicContact CE2-CD2 4.32Å; F302-L487 HydrophobicContact CZ-CD2 4.12Å; F302-C490 HydrophobicContact CE1-CB 4.23Å; F302-L494 HydrophobicContact CD1-CD1 3.65Å; F302-L494 HydrophobicContact CE1-CD1 3.7Å; F302-Q495 WeakPolarHBondContact O-CG 3.27Å
303	F	94.3	Very high	94.1	Very high	69 Å²	69	43.7 Å²	43.7	30%	0.303	22%	0.217	S	C	.	.	H	α-helix	trans	-131.6	3.9	-170.2	-51.9	-83.9	0	0	0	114.1	F299 H305 R306 F307	F299-F303 HydrophobicContact CD2-CB 4.46Å; F299-F303 AromaticContact CD2-CD2 3.95Å; F299-F303 HydrophobicContact CD2-CD2 3.95Å; F299-F303 HydrophobicContact CE1-CB 4.47Å; F299-F303 HydrophobicContact CE2-CB 4.11Å; F299-F303 HydrophobicContact CE2-CD2 4.14Å; F299-F303 HydrophobicContact CE2-CG 4.34Å; F299-F303 HydrophobicContact CZ-CB 4.13Å; F299-F303 WeakPolarHBondContact O-CA 3.41Å; F299-F303 WeakPolarHBondContact O-CB 3.27Å; F299-F303 PolarHBondContact O-N 3.23Å; F303-H305 PolarHBondContact O-N 3.27Å; F303-R306 PolarHBondContact O-N 2.95Å; F303-F307 HydrophobicContact CB-CD2 3.87Å; F303-F307 HydrophobicContact CB-CE2 4.2Å; F303-F307 PolarHBondContact O-N 2.7Å
304	G	92	Very high	94.1	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	21%	0.213	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.4	-57.8	-174.1	0	0	0	0	0	113	V300 R306 F307 F308	V300-G304 VanDerWaalsContact O-CA 3.24Å; V300-G304 WeakPolarHBondContact O-CA 3.44Å; V300-G304 PolarHBondContact O-N 2.92Å; G304-R306 VanDerWaalsContact C-N 3.28Å; G304-R306 PolarHBondContact O-N 3.35Å; G304-F307 CarbonylContact O-C 3.58Å; G304-F307 PolarHBondContact O-N 2.77Å; G304-F307 VanDerWaalsContact O-N 3.07Å; G304-F308 PolarHBondContact O-N 2.86Å
305	H	90.5	Very high	93.9	Very high	8 Å²	8	43.6 Å²	43.6	4%	0.037	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.1	-35.7	-177.2	-169.8	63.6	0	0	0	113.1	F303 N424 I425 Q495 F504 F505	F303-H305 PolarHBondContact O-N 3.27Å; H305-N424 PolarHBondContact ND1-ND2 3.46Å; H305-N424 VanDerWaalsContact ND1-ND2 3.14Å; H305-I425 HydrophobicContact CB-CG1 3.76Å; H305-Q495 VanDerWaalsContact N-OE1 3.17Å; H305-F504 PolarHBondContact CE1-O 3.37Å; H305-F504 VanDerWaalsContact CE1-O 3.25Å; H305-F504 PolarHBondContact NE2-O 3.21Å; H305-F505 AromaticContact CE1-CE1 3.9Å
306	R	89.9	Confident	93.8	Very high	115 Å²	115	37.9 Å²	37.9	43%	0.434	18%	0.183	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.8	-43.5	175.7	-178.2	176.9	174.3	-177.5	-0.4	111.6	F303 G304 E499	F303-R306 PolarHBondContact O-N 2.95Å; G304-R306 VanDerWaalsContact C-N 3.28Å; G304-R306 PolarHBondContact O-N 3.35Å; R306-E499 WeakPolarHBondContact CB-OE1 3.17Å
307	F	90.9	Very high	93.8	Very high	91 Å²	91	38.1 Å²	38.1	40%	0.399	18%	0.178	S	C	.	.	T	Hydrogen-bonded Turn	trans	-103	59.9	178.1	-64.1	-77.7	0	0	0	110.4	F299 F303 G304 K309 C310 E311	F299-F307 HydrophobicContact CE1-CB 4.27Å; F299-F307 HydrophobicContact CE1-CD2 4.25Å; F299-F307 HydrophobicContact CE2-CD2 4.38Å; F299-F307 HydrophobicContact CZ-CB 4.29Å; F299-F307 AromaticContact CZ-CD2 3.56Å; F299-F307 HydrophobicContact CZ-CD2 3.56Å; F299-F307 HydrophobicContact CZ-CE2 4.05Å; F299-F307 HydrophobicContact CZ-CG 4.05Å; F303-F307 HydrophobicContact CB-CD2 3.87Å; F303-F307 HydrophobicContact CB-CE2 4.2Å; F303-F307 PolarHBondContact O-N 2.7Å; G304-F307 CarbonylContact O-C 3.58Å; G304-F307 PolarHBondContact O-N 2.77Å; G304-F307 VanDerWaalsContact O-N 3.07Å; F307-K309 PolarHBondContact O-N 2.75Å; F307-C310 HydrophobicContact CB-CB 4.12Å; F307-C310 WeakPolarHBondContact O-CA 3.47Å; F307-C310 WeakPolarHBondContact O-CB 3.25Å; F307-C310 PolarHBondContact O-N 2.83Å; F307-E311 PolarHBondContact O-N 3.45Å; F307-E311 VanDerWaalsContact O-N 3.09Å
308	F	88.7	Confident	93.7	Very high	4 Å²	4	40.2 Å²	40.2	2%	0.018	19%	0.192	C	C	.	.	H	α-helix	trans	-49.8	-35.2	-174.5	-168.2	-117.9	0	0	0	114.4	G304 C310 E311 L312 W358 F505 P506	G304-F308 PolarHBondContact O-N 2.86Å; F308-C310 PolarHBondContact O-N 2.88Å; F308-E311 WeakPolarHBondContact CD2-OE2 3.4Å; F308-E311 PolarHBondContact O-N 3.04Å; F308-L312 HydrophobicContact CD1-CD1 3.86Å; F308-L312 HydrophobicContact CD1-CG 4.24Å; F308-L312 HydrophobicContact CE1-CD1 3.46Å; F308-L312 VanDerWaalsContact CE1-CD1 3.46Å; F308-L312 HydrophobicContact CE1-CD2 4.25Å; F308-L312 HydrophobicContact CE1-CG 3.93Å; F308-L312 HydrophobicContact CE2-CD2 4.13Å; F308-L312 HydrophobicContact CE2-CG 4.23Å; F308-L312 HydrophobicContact CZ-CD1 3.9Å; F308-L312 HydrophobicContact CZ-CD2 3.79Å; F308-L312 HydrophobicContact CZ-CG 3.92Å; F308-L312 WeakPolarHBondContact O-CB 3.49Å; F308-L312 VanDerWaalsContact O-CG 3.31Å; F308-L312 WeakPolarHBondContact O-CG 3.44Å; F308-L312 PolarHBondContact O-N 2.92Å; F308-W358 HydrophobicContact CD1-CD2 4.26Å; F308-W358 AromaticContact CD1-CE2 3.85Å; F308-W358 HydrophobicContact CD1-CZ2 4.05Å; F308-W358 AromaticContact CE1-CD1 3.69Å; F308-W358 HydrophobicContact CE1-CD2 4.12Å; F308-W358 AromaticContact CE1-CE2 3.79Å; F308-W358 HydrophobicContact CE1-CG 4.06Å; F308-W358 HydrophobicContact CE1-CZ2 4.41Å; F308-W358 AromaticContact CE1-NE1 3.5Å; F308-F505 HydrophobicContact CD2-CD1 4.21Å; F308-F505 HydrophobicContact CD2-CE1 4.35Å; F308-F505 HydrophobicContact CE1-CD1 4.36Å; F308-F505 AromaticContact CE2-CD1 3.76Å; F308-F505 HydrophobicContact CE2-CD1 3.76Å; F308-F505 AromaticContact CE2-CE1 3.66Å; F308-F505 HydrophobicContact CE2-CE1 3.66Å; F308-F505 AromaticContact CZ-CD1 3.84Å; F308-F505 HydrophobicContact CZ-CD1 3.84Å; F308-F505 AromaticContact CZ-CE1 3.97Å; F308-F505 HydrophobicContact CZ-CE1 3.97Å; F308-P506 HydrophobicContact CB-CG 3.7Å; F308-P506 HydrophobicContact CD1-CG 3.86Å; F308-P506 HydrophobicContact CG-CG 4Å
309	K	91.1	Very high	93.5	Very high	122 Å²	122	41.4 Å²	41.4	53%	0.53	19%	0.194	S	C	.	.	H	α-helix	trans	-62.4	-41.6	174.9	-65.2	-180	-176.9	176.9	0	112.9	F307 F313 V355 W358	F307-K309 PolarHBondContact O-N 2.75Å; K309-F313 WeakPolarHBondContact O-CB 3.2Å; K309-F313 PolarHBondContact O-N 2.99Å; K309-F313 VanDerWaalsContact O-N 3.07Å; K309-V355 WeakPolarHBondContact O-CG2 3.27Å; K309-W358 HydrophobicContact CG-CZ3 3.91Å
310	C	92.4	Very high	93.4	Very high	47 Å²	47	38 Å²	38	32%	0.318	18%	0.18	S	C	.	.	H	α-helix	trans	-70.6	-41.1	178.5	-177.7	0	0	0	0	110.4	F299 F307 F308 F313 C314	F299-C310 HydrophobicContact CE1-CB 4.15Å; F307-C310 HydrophobicContact CB-CB 4.12Å; F307-C310 WeakPolarHBondContact O-CA 3.47Å; F307-C310 WeakPolarHBondContact O-CB 3.25Å; F307-C310 PolarHBondContact O-N 2.83Å; F308-C310 PolarHBondContact O-N 2.88Å; C310-F313 WeakPolarHBondContact O-CB 3.27Å; C310-F313 PolarHBondContact O-N 3.06Å; C310-C314 PolarHBondContact O-N 3.12Å; C310-C314 PolarHBondContact O-SG 2.64Å; C310-C314 VanDerWaalsContact O-SG 3.34Å
311	E	93	Very high	93.4	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-56.3	-53.8	172.9	179	-167.6	171.9	0	0	111.7	F307 F308 F313 C314 M315 N424 C428	F307-E311 PolarHBondContact O-N 3.45Å; F307-E311 VanDerWaalsContact O-N 3.09Å; F308-E311 WeakPolarHBondContact CD2-OE2 3.4Å; F308-E311 PolarHBondContact O-N 3.04Å; E311-F313 VanDerWaalsContact C-N 3.25Å; E311-F313 PolarHBondContact O-N 3.12Å; E311-C314 PolarHBondContact O-N 2.94Å; E311-C314 VanDerWaalsContact O-N 3.13Å; E311-M315 HydrophobicContact CG-CG 4.2Å; E311-M315 WeakPolarHBondContact O-CB 3.26Å; E311-M315 WeakPolarHBondContact O-CG 3.22Å; E311-M315 PolarHBondContact O-N 3.41Å; E311-N424 PolarHBondContact OE1-ND2 2.73Å; E311-N424 PolarHBondContact OE1-OD1 3.05Å; E311-N424 PolarHBondContact OE2-ND2 3.42Å; E311-C428 PolarHBondContact OE1-SG 2.97Å
312	L	92.6	Very high	93.3	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-58.8	-39.5	178.8	-70.6	-178.2	0	0	0	111.9	F308 G316 L354 V355 W358 C367	F308-L312 HydrophobicContact CD1-CD1 3.86Å; F308-L312 HydrophobicContact CD1-CG 4.24Å; F308-L312 HydrophobicContact CE1-CD1 3.46Å; F308-L312 VanDerWaalsContact CE1-CD1 3.46Å; F308-L312 HydrophobicContact CE1-CD2 4.25Å; F308-L312 HydrophobicContact CE1-CG 3.93Å; F308-L312 HydrophobicContact CE2-CD2 4.13Å; F308-L312 HydrophobicContact CE2-CG 4.23Å; F308-L312 HydrophobicContact CZ-CD1 3.9Å; F308-L312 HydrophobicContact CZ-CD2 3.79Å; F308-L312 HydrophobicContact CZ-CG 3.92Å; F308-L312 WeakPolarHBondContact O-CB 3.49Å; F308-L312 VanDerWaalsContact O-CG 3.31Å; F308-L312 WeakPolarHBondContact O-CG 3.44Å; F308-L312 PolarHBondContact O-N 2.92Å; L312-G316 PolarHBondContact O-N 3.41Å; L312-L354 HydrophobicContact CD2-CD2 4.37Å; L312-L354 HydrophobicContact CD2-CG 4.45Å; L312-L354 WeakPolarHBondContact O-CD2 3.12Å; L312-V355 HydrophobicContact CB-CG2 3.89Å; L312-W358 HydrophobicContact CD1-CB 3.57Å; L312-W358 HydrophobicContact CD1-CD2 4.09Å; L312-W358 HydrophobicContact CD1-CE3 4.43Å; L312-W358 HydrophobicContact CD1-CG 3.71Å; L312-C367 HydrophobicContact CD2-CB 3.66Å
313	F	95.4	Very high	93.2	Very high	69 Å²	69	44.4 Å²	44.4	30%	0.303	21%	0.209	S	C	.	.	H	α-helix	trans	-61.2	-49.9	174.8	177.8	-96	0	0	0	111.4	K309 C310 E311 F317 V348 G351 V352 V355	K309-F313 WeakPolarHBondContact O-CB 3.2Å; K309-F313 PolarHBondContact O-N 2.99Å; K309-F313 VanDerWaalsContact O-N 3.07Å; C310-F313 WeakPolarHBondContact O-CB 3.27Å; C310-F313 PolarHBondContact O-N 3.06Å; E311-F313 VanDerWaalsContact C-N 3.25Å; E311-F313 PolarHBondContact O-N 3.12Å; F313-F317 WeakPolarHBondContact O-CB 3.49Å; F313-F317 PolarHBondContact O-N 2.87Å; F313-V348 HydrophobicContact CE2-CG1 4.26Å; F313-V348 HydrophobicContact CZ-CG1 4.3Å; F313-G351 WeakPolarHBondContact O-CA 3.39Å; F313-V352 HydrophobicContact CE2-CG2 4.19Å; F313-V355 HydrophobicContact CB-CG2 3.9Å
314	C	95.6	Very high	93.2	Very high	23 Å²	23	44.7 Å²	44.7	16%	0.155	21%	0.21	C	C	.	.	H	α-helix	trans	-64.6	-44.3	-179.2	-69.9	0	0	0	0	112.4	V300 C310 E311 F317 S318	V300-C314 HydrophobicContact CG2-CB 3.91Å; C310-C314 PolarHBondContact O-N 3.12Å; C310-C314 PolarHBondContact O-SG 2.64Å; C310-C314 VanDerWaalsContact O-SG 3.34Å; E311-C314 PolarHBondContact O-N 2.94Å; E311-C314 VanDerWaalsContact O-N 3.13Å; C314-F317 WeakPolarHBondContact O-CB 3.4Å; C314-F317 PolarHBondContact O-N 2.96Å; C314-S318 PolarHBondContact O-N 2.7Å; C314-S318 PolarHBondContact O-OG 2.87Å
315	M	93.6	Very high	93.3	Very high	7 Å²	7	46 Å²	46	3%	0.034	22%	0.216	C	C	.	.	H	α-helix	trans	-66.8	-43.4	179	-65.6	-66.2	-175.9	0	0	111.4	V300 E311 F317 S318 F319 V371 T427 V431	V300-M315 HydrophobicContact CG1-CE 4.05Å; E311-M315 HydrophobicContact CG-CG 4.2Å; E311-M315 WeakPolarHBondContact O-CB 3.26Å; E311-M315 WeakPolarHBondContact O-CG 3.22Å; E311-M315 PolarHBondContact O-N 3.41Å; M315-F317 VanDerWaalsContact C-N 3.34Å; M315-S318 PolarHBondContact O-N 2.72Å; M315-F319 WeakPolarHBondContact O-CB 3.33Å; M315-F319 PolarHBondContact O-N 3.08Å; M315-V371 HydrophobicContact CB-CG2 4.18Å; M315-V371 HydrophobicContact CG-CG2 4.07Å; M315-T427 HydrophobicContact CE-CG2 3.89Å; M315-T427 HydrophobicContact SD-CG2 4.5Å; M315-V431 HydrophobicContact CE-CB 4.48Å
316	G	94.4	Very high	93.5	Very high	4 Å²	4	46.7 Å²	46.7	4%	0.041	22%	0.221	C	C	.	.	H	α-helix	trans	-64.8	-37.9	174.5	0	0	0	0	0	112.6	L312 A320	L312-G316 PolarHBondContact O-N 3.41Å; G316-A320 VanDerWaalsContact O-CB 3.28Å; G316-A320 WeakPolarHBondContact O-CB 3.42Å; G316-A320 PolarHBondContact O-N 3.21Å
317	F	96	Very high	93.7	Very high	41 Å²	41	45 Å²	45	18%	0.18	22%	0.22	C	C	.	.	H	α-helix	trans	-60.6	-54.9	172.8	174.7	-87.3	0	0	0	111	F289 F313 C314 M315 F319 A320 V321 A344 G347 V348	F289-F317 HydrophobicContact CE2-CE1 4.18Å; F289-F317 AromaticContact CE2-CZ 3.95Å; F289-F317 HydrophobicContact CE2-CZ 3.95Å; F289-F317 HydrophobicContact CZ-CE1 4.11Å; F289-F317 HydrophobicContact CZ-CZ 4.33Å; F313-F317 WeakPolarHBondContact O-CB 3.49Å; F313-F317 PolarHBondContact O-N 2.87Å; C314-F317 WeakPolarHBondContact O-CB 3.4Å; C314-F317 PolarHBondContact O-N 2.96Å; M315-F317 VanDerWaalsContact C-N 3.34Å; F317-F319 VanDerWaalsContact C-N 3.35Å; F317-F319 PolarHBondContact O-N 3.48Å; F317-A320 PolarHBondContact O-N 3.47Å; F317-V321 HydrophobicContact CD1-CG2 3.98Å; F317-V321 HydrophobicContact CD2-CG2 4.25Å; F317-V321 HydrophobicContact CE1-CG2 3.65Å; F317-V321 HydrophobicContact CE2-CG2 3.92Å; F317-V321 HydrophobicContact CG-CG2 4.25Å; F317-V321 HydrophobicContact CZ-CG2 3.62Å; F317-V321 WeakPolarHBondContact O-CB 3.34Å; F317-V321 VanDerWaalsContact O-CG2 3.26Å; F317-V321 WeakPolarHBondContact O-CG2 3.26Å; F317-V321 PolarHBondContact O-N 3.17Å; F317-A344 WeakPolarHBondContact CE2-O 3.38Å; F317-G347 WeakPolarHBondContact CA-O 3.36Å; F317-V348 HydrophobicContact CD2-CG2 4.19Å; F317-V348 HydrophobicContact CE2-CG2 4.04Å
318	S	94.6	Very high	93.8	Very high	51 Å²	51	41.5 Å²	41.5	36%	0.357	21%	0.205	S	C	.	.	H	α-helix	trans	-59.8	-43.5	-179	-65.5	0	0	0	0	112.4	C314 M315 F322	C314-S318 PolarHBondContact O-N 2.7Å; C314-S318 PolarHBondContact O-OG 2.87Å; M315-S318 PolarHBondContact O-N 2.72Å; S318-F322 WeakPolarHBondContact O-CB 3.2Å; S318-F322 PolarHBondContact O-N 2.79Å
319	F	93.8	Very high	93.9	Very high	91 Å²	91	42.3 Å²	42.3	40%	0.399	21%	0.211	S	C	.	.	H	α-helix	trans	-60.7	-49.9	177	179.4	-96.7	0	0	0	111.8	M315 F317 F322 F323 M374	M315-F319 WeakPolarHBondContact O-CB 3.33Å; M315-F319 PolarHBondContact O-N 3.08Å; F317-F319 VanDerWaalsContact C-N 3.35Å; F317-F319 PolarHBondContact O-N 3.48Å; F319-F322 PolarHBondContact O-N 2.95Å; F319-F323 WeakPolarHBondContact O-CB 3.32Å; F319-F323 PolarHBondContact O-N 3.49Å; F319-M374 HydrophobicContact CB-SD 3.95Å; F319-M374 HydrophobicContact CD2-SD 4.04Å
320	A	95.1	Very high	93.9	Very high	6 Å²	6	42.2 Å²	42.2	5%	0.05	21%	0.207	C	C	.	.	H	α-helix	trans	-66.9	-43	-179.9	0	0	0	0	0	111.9	G316 F317 F322 F323 F324	G316-A320 VanDerWaalsContact O-CB 3.28Å; G316-A320 WeakPolarHBondContact O-CB 3.42Å; G316-A320 PolarHBondContact O-N 3.21Å; F317-A320 PolarHBondContact O-N 3.47Å; A320-F322 PolarHBondContact O-N 3.47Å; A320-F323 PolarHBondContact O-N 2.93Å; A320-F324 HydrophobicContact CB-CD2 4.33Å; A320-F324 WeakPolarHBondContact O-CB 3.38Å; A320-F324 VanDerWaalsContact O-CD2 3.28Å; A320-F324 WeakPolarHBondContact O-CD2 3.22Å; A320-F324 PolarHBondContact O-N 3.37Å
321	V	95.6	Very high	93.9	Very high	13 Å²	13	44.7 Å²	44.7	8%	0.079	22%	0.221	C	C	.	.	H	α-helix	trans	-57	-51.3	175.9	171.5	0	0	0	0	110.2	F289 F317 F325 S343	F289-V321 HydrophobicContact CZ-CG1 3.94Å; F317-V321 HydrophobicContact CD1-CG2 3.98Å; F317-V321 HydrophobicContact CD2-CG2 4.25Å; F317-V321 HydrophobicContact CE1-CG2 3.65Å; F317-V321 HydrophobicContact CE2-CG2 3.92Å; F317-V321 HydrophobicContact CG-CG2 4.25Å; F317-V321 HydrophobicContact CZ-CG2 3.62Å; F317-V321 WeakPolarHBondContact O-CB 3.34Å; F317-V321 VanDerWaalsContact O-CG2 3.26Å; F317-V321 WeakPolarHBondContact O-CG2 3.26Å; F317-V321 PolarHBondContact O-N 3.17Å; V321-F325 WeakPolarHBondContact O-CA 3.26Å; V321-F325 WeakPolarHBondContact O-CB 3.42Å; V321-F325 PolarHBondContact O-N 2.94Å; V321-S343 WeakPolarHBondContact CG2-O 3.34Å
322	F	93.8	Very high	93.8	Very high	61 Å²	61	47.1 Å²	47.1	27%	0.268	24%	0.236	S	C	.	.	H	α-helix	trans	-59.9	-51.6	-178	-179.2	-95.5	0	0	0	111.6	S318 F319 A320 F325 V326 F377 L456 F459	S318-F322 WeakPolarHBondContact O-CB 3.2Å; S318-F322 PolarHBondContact O-N 2.79Å; F319-F322 PolarHBondContact O-N 2.95Å; A320-F322 PolarHBondContact O-N 3.47Å; F322-F325 PolarHBondContact O-N 3.41Å; F322-V326 HydrophobicContact CE1-CG2 4.5Å; F322-V326 HydrophobicContact CZ-CG2 4.5Å; F322-V326 WeakPolarHBondContact O-CG2 3.4Å; F322-V326 PolarHBondContact O-N 2.97Å; F322-V326 VanDerWaalsContact O-N 3.15Å; F322-F377 AromaticContact CE1-CE2 3.71Å; F322-F377 HydrophobicContact CE1-CE2 3.71Å; F322-F377 AromaticContact CE1-CZ 3.92Å; F322-F377 HydrophobicContact CE1-CZ 3.92Å; F322-F377 HydrophobicContact CE2-CE2 4.4Å; F322-F377 AromaticContact CE2-CZ 3.77Å; F322-F377 HydrophobicContact CE2-CZ 3.77Å; F322-F377 HydrophobicContact CZ-CE1 4.5Å; F322-F377 AromaticContact CZ-CE2 3.62Å; F322-F377 HydrophobicContact CZ-CE2 3.62Å; F322-F377 AromaticContact CZ-CZ 3.42Å; F322-F377 HydrophobicContact CZ-CZ 3.42Å; F322-F377 VanDerWaalsContact CZ-CZ 3.42Å; F322-L456 HydrophobicContact CE2-CB 4.4Å; F322-L456 HydrophobicContact CE2-CD1 4.2Å; F322-F459 HydrophobicContact CE1-CD2 4.38Å; F322-F459 HydrophobicContact CE1-CE2 4.1Å; F322-F459 HydrophobicContact CZ-CD2 4.06Å; F322-F459 HydrophobicContact CZ-CE2 4.07Å
323	F	93.3	Very high	93.7	Very high	111 Å²	111	56.9 Å²	56.9	49%	0.487	28%	0.281	S	S	.	.	H	α-helix	trans	-62.3	-48.3	-177.8	-177.6	-95.5	0	0	0	112.4	F319 A320 V326 L327	F319-F323 WeakPolarHBondContact O-CB 3.32Å; F319-F323 PolarHBondContact O-N 3.49Å; A320-F323 PolarHBondContact O-N 2.93Å; F323-V326 PolarHBondContact O-N 3.18Å; F323-L327 PolarHBondContact O-N 3.16Å
324	F	94.4	Very high	93.3	Very high	75 Å²	75	56.8 Å²	56.8	33%	0.329	28%	0.283	S	S	.	.	H	α-helix	trans	-75	-28.3	-178.9	-77.5	-79.9	0	0	0	112.7	A320 V326 L327 I328 V346	A320-F324 HydrophobicContact CB-CD2 4.33Å; A320-F324 WeakPolarHBondContact O-CB 3.38Å; A320-F324 VanDerWaalsContact O-CD2 3.28Å; A320-F324 WeakPolarHBondContact O-CD2 3.22Å; A320-F324 PolarHBondContact O-N 3.37Å; F324-V326 VanDerWaalsContact C-N 3.33Å; F324-L327 HydrophobicContact CD1-CD2 3.97Å; F324-L327 HydrophobicContact CE1-CD2 4.08Å; F324-L327 PolarHBondContact O-N 3.43Å; F324-I328 HydrophobicContact CB-CD1 4.36Å; F324-I328 VanDerWaalsContact O-CB 3.24Å; F324-I328 WeakPolarHBondContact O-CB 3.47Å; F324-I328 WeakPolarHBondContact O-CD1 3.28Å; F324-I328 WeakPolarHBondContact O-CG1 3.24Å; F324-I328 PolarHBondContact O-N 3.11Å; F324-V346 HydrophobicContact CB-CG1 4.08Å; F324-V346 HydrophobicContact CD1-CG1 4.05Å; F324-V346 HydrophobicContact CD2-CG1 3.31Å; F324-V346 HydrophobicContact CE1-CG1 4.31Å; F324-V346 HydrophobicContact CE2-CG1 3.63Å; F324-V346 HydrophobicContact CG-CB 4.44Å; F324-V346 HydrophobicContact CG-CG1 3.54Å; F324-V346 HydrophobicContact CZ-CG1 4.12Å
325	F	94.4	Very high	93	Very high	27 Å²	27	59.7 Å²	59.7	12%	0.118	30%	0.297	C	S	.	.	H	α-helix	trans	-60.8	-44.3	170.8	-176.6	-90.7	0	0	0	111.1	V321 F322 T329 Y336 R339 S343 L456 L460	V321-F325 WeakPolarHBondContact O-CA 3.26Å; V321-F325 WeakPolarHBondContact O-CB 3.42Å; V321-F325 PolarHBondContact O-N 2.94Å; F322-F325 PolarHBondContact O-N 3.41Å; F325-T329 WeakPolarHBondContact O-CB 3.29Å; F325-T329 PolarHBondContact O-N 3.37Å; F325-T329 PolarHBondContact O-OG1 2.88Å; F325-Y336 HydrophobicContact CE2-CE2 4.47Å; F325-Y336 HydrophobicContact CZ-CE2 4.24Å; F325-R339 HydrophobicContact CE2-CB 4.5Å; F325-S343 VanDerWaalsContact CA-OG 3.24Å; F325-S343 WeakPolarHBondContact CA-OG 3.28Å; F325-S343 PolarHBondContact N-OG 3.2Å; F325-L456 HydrophobicContact CD1-CD1 4.01Å; F325-L456 HydrophobicContact CD1-CD2 4.38Å; F325-L456 HydrophobicContact CE1-CD1 4.24Å; F325-L456 HydrophobicContact CE1-CD2 4.04Å; F325-L460 HydrophobicContact CE1-CD1 4.34Å
326	V	94.1	Very high	92.8	Very high	22 Å²	22	61.9 Å²	61.9	13%	0.133	31%	0.306	C	S	.	.	H	α-helix	trans	-61.2	-51	173.4	172.4	0	0	0	0	110.7	F322 F323 F324 I328 T329 R330 L456 F459	F322-V326 HydrophobicContact CE1-CG2 4.5Å; F322-V326 HydrophobicContact CZ-CG2 4.5Å; F322-V326 WeakPolarHBondContact O-CG2 3.4Å; F322-V326 PolarHBondContact O-N 2.97Å; F322-V326 VanDerWaalsContact O-N 3.15Å; F323-V326 PolarHBondContact O-N 3.18Å; F324-V326 VanDerWaalsContact C-N 3.33Å; V326-I328 PolarHBondContact O-N 3.4Å; V326-T329 PolarHBondContact O-N 2.89Å; V326-R330 HydrophobicContact CG1-CG 4.45Å; V326-R330 WeakPolarHBondContact O-CB 3.28Å; V326-R330 WeakPolarHBondContact O-CG 3.25Å; V326-R330 PolarHBondContact O-N 3.3Å; V326-L456 HydrophobicContact CG2-CD1 3.56Å; V326-F459 HydrophobicContact CG1-CB 3.91Å; V326-F459 HydrophobicContact CG1-CD1 4.45Å; V326-F459 HydrophobicContact CG1-CG 4.29Å; V326-F459 HydrophobicContact CG2-CB 4.15Å; V326-F459 HydrophobicContact CG2-CG 4.44Å
327	L	93.9	Very high	92.6	Very high	79 Å²	79	64.9 Å²	64.9	41%	0.414	32%	0.321	S	S	.	.	H	α-helix	trans	-59.7	-49.9	-177.6	-172.9	71.8	0	0	0	112.1	F323 F324 T329 R330 T331	F323-L327 PolarHBondContact O-N 3.16Å; F324-L327 HydrophobicContact CD1-CD2 3.97Å; F324-L327 HydrophobicContact CE1-CD2 4.08Å; F324-L327 PolarHBondContact O-N 3.43Å; L327-T329 PolarHBondContact O-N 3.45Å; L327-R330 PolarHBondContact O-N 2.79Å; L327-T331 HydrophobicContact CD1-CG2 4.3Å; L327-T331 WeakPolarHBondContact O-CB 3.45Å; L327-T331 WeakPolarHBondContact O-CG2 3.47Å; L327-T331 PolarHBondContact O-N 2.58Å; L327-T331 PolarHBondContact O-OG1 2.94Å
328	I	93.6	Very high	92.4	Very high	19 Å²	19	67 Å²	67	10%	0.097	33%	0.333	C	S	.	.	H	α-helix	trans	-62.2	-45.1	179.6	-67.4	165.2	0	0	0	109.9	F324 V326 R330 T331 T332 L334 R339 V342	F324-I328 HydrophobicContact CB-CD1 4.36Å; F324-I328 VanDerWaalsContact O-CB 3.24Å; F324-I328 WeakPolarHBondContact O-CB 3.47Å; F324-I328 WeakPolarHBondContact O-CD1 3.28Å; F324-I328 WeakPolarHBondContact O-CG1 3.24Å; F324-I328 PolarHBondContact O-N 3.11Å; V326-I328 PolarHBondContact O-N 3.4Å; I328-R330 VanDerWaalsContact C-N 3.29Å; I328-R330 PolarHBondContact O-N 2.93Å; I328-T331 PolarHBondContact O-N 3.36Å; I328-T332 VanDerWaalsContact CG2-OG1 3.3Å; I328-T332 WeakPolarHBondContact CG2-OG1 3.47Å; I328-T332 WeakPolarHBondContact O-CB 3.09Å; I328-T332 PolarHBondContact O-N 3.49Å; I328-T332 PolarHBondContact O-OG1 3.36Å; I328-L334 HydrophobicContact CG2-CD1 4.12Å; I328-R339 HydrophobicContact CG2-CG 3.99Å; I328-V342 HydrophobicContact CD1-CB 4.31Å; I328-V342 HydrophobicContact CD1-CG1 3.69Å
