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Asparaginyl-tRNA synthetase

Mitochondrial aminoacyl-tRNA synthetase that catalyzes the specific attachment of the asparagine amino acid (aa) to the homologous transfer RNA (tRNA), further participating in protein synthesis. The reaction occurs in a two steps: asparagine is first activated by ATP to form Asn-AMP and then transferred to the acceptor end of tRNA(Asn).

AlphaFold DB , UniProt , Accession A0A096MY56, Species PAPAN (Papio anubis, Olive baboon), Gene NARS2, Length 477 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	34.9	Very low	34.1	Very low	231 Å²	231	159.6 Å²	159.6	100%	1.138	85%	0.853	S	S	*	*				0	123.5	0	-108.6	-176.6	-176.6	0	0	107.9
2	L	32.7	Very low	34.1	Very low	175 Å²	175	166.3 Å²	166.3	92%	0.916	86%	0.858	S	S	*	*			trans	57.3	125.3	169.1	-64	114.2	0	0	0	118.2
3	G	32.6	Very low	34.4	Very low	64 Å²	64	169.5 Å²	169.5	66%	0.66	86%	0.862	S	S	*	*			cis	150.8	125	0	0	0	0	0	0	111.9
4	V	35.7	Very low	34.2	Very low	130 Å²	130	166.1 Å²	166.1	79%	0.788	86%	0.859	S	S	*	*			trans	74.8	119.9	132.5	-173.2	0	0	0	0	117.2
5	R	33	Very low	34.8	Very low	230 Å²	230	163.1 Å²	163.1	87%	0.868	86%	0.858	S	S	*	*				-179.8	121.8	72.8	-122.7	142.8	-161.2	-157.9	4.6	107.5
6	C	33.9	Very low	34.9	Very low	111 Å²	111	159.6 Å²	159.6	75%	0.75	85%	0.851	S	S	*	*				67.1	112.8	74.7	-154.1	0	0	0	0	115.2
7	L	30.8	Very low	35.3	Very low	161 Å²	161	155 Å²	155	84%	0.843	84%	0.841	S	S	*	*			trans	-168.7	83.1	135.6	-102	151.6	0	0	0	111.3
8	L	34.5	Very low	35.3	Very low	173 Å²	173	153.4 Å²	153.4	91%	0.906	84%	0.839	S	S	*	*			trans	-88.1	124.5	152	-90.7	150.2	0	0	0	107.2
9	R	32	Very low	35.3	Very low	222 Å²	222	155 Å²	155	84%	0.838	84%	0.838	S	S	*	*			trans	-132.2	110.9	160.2	-105.8	-174.8	176.8	-171.1	-1.1	109.2
10	S	43.4	Very low	35.3	Very low	117 Å²	117	153.4 Å²	153.4	82%	0.818	84%	0.835	S	S	*	*			trans	-63.7	135.7	163.6	42	0	0	0	0	110.6
11	V	31.6	Very low	35.4	Very low	142 Å²	142	157.1 Å²	157.1	86%	0.861	84%	0.838	S	S	*	*			trans	-134.3	137	158.7	-175.5	0	0	0	0	108.7
12	R	33.7	Very low	35.8	Very low	240 Å²	240	154.9 Å²	154.9	91%	0.906	82%	0.824	S	S	*	*			trans	-67.9	152.4	-162.9	-73.2	165.6	167.3	172.9	-4.9	114.2	C14	R12-C14 PolarHBondContact O-N 3.37Å
13	F	38.5	Very low	36.4	Very low	208 Å²	208	155.6 Å²	155.6	91%	0.912	82%	0.82	S	S	*	*			trans	-47	120.8	160.2	-91.7	-103.3	0	0	0	111.9
14	C	31.3	Very low	37.5	Very low	122 Å²	122	158.4 Å²	158.4	82%	0.824	83%	0.826	S	S	*	*			trans	-105.9	112.2	151.6	-89.2	0	0	0	0	107.6	R12 S16	R12-C14 PolarHBondContact O-N 3.37Å; C14-S16 PolarHBondContact O-N 3.19Å
15	S	42.8	Very low	38.9	Very low	121 Å²	121	153.7 Å²	153.7	85%	0.846	80%	0.799	S	S	*	*			trans	-63.2	108.3	165.3	171.9	0	0	0	0	108.7
16	S	36.6	Very low	41.5	Very low	107 Å²	107	145.4 Å²	145.4	75%	0.748	78%	0.779	S	S	*	*			trans	-106.5	111.1	161	60.4	0	0	0	0	107.5	C14	C14-S16 PolarHBondContact O-N 3.19Å
17	A	41.7	Very low	44.3	Very low	81 Å²	81	146.3 Å²	146.3	67%	0.669	77%	0.771	S	S	*	*			trans	-52.5	132.1	169.3	0	0	0	0	0	109.3	F19	A17-F19 PolarHBondContact O-N 3.16Å; A17-F19 VanDerWaalsContact O-N 3.16Å
18	P	35.3	Very low	47.4	Very low	126 Å²	126	140.7 Å²	140.7	82%	0.818	74%	0.741	S	S	*	*			trans	-71.3	115.6	176.3	4.4	8.5	0	0	0	108.3
19	F	36.1	Very low	50.4	Low	184 Å²	184	133.7 Å²	133.7	81%	0.807	71%	0.707	S	S	*	*			trans	-51.6	143.3	152.9	-86.4	-90.4	0	0	0	108.4	A17 R21	A17-F19 PolarHBondContact O-N 3.16Å; A17-F19 VanDerWaalsContact O-N 3.16Å; F19-R21 VanDerWaalsContact C-N 3.26Å; F19-R21 PolarHBondContact O-N 3.08Å
20	P	35.5	Very low	53.4	Low	122 Å²	122	123.1 Å²	123.1	79%	0.792	67%	0.667	S	S	*	*			trans	-64.6	92.6	175.6	27.8	-32.5	0	0	0	108.2	H22	P20-H22 PolarHBondContact O-N 2.72Å; P20-H22 VanDerWaalsContact O-N 3.08Å
21	R	37.8	Very low	55.9	Low	233 Å²	233	124.9 Å²	124.9	88%	0.879	66%	0.656	S	S	*	*			trans	-69.2	104.9	165.7	-73	-175.8	-176.3	-179.4	1.8	105.2	F19 K23	F19-R21 VanDerWaalsContact C-N 3.26Å; F19-R21 PolarHBondContact O-N 3.08Å; R21-K23 VanDerWaalsContact C-N 3.32Å; R21-K23 PolarHBondContact O-N 2.87Å
22	H	41.8	Very low	58.9	Low	183 Å²	183	121.9 Å²	121.9	85%	0.847	64%	0.635	S	S	*	*			trans	-50.1	106.3	156.2	-91.8	-72.4	0	0	0	106.3	P20 P24	P20-H22 PolarHBondContact O-N 2.72Å; P20-H22 VanDerWaalsContact O-N 3.08Å; H22-P24 WeakPolarHBondContact O-CD 3.47Å; H22-P24 VanDerWaalsContact O-N 3.17Å
23	K	46.4	Very low	61.8	Low	191 Å²	191	110.5 Å²	110.5	83%	0.83	59%	0.592	S	S	*	*	P	Polyproline II helix	trans	-54.4	124.1	166.3	-88.8	-177.5	174.6	-179.7	0	105.5	R21 S25	R21-K23 VanDerWaalsContact C-N 3.32Å; R21-K23 PolarHBondContact O-N 2.87Å; K23-S25 PolarHBondContact O-N 3.33Å; K23-S25 VanDerWaalsContact O-N 3.16Å
24	P	54.6	Low	64.4	Low	122 Å²	122	102 Å²	102	79%	0.792	56%	0.555	S	S	*	*	P	Polyproline II helix	trans	-54.7	128.2	172.7	21.4	-29.5	0	0	0	107.3	H22 A26	H22-P24 WeakPolarHBondContact O-CD 3.47Å; H22-P24 VanDerWaalsContact O-N 3.17Å; P24-A26 PolarHBondContact O-N 3.16Å
25	S	65.9	Low	67.2	Low	32 Å²	32	98.8 Å²	98.8	22%	0.224	54%	0.544	C	S	.	.	P	Polyproline II helix	trans	-56.5	132.9	179.4	50.7	0	0	0	0	109.2	K23 K27 H43	K23-S25 PolarHBondContact O-N 3.33Å; K23-S25 VanDerWaalsContact O-N 3.16Å; S25-K27 PolarHBondContact O-N 3.39Å; S25-H43 VanDerWaalsContact CB-O 3.27Å; S25-H43 WeakPolarHBondContact CB-O 3.38Å
26	A	86.9	Confident	69.3	Low	55 Å²	55	94.5 Å²	94.5	46%	0.455	52%	0.515	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61	123.9	178.6	0	0	0	0	0	108.2	P24 L28 I44 K45	P24-A26 PolarHBondContact O-N 3.16Å; A26-L28 PolarHBondContact O-N 3.41Å; A26-I44 WeakPolarHBondContact O-CA 3.24Å; A26-K45 PolarHBondContact O-N 2.98Å
27	K	93.8	Very high	71.2	Confident	131 Å²	131	98.2 Å²	98.2	57%	0.57	52%	0.521	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75.5	121	172.2	179.9	180	167.5	175	0	107.4	S25 K45	S25-K27 PolarHBondContact O-N 3.39Å; K27-K45 VanDerWaalsContact CA-O 3.32Å; K27-K45 WeakPolarHBondContact CA-O 3.34Å
28	L	95.2	Very high	72.6	Confident	43 Å²	43	100.4 Å²	100.4	23%	0.225	52%	0.521	C	S	.	.			trans	-114.7	147.8	175.6	-63.4	-175.7	0	0	0	110.4	A26 A33 I44 K45	A26-L28 PolarHBondContact O-N 3.41Å; L28-A33 HydrophobicContact CB-CB 4.5Å; L28-I44 HydrophobicContact CD1-CB 4.29Å; L28-I44 HydrophobicContact CD1-CD1 4.07Å; L28-I44 HydrophobicContact CD1-CG2 3.78Å; L28-I44 HydrophobicContact CG-CB 4.48Å; L28-I44 HydrophobicContact CG-CG2 4.32Å; L28-K45 PolarHBondContact N-O 2.91Å
29	S	96.8	Very high	74.3	Confident	25 Å²	25	96.2 Å²	96.2	18%	0.175	49%	0.493	C	S	.	.			trans	-70.7	162	162.8	72.4	0	0	0	0	110.1	R31 D32 A33 D66	S29-R31 VanDerWaalsContact C-N 3.29Å; S29-R31 PolarHBondContact O-N 3.17Å; S29-D32 PolarHBondContact O-N 2.83Å; S29-D32 PolarHBondContact OG-N 3.32Å; S29-D32 VanDerWaalsContact OG-N 3.08Å; S29-D32 PolarHBondContact OG-OD2 3.19Å; S29-A33 WeakPolarHBondContact O-CB 3.27Å; S29-A33 PolarHBondContact O-N 3.09Å; S29-D66 VanDerWaalsContact CA-OD2 3.28Å; S29-D66 WeakPolarHBondContact CA-OD2 3.44Å; S29-D66 WeakPolarHBondContact CB-OD2 3.42Å
30	V	96.4	Very high	76	Confident	0 Å²	0	92.6 Å²	92.6	0%	0	49%	0.491	C	S	.	.	H	α-helix	trans	-60.3	-42.1	173.9	166.9	0	0	0	0	110.7	D32 A33 L34 V46 D66 S68 E71 L73	V30-D32 PolarHBondContact O-N 2.97Å; V30-A33 PolarHBondContact O-N 2.94Å; V30-L34 HydrophobicContact CG1-CD1 3.75Å; V30-L34 HydrophobicContact CG1-CG 4.28Å; V30-L34 WeakPolarHBondContact O-CB 3.42Å; V30-L34 VanDerWaalsContact O-CG 3.23Å; V30-L34 WeakPolarHBondContact O-CG 3.14Å; V30-L34 PolarHBondContact O-N 2.9Å; V30-V46 HydrophobicContact CG2-CG1 3.88Å; V30-D66 WeakPolarHBondContact CB-OD1 3.12Å; V30-D66 HydrophobicContact CG2-CB 4.15Å; V30-D66 PolarHBondContact N-OD2 3.34Å; V30-S68 PolarHBondContact N-OG 3.42Å; V30-E71 WeakPolarHBondContact CG1-O 3.43Å; V30-L73 HydrophobicContact CG1-CB 4.06Å; V30-L73 HydrophobicContact CG2-CB 4.28Å
31	R	95.3	Very high	77.9	Confident	155 Å²	155	87.6 Å²	87.6	59%	0.585	46%	0.461	S	S	*	.	H	α-helix	trans	-57.8	-48.2	175.8	-176.6	-179.4	65	-175.8	0.5	112.2	S29 A33 L34 G35 S68	S29-R31 VanDerWaalsContact C-N 3.29Å; S29-R31 PolarHBondContact O-N 3.17Å; R31-A33 VanDerWaalsContact C-N 3.33Å; R31-A33 PolarHBondContact O-N 3.34Å; R31-L34 PolarHBondContact O-N 3.44Å; R31-G35 PolarHBondContact O-N 3.41Å; R31-S68 WeakPolarHBondContact CB-OG 3.44Å; R31-S68 PolarHBondContact N-OG 3.48Å
32	D	94.5	Very high	80.1	Confident	79 Å²	79	82 Å²	82	42%	0.422	45%	0.445	S	S	.	.	H	α-helix	trans	-68.5	-36	-178.3	-54.8	-34.3	0	0	0	111.5	S29 V30 G35 A36	S29-D32 PolarHBondContact O-N 2.83Å; S29-D32 PolarHBondContact OG-N 3.32Å; S29-D32 VanDerWaalsContact OG-N 3.08Å; S29-D32 PolarHBondContact OG-OD2 3.19Å; V30-D32 PolarHBondContact O-N 2.97Å; D32-G35 PolarHBondContact O-N 3.38Å; D32-A36 PolarHBondContact O-N 3.03Å
33	A	94.3	Very high	82.6	Confident	0 Å²	0	77.8 Å²	77.8	0%	0	43%	0.426	C	S	.	.	H	α-helix	trans	-63.5	-44.1	174.3	0	0	0	0	0	111.5	L28 S29 V30 R31 G35 A36 I44 L73 L98 V108	L28-A33 HydrophobicContact CB-CB 4.5Å; S29-A33 WeakPolarHBondContact O-CB 3.27Å; S29-A33 PolarHBondContact O-N 3.09Å; V30-A33 PolarHBondContact O-N 2.94Å; R31-A33 VanDerWaalsContact C-N 3.33Å; R31-A33 PolarHBondContact O-N 3.34Å; A33-G35 VanDerWaalsContact C-N 3.33Å; A33-G35 PolarHBondContact O-N 3.18Å; A33-A36 WeakPolarHBondContact O-CB 3.34Å; A33-A36 PolarHBondContact O-N 3.09Å; A33-I44 HydrophobicContact CB-CD1 4.26Å; A33-L73 HydrophobicContact CB-CD1 4.44Å; A33-L73 HydrophobicContact CB-CD2 4.11Å; A33-L98 HydrophobicContact CB-CD1 4.42Å; A33-L98 HydrophobicContact CB-CD2 4.38Å; A33-V108 WeakPolarHBondContact O-CG2 3.23Å
34	L	92.9	Very high	84.9	Confident	29 Å²	29	68.8 Å²	68.8	15%	0.152	39%	0.386	C	S	.	.	H	α-helix	trans	-65.7	-34.2	177.6	-69.5	169.4	0	0	0	112.7	V30 R31 A36 E71 L73 V108	V30-L34 HydrophobicContact CG1-CD1 3.75Å; V30-L34 HydrophobicContact CG1-CG 4.28Å; V30-L34 WeakPolarHBondContact O-CB 3.42Å; V30-L34 VanDerWaalsContact O-CG 3.23Å; V30-L34 WeakPolarHBondContact O-CG 3.14Å; V30-L34 PolarHBondContact O-N 2.9Å; R31-L34 PolarHBondContact O-N 3.44Å; L34-A36 VanDerWaalsContact C-N 3.35Å; L34-E71 HydrophobicContact CD1-CB 3.69Å; L34-L73 HydrophobicContact CD2-CD1 4.24Å; L34-V108 HydrophobicContact CD2-CG2 4.15Å
35	G	90.1	Very high	86.9	Confident	56 Å²	56	65.3 Å²	65.3	58%	0.577	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.1	-1.6	178.4	0	0	0	0	0	115.4	R31 D32 A33 Q37	R31-G35 PolarHBondContact O-N 3.41Å; D32-G35 PolarHBondContact O-N 3.38Å; A33-G35 VanDerWaalsContact C-N 3.33Å; A33-G35 PolarHBondContact O-N 3.18Å; G35-Q37 PolarHBondContact O-N 2.89Å; G35-Q37 VanDerWaalsContact O-N 3.14Å
36	A	87.5	Confident	88.4	Confident	30 Å²	30	63.9 Å²	63.9	25%	0.248	35%	0.349	C	S	.	.			trans	-65	114.1	-176.4	0	0	0	0	0	111.8	D32 A33 L34 T39 L98	D32-A36 PolarHBondContact O-N 3.03Å; A33-A36 WeakPolarHBondContact O-CB 3.34Å; A33-A36 PolarHBondContact O-N 3.09Å; L34-A36 VanDerWaalsContact C-N 3.35Å; A36-T39 HydrophobicContact CB-CG2 4.48Å; A36-L98 HydrophobicContact CB-CD2 3.71Å
37	Q	76.4	Confident	89	Confident	185 Å²	185	64.3 Å²	64.3	86%	0.864	34%	0.341	S	S	*	.	S	Bend	trans	-77.9	-31.6	177.8	-64	-167.8	-3.7	0	0	112.9	G35	G35-Q37 PolarHBondContact O-N 2.89Å; G35-Q37 VanDerWaalsContact O-N 3.14Å
38	N	71.6	Confident	89.2	Confident	128 Å²	128	58.3 Å²	58.3	68%	0.684	32%	0.317	S	S	*	.			trans	-101.7	97.4	178.4	-71.8	-23.1	0	0	0	110.5
39	T	70.8	Confident	89.3	Confident	37 Å²	37	61.4 Å²	61.4	23%	0.227	33%	0.326	C	S	.	.			trans	-102.6	55	179.3	47.1	0	0	0	0	112.2	A36 G41 L98 V108	A36-T39 HydrophobicContact CB-CG2 4.48Å; T39-G41 PolarHBondContact O-N 2.92Å; T39-L98 HydrophobicContact CG2-CD2 4.44Å; T39-L98 HydrophobicContact CG2-CG 4.36Å; T39-V108 HydrophobicContact CG2-CB 4.44Å; T39-V108 HydrophobicContact CG2-CG1 3.57Å
40	S	71.3	Confident	89.3	Confident	109 Å²	109	60.2 Å²	60.2	76%	0.762	32%	0.317	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76.3	21.2	-178.4	-56.9	0	0	0	0	114.4
41	G	75.7	Confident	89.2	Confident	16 Å²	16	62.4 Å²	62.4	17%	0.165	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	77.7	31.3	-175.3	0	0	0	0	0	113.3	T39 H43 L98	T39-G41 PolarHBondContact O-N 2.92Å; G41-H43 PolarHBondContact O-N 3.48Å; G41-H43 PolarHBondContact O-ND1 2.95Å; G41-L98 WeakPolarHBondContact CA-O 3.21Å; G41-L98 PolarHBondContact N-O 2.84Å
42	E	84.9	Confident	89.1	Confident	115 Å²	115	56.5 Å²	56.5	54%	0.537	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.2	134.2	176.8	-65.5	-167.3	167.1	0	0	110.6	I44 Q97 L98	E42-I44 HydrophobicContact CB-CG2 4.32Å; E42-I44 PolarHBondContact O-N 3.14Å; E42-Q97 WeakPolarHBondContact O-CA 3.37Å; E42-L98 PolarHBondContact O-N 2.63Å