329	T	91.4	Very high	92.3	Very high	21 Å²	21	67.1 Å²	67.1	13%	0.129	33%	0.326	C	S	.	.	H	α-helix	trans	-65.1	-33.2	-179.4	-58	0	0	0	0	112.4	F325 V326 L327 L460	F325-T329 WeakPolarHBondContact O-CB 3.29Å; F325-T329 PolarHBondContact O-N 3.37Å; F325-T329 PolarHBondContact O-OG1 2.88Å; V326-T329 PolarHBondContact O-N 2.89Å; L327-T329 PolarHBondContact O-N 3.45Å; T329-L460 HydrophobicContact CG2-CD1 4.13Å; T329-L460 HydrophobicContact CG2-CD2 3.52Å; T329-L460 HydrophobicContact CG2-CG 4.36Å
330	R	90.9	Very high	92.3	Very high	119 Å²	119	63.5 Å²	63.5	45%	0.449	31%	0.311	S	S	.	.	H	α-helix	trans	-80.2	-26.5	177.7	-71.7	-71.9	-71.5	-157.5	-12	113.9	V326 L327 I328 L460 N462	V326-R330 HydrophobicContact CG1-CG 4.45Å; V326-R330 WeakPolarHBondContact O-CB 3.28Å; V326-R330 WeakPolarHBondContact O-CG 3.25Å; V326-R330 PolarHBondContact O-N 3.3Å; L327-R330 PolarHBondContact O-N 2.79Å; I328-R330 VanDerWaalsContact C-N 3.29Å; I328-R330 PolarHBondContact O-N 2.93Å; R330-L460 HydrophobicContact CG-CD2 4.23Å; R330-L460 PolarHBondContact NH1-O 3.29Å; R330-N462 PolarHBondContact NH1-OD1 3.45Å; R330-N462 PolarHBondContact NH2-OD1 3.36Å
331	T	91.9	Very high	92.3	Very high	100 Å²	100	67.4 Å²	67.4	61%	0.613	33%	0.334	S	S	*	.	H	α-helix	trans	-104.8	-18.6	-173	55.6	0	0	0	0	113.8	L327 I328	L327-T331 HydrophobicContact CD1-CG2 4.3Å; L327-T331 WeakPolarHBondContact O-CB 3.45Å; L327-T331 WeakPolarHBondContact O-CG2 3.47Å; L327-T331 PolarHBondContact O-N 2.58Å; L327-T331 PolarHBondContact O-OG1 2.94Å; I328-T331 PolarHBondContact O-N 3.36Å
332	T	91	Very high	92.2	Very high	51 Å²	51	69.6 Å²	69.6	31%	0.313	35%	0.347	S	S	.	.			trans	-130.8	150.3	-173.9	72.8	0	0	0	0	111.6	I328 L334	I328-T332 VanDerWaalsContact CG2-OG1 3.3Å; I328-T332 WeakPolarHBondContact CG2-OG1 3.47Å; I328-T332 WeakPolarHBondContact O-CB 3.09Å; I328-T332 PolarHBondContact O-N 3.49Å; I328-T332 PolarHBondContact O-OG1 3.36Å; T332-L334 VanDerWaalsContact C-N 3.32Å; T332-L334 PolarHBondContact O-N 2.66Å
333	Q	89.9	Confident	92.3	Very high	204 Å²	204	66.7 Å²	66.7	95%	0.953	33%	0.334	S	S	*	.			trans	-98.6	40	175	-62.6	-176.7	-0.8	0	0	111.6
334	L	88.8	Confident	92.4	Very high	67 Å²	67	62.5 Å²	62.5	35%	0.351	32%	0.32	S	S	.	.			trans	-72.8	152.9	179.3	-69.4	174.2	0	0	0	111.2	I328 T332 I338 R339	I328-L334 HydrophobicContact CG2-CD1 4.12Å; T332-L334 VanDerWaalsContact C-N 3.32Å; T332-L334 PolarHBondContact O-N 2.66Å; L334-I338 HydrophobicContact CD1-CG2 4.28Å; L334-I338 HydrophobicContact CD2-CG2 4.27Å; L334-R339 HydrophobicContact CB-CG 3.56Å; L334-R339 WeakPolarHBondContact O-CD 3.23Å; L334-R339 PolarHBondContact O-NE 2.86Å; L334-R339 PolarHBondContact O-NH2 2.92Å
335	D	89.3	Confident	92.5	Very high	84 Å²	84	63.3 Å²	63.3	45%	0.449	33%	0.331	S	S	.	.			trans	-60.9	154.2	171.2	-172.3	-88.1	0	0	0	111.2	D337 I338 R339	D335-D337 VanDerWaalsContact C-N 3.33Å; D335-D337 PolarHBondContact O-N 3.25Å; D335-D337 PolarHBondContact OD1-N 3.41Å; D335-I338 HydrophobicContact CB-CD1 4.24Å; D335-I338 HydrophobicContact CB-CG1 4.34Å; D335-I338 PolarHBondContact O-N 2.86Å; D335-R339 WeakPolarHBondContact O-CB 3.43Å; D335-R339 VanDerWaalsContact O-CG 3.23Å; D335-R339 WeakPolarHBondContact O-CG 3.28Å; D335-R339 PolarHBondContact O-N 3.44Å; D335-R339 PolarHBondContact O-NE 3.45Å
336	Y	87.4	Confident	92.6	Very high	54 Å²	54	63.9 Å²	63.9	21%	0.212	34%	0.337	C	S	.	.	H	α-helix	trans	-54.9	-45	179.1	177.9	-93.5	0	0	0	113	K283 T286 F325 I338 R339 L340	K283-Y336 HydrophobicContact CB-CE1 4.49Å; K283-Y336 HydrophobicContact CD-CD1 3.73Å; K283-Y336 HydrophobicContact CD-CE1 4.28Å; K283-Y336 HydrophobicContact CD-CG 4.41Å; T286-Y336 WeakPolarHBondContact OG1-CE1 3.36Å; T286-Y336 PolarHBondContact OG1-OH 3.24Å; F325-Y336 HydrophobicContact CE2-CE2 4.47Å; F325-Y336 HydrophobicContact CZ-CE2 4.24Å; Y336-I338 VanDerWaalsContact C-N 3.33Å; Y336-I338 PolarHBondContact O-N 3.11Å; Y336-R339 VanDerWaalsContact N-NH2 3.13Å; Y336-R339 PolarHBondContact O-N 3.32Å; Y336-L340 HydrophobicContact CE1-CD2 4.11Å; Y336-L340 WeakPolarHBondContact O-CB 3.42Å; Y336-L340 PolarHBondContact O-N 3.47Å
337	D	90.4	Very high	92.7	Very high	66 Å²	66	62.9 Å²	62.9	35%	0.353	33%	0.331	S	S	.	.	H	α-helix	trans	-68.8	-37	-175.1	-69.7	-23.9	0	0	0	111.3	S285 D335 T341	S285-D337 VanDerWaalsContact CB-OD1 3.26Å; S285-D337 WeakPolarHBondContact CB-OD1 3.21Å; S285-D337 PolarHBondContact OG-OD1 3.45Å; D335-D337 VanDerWaalsContact C-N 3.33Å; D335-D337 PolarHBondContact O-N 3.25Å; D335-D337 PolarHBondContact OD1-N 3.41Å; D337-T341 WeakPolarHBondContact O-CB 3.36Å; D337-T341 PolarHBondContact O-N 2.83Å; D337-T341 PolarHBondContact O-OG1 2.89Å
338	I	92.6	Very high	92.8	Very high	87 Å²	87	62.4 Å²	62.4	45%	0.446	33%	0.331	S	S	.	.	H	α-helix	trans	-68.2	-45.3	175.3	-58.8	176.2	0	0	0	110	L334 D335 Y336 L340 T341 V342	L334-I338 HydrophobicContact CD1-CG2 4.28Å; L334-I338 HydrophobicContact CD2-CG2 4.27Å; D335-I338 HydrophobicContact CB-CD1 4.24Å; D335-I338 HydrophobicContact CB-CG1 4.34Å; D335-I338 PolarHBondContact O-N 2.86Å; Y336-I338 VanDerWaalsContact C-N 3.33Å; Y336-I338 PolarHBondContact O-N 3.11Å; I338-L340 PolarHBondContact O-N 3.49Å; I338-T341 PolarHBondContact O-N 2.99Å; I338-V342 HydrophobicContact CG2-CG2 4.24Å; I338-V342 VanDerWaalsContact O-CG2 3.31Å; I338-V342 WeakPolarHBondContact O-CG2 3.24Å; I338-V342 PolarHBondContact O-N 2.67Å
339	R	93.4	Very high	93	Very high	53 Å²	53	65.5 Å²	65.5	20%	0.2	35%	0.35	C	S	.	.	H	α-helix	trans	-56.5	-51.3	176.6	-74.3	177.5	-72.6	-171	-6.5	111.1	F325 I328 L334 D335 Y336 T341 V342 S343	F325-R339 HydrophobicContact CE2-CB 4.5Å; I328-R339 HydrophobicContact CG2-CG 3.99Å; L334-R339 HydrophobicContact CB-CG 3.56Å; L334-R339 WeakPolarHBondContact O-CD 3.23Å; L334-R339 PolarHBondContact O-NE 2.86Å; L334-R339 PolarHBondContact O-NH2 2.92Å; D335-R339 WeakPolarHBondContact O-CB 3.43Å; D335-R339 VanDerWaalsContact O-CG 3.23Å; D335-R339 WeakPolarHBondContact O-CG 3.28Å; D335-R339 PolarHBondContact O-N 3.44Å; D335-R339 PolarHBondContact O-NE 3.45Å; Y336-R339 VanDerWaalsContact N-NH2 3.13Å; Y336-R339 PolarHBondContact O-N 3.32Å; R339-T341 VanDerWaalsContact C-N 3.31Å; R339-T341 PolarHBondContact O-N 3.22Å; R339-V342 PolarHBondContact O-N 3.02Å; R339-S343 WeakPolarHBondContact O-CB 3.23Å; R339-S343 PolarHBondContact O-N 2.98Å; R339-S343 PolarHBondContact O-OG 2.87Å
340	L	93.1	Very high	93.1	Very high	15 Å²	15	65.4 Å²	65.4	8%	0.079	35%	0.354	C	S	.	.	H	α-helix	trans	-59.4	-43.3	179.6	-176.1	62.8	0	0	0	111.4	F289 Y336 I338 S343 A344	F289-L340 HydrophobicContact CB-CD2 4.05Å; F289-L340 HydrophobicContact CD1-CD1 4.28Å; F289-L340 HydrophobicContact CD2-CD1 4.05Å; F289-L340 HydrophobicContact CD2-CG 4.45Å; F289-L340 HydrophobicContact CE2-CD1 4.36Å; F289-L340 HydrophobicContact CG-CD1 4.02Å; F289-L340 HydrophobicContact CG-CD2 4.41Å; F289-L340 HydrophobicContact CG-CG 4.5Å; Y336-L340 HydrophobicContact CE1-CD2 4.11Å; Y336-L340 WeakPolarHBondContact O-CB 3.42Å; Y336-L340 PolarHBondContact O-N 3.47Å; I338-L340 PolarHBondContact O-N 3.49Å; L340-S343 PolarHBondContact O-N 3.45Å; L340-A344 WeakPolarHBondContact O-CB 3.3Å; L340-A344 PolarHBondContact O-N 3.4Å
341	T	93.9	Very high	93.3	Very high	87 Å²	87	59.8 Å²	59.8	53%	0.534	33%	0.333	S	S	.	.	H	α-helix	trans	-64.1	-47.6	178.9	-57.5	0	0	0	0	111.8	D337 I338 R339 A344 V345	D337-T341 WeakPolarHBondContact O-CB 3.36Å; D337-T341 PolarHBondContact O-N 2.83Å; D337-T341 PolarHBondContact O-OG1 2.89Å; I338-T341 PolarHBondContact O-N 2.99Å; R339-T341 VanDerWaalsContact C-N 3.31Å; R339-T341 PolarHBondContact O-N 3.22Å; T341-A344 PolarHBondContact O-N 3.35Å; T341-V345 WeakPolarHBondContact O-CG2 3.45Å; T341-V345 PolarHBondContact O-N 2.99Å
342	V	95.1	Very high	93.5	Very high	59 Å²	59	58.4 Å²	58.4	36%	0.358	32%	0.324	S	S	.	.	H	α-helix	trans	-63.7	-44.1	178.4	175.6	0	0	0	0	110.6	I328 I338 R339 A344 V345 V346	I328-V342 HydrophobicContact CD1-CB 4.31Å; I328-V342 HydrophobicContact CD1-CG1 3.69Å; I338-V342 HydrophobicContact CG2-CG2 4.24Å; I338-V342 VanDerWaalsContact O-CG2 3.31Å; I338-V342 WeakPolarHBondContact O-CG2 3.24Å; I338-V342 PolarHBondContact O-N 2.67Å; R339-V342 PolarHBondContact O-N 3.02Å; V342-A344 VanDerWaalsContact C-N 3.31Å; V342-A344 PolarHBondContact O-N 3.33Å; V342-V345 PolarHBondContact O-N 3.36Å; V342-V346 HydrophobicContact CG1-CG2 4.48Å; V342-V346 WeakPolarHBondContact O-CG2 3.21Å; V342-V346 PolarHBondContact O-N 2.78Å
343	S	95.4	Very high	93.5	Very high	0 Å²	0	60.3 Å²	60.3	0%	0	34%	0.335	C	S	.	.	H	α-helix	trans	-59.8	-40.9	175.3	-62.6	0	0	0	0	112	V321 F325 R339 L340 V346 G347	V321-S343 WeakPolarHBondContact CG2-O 3.34Å; F325-S343 VanDerWaalsContact CA-OG 3.24Å; F325-S343 WeakPolarHBondContact CA-OG 3.28Å; F325-S343 PolarHBondContact N-OG 3.2Å; R339-S343 WeakPolarHBondContact O-CB 3.23Å; R339-S343 PolarHBondContact O-N 2.98Å; R339-S343 PolarHBondContact O-OG 2.87Å; L340-S343 PolarHBondContact O-N 3.45Å; S343-V346 PolarHBondContact O-N 3.25Å; S343-G347 PolarHBondContact O-N 3.28Å
344	A	95.5	Very high	93.6	Very high	24 Å²	24	51.5 Å²	51.5	20%	0.198	30%	0.295	C	S	.	.	H	α-helix	trans	-63.6	-42.7	175.9	0	0	0	0	0	112.3	F289 F317 L340 T341 V342 G347 V348	F289-A344 HydrophobicContact CE2-CB 4.23Å; F317-A344 WeakPolarHBondContact CE2-O 3.38Å; L340-A344 WeakPolarHBondContact O-CB 3.3Å; L340-A344 PolarHBondContact O-N 3.4Å; T341-A344 PolarHBondContact O-N 3.35Å; V342-A344 VanDerWaalsContact C-N 3.31Å; V342-A344 PolarHBondContact O-N 3.33Å; A344-G347 WeakPolarHBondContact O-CA 3.43Å; A344-G347 PolarHBondContact O-N 3.36Å; A344-V348 PolarHBondContact O-N 3.27Å
345	V	96.4	Very high	93.8	Very high	91 Å²	91	49.7 Å²	49.7	55%	0.552	29%	0.287	S	S	*	.	H	α-helix	trans	-62.1	-46.5	176	172.2	0	0	0	0	111.1	T341 V342 G347 V348 V349	T341-V345 WeakPolarHBondContact O-CG2 3.45Å; T341-V345 PolarHBondContact O-N 2.99Å; V342-V345 PolarHBondContact O-N 3.36Å; V345-G347 PolarHBondContact O-N 3.48Å; V345-V348 WeakPolarHBondContact O-CB 3.44Å; V345-V348 PolarHBondContact O-N 3.43Å; V345-V348 VanDerWaalsContact O-N 3.17Å; V345-V349 PolarHBondContact O-N 3.02Å
346	V	96.3	Very high	93.8	Very high	40 Å²	40	50.1 Å²	50.1	24%	0.242	29%	0.287	C	S	.	.	H	α-helix	trans	-64.3	-34.2	175.2	178.2	0	0	0	0	111.1	F324 V342 S343 V348 V349 G350	F324-V346 HydrophobicContact CB-CG1 4.08Å; F324-V346 HydrophobicContact CD1-CG1 4.05Å; F324-V346 HydrophobicContact CD2-CG1 3.31Å; F324-V346 HydrophobicContact CE1-CG1 4.31Å; F324-V346 HydrophobicContact CE2-CG1 3.63Å; F324-V346 HydrophobicContact CG-CB 4.44Å; F324-V346 HydrophobicContact CG-CG1 3.54Å; F324-V346 HydrophobicContact CZ-CG1 4.12Å; V342-V346 HydrophobicContact CG1-CG2 4.48Å; V342-V346 WeakPolarHBondContact O-CG2 3.21Å; V342-V346 PolarHBondContact O-N 2.78Å; S343-V346 PolarHBondContact O-N 3.25Å; V346-V348 PolarHBondContact O-N 3.4Å; V346-V349 WeakPolarHBondContact O-CB 3.41Å; V346-V349 PolarHBondContact O-N 3.28Å; V346-G350 PolarHBondContact O-N 3.43Å
347	G	96.5	Very high	93.7	Very high	0 Å²	0	49.2 Å²	49.2	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-53.4	-49.7	169.6	0	0	0	0	0	112.7	F317 S343 A344 V345 V349 G350 G351	F317-G347 WeakPolarHBondContact CA-O 3.36Å; S343-G347 PolarHBondContact O-N 3.28Å; A344-G347 WeakPolarHBondContact O-CA 3.43Å; A344-G347 PolarHBondContact O-N 3.36Å; V345-G347 PolarHBondContact O-N 3.48Å; G347-V349 VanDerWaalsContact C-N 3.28Å; G347-V349 PolarHBondContact O-N 3.11Å; G347-G350 PolarHBondContact O-N 3.5Å; G347-G350 VanDerWaalsContact O-N 3.1Å; G347-G351 PolarHBondContact O-N 3.37Å
348	V	96.8	Very high	93.7	Very high	69 Å²	69	46.3 Å²	46.3	42%	0.418	27%	0.273	S	S	.	.	H	α-helix	trans	-58.9	-43.2	177.7	175.4	0	0	0	0	110.5	F313 F317 A344 V345 V346 G350 G351 V352	F313-V348 HydrophobicContact CE2-CG1 4.26Å; F313-V348 HydrophobicContact CZ-CG1 4.3Å; F317-V348 HydrophobicContact CD2-CG2 4.19Å; F317-V348 HydrophobicContact CE2-CG2 4.04Å; A344-V348 PolarHBondContact O-N 3.27Å; V345-V348 WeakPolarHBondContact O-CB 3.44Å; V345-V348 PolarHBondContact O-N 3.43Å; V345-V348 VanDerWaalsContact O-N 3.17Å; V346-V348 PolarHBondContact O-N 3.4Å; V348-G350 PolarHBondContact O-N 2.8Å; V348-G351 PolarHBondContact O-N 3.01Å; V348-V352 WeakPolarHBondContact O-CG2 3.5Å; V348-V352 PolarHBondContact O-N 3.48Å
349	V	96.6	Very high	93.4	Very high	84 Å²	84	47 Å²	47	51%	0.509	27%	0.27	S	S	.	.	H	α-helix	trans	-60.9	-45.3	175.3	179.8	0	0	0	0	110.8	V345 V346 G347 G351 V352 V353	V345-V349 PolarHBondContact O-N 3.02Å; V346-V349 WeakPolarHBondContact O-CB 3.41Å; V346-V349 PolarHBondContact O-N 3.28Å; G347-V349 VanDerWaalsContact C-N 3.28Å; G347-V349 PolarHBondContact O-N 3.11Å; V349-G351 PolarHBondContact O-N 3.28Å; V349-V352 PolarHBondContact O-N 3.37Å; V349-V353 HydrophobicContact CG1-CG2 4.26Å; V349-V353 WeakPolarHBondContact O-CB 3.46Å; V349-V353 VanDerWaalsContact O-CG2 3.26Å; V349-V353 WeakPolarHBondContact O-CG2 3.38Å; V349-V353 PolarHBondContact O-N 3.15Å
350	G	94.5	Very high	92.9	Very high	20 Å²	20	50.2 Å²	50.2	21%	0.206	28%	0.282	C	S	.	.	H	α-helix	trans	-59	-45.2	176.6	0	0	0	0	0	113.3	V346 G347 V348 V353 L354	V346-G350 PolarHBondContact O-N 3.43Å; G347-G350 PolarHBondContact O-N 3.5Å; G347-G350 VanDerWaalsContact O-N 3.1Å; V348-G350 PolarHBondContact O-N 2.8Å; G350-V353 PolarHBondContact O-N 3.29Å; G350-L354 PolarHBondContact O-N 3.44Å
351	G	94.9	Very high	92.2	Very high	0 Å²	0	56.2 Å²	56.2	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-60.5	-45.6	174.2	0	0	0	0	0	112.5	F313 G347 V348 V349 L354 V355	F313-G351 WeakPolarHBondContact O-CA 3.39Å; G347-G351 PolarHBondContact O-N 3.37Å; V348-G351 PolarHBondContact O-N 3.01Å; V349-G351 PolarHBondContact O-N 3.28Å; G351-L354 PolarHBondContact O-N 2.9Å; G351-V355 WeakPolarHBondContact O-CG2 3.49Å; G351-V355 PolarHBondContact O-N 3.09Å
352	V	95.1	Very high	91.2	Very high	72 Å²	72	53 Å²	53	44%	0.436	29%	0.292	S	S	.	.	H	α-helix	trans	-62.5	-44.7	176.2	171.7	0	0	0	0	111.2	F313 V348 V349 L354 V355 M356	F313-V352 HydrophobicContact CE2-CG2 4.19Å; V348-V352 WeakPolarHBondContact O-CG2 3.5Å; V348-V352 PolarHBondContact O-N 3.48Å; V349-V352 PolarHBondContact O-N 3.37Å; V352-L354 VanDerWaalsContact C-N 3.32Å; V352-L354 PolarHBondContact O-N 3.26Å; V352-V355 PolarHBondContact O-N 3.46Å; V352-M356 HydrophobicContact CG1-CG 4Å; V352-M356 VanDerWaalsContact O-CB 3.31Å; V352-M356 WeakPolarHBondContact O-CB 3.45Å; V352-M356 WeakPolarHBondContact O-CG 3.28Å; V352-M356 PolarHBondContact O-N 2.82Å
353	V	92.3	Very high	90.3	Very high	90 Å²	90	52.6 Å²	52.6	55%	0.545	29%	0.292	S	S	.	.	H	α-helix	trans	-60.4	-42.5	178.5	168.3	0	0	0	0	111	V349 G350 M356 S357	V349-V353 HydrophobicContact CG1-CG2 4.26Å; V349-V353 WeakPolarHBondContact O-CB 3.46Å; V349-V353 VanDerWaalsContact O-CG2 3.26Å; V349-V353 WeakPolarHBondContact O-CG2 3.38Å; V349-V353 PolarHBondContact O-N 3.15Å; G350-V353 PolarHBondContact O-N 3.29Å; V353-M356 PolarHBondContact O-N 3.32Å; V353-S357 WeakPolarHBondContact O-CB 3.44Å; V353-S357 PolarHBondContact O-N 2.98Å; V353-S357 PolarHBondContact O-OG 3.39Å
354	L	91.1	Very high	89.3	Confident	19 Å²	19	54.2 Å²	54.2	10%	0.099	30%	0.301	C	S	.	.	H	α-helix	trans	-66	-43.5	178.7	-165.5	61.1	0	0	0	111.5	L312 G350 G351 V352 M356 S357 W358 V370	L312-L354 HydrophobicContact CD2-CD2 4.37Å; L312-L354 HydrophobicContact CD2-CG 4.45Å; L312-L354 WeakPolarHBondContact O-CD2 3.12Å; G350-L354 PolarHBondContact O-N 3.44Å; G351-L354 PolarHBondContact O-N 2.9Å; V352-L354 VanDerWaalsContact C-N 3.32Å; V352-L354 PolarHBondContact O-N 3.26Å; L354-M356 PolarHBondContact O-N 2.76Å; L354-S357 PolarHBondContact O-N 3.48Å; L354-S357 PolarHBondContact O-OG 2.95Å; L354-W358 PolarHBondContact O-N 3.27Å; L354-W358 VanDerWaalsContact O-N 3.17Å; L354-V370 HydrophobicContact CD1-CB 4.44Å; L354-V370 HydrophobicContact CD1-CG2 4.16Å; L354-V370 HydrophobicContact CD2-CB 4.41Å; L354-V370 HydrophobicContact CD2-CG1 3.95Å
355	V	92.3	Very high	88.3	Confident	30 Å²	30	57 Å²	57	18%	0.182	31%	0.311	C	S	.	.	H	α-helix	trans	-62.4	-43.1	174.5	174	0	0	0	0	111.7	K309 L312 F313 G351 V352 W358 W359	K309-V355 WeakPolarHBondContact O-CG2 3.27Å; L312-V355 HydrophobicContact CB-CG2 3.89Å; F313-V355 HydrophobicContact CB-CG2 3.9Å; G351-V355 WeakPolarHBondContact O-CG2 3.49Å; G351-V355 PolarHBondContact O-N 3.09Å; V352-V355 PolarHBondContact O-N 3.46Å; V355-W358 PolarHBondContact O-N 2.78Å; V355-W359 WeakPolarHBondContact O-CB 3.41Å; V355-W359 PolarHBondContact O-N 3.17Å
356	M	89.6	Confident	87.4	Confident	92 Å²	92	55.2 Å²	55.2	45%	0.453	31%	0.306	S	S	.	.	H	α-helix	trans	-68.4	-36.1	-179.6	-73.2	-59.9	-69.1	0	0	112.1	V352 V353 L354 W359 R360	V352-M356 HydrophobicContact CG1-CG 4Å; V352-M356 VanDerWaalsContact O-CB 3.31Å; V352-M356 WeakPolarHBondContact O-CB 3.45Å; V352-M356 WeakPolarHBondContact O-CG 3.28Å; V352-M356 PolarHBondContact O-N 2.82Å; V353-M356 PolarHBondContact O-N 3.32Å; L354-M356 PolarHBondContact O-N 2.76Å; M356-W359 HydrophobicContact CE-CE3 3.6Å; M356-W359 HydrophobicContact CE-CZ3 3.78Å; M356-W359 PolarHBondContact O-N 2.75Å; M356-W359 HydrophobicContact SD-CE3 4.14Å; M356-R360 VanDerWaalsContact O-CB 3.23Å; M356-R360 WeakPolarHBondContact O-CB 3.37Å; M356-R360 PolarHBondContact O-N 2.98Å
357	S	86.6	Confident	86.6	Confident	36 Å²	36	53.3 Å²	53.3	25%	0.252	30%	0.295	S	S	.	.	H	α-helix	trans	-64.8	-44.3	175.9	71.7	0	0	0	0	111.1	V353 L354 R360 F361	V353-S357 WeakPolarHBondContact O-CB 3.44Å; V353-S357 PolarHBondContact O-N 2.98Å; V353-S357 PolarHBondContact O-OG 3.39Å; L354-S357 PolarHBondContact O-N 3.48Å; L354-S357 PolarHBondContact O-OG 2.95Å; S357-R360 PolarHBondContact O-N 2.78Å; S357-F361 WeakPolarHBondContact O-CB 3.43Å; S357-F361 VanDerWaalsContact O-CD2 3.32Å; S357-F361 WeakPolarHBondContact O-CD2 3.4Å; S357-F361 PolarHBondContact O-N 2.73Å
358	W	89.4	Confident	85.9	Confident	4 Å²	4	53.6 Å²	53.6	2%	0.015	30%	0.297	C	S	.	.	H	α-helix	trans	-60.4	-47.3	170.6	174.4	72.6	0	0	0	111.9	F308 K309 L312 L354 V355 R360 G362 P506 P509	F308-W358 HydrophobicContact CD1-CD2 4.26Å; F308-W358 AromaticContact CD1-CE2 3.85Å; F308-W358 HydrophobicContact CD1-CZ2 4.05Å; F308-W358 AromaticContact CE1-CD1 3.69Å; F308-W358 HydrophobicContact CE1-CD2 4.12Å; F308-W358 AromaticContact CE1-CE2 3.79Å; F308-W358 HydrophobicContact CE1-CG 4.06Å; F308-W358 HydrophobicContact CE1-CZ2 4.41Å; F308-W358 AromaticContact CE1-NE1 3.5Å; K309-W358 HydrophobicContact CG-CZ3 3.91Å; L312-W358 HydrophobicContact CD1-CB 3.57Å; L312-W358 HydrophobicContact CD1-CD2 4.09Å; L312-W358 HydrophobicContact CD1-CE3 4.43Å; L312-W358 HydrophobicContact CD1-CG 3.71Å; L354-W358 PolarHBondContact O-N 3.27Å; L354-W358 VanDerWaalsContact O-N 3.17Å; V355-W358 PolarHBondContact O-N 2.78Å; W358-R360 VanDerWaalsContact C-N 3.32Å; W358-R360 PolarHBondContact O-N 3.47Å; W358-G362 VanDerWaalsContact O-CA 3.24Å; W358-G362 WeakPolarHBondContact O-CA 3.41Å; W358-G362 PolarHBondContact O-N 3.44Å; W358-P506 HydrophobicContact CH2-CG 4.44Å; W358-P506 HydrophobicContact CZ2-CB 4.39Å; W358-P506 HydrophobicContact CZ2-CG 4.01Å; W358-P509 HydrophobicContact CH2-CG 4.13Å; W358-P509 HydrophobicContact CZ3-CG 4.21Å
359	W	86.5	Confident	85.5	Confident	103 Å²	103	53.1 Å²	53.1	39%	0.39	29%	0.293	S	S	.	.	H	α-helix	trans	-59.5	-42.1	-178.7	-179.5	73.7	0	0	0	112.1	V355 M356 Y510	V355-W359 WeakPolarHBondContact O-CB 3.41Å; V355-W359 PolarHBondContact O-N 3.17Å; M356-W359 HydrophobicContact CE-CE3 3.6Å; M356-W359 HydrophobicContact CE-CZ3 3.78Å; M356-W359 PolarHBondContact O-N 2.75Å; M356-W359 HydrophobicContact SD-CE3 4.14Å; W359-Y510 WeakPolarHBondContact O-CB 3.28Å
360	R	83.4	Confident	85.1	Confident	119 Å²	119	50.7 Å²	50.7	45%	0.449	28%	0.279	S	S	.	.	H	α-helix	trans	-83.9	-41.3	-174	179.5	59.2	-178.6	81.7	1.2	114.2	M356 S357 W358	M356-R360 VanDerWaalsContact O-CB 3.23Å; M356-R360 WeakPolarHBondContact O-CB 3.37Å; M356-R360 PolarHBondContact O-N 2.98Å; S357-R360 PolarHBondContact O-N 2.78Å; W358-R360 VanDerWaalsContact C-N 3.32Å; W358-R360 PolarHBondContact O-N 3.47Å
361	F	77.9	Confident	84.9	Confident	141 Å²	141	49.8 Å²	49.8	62%	0.618	27%	0.269	S	S	*	.	H	α-helix	trans	-100	-18.8	-174	-61.4	-69.6	0	0	0	112.8	S357 S363	S357-F361 WeakPolarHBondContact O-CB 3.43Å; S357-F361 VanDerWaalsContact O-CD2 3.32Å; S357-F361 WeakPolarHBondContact O-CD2 3.4Å; S357-F361 PolarHBondContact O-N 2.73Å; F361-S363 PolarHBondContact O-N 3.04Å
362	G	73.3	Confident	84.7	Confident	20 Å²	20	49.9 Å²	49.9	21%	0.206	27%	0.271	C	S	.	.			trans	60.6	11.7	-173.2	0	0	0	0	0	113.9	W358 V364	W358-G362 VanDerWaalsContact O-CA 3.24Å; W358-G362 WeakPolarHBondContact O-CA 3.41Å; W358-G362 PolarHBondContact O-N 3.44Å; G362-V364 PolarHBondContact O-N 3.36Å