43	H	92.9	Very high	89.1	Confident	96 Å²	96	54.8 Å²	54.8	44%	0.444	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81	111.3	176	-72	60.4	0	0	0	109.2	S25 G41 G96 Q97 E113	S25-H43 VanDerWaalsContact CB-O 3.27Å; S25-H43 WeakPolarHBondContact CB-O 3.38Å; G41-H43 PolarHBondContact O-N 3.48Å; G41-H43 PolarHBondContact O-ND1 2.95Å; H43-G96 CarbonylContact C-O 3.54Å; H43-G96 WeakPolarHBondContact CA-O 3.39Å; H43-Q97 WeakPolarHBondContact CE1-CG 3.39Å; H43-Q97 PolarHBondContact CE1-NE2 2.84Å; H43-Q97 VanDerWaalsContact CE1-NE2 3.32Å; H43-Q97 PolarHBondContact NE2-NE2 3.21Å; H43-E113 IonicContact CD2-OE1 3.68Å; H43-E113 IonicContact CD2-OE2 3.41Å; H43-E113 PolarHBondContact CD2-OE2 2.88Å; H43-E113 IonicContact NE2-OE1 3.17Å; H43-E113 PolarHBondContact NE2-OE1 2.8Å; H43-E113 IonicContact NE2-OE2 3.59Å
44	I	95.2	Very high	89	Confident	1 Å²	1	60.6 Å²	60.6	1%	0.005	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	167.3	-177.6	68.6	163.5	0	0	0	110.8	A26 L28 A33 E42 V46 Q95 G96 L98 L110	A26-I44 WeakPolarHBondContact O-CA 3.24Å; L28-I44 HydrophobicContact CD1-CB 4.29Å; L28-I44 HydrophobicContact CD1-CD1 4.07Å; L28-I44 HydrophobicContact CD1-CG2 3.78Å; L28-I44 HydrophobicContact CG-CB 4.48Å; L28-I44 HydrophobicContact CG-CG2 4.32Å; A33-I44 HydrophobicContact CB-CD1 4.26Å; E42-I44 HydrophobicContact CB-CG2 4.32Å; E42-I44 PolarHBondContact O-N 3.14Å; I44-V46 HydrophobicContact CD1-CG2 3.76Å; I44-V46 HydrophobicContact CG1-CG2 4.45Å; I44-Q95 WeakPolarHBondContact O-CA 3.34Å; I44-G96 PolarHBondContact N-O 3.37Å; I44-G96 PolarHBondContact O-N 2.93Å; I44-L98 HydrophobicContact CD1-CB 3.85Å; I44-L98 HydrophobicContact CD1-CD1 4.08Å; I44-L98 HydrophobicContact CD1-CD2 4.15Å; I44-L98 HydrophobicContact CD1-CG 4.25Å; I44-L98 HydrophobicContact CG1-CB 4.12Å; I44-L110 HydrophobicContact CD1-CD1 4.04Å; I44-L110 HydrophobicContact CG1-CD1 3.65Å
45	K	96.8	Very high	89	Confident	50 Å²	50	62.3 Å²	62.3	22%	0.217	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	128.5	170.2	179.5	176.9	64.2	178.3	0	109.7	A26 K27 L28 E93 I94 Q95	A26-K45 PolarHBondContact O-N 2.98Å; K27-K45 VanDerWaalsContact CA-O 3.32Å; K27-K45 WeakPolarHBondContact CA-O 3.34Å; L28-K45 PolarHBondContact N-O 2.91Å; K45-E93 HydrophobicContact CD-CG 3.86Å; K45-E93 HydrophobicContact CG-CG 3.88Å; K45-I94 CarbonylContact C-O 3.58Å; K45-I94 WeakPolarHBondContact CA-O 3.28Å; K45-Q95 HydrophobicContact CB-CG 4.21Å; K45-Q95 HydrophobicContact CD-CG 4.32Å; K45-Q95 HydrophobicContact CG-CG 4.02Å
46	V	97.6	Very high	88.9	Confident	2 Å²	2	64.4 Å²	64.4	1%	0.012	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	141	174.9	177.9	0	0	0	0	109.1	V30 I44 L73 I94 L110	V30-V46 HydrophobicContact CG2-CG1 3.88Å; I44-V46 HydrophobicContact CD1-CG2 3.76Å; I44-V46 HydrophobicContact CG1-CG2 4.45Å; V46-L73 HydrophobicContact CB-CD2 4.37Å; V46-L73 HydrophobicContact CG1-CD2 4.24Å; V46-L73 HydrophobicContact CG2-CD2 3.79Å; V46-I94 PolarHBondContact N-O 2.98Å; V46-I94 PolarHBondContact O-N 2.99Å; V46-L110 HydrophobicContact CB-CD2 4.35Å; V46-L110 HydrophobicContact CG2-CD2 4.21Å
47	Q	98.3	Very high	88.9	Confident	63 Å²	63	73.1 Å²	73.1	29%	0.294	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	136.9	176.6	-68.9	176.9	-39.9	0	0	108.8	D66 V92 E93	Q47-D66 VanDerWaalsContact O-CB 3.32Å; Q47-D66 WeakPolarHBondContact O-CB 3.49Å; Q47-V92 VanDerWaalsContact CA-O 3.3Å; Q47-V92 WeakPolarHBondContact CA-O 3.42Å; Q47-E93 HydrophobicContact CG-CB 3.96Å; Q47-E93 HydrophobicContact CG-CG 3.91Å; Q47-E93 PolarHBondContact NE2-OE2 2.97Å
48	G	97.9	Very high	89.7	Confident	5 Å²	5	72 Å²	72	5%	0.052	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	176.9	-162.1	-179.4	0	0	0	0	0	112.1	S91 V92	G48-S91 CarbonylContact O-C 3.51Å; G48-S91 WeakPolarHBondContact O-CA 3.44Å; G48-V92 PolarHBondContact N-O 3.06Å; G48-V92 VanDerWaalsContact N-O 3.11Å; G48-V92 PolarHBondContact O-N 3.47Å
49	W	97.5	Very high	90.7	Very high	109 Å²	109	68.3 Å²	68.3	41%	0.413	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	141.4	178.7	-64.8	-93.1	0	0	0	111.1	R51 N65 S90	W49-R51 PolarHBondContact O-N 3.39Å; W49-N65 PolarHBondContact N-O 3.3Å; W49-N65 PolarHBondContact O-N 3.08Å; W49-S90 WeakPolarHBondContact CA-O 3.32Å
50	I	96.7	Very high	91.9	Very high	0 Å²	0	66.6 Å²	66.6	0%	0	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.3	126	176	-65.7	173.2	0	0	0	109.8	V53 L86 T87 G89 S90 V92	I50-V53 HydrophobicContact CG2-CG2 3.32Å; I50-L86 HydrophobicContact CD1-CB 4.1Å; I50-L86 HydrophobicContact CD1-CD2 3.71Å; I50-T87 WeakPolarHBondContact CB-O 3.4Å; I50-T87 WeakPolarHBondContact CG2-O 3.49Å; I50-G89 PolarHBondContact O-N 3.3Å; I50-S90 PolarHBondContact N-O 3.36Å; I50-V92 HydrophobicContact CD1-CG1 3.62Å; I50-V92 HydrophobicContact CG1-CG1 3.9Å; I50-V92 HydrophobicContact CG1-CG2 4.05Å
51	R	94.4	Very high	93.1	Very high	45 Å²	45	63.1 Å²	63.1	17%	0.17	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	-27	175.8	-52.3	-61.8	-97.7	177.9	-6.5	112.6	W49 H63 N65 F88 R148 N150	W49-R51 PolarHBondContact O-N 3.39Å; R51-H63 HydrophobicContact CB-CB 4.17Å; R51-H63 PolarHBondContact N-O 2.95Å; R51-N65 HydrophobicContact CG-CB 3.55Å; R51-F88 VanDerWaalsContact O-CD2 3.27Å; R51-F88 WeakPolarHBondContact O-CD2 3.23Å; R51-R148 PolarHBondContact NH1-O 2.88Å; R51-R148 PolarHBondContact NH2-O 3.05Å; R51-N150 PolarHBondContact NH2-OD1 2.77Å
52	S	94.1	Very high	94.1	Very high	31 Å²	31	62.3 Å²	62.3	22%	0.217	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.4	153.8	172.2	69.4	0	0	0	0	110.5	L62 H63	S52-L62 WeakPolarHBondContact O-CA 3.48Å; S52-H63 PolarHBondContact O-N 3.32Å; S52-H63 VanDerWaalsContact O-N 3.07Å; S52-H63 WeakPolarHBondContact OG-CB 3.42Å; S52-H63 VanDerWaalsContact OG-CG 3.31Å
53	V	94	Very high	94.6	Very high	44 Å²	44	60 Å²	60	27%	0.267	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	129.8	175.3	-176.8	0	0	0	0	107.9	I50 L60 L62 L86	I50-V53 HydrophobicContact CG2-CG2 3.32Å; V53-L60 HydrophobicContact CG1-CD1 3.89Å; V53-L62 HydrophobicContact CB-CD2 4.02Å; V53-L62 HydrophobicContact CG1-CD2 3.7Å; V53-L62 HydrophobicContact CG2-CD2 3.64Å; V53-L86 WeakPolarHBondContact CG2-O 3.44Å
54	R	93.1	Very high	94.8	Very high	122 Å²	122	55.5 Å²	55.5	46%	0.46	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	113.5	176.6	-177	-175.2	66.4	-178.9	-3.8	109.9	Q56 F61	R54-Q56 HydrophobicContact CG-CG 4.23Å; R54-F61 HydrophobicContact CB-CB 4.36Å; R54-F61 PolarHBondContact N-O 2.85Å; R54-F61 PolarHBondContact O-N 2.9Å
55	S	91.4	Very high	94.9	Very high	65 Å²	65	56 Å²	56	46%	0.455	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	128.2	174.8	-158.5	0	0	0	0	109.8	D82	S55-D82 WeakPolarHBondContact CB-OD2 3.43Å; S55-D82 PolarHBondContact OG-OD2 2.88Å
56	Q	89.7	Confident	94.9	Very high	99 Å²	99	55.5 Å²	55.5	46%	0.463	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	110.5	178.8	-74.6	-173.2	-1.4	0	0	111.2	R54 K58 V59 F61	R54-Q56 HydrophobicContact CG-CG 4.23Å; Q56-K58 PolarHBondContact O-N 2.81Å; Q56-V59 PolarHBondContact N-O 3.01Å; Q56-V59 PolarHBondContact O-N 2.64Å; Q56-F61 HydrophobicContact CB-CE2 4.43Å
57	K	87.3	Confident	94.8	Very high	214 Å²	214	57.2 Å²	57.2	93%	0.93	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.9	-100.7	-179.4	-62.4	-179.9	178.4	178.6	0	111.7
58	K	91.7	Very high	94.8	Very high	161 Å²	161	55.6 Å²	55.6	70%	0.7	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.4	1.4	-177.5	-65.3	-171.9	174.6	-173.5	0	113.5	Q56 S79	Q56-K58 PolarHBondContact O-N 2.81Å; K58-S79 WeakPolarHBondContact CA-OG 3.2Å; K58-S79 PolarHBondContact O-N 2.83Å; K58-S79 PolarHBondContact O-OG 2.92Å
59	V	93.9	Very high	94.6	Very high	51 Å²	51	55.9 Å²	55.9	31%	0.309	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	132.5	-172.7	-172.4	0	0	0	0	110.2	Q56 F61 V76	Q56-V59 PolarHBondContact N-O 3.01Å; Q56-V59 PolarHBondContact O-N 2.64Å; V59-F61 HydrophobicContact CB-CE2 3.98Å; V59-F61 HydrophobicContact CB-CZ 4.26Å; V59-F61 HydrophobicContact CG1-CD2 4.16Å; V59-F61 HydrophobicContact CG1-CE1 4.09Å; V59-F61 HydrophobicContact CG1-CE2 3.6Å; V59-F61 HydrophobicContact CG1-CZ 3.56Å; V59-V76 HydrophobicContact CG1-CG1 3.56Å
60	L	95.7	Very high	94.5	Very high	0 Å²	0	52 Å²	52	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	127.2	172.1	172.7	66.5	0	0	0	109.2	V53 L62 A77 D82 L86 I115	V53-L60 HydrophobicContact CG1-CD1 3.89Å; L60-L62 HydrophobicContact CD1-CD2 4.06Å; L60-L62 HydrophobicContact CD2-CD1 4.48Å; L60-L62 HydrophobicContact CD2-CD2 4.34Å; L60-L62 HydrophobicContact CD2-CG 4.39Å; L60-L62 HydrophobicContact CG-CD2 4.19Å; L60-L62 HydrophobicContact CG-CG 4.25Å; L60-A77 HydrophobicContact CB-CB 4.15Å; L60-A77 HydrophobicContact CD2-CB 4.24Å; L60-A77 HydrophobicContact CG-CB 4.47Å; L60-A77 PolarHBondContact N-O 2.9Å; L60-A77 PolarHBondContact O-N 3.48Å; L60-D82 HydrophobicContact CD1-CB 4.47Å; L60-D82 HydrophobicContact CD2-CB 4.04Å; L60-L86 HydrophobicContact CD2-CD1 3.95Å; L60-I115 HydrophobicContact CD2-CD1 4.32Å
61	F	95.5	Very high	94.4	Very high	36 Å²	36	56.6 Å²	56.6	16%	0.158	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	126.6	173.6	-61.2	-88.2	0	0	0	109.7	R54 Q56 V59 V75 V76	R54-F61 HydrophobicContact CB-CB 4.36Å; R54-F61 PolarHBondContact N-O 2.85Å; R54-F61 PolarHBondContact O-N 2.9Å; Q56-F61 HydrophobicContact CB-CE2 4.43Å; V59-F61 HydrophobicContact CB-CE2 3.98Å; V59-F61 HydrophobicContact CB-CZ 4.26Å; V59-F61 HydrophobicContact CG1-CD2 4.16Å; V59-F61 HydrophobicContact CG1-CE1 4.09Å; V59-F61 HydrophobicContact CG1-CE2 3.6Å; V59-F61 HydrophobicContact CG1-CZ 3.56Å; F61-V75 WeakPolarHBondContact CA-O 3.25Å; F61-V76 HydrophobicContact CD1-CG2 4.04Å; F61-V76 HydrophobicContact CE1-CG1 4.34Å; F61-V76 HydrophobicContact CE1-CG2 4.02Å
62	L	96.7	Very high	94.4	Very high	0 Å²	0	55.9 Å²	55.9	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	143	170.8	-49.5	171.2	0	0	0	109.2	S52 V53 L60 V64 V75 I94 I115	S52-L62 WeakPolarHBondContact O-CA 3.48Å; V53-L62 HydrophobicContact CB-CD2 4.02Å; V53-L62 HydrophobicContact CG1-CD2 3.7Å; V53-L62 HydrophobicContact CG2-CD2 3.64Å; L60-L62 HydrophobicContact CD1-CD2 4.06Å; L60-L62 HydrophobicContact CD2-CD1 4.48Å; L60-L62 HydrophobicContact CD2-CD2 4.34Å; L60-L62 HydrophobicContact CD2-CG 4.39Å; L60-L62 HydrophobicContact CG-CD2 4.19Å; L60-L62 HydrophobicContact CG-CG 4.25Å; L62-V64 HydrophobicContact CB-CG2 4.36Å; L62-V75 HydrophobicContact CB-CB 4.14Å; L62-V75 PolarHBondContact N-O 3.05Å; L62-V75 PolarHBondContact O-N 3.02Å; L62-I94 HydrophobicContact CD1-CD1 4.14Å; L62-I115 HydrophobicContact CD1-CD1 3.76Å
63	H	96.4	Very high	94.6	Very high	67 Å²	67	54.4 Å²	54.4	31%	0.31	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	124.8	160.8	-72.5	-163	0	0	0	108.1	R51 S52	R51-H63 HydrophobicContact CB-CB 4.17Å; R51-H63 PolarHBondContact N-O 2.95Å; S52-H63 PolarHBondContact O-N 3.32Å; S52-H63 VanDerWaalsContact O-N 3.07Å; S52-H63 WeakPolarHBondContact OG-CB 3.42Å; S52-H63 VanDerWaalsContact OG-CG 3.31Å
64	V	97.4	Very high	94.7	Very high	1 Å²	1	53.1 Å²	53.1	1%	0.006	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	134.9	179	-179.8	0	0	0	0	109.8	L62 S72 L73 V75 V92 I94	L62-V64 HydrophobicContact CB-CG2 4.36Å; V64-S72 CarbonylContact O-C 3.55Å; V64-S72 WeakPolarHBondContact O-CA 3.33Å; V64-L73 PolarHBondContact N-O 3.06Å; V64-L73 PolarHBondContact O-N 2.87Å; V64-V75 HydrophobicContact CB-CG2 4.48Å; V64-V75 HydrophobicContact CG2-CG2 4.02Å; V64-V92 HydrophobicContact CG1-CG2 4.13Å; V64-V92 HydrophobicContact CG2-CG2 4Å; V64-I94 HydrophobicContact CG2-CD1 3.74Å
65	N	96.9	Very high	94.9	Very high	11 Å²	11	47.3 Å²	47.3	6%	0.059	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	140	177.2	-171.5	-83.9	0	0	0	109.8	W49 R51 G67 S69 E71	W49-N65 PolarHBondContact N-O 3.3Å; W49-N65 PolarHBondContact O-N 3.08Å; R51-N65 HydrophobicContact CG-CB 3.55Å; N65-G67 WeakPolarHBondContact OD1-CA 3.5Å; N65-G67 PolarHBondContact OD1-N 3.19Å; N65-S69 PolarHBondContact ND2-O 3.46Å; N65-E71 PolarHBondContact ND2-O 2.95Å
66	D	97.1	Very high	95.1	Very high	40 Å²	40	45.4 Å²	45.4	21%	0.214	23%	0.231	C	C	.	.			trans	-113.7	5.1	-178.5	67.3	-3.2	0	0	0	112.8	S29 V30 Q47 S68	S29-D66 VanDerWaalsContact CA-OD2 3.28Å; S29-D66 WeakPolarHBondContact CA-OD2 3.44Å; S29-D66 WeakPolarHBondContact CB-OD2 3.42Å; V30-D66 WeakPolarHBondContact CB-OD1 3.12Å; V30-D66 HydrophobicContact CG2-CB 4.15Å; V30-D66 PolarHBondContact N-OD2 3.34Å; Q47-D66 VanDerWaalsContact O-CB 3.32Å; Q47-D66 WeakPolarHBondContact O-CB 3.49Å; D66-S68 VanDerWaalsContact C-N 3.34Å; D66-S68 WeakPolarHBondContact OD1-CB 3.44Å; D66-S68 PolarHBondContact OD1-N 3.47Å; D66-S68 PolarHBondContact OD1-OG 2.98Å; D66-S68 PolarHBondContact OD2-OG 3.41Å