363	S	75.2	Confident	84.7	Confident	51 Å²	51	48.3 Å²	48.3	36%	0.357	26%	0.26	S	S	.	.			trans	-77.6	89.8	-178	-174.7	0	0	0	0	109.9	F361 M365 A366 C367	F361-S363 PolarHBondContact O-N 3.04Å; S363-M365 PolarHBondContact O-N 3.28Å; S363-A366 PolarHBondContact OG-N 3.37Å; S363-C367 PolarHBondContact O-SG 2.95Å; S363-C367 VanDerWaalsContact O-SG 3.41Å
364	V	74.3	Confident	84.8	Confident	33 Å²	33	45.2 Å²	45.2	20%	0.2	24%	0.239	C	C	.	.	H	α-helix	trans	-59.5	-36.6	173.4	177.6	0	0	0	0	110.4	G362 A366 C367 V368 F505	G362-V364 PolarHBondContact O-N 3.36Å; V364-A366 PolarHBondContact O-N 2.91Å; V364-C367 PolarHBondContact O-N 3.38Å; V364-V368 HydrophobicContact CG1-CG2 3.94Å; V364-V368 VanDerWaalsContact O-CG2 3.27Å; V364-V368 WeakPolarHBondContact O-CG2 3.45Å; V364-V368 PolarHBondContact O-N 3.03Å; V364-F505 HydrophobicContact CG1-CB 4.25Å; V364-F505 HydrophobicContact CG1-CD1 3.78Å; V364-F505 HydrophobicContact CG1-CD2 3.51Å; V364-F505 HydrophobicContact CG1-CE1 3.95Å; V364-F505 HydrophobicContact CG1-CE2 3.69Å; V364-F505 HydrophobicContact CG1-CG 3.56Å; V364-F505 HydrophobicContact CG1-CZ 3.9Å; V364-F505 HydrophobicContact CG2-CB 4.21Å; V364-F505 HydrophobicContact CG2-CG 4.4Å
365	M	76.1	Confident	85	Confident	83 Å²	83	44.7 Å²	44.7	41%	0.409	24%	0.236	S	C	.	.	H	α-helix	trans	-63.9	-42.4	-177.3	-62	-53.6	-69.4	0	0	112.9	S363 C367 V368 V369 V417	S363-M365 PolarHBondContact O-N 3.28Å; M365-C367 VanDerWaalsContact C-N 3.27Å; M365-C367 PolarHBondContact O-N 3.18Å; M365-V368 PolarHBondContact O-N 3.47Å; M365-V369 VanDerWaalsContact O-CG2 3.32Å; M365-V369 WeakPolarHBondContact O-CG2 3.37Å; M365-V369 PolarHBondContact O-N 2.93Å; M365-V417 HydrophobicContact CE-CB 4.21Å; M365-V417 HydrophobicContact CE-CG1 3.72Å; M365-V417 HydrophobicContact CE-CG2 4.07Å
366	A	76.8	Confident	85.2	Confident	53 Å²	53	43.2 Å²	43.2	44%	0.438	23%	0.228	S	C	.	.	H	α-helix	trans	-62.8	-37.3	177.6	0	0	0	0	0	112	S363 V364 V370	S363-A366 PolarHBondContact OG-N 3.37Å; V364-A366 PolarHBondContact O-N 2.91Å; A366-V370 PolarHBondContact O-N 3.44Å
367	C	80.1	Confident	85.5	Confident	1 Å²	1	40.1 Å²	40.1	1%	0.007	21%	0.212	C	C	.	.	H	α-helix	trans	-70.9	-44	178.2	-58.5	0	0	0	0	111.7	L312 S363 V364 M365 V369 V370 V371	L312-C367 HydrophobicContact CD2-CB 3.66Å; S363-C367 PolarHBondContact O-SG 2.95Å; S363-C367 VanDerWaalsContact O-SG 3.41Å; V364-C367 PolarHBondContact O-N 3.38Å; M365-C367 VanDerWaalsContact C-N 3.27Å; M365-C367 PolarHBondContact O-N 3.18Å; C367-V369 PolarHBondContact O-N 2.91Å; C367-V370 PolarHBondContact O-N 3.44Å; C367-V370 VanDerWaalsContact O-N 3.16Å; C367-V371 WeakPolarHBondContact O-CG2 3.23Å; C367-V371 PolarHBondContact O-N 2.9Å
368	V	81.9	Confident	85.9	Confident	6 Å²	6	38.7 Å²	38.7	4%	0.036	20%	0.201	C	C	.	.	H	α-helix	trans	-63.2	-31.5	177.3	172.4	0	0	0	0	111.5	V364 M365 G372 P420 F505	V364-V368 HydrophobicContact CG1-CG2 3.94Å; V364-V368 VanDerWaalsContact O-CG2 3.27Å; V364-V368 WeakPolarHBondContact O-CG2 3.45Å; V364-V368 PolarHBondContact O-N 3.03Å; M365-V368 PolarHBondContact O-N 3.47Å; V368-G372 PolarHBondContact O-N 3.43Å; V368-P420 HydrophobicContact CB-CB 4.45Å; V368-P420 HydrophobicContact CG1-CB 3.88Å; V368-P420 HydrophobicContact CG2-CB 4.03Å; V368-F505 HydrophobicContact CG2-CE1 4.17Å; V368-F505 HydrophobicContact CG2-CE2 4.48Å; V368-F505 HydrophobicContact CG2-CZ 3.74Å
369	V	87.4	Confident	86.3	Confident	58 Å²	58	41 Å²	41	35%	0.352	22%	0.216	S	C	.	.	H	α-helix	trans	-64.8	-47	172.8	170.1	0	0	0	0	111.2	M365 C367 V371 G372 L373	M365-V369 VanDerWaalsContact O-CG2 3.32Å; M365-V369 WeakPolarHBondContact O-CG2 3.37Å; M365-V369 PolarHBondContact O-N 2.93Å; C367-V369 PolarHBondContact O-N 2.91Å; V369-V371 VanDerWaalsContact C-N 3.35Å; V369-V371 PolarHBondContact O-N 3.3Å; V369-G372 PolarHBondContact O-N 2.93Å; V369-L373 HydrophobicContact CG1-CD1 4.12Å; V369-L373 HydrophobicContact CG1-CG 4.42Å; V369-L373 WeakPolarHBondContact O-CB 3.44Å; V369-L373 VanDerWaalsContact O-CG 3.28Å; V369-L373 WeakPolarHBondContact O-CG 3.5Å; V369-L373 PolarHBondContact O-N 3.44Å
370	V	87.5	Confident	86.7	Confident	33 Å²	33	36.1 Å²	36.1	20%	0.2	20%	0.197	C	C	.	.	H	α-helix	trans	-61.5	-44.5	177.7	176.4	0	0	0	0	111	L354 A366 C367 L373 M374	L354-V370 HydrophobicContact CD1-CB 4.44Å; L354-V370 HydrophobicContact CD1-CG2 4.16Å; L354-V370 HydrophobicContact CD2-CB 4.41Å; L354-V370 HydrophobicContact CD2-CG1 3.95Å; A366-V370 PolarHBondContact O-N 3.44Å; C367-V370 PolarHBondContact O-N 3.44Å; C367-V370 VanDerWaalsContact O-N 3.16Å; V370-L373 PolarHBondContact O-N 3.05Å; V370-M374 PolarHBondContact O-N 3.48Å
371	V	90.3	Very high	87.3	Confident	1 Å²	1	30.5 Å²	30.5	1%	0.006	18%	0.176	C	C	.	.	H	α-helix	trans	-62.2	-47.6	176	175.8	0	0	0	0	110.5	M315 C367 V369 L373 M374 L375 T427	M315-V371 HydrophobicContact CB-CG2 4.18Å; M315-V371 HydrophobicContact CG-CG2 4.07Å; C367-V371 WeakPolarHBondContact O-CG2 3.23Å; C367-V371 PolarHBondContact O-N 2.9Å; V369-V371 VanDerWaalsContact C-N 3.35Å; V369-V371 PolarHBondContact O-N 3.3Å; V371-L373 VanDerWaalsContact C-N 3.29Å; V371-L373 PolarHBondContact O-N 3.25Å; V371-M374 WeakPolarHBondContact O-CB 3.31Å; V371-M374 PolarHBondContact O-N 3.43Å; V371-L375 PolarHBondContact O-N 2.92Å; V371-T427 HydrophobicContact CG1-CG2 3.43Å; V371-T427 VanDerWaalsContact CG1-CG2 3.43Å; V371-T427 WeakPolarHBondContact O-CG2 3.33Å
372	G	92.6	Very high	88.1	Confident	3 Å²	3	26.1 Å²	26.1	3%	0.031	16%	0.161	C	C	.	.	H	α-helix	trans	-62.8	-31.9	177.8	0	0	0	0	0	113.6	V368 V369 M374 L375 G376	V368-G372 PolarHBondContact O-N 3.43Å; V369-G372 PolarHBondContact O-N 2.93Å; G372-M374 VanDerWaalsContact C-N 3.35Å; G372-L375 PolarHBondContact O-N 3.18Å; G372-G376 PolarHBondContact O-N 3.06Å
373	L	93.9	Very high	89.1	Confident	39 Å²	39	27.7 Å²	27.7	20%	0.204	17%	0.166	C	C	.	.	H	α-helix	trans	-66.5	-34	172.3	-75.3	170.1	0	0	0	112.3	V369 V370 V371 G376 F377 M409 V410 P413	V369-L373 HydrophobicContact CG1-CD1 4.12Å; V369-L373 HydrophobicContact CG1-CG 4.42Å; V369-L373 WeakPolarHBondContact O-CB 3.44Å; V369-L373 VanDerWaalsContact O-CG 3.28Å; V369-L373 WeakPolarHBondContact O-CG 3.5Å; V369-L373 PolarHBondContact O-N 3.44Å; V370-L373 PolarHBondContact O-N 3.05Å; V371-L373 VanDerWaalsContact C-N 3.29Å; V371-L373 PolarHBondContact O-N 3.25Å; L373-G376 CarbonylContact O-C 3.04Å; L373-G376 PolarHBondContact O-N 2.94Å; L373-F377 VanDerWaalsContact O-CB 3.31Å; L373-F377 WeakPolarHBondContact O-CB 3.44Å; L373-F377 PolarHBondContact O-N 3.07Å; L373-M409 HydrophobicContact CD2-CE 4.02Å; L373-M409 HydrophobicContact CD2-CG 3.99Å; L373-M409 HydrophobicContact CD2-SD 4.35Å; L373-V410 HydrophobicContact CD2-CG2 4.36Å; L373-P413 HydrophobicContact CD2-CG 3.94Å; L373-P413 HydrophobicContact CG-CG 4.17Å
374	M	94.1	Very high	89.9	Confident	25 Å²	25	25.8 Å²	25.8	12%	0.123	15%	0.152	C	C	.	.	H	α-helix	trans	-66.8	-43	175	-68.1	-62.6	-65.1	0	0	111.7	F319 V370 V371 G372 G376 F377 L378	F319-M374 HydrophobicContact CB-SD 3.95Å; F319-M374 HydrophobicContact CD2-SD 4.04Å; V370-M374 PolarHBondContact O-N 3.48Å; V371-M374 WeakPolarHBondContact O-CB 3.31Å; V371-M374 PolarHBondContact O-N 3.43Å; G372-M374 VanDerWaalsContact C-N 3.35Å; M374-G376 VanDerWaalsContact C-N 3.33Å; M374-F377 PolarHBondContact O-N 3.47Å; M374-L378 PolarHBondContact O-N 3.36Å; M374-L378 VanDerWaalsContact O-N 3.07Å
375	L	95.3	Very high	90.7	Very high	7 Å²	7	25 Å²	25	4%	0.037	15%	0.146	C	C	.	.	H	α-helix	trans	-63.5	-43.1	171.4	-176.4	61.5	0	0	0	110.9	V371 G372 F377 L378 V379 F416 V426 T427 V430	V371-L375 PolarHBondContact O-N 2.92Å; G372-L375 PolarHBondContact O-N 3.18Å; L375-F377 VanDerWaalsContact C-N 3.34Å; L375-F377 PolarHBondContact O-N 3.04Å; L375-L378 PolarHBondContact O-N 3.5Å; L375-V379 HydrophobicContact CD1-CG2 4.28Å; L375-V379 HydrophobicContact CG-CG2 4.46Å; L375-V379 WeakPolarHBondContact O-CG2 3.2Å; L375-V379 PolarHBondContact O-N 2.71Å; L375-F416 HydrophobicContact CD2-CD2 4.34Å; L375-F416 HydrophobicContact CD2-CE2 3.71Å; L375-F416 HydrophobicContact CD2-CZ 4.43Å; L375-V426 HydrophobicContact CD2-CG1 4.02Å; L375-T427 HydrophobicContact CB-CG2 3.91Å; L375-V430 HydrophobicContact CD1-CB 4.12Å; L375-V430 HydrophobicContact CD1-CG1 4.09Å
376	G	96.3	Very high	91.2	Very high	0 Å²	0	23.6 Å²	23.6	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-51.3	-51.2	173.6	0	0	0	0	0	112.9	G372 L373 M374 V379 A380	G372-G376 PolarHBondContact O-N 3.06Å; L373-G376 CarbonylContact O-C 3.04Å; L373-G376 PolarHBondContact O-N 2.94Å; M374-G376 VanDerWaalsContact C-N 3.33Å; G376-V379 PolarHBondContact O-N 3.05Å; G376-A380 VanDerWaalsContact O-CB 3.3Å; G376-A380 WeakPolarHBondContact O-CB 3.39Å; G376-A380 PolarHBondContact O-N 3.31Å
377	F	96.3	Very high	91.6	Very high	26 Å²	26	25 Å²	25	11%	0.114	15%	0.147	C	C	.	.	H	α-helix	trans	-60.4	-47.8	178.5	174.9	-88.1	0	0	0	111	F322 L373 M374 L375 A380 A381 F405 M409 T452 I455	F322-F377 AromaticContact CE1-CE2 3.71Å; F322-F377 HydrophobicContact CE1-CE2 3.71Å; F322-F377 AromaticContact CE1-CZ 3.92Å; F322-F377 HydrophobicContact CE1-CZ 3.92Å; F322-F377 HydrophobicContact CE2-CE2 4.4Å; F322-F377 AromaticContact CE2-CZ 3.77Å; F322-F377 HydrophobicContact CE2-CZ 3.77Å; F322-F377 HydrophobicContact CZ-CE1 4.5Å; F322-F377 AromaticContact CZ-CE2 3.62Å; F322-F377 HydrophobicContact CZ-CE2 3.62Å; F322-F377 AromaticContact CZ-CZ 3.42Å; F322-F377 HydrophobicContact CZ-CZ 3.42Å; F322-F377 VanDerWaalsContact CZ-CZ 3.42Å; L373-F377 VanDerWaalsContact O-CB 3.31Å; L373-F377 WeakPolarHBondContact O-CB 3.44Å; L373-F377 PolarHBondContact O-N 3.07Å; M374-F377 PolarHBondContact O-N 3.47Å; L375-F377 VanDerWaalsContact C-N 3.34Å; L375-F377 PolarHBondContact O-N 3.04Å; F377-A380 PolarHBondContact O-N 3.34Å; F377-A381 VanDerWaalsContact O-CB 3.25Å; F377-A381 WeakPolarHBondContact O-CB 3.43Å; F377-A381 PolarHBondContact O-N 3.48Å; F377-F405 AromaticContact CD2-CE1 3.82Å; F377-F405 HydrophobicContact CD2-CE1 3.82Å; F377-F405 AromaticContact CD2-CZ 3.43Å; F377-F405 HydrophobicContact CD2-CZ 3.43Å; F377-F405 VanDerWaalsContact CD2-CZ 3.43Å; F377-F405 HydrophobicContact CE2-CE1 4.14Å; F377-F405 AromaticContact CE2-CZ 3.62Å; F377-F405 HydrophobicContact CE2-CZ 3.62Å; F377-F405 HydrophobicContact CG-CZ 4.18Å; F377-M409 HydrophobicContact CB-CG 4.44Å; F377-M409 HydrophobicContact CB-SD 4.43Å; F377-T452 HydrophobicContact CE1-CG2 3.84Å; F377-I455 HydrophobicContact CE2-CG2 3.84Å; F377-I455 HydrophobicContact CZ-CB 4.34Å; F377-I455 HydrophobicContact CZ-CG2 3.95Å
378	L	96.4	Very high	91.8	Very high	7 Å²	7	29.6 Å²	29.6	4%	0.037	17%	0.171	C	C	.	.	H	α-helix	trans	-64.8	-42.7	-179.3	-175.6	58.7	0	0	0	111.8	M374 L375 A381 V382 V430 V431 Y434 I451 T452 W484	M374-L378 PolarHBondContact O-N 3.36Å; M374-L378 VanDerWaalsContact O-N 3.07Å; L375-L378 PolarHBondContact O-N 3.5Å; L378-A381 PolarHBondContact O-N 2.92Å; L378-V382 VanDerWaalsContact O-CG2 3.24Å; L378-V382 WeakPolarHBondContact O-CG2 3.24Å; L378-V382 PolarHBondContact O-N 3.47Å; L378-V430 HydrophobicContact CD2-CG1 3.98Å; L378-V431 HydrophobicContact CD2-CG2 4.01Å; L378-Y434 HydrophobicContact CD1-CD1 3.72Å; L378-Y434 HydrophobicContact CD1-CD2 4.23Å; L378-Y434 HydrophobicContact CD1-CE1 3.83Å; L378-Y434 HydrophobicContact CD1-CE2 4.33Å; L378-Y434 HydrophobicContact CD1-CG 3.93Å; L378-Y434 HydrophobicContact CD2-CD1 4.31Å; L378-Y434 HydrophobicContact CD2-CG 4.15Å; L378-I451 HydrophobicContact CD1-CG2 4.31Å; L378-T452 HydrophobicContact CD1-CG2 4.25Å; L378-W484 HydrophobicContact CD2-CZ2 4.09Å; L378-W484 HydrophobicContact CG-CZ2 4.48Å
379	V	96.4	Very high	91.9	Very high	53 Å²	53	29.5 Å²	29.5	32%	0.321	17%	0.172	S	C	.	.	H	α-helix	trans	-66.9	-42.9	177.1	172.5	0	0	0	0	111.4	L375 G376 A381 V382 V383 I408 L412	L375-V379 HydrophobicContact CD1-CG2 4.28Å; L375-V379 HydrophobicContact CG-CG2 4.46Å; L375-V379 WeakPolarHBondContact O-CG2 3.2Å; L375-V379 PolarHBondContact O-N 2.71Å; G376-V379 PolarHBondContact O-N 3.05Å; V379-A381 VanDerWaalsContact C-N 3.3Å; V379-A381 PolarHBondContact O-N 2.99Å; V379-V382 PolarHBondContact O-N 3.03Å; V379-V383 HydrophobicContact CG1-CG2 4.41Å; V379-V383 WeakPolarHBondContact O-CG2 3.34Å; V379-V383 PolarHBondContact O-N 3.4Å; V379-I408 HydrophobicContact CG1-CG2 4.41Å; V379-L412 HydrophobicContact CB-CD1 3.47Å; V379-L412 VanDerWaalsContact CB-CD1 3.47Å; V379-L412 HydrophobicContact CG1-CD1 3.78Å; V379-L412 HydrophobicContact CG2-CD1 3.64Å
380	A	96.3	Very high	91.9	Very high	0 Å²	0	28 Å²	28	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-60.1	-42.3	175.1	0	0	0	0	0	111.5	G376 F377 V383 L384 F405 I408	G376-A380 VanDerWaalsContact O-CB 3.3Å; G376-A380 WeakPolarHBondContact O-CB 3.39Å; G376-A380 PolarHBondContact O-N 3.31Å; F377-A380 PolarHBondContact O-N 3.34Å; A380-V383 PolarHBondContact O-N 2.89Å; A380-L384 WeakPolarHBondContact O-CG 3.33Å; A380-L384 PolarHBondContact O-N 2.88Å; A380-F405 HydrophobicContact CB-CD2 3.65Å; A380-F405 HydrophobicContact CB-CE2 3.55Å; A380-F405 HydrophobicContact CB-CG 4.26Å; A380-F405 HydrophobicContact CB-CZ 4.07Å; A380-I408 HydrophobicContact CB-CB 3.93Å; A380-I408 HydrophobicContact CB-CG2 3.76Å
381	A	95.6	Very high	92	Very high	1 Å²	1	30.5 Å²	30.5	1%	0.008	17%	0.173	C	C	.	.	H	α-helix	trans	-62.6	-44	175.1	0	0	0	0	0	112.1	F377 L378 V379 L384 F385 I451 I455	F377-A381 VanDerWaalsContact O-CB 3.25Å; F377-A381 WeakPolarHBondContact O-CB 3.43Å; F377-A381 PolarHBondContact O-N 3.48Å; L378-A381 PolarHBondContact O-N 2.92Å; V379-A381 VanDerWaalsContact C-N 3.3Å; V379-A381 PolarHBondContact O-N 2.99Å; A381-L384 PolarHBondContact O-N 3.45Å; A381-F385 VanDerWaalsContact O-CB 3.24Å; A381-F385 WeakPolarHBondContact O-CB 3.19Å; A381-F385 PolarHBondContact O-N 2.91Å; A381-I451 HydrophobicContact CB-CG2 3.8Å; A381-I455 HydrophobicContact CB-CG1 3.93Å
382	V	94.8	Very high	91.8	Very high	49 Å²	49	35.3 Å²	35.3	30%	0.297	20%	0.199	S	C	.	.	H	α-helix	trans	-61.9	-45.9	176.2	169.7	0	0	0	0	111.4	L378 V379 L384 F385 T386 I451 W484	L378-V382 VanDerWaalsContact O-CG2 3.24Å; L378-V382 WeakPolarHBondContact O-CG2 3.24Å; L378-V382 PolarHBondContact O-N 3.47Å; V379-V382 PolarHBondContact O-N 3.03Å; V382-L384 PolarHBondContact O-N 2.95Å; V382-F385 PolarHBondContact O-N 3.49Å; V382-T386 WeakPolarHBondContact O-CG2 3.15Å; V382-T386 PolarHBondContact O-N 2.9Å; V382-I451 HydrophobicContact CG2-CD1 4.35Å; V382-I451 HydrophobicContact CG2-CG2 3.8Å; V382-W484 HydrophobicContact CG2-CH2 3.82Å; V382-W484 HydrophobicContact CG2-CZ3 4.48Å
383	V	93.8	Very high	91.7	Very high	52 Å²	52	39.5 Å²	39.5	32%	0.315	22%	0.224	S	C	.	.	H	α-helix	trans	-61.6	-44.8	179.9	170.9	0	0	0	0	110.9	V379 A380 F385 T386 L388 I408	V379-V383 HydrophobicContact CG1-CG2 4.41Å; V379-V383 WeakPolarHBondContact O-CG2 3.34Å; V379-V383 PolarHBondContact O-N 3.4Å; A380-V383 PolarHBondContact O-N 2.89Å; V383-F385 VanDerWaalsContact C-N 3.3Å; V383-F385 PolarHBondContact O-N 3.37Å; V383-T386 PolarHBondContact O-N 3.48Å; V383-T386 PolarHBondContact O-OG1 3.26Å; V383-L388 HydrophobicContact CG1-CD1 4.37Å; V383-I408 HydrophobicContact CG1-CD1 4.28Å
384	L	91.9	Very high	91.5	Very high	11 Å²	11	39.1 Å²	39.1	6%	0.058	22%	0.22	C	C	.	.	H	α-helix	trans	-80.8	-8.3	180	-62.6	178.2	0	0	0	113.8	A380 A381 V382 T386 G389 F394 F401 F405	A380-L384 WeakPolarHBondContact O-CG 3.33Å; A380-L384 PolarHBondContact O-N 2.88Å; A381-L384 PolarHBondContact O-N 3.45Å; V382-L384 PolarHBondContact O-N 2.95Å; L384-T386 VanDerWaalsContact C-N 3.33Å; L384-G389 WeakPolarHBondContact O-CA 3.41Å; L384-F394 HydrophobicContact CD2-CE2 4.35Å; L384-F401 HydrophobicContact CB-CE2 4.23Å; L384-F401 HydrophobicContact CD1-CD2 3.96Å; L384-F401 HydrophobicContact CD1-CE1 4.43Å; L384-F401 HydrophobicContact CD1-CE2 3.38Å; L384-F401 HydrophobicContact CD1-CZ 3.65Å; L384-F401 HydrophobicContact CD2-CE2 4.46Å; L384-F401 HydrophobicContact CG-CE2 4.23Å; L384-F405 HydrophobicContact CD1-CB 4.09Å; L384-F405 HydrophobicContact CD1-CD2 3.69Å; L384-F405 HydrophobicContact CD1-CG 4.4Å
385	F	90.4	Very high	91.1	Very high	16 Å²	16	39.3 Å²	39.3	7%	0.07	22%	0.22	C	C	.	.	H	α-helix	trans	-79	-20.7	168.8	-178.2	-101	0	0	0	112.2	A381 V382 V383 I451 T471 F473	A381-F385 VanDerWaalsContact O-CB 3.24Å; A381-F385 WeakPolarHBondContact O-CB 3.19Å; A381-F385 PolarHBondContact O-N 2.91Å; V382-F385 PolarHBondContact O-N 3.49Å; V383-F385 VanDerWaalsContact C-N 3.3Å; V383-F385 PolarHBondContact O-N 3.37Å; F385-I451 HydrophobicContact CB-CG1 4.21Å; F385-I451 HydrophobicContact CD1-CG1 3.82Å; F385-I451 HydrophobicContact CD2-CG1 4.1Å; F385-I451 HydrophobicContact CE1-CG1 4.18Å; F385-I451 HydrophobicContact CE2-CG1 4.45Å; F385-I451 HydrophobicContact CG-CG1 3.76Å; F385-I451 HydrophobicContact CZ-CG1 4.47Å; F385-T471 VanDerWaalsContact CZ-OG1 3.28Å; F385-T471 WeakPolarHBondContact CZ-OG1 3.39Å; F385-F473 HydrophobicContact CD1-CZ 4.43Å; F385-F473 AromaticContact CE1-CE1 3.86Å; F385-F473 HydrophobicContact CE1-CE1 3.86Å; F385-F473 AromaticContact CE1-CZ 3.76Å; F385-F473 HydrophobicContact CE1-CZ 3.76Å
386	T	87.2	Confident	90.7	Very high	54 Å²	54	45.6 Å²	45.6	33%	0.331	25%	0.254	S	S	.	.	S	Bend	trans	-71.7	169.4	172.6	73.9	0	0	0	0	111.1	V382 V383 L384 L388 G389	V382-T386 WeakPolarHBondContact O-CG2 3.15Å; V382-T386 PolarHBondContact O-N 2.9Å; V383-T386 PolarHBondContact O-N 3.48Å; V383-T386 PolarHBondContact O-OG1 3.26Å; L384-T386 VanDerWaalsContact C-N 3.33Å; T386-L388 PolarHBondContact O-N 2.99Å; T386-L388 WeakPolarHBondContact OG1-CB 3.31Å; T386-L388 PolarHBondContact OG1-N 2.86Å; T386-G389 PolarHBondContact O-N 3.02Å
387	P	84.4	Confident	90.4	Very high	83 Å²	83	47.5 Å²	47.5	54%	0.539	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.5	-13.6	175.7	-26.6	34.5	0	0	0	114.9	G389 D390	P387-G389 VanDerWaalsContact C-N 3.27Å; P387-G389 PolarHBondContact O-N 3.42Å; P387-D390 PolarHBondContact O-N 3.47Å
388	L	85.6	Confident	90.1	Very high	97 Å²	97	48.9 Å²	48.9	51%	0.508	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.1	-31.9	170.5	-63.8	175.7	0	0	0	112.9	V383 T386 D390 L391 F394	V383-L388 HydrophobicContact CG1-CD1 4.37Å; T386-L388 PolarHBondContact O-N 2.99Å; T386-L388 WeakPolarHBondContact OG1-CB 3.31Å; T386-L388 PolarHBondContact OG1-N 2.86Å; L388-D390 VanDerWaalsContact C-N 3.31Å; L388-L391 WeakPolarHBondContact O-CD1 3.36Å; L388-L391 VanDerWaalsContact O-CG 3.31Å; L388-L391 WeakPolarHBondContact O-CG 3.32Å; L388-F394 WeakPolarHBondContact O-CD2 3.32Å; L388-F394 WeakPolarHBondContact O-CE2 3.4Å
389	G	84.3	Confident	89.9	Confident	5 Å²	5	53.5 Å²	53.5	5%	0.052	30%	0.304	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.5	-25.2	179.2	0	0	0	0	0	114.2	L384 T386 P387 L391	L384-G389 WeakPolarHBondContact O-CA 3.41Å; T386-G389 PolarHBondContact O-N 3.02Å; P387-G389 VanDerWaalsContact C-N 3.27Å; P387-G389 PolarHBondContact O-N 3.42Å; G389-L391 VanDerWaalsContact C-N 3.32Å; G389-L391 PolarHBondContact O-N 3.44Å
390	D	86.6	Confident	89.8	Confident	25 Å²	25	53.6 Å²	53.6	13%	0.134	30%	0.304	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.9	6.5	-176.6	-83.3	4.2	0	0	0	113.4	P387 L388 R395 T469 D470	P387-D390 PolarHBondContact O-N 3.47Å; L388-D390 VanDerWaalsContact C-N 3.31Å; D390-R395 VanDerWaalsContact O-CD 3.29Å; D390-R395 WeakPolarHBondContact O-CD 3.47Å; D390-T469 PolarHBondContact OD1-N 2.92Å; D390-T469 PolarHBondContact OD1-OG1 2.9Å; D390-T469 PolarHBondContact OD2-N 3.37Å; D390-D470 VanDerWaalsContact OD2-CB 3.29Å; D390-D470 WeakPolarHBondContact OD2-CB 3.45Å; D390-D470 PolarHBondContact OD2-N 3.47Å
391	L	88.9	Confident	89.6	Confident	87 Å²	87	54 Å²	54	46%	0.455	31%	0.306	S	S	.	.			trans	-59.5	140.5	173.6	-67.2	174.2	0	0	0	111.3	L388 G389 V393 F394 R395	L388-L391 WeakPolarHBondContact O-CD1 3.36Å; L388-L391 VanDerWaalsContact O-CG 3.31Å; L388-L391 WeakPolarHBondContact O-CG 3.32Å; G389-L391 VanDerWaalsContact C-N 3.32Å; G389-L391 PolarHBondContact O-N 3.44Å; L391-V393 PolarHBondContact O-N 2.98Å; L391-F394 HydrophobicContact CB-CD2 3.99Å; L391-F394 HydrophobicContact CB-CE2 4.44Å; L391-F394 HydrophobicContact CD1-CD2 4.45Å; L391-F394 HydrophobicContact CD1-CE2 4.08Å; L391-F394 PolarHBondContact O-N 3.36Å; L391-R395 PolarHBondContact O-N 3.08Å
392	D	86.8	Confident	89.6	Confident	101 Å²	101	56.7 Å²	56.7	54%	0.54	32%	0.316	S	S	.	.	H	α-helix	trans	-54.9	-31.6	-177.9	-67.8	-30.2	0	0	0	113.4	F394 R395 N396	D392-F394 VanDerWaalsContact C-N 3.34Å; D392-F394 PolarHBondContact O-N 3.29Å; D392-R395 PolarHBondContact O-N 3.31Å; D392-R395 IonicContact OD1-NH1 3.81Å; D392-R395 PolarHBondContact OD1-NH1 3.18Å; D392-N396 VanDerWaalsContact O-CB 3.32Å; D392-N396 WeakPolarHBondContact O-CB 3.45Å; D392-N396 PolarHBondContact O-N 3.22Å; D392-N396 PolarHBondContact O-ND2 2.9Å