67	G	96.1	Very high	95.4	Very high	38 Å²	38	41 Å²	41	39%	0.392	21%	0.212	S	C	.	.	S	Bend	trans	87.4	-11.9	-176.7	0	0	0	0	0	115.1	N65 S69 R157	N65-G67 WeakPolarHBondContact OD1-CA 3.5Å; N65-G67 PolarHBondContact OD1-N 3.19Å; G67-S69 PolarHBondContact O-N 2.99Å; G67-R157 PolarHBondContact O-NH1 3.35Å
68	S	96.4	Very high	95.8	Very high	29 Å²	29	34.8 Å²	34.8	20%	0.203	19%	0.189	C	C	.	.	S	Bend	trans	-69.6	-18.1	-178.6	65.1	0	0	0	0	114.2	V30 R31 D66	V30-S68 PolarHBondContact N-OG 3.42Å; R31-S68 WeakPolarHBondContact CB-OG 3.44Å; R31-S68 PolarHBondContact N-OG 3.48Å; D66-S68 VanDerWaalsContact C-N 3.34Å; D66-S68 WeakPolarHBondContact OD1-CB 3.44Å; D66-S68 PolarHBondContact OD1-N 3.47Å; D66-S68 PolarHBondContact OD1-OG 2.98Å; D66-S68 PolarHBondContact OD2-OG 3.41Å
69	S	95.1	Very high	95.8	Very high	11 Å²	11	29.1 Å²	29.1	8%	0.077	17%	0.169	C	C	.	.			trans	-146.2	155	-175.3	141.4	0	0	0	0	109.9	N65 G67 E71	N65-S69 PolarHBondContact ND2-O 3.46Å; G67-S69 PolarHBondContact O-N 2.99Å; S69-E71 WeakPolarHBondContact OG-CA 3.41Å; S69-E71 PolarHBondContact OG-N 2.86Å; S69-E71 PolarHBondContact OG-O 2.82Å
70	L	95.1	Very high	95.8	Very high	28 Å²	28	31.1 Å²	31.1	15%	0.147	19%	0.186	C	C	.	.	S	Bend	trans	-65.6	-47	167.9	176.3	56.3	0	0	0	111.2	N150 E293 D294 L297	L70-N150 HydrophobicContact CD1-CB 3.89Å; L70-E293 HydrophobicContact CD2-CB 4.33Å; L70-D294 WeakPolarHBondContact CB-OD1 3.3Å; L70-L297 HydrophobicContact CD1-CD1 4.32Å; L70-L297 HydrophobicContact CD1-CD2 3.96Å; L70-L297 HydrophobicContact CD2-CB 3.95Å; L70-L297 HydrophobicContact CD2-CD1 4.1Å; L70-L297 HydrophobicContact CD2-CD2 4.41Å; L70-L297 HydrophobicContact CD2-CG 4.36Å
71	E	94.4	Very high	95.6	Very high	96 Å²	96	33.8 Å²	33.8	45%	0.449	20%	0.2	S	C	.	.	S	Bend	trans	-68.5	146	178.8	-65.7	-165.5	169.2	0	0	111.4	V30 L34 N65 S69	V30-E71 WeakPolarHBondContact CG1-O 3.43Å; L34-E71 HydrophobicContact CD1-CB 3.69Å; N65-E71 PolarHBondContact ND2-O 2.95Å; S69-E71 WeakPolarHBondContact OG-CA 3.41Å; S69-E71 PolarHBondContact OG-N 2.86Å; S69-E71 PolarHBondContact OG-O 2.82Å
72	S	95.4	Very high	95.4	Very high	30 Å²	30	35.1 Å²	35.1	21%	0.21	21%	0.208	C	C	.	.	P	Polyproline II helix	trans	-98.6	144.2	174.7	-54.9	0	0	0	0	109.6	V64 Q74	V64-S72 CarbonylContact O-C 3.55Å; V64-S72 WeakPolarHBondContact O-CA 3.33Å; S72-Q74 PolarHBondContact O-N 3.39Å
73	L	96.4	Very high	95	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	123.7	171.6	-178.7	63	0	0	0	109.4	V30 A33 L34 V46 V64 L98 V108 L110	V30-L73 HydrophobicContact CG1-CB 4.06Å; V30-L73 HydrophobicContact CG2-CB 4.28Å; A33-L73 HydrophobicContact CB-CD1 4.44Å; A33-L73 HydrophobicContact CB-CD2 4.11Å; L34-L73 HydrophobicContact CD2-CD1 4.24Å; V46-L73 HydrophobicContact CB-CD2 4.37Å; V46-L73 HydrophobicContact CG1-CD2 4.24Å; V46-L73 HydrophobicContact CG2-CD2 3.79Å; V64-L73 PolarHBondContact N-O 3.06Å; V64-L73 PolarHBondContact O-N 2.87Å; L73-L98 HydrophobicContact CD1-CD1 4.26Å; L73-V108 HydrophobicContact CD1-CG2 3.95Å; L73-L110 HydrophobicContact CD2-CB 4.04Å; L73-L110 HydrophobicContact CD2-CD2 4.21Å; L73-L110 HydrophobicContact CG-CB 4.39Å
74	Q	96.6	Very high	94.7	Very high	16 Å²	16	45.9 Å²	45.9	8%	0.075	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	129.8	168.2	-179.2	169.9	-85.5	0	0	109.6	S72 V76 Q106 E109 L110	S72-Q74 PolarHBondContact O-N 3.39Å; Q74-V76 HydrophobicContact CG-CG2 4.23Å; Q74-Q106 VanDerWaalsContact CB-OE1 3.25Å; Q74-E109 HydrophobicContact CB-CB 4.37Å; Q74-E109 HydrophobicContact CG-CB 4.47Å; Q74-E109 PolarHBondContact NE2-OE2 3.47Å; Q74-E109 WeakPolarHBondContact O-CA 3.44Å; Q74-L110 PolarHBondContact O-N 3.1Å
75	V	96.8	Very high	94.4	Very high	1 Å²	1	50.6 Å²	50.6	1%	0.006	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	130	172.8	-176.2	0	0	0	0	108.5	F61 L62 V64 I94 L110 A112	F61-V75 WeakPolarHBondContact CA-O 3.25Å; L62-V75 HydrophobicContact CB-CB 4.14Å; L62-V75 PolarHBondContact N-O 3.05Å; L62-V75 PolarHBondContact O-N 3.02Å; V64-V75 HydrophobicContact CB-CG2 4.48Å; V64-V75 HydrophobicContact CG2-CG2 4.02Å; V75-I94 HydrophobicContact CB-CD1 4.42Å; V75-I94 HydrophobicContact CG1-CD1 4.08Å; V75-I94 HydrophobicContact CG1-CG2 3.94Å; V75-I94 HydrophobicContact CG2-CD1 3.92Å; V75-L110 CarbonylContact C-O 3.51Å; V75-L110 WeakPolarHBondContact CA-O 3.37Å; V75-L110 HydrophobicContact CG2-CB 4.28Å; V75-L110 HydrophobicContact CG2-CD2 4.34Å; V75-A112 HydrophobicContact CG1-CB 3.6Å
76	V	96.1	Very high	94.3	Very high	24 Å²	24	50.5 Å²	50.5	15%	0.145	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	123.8	176.4	-175	0	0	0	0	108.2	V59 F61 Q74 E109 L110 K111 A112	V59-V76 HydrophobicContact CG1-CG1 3.56Å; F61-V76 HydrophobicContact CD1-CG2 4.04Å; F61-V76 HydrophobicContact CE1-CG1 4.34Å; F61-V76 HydrophobicContact CE1-CG2 4.02Å; Q74-V76 HydrophobicContact CG-CG2 4.23Å; V76-E109 HydrophobicContact CG2-CB 4.42Å; V76-E109 HydrophobicContact CG2-CG 4.36Å; V76-E109 WeakPolarHBondContact CG2-OE2 3.3Å; V76-L110 PolarHBondContact N-O 2.88Å; V76-K111 CarbonylContact O-C 3.53Å; V76-K111 WeakPolarHBondContact O-CA 3.46Å; V76-A112 PolarHBondContact O-N 2.83Å
77	A	96.4	Very high	94.2	Very high	7 Å²	7	50.5 Å²	50.5	6%	0.058	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	158.3	-177.3	0	0	0	0	0	110.7	L60 L81 A112 I115	L60-A77 HydrophobicContact CB-CB 4.15Å; L60-A77 HydrophobicContact CD2-CB 4.24Å; L60-A77 HydrophobicContact CG-CB 4.47Å; L60-A77 PolarHBondContact N-O 2.9Å; L60-A77 PolarHBondContact O-N 3.48Å; A77-L81 HydrophobicContact CB-CB 4.41Å; A77-L81 HydrophobicContact CB-CD1 4.16Å; A77-A112 HydrophobicContact CB-CB 3.95Å; A77-I115 HydrophobicContact CB-CD1 3.91Å
78	D	95.2	Very high	94.1	Very high	84 Å²	84	50 Å²	50	45%	0.449	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.2	143.9	166.2	-173	-82	0	0	0	109.8	S80 L81	D78-S80 PolarHBondContact O-N 2.9Å; D78-S80 WeakPolarHBondContact OD1-CB 3.46Å; D78-S80 PolarHBondContact OD1-N 2.79Å; D78-S80 PolarHBondContact OD1-OG 3.33Å; D78-L81 WeakPolarHBondContact O-CB 3.28Å; D78-L81 PolarHBondContact O-N 2.79Å
79	S	92.3	Very high	94	Very high	41 Å²	41	49.3 Å²	49.3	29%	0.287	26%	0.261	S	S	.	.	G	3₁₀ helix	trans	-57.6	-19.5	178.1	53.4	0	0	0	0	114.5	K58 L81 D82	K58-S79 WeakPolarHBondContact CA-OG 3.2Å; K58-S79 PolarHBondContact O-N 2.83Å; K58-S79 PolarHBondContact O-OG 2.92Å; S79-L81 PolarHBondContact O-N 3.14Å; S79-D82 WeakPolarHBondContact O-CB 3.36Å; S79-D82 PolarHBondContact O-N 2.94Å
80	S	93.1	Very high	94	Very high	94 Å²	94	48.8 Å²	48.8	66%	0.657	26%	0.257	S	S	*	.	G	3₁₀ helix	trans	-64.8	-20.2	172.3	56.4	0	0	0	0	113.8	D78 D82	D78-S80 PolarHBondContact O-N 2.9Å; D78-S80 WeakPolarHBondContact OD1-CB 3.46Å; D78-S80 PolarHBondContact OD1-N 2.79Å; D78-S80 PolarHBondContact OD1-OG 3.33Å; S80-D82 VanDerWaalsContact C-N 3.34Å
81	L	92.4	Very high	94.2	Very high	56 Å²	56	48.6 Å²	48.6	29%	0.293	26%	0.258	S	S	.	.	G	3₁₀ helix	trans	-88.7	-1.1	172.9	-61.8	178.1	0	0	0	112.8	A77 D78 S79 I115	A77-L81 HydrophobicContact CB-CB 4.41Å; A77-L81 HydrophobicContact CB-CD1 4.16Å; D78-L81 WeakPolarHBondContact O-CB 3.28Å; D78-L81 PolarHBondContact O-N 2.79Å; S79-L81 PolarHBondContact O-N 3.14Å; L81-I115 HydrophobicContact CB-CD1 4.19Å; L81-I115 HydrophobicContact CD1-CG1 4.5Å
82	D	90.8	Very high	94.3	Very high	63 Å²	63	44.1 Å²	44.1	34%	0.337	24%	0.237	S	C	.	.			trans	-70.3	142.7	176.2	-159.4	-2.7	0	0	0	110.8	S55 L60 S79 S80	S55-D82 WeakPolarHBondContact CB-OD2 3.43Å; S55-D82 PolarHBondContact OG-OD2 2.88Å; L60-D82 HydrophobicContact CD1-CB 4.47Å; L60-D82 HydrophobicContact CD2-CB 4.04Å; S79-D82 WeakPolarHBondContact O-CB 3.36Å; S79-D82 PolarHBondContact O-N 2.94Å; S80-D82 VanDerWaalsContact C-N 3.34Å
83	S	89.6	Confident	94.5	Very high	49 Å²	49	44.2 Å²	44.2	34%	0.343	24%	0.235	S	C	.	.			trans	-146.9	143.9	179.2	171.2	0	0	0	0	109.1	E85 L86	S83-E85 PolarHBondContact O-N 3.11Å; S83-E85 PolarHBondContact OG-N 2.82Å; S83-L86 WeakPolarHBondContact O-CB 3.38Å; S83-L86 PolarHBondContact O-N 3.49Å
84	R	88.6	Confident	94.6	Very high	245 Å²	245	44.3 Å²	44.3	93%	0.925	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61	-18.2	176.8	-65.3	-177.8	179.8	178.3	0.4	113.1	T87	R84-T87 WeakPolarHBondContact O-CG2 3.32Å
85	E	91.5	Very high	94.6	Very high	99 Å²	99	46.3 Å²	46.3	46%	0.463	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.2	-11	177.9	-62.6	-176.3	-173.8	0	0	113.1	S83 T87 S90 I117 N120	S83-E85 PolarHBondContact O-N 3.11Å; S83-E85 PolarHBondContact OG-N 2.82Å; E85-T87 VanDerWaalsContact C-N 3.28Å; E85-T87 PolarHBondContact O-N 2.82Å; E85-S90 PolarHBondContact O-OG 2.89Å; E85-I117 HydrophobicContact CB-CD1 3.46Å; E85-I117 VanDerWaalsContact CB-CD1 3.46Å; E85-N120 PolarHBondContact OE2-ND2 2.91Å; E85-N120 VanDerWaalsContact OE2-ND2 3.11Å; E85-N120 PolarHBondContact OE2-OD1 2.86Å
86	L	94.9	Very high	94.6	Very high	10 Å²	10	46.3 Å²	46.3	5%	0.052	24%	0.244	C	C	.	.			trans	-75.6	85.5	169.3	-63.5	174	0	0	0	108.8	I50 V53 L60 S83 V92 I115 I117	I50-L86 HydrophobicContact CD1-CB 4.1Å; I50-L86 HydrophobicContact CD1-CD2 3.71Å; V53-L86 WeakPolarHBondContact CG2-O 3.44Å; L60-L86 HydrophobicContact CD2-CD1 3.95Å; S83-L86 WeakPolarHBondContact O-CB 3.38Å; S83-L86 PolarHBondContact O-N 3.49Å; L86-V92 HydrophobicContact CD2-CG1 3.98Å; L86-I115 HydrophobicContact CD2-CG2 3.9Å; L86-I117 HydrophobicContact CD2-CD1 3.78Å; L86-I117 HydrophobicContact CD2-CG1 3.67Å; L86-I117 HydrophobicContact CG-CD1 4.06Å; L86-I117 HydrophobicContact CG-CG1 4.47Å
87	T	94.6	Very high	94.5	Very high	39 Å²	39	48.3 Å²	48.3	24%	0.239	25%	0.252	C	S	.	.			trans	-118.6	164.6	179.5	60.2	0	0	0	0	110.7	I50 R84 E85 G89 S90 C121	I50-T87 WeakPolarHBondContact CB-O 3.4Å; I50-T87 WeakPolarHBondContact CG2-O 3.49Å; R84-T87 WeakPolarHBondContact O-CG2 3.32Å; E85-T87 VanDerWaalsContact C-N 3.28Å; E85-T87 PolarHBondContact O-N 2.82Å; T87-G89 PolarHBondContact O-N 2.88Å; T87-S90 WeakPolarHBondContact O-CB 3.48Å; T87-S90 PolarHBondContact O-N 3.08Å; T87-S90 VanDerWaalsContact O-N 3.08Å; T87-S90 PolarHBondContact OG1-OG 2.54Å; T87-S90 VanDerWaalsContact OG1-OG 3.08Å; T87-C121 PolarHBondContact OG1-O 2.77Å
88	F	93.8	Very high	94.4	Very high	29 Å²	29	48.2 Å²	48.2	13%	0.127	25%	0.251	C	S	.	.	T	Hydrogen-bonded Turn	trans	-53.7	130.6	171.4	174.7	-99.4	0	0	0	110.4	R51 S90 C121 F126 Y130	R51-F88 VanDerWaalsContact O-CD2 3.27Å; R51-F88 WeakPolarHBondContact O-CD2 3.23Å; F88-S90 VanDerWaalsContact C-N 3.3Å; F88-S90 PolarHBondContact O-N 2.84Å; F88-C121 PolarHBondContact O-SG 3.4Å; F88-C121 VanDerWaalsContact O-SG 3.39Å; F88-F126 HydrophobicContact CD1-CD1 4.23Å; F88-F126 AromaticContact CE1-CD1 3.76Å; F88-F126 HydrophobicContact CE1-CD1 3.76Å; F88-F126 AromaticContact CE1-CE1 3.77Å; F88-F126 HydrophobicContact CE1-CE1 3.77Å; F88-Y130 HydrophobicContact CB-CD1 3.8Å; F88-Y130 HydrophobicContact CB-CE1 4.11Å; F88-Y130 HydrophobicContact CD1-CD1 4.16Å; F88-Y130 AromaticContact CD2-CD1 3.89Å; F88-Y130 HydrophobicContact CD2-CD1 3.89Å; F88-Y130 AromaticContact CD2-CG 3.78Å; F88-Y130 HydrophobicContact CD2-CG 3.78Å; F88-Y130 HydrophobicContact CE2-CG 4.12Å; F88-Y130 AromaticContact CG-CD1 3.66Å; F88-Y130 HydrophobicContact CG-CD1 3.66Å; F88-Y130 HydrophobicContact CG-CE1 4.46Å; F88-Y130 HydrophobicContact CG-CG 4.05Å
89	G	94	Very high	94.4	Very high	13 Å²	13	45.5 Å²	45.5	13%	0.134	24%	0.236	C	C	.	.	T	Hydrogen-bonded Turn	trans	83.5	-6	-179.6	0	0	0	0	0	115.1	I50 T87	I50-G89 PolarHBondContact O-N 3.3Å; T87-G89 PolarHBondContact O-N 2.88Å
90	S	96.4	Very high	94.4	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	26%	0.256	C	S	.	.			trans	-63.7	138.5	170	-74.2	0	0	0	0	110	W49 I50 E85 T87 F88 G119 C121	W49-S90 WeakPolarHBondContact CA-O 3.32Å; I50-S90 PolarHBondContact N-O 3.36Å; E85-S90 PolarHBondContact O-OG 2.89Å; T87-S90 WeakPolarHBondContact O-CB 3.48Å; T87-S90 PolarHBondContact O-N 3.08Å; T87-S90 VanDerWaalsContact O-N 3.08Å; T87-S90 PolarHBondContact OG1-OG 2.54Å; T87-S90 VanDerWaalsContact OG1-OG 3.08Å; F88-S90 VanDerWaalsContact C-N 3.3Å; F88-S90 PolarHBondContact O-N 2.84Å; S90-G119 WeakPolarHBondContact CA-O 3.4Å; S90-C121 PolarHBondContact OG-N 2.87Å
91	S	97.9	Very high	94.2	Very high	25 Å²	25	47.3 Å²	47.3	18%	0.175	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	134.7	174.5	58.9	0	0	0	0	110.1	G48 V118 G119	G48-S91 CarbonylContact O-C 3.51Å; G48-S91 WeakPolarHBondContact O-CA 3.44Å; S91-V118 PolarHBondContact O-N 3.08Å; S91-G119 PolarHBondContact N-O 2.72Å; S91-G119 PolarHBondContact O-N 2.95Å; S91-G119 WeakPolarHBondContact OG-CA 3.31Å; S91-G119 PolarHBondContact OG-N 3.44Å; S91-G119 PolarHBondContact OG-O 3.29Å