393	V	89.9	Confident	89.7	Confident	92 Å²	92	58.2 Å²	58.2	56%	0.558	33%	0.325	S	S	*	.	H	α-helix	trans	-62.6	-40.4	177.3	179.1	0	0	0	0	111.5	L391 S397 V400	L391-V393 PolarHBondContact O-N 2.98Å; V393-S397 PolarHBondContact O-N 3.08Å; V393-V400 HydrophobicContact CG1-CB 4.5Å; V393-V400 HydrophobicContact CG1-CG1 3.88Å
394	F	89.5	Confident	89.7	Confident	30 Å²	30	57.9 Å²	57.9	13%	0.132	32%	0.324	C	S	.	.	H	α-helix	trans	-79.3	-27.4	179.4	-63.8	-45.6	0	0	0	112.7	L384 L388 L391 D392 V400 F401 T404 R458	L384-F394 HydrophobicContact CD2-CE2 4.35Å; L388-F394 WeakPolarHBondContact O-CD2 3.32Å; L388-F394 WeakPolarHBondContact O-CE2 3.4Å; L391-F394 HydrophobicContact CB-CD2 3.99Å; L391-F394 HydrophobicContact CB-CE2 4.44Å; L391-F394 HydrophobicContact CD1-CD2 4.45Å; L391-F394 HydrophobicContact CD1-CE2 4.08Å; L391-F394 PolarHBondContact O-N 3.36Å; D392-F394 VanDerWaalsContact C-N 3.34Å; D392-F394 PolarHBondContact O-N 3.29Å; F394-V400 HydrophobicContact CD1-CG1 4.05Å; F394-V400 HydrophobicContact CE1-CG1 3.97Å; F394-F401 HydrophobicContact CB-CB 4.5Å; F394-F401 HydrophobicContact CB-CD2 4.19Å; F394-F401 HydrophobicContact CD1-CB 4.36Å; F394-F401 HydrophobicContact CG-CD2 4.46Å; F394-T404 HydrophobicContact CE1-CG2 4.21Å; F394-T404 HydrophobicContact CZ-CG2 4.22Å; F394-R458 PolarHBondContact O-NH2 3.02Å
395	R	87.6	Confident	89.9	Confident	29 Å²	29	57.6 Å²	57.6	11%	0.109	32%	0.322	C	S	.	.	H	α-helix	trans	-76.8	-40	177.4	-71.7	172.3	56	-132.8	-3.3	112.6	D390 L391 D392 S465 A466	D390-R395 VanDerWaalsContact O-CD 3.29Å; D390-R395 WeakPolarHBondContact O-CD 3.47Å; L391-R395 PolarHBondContact O-N 3.08Å; D392-R395 PolarHBondContact O-N 3.31Å; D392-R395 IonicContact OD1-NH1 3.81Å; D392-R395 PolarHBondContact OD1-NH1 3.18Å; R395-S465 VanDerWaalsContact CA-O 3.24Å; R395-S465 WeakPolarHBondContact CA-O 3.26Å; R395-A466 PolarHBondContact NE-O 3.34Å; R395-A466 PolarHBondContact NH2-O 3.12Å
396	N	86.6	Confident	90.1	Very high	140 Å²	140	59.6 Å²	59.6	75%	0.749	34%	0.337	S	S	*	.	H	α-helix	trans	-81.5	-19.4	-179.2	-69.4	-40.8	0	0	0	113.8	D392	D392-N396 VanDerWaalsContact O-CB 3.32Å; D392-N396 WeakPolarHBondContact O-CB 3.45Å; D392-N396 PolarHBondContact O-N 3.22Å; D392-N396 PolarHBondContact O-ND2 2.9Å
397	S	89.8	Confident	90.5	Very high	40 Å²	40	60.5 Å²	60.5	28%	0.28	35%	0.345	S	S	.	.			trans	-134.6	104.5	-178.1	-169	0	0	0	0	113.2	V393 V399 V400 F401	V393-S397 PolarHBondContact O-N 3.08Å; S397-V399 PolarHBondContact O-N 3.37Å; S397-V400 PolarHBondContact O-N 2.82Å; S397-F401 PolarHBondContact O-N 2.98Å
398	D	89.4	Confident	91	Very high	55 Å²	55	58.4 Å²	58.4	29%	0.294	33%	0.329	S	S	.	.	H	α-helix	trans	-59.5	-35.3	172.2	-83.8	-41.7	0	0	0	112.9	V400 F401 W402 R458 S465	D398-V400 VanDerWaalsContact C-N 3.34Å; D398-V400 PolarHBondContact O-N 3.17Å; D398-F401 PolarHBondContact O-N 3.4Å; D398-W402 PolarHBondContact O-N 3.41Å; D398-R458 IonicContact OD1-CZ 2.61Å; D398-R458 VanDerWaalsContact OD1-CZ 3.27Å; D398-R458 IonicContact OD1-NE 3.76Å; D398-R458 PolarHBondContact OD1-NE 3.41Å; D398-R458 IonicContact OD1-NH2 2.8Å; D398-R458 PolarHBondContact OD1-NH2 3.33Å; D398-S465 WeakPolarHBondContact OD1-CB 3.12Å; D398-S465 WeakPolarHBondContact OD2-CB 3.24Å
399	V	91.9	Very high	91.5	Very high	104 Å²	104	55.8 Å²	55.8	63%	0.63	31%	0.314	S	S	*	.	H	α-helix	trans	-61.5	-46.3	179.7	-179.1	0	0	0	0	110.2	S397 F401 W402 V403	S397-V399 PolarHBondContact O-N 3.37Å; V399-F401 VanDerWaalsContact C-N 3.35Å; V399-F401 PolarHBondContact O-N 3.42Å; V399-W402 PolarHBondContact O-N 3.26Å; V399-V403 HydrophobicContact CG1-CG2 4.28Å; V399-V403 WeakPolarHBondContact O-CB 3.25Å; V399-V403 WeakPolarHBondContact O-CG2 3.24Å; V399-V403 PolarHBondContact O-N 3.48Å
400	V	93.7	Very high	92	Very high	55 Å²	55	58.5 Å²	58.5	33%	0.333	33%	0.33	S	S	.	.	H	α-helix	trans	-65.1	-41.7	-179.9	179.2	0	0	0	0	110.8	V393 F394 S397 D398 T404	V393-V400 HydrophobicContact CG1-CB 4.5Å; V393-V400 HydrophobicContact CG1-CG1 3.88Å; F394-V400 HydrophobicContact CD1-CG1 4.05Å; F394-V400 HydrophobicContact CE1-CG1 3.97Å; S397-V400 PolarHBondContact O-N 2.82Å; D398-V400 VanDerWaalsContact C-N 3.34Å; D398-V400 PolarHBondContact O-N 3.17Å; V400-T404 WeakPolarHBondContact O-CB 3.44Å; V400-T404 PolarHBondContact O-N 3.02Å; V400-T404 PolarHBondContact O-OG1 2.71Å
401	F	93.9	Very high	92.3	Very high	9 Å²	9	61 Å²	61	4%	0.039	35%	0.346	C	S	.	.	H	α-helix	trans	-59.3	-53.9	175.7	177.6	-92.2	0	0	0	112.1	L384 F394 S397 D398 V399 V403 T404 F405 I455 R458	L384-F401 HydrophobicContact CB-CE2 4.23Å; L384-F401 HydrophobicContact CD1-CD2 3.96Å; L384-F401 HydrophobicContact CD1-CE1 4.43Å; L384-F401 HydrophobicContact CD1-CE2 3.38Å; L384-F401 HydrophobicContact CD1-CZ 3.65Å; L384-F401 HydrophobicContact CD2-CE2 4.46Å; L384-F401 HydrophobicContact CG-CE2 4.23Å; F394-F401 HydrophobicContact CB-CB 4.5Å; F394-F401 HydrophobicContact CB-CD2 4.19Å; F394-F401 HydrophobicContact CD1-CB 4.36Å; F394-F401 HydrophobicContact CG-CD2 4.46Å; S397-F401 PolarHBondContact O-N 2.98Å; D398-F401 PolarHBondContact O-N 3.4Å; V399-F401 VanDerWaalsContact C-N 3.35Å; V399-F401 PolarHBondContact O-N 3.42Å; F401-V403 PolarHBondContact O-N 3.04Å; F401-T404 PolarHBondContact O-N 2.82Å; F401-F405 WeakPolarHBondContact O-CB 3.24Å; F401-F405 PolarHBondContact O-N 2.91Å; F401-I455 HydrophobicContact CE1-CD1 4.38Å; F401-I455 HydrophobicContact CZ-CD1 3.74Å; F401-R458 VanDerWaalsContact CD1-CZ 3.48Å; F401-R458 VanDerWaalsContact CE1-CD 3.42Å
402	W	95.1	Very high	92.4	Very high	56 Å²	56	58.6 Å²	58.6	21%	0.212	33%	0.334	C	S	.	.	H	α-helix	trans	-67.9	-36.8	-175.7	-70.3	119.3	0	0	0	112.9	D398 V399 F405 C406 I455 R458 F459	D398-W402 PolarHBondContact O-N 3.41Å; V399-W402 PolarHBondContact O-N 3.26Å; W402-F405 HydrophobicContact CE3-CD1 4.39Å; W402-F405 HydrophobicContact CZ3-CD1 4.44Å; W402-F405 PolarHBondContact O-N 3.34Å; W402-C406 VanDerWaalsContact O-CB 3.28Å; W402-C406 WeakPolarHBondContact O-CB 3.46Å; W402-C406 PolarHBondContact O-N 3Å; W402-C406 PolarHBondContact O-SG 3.47Å; W402-I455 HydrophobicContact CH2-CG2 4.37Å; W402-I455 HydrophobicContact CZ3-CG2 4.31Å; W402-R458 HydrophobicContact CH2-CB 4.33Å; W402-R458 HydrophobicContact CZ2-CB 4.09Å; W402-R458 HydrophobicContact CZ2-CG 3.85Å; W402-F459 HydrophobicContact CE3-CE1 4.24Å; W402-F459 HydrophobicContact CE3-CZ 4.05Å; W402-F459 AromaticContact CH2-CD1 3.6Å; W402-F459 HydrophobicContact CH2-CD1 3.6Å; W402-F459 AromaticContact CH2-CD2 3.64Å; W402-F459 HydrophobicContact CH2-CD2 3.64Å; W402-F459 AromaticContact CH2-CE1 3.47Å; W402-F459 HydrophobicContact CH2-CE1 3.47Å; W402-F459 VanDerWaalsContact CH2-CE1 3.47Å; W402-F459 AromaticContact CH2-CE2 3.51Å; W402-F459 HydrophobicContact CH2-CE2 3.51Å; W402-F459 AromaticContact CH2-CG 3.68Å; W402-F459 HydrophobicContact CH2-CG 3.68Å; W402-F459 AromaticContact CH2-CZ 3.42Å; W402-F459 HydrophobicContact CH2-CZ 3.42Å; W402-F459 VanDerWaalsContact CH2-CZ 3.42Å; W402-F459 AromaticContact CZ2-CD1 3.92Å; W402-F459 HydrophobicContact CZ2-CD1 3.92Å; W402-F459 AromaticContact CZ2-CE1 4Å; W402-F459 HydrophobicContact CZ2-CE1 4Å; W402-F459 HydrophobicContact CZ2-CG 4.22Å; W402-F459 HydrophobicContact CZ2-CZ 4.38Å; W402-F459 HydrophobicContact CZ3-CD1 4.23Å; W402-F459 HydrophobicContact CZ3-CD2 4.17Å; W402-F459 AromaticContact CZ3-CE1 3.61Å; W402-F459 HydrophobicContact CZ3-CE1 3.61Å; W402-F459 AromaticContact CZ3-CE2 3.54Å; W402-F459 HydrophobicContact CZ3-CE2 3.54Å; W402-F459 HydrophobicContact CZ3-CG 4.48Å; W402-F459 AromaticContact CZ3-CZ 3.22Å; W402-F459 HydrophobicContact CZ3-CZ 3.22Å
403	V	95.6	Very high	92.6	Very high	82 Å²	82	54.2 Å²	54.2	50%	0.497	31%	0.311	S	S	.	.	H	α-helix	trans	-62.3	-47.5	173.7	170.4	0	0	0	0	110.1	V399 F401 F405 C406 C407	V399-V403 HydrophobicContact CG1-CG2 4.28Å; V399-V403 WeakPolarHBondContact O-CB 3.25Å; V399-V403 WeakPolarHBondContact O-CG2 3.24Å; V399-V403 PolarHBondContact O-N 3.48Å; F401-V403 PolarHBondContact O-N 3.04Å; V403-F405 PolarHBondContact O-N 2.9Å; V403-C406 PolarHBondContact O-N 3.39Å; V403-C407 WeakPolarHBondContact O-CB 3.42Å; V403-C407 PolarHBondContact O-N 2.9Å; V403-C407 PolarHBondContact O-SG 3.24Å
404	T	94.5	Very high	92.6	Very high	45 Å²	45	55.5 Å²	55.5	28%	0.276	31%	0.314	S	S	.	.	H	α-helix	trans	-61.9	-45.9	178.7	-55	0	0	0	0	111.4	F394 V400 F401 C406 C407 I408	F394-T404 HydrophobicContact CE1-CG2 4.21Å; F394-T404 HydrophobicContact CZ-CG2 4.22Å; V400-T404 WeakPolarHBondContact O-CB 3.44Å; V400-T404 PolarHBondContact O-N 3.02Å; V400-T404 PolarHBondContact O-OG1 2.71Å; F401-T404 PolarHBondContact O-N 2.82Å; T404-C406 PolarHBondContact O-N 3.27Å; T404-C407 PolarHBondContact O-N 3.47Å; T404-I408 HydrophobicContact CG2-CD1 4.22Å; T404-I408 WeakPolarHBondContact O-CG1 3.3Å; T404-I408 PolarHBondContact O-N 2.86Å
405	F	95.5	Very high	92.6	Very high	5 Å²	5	59.9 Å²	59.9	2%	0.022	33%	0.333	C	S	.	.	H	α-helix	trans	-57.2	-49.9	176.1	-176.3	-90.5	0	0	0	111.7	F377 A380 L384 F401 W402 V403 C407 I408 M409 I455	F377-F405 AromaticContact CD2-CE1 3.82Å; F377-F405 HydrophobicContact CD2-CE1 3.82Å; F377-F405 AromaticContact CD2-CZ 3.43Å; F377-F405 HydrophobicContact CD2-CZ 3.43Å; F377-F405 VanDerWaalsContact CD2-CZ 3.43Å; F377-F405 HydrophobicContact CE2-CE1 4.14Å; F377-F405 AromaticContact CE2-CZ 3.62Å; F377-F405 HydrophobicContact CE2-CZ 3.62Å; F377-F405 HydrophobicContact CG-CZ 4.18Å; A380-F405 HydrophobicContact CB-CD2 3.65Å; A380-F405 HydrophobicContact CB-CE2 3.55Å; A380-F405 HydrophobicContact CB-CG 4.26Å; A380-F405 HydrophobicContact CB-CZ 4.07Å; L384-F405 HydrophobicContact CD1-CB 4.09Å; L384-F405 HydrophobicContact CD1-CD2 3.69Å; L384-F405 HydrophobicContact CD1-CG 4.4Å; F401-F405 WeakPolarHBondContact O-CB 3.24Å; F401-F405 PolarHBondContact O-N 2.91Å; W402-F405 HydrophobicContact CE3-CD1 4.39Å; W402-F405 HydrophobicContact CZ3-CD1 4.44Å; W402-F405 PolarHBondContact O-N 3.34Å; V403-F405 PolarHBondContact O-N 2.9Å; F405-C407 PolarHBondContact O-N 2.84Å; F405-I408 PolarHBondContact O-N 3.06Å; F405-M409 HydrophobicContact CE1-SD 4.28Å; F405-M409 VanDerWaalsContact O-CB 3.32Å; F405-M409 WeakPolarHBondContact O-CB 3.48Å; F405-M409 PolarHBondContact O-N 3.4Å; F405-I455 HydrophobicContact CD2-CD1 4.1Å; F405-I455 HydrophobicContact CE2-CD1 3.75Å; F405-I455 HydrophobicContact CE2-CG1 4.02Å; F405-I455 HydrophobicContact CE2-CG2 4.21Å; F405-I455 HydrophobicContact CZ-CG2 4.06Å
406	C	95.7	Very high	92.6	Very high	58 Å²	58	59.7 Å²	59.7	39%	0.392	33%	0.333	S	S	.	.	H	α-helix	trans	-63.9	-38.8	178.5	-74.9	0	0	0	0	112.4	W402 V403 T404 M409 V410	W402-C406 VanDerWaalsContact O-CB 3.28Å; W402-C406 WeakPolarHBondContact O-CB 3.46Å; W402-C406 PolarHBondContact O-N 3Å; W402-C406 PolarHBondContact O-SG 3.47Å; V403-C406 PolarHBondContact O-N 3.39Å; T404-C406 PolarHBondContact O-N 3.27Å; C406-M409 PolarHBondContact O-N 2.88Å; C406-V410 WeakPolarHBondContact O-CB 3.24Å; C406-V410 VanDerWaalsContact O-CG2 3.31Å; C406-V410 WeakPolarHBondContact O-CG2 3.49Å; C406-V410 PolarHBondContact O-N 3.31Å
407	C	95.9	Very high	92.6	Very high	72 Å²	72	56 Å²	56	49%	0.486	32%	0.315	S	S	.	.	H	α-helix	trans	-59.6	-50.9	175.1	-74.6	0	0	0	0	111.1	V403 T404 F405 M409 V410 T411	V403-C407 WeakPolarHBondContact O-CB 3.42Å; V403-C407 PolarHBondContact O-N 2.9Å; V403-C407 PolarHBondContact O-SG 3.24Å; T404-C407 PolarHBondContact O-N 3.47Å; F405-C407 PolarHBondContact O-N 2.84Å; C407-M409 VanDerWaalsContact C-N 3.34Å; C407-M409 PolarHBondContact O-N 3.49Å; C407-V410 PolarHBondContact O-N 3.12Å; C407-T411 WeakPolarHBondContact O-CG2 3.12Å; C407-T411 PolarHBondContact O-N 2.95Å; C407-T411 PolarHBondContact O-OG1 2.72Å
408	I	94.8	Very high	92.5	Very high	40 Å²	40	62.7 Å²	62.7	21%	0.205	33%	0.334	C	S	.	.	H	α-helix	trans	-60.4	-47	177.1	-61.4	167.5	0	0	0	109.9	V379 A380 V383 T404 F405 V410 T411	V379-I408 HydrophobicContact CG1-CG2 4.41Å; A380-I408 HydrophobicContact CB-CB 3.93Å; A380-I408 HydrophobicContact CB-CG2 3.76Å; V383-I408 HydrophobicContact CG1-CD1 4.28Å; T404-I408 HydrophobicContact CG2-CD1 4.22Å; T404-I408 WeakPolarHBondContact O-CG1 3.3Å; T404-I408 PolarHBondContact O-N 2.86Å; F405-I408 PolarHBondContact O-N 3.06Å; I408-V410 VanDerWaalsContact C-N 3.31Å; I408-V410 PolarHBondContact O-N 3.1Å; I408-T411 PolarHBondContact O-N 3.02Å; I408-T411 PolarHBondContact O-OG1 2.9Å
409	M	95.6	Very high	92.5	Very high	41 Å²	41	66.3 Å²	66.3	20%	0.202	34%	0.344	C	S	.	.	H	α-helix	trans	-57.7	-39.6	-179.7	-176.3	-173.9	70.5	0	0	113.1	L373 F377 F405 C406 C407 P413	L373-M409 HydrophobicContact CD2-CE 4.02Å; L373-M409 HydrophobicContact CD2-CG 3.99Å; L373-M409 HydrophobicContact CD2-SD 4.35Å; F377-M409 HydrophobicContact CB-CG 4.44Å; F377-M409 HydrophobicContact CB-SD 4.43Å; F405-M409 HydrophobicContact CE1-SD 4.28Å; F405-M409 VanDerWaalsContact O-CB 3.32Å; F405-M409 WeakPolarHBondContact O-CB 3.48Å; F405-M409 PolarHBondContact O-N 3.4Å; C406-M409 PolarHBondContact O-N 2.88Å; C407-M409 VanDerWaalsContact C-N 3.34Å; C407-M409 PolarHBondContact O-N 3.49Å; M409-P413 WeakPolarHBondContact O-CD 3.45Å
410	V	95.2	Very high	92.3	Very high	63 Å²	63	63 Å²	63	38%	0.382	32%	0.324	S	S	.	.	H	α-helix	trans	-83.7	-28.7	-177.4	173	0	0	0	0	112.7	L373 C406 C407 I408 L412 P413 L414	L373-V410 HydrophobicContact CD2-CG2 4.36Å; C406-V410 WeakPolarHBondContact O-CB 3.24Å; C406-V410 VanDerWaalsContact O-CG2 3.31Å; C406-V410 WeakPolarHBondContact O-CG2 3.49Å; C406-V410 PolarHBondContact O-N 3.31Å; C407-V410 PolarHBondContact O-N 3.12Å; I408-V410 VanDerWaalsContact C-N 3.31Å; I408-V410 PolarHBondContact O-N 3.1Å; V410-L412 VanDerWaalsContact C-N 3.31Å; V410-L412 PolarHBondContact O-N 2.81Å; V410-P413 VanDerWaalsContact O-CD 3.25Å; V410-P413 WeakPolarHBondContact O-CD 3.24Å; V410-P413 VanDerWaalsContact O-CG 3.31Å; V410-P413 WeakPolarHBondContact O-CG 3.24Å; V410-L414 HydrophobicContact CG1-CD1 3.84Å; V410-L414 HydrophobicContact CG1-CG 4.21Å; V410-L414 VanDerWaalsContact O-CG 3.32Å; V410-L414 WeakPolarHBondContact O-CG 3.43Å; V410-L414 PolarHBondContact O-N 3.45Å
411	T	93.4	Very high	92	Very high	78 Å²	78	61.5 Å²	61.5	48%	0.479	31%	0.313	S	S	.	.	H	α-helix	trans	-61.7	-38	179.6	56.2	0	0	0	0	113.1	C407 I408 L414 F415	C407-T411 WeakPolarHBondContact O-CG2 3.12Å; C407-T411 PolarHBondContact O-N 2.95Å; C407-T411 PolarHBondContact O-OG1 2.72Å; I408-T411 PolarHBondContact O-N 3.02Å; I408-T411 PolarHBondContact O-OG1 2.9Å; T411-L414 PolarHBondContact O-N 3.34Å; T411-F415 PolarHBondContact O-N 3.39Å
412	L	89.9	Confident	91.9	Very high	36 Å²	36	64.4 Å²	64.4	19%	0.188	33%	0.326	C	S	.	.	H	α-helix	trans	-64.6	-51.1	-178.9	-76.3	171.2	0	0	0	114.3	V379 V410 L414 F415 F416	V379-L412 HydrophobicContact CB-CD1 3.47Å; V379-L412 VanDerWaalsContact CB-CD1 3.47Å; V379-L412 HydrophobicContact CG1-CD1 3.78Å; V379-L412 HydrophobicContact CG2-CD1 3.64Å; V410-L412 VanDerWaalsContact C-N 3.31Å; V410-L412 PolarHBondContact O-N 2.81Å; L412-L414 VanDerWaalsContact C-N 3.29Å; L412-L414 PolarHBondContact O-N 3.32Å; L412-F415 WeakPolarHBondContact O-CB 3.26Å; L412-F415 PolarHBondContact O-N 3.26Å; L412-F416 HydrophobicContact CD2-CE2 4.28Å; L412-F416 VanDerWaalsContact O-CD2 3.25Å; L412-F416 WeakPolarHBondContact O-CD2 3.45Å; L412-F416 PolarHBondContact O-N 3.24Å
413	P	90.7	Very high	91.7	Very high	9 Å²	9	61.8 Å²	61.8	6%	0.058	32%	0.317	C	S	.	.	H	α-helix	trans	-60.2	-38.6	173.8	15.6	-24.3	0	0	0	111.9	L373 M409 V410 F415 F416 V417	L373-P413 HydrophobicContact CD2-CG 3.94Å; L373-P413 HydrophobicContact CG-CG 4.17Å; M409-P413 WeakPolarHBondContact O-CD 3.45Å; V410-P413 VanDerWaalsContact O-CD 3.25Å; V410-P413 WeakPolarHBondContact O-CD 3.24Å; V410-P413 VanDerWaalsContact O-CG 3.31Å; V410-P413 WeakPolarHBondContact O-CG 3.24Å; P413-F415 VanDerWaalsContact C-N 3.32Å; P413-F415 PolarHBondContact O-N 3.44Å; P413-F416 PolarHBondContact O-N 3.41Å; P413-V417 VanDerWaalsContact O-CG2 3.31Å; P413-V417 WeakPolarHBondContact O-CG2 3.33Å; P413-V417 PolarHBondContact O-N 2.91Å
414	L	91.3	Very high	91.6	Very high	119 Å²	119	58 Å²	58	62%	0.623	29%	0.294	S	S	*	.	H	α-helix	trans	-61.8	-38.2	176.5	-69.2	176.1	0	0	0	112.6	V410 T411 L412	V410-L414 HydrophobicContact CG1-CD1 3.84Å; V410-L414 HydrophobicContact CG1-CG 4.21Å; V410-L414 VanDerWaalsContact O-CG 3.32Å; V410-L414 WeakPolarHBondContact O-CG 3.43Å; V410-L414 PolarHBondContact O-N 3.45Å; T411-L414 PolarHBondContact O-N 3.34Å; L412-L414 VanDerWaalsContact C-N 3.29Å; L412-L414 PolarHBondContact O-N 3.32Å
415	F	89.4	Confident	91.5	Very high	121 Å²	121	55.8 Å²	55.8	53%	0.531	28%	0.281	S	S	.	.	H	α-helix	trans	-65.4	-47.4	174.3	179	-101.3	0	0	0	111.4	T411 L412 P413 V417 R418 W419	T411-F415 PolarHBondContact O-N 3.39Å; L412-F415 WeakPolarHBondContact O-CB 3.26Å; L412-F415 PolarHBondContact O-N 3.26Å; P413-F415 VanDerWaalsContact C-N 3.32Å; P413-F415 PolarHBondContact O-N 3.44Å; F415-V417 VanDerWaalsContact C-N 3.29Å; F415-V417 PolarHBondContact O-N 3.07Å; F415-R418 PolarHBondContact O-N 3.45Å; F415-W419 HydrophobicContact CZ-CZ3 4.08Å
416	F	87.2	Confident	91.5	Very high	26 Å²	26	57.5 Å²	57.5	11%	0.114	29%	0.292	C	S	.	.	H	α-helix	trans	-75.5	-10.4	-178	-72.8	-62.1	0	0	0	114.7	L375 L412 P413 R418 W419 P420	L375-F416 HydrophobicContact CD2-CD2 4.34Å; L375-F416 HydrophobicContact CD2-CE2 3.71Å; L375-F416 HydrophobicContact CD2-CZ 4.43Å; L412-F416 HydrophobicContact CD2-CE2 4.28Å; L412-F416 VanDerWaalsContact O-CD2 3.25Å; L412-F416 WeakPolarHBondContact O-CD2 3.45Å; L412-F416 PolarHBondContact O-N 3.24Å; P413-F416 PolarHBondContact O-N 3.41Å; F416-R418 PolarHBondContact O-N 2.78Å; F416-W419 CarbonylContact O-C 3Å; F416-W419 PolarHBondContact O-N 3.27Å; F416-P420 VanDerWaalsContact O-CA 3.27Å; F416-P420 WeakPolarHBondContact O-CA 3.49Å
417	V	86.6	Confident	91.5	Very high	62 Å²	62	54.8 Å²	54.8	38%	0.376	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.5	-32.5	168.5	159.5	0	0	0	0	111.5	M365 P413 F415	M365-V417 HydrophobicContact CE-CB 4.21Å; M365-V417 HydrophobicContact CE-CG1 3.72Å; M365-V417 HydrophobicContact CE-CG2 4.07Å; P413-V417 VanDerWaalsContact O-CG2 3.31Å; P413-V417 WeakPolarHBondContact O-CG2 3.33Å; P413-V417 PolarHBondContact O-N 2.91Å; F415-V417 VanDerWaalsContact C-N 3.29Å; F415-V417 PolarHBondContact O-N 3.07Å
418	R	87.8	Confident	91.4	Very high	180 Å²	180	51.4 Å²	51.4	68%	0.679	25%	0.25	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70.8	-31.7	178.2	-176.8	59.5	-175.6	85	-4.1	113.1	F415 F416	F415-R418 PolarHBondContact O-N 3.45Å; F416-R418 PolarHBondContact O-N 2.78Å
419	W	88.1	Confident	91.5	Very high	132 Å²	132	49.5 Å²	49.5	50%	0.5	24%	0.24	S	C	.	.	S	Bend	trans	-135.7	69.8	-178	-58.1	-40.8	0	0	0	110.4	F415 F416 R421 E422 G423	F415-W419 HydrophobicContact CZ-CZ3 4.08Å; F416-W419 CarbonylContact O-C 3Å; F416-W419 PolarHBondContact O-N 3.27Å; W419-R421 VanDerWaalsContact C-N 3.29Å; W419-R421 PolarHBondContact O-N 3.47Å; W419-E422 HydrophobicContact CB-CB 4.19Å; W419-E422 HydrophobicContact CB-CG 4.21Å; W419-E422 PolarHBondContact O-N 2.85Å; W419-G423 PolarHBondContact O-N 3.29Å; W419-G423 VanDerWaalsContact O-N 3.08Å
420	P	88.1	Confident	91.5	Very high	33 Å²	33	49.4 Å²	49.4	21%	0.214	24%	0.242	C	C	.	.	H	α-helix	trans	-64.7	-33.4	-168.8	23.3	-33.9	0	0	0	112.7	V368 F416 N424 F505	V368-P420 HydrophobicContact CB-CB 4.45Å; V368-P420 HydrophobicContact CG1-CB 3.88Å; V368-P420 HydrophobicContact CG2-CB 4.03Å; F416-P420 VanDerWaalsContact O-CA 3.27Å; F416-P420 WeakPolarHBondContact O-CA 3.49Å; P420-N424 VanDerWaalsContact O-CB 3.22Å; P420-N424 WeakPolarHBondContact O-CB 3.39Å; P420-N424 PolarHBondContact O-N 3.07Å; P420-F505 HydrophobicContact CB-CE2 3.9Å; P420-F505 HydrophobicContact CB-CZ 4.19Å; P420-F505 HydrophobicContact CG-CE2 4.1Å
421	R	88.8	Confident	91.6	Very high	24 Å²	24	47.4 Å²	47.4	9%	0.091	23%	0.23	C	C	.	.	H	α-helix	trans	-62.8	-51.7	176.5	174.5	-177.3	170.2	-169.4	-8.9	111.9	W419 G423 N424 I425 E499 F504 F505	W419-R421 VanDerWaalsContact C-N 3.29Å; W419-R421 PolarHBondContact O-N 3.47Å; R421-G423 VanDerWaalsContact C-N 3.34Å; R421-G423 PolarHBondContact O-N 3.33Å; R421-N424 PolarHBondContact O-N 3.25Å; R421-I425 HydrophobicContact CG-CD1 3.93Å; R421-I425 WeakPolarHBondContact O-CG1 3.24Å; R421-I425 PolarHBondContact O-N 3.12Å; R421-E499 PolarHBondContact NH2-O 3.41Å; R421-F504 HydrophobicContact CB-CD1 3.89Å; R421-F504 VanDerWaalsContact CD-CD1 3.45Å; R421-F504 HydrophobicContact CG-CD1 4.29Å; R421-F505 HydrophobicContact CB-CE2 4.26Å
422	E	90.7	Very high	91.7	Very high	70 Å²	70	43.9 Å²	43.9	33%	0.327	21%	0.209	S	C	.	.	H	α-helix	trans	-61.8	-45.4	-178.9	-58.4	-57.6	135.5	0	0	110.2	W419 N424 I425 V426 L496	W419-E422 HydrophobicContact CB-CB 4.19Å; W419-E422 HydrophobicContact CB-CG 4.21Å; W419-E422 PolarHBondContact O-N 2.85Å; E422-N424 VanDerWaalsContact C-N 3.34Å; E422-N424 PolarHBondContact O-N 3.21Å; E422-I425 PolarHBondContact O-N 3.49Å; E422-V426 WeakPolarHBondContact O-CB 3.4Å; E422-V426 VanDerWaalsContact O-CG2 3.24Å; E422-V426 WeakPolarHBondContact O-CG2 3.21Å; E422-V426 PolarHBondContact O-N 3.33Å; E422-L496 WeakPolarHBondContact OE2-CD2 3.33Å