92	V	98.4	Very high	93.8	Very high	2 Å²	2	49.9 Å²	49.9	1%	0.012	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	150.1	-171.2	-66.9	0	0	0	0	111.5	Q47 G48 I50 V64 L86 I94 K116	Q47-V92 VanDerWaalsContact CA-O 3.3Å; Q47-V92 WeakPolarHBondContact CA-O 3.42Å; G48-V92 PolarHBondContact N-O 3.06Å; G48-V92 VanDerWaalsContact N-O 3.11Å; G48-V92 PolarHBondContact O-N 3.47Å; I50-V92 HydrophobicContact CD1-CG1 3.62Å; I50-V92 HydrophobicContact CG1-CG1 3.9Å; I50-V92 HydrophobicContact CG1-CG2 4.05Å; V64-V92 HydrophobicContact CG1-CG2 4.13Å; V64-V92 HydrophobicContact CG2-CG2 4Å; L86-V92 HydrophobicContact CD2-CG1 3.98Å; V92-I94 HydrophobicContact CB-CD1 4.47Å; V92-I94 HydrophobicContact CB-CG1 4.24Å; V92-I94 HydrophobicContact CG2-CD1 3.91Å; V92-I94 HydrophobicContact CG2-CG1 4.07Å; V92-K116 CarbonylContact C-O 3.53Å; V92-K116 WeakPolarHBondContact CA-O 3.46Å
93	E	98.3	Very high	93.3	Very high	32 Å²	32	49.6 Å²	49.6	15%	0.15	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	125.9	162.2	176.3	-178.8	113.6	0	0	108.1	K45 Q47 Q95 K116 V118	K45-E93 HydrophobicContact CD-CG 3.86Å; K45-E93 HydrophobicContact CG-CG 3.88Å; Q47-E93 HydrophobicContact CG-CB 3.96Å; Q47-E93 HydrophobicContact CG-CG 3.91Å; Q47-E93 PolarHBondContact NE2-OE2 2.97Å; E93-Q95 PolarHBondContact OE1-NE2 3.07Å; E93-Q95 VanDerWaalsContact OE1-NE2 3.09Å; E93-K116 HydrophobicContact CB-CB 4.35Å; E93-K116 PolarHBondContact N-O 2.9Å; E93-K116 PolarHBondContact O-N 3.08Å; E93-V118 HydrophobicContact CB-CG2 4.11Å
94	I	98	Very high	92.8	Very high	1 Å²	1	57.5 Å²	57.5	1%	0.005	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	129	-176.3	-55.7	-178.6	0	0	0	108.8	K45 V46 L62 V64 V75 V92 L110 A112 K114 I115	K45-I94 CarbonylContact C-O 3.58Å; K45-I94 WeakPolarHBondContact CA-O 3.28Å; V46-I94 PolarHBondContact N-O 2.98Å; V46-I94 PolarHBondContact O-N 2.99Å; L62-I94 HydrophobicContact CD1-CD1 4.14Å; V64-I94 HydrophobicContact CG2-CD1 3.74Å; V75-I94 HydrophobicContact CB-CD1 4.42Å; V75-I94 HydrophobicContact CG1-CD1 4.08Å; V75-I94 HydrophobicContact CG1-CG2 3.94Å; V75-I94 HydrophobicContact CG2-CD1 3.92Å; V92-I94 HydrophobicContact CB-CD1 4.47Å; V92-I94 HydrophobicContact CB-CG1 4.24Å; V92-I94 HydrophobicContact CG2-CD1 3.91Å; V92-I94 HydrophobicContact CG2-CG1 4.07Å; I94-L110 HydrophobicContact CB-CD2 4.23Å; I94-L110 HydrophobicContact CG2-CD2 3.69Å; I94-L110 HydrophobicContact CG2-CG 4.47Å; I94-A112 HydrophobicContact CG2-CB 3.64Å; I94-K114 WeakPolarHBondContact CA-O 3.46Å; I94-I115 HydrophobicContact CD1-CG1 4.48Å; I94-I115 HydrophobicContact CG1-CG1 4.24Å; I94-I115 HydrophobicContact CG1-CG2 4.25Å; I94-I115 HydrophobicContact CG2-CG1 4.23Å
95	Q	97.7	Very high	92.2	Very high	58 Å²	58	49.9 Å²	49.9	27%	0.271	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	136.8	175.1	-58.3	179.4	11.2	0	0	108.9	I44 K45 E93 E113 K114	I44-Q95 WeakPolarHBondContact O-CA 3.34Å; K45-Q95 HydrophobicContact CB-CG 4.21Å; K45-Q95 HydrophobicContact CD-CG 4.32Å; K45-Q95 HydrophobicContact CG-CG 4.02Å; E93-Q95 PolarHBondContact OE1-NE2 3.07Å; E93-Q95 VanDerWaalsContact OE1-NE2 3.09Å; Q95-E113 PolarHBondContact O-N 3.41Å; Q95-K114 HydrophobicContact CB-CB 4.38Å; Q95-K114 PolarHBondContact N-O 2.86Å; Q95-K114 PolarHBondContact O-N 3.48Å; Q95-K114 VanDerWaalsContact O-N 3.09Å
96	G	95.9	Very high	91.7	Very high	1 Å²	1	47.2 Å²	47.2	1%	0.01	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	173.2	-171.3	-177.5	0	0	0	0	0	113.3	H43 I44 L110 K111	H43-G96 CarbonylContact C-O 3.54Å; H43-G96 WeakPolarHBondContact CA-O 3.39Å; I44-G96 PolarHBondContact N-O 3.37Å; I44-G96 PolarHBondContact O-N 2.93Å; G96-L110 VanDerWaalsContact C-CD1 3.48Å; G96-K111 CarbonylContact C-O 3.53Å; G96-K111 WeakPolarHBondContact CA-O 3.33Å
97	Q	95.3	Very high	91.3	Very high	66 Å²	66	52.8 Å²	52.8	31%	0.308	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	122.1	-176.6	-67.2	175.1	33.3	0	0	111.1	E42 H43 I99 K111 E113	E42-Q97 WeakPolarHBondContact O-CA 3.37Å; H43-Q97 WeakPolarHBondContact CE1-CG 3.39Å; H43-Q97 PolarHBondContact CE1-NE2 2.84Å; H43-Q97 VanDerWaalsContact CE1-NE2 3.32Å; H43-Q97 PolarHBondContact NE2-NE2 3.21Å; Q97-I99 HydrophobicContact CB-CG2 4.31Å; Q97-I99 PolarHBondContact O-N 3.42Å; Q97-K111 PolarHBondContact N-O 2.86Å; Q97-K111 PolarHBondContact O-N 2.86Å; Q97-E113 PolarHBondContact NE2-OE1 2.92Å
98	L	94.6	Very high	91.3	Very high	5 Å²	5	51.1 Å²	51.1	3%	0.026	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	118.2	171.6	-170.7	69.8	0	0	0	109.4	A33 A36 T39 G41 E42 I44 L73 V108	A33-L98 HydrophobicContact CB-CD1 4.42Å; A33-L98 HydrophobicContact CB-CD2 4.38Å; A36-L98 HydrophobicContact CB-CD2 3.71Å; T39-L98 HydrophobicContact CG2-CD2 4.44Å; T39-L98 HydrophobicContact CG2-CG 4.36Å; G41-L98 WeakPolarHBondContact CA-O 3.21Å; G41-L98 PolarHBondContact N-O 2.84Å; E42-L98 PolarHBondContact O-N 2.63Å; I44-L98 HydrophobicContact CD1-CB 3.85Å; I44-L98 HydrophobicContact CD1-CD1 4.08Å; I44-L98 HydrophobicContact CD1-CD2 4.15Å; I44-L98 HydrophobicContact CD1-CG 4.25Å; I44-L98 HydrophobicContact CG1-CB 4.12Å; L73-L98 HydrophobicContact CD1-CD1 4.26Å; L98-V108 HydrophobicContact CD1-CB 4.03Å; L98-V108 HydrophobicContact CD1-CG2 3.98Å; L98-V108 HydrophobicContact CG-CB 4.47Å
99	I	94	Very high	91.3	Very high	28 Å²	28	50.3 Å²	50.3	14%	0.144	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	161.4	-176.7	60.8	153.6	0	0	0	110.9	Q97 S101 V108 E109 K111	Q97-I99 HydrophobicContact CB-CG2 4.31Å; Q97-I99 PolarHBondContact O-N 3.42Å; I99-S101 PolarHBondContact O-N 2.94Å; I99-V108 CarbonylContact O-C 3.6Å; I99-V108 VanDerWaalsContact O-CA 3.24Å; I99-V108 WeakPolarHBondContact O-CA 3.5Å; I99-E109 HydrophobicContact CD1-CG 4.01Å; I99-E109 HydrophobicContact CG1-CG 3.81Å; I99-E109 WeakPolarHBondContact CG1-O 3.38Å; I99-E109 PolarHBondContact N-O 2.86Å; I99-E109 PolarHBondContact O-N 3.35Å; I99-K111 HydrophobicContact CD1-CD 3.58Å; I99-K111 HydrophobicContact CD1-CG 3.84Å; I99-K111 HydrophobicContact CG1-CD 4.25Å; I99-K111 HydrophobicContact CG1-CG 4.16Å
100	K	92.4	Very high	91.4	Very high	160 Å²	160	49.7 Å²	49.7	70%	0.696	28%	0.275	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-62.3	130.3	167.7	-169.1	171.4	-175.1	172.8	0	109.7
101	S	88.9	Confident	91.4	Very high	13 Å²	13	54.7 Å²	54.7	9%	0.091	30%	0.296	C	S	.	.			trans	-70.3	137.8	178.4	150.9	0	0	0	0	110.9	I99 S103 Q106 N107	I99-S101 PolarHBondContact O-N 2.94Å; S101-S103 VanDerWaalsContact C-N 3.3Å; S101-S103 PolarHBondContact OG-N 3.11Å; S101-S103 PolarHBondContact OG-O 3.26Å; S101-Q106 VanDerWaalsContact CB-O 3.3Å; S101-Q106 WeakPolarHBondContact CB-O 3.35Å; S101-Q106 VanDerWaalsContact OG-CG 3.25Å; S101-Q106 WeakPolarHBondContact OG-CG 3.14Å; S101-Q106 PolarHBondContact OG-NE2 3.3Å; S101-Q106 PolarHBondContact OG-O 2.89Å; S101-N107 PolarHBondContact N-O 3.32Å; S101-N107 VanDerWaalsContact N-O 3.08Å
102	P	84.7	Confident	91.4	Very high	109 Å²	109	54.1 Å²	54.1	71%	0.708	29%	0.293	S	S	*	.	S	Bend	trans	-78	-14.6	170.8	32.6	-34	0	0	0	113.1	E109	P102-E109 VanDerWaalsContact CD-OE1 3.28Å; P102-E109 WeakPolarHBondContact CD-OE1 3.38Å
103	S	80.5	Confident	91.3	Very high	58 Å²	58	58.7 Å²	58.7	41%	0.406	31%	0.314	S	S	.	.	S	Bend	trans	-89.3	142.8	-176.2	-52.6	0	0	0	0	112	S101	S101-S103 VanDerWaalsContact C-N 3.3Å; S101-S103 PolarHBondContact OG-N 3.11Å; S101-S103 PolarHBondContact OG-O 3.26Å
104	K	77.9	Confident	91.2	Very high	215 Å²	215	62.7 Å²	62.7	94%	0.935	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.7	137.9	173	-67.9	-175.5	177.9	-177.3	0	110.4
105	G	75.4	Confident	91.2	Very high	84 Å²	84	64 Å²	64	87%	0.866	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	92.7	6.2	174.8	0	0	0	0	0	115.6
106	Q	81.9	Confident	91.2	Very high	43 Å²	43	66.8 Å²	66.8	20%	0.201	35%	0.349	C	S	.	.			trans	-144.5	132.5	172.5	40.2	167.8	39.5	0	0	109.2	Q74 S101	Q74-Q106 VanDerWaalsContact CB-OE1 3.25Å; S101-Q106 VanDerWaalsContact CB-O 3.3Å; S101-Q106 WeakPolarHBondContact CB-O 3.35Å; S101-Q106 VanDerWaalsContact OG-CG 3.25Å; S101-Q106 WeakPolarHBondContact OG-CG 3.14Å; S101-Q106 PolarHBondContact OG-NE2 3.3Å; S101-Q106 PolarHBondContact OG-O 2.89Å
107	N	86.6	Confident	91.3	Very high	127 Å²	127	68.8 Å²	68.8	68%	0.679	36%	0.359	S	S	*	.	S	Bend	trans	-76.2	-37.6	-175.5	-67.1	-29.1	0	0	0	111.8	S101	S101-N107 PolarHBondContact N-O 3.32Å; S101-N107 VanDerWaalsContact N-O 3.08Å
108	V	93.8	Very high	91.4	Very high	5 Å²	5	70 Å²	70	3%	0.03	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	158.3	-172.1	-53.9	0	0	0	0	111.2	A33 L34 T39 L73 L98 I99	A33-V108 WeakPolarHBondContact O-CG2 3.23Å; L34-V108 HydrophobicContact CD2-CG2 4.15Å; T39-V108 HydrophobicContact CG2-CB 4.44Å; T39-V108 HydrophobicContact CG2-CG1 3.57Å; L73-V108 HydrophobicContact CD1-CG2 3.95Å; L98-V108 HydrophobicContact CD1-CB 4.03Å; L98-V108 HydrophobicContact CD1-CG2 3.98Å; L98-V108 HydrophobicContact CG-CB 4.47Å; I99-V108 CarbonylContact O-C 3.6Å; I99-V108 VanDerWaalsContact O-CA 3.24Å; I99-V108 WeakPolarHBondContact O-CA 3.5Å
109	E	95	Very high	91.5	Very high	12 Å²	12	71 Å²	71	6%	0.056	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	152	166	65.1	-176.4	-162.6	0	0	110.3	Q74 V76 I99 P102	Q74-E109 HydrophobicContact CB-CB 4.37Å; Q74-E109 HydrophobicContact CG-CB 4.47Å; Q74-E109 PolarHBondContact NE2-OE2 3.47Å; Q74-E109 WeakPolarHBondContact O-CA 3.44Å; V76-E109 HydrophobicContact CG2-CB 4.42Å; V76-E109 HydrophobicContact CG2-CG 4.36Å; V76-E109 WeakPolarHBondContact CG2-OE2 3.3Å; I99-E109 HydrophobicContact CD1-CG 4.01Å; I99-E109 HydrophobicContact CG1-CG 3.81Å; I99-E109 WeakPolarHBondContact CG1-O 3.38Å; I99-E109 PolarHBondContact N-O 2.86Å; I99-E109 PolarHBondContact O-N 3.35Å; P102-E109 VanDerWaalsContact CD-OE1 3.28Å; P102-E109 WeakPolarHBondContact CD-OE1 3.38Å
110	L	95.8	Very high	91.6	Very high	0 Å²	0	74.6 Å²	74.6	0%	0	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	112.5	176.3	-178.4	62.3	0	0	0	109.7	I44 V46 L73 Q74 V75 V76 I94 G96 A112	I44-L110 HydrophobicContact CD1-CD1 4.04Å; I44-L110 HydrophobicContact CG1-CD1 3.65Å; V46-L110 HydrophobicContact CB-CD2 4.35Å; V46-L110 HydrophobicContact CG2-CD2 4.21Å; L73-L110 HydrophobicContact CD2-CB 4.04Å; L73-L110 HydrophobicContact CD2-CD2 4.21Å; L73-L110 HydrophobicContact CG-CB 4.39Å; Q74-L110 PolarHBondContact O-N 3.1Å; V75-L110 CarbonylContact C-O 3.51Å; V75-L110 WeakPolarHBondContact CA-O 3.37Å; V75-L110 HydrophobicContact CG2-CB 4.28Å; V75-L110 HydrophobicContact CG2-CD2 4.34Å; V76-L110 PolarHBondContact N-O 2.88Å; I94-L110 HydrophobicContact CB-CD2 4.23Å; I94-L110 HydrophobicContact CG2-CD2 3.69Å; I94-L110 HydrophobicContact CG2-CG 4.47Å; G96-L110 VanDerWaalsContact C-CD1 3.48Å; L110-A112 PolarHBondContact O-N 3.02Å
111	K	96.3	Very high	91.7	Very high	104 Å²	104	68.2 Å²	68.2	45%	0.452	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	100.8	169.2	-79.1	-177.2	169.8	167.1	0	109.3	V76 G96 Q97 I99	V76-K111 CarbonylContact O-C 3.53Å; V76-K111 WeakPolarHBondContact O-CA 3.46Å; G96-K111 CarbonylContact C-O 3.53Å; G96-K111 WeakPolarHBondContact CA-O 3.33Å; Q97-K111 PolarHBondContact N-O 2.86Å; Q97-K111 PolarHBondContact O-N 2.86Å; I99-K111 HydrophobicContact CD1-CD 3.58Å; I99-K111 HydrophobicContact CD1-CG 3.84Å; I99-K111 HydrophobicContact CG1-CD 4.25Å; I99-K111 HydrophobicContact CG1-CG 4.16Å
112	A	97.2	Very high	91.9	Very high	13 Å²	13	72.6 Å²	72.6	11%	0.107	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.6	129.8	-175.8	0	0	0	0	0	111.8	V75 V76 A77 I94 L110 I115	V75-A112 HydrophobicContact CG1-CB 3.6Å; V76-A112 PolarHBondContact O-N 2.83Å; A77-A112 HydrophobicContact CB-CB 3.95Å; I94-A112 HydrophobicContact CG2-CB 3.64Å; L110-A112 PolarHBondContact O-N 3.02Å; A112-I115 HydrophobicContact CB-CD1 4.23Å; A112-I115 HydrophobicContact CB-CG1 4.04Å
113	E	96.8	Very high	92.1	Very high	98 Å²	98	69 Å²	69	46%	0.458	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	-29.1	171.4	-63.9	172.3	174.5	0	0	110.4	H43 Q95 Q97	H43-E113 IonicContact CD2-OE1 3.68Å; H43-E113 IonicContact CD2-OE2 3.41Å; H43-E113 PolarHBondContact CD2-OE2 2.88Å; H43-E113 IonicContact NE2-OE1 3.17Å; H43-E113 PolarHBondContact NE2-OE1 2.8Å; H43-E113 IonicContact NE2-OE2 3.59Å; Q95-E113 PolarHBondContact O-N 3.41Å; Q97-E113 PolarHBondContact NE2-OE1 2.92Å
114	K	96.9	Very high	92.4	Very high	117 Å²	117	75.2 Å²	75.2	51%	0.509	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.8	131.6	178.8	-173.5	176.8	-177.6	176	0	110.9	I94 Q95	I94-K114 WeakPolarHBondContact CA-O 3.46Å; Q95-K114 HydrophobicContact CB-CB 4.38Å; Q95-K114 PolarHBondContact N-O 2.86Å; Q95-K114 PolarHBondContact O-N 3.48Å; Q95-K114 VanDerWaalsContact O-N 3.09Å
115	I	97.8	Very high	93.1	Very high	28 Å²	28	68.3 Å²	68.3	14%	0.144	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	121.1	172	-58.6	174.9	0	0	0	107.5	L60 L62 A77 L81 L86 I94 A112	L60-I115 HydrophobicContact CD2-CD1 4.32Å; L62-I115 HydrophobicContact CD1-CD1 3.76Å; A77-I115 HydrophobicContact CB-CD1 3.91Å; L81-I115 HydrophobicContact CB-CD1 4.19Å; L81-I115 HydrophobicContact CD1-CG1 4.5Å; L86-I115 HydrophobicContact CD2-CG2 3.9Å; I94-I115 HydrophobicContact CD1-CG1 4.48Å; I94-I115 HydrophobicContact CG1-CG1 4.24Å; I94-I115 HydrophobicContact CG1-CG2 4.25Å; I94-I115 HydrophobicContact CG2-CG1 4.23Å; A112-I115 HydrophobicContact CB-CD1 4.23Å; A112-I115 HydrophobicContact CB-CG1 4.04Å
116	K	97.6	Very high	93.9	Very high	116 Å²	116	65.1 Å²	65.1	50%	0.504	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	122.3	172.9	177.7	-176.4	176.2	-173.8	0	108.6	V92 E93 V118	V92-K116 CarbonylContact C-O 3.53Å; V92-K116 WeakPolarHBondContact CA-O 3.46Å; E93-K116 HydrophobicContact CB-CB 4.35Å; E93-K116 PolarHBondContact N-O 2.9Å; E93-K116 PolarHBondContact O-N 3.08Å; K116-V118 PolarHBondContact O-N 3.3Å
117	I	97.6	Very high	94.3	Very high	43 Å²	43	64.3 Å²	64.3	22%	0.221	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	124.8	170	-54	175	0	0	0	108	E85 L86 N120	E85-I117 HydrophobicContact CB-CD1 3.46Å; E85-I117 VanDerWaalsContact CB-CD1 3.46Å; L86-I117 HydrophobicContact CD2-CD1 3.78Å; L86-I117 HydrophobicContact CD2-CG1 3.67Å; L86-I117 HydrophobicContact CG-CD1 4.06Å; L86-I117 HydrophobicContact CG-CG1 4.47Å; I117-N120 WeakPolarHBondContact CG2-OD1 3.49Å
118	V	97.8	Very high	94.5	Very high	92 Å²	92	58.8 Å²	58.8	56%	0.558	31%	0.313	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.7	-36.2	-179.9	178.1	0	0	0	0	110.3	S91 E93 K116	S91-V118 PolarHBondContact O-N 3.08Å; E93-V118 HydrophobicContact CB-CG2 4.11Å; K116-V118 PolarHBondContact O-N 3.3Å
119	G	96.9	Very high	94.1	Very high	27 Å²	27	61.4 Å²	61.4	28%	0.278	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.6	131.6	179.7	0	0	0	0	0	111	S90 S91	S90-G119 WeakPolarHBondContact CA-O 3.4Å; S91-G119 PolarHBondContact N-O 2.72Å; S91-G119 PolarHBondContact O-N 2.95Å; S91-G119 WeakPolarHBondContact OG-CA 3.31Å; S91-G119 PolarHBondContact OG-N 3.44Å; S91-G119 PolarHBondContact OG-O 3.29Å
120	N	95.7	Very high	93.3	Very high	102 Å²	102	66.3 Å²	66.3	55%	0.545	34%	0.343	S	S	.	.			trans	-76.4	152.1	-176.2	-67.2	-11.6	0	0	0	111.3	E85 I117	E85-N120 PolarHBondContact OE2-ND2 2.91Å; E85-N120 VanDerWaalsContact OE2-ND2 3.11Å; E85-N120 PolarHBondContact OE2-OD1 2.86Å; I117-N120 WeakPolarHBondContact CG2-OD1 3.49Å
121	C	93.9	Very high	92.5	Very high	27 Å²	27	74.3 Å²	74.3	18%	0.182	38%	0.378	C	S	.	.			trans	-124.6	125.9	172.2	-172.4	0	0	0	0	111.3	T87 F88 S90 A123	T87-C121 PolarHBondContact OG1-O 2.77Å; F88-C121 PolarHBondContact O-SG 3.4Å; F88-C121 VanDerWaalsContact O-SG 3.39Å; S90-C121 PolarHBondContact OG-N 2.87Å; C121-A123 VanDerWaalsContact C-N 3.29Å; C121-A123 PolarHBondContact O-N 2.77Å
122	D	93.3	Very high	92	Very high	105 Å²	105	75 Å²	75	56%	0.561	38%	0.383	S	S	*	.			trans	-74.4	87	164.6	-174.3	-9.9	0	0	0	109.6	K124 A125 F126	D122-K124 PolarHBondContact O-N 3.13Å; D122-K124 VanDerWaalsContact O-N 3.16Å; D122-K124 WeakPolarHBondContact OD1-CA 3.48Å; D122-K124 WeakPolarHBondContact OD1-CB 3.35Å; D122-K124 PolarHBondContact OD1-N 2.94Å; D122-A125 HydrophobicContact CB-CB 4.09Å; D122-A125 PolarHBondContact O-N 3.4Å; D122-A125 PolarHBondContact OD1-N 2.81Å; D122-A125 WeakPolarHBondContact OD2-CB 3.46Å; D122-F126 WeakPolarHBondContact O-CB 3.41Å; D122-F126 PolarHBondContact O-N 2.95Å
123	A	89	Confident	91.4	Very high	33 Å²	33	84 Å²	84	27%	0.273	41%	0.414	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.2	-20	179.2	0	0	0	0	0	113.3	C121 K129	C121-A123 VanDerWaalsContact C-N 3.29Å; C121-A123 PolarHBondContact O-N 2.77Å; A123-K129 PolarHBondContact O-NZ 3.41Å
124	K	88.2	Confident	91.1	Very high	188 Å²	188	81.2 Å²	81.2	82%	0.817	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.7	-40.2	176	-67	-176.9	180	178.9	0	111.1	D122 K129	D122-K124 PolarHBondContact O-N 3.13Å; D122-K124 VanDerWaalsContact O-N 3.16Å; D122-K124 WeakPolarHBondContact OD1-CA 3.48Å; D122-K124 WeakPolarHBondContact OD1-CB 3.35Å; D122-K124 PolarHBondContact OD1-N 2.94Å; K124-K129 VanDerWaalsContact C-NZ 3.35Å; K124-K129 PolarHBondContact O-NZ 2.96Å
125	A	91.9	Very high	90.9	Very high	71 Å²	71	79.7 Å²	79.7	59%	0.587	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.6	-23	175.2	0	0	0	0	0	113.6	D122	D122-A125 HydrophobicContact CB-CB 4.09Å; D122-A125 PolarHBondContact O-N 3.4Å; D122-A125 PolarHBondContact OD1-N 2.81Å; D122-A125 WeakPolarHBondContact OD2-CB 3.46Å
126	F	91.3	Very high	90.6	Very high	17 Å²	17	80.1 Å²	80.1	8%	0.075	41%	0.405	C	S	.	.			trans	-61.6	123.8	-177.2	-163.9	-112.8	0	0	0	111.9	F88 D122 I128 K129 F145	F88-F126 HydrophobicContact CD1-CD1 4.23Å; F88-F126 AromaticContact CE1-CD1 3.76Å; F88-F126 HydrophobicContact CE1-CD1 3.76Å; F88-F126 AromaticContact CE1-CE1 3.77Å; F88-F126 HydrophobicContact CE1-CE1 3.77Å; D122-F126 WeakPolarHBondContact O-CB 3.41Å; D122-F126 PolarHBondContact O-N 2.95Å; F126-I128 VanDerWaalsContact C-N 3.34Å; F126-I128 HydrophobicContact CD1-CB 4.3Å; F126-I128 VanDerWaalsContact CD1-O 3.28Å; F126-I128 WeakPolarHBondContact CD1-O 3.36Å; F126-I128 HydrophobicContact CE1-CB 3.86Å; F126-I128 PolarHBondContact O-N 2.99Å; F126-K129 WeakPolarHBondContact O-CE 3.41Å; F126-K129 PolarHBondContact O-NZ 3.01Å; F126-F145 AromaticContact CE2-CD1 3.7Å; F126-F145 HydrophobicContact CE2-CD1 3.7Å; F126-F145 HydrophobicContact CE2-CD2 4.13Å; F126-F145 AromaticContact CE2-CE1 3.8Å; F126-F145 HydrophobicContact CE2-CE1 3.8Å; F126-F145 HydrophobicContact CE2-CE2 4.2Å; F126-F145 AromaticContact CE2-CG 3.88Å; F126-F145 HydrophobicContact CE2-CG 3.88Å; F126-F145 HydrophobicContact CE2-CZ 4.06Å; F126-F145 HydrophobicContact CZ-CB 4.31Å; F126-F145 HydrophobicContact CZ-CD1 4.1Å; F126-F145 HydrophobicContact CZ-CG 4.12Å
127	P	91.6	Very high	90.4	Very high	25 Å²	25	81.1 Å²	81.1	16%	0.162	41%	0.412	C	S	.	.	S	Bend	trans	-70.2	-29.7	-168.9	24.4	-33	0	0	0	113.1	K129 Y138 Y142 F145	P127-K129 PolarHBondContact O-N 2.88Å; P127-Y138 PolarHBondContact O-OH 2.98Å; P127-Y142 HydrophobicContact CB-CD1 3.88Å; P127-Y142 HydrophobicContact CB-CD2 4.32Å; P127-Y142 HydrophobicContact CB-CE1 3.53Å; P127-Y142 HydrophobicContact CB-CE2 4.03Å; P127-Y142 HydrophobicContact CB-CG 4.25Å; P127-Y142 HydrophobicContact CG-CD1 3.63Å; P127-Y142 HydrophobicContact CG-CE1 3.75Å; P127-Y142 HydrophobicContact CG-CG 4.09Å; P127-F145 HydrophobicContact CG-CD2 3.73Å; P127-F145 HydrophobicContact CG-CE2 4.11Å
128	I	90.4	Very high	90.2	Very high	11 Å²	11	82.1 Å²	82.1	6%	0.056	41%	0.413	C	S	.	.	S	Bend	trans	-93.9	96.6	-177.8	-55.3	176	0	0	0	109.6	F126 L139 F145 T149	F126-I128 VanDerWaalsContact C-N 3.34Å; F126-I128 HydrophobicContact CD1-CB 4.3Å; F126-I128 VanDerWaalsContact CD1-O 3.28Å; F126-I128 WeakPolarHBondContact CD1-O 3.36Å; F126-I128 HydrophobicContact CE1-CB 3.86Å; F126-I128 PolarHBondContact O-N 2.99Å; I128-L139 HydrophobicContact CD1-CD2 3.91Å; I128-L139 HydrophobicContact CG1-CD2 4.1Å; I128-L139 HydrophobicContact CG2-CD2 4.42Å; I128-F145 HydrophobicContact CD1-CB 3.71Å; I128-T149 HydrophobicContact CD1-CG2 4.1Å; I128-T149 HydrophobicContact CG2-CG2 3.79Å
129	K	86	Confident	90	Very high	61 Å²	61	78 Å²	78	27%	0.265	39%	0.388	S	S	.	.			trans	-75.1	124.9	178.3	-57.1	-51.6	-173.8	-161.7	0	111.7	A123 K124 F126 P127 K131 E132 H134	A123-K129 PolarHBondContact O-NZ 3.41Å; K124-K129 VanDerWaalsContact C-NZ 3.35Å; K124-K129 PolarHBondContact O-NZ 2.96Å; F126-K129 WeakPolarHBondContact O-CE 3.41Å; F126-K129 PolarHBondContact O-NZ 3.01Å; P127-K129 PolarHBondContact O-N 2.88Å; K129-K131 VanDerWaalsContact C-N 3.29Å; K129-K131 PolarHBondContact O-N 3.23Å; K129-E132 HydrophobicContact CB-CB 4.23Å; K129-E132 HydrophobicContact CB-CG 4.28Å; K129-E132 PolarHBondContact O-N 2.88Å; K129-H134 PolarHBondContact N-NE2 3.16Å; K129-H134 VanDerWaalsContact N-NE2 3.15Å; K129-H134 PolarHBondContact O-NE2 3.41Å; K129-H134 VanDerWaalsContact O-NE2 3.1Å
130	Y	78.2	Confident	89.8	Confident	114 Å²	114	79.7 Å²	79.7	45%	0.447	39%	0.386	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.9	-21.3	-174.7	77.1	-89	0	0	0	115.6	F88	F88-Y130 HydrophobicContact CB-CD1 3.8Å; F88-Y130 HydrophobicContact CB-CE1 4.11Å; F88-Y130 HydrophobicContact CD1-CD1 4.16Å; F88-Y130 AromaticContact CD2-CD1 3.89Å; F88-Y130 HydrophobicContact CD2-CD1 3.89Å; F88-Y130 AromaticContact CD2-CG 3.78Å; F88-Y130 HydrophobicContact CD2-CG 3.78Å; F88-Y130 HydrophobicContact CE2-CG 4.12Å; F88-Y130 AromaticContact CG-CD1 3.66Å; F88-Y130 HydrophobicContact CG-CD1 3.66Å; F88-Y130 HydrophobicContact CG-CE1 4.46Å; F88-Y130 HydrophobicContact CG-CG 4.05Å
131	K	78.9	Confident	89.7	Confident	168 Å²	168	80.6 Å²	80.6	73%	0.73	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87	-8.6	177.8	-70.1	-174.5	168.9	168.4	0	113.2	K129	K129-K131 VanDerWaalsContact C-N 3.29Å; K129-K131 PolarHBondContact O-N 3.23Å
132	E	85.4	Confident	89.7	Confident	119 Å²	119	82.2 Å²	82.2	56%	0.556	39%	0.39	S	S	*	.	S	Bend	trans	-113.3	144.3	-173.9	-68.9	166.4	-153.8	0	0	109.8	K129 H134	K129-E132 HydrophobicContact CB-CB 4.23Å; K129-E132 HydrophobicContact CB-CG 4.28Å; K129-E132 PolarHBondContact O-N 2.88Å; E132-H134 PolarHBondContact O-CD2 3.49Å; E132-H134 IonicContact OE2-CE1 2.9Å
133	R	84.1	Confident	89.7	Confident	203 Å²	203	78.1 Å²	78.1	77%	0.766	37%	0.369	S	S	*	.	P	Polyproline II helix	trans	-87.5	119.6	168.2	-70.7	-174.1	177.7	-159.6	-3.9	108.1
134	H	90.4	Very high	89.9	Confident	38 Å²	38	81.3 Å²	81.3	18%	0.176	38%	0.378	C	S	.	.	P	Polyproline II helix	trans	-96.3	129.2	176.8	-63.5	-72.5	0	0	0	109.4	K129 E132 Y138 L139	K129-H134 PolarHBondContact N-NE2 3.16Å; K129-H134 VanDerWaalsContact N-NE2 3.15Å; K129-H134 PolarHBondContact O-NE2 3.41Å; K129-H134 VanDerWaalsContact O-NE2 3.1Å; E132-H134 PolarHBondContact O-CD2 3.49Å; E132-H134 IonicContact OE2-CE1 2.9Å; H134-Y138 HydrophobicContact CB-CD1 3.84Å; H134-Y138 AromaticContact CG-CD1 3.89Å; H134-Y138 AromaticContact ND1-CD1 3.6Å; H134-Y138 AromaticContact ND1-CE1 3.55Å; H134-L139 HydrophobicContact CB-CD2 3.78Å; H134-L139 HydrophobicContact CB-CG 4.04Å
135	P	92.1	Very high	90.2	Very high	86 Å²	86	74.7 Å²	74.7	56%	0.558	35%	0.349	S	S	*	.	P	Polyproline II helix	trans	-62.9	151.1	173.7	26.8	-32.6	0	0	0	110.4	E137 Y138 L139	P135-E137 PolarHBondContact O-N 2.99Å; P135-E137 VanDerWaalsContact O-N 3.13Å; P135-Y138 WeakPolarHBondContact O-CB 3.44Å; P135-Y138 PolarHBondContact O-N 3.42Å; P135-L139 PolarHBondContact O-N 3.4Å
136	L	92.4	Very high	90.2	Very high	36 Å²	36	71.6 Å²	71.6	19%	0.188	32%	0.322	C	S	.	.	H	α-helix	trans	-57.2	-32.1	-178.9	-66.3	175.8	0	0	0	112.4	L139 R140 V151 L152 I302 D464	L136-L139 HydrophobicContact CD2-CD1 4.29Å; L136-L139 PolarHBondContact O-N 3.32Å; L136-R140 WeakPolarHBondContact O-CG 3.36Å; L136-R140 PolarHBondContact O-N 2.88Å; L136-V151 HydrophobicContact CD2-CG1 4.21Å; L136-L152 HydrophobicContact CD2-CD2 3.66Å; L136-I302 HydrophobicContact CD1-CD1 4.38Å; L136-D464 WeakPolarHBondContact CB-OD2 3.17Å; L136-D464 HydrophobicContact CD1-CB 4.28Å; L136-D464 VanDerWaalsContact CD1-OD2 3.31Å; L136-D464 WeakPolarHBondContact CD1-OD2 3.34Å
137	E	92.8	Very high	90.3	Very high	137 Å²	137	73.5 Å²	73.5	64%	0.64	34%	0.337	S	S	*	.	H	α-helix	trans	-61.8	-43.1	174.8	-171.5	173.7	179.7	0	0	113.5	P135 L139 R140	P135-E137 PolarHBondContact O-N 2.99Å; P135-E137 VanDerWaalsContact O-N 3.13Å; E137-L139 VanDerWaalsContact C-N 3.34Å; E137-R140 PolarHBondContact O-N 3.46Å
138	Y	94.2	Very high	90.3	Very high	65 Å²	65	77 Å²	77	26%	0.255	35%	0.347	S	S	.	.	H	α-helix	trans	-64.1	-42.3	173.9	177.5	-95.3	0	0	0	110.9	P127 H134 P135 R140 Q141 Y142	P127-Y138 PolarHBondContact O-OH 2.98Å; H134-Y138 HydrophobicContact CB-CD1 3.84Å; H134-Y138 AromaticContact CG-CD1 3.89Å; H134-Y138 AromaticContact ND1-CD1 3.6Å; H134-Y138 AromaticContact ND1-CE1 3.55Å; P135-Y138 WeakPolarHBondContact O-CB 3.44Å; P135-Y138 PolarHBondContact O-N 3.42Å; Y138-R140 PolarHBondContact O-N 3.1Å; Y138-Q141 WeakPolarHBondContact O-CB 3.31Å; Y138-Q141 PolarHBondContact O-N 2.75Å; Y138-Y142 HydrophobicContact CD1-CE2 4.4Å; Y138-Y142 HydrophobicContact CD2-CE2 4.45Å; Y138-Y142 HydrophobicContact CE1-CD2 4.12Å; Y138-Y142 AromaticContact CE1-CE2 3.8Å; Y138-Y142 HydrophobicContact CE1-CE2 3.8Å; Y138-Y142 AromaticContact CE2-CE2 3.84Å; Y138-Y142 HydrophobicContact CE2-CE2 3.84Å; Y138-Y142 AromaticContact CZ-CE2 3.48Å; Y138-Y142 VanDerWaalsContact CZ-CE2 3.48Å