423	G	91.2	Very high	92.1	Very high	2 Å²	2	42.1 Å²	42.1	2%	0.021	20%	0.2	C	C	.	.	H	α-helix	trans	-60.6	-40.5	176.5	0	0	0	0	0	113.7	W419 R421 T427	W419-G423 PolarHBondContact O-N 3.29Å; W419-G423 VanDerWaalsContact O-N 3.08Å; R421-G423 VanDerWaalsContact C-N 3.34Å; R421-G423 PolarHBondContact O-N 3.33Å; G423-T427 WeakPolarHBondContact O-CB 3.02Å; G423-T427 PolarHBondContact O-N 2.78Å; G423-T427 PolarHBondContact O-OG1 3.31Å
424	N	92.6	Very high	92.4	Very high	1 Å²	1	42.2 Å²	42.2	1%	0.005	20%	0.199	C	C	.	.	H	α-helix	trans	-65	-44.8	177.3	-165.8	86.7	0	0	0	112	H305 E311 P420 R421 E422 T427 C428 F505	H305-N424 PolarHBondContact ND1-ND2 3.46Å; H305-N424 VanDerWaalsContact ND1-ND2 3.14Å; E311-N424 PolarHBondContact OE1-ND2 2.73Å; E311-N424 PolarHBondContact OE1-OD1 3.05Å; E311-N424 PolarHBondContact OE2-ND2 3.42Å; P420-N424 VanDerWaalsContact O-CB 3.22Å; P420-N424 WeakPolarHBondContact O-CB 3.39Å; P420-N424 PolarHBondContact O-N 3.07Å; R421-N424 PolarHBondContact O-N 3.25Å; E422-N424 VanDerWaalsContact C-N 3.34Å; E422-N424 PolarHBondContact O-N 3.21Å; N424-T427 PolarHBondContact O-N 2.86Å; N424-C428 PolarHBondContact O-N 3.04Å; N424-C428 PolarHBondContact O-SG 3.27Å; N424-C428 VanDerWaalsContact O-SG 3.34Å; N424-F505 HydrophobicContact CB-CE1 4.26Å; N424-F505 HydrophobicContact CB-CZ 4.13Å
425	I	94.2	Very high	92.7	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-65	-44.3	177.1	-68.9	169.5	0	0	0	111.2	H305 R421 E422 T427 C428 G429 V492 Q495 L496	H305-I425 HydrophobicContact CB-CG1 3.76Å; R421-I425 HydrophobicContact CG-CD1 3.93Å; R421-I425 WeakPolarHBondContact O-CG1 3.24Å; R421-I425 PolarHBondContact O-N 3.12Å; E422-I425 PolarHBondContact O-N 3.49Å; I425-T427 VanDerWaalsContact C-N 3.33Å; I425-T427 PolarHBondContact O-N 2.86Å; I425-C428 WeakPolarHBondContact O-CB 3.36Å; I425-C428 PolarHBondContact O-N 2.78Å; I425-G429 PolarHBondContact O-N 3.09Å; I425-V492 HydrophobicContact CG2-CG1 4.34Å; I425-Q495 HydrophobicContact CG1-CB 4.38Å; I425-Q495 HydrophobicContact CG2-CB 3.52Å; I425-L496 HydrophobicContact CB-CD2 4.4Å; I425-L496 HydrophobicContact CD1-CD2 3.67Å; I425-L496 HydrophobicContact CG2-CD2 4.07Å; I425-L496 HydrophobicContact CG2-CG 4.01Å
426	V	95.1	Very high	93	Very high	41 Å²	41	33 Å²	33	25%	0.248	16%	0.16	C	C	.	.	H	α-helix	trans	-59.9	-45.6	175.7	170.7	0	0	0	0	110.7	L375 E422 C428 G429 V430 V492	L375-V426 HydrophobicContact CD2-CG1 4.02Å; E422-V426 WeakPolarHBondContact O-CB 3.4Å; E422-V426 VanDerWaalsContact O-CG2 3.24Å; E422-V426 WeakPolarHBondContact O-CG2 3.21Å; E422-V426 PolarHBondContact O-N 3.33Å; V426-C428 PolarHBondContact O-N 3.24Å; V426-G429 PolarHBondContact O-N 3.4Å; V426-V430 HydrophobicContact CG1-CG2 4.24Å; V426-V430 WeakPolarHBondContact O-CG2 3.42Å; V426-V430 PolarHBondContact O-N 2.92Å; V426-V492 HydrophobicContact CG2-CG1 4.3Å
427	T	95.3	Very high	93.4	Very high	1 Å²	1	31.8 Å²	31.8	1%	0.006	15%	0.154	C	C	.	.	H	α-helix	trans	-61.7	-46.3	178.1	-55.7	0	0	0	0	111.5	M315 V371 L375 G423 N424 I425 G429 V430 V431	M315-T427 HydrophobicContact CE-CG2 3.89Å; M315-T427 HydrophobicContact SD-CG2 4.5Å; V371-T427 HydrophobicContact CG1-CG2 3.43Å; V371-T427 VanDerWaalsContact CG1-CG2 3.43Å; V371-T427 WeakPolarHBondContact O-CG2 3.33Å; L375-T427 HydrophobicContact CB-CG2 3.91Å; G423-T427 WeakPolarHBondContact O-CB 3.02Å; G423-T427 PolarHBondContact O-N 2.78Å; G423-T427 PolarHBondContact O-OG1 3.31Å; N424-T427 PolarHBondContact O-N 2.86Å; I425-T427 VanDerWaalsContact C-N 3.33Å; I425-T427 PolarHBondContact O-N 2.86Å; T427-G429 VanDerWaalsContact C-N 3.34Å; T427-G429 PolarHBondContact O-N 2.81Å; T427-V430 PolarHBondContact O-N 3.13Å; T427-V431 HydrophobicContact CG2-CB 4.41Å; T427-V431 HydrophobicContact CG2-CG2 3.76Å; T427-V431 VanDerWaalsContact O-CB 3.26Å; T427-V431 WeakPolarHBondContact O-CB 3.41Å; T427-V431 WeakPolarHBondContact O-CG2 3.31Å; T427-V431 PolarHBondContact O-N 2.84Å
428	C	94.6	Very high	93.8	Very high	0 Å²	0	30 Å²	30	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-54.4	-49.3	175.8	-78.4	0	0	0	0	112.1	V300 C301 E311 N424 I425 V426 G432	V300-C428 HydrophobicContact CG1-CB 4.09Å; C301-C428 WeakPolarHBondContact CA-O 2.95Å; E311-C428 PolarHBondContact OE1-SG 2.97Å; N424-C428 PolarHBondContact O-N 3.04Å; N424-C428 PolarHBondContact O-SG 3.27Å; N424-C428 VanDerWaalsContact O-SG 3.34Å; I425-C428 WeakPolarHBondContact O-CB 3.36Å; I425-C428 PolarHBondContact O-N 2.78Å; V426-C428 PolarHBondContact O-N 3.24Å; C428-G432 VanDerWaalsContact O-CA 3.3Å; C428-G432 WeakPolarHBondContact O-CA 3.24Å; C428-G432 PolarHBondContact O-N 2.71Å
429	G	95.9	Very high	94.1	Very high	0 Å²	0	22.1 Å²	22.1	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-63.9	-52	-179.3	0	0	0	0	0	112.4	C301 I425 V426 T427 A433	C301-G429 PolarHBondContact SG-O 3.47Å; I425-G429 PolarHBondContact O-N 3.09Å; V426-G429 PolarHBondContact O-N 3.4Å; T427-G429 VanDerWaalsContact C-N 3.34Å; T427-G429 PolarHBondContact O-N 2.81Å; G429-A433 WeakPolarHBondContact O-CB 3.42Å; G429-A433 PolarHBondContact O-N 3Å
430	V	96.7	Very high	94.4	Very high	40 Å²	40	18 Å²	18	24%	0.242	11%	0.105	C	C	.	.	H	α-helix	trans	-72.1	-49.9	-173.4	178.6	0	0	0	0	112.1	L375 L378 V426 T427 Y434 W484	L375-V430 HydrophobicContact CD1-CB 4.12Å; L375-V430 HydrophobicContact CD1-CG1 4.09Å; L378-V430 HydrophobicContact CD2-CG1 3.98Å; V426-V430 HydrophobicContact CG1-CG2 4.24Å; V426-V430 WeakPolarHBondContact O-CG2 3.42Å; V426-V430 PolarHBondContact O-N 2.92Å; T427-V430 PolarHBondContact O-N 3.13Å; V430-Y434 WeakPolarHBondContact O-CB 3.39Å; V430-Y434 PolarHBondContact O-N 3.31Å; V430-W484 HydrophobicContact CG1-CZ2 4.25Å; V430-W484 PolarHBondContact O-NE1 3.5Å
431	V	96.3	Very high	94.5	Very high	20 Å²	20	18 Å²	18	12%	0.121	10%	0.103	C	C	.	.	H	α-helix	trans	-71.6	-39.4	-178.6	179.5	0	0	0	0	110.6	M315 L378 T427 Y434 A435	M315-V431 HydrophobicContact CE-CB 4.48Å; L378-V431 HydrophobicContact CD2-CG2 4.01Å; T427-V431 HydrophobicContact CG2-CB 4.41Å; T427-V431 HydrophobicContact CG2-CG2 3.76Å; T427-V431 VanDerWaalsContact O-CB 3.26Å; T427-V431 WeakPolarHBondContact O-CB 3.41Å; T427-V431 WeakPolarHBondContact O-CG2 3.31Å; T427-V431 PolarHBondContact O-N 2.84Å; V431-Y434 PolarHBondContact O-N 2.91Å; V431-A435 PolarHBondContact O-N 3.28Å
432	G	96.3	Very high	94.5	Very high	4 Å²	4	17.4 Å²	17.4	4%	0.041	10%	0.103	C	C	.	.	H	α-helix	trans	-63.2	-42.2	175.4	0	0	0	0	0	112.5	G297 C428 A435 V436	G297-G432 CarbonylContact C-O 3.13Å; G297-G432 CarbonylContact O-C 3.56Å; G297-G432 VanDerWaalsContact O-CA 3.28Å; G297-G432 WeakPolarHBondContact O-CA 3.41Å; C428-G432 VanDerWaalsContact O-CA 3.3Å; C428-G432 WeakPolarHBondContact O-CA 3.24Å; C428-G432 PolarHBondContact O-N 2.71Å; G432-A435 PolarHBondContact O-N 3.34Å; G432-V436 PolarHBondContact O-N 3.44Å
433	A	97.3	Very high	94.4	Very high	0 Å²	0	19.9 Å²	19.9	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-66.5	-37.7	174	0	0	0	0	0	112.3	G429 A435 V436 V437 L487	G429-A433 WeakPolarHBondContact O-CB 3.42Å; G429-A433 PolarHBondContact O-N 3Å; A433-A435 VanDerWaalsContact C-N 3.32Å; A433-A435 PolarHBondContact O-N 2.93Å; A433-V436 WeakPolarHBondContact O-CB 3.25Å; A433-V436 PolarHBondContact O-N 2.99Å; A433-V436 VanDerWaalsContact O-N 3.11Å; A433-V437 PolarHBondContact O-N 2.82Å; A433-L487 HydrophobicContact CB-CB 3.74Å
434	Y	97.3	Very high	94.2	Very high	11 Å²	11	23.6 Å²	23.6	4%	0.043	13%	0.129	C	C	.	.	H	α-helix	trans	-64.2	-35.9	175.9	-176.9	-110.7	0	0	0	112.4	L378 V430 V431 V436 V437 L438 L448 I451 T452 W484	L378-Y434 HydrophobicContact CD1-CD1 3.72Å; L378-Y434 HydrophobicContact CD1-CD2 4.23Å; L378-Y434 HydrophobicContact CD1-CE1 3.83Å; L378-Y434 HydrophobicContact CD1-CE2 4.33Å; L378-Y434 HydrophobicContact CD1-CG 3.93Å; L378-Y434 HydrophobicContact CD2-CD1 4.31Å; L378-Y434 HydrophobicContact CD2-CG 4.15Å; V430-Y434 WeakPolarHBondContact O-CB 3.39Å; V430-Y434 PolarHBondContact O-N 3.31Å; V431-Y434 PolarHBondContact O-N 2.91Å; Y434-V436 PolarHBondContact O-N 2.89Å; Y434-V437 HydrophobicContact CD2-CB 4.42Å; Y434-V437 WeakPolarHBondContact O-CA 3.41Å; Y434-V437 WeakPolarHBondContact O-CB 3.36Å; Y434-V437 PolarHBondContact O-N 3.02Å; Y434-L438 HydrophobicContact CD1-CD1 4.06Å; Y434-L438 HydrophobicContact CD1-CG 4.22Å; Y434-L438 HydrophobicContact CE1-CD1 3.65Å; Y434-L438 HydrophobicContact CE1-CD2 4.01Å; Y434-L438 HydrophobicContact CE1-CG 3.81Å; Y434-L438 PolarHBondContact O-N 3.45Å; Y434-L448 PolarHBondContact OH-O 3.17Å; Y434-I451 HydrophobicContact CE2-CD1 4.28Å; Y434-T452 HydrophobicContact CE1-CG2 3.53Å; Y434-T452 WeakPolarHBondContact OH-CG2 3.24Å; Y434-T452 PolarHBondContact OH-N 2.66Å; Y434-T452 PolarHBondContact OH-OG1 2.97Å; Y434-W484 HydrophobicContact CD2-CD2 4.41Å; Y434-W484 AromaticContact CD2-CE2 3.97Å; Y434-W484 HydrophobicContact CD2-CH2 4.21Å; Y434-W484 AromaticContact CD2-CZ2 3.89Å; Y434-W484 HydrophobicContact CD2-CZ2 3.89Å; Y434-W484 HydrophobicContact CG-CZ2 4.29Å
435	A	96.5	Very high	93.6	Very high	20 Å²	20	24.6 Å²	24.6	17%	0.165	13%	0.133	C	C	.	.	H	α-helix	trans	-60.7	-30.9	173.6	0	0	0	0	0	112.8	G294 V431 G432 A433 L438 A439	G294-A435 WeakPolarHBondContact CA-O 3.41Å; V431-A435 PolarHBondContact O-N 3.28Å; G432-A435 PolarHBondContact O-N 3.34Å; A433-A435 VanDerWaalsContact C-N 3.32Å; A433-A435 PolarHBondContact O-N 2.93Å; A435-L438 PolarHBondContact O-N 3.29Å; A435-A439 PolarHBondContact O-N 3.07Å
436	V	96.4	Very high	93.3	Very high	26 Å²	26	24.6 Å²	24.6	16%	0.158	13%	0.133	C	C	.	.	H	α-helix	trans	-68.5	-41.2	172.5	-178.9	0	0	0	0	110.8	L298 G432 A433 Y434 L438 A439 V440 L487	L298-V436 HydrophobicContact CB-CG2 3.93Å; L298-V436 HydrophobicContact CD1-CG2 4.06Å; G432-V436 PolarHBondContact O-N 3.44Å; A433-V436 WeakPolarHBondContact O-CB 3.25Å; A433-V436 PolarHBondContact O-N 2.99Å; A433-V436 VanDerWaalsContact O-N 3.11Å; Y434-V436 PolarHBondContact O-N 2.89Å; V436-L438 VanDerWaalsContact C-N 3.32Å; V436-L438 PolarHBondContact O-N 3.35Å; V436-A439 WeakPolarHBondContact O-CB 3.29Å; V436-A439 PolarHBondContact O-N 3.39Å; V436-A439 VanDerWaalsContact O-N 3.15Å; V436-V440 WeakPolarHBondContact O-CG2 3.39Å; V436-V440 PolarHBondContact O-N 3.07Å; V436-L487 HydrophobicContact CB-CD1 4.34Å; V436-L487 HydrophobicContact CG1-CD1 4.13Å
437	V	96.1	Very high	92.9	Very high	0 Å²	0	22.7 Å²	22.7	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-58.5	-45.9	174.3	-180	0	0	0	0	110.6	A433 Y434 A439 V440 N441 L448 M480 W484	A433-V437 PolarHBondContact O-N 2.82Å; Y434-V437 HydrophobicContact CD2-CB 4.42Å; Y434-V437 WeakPolarHBondContact O-CA 3.41Å; Y434-V437 WeakPolarHBondContact O-CB 3.36Å; Y434-V437 PolarHBondContact O-N 3.02Å; V437-A439 VanDerWaalsContact C-N 3.29Å; V437-A439 PolarHBondContact O-N 2.82Å; V437-V440 PolarHBondContact O-N 2.9Å; V437-N441 WeakPolarHBondContact O-CB 3.3Å; V437-N441 PolarHBondContact O-N 3.47Å; V437-L448 HydrophobicContact CG1-CB 3.85Å; V437-L448 HydrophobicContact CG1-CD1 3.82Å; V437-M480 HydrophobicContact CB-CE 4.29Å; V437-M480 HydrophobicContact CG1-CE 4.06Å; V437-M480 HydrophobicContact CG2-CE 4.22Å; V437-W484 HydrophobicContact CG2-CB 3.69Å; V437-W484 HydrophobicContact CG2-CG 3.88Å
438	L	94.6	Very high	92.7	Very high	26 Å²	26	22.8 Å²	22.8	14%	0.136	12%	0.122	C	C	.	.	H	α-helix	trans	-61.9	-35.8	176.1	-66.7	-179.1	0	0	0	112.9	F290 Y434 A435 V436 N441 A442	F290-L438 HydrophobicContact CD1-CB 3.89Å; F290-L438 HydrophobicContact CD1-CD1 4.4Å; F290-L438 HydrophobicContact CE1-CB 4.14Å; F290-L438 HydrophobicContact CE1-CD1 3.95Å; Y434-L438 HydrophobicContact CD1-CD1 4.06Å; Y434-L438 HydrophobicContact CD1-CG 4.22Å; Y434-L438 HydrophobicContact CE1-CD1 3.65Å; Y434-L438 HydrophobicContact CE1-CD2 4.01Å; Y434-L438 HydrophobicContact CE1-CG 3.81Å; Y434-L438 PolarHBondContact O-N 3.45Å; A435-L438 PolarHBondContact O-N 3.29Å; V436-L438 VanDerWaalsContact C-N 3.32Å; V436-L438 PolarHBondContact O-N 3.35Å; L438-N441 PolarHBondContact O-N 3.48Å; L438-A442 PolarHBondContact O-N 3.02Å
439	A	94.8	Very high	92.5	Very high	13 Å²	13	23 Å²	23	11%	0.107	12%	0.123	C	C	.	.	H	α-helix	trans	-66.8	-43.3	175.6	0	0	0	0	0	112.2	F290 A435 V436 V437 N441 A442 Y443	F290-A439 VanDerWaalsContact O-CB 3.26Å; F290-A439 WeakPolarHBondContact O-CB 3.36Å; A435-A439 PolarHBondContact O-N 3.07Å; V436-A439 WeakPolarHBondContact O-CB 3.29Å; V436-A439 PolarHBondContact O-N 3.39Å; V436-A439 VanDerWaalsContact O-N 3.15Å; V437-A439 VanDerWaalsContact C-N 3.29Å; V437-A439 PolarHBondContact O-N 2.82Å; A439-N441 VanDerWaalsContact C-N 3.33Å; A439-A442 WeakPolarHBondContact O-CB 3.35Å; A439-A442 PolarHBondContact O-N 3.38Å; A439-Y443 WeakPolarHBondContact O-CD2 3.43Å
440	V	93.1	Very high	92.3	Very high	45 Å²	45	23.8 Å²	23.8	27%	0.273	13%	0.126	S	C	.	.	H	α-helix	trans	-64.6	-40.6	175.5	175.7	0	0	0	0	110.7	V436 V437 A442 Y443 I444 M480	V436-V440 WeakPolarHBondContact O-CG2 3.39Å; V436-V440 PolarHBondContact O-N 3.07Å; V437-V440 PolarHBondContact O-N 2.9Å; V440-A442 PolarHBondContact O-N 3.42Å; V440-A442 VanDerWaalsContact O-N 3.1Å; V440-Y443 PolarHBondContact O-N 3.15Å; V440-I444 HydrophobicContact CG1-CB 4.46Å; V440-I444 HydrophobicContact CG1-CD1 4.16Å; V440-I444 PolarHBondContact O-N 2.85Å; V440-M480 HydrophobicContact CB-CE 3.74Å; V440-M480 HydrophobicContact CB-SD 4.49Å; V440-M480 HydrophobicContact CG1-CE 3.78Å; V440-M480 HydrophobicContact CG1-SD 3.87Å; V440-M480 HydrophobicContact CG2-CE 4.05Å
441	N	90.1	Very high	92.2	Very high	35 Å²	35	22.1 Å²	22.1	19%	0.187	12%	0.116	C	C	.	.	H	α-helix	trans	-57.8	-25.7	177.1	-176.8	80.9	0	0	0	113.5	V437 L438 A439 Y443 I444 T446 S449	V437-N441 WeakPolarHBondContact O-CB 3.3Å; V437-N441 PolarHBondContact O-N 3.47Å; L438-N441 PolarHBondContact O-N 3.48Å; A439-N441 VanDerWaalsContact C-N 3.33Å; N441-Y443 PolarHBondContact O-N 2.81Å; N441-I444 CarbonylContact C-O 3.53Å; N441-I444 WeakPolarHBondContact CA-O 3.31Å; N441-T446 WeakPolarHBondContact CB-OG1 3.49Å; N441-T446 PolarHBondContact OD1-N 2.91Å; N441-T446 PolarHBondContact OD1-O 3.17Å; N441-T446 PolarHBondContact OD1-OG1 3.37Å; N441-S449 WeakPolarHBondContact ND2-CB 3.37Å; N441-S449 PolarHBondContact ND2-OG 3.5Å; N441-S449 VanDerWaalsContact ND2-OG 3.12Å; N441-S449 PolarHBondContact OD1-OG 3.01Å
442	A	89.4	Confident	92	Very high	11 Å²	11	22.3 Å²	22.3	9%	0.091	12%	0.117	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.2	-13.5	177.2	0	0	0	0	0	113.3	K287 F290 L438 A439 V440	K287-A442 VanDerWaalsContact CE-O 3.29Å; K287-A442 WeakPolarHBondContact CE-O 3.36Å; K287-A442 HydrophobicContact CG-CB 4.21Å; F290-A442 HydrophobicContact CB-CB 4.33Å; L438-A442 PolarHBondContact O-N 3.02Å; A439-A442 WeakPolarHBondContact O-CB 3.35Å; A439-A442 PolarHBondContact O-N 3.38Å; V440-A442 PolarHBondContact O-N 3.42Å; V440-A442 VanDerWaalsContact O-N 3.1Å
443	Y	88.4	Confident	91.8	Very high	121 Å²	121	24.7 Å²	24.7	48%	0.475	13%	0.129	S	C	.	.	T	Hydrogen-bonded Turn	trans	-119.7	-28.8	-179	-62.7	-83.1	0	0	0	113.4	K287 T291 A439 V440 N441	K287-Y443 HydrophobicContact CD-CE1 4.15Å; T291-Y443 HydrophobicContact CG2-CE2 3.38Å; T291-Y443 WeakPolarHBondContact CG2-OH 3.45Å; A439-Y443 WeakPolarHBondContact O-CD2 3.43Å; V440-Y443 PolarHBondContact O-N 3.15Å; N441-Y443 PolarHBondContact O-N 2.81Å
444	I	86.4	Confident	91.6	Very high	81 Å²	81	25.2 Å²	25.2	42%	0.415	13%	0.131	S	C	.	.	S	Bend	trans	-125.1	134.1	-179.7	-57.4	175	0	0	0	106.7	V440 N441 T446 I476	V440-I444 HydrophobicContact CG1-CB 4.46Å; V440-I444 HydrophobicContact CG1-CD1 4.16Å; V440-I444 PolarHBondContact O-N 2.85Å; N441-I444 CarbonylContact C-O 3.53Å; N441-I444 WeakPolarHBondContact CA-O 3.31Å; I444-T446 PolarHBondContact O-N 2.99Å; I444-I476 HydrophobicContact CG2-CD1 4.47Å; I444-I476 HydrophobicContact CG2-CG2 4.17Å
445	Y	81.5	Confident	91.5	Very high	22 Å²	22	25 Å²	25	9%	0.086	13%	0.131	C	C	.	.			trans	-63.8	128.2	175.1	179.6	-81.1	0	0	0	110	E195 I239 Q242	E195-Y445 HydrophobicContact CB-CD1 3.89Å; E195-Y445 HydrophobicContact CB-CE1 4.36Å; E195-Y445 HydrophobicContact CG-CD1 3.52Å; E195-Y445 HydrophobicContact CG-CE1 3.51Å; I239-Y445 HydrophobicContact CG2-CE2 3.51Å; I239-Y445 WeakPolarHBondContact CG2-OH 3.32Å; Q242-Y445 HydrophobicContact CB-CE1 4.46Å; Q242-Y445 HydrophobicContact CB-CE2 3.9Å; Q242-Y445 WeakPolarHBondContact CB-OH 3.48Å
446	T	86.8	Confident	91.3	Very high	0 Å²	0	25.3 Å²	25.3	0%	0	13%	0.13	C	C	.	.			trans	-142.6	141.1	173.1	73.9	0	0	0	0	110	N441 I444 L448 S449 I476 M480	N441-T446 WeakPolarHBondContact CB-OG1 3.49Å; N441-T446 PolarHBondContact OD1-N 2.91Å; N441-T446 PolarHBondContact OD1-O 3.17Å; N441-T446 PolarHBondContact OD1-OG1 3.37Å; I444-T446 PolarHBondContact O-N 2.99Å; T446-L448 PolarHBondContact O-N 3.48Å; T446-S449 PolarHBondContact O-OG 3.1Å; T446-I476 HydrophobicContact CG2-CG2 4.02Å; T446-M480 HydrophobicContact CG2-CG 4.01Å
447	S	87.9	Confident	91.1	Very high	1 Å²	1	25 Å²	25	1%	0.007	13%	0.126	C	C	.	.	G	3₁₀ helix	trans	-71.8	-19.4	176.6	70.4	0	0	0	0	112.3	S449 Y450 D477	S447-S449 VanDerWaalsContact C-N 3.27Å; S447-S449 PolarHBondContact O-N 3.43Å; S447-Y450 VanDerWaalsContact O-CB 3.27Å; S447-Y450 WeakPolarHBondContact O-CB 3.42Å; S447-Y450 PolarHBondContact O-N 3.33Å; S447-D477 WeakPolarHBondContact CB-OD2 3.25Å; S447-D477 PolarHBondContact N-OD1 3.27Å; S447-D477 PolarHBondContact OG-OD1 2.93Å; S447-D477 PolarHBondContact OG-OD2 3.46Å
448	L	90.6	Very high	90.9	Very high	3 Å²	3	26 Å²	26	2%	0.016	13%	0.13	C	C	.	.	G	3₁₀ helix	trans	-62.4	-26.8	-176	-64.1	177.1	0	0	0	114.9	Y434 V437 T446 Y450 I451 F473 M480 I481	Y434-L448 PolarHBondContact OH-O 3.17Å; V437-L448 HydrophobicContact CG1-CB 3.85Å; V437-L448 HydrophobicContact CG1-CD1 3.82Å; T446-L448 PolarHBondContact O-N 3.48Å; L448-Y450 PolarHBondContact O-N 2.79Å; L448-I451 HydrophobicContact CB-CD1 4.48Å; L448-I451 HydrophobicContact CD2-CD1 4.09Å; L448-I451 WeakPolarHBondContact O-CB 3.35Å; L448-I451 WeakPolarHBondContact O-CD1 3.35Å; L448-I451 VanDerWaalsContact O-CG1 3.28Å; L448-I451 WeakPolarHBondContact O-CG1 3.16Å; L448-I451 PolarHBondContact O-N 3.4Å; L448-F473 HydrophobicContact CD2-CE1 4.06Å; L448-M480 HydrophobicContact CD1-CB 3.44Å; L448-M480 VanDerWaalsContact CD1-CB 3.44Å; L448-I481 HydrophobicContact CD1-CG1 3.97Å; L448-I481 HydrophobicContact CD2-CD1 4.1Å; L448-I481 HydrophobicContact CD2-CG1 3.65Å; L448-I481 HydrophobicContact CG-CG1 4.38Å
449	S	90.7	Very high	90.8	Very high	3 Å²	3	28 Å²	28	2%	0.021	14%	0.138	C	C	.	.	G	3₁₀ helix	trans	-63.7	-25.2	174.5	63.3	0	0	0	0	112.7	N441 T446 S447 I451 T452 L453	N441-S449 WeakPolarHBondContact ND2-CB 3.37Å; N441-S449 PolarHBondContact ND2-OG 3.5Å; N441-S449 VanDerWaalsContact ND2-OG 3.12Å; N441-S449 PolarHBondContact OD1-OG 3.01Å; T446-S449 PolarHBondContact O-OG 3.1Å; S447-S449 VanDerWaalsContact C-N 3.27Å; S447-S449 PolarHBondContact O-N 3.43Å; S449-I451 PolarHBondContact O-N 2.82Å; S449-T452 PolarHBondContact O-N 3Å; S449-T452 PolarHBondContact O-OG1 3.3Å; S449-L453 VanDerWaalsContact O-CG 3.3Å; S449-L453 WeakPolarHBondContact O-CG 3.48Å; S449-L453 PolarHBondContact O-N 3.36Å
450	Y	91.1	Very high	90.6	Very high	18 Å²	18	28.4 Å²	28.4	7%	0.071	14%	0.138	C	C	.	.	H	α-helix	trans	-69.5	-14.7	178.2	-71.1	-88	0	0	0	114	N237 I239 P240 S447 L448 T452 L453 N454	N237-Y450 WeakPolarHBondContact ND2-CD1 3.35Å; I239-Y450 WeakPolarHBondContact CA-OH 3.45Å; I239-Y450 HydrophobicContact CG1-CE1 4.07Å; I239-Y450 HydrophobicContact CG1-CE2 4.45Å; I239-Y450 HydrophobicContact CG2-CE1 4.43Å; I239-Y450 HydrophobicContact CG2-CE2 3.63Å; I239-Y450 VanDerWaalsContact CG2-OH 3.23Å; I239-Y450 WeakPolarHBondContact CG2-OH 3.33Å; P240-Y450 WeakPolarHBondContact CD-OH 3.32Å; S447-Y450 VanDerWaalsContact O-CB 3.27Å; S447-Y450 WeakPolarHBondContact O-CB 3.42Å; S447-Y450 PolarHBondContact O-N 3.33Å; L448-Y450 PolarHBondContact O-N 2.79Å; Y450-T452 VanDerWaalsContact C-N 3.3Å; Y450-T452 PolarHBondContact O-N 3.32Å; Y450-L453 HydrophobicContact CD1-CB 4.25Å; Y450-L453 PolarHBondContact O-N 3Å; Y450-N454 WeakPolarHBondContact CD1-OD1 3.46Å; Y450-N454 WeakPolarHBondContact O-CB 3.42Å; Y450-N454 PolarHBondContact O-N 3.24Å; Y450-N454 PolarHBondContact O-ND2 3.48Å
451	I	93.9	Very high	90.4	Very high	5 Å²	5	27.5 Å²	27.5	3%	0.026	13%	0.132	C	C	.	.	H	α-helix	trans	-52.1	-52.7	168.9	-66	169.2	0	0	0	109.6	L378 A381 V382 F385 Y434 L448 S449 W484	L378-I451 HydrophobicContact CD1-CG2 4.31Å; A381-I451 HydrophobicContact CB-CG2 3.8Å; V382-I451 HydrophobicContact CG2-CD1 4.35Å; V382-I451 HydrophobicContact CG2-CG2 3.8Å; F385-I451 HydrophobicContact CB-CG1 4.21Å; F385-I451 HydrophobicContact CD1-CG1 3.82Å; F385-I451 HydrophobicContact CD2-CG1 4.1Å; F385-I451 HydrophobicContact CE1-CG1 4.18Å; F385-I451 HydrophobicContact CE2-CG1 4.45Å; F385-I451 HydrophobicContact CG-CG1 3.76Å; F385-I451 HydrophobicContact CZ-CG1 4.47Å; Y434-I451 HydrophobicContact CE2-CD1 4.28Å; L448-I451 HydrophobicContact CB-CD1 4.48Å; L448-I451 HydrophobicContact CD2-CD1 4.09Å; L448-I451 WeakPolarHBondContact O-CB 3.35Å; L448-I451 WeakPolarHBondContact O-CD1 3.35Å; L448-I451 VanDerWaalsContact O-CG1 3.28Å; L448-I451 WeakPolarHBondContact O-CG1 3.16Å; L448-I451 PolarHBondContact O-N 3.4Å; S449-I451 PolarHBondContact O-N 2.82Å; I451-W484 HydrophobicContact CD1-CH2 4.46Å; I451-W484 HydrophobicContact CD1-CZ3 4.1Å
452	T	93.6	Very high	90.2	Very high	23 Å²	23	30.4 Å²	30.4	14%	0.141	15%	0.147	C	C	.	.	H	α-helix	trans	-91.1	-28.7	178.5	50	0	0	0	0	113.6	F377 L378 Y434 S449 Y450 I455 L456	F377-T452 HydrophobicContact CE1-CG2 3.84Å; L378-T452 HydrophobicContact CD1-CG2 4.25Å; Y434-T452 HydrophobicContact CE1-CG2 3.53Å; Y434-T452 WeakPolarHBondContact OH-CG2 3.24Å; Y434-T452 PolarHBondContact OH-N 2.66Å; Y434-T452 PolarHBondContact OH-OG1 2.97Å; S449-T452 PolarHBondContact O-N 3Å; S449-T452 PolarHBondContact O-OG1 3.3Å; Y450-T452 VanDerWaalsContact C-N 3.3Å; Y450-T452 PolarHBondContact O-N 3.32Å; T452-I455 PolarHBondContact O-N 3.08Å; T452-L456 PolarHBondContact O-N 3.25Å; T452-L456 VanDerWaalsContact O-N 3.08Å
453	L	91.8	Very high	90	Very high	54 Å²	54	34.8 Å²	34.8	28%	0.283	17%	0.169	S	C	.	.	H	α-helix	trans	-69.9	-33.6	179.5	-65.1	169	0	0	0	112.4	S449 Y450 I455 L456 K457	S449-L453 VanDerWaalsContact O-CG 3.3Å; S449-L453 WeakPolarHBondContact O-CG 3.48Å; S449-L453 PolarHBondContact O-N 3.36Å; Y450-L453 HydrophobicContact CD1-CB 4.25Å; Y450-L453 PolarHBondContact O-N 3Å; L453-I455 VanDerWaalsContact C-N 3.32Å; L453-I455 PolarHBondContact O-N 3.49Å; L453-L456 HydrophobicContact CD2-CD2 4.09Å; L453-L456 CarbonylContact O-C 3.59Å; L453-L456 WeakPolarHBondContact O-CB 3.28Å; L453-L456 PolarHBondContact O-N 3.36Å; L453-L456 VanDerWaalsContact O-N 3.17Å; L453-K457 WeakPolarHBondContact O-CB 3.28Å; L453-K457 VanDerWaalsContact O-CG 3.28Å; L453-K457 WeakPolarHBondContact O-CG 3.34Å; L453-K457 PolarHBondContact O-N 2.96Å
454	N	92.9	Very high	90.1	Very high	11 Å²	11	29.3 Å²	29.3	6%	0.059	15%	0.148	C	C	.	.	H	α-helix	trans	-62.5	-41.8	176.7	-71.8	-10.2	0	0	0	111.3	N237 Y450 L456 K457 R458 F464	N237-N454 PolarHBondContact ND2-OD1 3.41Å; Y450-N454 WeakPolarHBondContact CD1-OD1 3.46Å; Y450-N454 WeakPolarHBondContact O-CB 3.42Å; Y450-N454 PolarHBondContact O-N 3.24Å; Y450-N454 PolarHBondContact O-ND2 3.48Å; N454-L456 VanDerWaalsContact C-N 3.35Å; N454-K457 PolarHBondContact O-N 2.68Å; N454-R458 PolarHBondContact O-N 2.87Å; N454-F464 HydrophobicContact CB-CE1 4.43Å; N454-F464 WeakPolarHBondContact O-CE1 3.39Å
455	I	94.1	Very high	90.1	Very high	6 Å²	6	26.4 Å²	26.4	3%	0.031	14%	0.135	C	C	.	.	H	α-helix	trans	-62.5	-44.3	173.8	-55.4	-56.2	0	0	0	110.6	F377 A381 F401 W402 F405 T452 L453 R458 F459	F377-I455 HydrophobicContact CE2-CG2 3.84Å; F377-I455 HydrophobicContact CZ-CB 4.34Å; F377-I455 HydrophobicContact CZ-CG2 3.95Å; A381-I455 HydrophobicContact CB-CG1 3.93Å; F401-I455 HydrophobicContact CE1-CD1 4.38Å; F401-I455 HydrophobicContact CZ-CD1 3.74Å; W402-I455 HydrophobicContact CH2-CG2 4.37Å; W402-I455 HydrophobicContact CZ3-CG2 4.31Å; F405-I455 HydrophobicContact CD2-CD1 4.1Å; F405-I455 HydrophobicContact CE2-CD1 3.75Å; F405-I455 HydrophobicContact CE2-CG1 4.02Å; F405-I455 HydrophobicContact CE2-CG2 4.21Å; F405-I455 HydrophobicContact CZ-CG2 4.06Å; T452-I455 PolarHBondContact O-N 3.08Å; L453-I455 VanDerWaalsContact C-N 3.32Å; L453-I455 PolarHBondContact O-N 3.49Å; I455-R458 PolarHBondContact O-N 3.26Å; I455-F459 HydrophobicContact CG2-CD2 3.89Å; I455-F459 HydrophobicContact CG2-CE2 3.63Å; I455-F459 VanDerWaalsContact O-CD2 3.24Å; I455-F459 WeakPolarHBondContact O-CD2 3.45Å; I455-F459 PolarHBondContact O-N 3.27Å
456	L	92.9	Very high	90.4	Very high	28 Å²	28	27.5 Å²	27.5	15%	0.147	15%	0.148	C	C	.	.	H	α-helix	trans	-61.1	-46.9	176.1	-179	61.2	0	0	0	111.7	F322 F325 V326 T452 L453 N454 R458 F459 L460	F322-L456 HydrophobicContact CE2-CB 4.4Å; F322-L456 HydrophobicContact CE2-CD1 4.2Å; F325-L456 HydrophobicContact CD1-CD1 4.01Å; F325-L456 HydrophobicContact CD1-CD2 4.38Å; F325-L456 HydrophobicContact CE1-CD1 4.24Å; F325-L456 HydrophobicContact CE1-CD2 4.04Å; V326-L456 HydrophobicContact CG2-CD1 3.56Å; T452-L456 PolarHBondContact O-N 3.25Å; T452-L456 VanDerWaalsContact O-N 3.08Å; L453-L456 HydrophobicContact CD2-CD2 4.09Å; L453-L456 CarbonylContact O-C 3.59Å; L453-L456 WeakPolarHBondContact O-CB 3.28Å; L453-L456 PolarHBondContact O-N 3.36Å; L453-L456 VanDerWaalsContact O-N 3.17Å; N454-L456 VanDerWaalsContact C-N 3.35Å; L456-R458 VanDerWaalsContact C-N 3.29Å; L456-R458 PolarHBondContact O-N 2.77Å; L456-F459 WeakPolarHBondContact O-CB 3.49Å; L456-F459 PolarHBondContact O-N 3.03Å; L456-F459 VanDerWaalsContact O-N 3.12Å; L456-L460 HydrophobicContact CD1-CD1 3.96Å; L456-L460 HydrophobicContact CD1-CG 4.11Å; L456-L460 HydrophobicContact CG-CD1 3.89Å; L456-L460 HydrophobicContact CG-CG 4.37Å; L456-L460 VanDerWaalsContact O-CG 3.24Å; L456-L460 WeakPolarHBondContact O-CG 3.35Å; L456-L460 PolarHBondContact O-N 3.03Å
457	K	92.1	Very high	90.5	Very high	19 Å²	19	27.6 Å²	27.6	8%	0.083	15%	0.149	C	C	.	.	H	α-helix	trans	-58.8	-41.1	177.6	-73.3	-177.2	172.5	-162.7	0	111.5	L149 Y150 N237 S238 L453 N454 L460 N461 F464	L149-K457 PolarHBondContact O-NZ 3.37Å; Y150-K457 HydrophobicContact CD1-CB 4.2Å; Y150-K457 HydrophobicContact CD1-CG 4.02Å; Y150-K457 PolarHBondContact O-NZ 2.96Å; N237-K457 WeakPolarHBondContact OD1-CD 3.41Å; N237-K457 PolarHBondContact OD1-NZ 3.24Å; S238-K457 PolarHBondContact O-NZ 3.37Å; L453-K457 WeakPolarHBondContact O-CB 3.28Å; L453-K457 VanDerWaalsContact O-CG 3.28Å; L453-K457 WeakPolarHBondContact O-CG 3.34Å; L453-K457 PolarHBondContact O-N 2.96Å; N454-K457 PolarHBondContact O-N 2.68Å; K457-L460 PolarHBondContact O-N 3.22Å; K457-L460 VanDerWaalsContact O-N 3.17Å; K457-N461 PolarHBondContact O-N 3.38Å; K457-F464 HydrophobicContact CB-CD1 3.99Å; K457-F464 HydrophobicContact CB-CD2 4.07Å; K457-F464 HydrophobicContact CB-CE1 3.87Å; K457-F464 HydrophobicContact CB-CE2 3.96Å; K457-F464 HydrophobicContact CB-CG 4.08Å; K457-F464 HydrophobicContact CB-CZ 3.85Å; K457-F464 HydrophobicContact CD-CD2 4.37Å; K457-F464 HydrophobicContact CD-CE2 3.68Å; K457-F464 HydrophobicContact CD-CZ 3.83Å; K457-F464 HydrophobicContact CG-CE2 4.49Å
458	R	92.8	Very high	90.7	Very high	22 Å²	22	28.3 Å²	28.3	8%	0.083	15%	0.152	C	C	.	.	H	α-helix	trans	-67.3	-33.6	176	-158.7	174.2	-179.1	148.3	0.9	113.3	F394 D398 F401 W402 N454 I455 L456 L460 F464	F394-R458 PolarHBondContact O-NH2 3.02Å; D398-R458 IonicContact OD1-CZ 2.61Å; D398-R458 VanDerWaalsContact OD1-CZ 3.27Å; D398-R458 IonicContact OD1-NE 3.76Å; D398-R458 PolarHBondContact OD1-NE 3.41Å; D398-R458 IonicContact OD1-NH2 2.8Å; D398-R458 PolarHBondContact OD1-NH2 3.33Å; F401-R458 VanDerWaalsContact CD1-CZ 3.48Å; F401-R458 VanDerWaalsContact CE1-CD 3.42Å; W402-R458 HydrophobicContact CH2-CB 4.33Å; W402-R458 HydrophobicContact CZ2-CB 4.09Å; W402-R458 HydrophobicContact CZ2-CG 3.85Å; N454-R458 PolarHBondContact O-N 2.87Å; I455-R458 PolarHBondContact O-N 3.26Å; L456-R458 VanDerWaalsContact C-N 3.29Å; L456-R458 PolarHBondContact O-N 2.77Å; R458-L460 VanDerWaalsContact C-N 3.33Å; R458-F464 HydrophobicContact CB-CD1 3.79Å; R458-F464 HydrophobicContact CB-CE1 4.39Å; R458-F464 HydrophobicContact CG-CD1 4.25Å
459	F	91.4	Very high	90.5	Very high	68 Å²	68	29 Å²	29	30%	0.298	16%	0.156	S	C	.	.	H	α-helix	trans	-67.3	-34.7	170.6	-84.3	-61.2	0	0	0	112.6	F322 V326 W402 I455 L456	F322-F459 HydrophobicContact CE1-CD2 4.38Å; F322-F459 HydrophobicContact CE1-CE2 4.1Å; F322-F459 HydrophobicContact CZ-CD2 4.06Å; F322-F459 HydrophobicContact CZ-CE2 4.07Å; V326-F459 HydrophobicContact CG1-CB 3.91Å; V326-F459 HydrophobicContact CG1-CD1 4.45Å; V326-F459 HydrophobicContact CG1-CG 4.29Å; V326-F459 HydrophobicContact CG2-CB 4.15Å; V326-F459 HydrophobicContact CG2-CG 4.44Å; W402-F459 HydrophobicContact CE3-CE1 4.24Å; W402-F459 HydrophobicContact CE3-CZ 4.05Å; W402-F459 AromaticContact CH2-CD1 3.6Å; W402-F459 HydrophobicContact CH2-CD1 3.6Å; W402-F459 AromaticContact CH2-CD2 3.64Å; W402-F459 HydrophobicContact CH2-CD2 3.64Å; W402-F459 AromaticContact CH2-CE1 3.47Å; W402-F459 HydrophobicContact CH2-CE1 3.47Å; W402-F459 VanDerWaalsContact CH2-CE1 3.47Å; W402-F459 AromaticContact CH2-CE2 3.51Å; W402-F459 HydrophobicContact CH2-CE2 3.51Å; W402-F459 AromaticContact CH2-CG 3.68Å; W402-F459 HydrophobicContact CH2-CG 3.68Å; W402-F459 AromaticContact CH2-CZ 3.42Å; W402-F459 HydrophobicContact CH2-CZ 3.42Å; W402-F459 VanDerWaalsContact CH2-CZ 3.42Å; W402-F459 AromaticContact CZ2-CD1 3.92Å; W402-F459 HydrophobicContact CZ2-CD1 3.92Å; W402-F459 AromaticContact CZ2-CE1 4Å; W402-F459 HydrophobicContact CZ2-CE1 4Å; W402-F459 HydrophobicContact CZ2-CG 4.22Å; W402-F459 HydrophobicContact CZ2-CZ 4.38Å; W402-F459 HydrophobicContact CZ3-CD1 4.23Å; W402-F459 HydrophobicContact CZ3-CD2 4.17Å; W402-F459 AromaticContact CZ3-CE1 3.61Å; W402-F459 HydrophobicContact CZ3-CE1 3.61Å; W402-F459 AromaticContact CZ3-CE2 3.54Å; W402-F459 HydrophobicContact CZ3-CE2 3.54Å; W402-F459 HydrophobicContact CZ3-CG 4.48Å; W402-F459 AromaticContact CZ3-CZ 3.22Å; W402-F459 HydrophobicContact CZ3-CZ 3.22Å; I455-F459 HydrophobicContact CG2-CD2 3.89Å; I455-F459 HydrophobicContact CG2-CE2 3.63Å; I455-F459 VanDerWaalsContact O-CD2 3.24Å; I455-F459 WeakPolarHBondContact O-CD2 3.45Å; I455-F459 PolarHBondContact O-N 3.27Å; L456-F459 WeakPolarHBondContact O-CB 3.49Å; L456-F459 PolarHBondContact O-N 3.03Å; L456-F459 VanDerWaalsContact O-N 3.12Å
460	L	90.8	Very high	90.1	Very high	21 Å²	21	29.9 Å²	29.9	11%	0.11	16%	0.161	C	C	.	.	H	α-helix	trans	-86.3	-37.8	-173	-66.4	-178.6	0	0	0	113.2	Y150 F325 T329 R330 L456 K457 R458	Y150-L460 HydrophobicContact CE1-CB 3.74Å; Y150-L460 HydrophobicContact CE1-CD1 4.08Å; F325-L460 HydrophobicContact CE1-CD1 4.34Å; T329-L460 HydrophobicContact CG2-CD1 4.13Å; T329-L460 HydrophobicContact CG2-CD2 3.52Å; T329-L460 HydrophobicContact CG2-CG 4.36Å; R330-L460 HydrophobicContact CG-CD2 4.23Å; R330-L460 PolarHBondContact NH1-O 3.29Å; L456-L460 HydrophobicContact CD1-CD1 3.96Å; L456-L460 HydrophobicContact CD1-CG 4.11Å; L456-L460 HydrophobicContact CG-CD1 3.89Å; L456-L460 HydrophobicContact CG-CG 4.37Å; L456-L460 VanDerWaalsContact O-CG 3.24Å; L456-L460 WeakPolarHBondContact O-CG 3.35Å; L456-L460 PolarHBondContact O-N 3.03Å; K457-L460 PolarHBondContact O-N 3.22Å; K457-L460 VanDerWaalsContact O-N 3.17Å; R458-L460 VanDerWaalsContact C-N 3.33Å
461	N	89.4	Confident	89.7	Confident	25 Å²	25	29.4 Å²	29.4	13%	0.134	16%	0.16	C	C	.	.			trans	-119.9	121.9	-177.2	-177.5	14.5	0	0	0	111.1	Y150 K457 N463 F464	Y150-N461 HydrophobicContact CD1-CB 4.06Å; Y150-N461 HydrophobicContact CD2-CB 4.14Å; Y150-N461 HydrophobicContact CG-CB 3.85Å; K457-N461 PolarHBondContact O-N 3.38Å; N461-N463 VanDerWaalsContact C-N 3.28Å; N461-N463 PolarHBondContact O-N 3.34Å; N461-N463 PolarHBondContact OD1-N 3.04Å; N461-F464 HydrophobicContact CB-CB 4.11Å; N461-F464 WeakPolarHBondContact O-CB 3.49Å; N461-F464 PolarHBondContact O-N 2.72Å
462	N	85.9	Confident	89.1	Confident	97 Å²	97	31.3 Å²	31.3	52%	0.519	17%	0.173	S	C	.	.	G	3₁₀ helix	trans	-70	-26.2	178.9	-59.8	-13.5	0	0	0	112.3	R330 F464 S465	R330-N462 PolarHBondContact NH1-OD1 3.45Å; R330-N462 PolarHBondContact NH2-OD1 3.36Å; N462-F464 VanDerWaalsContact C-N 3.3Å; N462-S465 PolarHBondContact O-OG 3.25Å
463	N	85.6	Confident	88.7	Confident	103 Å²	103	34.2 Å²	34.2	55%	0.551	18%	0.183	S	C	*	.	G	3₁₀ helix	trans	-78.9	-17.2	-179	-63.2	-15.1	0	0	0	112.7	N461 S465 A466	N461-N463 VanDerWaalsContact C-N 3.28Å; N461-N463 PolarHBondContact O-N 3.34Å; N461-N463 PolarHBondContact OD1-N 3.04Å; N463-S465 PolarHBondContact O-N 3.31Å; N463-S465 VanDerWaalsContact O-N 3.08Å; N463-A466 PolarHBondContact O-N 3.14Å
464	F	89.4	Confident	88.6	Confident	5 Å²	5	33.5 Å²	33.5	2%	0.022	18%	0.179	C	C	.	.	G	3₁₀ helix	trans	-65.7	-14.3	-177.8	-170.7	-99.1	0	0	0	113	Y150 N237 N454 K457 R458 N461 N462 A466 A467 T469	Y150-F464 WeakPolarHBondContact O-CE2 3.37Å; N237-F464 HydrophobicContact CB-CE2 4.42Å; N237-F464 HydrophobicContact CB-CZ 4.5Å; N237-F464 WeakPolarHBondContact OD1-CE2 3.29Å; N454-F464 HydrophobicContact CB-CE1 4.43Å; N454-F464 WeakPolarHBondContact O-CE1 3.39Å; K457-F464 HydrophobicContact CB-CD1 3.99Å; K457-F464 HydrophobicContact CB-CD2 4.07Å; K457-F464 HydrophobicContact CB-CE1 3.87Å; K457-F464 HydrophobicContact CB-CE2 3.96Å; K457-F464 HydrophobicContact CB-CG 4.08Å; K457-F464 HydrophobicContact CB-CZ 3.85Å; K457-F464 HydrophobicContact CD-CD2 4.37Å; K457-F464 HydrophobicContact CD-CE2 3.68Å; K457-F464 HydrophobicContact CD-CZ 3.83Å; K457-F464 HydrophobicContact CG-CE2 4.49Å; R458-F464 HydrophobicContact CB-CD1 3.79Å; R458-F464 HydrophobicContact CB-CE1 4.39Å; R458-F464 HydrophobicContact CG-CD1 4.25Å; N461-F464 HydrophobicContact CB-CB 4.11Å; N461-F464 WeakPolarHBondContact O-CB 3.49Å; N461-F464 PolarHBondContact O-N 2.72Å; N462-F464 VanDerWaalsContact C-N 3.3Å; F464-A466 PolarHBondContact O-N 3.16Å; F464-A467 HydrophobicContact CD2-CB 4.07Å; F464-A467 HydrophobicContact CE2-CB 4.19Å; F464-A467 WeakPolarHBondContact O-CB 3.33Å; F464-A467 PolarHBondContact O-N 3.29Å; F464-A467 VanDerWaalsContact O-N 3.15Å; F464-T469 HydrophobicContact CE1-CG2 3.95Å; F464-T469 HydrophobicContact CZ-CG2 3.83Å
465	S	87.3	Confident	88.4	Confident	20 Å²	20	38.7 Å²	38.7	14%	0.14	21%	0.211	C	C	.	.	G	3₁₀ helix	trans	-59.2	-32.6	176.4	56.6	0	0	0	0	113.1	R395 D398 N462 N463 A467	R395-S465 VanDerWaalsContact CA-O 3.24Å; R395-S465 WeakPolarHBondContact CA-O 3.26Å; D398-S465 WeakPolarHBondContact OD1-CB 3.12Å; D398-S465 WeakPolarHBondContact OD2-CB 3.24Å; N462-S465 PolarHBondContact O-OG 3.25Å; N463-S465 PolarHBondContact O-N 3.31Å; N463-S465 VanDerWaalsContact O-N 3.08Å; S465-A467 VanDerWaalsContact C-N 3.34Å
466	A	86.6	Confident	88.1	Confident	45 Å²	45	41.1 Å²	41.1	37%	0.372	22%	0.224	S	C	.	.	G	3₁₀ helix	trans	-81	-13.5	179.6	0	0	0	0	0	113.9	R395 N463 F464	R395-A466 PolarHBondContact NE-O 3.34Å; R395-A466 PolarHBondContact NH2-O 3.12Å; N463-A466 PolarHBondContact O-N 3.14Å; F464-A466 PolarHBondContact O-N 3.16Å
467	A	90.3	Very high	88.1	Confident	3 Å²	3	39.8 Å²	39.8	3%	0.025	22%	0.217	C	C	.	.	S	Bend	trans	-74.5	138.5	-170.7	0	0	0	0	0	112.4	A235 F464 S465	A235-A467 HydrophobicContact CB-CB 4.11Å; A235-A467 VanDerWaalsContact O-CA 3.27Å; A235-A467 WeakPolarHBondContact O-CA 3.43Å; F464-A467 HydrophobicContact CD2-CB 4.07Å; F464-A467 HydrophobicContact CE2-CB 4.19Å; F464-A467 WeakPolarHBondContact O-CB 3.33Å; F464-A467 PolarHBondContact O-N 3.29Å; F464-A467 VanDerWaalsContact O-N 3.15Å; S465-A467 VanDerWaalsContact C-N 3.34Å
468	F	90.4	Very high	88.1	Confident	15 Å²	15	45.4 Å²	45.4	7%	0.066	24%	0.238	C	C	.	.	B	Isolated β-bridge	trans	-72.8	130.6	166.8	-65.8	-82	0	0	0	110	V223 V224 M234 A235 F236 N237	V223-F468 HydrophobicContact CG1-CB 4.38Å; V223-F468 HydrophobicContact CG1-CD1 3.54Å; V223-F468 HydrophobicContact CG1-CD2 3.82Å; V223-F468 HydrophobicContact CG1-CE1 3.57Å; V223-F468 HydrophobicContact CG1-CE2 3.87Å; V223-F468 HydrophobicContact CG1-CG 3.65Å; V223-F468 HydrophobicContact CG1-CZ 3.73Å; V224-F468 HydrophobicContact CB-CZ 3.93Å; V224-F468 HydrophobicContact CG1-CE2 4.2Å; V224-F468 HydrophobicContact CG1-CZ 3.92Å; V224-F468 HydrophobicContact CG2-CZ 4.43Å; M234-F468 HydrophobicContact CE-CE2 3.9Å; M234-F468 HydrophobicContact CE-CZ 4.09Å; A235-F468 WeakPolarHBondContact O-CD2 3.38Å; A235-F468 PolarHBondContact O-N 3.06Å; F236-F468 HydrophobicContact CD1-CB 3.85Å; F236-F468 HydrophobicContact CD1-CD2 4.03Å; F236-F468 HydrophobicContact CD1-CG 4.34Å; F236-F468 HydrophobicContact CE1-CB 4.21Å; F236-F468 AromaticContact CE1-CD2 3.77Å; F236-F468 HydrophobicContact CE1-CD2 3.77Å; F236-F468 HydrophobicContact CE1-CG 4.26Å; F236-F468 HydrophobicContact CZ-CD2 4.19Å; N237-F468 WeakPolarHBondContact CB-O 3.35Å; N237-F468 PolarHBondContact N-O 2.99Å
469	T	88.1	Confident	88.1	Confident	17 Å²	17	46.8 Å²	46.8	10%	0.104	26%	0.255	C	S	.	.			trans	-111.9	-6.4	-172.2	65.4	0	0	0	0	114.5	D390 F464 T471	D390-T469 PolarHBondContact OD1-N 2.92Å; D390-T469 PolarHBondContact OD1-OG1 2.9Å; D390-T469 PolarHBondContact OD2-N 3.37Å; F464-T469 HydrophobicContact CE1-CG2 3.95Å; F464-T469 HydrophobicContact CZ-CG2 3.83Å; T469-T471 PolarHBondContact O-N 3.34Å
470	D	82.6	Confident	88.3	Confident	23 Å²	23	44.6 Å²	44.6	12%	0.123	25%	0.245	C	C	.	.			trans	-65.3	128	-179.4	-158	-40.2	0	0	0	113.2	R221 D390	R221-D470 IonicContact CZ-OD1 2.97Å; R221-D470 IonicContact CZ-OD2 3.06Å; R221-D470 IonicContact NH1-OD1 2.71Å; R221-D470 PolarHBondContact NH1-OD1 3.29Å; R221-D470 IonicContact NH1-OD2 3.5Å; R221-D470 PolarHBondContact NH1-OD2 2.88Å; R221-D470 IonicContact NH2-OD1 3.93Å; R221-D470 IonicContact NH2-OD2 3.27Å; R221-D470 PolarHBondContact NH2-OD2 3.49Å; D390-D470 VanDerWaalsContact OD2-CB 3.29Å; D390-D470 WeakPolarHBondContact OD2-CB 3.45Å; D390-D470 PolarHBondContact OD2-N 3.47Å
471	T	82.1	Confident	88.5	Confident	8 Å²	8	45.8 Å²	45.8	5%	0.049	25%	0.252	C	S	.	.			trans	-125.1	132.6	178.6	53.5	0	0	0	0	109.6	I239 F385 T469	I239-T471 HydrophobicContact CD1-CG2 3.36Å; F385-T471 VanDerWaalsContact CZ-OG1 3.28Å; F385-T471 WeakPolarHBondContact CZ-OG1 3.39Å; T469-T471 PolarHBondContact O-N 3.34Å
472	P	81.8	Confident	88.7	Confident	45 Å²	45	48.7 Å²	48.7	29%	0.292	27%	0.27	S	S	.	.			trans	-71.4	138.6	179.6	31.1	-34.8	0	0	0	110.1	F192 Q474	F192-P472 HydrophobicContact CB-CG 3.69Å; F192-P472 HydrophobicContact CD1-CG 3.99Å; F192-P472 HydrophobicContact CD2-CG 3.39Å; F192-P472 HydrophobicContact CE1-CG 4.48Å; F192-P472 HydrophobicContact CE2-CG 3.93Å; F192-P472 HydrophobicContact CG-CG 3.41Å; F192-P472 VanDerWaalsContact CG-CG 3.41Å; F192-P472 HydrophobicContact CZ-CG 4.45Å; P472-Q474 PolarHBondContact O-N 2.91Å
473	F	84.8	Confident	89.2	Confident	83 Å²	83	47 Å²	47	36%	0.364	26%	0.264	S	S	.	.			trans	-74.1	122.8	170.6	-68.2	-56.1	0	0	0	110.3	F385 L448 D477 Y478 I481	F385-F473 HydrophobicContact CD1-CZ 4.43Å; F385-F473 AromaticContact CE1-CE1 3.86Å; F385-F473 HydrophobicContact CE1-CE1 3.86Å; F385-F473 AromaticContact CE1-CZ 3.76Å; F385-F473 HydrophobicContact CE1-CZ 3.76Å; L448-F473 HydrophobicContact CD2-CE1 4.06Å; F473-D477 WeakPolarHBondContact CA-OD2 3.3Å; F473-D477 HydrophobicContact CB-CB 4.22Å; F473-D477 HydrophobicContact CD1-CB 3.71Å; F473-D477 HydrophobicContact CG-CB 4.43Å; F473-Y478 HydrophobicContact CB-CE1 3.97Å; F473-Y478 HydrophobicContact CB-CE2 4.06Å; F473-I481 HydrophobicContact CD1-CD1 4.14Å; F473-I481 HydrophobicContact CE1-CD1 3.99Å; F473-I481 HydrophobicContact CZ-CD1 4.27Å
474	Q	88.4	Confident	89.8	Confident	39 Å²	39	43.8 Å²	43.8	18%	0.182	24%	0.244	C	C	.	.			trans	-98.4	179.2	170.8	-58.5	-160.7	4.8	0	0	111.6	L193 E195 P472 I476 D477 Y478	L193-Q474 PolarHBondContact O-NE2 2.97Å; E195-Q474 HydrophobicContact CG-CB 4.3Å; E195-Q474 VanDerWaalsContact CG-CD 3.45Å; E195-Q474 HydrophobicContact CG-CG 4.06Å; E195-Q474 VanDerWaalsContact CG-OE1 3.27Å; P472-Q474 PolarHBondContact O-N 2.91Å; Q474-I476 PolarHBondContact O-N 3.48Å; Q474-D477 PolarHBondContact N-OD2 3.45Å; Q474-D477 VanDerWaalsContact N-OD2 3.17Å; Q474-D477 WeakPolarHBondContact O-CB 3.44Å; Q474-D477 PolarHBondContact O-N 3.5Å; Q474-D477 VanDerWaalsContact O-N 3.08Å; Q474-Y478 WeakPolarHBondContact O-CD2 3.5Å; Q474-Y478 PolarHBondContact O-N 3.03Å
475	T	88.9	Confident	90.1	Very high	121 Å²	121	47.5 Å²	47.5	74%	0.742	27%	0.267	S	S	*	.	H	α-helix	trans	-54.8	-37.7	-179.2	18.9	0	0	0	0	113.6	Y478 A479	T475-Y478 PolarHBondContact O-N 2.78Å; T475-A479 PolarHBondContact O-N 3.47Å; T475-A479 VanDerWaalsContact O-N 3.1Å
476	I	88.9	Confident	90.6	Very high	57 Å²	57	50.7 Å²	50.7	29%	0.292	29%	0.285	S	S	.	.	H	α-helix	trans	-67.5	-42.1	178.5	-62.6	173.4	0	0	0	109.9	E195 I444 T446 Q474 Y478 A479 M480	E195-I476 HydrophobicContact CB-CD1 4.49Å; I444-I476 HydrophobicContact CG2-CD1 4.47Å; I444-I476 HydrophobicContact CG2-CG2 4.17Å; T446-I476 HydrophobicContact CG2-CG2 4.02Å; Q474-I476 PolarHBondContact O-N 3.48Å; I476-Y478 PolarHBondContact O-N 3.29Å; I476-A479 WeakPolarHBondContact O-CB 3.11Å; I476-A479 PolarHBondContact O-N 3.16Å; I476-M480 HydrophobicContact CG2-CG 4.32Å; I476-M480 WeakPolarHBondContact O-CB 3.42Å; I476-M480 WeakPolarHBondContact O-CG 3.32Å; I476-M480 PolarHBondContact O-N 2.84Å
477	D	91.6	Very high	91.1	Very high	0 Å²	0	50.2 Å²	50.2	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-63.2	-43.4	177	-64.6	-40.4	0	0	0	112.4	E195 S447 F473 Q474 A479 M480 I481	E195-D477 VanDerWaalsContact OE1-OD2 3.14Å; S447-D477 WeakPolarHBondContact CB-OD2 3.25Å; S447-D477 PolarHBondContact N-OD1 3.27Å; S447-D477 PolarHBondContact OG-OD1 2.93Å; S447-D477 PolarHBondContact OG-OD2 3.46Å; F473-D477 WeakPolarHBondContact CA-OD2 3.3Å; F473-D477 HydrophobicContact CB-CB 4.22Å; F473-D477 HydrophobicContact CD1-CB 3.71Å; F473-D477 HydrophobicContact CG-CB 4.43Å; Q474-D477 PolarHBondContact N-OD2 3.45Å; Q474-D477 VanDerWaalsContact N-OD2 3.17Å; Q474-D477 WeakPolarHBondContact O-CB 3.44Å; Q474-D477 PolarHBondContact O-N 3.5Å; Q474-D477 VanDerWaalsContact O-N 3.08Å; D477-A479 VanDerWaalsContact C-N 3.3Å; D477-A479 PolarHBondContact O-N 3.34Å; D477-M480 PolarHBondContact O-N 3.05Å; D477-M480 VanDerWaalsContact O-N 3.16Å; D477-I481 WeakPolarHBondContact O-CB 3.22Å; D477-I481 VanDerWaalsContact O-CG1 3.24Å; D477-I481 WeakPolarHBondContact O-CG1 3.25Å; D477-I481 PolarHBondContact O-N 3.3Å