139	L	94	Very high	90.4	Very high	6 Å²	6	77.6 Å²	77.6	3%	0.031	35%	0.351	C	S	.	.	H	α-helix	trans	-63.2	-29.8	179.4	-64.6	-179.5	0	0	0	113	I128 H134 P135 L136 E137 Q141 Y142 R146 T149 L152	I128-L139 HydrophobicContact CD1-CD2 3.91Å; I128-L139 HydrophobicContact CG1-CD2 4.1Å; I128-L139 HydrophobicContact CG2-CD2 4.42Å; H134-L139 HydrophobicContact CB-CD2 3.78Å; H134-L139 HydrophobicContact CB-CG 4.04Å; P135-L139 PolarHBondContact O-N 3.4Å; L136-L139 HydrophobicContact CD2-CD1 4.29Å; L136-L139 PolarHBondContact O-N 3.32Å; E137-L139 VanDerWaalsContact C-N 3.34Å; L139-Q141 PolarHBondContact O-N 3.09Å; L139-Y142 CarbonylContact O-C 3.46Å; L139-Y142 PolarHBondContact O-N 3.34Å; L139-Y142 VanDerWaalsContact O-N 3.11Å; L139-R146 HydrophobicContact CB-CB 4.02Å; L139-R146 WeakPolarHBondContact O-CB 3.37Å; L139-T149 HydrophobicContact CD1-CG2 3.98Å; L139-T149 HydrophobicContact CD2-CG2 3.84Å; L139-L152 HydrophobicContact CD1-CD2 3.83Å
140	R	92.8	Very high	90.8	Very high	62 Å²	62	78.3 Å²	78.3	23%	0.234	36%	0.358	C	S	.	.	H	α-helix	trans	-63	-23.1	174.8	-76.4	-173.7	-73.1	-102.2	4.9	113.4	L136 E137 Y138 Y142 D464	L136-R140 WeakPolarHBondContact O-CG 3.36Å; L136-R140 PolarHBondContact O-N 2.88Å; E137-R140 PolarHBondContact O-N 3.46Å; Y138-R140 PolarHBondContact O-N 3.1Å; R140-Y142 PolarHBondContact O-N 3.25Å; R140-D464 IonicContact CZ-OD1 3.46Å; R140-D464 IonicContact CZ-OD2 3.45Å; R140-D464 IonicContact NH1-OD1 3.58Å; R140-D464 PolarHBondContact NH1-OD1 2.66Å; R140-D464 IonicContact NH1-OD2 3.98Å; R140-D464 PolarHBondContact NH1-OD2 3.12Å
141	Q	93.1	Very high	91.5	Very high	121 Å²	121	74.3 Å²	74.3	57%	0.565	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.9	-16.9	175.7	-57.4	178	1.9	0	0	112.8	Y138 L139 P143	Y138-Q141 WeakPolarHBondContact O-CB 3.31Å; Y138-Q141 PolarHBondContact O-N 2.75Å; L139-Q141 PolarHBondContact O-N 3.09Å; Q141-P143 VanDerWaalsContact C-CD 3.45Å; Q141-P143 WeakPolarHBondContact O-CD 3.33Å
142	Y	93.9	Very high	92.2	Very high	61 Å²	61	66.6 Å²	66.6	24%	0.239	31%	0.312	C	S	.	.			trans	-124.7	64.4	-177.7	-56	-83.5	0	0	0	111.1	P127 Y138 L139 R140 H144 F145 R146	P127-Y142 HydrophobicContact CB-CD1 3.88Å; P127-Y142 HydrophobicContact CB-CD2 4.32Å; P127-Y142 HydrophobicContact CB-CE1 3.53Å; P127-Y142 HydrophobicContact CB-CE2 4.03Å; P127-Y142 HydrophobicContact CB-CG 4.25Å; P127-Y142 HydrophobicContact CG-CD1 3.63Å; P127-Y142 HydrophobicContact CG-CE1 3.75Å; P127-Y142 HydrophobicContact CG-CG 4.09Å; Y138-Y142 HydrophobicContact CD1-CE2 4.4Å; Y138-Y142 HydrophobicContact CD2-CE2 4.45Å; Y138-Y142 HydrophobicContact CE1-CD2 4.12Å; Y138-Y142 AromaticContact CE1-CE2 3.8Å; Y138-Y142 HydrophobicContact CE1-CE2 3.8Å; Y138-Y142 AromaticContact CE2-CE2 3.84Å; Y138-Y142 HydrophobicContact CE2-CE2 3.84Å; Y138-Y142 AromaticContact CZ-CE2 3.48Å; Y138-Y142 VanDerWaalsContact CZ-CE2 3.48Å; L139-Y142 CarbonylContact O-C 3.46Å; L139-Y142 PolarHBondContact O-N 3.34Å; L139-Y142 VanDerWaalsContact O-N 3.11Å; R140-Y142 PolarHBondContact O-N 3.25Å; Y142-H144 PolarHBondContact O-N 3.42Å; Y142-H144 VanDerWaalsContact O-N 3.15Å; Y142-F145 PolarHBondContact O-N 3.47Å; Y142-R146 PolarHBondContact O-N 3.38Å
143	P	93.1	Very high	92.7	Very high	19 Å²	19	61.4 Å²	61.4	12%	0.123	29%	0.291	C	S	.	.	H	α-helix	trans	-57.7	-34.6	-174.9	23.3	-33.5	0	0	0	112.5	Q141 F145 F468 L477	Q141-P143 VanDerWaalsContact C-CD 3.45Å; Q141-P143 WeakPolarHBondContact O-CD 3.33Å; P143-F145 VanDerWaalsContact C-N 3.28Å; P143-F145 PolarHBondContact O-N 3.14Å; P143-F468 HydrophobicContact CB-CD1 4.12Å; P143-F468 HydrophobicContact CB-CE1 4.25Å; P143-L477 HydrophobicContact CB-CD1 4.23Å; P143-L477 HydrophobicContact CB-CD2 4.19Å; P143-L477 HydrophobicContact CB-CG 4.23Å; P143-L477 HydrophobicContact CG-CD2 4.19Å; P143-L477 HydrophobicContact CG-CG 4.18Å
144	H	93.6	Very high	93.4	Very high	99 Å²	99	51.8 Å²	51.8	46%	0.458	25%	0.254	S	S	.	.	H	α-helix	trans	-71.9	-13.3	178.1	56.1	-83.9	0	0	0	114.7	Y142	Y142-H144 PolarHBondContact O-N 3.42Å; Y142-H144 VanDerWaalsContact O-N 3.15Å
145	F	93.1	Very high	93.7	Very high	49 Å²	49	50 Å²	50	22%	0.215	25%	0.246	C	C	.	.	H	α-helix	trans	-119.1	-23.3	178.9	-66	-44.6	0	0	0	114.7	F126 P127 I128 Y142 P143 C147 R148	F126-F145 AromaticContact CE2-CD1 3.7Å; F126-F145 HydrophobicContact CE2-CD1 3.7Å; F126-F145 HydrophobicContact CE2-CD2 4.13Å; F126-F145 AromaticContact CE2-CE1 3.8Å; F126-F145 HydrophobicContact CE2-CE1 3.8Å; F126-F145 HydrophobicContact CE2-CE2 4.2Å; F126-F145 AromaticContact CE2-CG 3.88Å; F126-F145 HydrophobicContact CE2-CG 3.88Å; F126-F145 HydrophobicContact CE2-CZ 4.06Å; F126-F145 HydrophobicContact CZ-CB 4.31Å; F126-F145 HydrophobicContact CZ-CD1 4.1Å; F126-F145 HydrophobicContact CZ-CG 4.12Å; P127-F145 HydrophobicContact CG-CD2 3.73Å; P127-F145 HydrophobicContact CG-CE2 4.11Å; I128-F145 HydrophobicContact CD1-CB 3.71Å; Y142-F145 PolarHBondContact O-N 3.47Å; P143-F145 VanDerWaalsContact C-N 3.28Å; P143-F145 PolarHBondContact O-N 3.14Å; F145-C147 PolarHBondContact O-N 3.15Å; F145-C147 VanDerWaalsContact O-N 3.12Å; F145-R148 VanDerWaalsContact O-CB 3.28Å; F145-R148 WeakPolarHBondContact O-CB 3.25Å; F145-R148 PolarHBondContact O-N 3.45Å
146	R	93.1	Very high	94	Very high	6 Å²	6	48.1 Å²	48.1	2%	0.023	23%	0.231	C	C	.	.	H	α-helix	trans	-57.3	-32.6	-171.9	69.3	-175.8	-61.5	-156.2	7.1	114	L139 Y142 R148 T149 L152 K463 D464	L139-R146 HydrophobicContact CB-CB 4.02Å; L139-R146 WeakPolarHBondContact O-CB 3.37Å; Y142-R146 PolarHBondContact O-N 3.38Å; R146-R148 PolarHBondContact O-N 3.39Å; R146-R148 VanDerWaalsContact O-N 3.13Å; R146-T149 WeakPolarHBondContact O-CB 3.43Å; R146-T149 WeakPolarHBondContact O-CG2 3.28Å; R146-T149 PolarHBondContact O-N 2.92Å; R146-T149 PolarHBondContact O-OG1 3.33Å; R146-L152 HydrophobicContact CB-CG 4.42Å; R146-L152 HydrophobicContact CG-CG 4.38Å; R146-L152 WeakPolarHBondContact O-CB 3.27Å; R146-K463 PolarHBondContact NH1-O 3.41Å; R146-D464 IonicContact CZ-OD1 2.87Å; R146-D464 IonicContact NH1-OD1 3.41Å; R146-D464 IonicContact NH2-OD1 3.52Å; R146-D464 PolarHBondContact NH2-OD1 3.32Å
147	C	92.3	Very high	94.2	Very high	58 Å²	58	48.5 Å²	48.5	39%	0.392	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-19.2	176.2	62.8	0	0	0	0	113.5	F145 T149 L156	F145-C147 PolarHBondContact O-N 3.15Å; F145-C147 VanDerWaalsContact O-N 3.12Å; C147-T149 PolarHBondContact O-N 3.01Å; C147-L156 HydrophobicContact CB-CD1 3.81Å
148	R	92.3	Very high	94.5	Very high	98 Å²	98	42 Å²	42	37%	0.37	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.8	-5.1	176	-56.7	-176.4	-179.9	-169.5	-0.3	112.7	R51 F145 R146	R51-R148 PolarHBondContact NH1-O 2.88Å; R51-R148 PolarHBondContact NH2-O 3.05Å; F145-R148 VanDerWaalsContact O-CB 3.28Å; F145-R148 WeakPolarHBondContact O-CB 3.25Å; F145-R148 PolarHBondContact O-N 3.45Å; R146-R148 PolarHBondContact O-N 3.39Å; R146-R148 VanDerWaalsContact O-N 3.13Å
149	T	93.1	Very high	94.7	Very high	23 Å²	23	40.1 Å²	40.1	14%	0.141	19%	0.192	C	C	.	.	S	Bend	trans	-79.7	156.2	172.3	64.2	0	0	0	0	111.2	I128 L139 R146 C147 V151 L152 G153	I128-T149 HydrophobicContact CD1-CG2 4.1Å; I128-T149 HydrophobicContact CG2-CG2 3.79Å; L139-T149 HydrophobicContact CD1-CG2 3.98Å; L139-T149 HydrophobicContact CD2-CG2 3.84Å; R146-T149 WeakPolarHBondContact O-CB 3.43Å; R146-T149 WeakPolarHBondContact O-CG2 3.28Å; R146-T149 PolarHBondContact O-N 2.92Å; R146-T149 PolarHBondContact O-OG1 3.33Å; C147-T149 PolarHBondContact O-N 3.01Å; T149-V151 VanDerWaalsContact C-N 3.33Å; T149-V151 PolarHBondContact O-N 3.1Å; T149-L152 PolarHBondContact OG1-N 2.89Å; T149-G153 PolarHBondContact O-N 2.95Å
150	N	93.6	Very high	94.9	Very high	77 Å²	77	43.7 Å²	43.7	41%	0.412	22%	0.218	S	C	.	.	H	α-helix	trans	-60.9	-43.7	177.4	-70	-1.9	0	0	0	111.5	R51 L70 S154 L297	R51-N150 PolarHBondContact NH2-OD1 2.77Å; L70-N150 HydrophobicContact CD1-CB 3.89Å; N150-S154 WeakPolarHBondContact O-CB 3.36Å; N150-S154 PolarHBondContact O-N 3.31Å; N150-S154 PolarHBondContact O-OG 2.88Å; N150-L297 HydrophobicContact CB-CD2 4.19Å
151	V	93	Very high	95.2	Very high	30 Å²	30	43 Å²	43	18%	0.182	22%	0.217	C	C	.	.	H	α-helix	trans	-61.6	-57.9	-178.6	176.8	0	0	0	0	111.3	L136 T149 G153 S154 I155 L297 I302	L136-V151 HydrophobicContact CD2-CG1 4.21Å; T149-V151 VanDerWaalsContact C-N 3.33Å; T149-V151 PolarHBondContact O-N 3.1Å; V151-G153 VanDerWaalsContact C-N 3.34Å; V151-G153 PolarHBondContact O-N 2.8Å; V151-S154 WeakPolarHBondContact O-CB 3.37Å; V151-S154 PolarHBondContact O-N 2.78Å; V151-S154 VanDerWaalsContact O-N 3.16Å; V151-I155 HydrophobicContact CG1-CD1 3.91Å; V151-I155 WeakPolarHBondContact O-CG1 3.43Å; V151-I155 PolarHBondContact O-N 3.47Å; V151-L297 HydrophobicContact CG2-CD2 4.34Å; V151-I302 HydrophobicContact CG1-CD1 3.61Å; V151-I302 HydrophobicContact CG1-CG1 3.86Å; V151-I302 HydrophobicContact CG2-CD1 4.1Å
152	L	94.8	Very high	95.5	Very high	5 Å²	5	37.2 Å²	37.2	3%	0.026	19%	0.19	C	C	.	.	H	α-helix	trans	-69.7	-33.6	-176.6	-79.5	-65.3	0	0	0	111.7	L136 L139 R146 T149 S154 I155 L156 D464	L136-L152 HydrophobicContact CD2-CD2 3.66Å; L139-L152 HydrophobicContact CD1-CD2 3.83Å; R146-L152 HydrophobicContact CB-CG 4.42Å; R146-L152 HydrophobicContact CG-CG 4.38Å; R146-L152 WeakPolarHBondContact O-CB 3.27Å; T149-L152 PolarHBondContact OG1-N 2.89Å; L152-S154 VanDerWaalsContact C-N 3.28Å; L152-S154 PolarHBondContact O-N 3.2Å; L152-I155 HydrophobicContact CD1-CD1 4.43Å; L152-I155 PolarHBondContact O-N 3.45Å; L152-L156 WeakPolarHBondContact O-CB 3.36Å; L152-L156 VanDerWaalsContact O-CG 3.25Å; L152-L156 WeakPolarHBondContact O-CG 3.45Å; L152-L156 PolarHBondContact O-N 3.19Å; L152-D464 WeakPolarHBondContact CD1-O 3.33Å
153	G	96	Very high	95.7	Very high	11 Å²	11	36.3 Å²	36.3	11%	0.113	19%	0.191	C	C	.	.	H	α-helix	trans	-59	-41.1	171.7	0	0	0	0	0	112.3	T149 V151 L156 R157	T149-G153 PolarHBondContact O-N 2.95Å; V151-G153 VanDerWaalsContact C-N 3.34Å; V151-G153 PolarHBondContact O-N 2.8Å; G153-L156 PolarHBondContact O-N 3.38Å; G153-R157 PolarHBondContact O-N 3.28Å
154	S	97	Very high	96	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-66.1	-48.3	176.6	-52.2	0	0	0	0	111.3	N150 V151 L152 L156 R157 I158 D294 L297	N150-S154 WeakPolarHBondContact O-CB 3.36Å; N150-S154 PolarHBondContact O-N 3.31Å; N150-S154 PolarHBondContact O-OG 2.88Å; V151-S154 WeakPolarHBondContact O-CB 3.37Å; V151-S154 PolarHBondContact O-N 2.78Å; V151-S154 VanDerWaalsContact O-N 3.16Å; L152-S154 VanDerWaalsContact C-N 3.28Å; L152-S154 PolarHBondContact O-N 3.2Å; S154-L156 VanDerWaalsContact C-N 3.26Å; S154-L156 PolarHBondContact O-N 2.93Å; S154-R157 PolarHBondContact O-N 2.68Å; S154-R157 PolarHBondContact OG-NH2 3.43Å; S154-I158 VanDerWaalsContact O-CG1 3.25Å; S154-I158 WeakPolarHBondContact O-CG1 3.24Å; S154-I158 PolarHBondContact O-N 2.96Å; S154-D294 WeakPolarHBondContact CA-OD1 3.13Å; S154-D294 VanDerWaalsContact CB-OD1 3.24Å; S154-D294 WeakPolarHBondContact CB-OD1 3.48Å; S154-D294 PolarHBondContact OG-OD1 2.96Å; S154-L297 VanDerWaalsContact OG-CD2 3.24Å; S154-L297 WeakPolarHBondContact OG-CD2 3.24Å
155	I	97.7	Very high	96.2	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-57.6	-40.1	177.6	-66.7	172	0	0	0	111.2	V151 L152 I158 R159 L457 V459 V465	V151-I155 HydrophobicContact CG1-CD1 3.91Å; V151-I155 WeakPolarHBondContact O-CG1 3.43Å; V151-I155 PolarHBondContact O-N 3.47Å; L152-I155 HydrophobicContact CD1-CD1 4.43Å; L152-I155 PolarHBondContact O-N 3.45Å; I155-I158 PolarHBondContact O-N 3.47Å; I155-R159 WeakPolarHBondContact O-CB 3.44Å; I155-R159 PolarHBondContact O-N 2.83Å; I155-L457 HydrophobicContact CG1-CD1 4.09Å; I155-L457 HydrophobicContact CG2-CD1 4.25Å; I155-V459 HydrophobicContact CD1-CG2 4.08Å; I155-V465 HydrophobicContact CG2-CB 4.39Å; I155-V465 HydrophobicContact CG2-CG1 4.33Å
156	L	97.6	Very high	96.5	Very high	47 Å²	47	30.5 Å²	30.5	25%	0.246	17%	0.171	C	C	.	.	H	α-helix	trans	-72	-36.4	178.9	-66.9	-177.5	0	0	0	113.5	C147 L152 G153 S154 R159 S160 P467	C147-L156 HydrophobicContact CB-CD1 3.81Å; L152-L156 WeakPolarHBondContact O-CB 3.36Å; L152-L156 VanDerWaalsContact O-CG 3.25Å; L152-L156 WeakPolarHBondContact O-CG 3.45Å; L152-L156 PolarHBondContact O-N 3.19Å; G153-L156 PolarHBondContact O-N 3.38Å; S154-L156 VanDerWaalsContact C-N 3.26Å; S154-L156 PolarHBondContact O-N 2.93Å; L156-R159 PolarHBondContact O-N 3.06Å; L156-S160 PolarHBondContact O-N 3.1Å; L156-P467 HydrophobicContact CD2-CB 4.26Å; L156-P467 HydrophobicContact CD2-CG 3.58Å
157	R	98.3	Very high	96.8	Very high	45 Å²	45	33.1 Å²	33.1	17%	0.17	18%	0.183	C	C	.	.	H	α-helix	trans	-63.8	-45.3	170.7	-76.7	-172.3	-65.2	-84.8	-4.7	111.1	G67 G153 S154 R159 S160 E161 D294	G67-R157 PolarHBondContact O-NH1 3.35Å; G153-R157 PolarHBondContact O-N 3.28Å; S154-R157 PolarHBondContact O-N 2.68Å; S154-R157 PolarHBondContact OG-NH2 3.43Å; R157-R159 VanDerWaalsContact C-N 3.34Å; R157-R159 PolarHBondContact O-N 3.32Å; R157-S160 WeakPolarHBondContact O-CB 3.26Å; R157-S160 PolarHBondContact O-N 3.46Å; R157-S160 VanDerWaalsContact O-N 3.15Å; R157-E161 PolarHBondContact O-N 2.84Å; R157-D294 IonicContact CZ-OD1 3.77Å; R157-D294 IonicContact CZ-OD2 2.72Å; R157-D294 IonicContact NE-OD1 3.75Å; R157-D294 PolarHBondContact NE-OD1 3.24Å; R157-D294 IonicContact NE-OD2 2.68Å; R157-D294 PolarHBondContact NE-OD2 2.84Å; R157-D294 IonicContact NH2-OD1 3.56Å; R157-D294 PolarHBondContact NH2-OD1 3.16Å; R157-D294 IonicContact NH2-OD2 3.38Å