478	Y	92.8	Very high	91.4	Very high	136 Å²	136	50.4 Å²	50.4	53%	0.533	28%	0.278	S	S	.	.	H	α-helix	trans	-59.4	-44	175	-68.9	-60.5	0	0	0	111.3	F473 Q474 T475 I476 M480 I481 T482	F473-Y478 HydrophobicContact CB-CE1 3.97Å; F473-Y478 HydrophobicContact CB-CE2 4.06Å; Q474-Y478 WeakPolarHBondContact O-CD2 3.5Å; Q474-Y478 PolarHBondContact O-N 3.03Å; T475-Y478 PolarHBondContact O-N 2.78Å; I476-Y478 PolarHBondContact O-N 3.29Å; Y478-M480 PolarHBondContact O-N 3.32Å; Y478-I481 PolarHBondContact O-N 3Å; Y478-T482 WeakPolarHBondContact O-CG2 3.01Å; Y478-T482 PolarHBondContact O-N 3.37Å
479	A	93.5	Very high	91.8	Very high	52 Å²	52	53.6 Å²	53.6	43%	0.43	30%	0.298	S	S	.	.	H	α-helix	trans	-60	-46	174.5	0	0	0	0	0	111.3	T475 I476 D477 I481 T482 V483	T475-A479 PolarHBondContact O-N 3.47Å; T475-A479 VanDerWaalsContact O-N 3.1Å; I476-A479 WeakPolarHBondContact O-CB 3.11Å; I476-A479 PolarHBondContact O-N 3.16Å; D477-A479 VanDerWaalsContact C-N 3.3Å; D477-A479 PolarHBondContact O-N 3.34Å; A479-I481 PolarHBondContact O-N 3.34Å; A479-T482 PolarHBondContact O-N 2.88Å; A479-T482 PolarHBondContact O-OG1 3.36Å; A479-V483 WeakPolarHBondContact O-CG2 3.31Å; A479-V483 PolarHBondContact O-N 2.85Å
480	M	94.1	Very high	92.2	Very high	21 Å²	21	55.4 Å²	55.4	10%	0.103	31%	0.311	C	S	.	.	H	α-helix	trans	-69.5	-33.5	-179	-71.2	-57.6	-57.8	0	0	113.6	V437 V440 T446 L448 I476 D477 Y478 V483 W484	V437-M480 HydrophobicContact CB-CE 4.29Å; V437-M480 HydrophobicContact CG1-CE 4.06Å; V437-M480 HydrophobicContact CG2-CE 4.22Å; V440-M480 HydrophobicContact CB-CE 3.74Å; V440-M480 HydrophobicContact CB-SD 4.49Å; V440-M480 HydrophobicContact CG1-CE 3.78Å; V440-M480 HydrophobicContact CG1-SD 3.87Å; V440-M480 HydrophobicContact CG2-CE 4.05Å; T446-M480 HydrophobicContact CG2-CG 4.01Å; L448-M480 HydrophobicContact CD1-CB 3.44Å; L448-M480 VanDerWaalsContact CD1-CB 3.44Å; I476-M480 HydrophobicContact CG2-CG 4.32Å; I476-M480 WeakPolarHBondContact O-CB 3.42Å; I476-M480 WeakPolarHBondContact O-CG 3.32Å; I476-M480 PolarHBondContact O-N 2.84Å; D477-M480 PolarHBondContact O-N 3.05Å; D477-M480 VanDerWaalsContact O-N 3.16Å; Y478-M480 PolarHBondContact O-N 3.32Å; M480-V483 PolarHBondContact O-N 3.26Å; M480-W484 WeakPolarHBondContact O-CB 3.32Å; M480-W484 PolarHBondContact O-N 2.97Å
481	I	94.9	Very high	92.8	Very high	47 Å²	47	54.3 Å²	54.3	24%	0.241	31%	0.306	C	S	.	.	H	α-helix	trans	-61.6	-45.6	170.2	-69.9	166.7	0	0	0	109.7	L448 F473 D477 Y478 A479 V483 W484 V485	L448-I481 HydrophobicContact CD1-CG1 3.97Å; L448-I481 HydrophobicContact CD2-CD1 4.1Å; L448-I481 HydrophobicContact CD2-CG1 3.65Å; L448-I481 HydrophobicContact CG-CG1 4.38Å; F473-I481 HydrophobicContact CD1-CD1 4.14Å; F473-I481 HydrophobicContact CE1-CD1 3.99Å; F473-I481 HydrophobicContact CZ-CD1 4.27Å; D477-I481 WeakPolarHBondContact O-CB 3.22Å; D477-I481 VanDerWaalsContact O-CG1 3.24Å; D477-I481 WeakPolarHBondContact O-CG1 3.25Å; D477-I481 PolarHBondContact O-N 3.3Å; Y478-I481 PolarHBondContact O-N 3Å; A479-I481 PolarHBondContact O-N 3.34Å; I481-V483 VanDerWaalsContact C-N 3.34Å; I481-V483 PolarHBondContact O-N 3.37Å; I481-W484 PolarHBondContact O-N 3.47Å; I481-V485 HydrophobicContact CG2-CG2 4.33Å; I481-V485 WeakPolarHBondContact O-CG2 3.31Å; I481-V485 PolarHBondContact O-N 2.85Å
482	T	95.7	Very high	93.5	Very high	85 Å²	85	55.1 Å²	55.1	52%	0.521	31%	0.31	S	S	.	.	H	α-helix	trans	-62.1	-43	178	64.9	0	0	0	0	111.6	Y478 A479 W484 V485 V486	Y478-T482 WeakPolarHBondContact O-CG2 3.01Å; Y478-T482 PolarHBondContact O-N 3.37Å; A479-T482 PolarHBondContact O-N 2.88Å; A479-T482 PolarHBondContact O-OG1 3.36Å; T482-W484 PolarHBondContact O-N 2.99Å; T482-V485 PolarHBondContact O-N 3.24Å; T482-V486 WeakPolarHBondContact O-CB 3.42Å; T482-V486 WeakPolarHBondContact O-CG2 3.28Å; T482-V486 PolarHBondContact O-N 3.03Å
483	V	95.8	Very high	94.1	Very high	63 Å²	63	57 Å²	57	38%	0.382	32%	0.321	S	S	.	.	H	α-helix	trans	-60.1	-46	175.1	170.7	0	0	0	0	110.7	A479 M480 I481 V486 L487	A479-V483 WeakPolarHBondContact O-CG2 3.31Å; A479-V483 PolarHBondContact O-N 2.85Å; M480-V483 PolarHBondContact O-N 3.26Å; I481-V483 VanDerWaalsContact C-N 3.34Å; I481-V483 PolarHBondContact O-N 3.37Å; V483-V486 PolarHBondContact O-N 3.17Å; V483-L487 HydrophobicContact CG1-CD1 3.69Å; V483-L487 HydrophobicContact CG1-CG 4.24Å; V483-L487 VanDerWaalsContact O-CB 3.28Å; V483-L487 WeakPolarHBondContact O-CB 3.36Å; V483-L487 VanDerWaalsContact O-CG 3.25Å; V483-L487 WeakPolarHBondContact O-CG 3.21Å; V483-L487 PolarHBondContact O-N 3.4Å
484	W	97.4	Very high	94.6	Very high	35 Å²	35	57 Å²	57	13%	0.133	32%	0.324	C	S	.	.	H	α-helix	trans	-61.1	-48.6	179.9	-177.2	23.9	0	0	0	112.2	L378 V382 V430 Y434 V437 I451 M480 I481 T482 G488	L378-W484 HydrophobicContact CD2-CZ2 4.09Å; L378-W484 HydrophobicContact CG-CZ2 4.48Å; V382-W484 HydrophobicContact CG2-CH2 3.82Å; V382-W484 HydrophobicContact CG2-CZ3 4.48Å; V430-W484 HydrophobicContact CG1-CZ2 4.25Å; V430-W484 PolarHBondContact O-NE1 3.5Å; Y434-W484 HydrophobicContact CD2-CD2 4.41Å; Y434-W484 AromaticContact CD2-CE2 3.97Å; Y434-W484 HydrophobicContact CD2-CH2 4.21Å; Y434-W484 AromaticContact CD2-CZ2 3.89Å; Y434-W484 HydrophobicContact CD2-CZ2 3.89Å; Y434-W484 HydrophobicContact CG-CZ2 4.29Å; V437-W484 HydrophobicContact CG2-CB 3.69Å; V437-W484 HydrophobicContact CG2-CG 3.88Å; I451-W484 HydrophobicContact CD1-CH2 4.46Å; I451-W484 HydrophobicContact CD1-CZ3 4.1Å; M480-W484 WeakPolarHBondContact O-CB 3.32Å; M480-W484 PolarHBondContact O-N 2.97Å; I481-W484 PolarHBondContact O-N 3.47Å; T482-W484 PolarHBondContact O-N 2.99Å; W484-G488 PolarHBondContact O-N 3.22Å
485	V	97.1	Very high	94.9	Very high	83 Å²	83	55.3 Å²	55.3	50%	0.503	32%	0.316	S	S	.	.	H	α-helix	trans	-64.5	-46.1	179.6	173	0	0	0	0	110.9	I481 T482 G488 V489	I481-V485 HydrophobicContact CG2-CG2 4.33Å; I481-V485 WeakPolarHBondContact O-CG2 3.31Å; I481-V485 PolarHBondContact O-N 2.85Å; T482-V485 PolarHBondContact O-N 3.24Å; V485-G488 PolarHBondContact O-N 3.19Å; V485-V489 HydrophobicContact CG1-CG2 4.24Å; V485-V489 WeakPolarHBondContact O-CB 3.28Å; V485-V489 VanDerWaalsContact O-CG2 3.28Å; V485-V489 WeakPolarHBondContact O-CG2 3.48Å; V485-V489 PolarHBondContact O-N 3.23Å
486	V	97.5	Very high	95	Very high	87 Å²	87	52 Å²	52	53%	0.527	29%	0.293	S	S	.	.	H	α-helix	trans	-62.6	-47.8	179.3	170.7	0	0	0	0	110.7	T482 V483 G488 V489 C490	T482-V486 WeakPolarHBondContact O-CB 3.42Å; T482-V486 WeakPolarHBondContact O-CG2 3.28Å; T482-V486 PolarHBondContact O-N 3.03Å; V483-V486 PolarHBondContact O-N 3.17Å; V486-G488 PolarHBondContact O-N 3.35Å; V486-V489 PolarHBondContact O-N 3.34Å; V486-C490 WeakPolarHBondContact O-CB 3.31Å; V486-C490 PolarHBondContact O-N 2.94Å; V486-C490 PolarHBondContact O-SG 3Å
487	L	96.9	Very high	95.2	Very high	35 Å²	35	58 Å²	58	18%	0.183	31%	0.314	C	S	.	.	H	α-helix	trans	-59.8	-45.9	177	-75.2	175.6	0	0	0	111.6	L298 C301 F302 A433 V436 V483 G491	L298-L487 HydrophobicContact CD1-CD2 4.47Å; C301-L487 PolarHBondContact SG-O 3.33Å; F302-L487 HydrophobicContact CE2-CD2 4.32Å; F302-L487 HydrophobicContact CZ-CD2 4.12Å; A433-L487 HydrophobicContact CB-CB 3.74Å; V436-L487 HydrophobicContact CB-CD1 4.34Å; V436-L487 HydrophobicContact CG1-CD1 4.13Å; V483-L487 HydrophobicContact CG1-CD1 3.69Å; V483-L487 HydrophobicContact CG1-CG 4.24Å; V483-L487 VanDerWaalsContact O-CB 3.28Å; V483-L487 WeakPolarHBondContact O-CB 3.36Å; V483-L487 VanDerWaalsContact O-CG 3.25Å; V483-L487 WeakPolarHBondContact O-CG 3.21Å; V483-L487 PolarHBondContact O-N 3.4Å; L487-G491 PolarHBondContact O-N 3.17Å
488	G	96.7	Very high	95.1	Very high	6 Å²	6	63 Å²	63	6%	0.062	33%	0.333	C	S	.	.	H	α-helix	trans	-61.3	-50.6	178.7	0	0	0	0	0	112.3	W484 V485 V486 G491 V492	W484-G488 PolarHBondContact O-N 3.22Å; V485-G488 PolarHBondContact O-N 3.19Å; V486-G488 PolarHBondContact O-N 3.35Å; G488-G491 PolarHBondContact O-N 2.92Å; G488-V492 VanDerWaalsContact O-CG2 3.28Å; G488-V492 WeakPolarHBondContact O-CG2 3.35Å; G488-V492 PolarHBondContact O-N 3.36Å
489	V	97.2	Very high	94.9	Very high	82 Å²	82	57.3 Å²	57.3	50%	0.497	31%	0.311	S	S	.	.	H	α-helix	trans	-64.3	-46.6	179.8	173.3	0	0	0	0	111.1	V485 V486 G491 V492 V493	V485-V489 HydrophobicContact CG1-CG2 4.24Å; V485-V489 WeakPolarHBondContact O-CB 3.28Å; V485-V489 VanDerWaalsContact O-CG2 3.28Å; V485-V489 WeakPolarHBondContact O-CG2 3.48Å; V485-V489 PolarHBondContact O-N 3.23Å; V486-V489 PolarHBondContact O-N 3.34Å; V489-G491 VanDerWaalsContact C-N 3.34Å; V489-G491 PolarHBondContact O-N 3.38Å; V489-V492 PolarHBondContact O-N 3.46Å; V489-V493 HydrophobicContact CG1-CG2 4.2Å; V489-V493 WeakPolarHBondContact O-CB 3.26Å; V489-V493 VanDerWaalsContact O-CG2 3.26Å; V489-V493 WeakPolarHBondContact O-CG2 3.47Å; V489-V493 PolarHBondContact O-N 3.36Å
490	C	96.8	Very high	94.5	Very high	56 Å²	56	64.5 Å²	64.5	38%	0.378	33%	0.327	S	S	.	.	H	α-helix	trans	-60.6	-43.6	176.7	-71.9	0	0	0	0	111.6	F302 V486 L494	F302-C490 HydrophobicContact CE1-CB 4.23Å; V486-C490 WeakPolarHBondContact O-CB 3.31Å; V486-C490 PolarHBondContact O-N 2.94Å; V486-C490 PolarHBondContact O-SG 3Å; C490-L494 VanDerWaalsContact O-CB 3.24Å; C490-L494 WeakPolarHBondContact O-CB 3.5Å; C490-L494 WeakPolarHBondContact O-CD1 3.47Å; C490-L494 WeakPolarHBondContact O-CG 3.31Å; C490-L494 PolarHBondContact O-N 2.87Å
491	G	96	Very high	93.8	Very high	0 Å²	0	69 Å²	69	0%	0	36%	0.361	C	S	.	.	H	α-helix	trans	-59	-50.3	176.2	0	0	0	0	0	112.2	C301 L487 G488 V489 L494 Q495	C301-G491 VanDerWaalsContact O-CA 3.25Å; C301-G491 WeakPolarHBondContact O-CA 3.36Å; L487-G491 PolarHBondContact O-N 3.17Å; G488-G491 PolarHBondContact O-N 2.92Å; V489-G491 VanDerWaalsContact C-N 3.34Å; V489-G491 PolarHBondContact O-N 3.38Å; G491-L494 PolarHBondContact O-N 3.3Å; G491-Q495 WeakPolarHBondContact O-CB 3.32Å; G491-Q495 VanDerWaalsContact O-CG 3.32Å; G491-Q495 WeakPolarHBondContact O-CG 3.42Å; G491-Q495 PolarHBondContact O-N 3.4Å
492	V	96	Very high	93	Very high	24 Å²	24	73.7 Å²	73.7	15%	0.145	38%	0.375	C	S	.	.	H	α-helix	trans	-60.3	-51.9	177.7	172.2	0	0	0	0	111.2	I425 V426 G488 V489 L494 Q495 L496	I425-V492 HydrophobicContact CG2-CG1 4.34Å; V426-V492 HydrophobicContact CG2-CG1 4.3Å; G488-V492 VanDerWaalsContact O-CG2 3.28Å; G488-V492 WeakPolarHBondContact O-CG2 3.35Å; G488-V492 PolarHBondContact O-N 3.36Å; V489-V492 PolarHBondContact O-N 3.46Å; V492-L494 PolarHBondContact O-N 2.81Å; V492-Q495 PolarHBondContact O-N 3.43Å; V492-L496 HydrophobicContact CG1-CD1 3.71Å; V492-L496 HydrophobicContact CG1-CG 4.24Å; V492-L496 WeakPolarHBondContact O-CB 3.32Å; V492-L496 VanDerWaalsContact O-CG 3.24Å; V492-L496 WeakPolarHBondContact O-CG 3.34Å; V492-L496 PolarHBondContact O-N 3.48Å
493	V	96.1	Very high	92.1	Very high	86 Å²	86	74.2 Å²	74.2	52%	0.521	38%	0.38	S	S	.	.	H	α-helix	trans	-60.7	-44.3	-178.2	171.5	0	0	0	0	111.4	V489 L496 Y497	V489-V493 HydrophobicContact CG1-CG2 4.2Å; V489-V493 WeakPolarHBondContact O-CB 3.26Å; V489-V493 VanDerWaalsContact O-CG2 3.26Å; V489-V493 WeakPolarHBondContact O-CG2 3.47Å; V489-V493 PolarHBondContact O-N 3.36Å; V493-L496 PolarHBondContact O-N 3.36Å; V493-Y497 VanDerWaalsContact O-CB 3.31Å; V493-Y497 WeakPolarHBondContact O-CB 3.37Å; V493-Y497 PolarHBondContact O-N 2.82Å
494	L	94.8	Very high	91.2	Very high	81 Å²	81	78 Å²	78	42%	0.424	39%	0.392	S	S	.	.	H	α-helix	trans	-65.2	-42.7	179.3	-74.9	170.5	0	0	0	112.1	F302 C490 G491 V492 R498	F302-L494 HydrophobicContact CD1-CD1 3.65Å; F302-L494 HydrophobicContact CE1-CD1 3.7Å; C490-L494 VanDerWaalsContact O-CB 3.24Å; C490-L494 WeakPolarHBondContact O-CB 3.5Å; C490-L494 WeakPolarHBondContact O-CD1 3.47Å; C490-L494 WeakPolarHBondContact O-CG 3.31Å; C490-L494 PolarHBondContact O-N 2.87Å; G491-L494 PolarHBondContact O-N 3.3Å; V492-L494 PolarHBondContact O-N 2.81Å; L494-R498 WeakPolarHBondContact O-CB 3.43Å; L494-R498 WeakPolarHBondContact O-CG 3.27Å; L494-R498 PolarHBondContact O-N 3.4Å
495	Q	94.2	Very high	90.4	Very high	4 Å²	4	77.6 Å²	77.6	2%	0.019	39%	0.391	C	S	.	.	H	α-helix	trans	-65.8	-43	176.9	-73.6	-166.7	48.3	0	0	111.6	V300 C301 F302 H305 I425 G491 V492 Y497 E499	V300-Q495 PolarHBondContact O-NE2 3.4Å; C301-Q495 VanDerWaalsContact C-NE2 3.26Å; C301-Q495 PolarHBondContact O-NE2 2.85Å; F302-Q495 WeakPolarHBondContact O-CG 3.27Å; H305-Q495 VanDerWaalsContact N-OE1 3.17Å; I425-Q495 HydrophobicContact CG1-CB 4.38Å; I425-Q495 HydrophobicContact CG2-CB 3.52Å; G491-Q495 WeakPolarHBondContact O-CB 3.32Å; G491-Q495 VanDerWaalsContact O-CG 3.32Å; G491-Q495 WeakPolarHBondContact O-CG 3.42Å; G491-Q495 PolarHBondContact O-N 3.4Å; V492-Q495 PolarHBondContact O-N 3.43Å; Q495-Y497 PolarHBondContact O-N 3.42Å; Q495-E499 VanDerWaalsContact O-CB 3.29Å; Q495-E499 WeakPolarHBondContact O-CB 3.31Å; Q495-E499 VanDerWaalsContact O-CG 3.25Å; Q495-E499 WeakPolarHBondContact O-CG 3.43Å; Q495-E499 PolarHBondContact O-N 3.47Å; Q495-E499 VanDerWaalsContact O-N 3.1Å
496	L	91.9	Very high	89.4	Confident	51 Å²	51	76 Å²	76	27%	0.267	38%	0.382	S	S	.	.	H	α-helix	trans	-61.3	-45	176.3	-70.9	176	0	0	0	112.2	E422 I425 V492 V493 R500	E422-L496 WeakPolarHBondContact OE2-CD2 3.33Å; I425-L496 HydrophobicContact CB-CD2 4.4Å; I425-L496 HydrophobicContact CD1-CD2 3.67Å; I425-L496 HydrophobicContact CG2-CD2 4.07Å; I425-L496 HydrophobicContact CG2-CG 4.01Å; V492-L496 HydrophobicContact CG1-CD1 3.71Å; V492-L496 HydrophobicContact CG1-CG 4.24Å; V492-L496 WeakPolarHBondContact O-CB 3.32Å; V492-L496 VanDerWaalsContact O-CG 3.24Å; V492-L496 WeakPolarHBondContact O-CG 3.34Å; V492-L496 PolarHBondContact O-N 3.48Å; V493-L496 PolarHBondContact O-N 3.36Å; L496-R500 PolarHBondContact O-N 3.49Å
497	Y	92.3	Very high	88.4	Confident	183 Å²	183	75.6 Å²	75.6	72%	0.718	38%	0.381	S	S	*	.	H	α-helix	trans	-64	-48.5	-179.9	-179	-100.8	0	0	0	112	V493 Q495 E499 R500	V493-Y497 VanDerWaalsContact O-CB 3.31Å; V493-Y497 WeakPolarHBondContact O-CB 3.37Å; V493-Y497 PolarHBondContact O-N 2.82Å; Q495-Y497 PolarHBondContact O-N 3.42Å; Y497-E499 VanDerWaalsContact C-N 3.35Å; Y497-E499 PolarHBondContact O-N 2.98Å; Y497-R500 WeakPolarHBondContact O-CB 3.2Å
498	R	88.8	Confident	87.6	Confident	106 Å²	106	74.3 Å²	74.3	40%	0.4	38%	0.375	S	S	.	.	H	α-helix	trans	-67.6	-34.2	-176.6	-71	174.1	73.9	151.2	14.2	113.4	L494	L494-R498 WeakPolarHBondContact O-CB 3.43Å; L494-R498 WeakPolarHBondContact O-CG 3.27Å; L494-R498 PolarHBondContact O-N 3.4Å
499	E	88.3	Confident	86.9	Confident	16 Å²	16	75.9 Å²	75.9	8%	0.075	39%	0.385	C	S	.	.	H	α-helix	trans	-95.1	-0.8	-172.4	-58	-63.2	147.8	0	0	111.9	R306 R421 Q495 Y497 S501 R502	R306-E499 WeakPolarHBondContact CB-OE1 3.17Å; R421-E499 PolarHBondContact NH2-O 3.41Å; Q495-E499 VanDerWaalsContact O-CB 3.29Å; Q495-E499 WeakPolarHBondContact O-CB 3.31Å; Q495-E499 VanDerWaalsContact O-CG 3.25Å; Q495-E499 WeakPolarHBondContact O-CG 3.43Å; Q495-E499 PolarHBondContact O-N 3.47Å; Q495-E499 VanDerWaalsContact O-N 3.1Å; Y497-E499 VanDerWaalsContact C-N 3.35Å; Y497-E499 PolarHBondContact O-N 2.98Å; E499-S501 PolarHBondContact O-N 2.85Å; E499-S501 VanDerWaalsContact O-N 3.12Å; E499-R502 PolarHBondContact O-N 3.45Å; E499-R502 VanDerWaalsContact OE2-CD 3.24Å; E499-R502 WeakPolarHBondContact OE2-CD 3.24Å
500	R	85.1	Confident	86.1	Confident	204 Å²	204	75 Å²	75	77%	0.77	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51	-38.8	-176.9	-173.1	174.6	179.2	169.4	0.7	113.9	L496 Y497	L496-R500 PolarHBondContact O-N 3.49Å; Y497-R500 WeakPolarHBondContact O-CB 3.2Å
501	S	81.3	Confident	85.3	Confident	115 Å²	115	76 Å²	76	80%	0.804	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97	6.2	-176.5	64.2	0	0	0	0	114.2	E499	E499-S501 PolarHBondContact O-N 2.85Å; E499-S501 VanDerWaalsContact O-N 3.12Å
502	R	77.5	Confident	84.7	Confident	145 Å²	145	80.8 Å²	80.8	55%	0.547	40%	0.397	S	S	.	.	S	Bend	trans	-104.6	158.4	-176.5	-73	-164.3	175.1	-133.3	-1.4	111.5	E499	E499-R502 PolarHBondContact O-N 3.45Å; E499-R502 VanDerWaalsContact OE2-CD 3.24Å; E499-R502 WeakPolarHBondContact OE2-CD 3.24Å
503	P	75.8	Confident	84.1	Confident	96 Å²	96	85.9 Å²	85.9	62%	0.623	41%	0.414	S	S	*	.			trans	-58.9	148.8	173.7	25.3	-35.1	0	0	0	111.1	F505	P503-F505 PolarHBondContact O-N 2.97Å; P503-F505 VanDerWaalsContact O-N 3.16Å
504	F	78.6	Confident	83.5	Confident	143 Å²	143	84.4 Å²	84.4	63%	0.627	40%	0.403	S	S	*	.	S	Bend	trans	-55.9	-35	-172.9	-70.7	-82.1	0	0	0	114.6	H305 R421	H305-F504 PolarHBondContact CE1-O 3.37Å; H305-F504 VanDerWaalsContact CE1-O 3.25Å; H305-F504 PolarHBondContact NE2-O 3.21Å; R421-F504 HydrophobicContact CB-CD1 3.89Å; R421-F504 VanDerWaalsContact CD-CD1 3.45Å; R421-F504 HydrophobicContact CG-CD1 4.29Å
505	F	79.2	Confident	82.9	Confident	27 Å²	27	86.8 Å²	86.8	12%	0.118	41%	0.412	C	S	.	.	S	Bend	trans	-145.9	151.2	172.9	-75	-85.3	0	0	0	109.1	H305 F308 V364 V368 P420 R421 N424 P503	H305-F505 AromaticContact CE1-CE1 3.9Å; F308-F505 HydrophobicContact CD2-CD1 4.21Å; F308-F505 HydrophobicContact CD2-CE1 4.35Å; F308-F505 HydrophobicContact CE1-CD1 4.36Å; F308-F505 AromaticContact CE2-CD1 3.76Å; F308-F505 HydrophobicContact CE2-CD1 3.76Å; F308-F505 AromaticContact CE2-CE1 3.66Å; F308-F505 HydrophobicContact CE2-CE1 3.66Å; F308-F505 AromaticContact CZ-CD1 3.84Å; F308-F505 HydrophobicContact CZ-CD1 3.84Å; F308-F505 AromaticContact CZ-CE1 3.97Å; F308-F505 HydrophobicContact CZ-CE1 3.97Å; V364-F505 HydrophobicContact CG1-CB 4.25Å; V364-F505 HydrophobicContact CG1-CD1 3.78Å; V364-F505 HydrophobicContact CG1-CD2 3.51Å; V364-F505 HydrophobicContact CG1-CE1 3.95Å; V364-F505 HydrophobicContact CG1-CE2 3.69Å; V364-F505 HydrophobicContact CG1-CG 3.56Å; V364-F505 HydrophobicContact CG1-CZ 3.9Å; V364-F505 HydrophobicContact CG2-CB 4.21Å; V364-F505 HydrophobicContact CG2-CG 4.4Å; V368-F505 HydrophobicContact CG2-CE1 4.17Å; V368-F505 HydrophobicContact CG2-CE2 4.48Å; V368-F505 HydrophobicContact CG2-CZ 3.74Å; P420-F505 HydrophobicContact CB-CE2 3.9Å; P420-F505 HydrophobicContact CB-CZ 4.19Å; P420-F505 HydrophobicContact CG-CE2 4.1Å; R421-F505 HydrophobicContact CB-CE2 4.26Å; N424-F505 HydrophobicContact CB-CE1 4.26Å; N424-F505 HydrophobicContact CB-CZ 4.13Å; P503-F505 PolarHBondContact O-N 2.97Å; P503-F505 VanDerWaalsContact O-N 3.16Å
506	P	76.9	Confident	82.4	Confident	49 Å²	49	89.7 Å²	89.7	32%	0.318	43%	0.425	S	S	.	.	P	Polyproline II helix	trans	-63.2	137.6	173.3	24.6	-30.8	0	0	0	110.3	F308 W358	F308-P506 HydrophobicContact CB-CG 3.7Å; F308-P506 HydrophobicContact CD1-CG 3.86Å; F308-P506 HydrophobicContact CG-CG 4Å; W358-P506 HydrophobicContact CH2-CG 4.44Å; W358-P506 HydrophobicContact CZ2-CB 4.39Å; W358-P506 HydrophobicContact CZ2-CG 4.01Å
507	P	77.3	Confident	81.9	Confident	78 Å²	78	93.1 Å²	93.1	51%	0.506	44%	0.435	S	S	.	.	P	Polyproline II helix	trans	-63	149	175.1	26.4	-34.9	0	0	0	111	M512	P507-M512 HydrophobicContact CB-CG 3.92Å; P507-M512 HydrophobicContact CB-SD 3.87Å; P507-M512 HydrophobicContact CG-CE 4.44Å; P507-M512 HydrophobicContact CG-CG 4.15Å; P507-M512 HydrophobicContact CG-SD 3.42Å; P507-M512 WeakPolarHBondContact CG-SD 3.06Å
508	S	79.8	Confident	81.5	Confident	9 Å²	9	89.5 Å²	89.5	6%	0.063	43%	0.425	C	S	.	.	P	Polyproline II helix	trans	-70.5	130.6	-178.3	75.5	0	0	0	0	110.4	Y510 L511 M512	S508-Y510 PolarHBondContact O-N 3.22Å; S508-L511 PolarHBondContact O-N 2.87Å; S508-L511 WeakPolarHBondContact OG-CB 3.17Å; S508-L511 VanDerWaalsContact OG-CD1 3.24Å; S508-L511 WeakPolarHBondContact OG-CD1 3.4Å; S508-L511 WeakPolarHBondContact OG-CG 3.24Å; S508-L511 PolarHBondContact OG-N 3.36Å; S508-M512 WeakPolarHBondContact O-CG 3.23Å; S508-M512 PolarHBondContact O-N 3.26Å
509	P	81.3	Confident	81.1	Confident	39 Å²	39	91.2 Å²	91.2	25%	0.253	43%	0.431	S	S	.	.	H	α-helix	trans	-61.9	-31.1	-176.5	-25.3	33.8	0	0	0	113.1	W358 W513	W358-P509 HydrophobicContact CH2-CG 4.13Å; W358-P509 HydrophobicContact CZ3-CG 4.21Å; P509-W513 VanDerWaalsContact O-CB 3.28Å; P509-W513 WeakPolarHBondContact O-CB 3.32Å; P509-W513 PolarHBondContact O-N 3.47Å
510	Y	79.9	Confident	80.5	Confident	62 Å²	62	96.4 Å²	96.4	24%	0.243	45%	0.45	C	S	.	.	H	α-helix	trans	-69.3	-43.6	176.9	-179	-104.2	0	0	0	112.4	W359 S508 W513 L514	W359-Y510 WeakPolarHBondContact O-CB 3.28Å; S508-Y510 PolarHBondContact O-N 3.22Å; Y510-W513 HydrophobicContact CD2-CE3 4.3Å; Y510-W513 HydrophobicContact CE2-CE3 4.08Å; Y510-W513 HydrophobicContact CE2-CZ3 4.09Å; Y510-W513 PolarHBondContact O-N 2.85Å; Y510-L514 WeakPolarHBondContact O-CB 3.46Å; Y510-L514 PolarHBondContact O-N 3.47Å