158	I	98.6	Very high	97.1	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-60.3	-43.9	175.1	-66.2	163.1	0	0	0	111	S154 I155 S160 E161 A162 V287 C291 D294 V295 L453 I456 L457	S154-I158 VanDerWaalsContact O-CG1 3.25Å; S154-I158 WeakPolarHBondContact O-CG1 3.24Å; S154-I158 PolarHBondContact O-N 2.96Å; I155-I158 PolarHBondContact O-N 3.47Å; I158-S160 VanDerWaalsContact C-N 3.3Å; I158-S160 PolarHBondContact O-N 3.35Å; I158-E161 PolarHBondContact O-N 2.99Å; I158-A162 VanDerWaalsContact O-CB 3.28Å; I158-A162 WeakPolarHBondContact O-CB 3.28Å; I158-A162 PolarHBondContact O-N 3.42Å; I158-V287 HydrophobicContact CG2-CG1 3.7Å; I158-C291 HydrophobicContact CG1-CB 4.15Å; I158-D294 HydrophobicContact CD1-CB 3.81Å; I158-D294 HydrophobicContact CG1-CB 3.78Å; I158-V295 HydrophobicContact CD1-CG2 3.83Å; I158-V295 HydrophobicContact CG1-CG2 4.14Å; I158-L453 HydrophobicContact CG2-CD2 4.35Å; I158-I456 HydrophobicContact CG2-CD1 4.46Å; I158-L457 HydrophobicContact CD1-CD1 4.18Å; I158-L457 HydrophobicContact CD1-CD2 3.67Å; I158-L457 HydrophobicContact CG2-CD1 4.26Å; I158-L457 HydrophobicContact CG2-CD2 4.15Å
159	R	98.6	Very high	97.4	Very high	25 Å²	25	28.9 Å²	28.9	9%	0.094	17%	0.167	C	C	.	.	H	α-helix	trans	-57.6	-43.9	174.9	177.7	177.5	-176.9	94.1	3.5	111.6	I155 L156 R157 T163 F449 E450 L453 V465	I155-R159 WeakPolarHBondContact O-CB 3.44Å; I155-R159 PolarHBondContact O-N 2.83Å; L156-R159 PolarHBondContact O-N 3.06Å; R157-R159 VanDerWaalsContact C-N 3.34Å; R157-R159 PolarHBondContact O-N 3.32Å; R159-T163 PolarHBondContact O-N 2.71Å; R159-T163 PolarHBondContact O-OG1 3.05Å; R159-F449 HydrophobicContact CG-CE1 3.64Å; R159-F449 HydrophobicContact CG-CZ 3.89Å; R159-F449 VanDerWaalsContact CZ-CE1 3.43Å; R159-E450 IonicContact CZ-OE1 2.8Å; R159-E450 IonicContact NH1-OE1 3.77Å; R159-E450 PolarHBondContact NH1-OE1 3Å; R159-E450 IonicContact NH2-OE1 3.04Å; R159-E450 PolarHBondContact NH2-OE1 3.34Å; R159-L453 HydrophobicContact CB-CD1 3.92Å; R159-L453 HydrophobicContact CG-CD1 3.79Å; R159-V465 PolarHBondContact NH1-O 2.92Å; R159-V465 VanDerWaalsContact NH1-O 3.15Å
160	S	98.5	Very high	97.7	Very high	81 Å²	81	27.8 Å²	27.8	57%	0.566	16%	0.161	S	C	*	.	H	α-helix	trans	-61.9	-44.6	176.3	-172.4	0	0	0	0	111.5	L156 R157 I158 T163 A164	L156-S160 PolarHBondContact O-N 3.1Å; R157-S160 WeakPolarHBondContact O-CB 3.26Å; R157-S160 PolarHBondContact O-N 3.46Å; R157-S160 VanDerWaalsContact O-N 3.15Å; I158-S160 VanDerWaalsContact C-N 3.3Å; I158-S160 PolarHBondContact O-N 3.35Å; S160-T163 WeakPolarHBondContact O-CB 3.25Å; S160-T163 PolarHBondContact O-N 2.98Å; S160-A164 PolarHBondContact O-N 3.3Å; S160-A164 VanDerWaalsContact O-N 3.14Å
161	E	98.6	Very high	97.9	Very high	47 Å²	47	31.6 Å²	31.6	22%	0.22	17%	0.174	C	C	.	.	H	α-helix	trans	-66.2	-44.8	178.4	-173.7	55.9	-139.3	0	0	111.8	R157 I158 T163 A164 A165 V287 H290	R157-E161 PolarHBondContact O-N 2.84Å; I158-E161 PolarHBondContact O-N 2.99Å; E161-T163 VanDerWaalsContact C-N 3.26Å; E161-T163 PolarHBondContact O-N 3.28Å; E161-A164 PolarHBondContact O-N 3.03Å; E161-A164 VanDerWaalsContact O-N 3.09Å; E161-A165 WeakPolarHBondContact O-CB 3.49Å; E161-A165 PolarHBondContact O-N 3.3Å; E161-V287 HydrophobicContact CG-CG2 4.44Å; E161-H290 HydrophobicContact CG-CB 3.83Å; E161-H290 IonicContact OE1-CE1 3.39Å; E161-H290 IonicContact OE1-CG 3.03Å; E161-H290 IonicContact OE1-ND1 2.92Å; E161-H290 PolarHBondContact OE1-ND1 3.34Å
162	A	98.8	Very high	98.2	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-58.3	-39.3	175.5	0	0	0	0	0	111.8	I158 A165 I166 V287 F449 Y452 L453	I158-A162 VanDerWaalsContact O-CB 3.28Å; I158-A162 WeakPolarHBondContact O-CB 3.28Å; I158-A162 PolarHBondContact O-N 3.42Å; A162-A165 PolarHBondContact O-N 2.61Å; A162-I166 WeakPolarHBondContact O-CB 3.35Å; A162-I166 WeakPolarHBondContact O-CD1 3.42Å; A162-I166 WeakPolarHBondContact O-CG1 3.46Å; A162-I166 PolarHBondContact O-N 2.94Å; A162-V287 HydrophobicContact CB-CG2 3.81Å; A162-F449 HydrophobicContact CB-CE2 3.84Å; A162-F449 HydrophobicContact CB-CZ 4.03Å; A162-Y452 HydrophobicContact CB-CE1 3.98Å; A162-L453 HydrophobicContact CB-CD2 3.95Å
163	T	98.8	Very high	98.3	Very high	42 Å²	42	38.4 Å²	38.4	26%	0.258	21%	0.213	S	C	.	.	H	α-helix	trans	-60.3	-49.5	174.1	-54.6	0	0	0	0	110.6	R159 S160 E161 A165 I166 H167 F238 F449	R159-T163 PolarHBondContact O-N 2.71Å; R159-T163 PolarHBondContact O-OG1 3.05Å; S160-T163 WeakPolarHBondContact O-CB 3.25Å; S160-T163 PolarHBondContact O-N 2.98Å; E161-T163 VanDerWaalsContact C-N 3.26Å; E161-T163 PolarHBondContact O-N 3.28Å; T163-A165 PolarHBondContact O-N 3.34Å; T163-I166 PolarHBondContact O-N 3.31Å; T163-H167 PolarHBondContact O-CD2 2.94Å; T163-H167 VanDerWaalsContact O-CD2 3.25Å; T163-H167 PolarHBondContact O-N 3.41Å; T163-H167 VanDerWaalsContact O-N 3.1Å; T163-F238 HydrophobicContact CG2-CD1 4.42Å; T163-F238 HydrophobicContact CG2-CE1 3.84Å; T163-F238 HydrophobicContact CG2-CZ 4.14Å; T163-F449 WeakPolarHBondContact OG1-CZ 3.33Å
164	A	98.8	Very high	98.4	Very high	45 Å²	45	40.4 Å²	40.4	37%	0.372	23%	0.233	S	C	.	.	H	α-helix	trans	-63.6	-39	178	0	0	0	0	0	112.7	S160 E161 H167 S168	S160-A164 PolarHBondContact O-N 3.3Å; S160-A164 VanDerWaalsContact O-N 3.14Å; E161-A164 PolarHBondContact O-N 3.03Å; E161-A164 VanDerWaalsContact O-N 3.09Å; A164-H167 PolarHBondContact O-N 2.94Å; A164-S168 WeakPolarHBondContact O-CB 3.24Å; A164-S168 PolarHBondContact O-N 3.02Å; A164-S168 PolarHBondContact O-OG 3.26Å
165	A	98.8	Very high	98.4	Very high	1 Å²	1	41 Å²	41	1%	0.008	24%	0.236	C	C	.	.	H	α-helix	trans	-64.4	-43.4	178.1	0	0	0	0	0	111.9	E161 A162 T163 S168 F169 T283 M286 V287	E161-A165 WeakPolarHBondContact O-CB 3.49Å; E161-A165 PolarHBondContact O-N 3.3Å; A162-A165 PolarHBondContact O-N 2.61Å; T163-A165 PolarHBondContact O-N 3.34Å; A165-S168 PolarHBondContact O-N 3.34Å; A165-F169 PolarHBondContact O-N 2.99Å; A165-T283 HydrophobicContact CB-CG2 4.49Å; A165-M286 HydrophobicContact CB-CB 3.88Å; A165-M286 HydrophobicContact CB-CE 4.02Å; A165-M286 HydrophobicContact CB-SD 4.17Å; A165-M286 WeakPolarHBondContact O-CE 3.21Å; A165-V287 HydrophobicContact CB-CG2 4.43Å
166	I	98.9	Very high	98.5	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-63	-48	175.9	-70.9	161.5	0	0	0	110.6	A162 T163 S168 F169 F170 F238 V259 T283 M447 F449	A162-I166 WeakPolarHBondContact O-CB 3.35Å; A162-I166 WeakPolarHBondContact O-CD1 3.42Å; A162-I166 WeakPolarHBondContact O-CG1 3.46Å; A162-I166 PolarHBondContact O-N 2.94Å; T163-I166 PolarHBondContact O-N 3.31Å; I166-S168 VanDerWaalsContact C-N 3.3Å; I166-S168 PolarHBondContact O-N 2.87Å; I166-F169 PolarHBondContact O-N 3.35Å; I166-F170 HydrophobicContact CG2-CD2 3.87Å; I166-F170 HydrophobicContact CG2-CE2 3.83Å; I166-F170 VanDerWaalsContact O-CD2 3.3Å; I166-F170 WeakPolarHBondContact O-CD2 3.33Å; I166-F170 PolarHBondContact O-N 3.35Å; I166-F170 VanDerWaalsContact O-N 3.1Å; I166-F238 HydrophobicContact CB-CE1 4.31Å; I166-F238 HydrophobicContact CD1-CE1 4.06Å; I166-F238 HydrophobicContact CG2-CD1 4.02Å; I166-F238 HydrophobicContact CG2-CE1 4.14Å; I166-V259 HydrophobicContact CD1-CG2 4.29Å; I166-V259 HydrophobicContact CG2-CG1 3.78Å; I166-V259 HydrophobicContact CG2-CG2 4.14Å; I166-T283 HydrophobicContact CB-CG2 4.37Å; I166-T283 HydrophobicContact CG1-CG2 3.71Å; I166-M447 HydrophobicContact CD1-CE 3.83Å; I166-F449 HydrophobicContact CD1-CD2 3.79Å; I166-F449 HydrophobicContact CD1-CE2 3.65Å
167	H	98.8	Very high	98.5	Very high	61 Å²	61	44.6 Å²	44.6	28%	0.282	26%	0.255	S	S	.	.	H	α-helix	trans	-61.6	-38.8	176.2	-83.3	-75.2	0	0	0	112.6	T163 A164 K171 H177 F236 F238	T163-H167 PolarHBondContact O-CD2 2.94Å; T163-H167 VanDerWaalsContact O-CD2 3.25Å; T163-H167 PolarHBondContact O-N 3.41Å; T163-H167 VanDerWaalsContact O-N 3.1Å; A164-H167 PolarHBondContact O-N 2.94Å; H167-K171 VanDerWaalsContact O-CB 3.23Å; H167-K171 WeakPolarHBondContact O-CB 3.48Å; H167-K171 PolarHBondContact O-N 3.23Å; H167-H177 AromaticContact CE1-CE1 3.65Å; H167-H177 AromaticContact CE1-ND1 3.93Å; H167-H177 AromaticContact CE1-NE2 3.81Å; H167-F236 AromaticContact CE1-CE2 3.96Å; H167-F236 AromaticContact ND1-CE2 3.72Å; H167-F236 AromaticContact ND1-CZ 3.6Å; H167-F238 AromaticContact NE2-CD1 3.72Å
168	S	98.6	Very high	98.6	Very high	50 Å²	50	43.5 Å²	43.5	35%	0.35	25%	0.252	S	S	.	.	H	α-helix	trans	-65.6	-45.4	177.5	-57.8	0	0	0	0	111.1	A164 A165 I166 F170 K171 D172	A164-S168 WeakPolarHBondContact O-CB 3.24Å; A164-S168 PolarHBondContact O-N 3.02Å; A164-S168 PolarHBondContact O-OG 3.26Å; A165-S168 PolarHBondContact O-N 3.34Å; I166-S168 VanDerWaalsContact C-N 3.3Å; I166-S168 PolarHBondContact O-N 2.87Å; S168-F170 PolarHBondContact O-N 2.9Å; S168-K171 PolarHBondContact O-N 3.45Å; S168-D172 VanDerWaalsContact O-CB 3.31Å; S168-D172 WeakPolarHBondContact O-CB 3.35Å; S168-D172 PolarHBondContact O-N 3.43Å
169	F	98.8	Very high	98.6	Very high	17 Å²	17	51.1 Å²	51.1	8%	0.075	29%	0.287	C	S	.	.	H	α-helix	trans	-53.8	-54.3	174.5	171.9	-91.5	0	0	0	111.6	A165 I166 K171 D172 S173 E278 L279 A282 T283 M286	A165-F169 PolarHBondContact O-N 2.99Å; I166-F169 PolarHBondContact O-N 3.35Å; F169-K171 VanDerWaalsContact C-N 3.35Å; F169-K171 PolarHBondContact O-N 2.97Å; F169-D172 PolarHBondContact O-N 3Å; F169-S173 VanDerWaalsContact O-CB 3.31Å; F169-S173 WeakPolarHBondContact O-CB 3.3Å; F169-S173 PolarHBondContact O-N 3.48Å; F169-S173 PolarHBondContact O-OG 3.49Å; F169-S173 VanDerWaalsContact O-OG 3.05Å; F169-E278 HydrophobicContact CE2-CB 4.11Å; F169-E278 HydrophobicContact CZ-CB 4.25Å; F169-L279 HydrophobicContact CB-CD1 4.29Å; F169-L279 HydrophobicContact CD1-CB 4.14Å; F169-L279 HydrophobicContact CD1-CD1 3.35Å; F169-L279 HydrophobicContact CD1-CG 4.28Å; F169-L279 HydrophobicContact CE1-CB 3.64Å; F169-L279 HydrophobicContact CE1-CD1 3.75Å; F169-L279 HydrophobicContact CE1-CG 4.2Å; F169-L279 HydrophobicContact CE2-CB 4.35Å; F169-L279 HydrophobicContact CG-CD1 3.82Å; F169-L279 HydrophobicContact CZ-CB 3.76Å; F169-A282 HydrophobicContact CD2-CB 3.87Å; F169-A282 HydrophobicContact CE2-CB 4.31Å; F169-T283 HydrophobicContact CB-CG2 4.12Å; F169-M286 HydrophobicContact CB-CE 4.29Å
170	F	98.8	Very high	98.5	Very high	0 Å²	0	51.1 Å²	51.1	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-64.4	-40.3	-177.7	-81.1	-63.8	0	0	0	112.6	I166 S168 S173 G174 F175 F236 V259 A261 L279 F445	I166-F170 HydrophobicContact CG2-CD2 3.87Å; I166-F170 HydrophobicContact CG2-CE2 3.83Å; I166-F170 VanDerWaalsContact O-CD2 3.3Å; I166-F170 WeakPolarHBondContact O-CD2 3.33Å; I166-F170 PolarHBondContact O-N 3.35Å; I166-F170 VanDerWaalsContact O-N 3.1Å; S168-F170 PolarHBondContact O-N 2.9Å; F170-S173 CarbonylContact O-C 3.6Å; F170-S173 PolarHBondContact O-N 3.05Å; F170-G174 PolarHBondContact O-N 2.84Å; F170-G174 VanDerWaalsContact O-N 3.16Å; F170-F175 HydrophobicContact CB-CB 4.03Å; F170-F175 HydrophobicContact CB-CG 4.47Å; F170-F175 HydrophobicContact CD1-CB 3.92Å; F170-F175 AromaticContact CD1-CD1 3.67Å; F170-F175 HydrophobicContact CD1-CD1 3.67Å; F170-F175 AromaticContact CD1-CD2 3.75Å; F170-F175 HydrophobicContact CD1-CD2 3.75Å; F170-F175 HydrophobicContact CD1-CE1 4.09Å; F170-F175 HydrophobicContact CD1-CE2 4.14Å; F170-F175 AromaticContact CD1-CG 3.51Å; F170-F175 HydrophobicContact CD1-CG 3.51Å; F170-F175 HydrophobicContact CD1-CZ 4.3Å; F170-F175 AromaticContact CE1-CD1 3.95Å; F170-F175 HydrophobicContact CE1-CD1 3.95Å; F170-F175 HydrophobicContact CE1-CD2 4.48Å; F170-F175 AromaticContact CE1-CE1 3.98Å; F170-F175 HydrophobicContact CE1-CE1 3.98Å; F170-F175 HydrophobicContact CE1-CE2 4.47Å; F170-F175 HydrophobicContact CE1-CG 4.23Å; F170-F175 HydrophobicContact CE1-CZ 4.24Å; F170-F175 HydrophobicContact CG-CB 4.41Å; F170-F175 HydrophobicContact CG-CG 4.44Å; F170-F175 WeakPolarHBondContact O-CB 3.11Å; F170-F175 PolarHBondContact O-N 3Å; F170-F236 HydrophobicContact CB-CD1 3.63Å; F170-F236 HydrophobicContact CB-CD2 4.13Å; F170-F236 HydrophobicContact CB-CE1 3.42Å; F170-F236 VanDerWaalsContact CB-CE1 3.42Å; F170-F236 HydrophobicContact CB-CE2 3.96Å; F170-F236 HydrophobicContact CB-CG 3.96Å; F170-F236 HydrophobicContact CB-CZ 3.59Å; F170-F236 HydrophobicContact CD1-CB 3.94Å; F170-F236 HydrophobicContact CD1-CD1 4.14Å; F170-F236 HydrophobicContact CD1-CD2 4.39Å; F170-F236 AromaticContact CD1-CG 3.91Å; F170-F236 HydrophobicContact CD1-CG 3.91Å; F170-F236 HydrophobicContact CD2-CB 4.33Å; F170-F236 HydrophobicContact CD2-CD1 4.35Å; F170-F236 AromaticContact CD2-CD2 3.41Å; F170-F236 HydrophobicContact CD2-CD2 3.41Å; F170-F236 VanDerWaalsContact CD2-CD2 3.41Å; F170-F236 AromaticContact CD2-CE2 3.66Å; F170-F236 HydrophobicContact CD2-CE2 3.66Å; F170-F236 AromaticContact CD2-CG 3.78Å; F170-F236 HydrophobicContact CD2-CG 3.78Å; F170-F236 HydrophobicContact CD2-CZ 4.2Å; F170-F236 HydrophobicContact CE1-CB 3.94Å; F170-F236 HydrophobicContact CE1-CG 4.33Å; F170-F236 HydrophobicContact CE2-CB 4.34Å; F170-F236 AromaticContact CE2-CD2 3.85Å; F170-F236 HydrophobicContact CE2-CD2 3.85Å; F170-F236 HydrophobicContact CE2-CE2 4.44Å; F170-F236 HydrophobicContact CE2-CG 4.22Å; F170-F236 HydrophobicContact CG-CB 4.13Å; F170-F236 AromaticContact CG-CD1 3.8Å; F170-F236 HydrophobicContact CG-CD1 3.8Å; F170-F236 AromaticContact CG-CD2 3.73Å; F170-F236 HydrophobicContact CG-CD2 3.73Å; F170-F236 HydrophobicContact CG-CE1 4.04Å; F170-F236 AromaticContact CG-CE2 3.99Å; F170-F236 HydrophobicContact CG-CE2 3.99Å; F170-F236 AromaticContact CG-CG 3.6Å; F170-F236 HydrophobicContact CG-CG 3.6Å; F170-F236 HydrophobicContact CG-CZ 4.12Å; F170-F236 HydrophobicContact CZ-CB 4.14Å; F170-F236 HydrophobicContact CZ-CD2 4.48Å; F170-F236 HydrophobicContact CZ-CG 4.47Å; F170-V259 HydrophobicContact CE2-CG1 3.49Å; F170-V259 VanDerWaalsContact CE2-CG1 3.49Å; F170-V259 HydrophobicContact CZ-CG1 4.06Å; F170-A261 HydrophobicContact CE1-CB 3.74Å; F170-A261 HydrophobicContact CZ-CB 3.95Å; F170-L279 HydrophobicContact CE2-CD1 4.04Å; F170-L279 HydrophobicContact CE2-CD2 4.16Å; F170-L279 HydrophobicContact CZ-CD1 4.33Å; F170-L279 HydrophobicContact CZ-CD2 3.83Å; F170-F445 HydrophobicContact CZ-CE2 4.5Å; F170-F445 HydrophobicContact CZ-CZ 4.38Å