511	L	79.6	Confident	79.9	Confident	79 Å²	79	93.3 Å²	93.3	41%	0.414	44%	0.442	S	S	.	.	H	α-helix	trans	-67.8	-39.1	176.5	-66.7	176	0	0	0	110.9	S508 W513 L514 Q515	S508-L511 PolarHBondContact O-N 2.87Å; S508-L511 WeakPolarHBondContact OG-CB 3.17Å; S508-L511 VanDerWaalsContact OG-CD1 3.24Å; S508-L511 WeakPolarHBondContact OG-CD1 3.4Å; S508-L511 WeakPolarHBondContact OG-CG 3.24Å; S508-L511 PolarHBondContact OG-N 3.36Å; L511-W513 VanDerWaalsContact C-N 3.33Å; L511-W513 PolarHBondContact O-N 3.05Å; L511-L514 PolarHBondContact O-N 3.41Å; L511-Q515 WeakPolarHBondContact O-CB 3.49Å; L511-Q515 VanDerWaalsContact O-CG 3.31Å; L511-Q515 WeakPolarHBondContact O-CG 3.31Å; L511-Q515 PolarHBondContact O-N 2.82Å
512	M	83.4	Confident	79.6	Confident	99 Å²	99	93.1 Å²	93.1	49%	0.488	44%	0.436	S	S	.	.	H	α-helix	trans	-59.7	-44.3	171.6	-71.2	-174	75.2	0	0	111.7	P507 S508 L514 Q515 E516	P507-M512 HydrophobicContact CB-CG 3.92Å; P507-M512 HydrophobicContact CB-SD 3.87Å; P507-M512 HydrophobicContact CG-CE 4.44Å; P507-M512 HydrophobicContact CG-CG 4.15Å; P507-M512 HydrophobicContact CG-SD 3.42Å; P507-M512 WeakPolarHBondContact CG-SD 3.06Å; S508-M512 WeakPolarHBondContact O-CG 3.23Å; S508-M512 PolarHBondContact O-N 3.26Å; M512-L514 VanDerWaalsContact C-N 3.34Å; M512-L514 PolarHBondContact O-N 3.28Å; M512-Q515 PolarHBondContact O-N 2.87Å; M512-E516 WeakPolarHBondContact O-CB 3.12Å; M512-E516 PolarHBondContact O-N 2.95Å
513	W	83.8	Confident	79.5	Confident	132 Å²	132	88.8 Å²	88.8	50%	0.5	42%	0.424	S	S	.	.	H	α-helix	trans	-63.2	-39.9	176.6	174.7	85.1	0	0	0	112.2	P509 Y510 L511 E516 R517	P509-W513 VanDerWaalsContact O-CB 3.28Å; P509-W513 WeakPolarHBondContact O-CB 3.32Å; P509-W513 PolarHBondContact O-N 3.47Å; Y510-W513 HydrophobicContact CD2-CE3 4.3Å; Y510-W513 HydrophobicContact CE2-CE3 4.08Å; Y510-W513 HydrophobicContact CE2-CZ3 4.09Å; Y510-W513 PolarHBondContact O-N 2.85Å; L511-W513 VanDerWaalsContact C-N 3.33Å; L511-W513 PolarHBondContact O-N 3.05Å; W513-E516 PolarHBondContact O-N 3.27Å; W513-R517 VanDerWaalsContact O-CB 3.24Å; W513-R517 WeakPolarHBondContact O-CB 3.4Å; W513-R517 PolarHBondContact O-N 2.65Å
514	L	83.7	Confident	79	Confident	54 Å²	54	88.3 Å²	88.3	28%	0.283	42%	0.419	S	S	.	.	H	α-helix	trans	-66.3	-46.7	177.6	-169.8	69.7	0	0	0	111.1	Y510 L511 M512 E516 R517 E518	Y510-L514 WeakPolarHBondContact O-CB 3.46Å; Y510-L514 PolarHBondContact O-N 3.47Å; L511-L514 PolarHBondContact O-N 3.41Å; M512-L514 VanDerWaalsContact C-N 3.34Å; M512-L514 PolarHBondContact O-N 3.28Å; L514-E516 VanDerWaalsContact C-N 3.34Å; L514-E516 PolarHBondContact O-N 3.48Å; L514-R517 WeakPolarHBondContact O-CB 3.34Å; L514-R517 PolarHBondContact O-N 3.37Å; L514-E518 WeakPolarHBondContact O-CG 3.3Å; L514-E518 PolarHBondContact O-N 3.48Å
515	Q	83.6	Confident	78.5	Confident	131 Å²	131	88.1 Å²	88.1	61%	0.612	42%	0.424	S	S	*	.	H	α-helix	trans	-59.7	-43.8	174.8	-75.6	176.7	-18.1	0	0	111.6	L511 M512 R517 E518 R519	L511-Q515 WeakPolarHBondContact O-CB 3.49Å; L511-Q515 VanDerWaalsContact O-CG 3.31Å; L511-Q515 WeakPolarHBondContact O-CG 3.31Å; L511-Q515 PolarHBondContact O-N 2.82Å; M512-Q515 PolarHBondContact O-N 2.87Å; Q515-R517 VanDerWaalsContact C-N 3.35Å; Q515-E518 PolarHBondContact O-N 3.34Å; Q515-R519 VanDerWaalsContact O-CB 3.3Å; Q515-R519 WeakPolarHBondContact O-CB 3.35Å; Q515-R519 PolarHBondContact O-N 2.87Å
516	E	83.3	Confident	77.8	Confident	65 Å²	65	88.2 Å²	88.2	30%	0.304	43%	0.425	S	S	.	.	H	α-helix	trans	-66.5	-37.5	177.2	-176.2	61.3	-161.5	0	0	111.4	M512 W513 L514 R519 R520	M512-E516 WeakPolarHBondContact O-CB 3.12Å; M512-E516 PolarHBondContact O-N 2.95Å; W513-E516 PolarHBondContact O-N 3.27Å; L514-E516 VanDerWaalsContact C-N 3.34Å; L514-E516 PolarHBondContact O-N 3.48Å; E516-R519 WeakPolarHBondContact O-CB 3.27Å; E516-R519 PolarHBondContact O-N 3.21Å; E516-R519 IonicContact OE2-NH1 3.41Å; E516-R520 VanDerWaalsContact O-CG 3.27Å; E516-R520 WeakPolarHBondContact O-CG 3.49Å; E516-R520 PolarHBondContact O-N 2.94Å; E516-R520 IonicContact OE1-CZ 3.93Å; E516-R520 IonicContact OE1-NE 3.26Å; E516-R520 PolarHBondContact OE1-NE 3Å; E516-R520 IonicContact OE1-NH2 3.41Å; E516-R520 PolarHBondContact OE1-NH2 3.48Å
517	R	81.7	Confident	77.3	Confident	123 Å²	123	91 Å²	91	46%	0.464	44%	0.443	S	S	.	.	H	α-helix	trans	-66.4	-39.8	174.5	-175.5	-179.1	-178.3	-166.8	0.7	112	W513 L514 Q515 K521	W513-R517 VanDerWaalsContact O-CB 3.24Å; W513-R517 WeakPolarHBondContact O-CB 3.4Å; W513-R517 PolarHBondContact O-N 2.65Å; L514-R517 WeakPolarHBondContact O-CB 3.34Å; L514-R517 PolarHBondContact O-N 3.37Å; Q515-R517 VanDerWaalsContact C-N 3.35Å; R517-K521 WeakPolarHBondContact O-CG 3.46Å; R517-K521 PolarHBondContact O-N 3.41Å
518	E	83.1	Confident	76.8	Confident	108 Å²	108	89.3 Å²	89.3	51%	0.505	43%	0.434	S	S	.	.	H	α-helix	trans	-67	-44.1	173.9	-75.7	175.7	-176.3	0	0	111.1	L514 Q515 R520 K521 T522	L514-E518 WeakPolarHBondContact O-CG 3.3Å; L514-E518 PolarHBondContact O-N 3.48Å; Q515-E518 PolarHBondContact O-N 3.34Å; E518-R520 VanDerWaalsContact C-N 3.3Å; E518-R520 PolarHBondContact O-N 2.87Å; E518-K521 WeakPolarHBondContact O-CA 3.24Å; E518-K521 WeakPolarHBondContact O-CB 3.48Å; E518-K521 PolarHBondContact O-N 3.3Å; E518-T522 PolarHBondContact O-N 3.39Å; E518-T522 PolarHBondContact O-OG1 2.99Å; E518-T522 VanDerWaalsContact O-OG1 3.12Å
519	R	79.6	Confident	76	Confident	142 Å²	142	92.2 Å²	92.2	54%	0.536	45%	0.446	S	S	.	.	H	α-helix	trans	-55.3	-44.8	174	-169	-173.7	-162.5	-164.9	3.1	111.7	Q515 E516 K521 T522 N523	Q515-R519 VanDerWaalsContact O-CB 3.3Å; Q515-R519 WeakPolarHBondContact O-CB 3.35Å; Q515-R519 PolarHBondContact O-N 2.87Å; E516-R519 WeakPolarHBondContact O-CB 3.27Å; E516-R519 PolarHBondContact O-N 3.21Å; E516-R519 IonicContact OE2-NH1 3.41Å; R519-K521 PolarHBondContact O-N 2.84Å; R519-T522 PolarHBondContact O-N 2.93Å; R519-T522 PolarHBondContact O-OG1 2.88Å; R519-N523 HydrophobicContact CG-CB 4.4Å; R519-N523 WeakPolarHBondContact O-CB 3.27Å; R519-N523 PolarHBondContact O-N 2.96Å
520	R	76.5	Confident	75.2	Confident	125 Å²	125	96.5 Å²	96.5	47%	0.472	46%	0.462	S	S	.	.	H	α-helix	trans	-66.7	-18.6	175.6	-71.2	177.2	-162.8	-161.7	2.7	114	E516 E518 H529	E516-R520 VanDerWaalsContact O-CG 3.27Å; E516-R520 WeakPolarHBondContact O-CG 3.49Å; E516-R520 PolarHBondContact O-N 2.94Å; E516-R520 IonicContact OE1-CZ 3.93Å; E516-R520 IonicContact OE1-NE 3.26Å; E516-R520 PolarHBondContact OE1-NE 3Å; E516-R520 IonicContact OE1-NH2 3.41Å; E516-R520 PolarHBondContact OE1-NH2 3.48Å; E518-R520 VanDerWaalsContact C-N 3.3Å; E518-R520 PolarHBondContact O-N 2.87Å; R520-H529 PolarHBondContact O-ND1 2.84Å
521	K	72.6	Confident	74.6	Confident	138 Å²	138	96.8 Å²	96.8	60%	0.6	47%	0.471	S	S	*	.	H	α-helix	trans	-87.7	-32.2	173.7	-73	178.1	178	-176.2	0	112.6	R517 E518 R519 H529	R517-K521 WeakPolarHBondContact O-CG 3.46Å; R517-K521 PolarHBondContact O-N 3.41Å; E518-K521 WeakPolarHBondContact O-CA 3.24Å; E518-K521 WeakPolarHBondContact O-CB 3.48Å; E518-K521 PolarHBondContact O-N 3.3Å; R519-K521 PolarHBondContact O-N 2.84Å; K521-H529 PolarHBondContact O-CE1 3.43Å
522	T	75.4	Confident	73.8	Confident	111 Å²	111	95.7 Å²	95.7	68%	0.681	47%	0.468	S	S	*	.	H	α-helix	trans	-99.1	-25.7	-173.2	55.7	0	0	0	0	113.3	E518 R519 V524	E518-T522 PolarHBondContact O-N 3.39Å; E518-T522 PolarHBondContact O-OG1 2.99Å; E518-T522 VanDerWaalsContact O-OG1 3.12Å; R519-T522 PolarHBondContact O-N 2.93Å; R519-T522 PolarHBondContact O-OG1 2.88Å; T522-V524 PolarHBondContact O-N 3.22Å
523	N	74.6	Confident	73.2	Confident	54 Å²	54	94.6 Å²	94.6	29%	0.289	47%	0.47	S	S	.	.			trans	-89.2	92.1	-179.8	-168.9	13.1	0	0	0	110.9	R519 L525 D526	R519-N523 HydrophobicContact CG-CB 4.4Å; R519-N523 WeakPolarHBondContact O-CB 3.27Å; R519-N523 PolarHBondContact O-N 2.96Å; N523-L525 PolarHBondContact O-N 3.39Å; N523-L525 PolarHBondContact OD1-N 3.24Å; N523-D526 HydrophobicContact CB-CB 4.21Å; N523-D526 WeakPolarHBondContact O-CB 3.4Å; N523-D526 PolarHBondContact O-N 3.3Å; N523-D526 VanDerWaalsContact O-N 3.1Å
524	V	65.6	Low	72.5	Confident	86 Å²	86	94.1 Å²	94.1	52%	0.521	48%	0.477	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-25.7	177.6	-177.2	0	0	0	0	112	T522 D526 H530	T522-V524 PolarHBondContact O-N 3.22Å; V524-D526 VanDerWaalsContact C-N 3.27Å; V524-D526 PolarHBondContact O-N 2.83Å; V524-H530 PolarHBondContact O-NE2 3.1Å; V524-H530 VanDerWaalsContact O-NE2 3.15Å
525	L	67.8	Low	71.9	Confident	140 Å²	140	95.7 Å²	95.7	73%	0.733	49%	0.49	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.8	-3.6	178.7	-62.2	168.8	0	0	0	113.5	N523 P527	N523-L525 PolarHBondContact O-N 3.39Å; N523-L525 PolarHBondContact OD1-N 3.24Å; L525-P527 WeakPolarHBondContact O-CD 3.18Å
526	D	65.2	Low	71.3	Confident	28 Å²	28	90.6 Å²	90.6	15%	0.15	47%	0.473	C	S	.	.	S	Bend	trans	-77	122.1	174.3	-168.9	-34.9	0	0	0	109.3	N523 V524 S528 H529	N523-D526 HydrophobicContact CB-CB 4.21Å; N523-D526 WeakPolarHBondContact O-CB 3.4Å; N523-D526 PolarHBondContact O-N 3.3Å; N523-D526 VanDerWaalsContact O-N 3.1Å; V524-D526 VanDerWaalsContact C-N 3.27Å; V524-D526 PolarHBondContact O-N 2.83Å; D526-S528 PolarHBondContact O-N 3.12Å; D526-S528 WeakPolarHBondContact OD1-CB 3.5Å; D526-S528 PolarHBondContact OD1-N 3.42Å; D526-S528 PolarHBondContact OD1-OG 3.27Å; D526-S528 PolarHBondContact OD2-OG 3.15Å; D526-H529 HydrophobicContact CB-CB 4.4Å; D526-H529 WeakPolarHBondContact O-CB 3.44Å; D526-H529 PolarHBondContact O-N 3.27Å
527	P	66.5	Low	71	Confident	107 Å²	107	92.7 Å²	92.7	70%	0.695	48%	0.478	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55	-26.7	178.5	-24	32.3	0	0	0	113.2	L525 H529	L525-P527 WeakPolarHBondContact O-CD 3.18Å; P527-H529 VanDerWaalsContact C-N 3.29Å; P527-H529 PolarHBondContact O-N 3.49Å
528	S	65.3	Low	70.6	Confident	44 Å²	44	93 Å²	93	31%	0.308	49%	0.487	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.1	-16.4	177.1	71	0	0	0	0	114.1	D526 H530 V531	D526-S528 PolarHBondContact O-N 3.12Å; D526-S528 WeakPolarHBondContact OD1-CB 3.5Å; D526-S528 PolarHBondContact OD1-N 3.42Å; D526-S528 PolarHBondContact OD1-OG 3.27Å; D526-S528 PolarHBondContact OD2-OG 3.15Å; S528-H530 VanDerWaalsContact C-N 3.34Å; S528-V531 PolarHBondContact O-N 2.96Å
529	H	62.9	Low	70.3	Confident	69 Å²	69	92 Å²	92	32%	0.319	49%	0.487	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.5	-34.7	175.5	-168.7	69.1	0	0	0	112.1	R520 K521 D526 P527 V531	R520-H529 PolarHBondContact O-ND1 2.84Å; K521-H529 PolarHBondContact O-CE1 3.43Å; D526-H529 HydrophobicContact CB-CB 4.4Å; D526-H529 WeakPolarHBondContact O-CB 3.44Å; D526-H529 PolarHBondContact O-N 3.27Å; P527-H529 VanDerWaalsContact C-N 3.29Å; P527-H529 PolarHBondContact O-N 3.49Å; H529-V531 VanDerWaalsContact C-N 3.3Å; H529-V531 PolarHBondContact O-N 2.74Å
530	H	65.3	Low	69.9	Low	129 Å²	129	90.2 Å²	90.2	60%	0.597	49%	0.485	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.5	-1.4	179.9	-60	-61.5	0	0	0	113.7	V524 S528 P532	V524-H530 PolarHBondContact O-NE2 3.1Å; V524-H530 VanDerWaalsContact O-NE2 3.15Å; S528-H530 VanDerWaalsContact C-N 3.34Å; H530-P532 VanDerWaalsContact O-CD 3.31Å; H530-P532 WeakPolarHBondContact O-CD 3.12Å
531	V	66.6	Low	69.7	Low	69 Å²	69	92.4 Å²	92.4	42%	0.418	49%	0.493	S	S	.	.	S	Bend	trans	-82	117.7	-179.3	-172.7	0	0	0	0	109.3	S528 H529	S528-V531 PolarHBondContact O-N 2.96Å; H529-V531 VanDerWaalsContact C-N 3.3Å; H529-V531 PolarHBondContact O-N 2.74Å
532	P	64.2	Low	69.8	Low	55 Å²	55	89.5 Å²	89.5	36%	0.357	49%	0.487	S	S	.	.	P	Polyproline II helix	trans	-61.2	151.3	-178.3	19.2	-27.5	0	0	0	111.8	H530 R537	H530-P532 VanDerWaalsContact O-CD 3.31Å; H530-P532 WeakPolarHBondContact O-CD 3.12Å; P532-R537 HydrophobicContact CB-CG 4.34Å; P532-R537 HydrophobicContact CG-CG 3.83Å; P532-R537 PolarHBondContact O-NE 2.99Å; P532-R537 PolarHBondContact O-NH2 3.24Å
533	S	70.7	Confident	69.6	Low	76 Å²	76	93.3 Å²	93.3	53%	0.531	49%	0.489	S	S	.	.	P	Polyproline II helix	trans	-56.9	153.1	177.4	66	0	0	0	0	110.9	P535 G536 R537	S533-P535 VanDerWaalsContact C-CD 3.5Å; S533-P535 VanDerWaalsContact C-N 3.33Å; S533-G536 CarbonylContact O-C 3.52Å; S533-G536 VanDerWaalsContact O-CA 3.3Å; S533-G536 WeakPolarHBondContact O-CA 3.45Å; S533-G536 PolarHBondContact O-N 3.35Å; S533-G536 PolarHBondContact OG-N 3.21Å; S533-R537 PolarHBondContact O-N 2.85Å
534	L	69.1	Low	69.3	Low	123 Å²	123	97.9 Å²	97.9	64%	0.644	51%	0.509	S	S	*	.	H	α-helix	trans	-48.5	-44.7	177.2	-84.4	162.7	0	0	0	114.2	G536 R537 M538	L534-G536 VanDerWaalsContact C-N 3.35Å; L534-R537 PolarHBondContact O-N 2.92Å; L534-M538 VanDerWaalsContact O-CG 3.27Å; L534-M538 WeakPolarHBondContact O-CG 3.09Å; L534-M538 PolarHBondContact O-N 3.3Å
535	P	71.1	Confident	69.5	Low	86 Å²	86	100.7 Å²	100.7	56%	0.558	52%	0.52	S	S	*	.	H	α-helix	trans	-66.1	-36.2	173.2	22.4	-31.1	0	0	0	112.4	S533 M538 V539	S533-P535 VanDerWaalsContact C-CD 3.5Å; S533-P535 VanDerWaalsContact C-N 3.33Å; P535-M538 PolarHBondContact O-N 3.42Å; P535-V539 WeakPolarHBondContact O-CB 3.47Å; P535-V539 VanDerWaalsContact O-CG2 3.27Å; P535-V539 WeakPolarHBondContact O-CG2 3.4Å; P535-V539 PolarHBondContact O-N 3.4Å
536	G	71.3	Confident	69.6	Low	24 Å²	24	100.7 Å²	100.7	25%	0.247	52%	0.519	C	S	.	.	H	α-helix	trans	-58.6	-48.1	172.4	0	0	0	0	0	112.2	S533 L534 M538 V539 E540	S533-G536 CarbonylContact O-C 3.52Å; S533-G536 VanDerWaalsContact O-CA 3.3Å; S533-G536 WeakPolarHBondContact O-CA 3.45Å; S533-G536 PolarHBondContact O-N 3.35Å; S533-G536 PolarHBondContact OG-N 3.21Å; L534-G536 VanDerWaalsContact C-N 3.35Å; G536-M538 VanDerWaalsContact C-N 3.34Å; G536-M538 PolarHBondContact O-N 3.32Å; G536-V539 PolarHBondContact O-N 3.48Å; G536-E540 WeakPolarHBondContact O-CB 3.31Å; G536-E540 PolarHBondContact O-N 3.07Å
537	R	75.4	Confident	69.3	Low	110 Å²	110	101.7 Å²	101.7	42%	0.415	54%	0.536	S	S	.	.	H	α-helix	trans	-62.7	-37.6	175.8	-73.9	-173.2	-119.7	174.5	1	113	P532 S533 L534 R541	P532-R537 HydrophobicContact CB-CG 4.34Å; P532-R537 HydrophobicContact CG-CG 3.83Å; P532-R537 PolarHBondContact O-NE 2.99Å; P532-R537 PolarHBondContact O-NH2 3.24Å; S533-R537 PolarHBondContact O-N 2.85Å; L534-R537 PolarHBondContact O-N 2.92Å; R537-R541 WeakPolarHBondContact O-CB 3.44Å; R537-R541 PolarHBondContact O-N 2.84Å
538	M	73.8	Confident	68.8	Low	130 Å²	130	108.4 Å²	108.4	64%	0.64	55%	0.547	S	S	*	.	H	α-helix	trans	-67	-43.7	175.6	-71.9	-110.1	-174.1	0	0	111	L534 P535 G536 R541 V542	L534-M538 VanDerWaalsContact O-CG 3.27Å; L534-M538 WeakPolarHBondContact O-CG 3.09Å; L534-M538 PolarHBondContact O-N 3.3Å; P535-M538 PolarHBondContact O-N 3.42Å; G536-M538 VanDerWaalsContact C-N 3.34Å; G536-M538 PolarHBondContact O-N 3.32Å; M538-R541 PolarHBondContact O-N 2.76Å; M538-V542 WeakPolarHBondContact O-CB 3.42Å; M538-V542 WeakPolarHBondContact O-CG2 3.3Å; M538-V542 PolarHBondContact O-N 2.84Å
539	V	76	Confident	68.1	Low	85 Å²	85	118.3 Å²	118.3	52%	0.515	58%	0.578	S	S	.	*	H	α-helix	trans	-64.3	-41.4	176	170.3	0	0	0	0	111.4	P535 G536 V542 R543	P535-V539 WeakPolarHBondContact O-CB 3.47Å; P535-V539 VanDerWaalsContact O-CG2 3.27Å; P535-V539 WeakPolarHBondContact O-CG2 3.4Å; P535-V539 PolarHBondContact O-N 3.4Å; G536-V539 PolarHBondContact O-N 3.48Å; V539-V542 PolarHBondContact O-N 2.89Å; V539-R543 WeakPolarHBondContact O-CB 3.32Å; V539-R543 PolarHBondContact O-N 2.85Å
540	E	72.1	Confident	67.6	Low	106 Å²	106	123.4 Å²	123.4	50%	0.495	60%	0.602	S	S	.	*	H	α-helix	trans	-64.3	-42.4	176.3	-127.2	156.7	-168.8	0	0	111.7	G536 V542 R543 Q544	G536-E540 WeakPolarHBondContact O-CB 3.31Å; G536-E540 PolarHBondContact O-N 3.07Å; E540-V542 VanDerWaalsContact C-N 3.34Å; E540-R543 PolarHBondContact O-N 3.27Å; E540-Q544 WeakPolarHBondContact O-CB 3.19Å; E540-Q544 WeakPolarHBondContact O-CG 3.38Å; E540-Q544 PolarHBondContact O-N 3.36Å
541	R	73.2	Confident	66.8	Low	170 Å²	170	123.2 Å²	123.2	64%	0.642	61%	0.612	S	S	*	*	H	α-helix	trans	-67.2	-35.3	176.3	-160.8	178.9	-73.6	-173.9	-5.8	111.6	R537 M538 L545	R537-R541 WeakPolarHBondContact O-CB 3.44Å; R537-R541 PolarHBondContact O-N 2.84Å; M538-R541 PolarHBondContact O-N 2.76Å; R541-L545 WeakPolarHBondContact O-CD1 3.33Å; R541-L545 WeakPolarHBondContact O-CG 3.47Å; R541-L545 PolarHBondContact O-N 3.32Å
542	V	74	Confident	66.1	Low	77 Å²	77	125 Å²	125	47%	0.467	63%	0.634	S	S	.	*	H	α-helix	trans	-70.8	-39.2	172.2	169.5	0	0	0	0	111.3	M538 V539 E540 Q544 L545 I546	M538-V542 WeakPolarHBondContact O-CB 3.42Å; M538-V542 WeakPolarHBondContact O-CG2 3.3Å; M538-V542 PolarHBondContact O-N 2.84Å; V539-V542 PolarHBondContact O-N 2.89Å; E540-V542 VanDerWaalsContact C-N 3.34Å; V542-Q544 VanDerWaalsContact C-N 3.35Å; V542-L545 WeakPolarHBondContact O-CB 3.27Å; V542-L545 PolarHBondContact O-N 3.29Å; V542-L545 VanDerWaalsContact O-N 3.16Å; V542-I546 HydrophobicContact CG1-CD1 3.62Å; V542-I546 WeakPolarHBondContact O-CG1 3.39Å; V542-I546 PolarHBondContact O-N 2.86Å; V542-I546 VanDerWaalsContact O-N 3.09Å
543	R	70.5	Confident	65	Low	192 Å²	192	125.4 Å²	125.4	73%	0.725	65%	0.649	S	S	*	*	H	α-helix	trans	-64.2	-38.8	173.8	-116.4	-180	-166.6	163.9	4	112.1	V539 E540 L545 I546 G547	V539-R543 WeakPolarHBondContact O-CB 3.32Å; V539-R543 PolarHBondContact O-N 2.85Å; E540-R543 PolarHBondContact O-N 3.27Å; R543-L545 PolarHBondContact O-N 3.46Å; R543-I546 PolarHBondContact O-N 2.87Å; R543-G547 PolarHBondContact O-N 2.8Å
544	Q	69.9	Low	63.8	Low	150 Å²	150	130.7 Å²	130.7	70%	0.701	67%	0.665	S	S	*	*	H	α-helix	trans	-66.6	-25.8	174.1	-77.1	178.5	-9.7	0	0	112.9	E540 V542	E540-Q544 WeakPolarHBondContact O-CB 3.19Å; E540-Q544 WeakPolarHBondContact O-CG 3.38Å; E540-Q544 PolarHBondContact O-N 3.36Å; V542-Q544 VanDerWaalsContact C-N 3.35Å
545	L	69.1	Low	62.5	Low	145 Å²	145	133.8 Å²	133.8	76%	0.759	68%	0.675	S	S	*	*	H	α-helix	trans	-82.2	-23.4	174.4	-77.4	161.5	0	0	0	113.2	R541 V542 R543	R541-L545 WeakPolarHBondContact O-CD1 3.33Å; R541-L545 WeakPolarHBondContact O-CG 3.47Å; R541-L545 PolarHBondContact O-N 3.32Å; V542-L545 WeakPolarHBondContact O-CB 3.27Å; V542-L545 PolarHBondContact O-N 3.29Å; V542-L545 VanDerWaalsContact O-N 3.16Å; R543-L545 PolarHBondContact O-N 3.46Å
546	I	70.1	Confident	61.2	Low	139 Å²	139	135.1 Å²	135.1	71%	0.713	68%	0.682	S	S	*	*	H	α-helix	trans	-105.1	-24.4	-175.2	-61.9	170.3	0	0	0	112.3	V542 R543	V542-I546 HydrophobicContact CG1-CD1 3.62Å; V542-I546 WeakPolarHBondContact O-CG1 3.39Å; V542-I546 PolarHBondContact O-N 2.86Å; V542-I546 VanDerWaalsContact O-N 3.09Å; R543-I546 PolarHBondContact O-N 2.87Å
547	G	57.7	Low	60.1	Low	49 Å²	49	139.4 Å²	139.4	51%	0.505	71%	0.706	S	S	.	*	S	Bend	trans	-88.6	132.8	-178.8	0	0	0	0	0	113.6	R543 R549	R543-G547 PolarHBondContact O-N 2.8Å; G547-R549 PolarHBondContact O-N 3.42Å
548	R	56.8	Low	58.3	Low	249 Å²	249	142.5 Å²	142.5	94%	0.94	73%	0.73	S	S	*	*			trans	-59.5	131	169.5	-131.1	176.5	-173.9	-179.6	1	109.2	E550	R548-E550 PolarHBondContact O-N 3.16Å; R548-E550 VanDerWaalsContact O-N 3.08Å
549	R	51.1	Low	56.9	Low	251 Å²	251	143.7 Å²	143.7	95%	0.947	74%	0.738	S	S	*	*			trans	-58.3	109	174.6	-94.5	-179.9	171.9	175.8	-3	110.2	G547	G547-R549 PolarHBondContact O-N 3.42Å
550	E	51.8	Low	54.9	Low	177 Å²	177	150.4 Å²	150.4	83%	0.827	77%	0.77	S	S	*	*			trans	-83.2	147.9	157.2	-77	-175.3	166.5	0	0	109.7	R548	R548-E550 PolarHBondContact O-N 3.16Å; R548-E550 VanDerWaalsContact O-N 3.08Å
551	P	47.5	Very low	54.1	Low	124 Å²	124	152.6 Å²	152.6	81%	0.805	78%	0.783	S	S	*	*			trans	-67.1	140.7	-175	27.2	-32.3	0	0	0	111	G553	P551-G553 PolarHBondContact O-N 3.26Å
552	A	51.9	Low	53.1	Low	107 Å²	107	151.7 Å²	151.7	88%	0.884	79%	0.791	S	S	*	*			trans	-58.3	104.3	-178.8	0	0	0	0	0	111.3
553	G	41.5	Very low	51.9	Low	64 Å²	64	155.8 Å²	155.8	66%	0.66	81%	0.809	S	S	*	*			trans	-70.3	135	158.6	0	0	0	0	0	109.1	P551 H555	P551-G553 PolarHBondContact O-N 3.26Å; G553-H555 PolarHBondContact O-N 3.09Å
554	E	45	Very low	50.8	Low	187 Å²	187	153.7 Å²	153.7	87%	0.874	81%	0.814	S	S	*	*			trans	-47.5	110.3	-178.7	-73.9	172.3	133.1	0	0	112.2	T556	E554-T556 PolarHBondContact O-N 3.19Å
555	H	43.3	Very low	49.6	Very low	187 Å²	187	153.9 Å²	153.9	87%	0.866	82%	0.821	S	S	*	*			trans	-81.3	97.6	154.7	-88.6	-44.4	0	0	0	107.4	G553	G553-H555 PolarHBondContact O-N 3.09Å
556	T	44.2	Very low	48.3	Very low	115 Å²	115	154.5 Å²	154.5	71%	0.706	83%	0.825	S	S	*	*			trans	-56.2	126.9	162	37.1	0	0	0	0	108.8	E554 L558	E554-T556 PolarHBondContact O-N 3.19Å; T556-L558 PolarHBondContact O-N 2.99Å
557	P	46.9	Very low	46.8	Very low	114 Å²	114	155.6 Å²	155.6	74%	0.74	83%	0.833	S	S	*	*			trans	-70.2	117.1	172.7	27.4	-29.9	0	0	0	107.8	L559	P557-L559 PolarHBondContact O-N 3.08Å
558	L	39.1	Very low	45.9	Very low	175 Å²	175	163.8 Å²	163.8	92%	0.916	86%	0.858	S	S	*	*			trans	-60.4	103.8	165.1	-89.7	155.5	0	0	0	107.9	T556	T556-L558 PolarHBondContact O-N 2.99Å
559	L	42.7	Very low	45	Very low	155 Å²	155	156.8 Å²	156.8	81%	0.812	85%	0.851	S	S	*	*			trans	-73.3	126.6	156.3	-91.8	154.1	0	0	0	107.6	P557	P557-L559 PolarHBondContact O-N 3.08Å
560	L	35.4	Very low	44.5	Very low	225 Å²	225	148.2 Å²	148.2	100%	1.178	84%	0.843	S	S	*	*			trans	112.1	0	170.5	-74	137.4	0	0	0	116

Retrieved 560 of 560 residues in 118.4 ms (Link to these results)

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