171	K	98.3	Very high	98.4	Very high	157 Å²	157	50 Å²	50	68%	0.683	28%	0.281	S	S	*	.	H	α-helix	trans	-61.6	-47.3	176.3	179.5	-172.9	172.4	-166.6	0	111.6	H167 S168 F169 S173 G174	H167-K171 VanDerWaalsContact O-CB 3.23Å; H167-K171 WeakPolarHBondContact O-CB 3.48Å; H167-K171 PolarHBondContact O-N 3.23Å; S168-K171 PolarHBondContact O-N 3.45Å; F169-K171 VanDerWaalsContact C-N 3.35Å; F169-K171 PolarHBondContact O-N 2.97Å; K171-S173 VanDerWaalsContact C-N 3.28Å; K171-S173 PolarHBondContact O-N 2.97Å; K171-G174 PolarHBondContact O-N 2.79Å; K171-G174 VanDerWaalsContact O-N 3.1Å
172	D	98.3	Very high	98.4	Very high	131 Å²	131	51.1 Å²	51.1	70%	0.701	29%	0.288	S	S	*	.	H	α-helix	trans	-71.1	-27.8	-177.3	-65.4	-16.6	0	0	0	111.5	S168 F169 G174	S168-D172 VanDerWaalsContact O-CB 3.31Å; S168-D172 WeakPolarHBondContact O-CB 3.35Å; S168-D172 PolarHBondContact O-N 3.43Å; F169-D172 PolarHBondContact O-N 3Å; D172-G174 VanDerWaalsContact C-N 3.28Å; D172-G174 PolarHBondContact O-N 2.75Å
173	S	97.6	Very high	98.2	Very high	47 Å²	47	55.1 Å²	55.1	33%	0.329	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.5	1.6	171	-60.7	0	0	0	0	114.1	F169 F170 K171	F169-S173 VanDerWaalsContact O-CB 3.31Å; F169-S173 WeakPolarHBondContact O-CB 3.3Å; F169-S173 PolarHBondContact O-N 3.48Å; F169-S173 PolarHBondContact O-OG 3.49Å; F169-S173 VanDerWaalsContact O-OG 3.05Å; F170-S173 CarbonylContact O-C 3.6Å; F170-S173 PolarHBondContact O-N 3.05Å; K171-S173 VanDerWaalsContact C-N 3.28Å; K171-S173 PolarHBondContact O-N 2.97Å
174	G	97.8	Very high	98	Very high	52 Å²	52	53.6 Å²	53.6	54%	0.536	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	81.4	15	173.9	0	0	0	0	0	115.9	F170 K171 D172	F170-G174 PolarHBondContact O-N 2.84Å; F170-G174 VanDerWaalsContact O-N 3.16Å; K171-G174 PolarHBondContact O-N 2.79Å; K171-G174 VanDerWaalsContact O-N 3.1Å; D172-G174 VanDerWaalsContact C-N 3.28Å; D172-G174 PolarHBondContact O-N 2.75Å
175	F	98.6	Very high	97.5	Very high	14 Å²	14	54.3 Å²	54.3	6%	0.061	30%	0.301	C	S	.	.	P	Polyproline II helix	trans	-75.8	145.2	175.8	-72.8	-114.7	0	0	0	111.6	F170 Q234 F236 A261 I263 V275	F170-F175 HydrophobicContact CB-CB 4.03Å; F170-F175 HydrophobicContact CB-CG 4.47Å; F170-F175 HydrophobicContact CD1-CB 3.92Å; F170-F175 AromaticContact CD1-CD1 3.67Å; F170-F175 HydrophobicContact CD1-CD1 3.67Å; F170-F175 AromaticContact CD1-CD2 3.75Å; F170-F175 HydrophobicContact CD1-CD2 3.75Å; F170-F175 HydrophobicContact CD1-CE1 4.09Å; F170-F175 HydrophobicContact CD1-CE2 4.14Å; F170-F175 AromaticContact CD1-CG 3.51Å; F170-F175 HydrophobicContact CD1-CG 3.51Å; F170-F175 HydrophobicContact CD1-CZ 4.3Å; F170-F175 AromaticContact CE1-CD1 3.95Å; F170-F175 HydrophobicContact CE1-CD1 3.95Å; F170-F175 HydrophobicContact CE1-CD2 4.48Å; F170-F175 AromaticContact CE1-CE1 3.98Å; F170-F175 HydrophobicContact CE1-CE1 3.98Å; F170-F175 HydrophobicContact CE1-CE2 4.47Å; F170-F175 HydrophobicContact CE1-CG 4.23Å; F170-F175 HydrophobicContact CE1-CZ 4.24Å; F170-F175 HydrophobicContact CG-CB 4.41Å; F170-F175 HydrophobicContact CG-CG 4.44Å; F170-F175 WeakPolarHBondContact O-CB 3.11Å; F170-F175 PolarHBondContact O-N 3Å; F175-Q234 WeakPolarHBondContact CA-O 3.14Å; F175-Q234 HydrophobicContact CB-CB 4.45Å; F175-Q234 HydrophobicContact CD1-CB 3.72Å; F175-Q234 HydrophobicContact CD2-CB 4.08Å; F175-Q234 HydrophobicContact CE1-CB 3.88Å; F175-Q234 HydrophobicContact CE1-CG 4.31Å; F175-Q234 HydrophobicContact CE2-CB 4.23Å; F175-Q234 HydrophobicContact CE2-CG 4.35Å; F175-Q234 HydrophobicContact CG-CB 3.81Å; F175-Q234 HydrophobicContact CZ-CB 4.13Å; F175-Q234 HydrophobicContact CZ-CG 4.17Å; F175-F236 HydrophobicContact CB-CD1 3.71Å; F175-F236 HydrophobicContact CB-CE1 4.27Å; F175-F236 HydrophobicContact CD1-CB 4.3Å; F175-A261 HydrophobicContact CE1-CB 4.01Å; F175-I263 HydrophobicContact CE1-CD1 4.15Å; F175-I263 HydrophobicContact CE1-CG1 3.7Å; F175-I263 HydrophobicContact CZ-CD1 3.83Å; F175-I263 HydrophobicContact CZ-CG1 3.8Å; F175-V275 HydrophobicContact CZ-CG1 4.32Å
176	V	98.7	Very high	96.8	Very high	58 Å²	58	55.1 Å²	55.1	35%	0.352	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	125.7	171.7	-174.9	0	0	0	0	109.7	I178 F232 Q234 V235 F236	V176-I178 HydrophobicContact CB-CD1 4.47Å; V176-I178 HydrophobicContact CG1-CD1 3.84Å; V176-I178 PolarHBondContact O-N 3.42Å; V176-F232 HydrophobicContact CG2-CB 4.28Å; V176-F232 HydrophobicContact CG2-CD1 4Å; V176-F232 HydrophobicContact CG2-CG 4.24Å; V176-Q234 PolarHBondContact N-O 3.13Å; V176-V235 HydrophobicContact CB-CG1 4.41Å; V176-V235 WeakPolarHBondContact O-CA 3.47Å; V176-F236 PolarHBondContact O-N 3.27Å
177	H	98.7	Very high	95.9	Very high	64 Å²	64	56.9 Å²	56.9	30%	0.296	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76	122.3	174.6	-174.1	-141.9	0	0	0	110.7	H167 H179 F236 F238	H167-H177 AromaticContact CE1-CE1 3.65Å; H167-H177 AromaticContact CE1-ND1 3.93Å; H167-H177 AromaticContact CE1-NE2 3.81Å; H177-H179 AromaticContact CE1-CD2 3.45Å; H177-H179 PolarHBondContact CE1-CD2 3.18Å; H177-H179 VanDerWaalsContact CE1-CD2 3.45Å; H177-H179 AromaticContact CE1-NE2 3.23Å; H177-H179 PolarHBondContact CE1-NE2 3.05Å; H177-H179 AromaticContact ND1-NE2 3.74Å; H177-H179 AromaticContact NE2-CD2 3.93Å; H177-F236 CarbonylContact C-O 3.57Å; H177-F236 VanDerWaalsContact CA-CE1 3.47Å; H177-F236 WeakPolarHBondContact CA-O 3.22Å; H177-F236 HydrophobicContact CB-CD1 4.18Å; H177-F236 HydrophobicContact CB-CE1 3.45Å; H177-F236 VanDerWaalsContact CB-CE1 3.45Å; H177-F236 HydrophobicContact CB-CE2 4.45Å; H177-F236 HydrophobicContact CB-CZ 3.62Å; H177-F236 AromaticContact CD2-CE2 3.63Å; H177-F236 AromaticContact CD2-CZ 3.69Å; H177-F236 PolarHBondContact CD2-O 3.41Å; H177-F236 AromaticContact CG-CZ 3.76Å; H177-F238 PolarHBondContact NE2-N 2.9Å
178	I	98.6	Very high	94.5	Very high	21 Å²	21	54.1 Å²	54.1	11%	0.108	30%	0.303	C	S	.	.			trans	-114.6	125.9	-179.8	-56.5	-53.8	0	0	0	108.9	V176 T180 L225 M228 V235 F236 T237	V176-I178 HydrophobicContact CB-CD1 4.47Å; V176-I178 HydrophobicContact CG1-CD1 3.84Å; V176-I178 PolarHBondContact O-N 3.42Å; I178-T180 HydrophobicContact CG2-CG2 4.2Å; I178-T180 PolarHBondContact O-N 3.12Å; I178-L225 HydrophobicContact CB-CD2 3.91Å; I178-L225 HydrophobicContact CG1-CD2 4.3Å; I178-L225 HydrophobicContact CG2-CD2 4.24Å; I178-M228 HydrophobicContact CD1-CB 4.49Å; I178-M228 HydrophobicContact CD1-CE 3.75Å; I178-M228 HydrophobicContact CD1-CG 4.37Å; I178-M228 HydrophobicContact CG1-CB 4.17Å; I178-M228 HydrophobicContact CG1-CG 4.14Å; I178-M228 HydrophobicContact CG2-CG 3.82Å; I178-V235 HydrophobicContact CD1-CG1 4.42Å; I178-V235 HydrophobicContact CG1-CB 3.89Å; I178-V235 HydrophobicContact CG1-CG1 3.98Å; I178-F236 PolarHBondContact N-O 3.3Å; I178-T237 WeakPolarHBondContact O-CA 3.4Å; I178-T237 VanDerWaalsContact O-CB 3.24Å; I178-T237 WeakPolarHBondContact O-CB 3.25Å; I178-T237 PolarHBondContact O-OG1 2.92Å; I178-T237 VanDerWaalsContact O-OG1 3.05Å
179	H	98.4	Very high	93.1	Very high	160 Å²	160	54.3 Å²	54.3	74%	0.741	30%	0.298	S	S	*	.			trans	-82.6	104.2	166.2	-62.9	141.9	0	0	0	109.7	H177	H177-H179 AromaticContact CE1-CD2 3.45Å; H177-H179 PolarHBondContact CE1-CD2 3.18Å; H177-H179 VanDerWaalsContact CE1-CD2 3.45Å; H177-H179 AromaticContact CE1-NE2 3.23Å; H177-H179 PolarHBondContact CE1-NE2 3.05Å; H177-H179 AromaticContact ND1-NE2 3.74Å; H177-H179 AromaticContact NE2-CD2 3.93Å
180	T	97.8	Very high	91.5	Very high	25 Å²	25	56.1 Å²	56.1	15%	0.153	32%	0.321	C	S	.	.			trans	-77.1	149.5	174.1	51.5	0	0	0	0	111	I178 H224 L225 T237	I178-T180 HydrophobicContact CG2-CG2 4.2Å; I178-T180 PolarHBondContact O-N 3.12Å; T180-H224 HydrophobicContact CG2-CB 3.82Å; T180-L225 HydrophobicContact CG2-CD2 3.9Å; T180-L225 HydrophobicContact CG2-CG 4.08Å; T180-T237 HydrophobicContact CG2-CG2 4.32Å; T180-T237 PolarHBondContact OG1-OG1 3.16Å
181	P	96.9	Very high	89.8	Confident	57 Å²	57	59.3 Å²	59.3	37%	0.37	35%	0.347	S	S	.	.			trans	-67.3	142.5	179.7	28.7	-34.7	0	0	0	111.6	H224	P181-H224 VanDerWaalsContact CG-CE1 3.43Å; P181-H224 WeakPolarHBondContact CG-CE1 3.48Å; P181-H224 WeakPolarHBondContact CG-NE2 3.4Å
182	I	97.3	Very high	88.3	Confident	71 Å²	71	54.6 Å²	54.6	36%	0.364	34%	0.344	S	S	.	.	S	Bend	trans	-85.6	-38.8	175.7	-66.1	169.1	0	0	0	111.1	L217 T218 P240 F242	I182-L217 HydrophobicContact CG2-CD2 3.76Å; I182-T218 WeakPolarHBondContact O-CB 3.28Å; I182-T218 PolarHBondContact O-N 2.97Å; I182-P240 HydrophobicContact CD1-CG 3.69Å; I182-P240 HydrophobicContact CG1-CG 4.22Å; I182-F242 HydrophobicContact CG2-CE2 3.68Å; I182-F242 HydrophobicContact CG2-CZ 4.32Å
183	I	96.1	Very high	87.5	Confident	84 Å²	84	52 Å²	52	43%	0.431	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	126.3	175.5	-58.1	178.4	0	0	0	107.8	L197 F211 A215 F216	I183-L197 HydrophobicContact CB-CD1 4.32Å; I183-L197 HydrophobicContact CD1-CD1 4.21Å; I183-L197 HydrophobicContact CG1-CD1 3.75Å; I183-L197 HydrophobicContact CG2-CD1 4Å; I183-F211 HydrophobicContact CD1-CZ 4.29Å; I183-F211 HydrophobicContact CG2-CD2 4.38Å; I183-F211 HydrophobicContact CG2-CE2 3.74Å; I183-F211 HydrophobicContact CG2-CZ 4.09Å; I183-A215 HydrophobicContact CG2-CB 4.03Å; I183-F216 WeakPolarHBondContact CA-O 3.28Å
184	T	92.6	Very high	87.1	Confident	10 Å²	10	51.2 Å²	51.2	6%	0.061	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	151.7	-175	-176	0	0	0	0	111.2	N186 F216	T184-N186 WeakPolarHBondContact CG2-O 3.49Å; T184-N186 WeakPolarHBondContact OG1-CB 3.38Å; T184-N186 PolarHBondContact OG1-N 2.96Å; T184-F216 PolarHBondContact N-O 2.89Å; T184-F216 PolarHBondContact O-N 2.82Å
185	S	89.9	Confident	86.9	Confident	61 Å²	61	52.5 Å²	52.5	43%	0.427	31%	0.31	S	S	.	.	S	Bend	trans	-93.6	-5.3	164.5	57.1	0	0	0	0	112.5	P214	S185-P214 WeakPolarHBondContact CA-O 3.32Å; S185-P214 WeakPolarHBondContact CB-O 3.39Å
186	N	82.8	Confident	86.6	Confident	18 Å²	18	57 Å²	57	10%	0.096	33%	0.332	C	S	.	.			trans	-92.9	137.2	-174.6	-54.6	-34.1	0	0	0	110.9	T184 L223 Y428	T184-N186 WeakPolarHBondContact CG2-O 3.49Å; T184-N186 WeakPolarHBondContact OG1-CB 3.38Å; T184-N186 PolarHBondContact OG1-N 2.96Å; N186-L223 HydrophobicContact CB-CD1 4.41Å; N186-Y428 HydrophobicContact CB-CE1 4.43Å
187	D	80.8	Confident	86.3	Confident	36 Å²	36	57.2 Å²	57.2	19%	0.193	33%	0.33	C	S	.	.			trans	-97.8	95.9	160.8	-171.5	-8	0	0	0	108.4	E189 G190 A191 G192 L194 Y428	D187-E189 VanDerWaalsContact C-N 3.33Å; D187-E189 PolarHBondContact O-N 3.39Å; D187-E189 PolarHBondContact OD1-N 2.96Å; D187-G190 VanDerWaalsContact CG-N 3.31Å; D187-G190 PolarHBondContact OD1-N 2.77Å; D187-G190 WeakPolarHBondContact OD2-CA 3.49Å; D187-A191 PolarHBondContact OD2-N 2.96Å; D187-G192 PolarHBondContact OD2-N 3.44Å; D187-G192 VanDerWaalsContact OD2-N 3.16Å; D187-L194 HydrophobicContact CB-CD1 3.85Å; D187-Y428 PolarHBondContact N-OH 3.16Å; D187-Y428 PolarHBondContact O-OH 3.29Å
188	S	70.1	Confident	85.9	Confident	4 Å²	4	61.2 Å²	61.2	3%	0.028	35%	0.349	C	S	.	.	S	Bend	trans	-69.5	-29.6	-176.6	52.7	0	0	0	0	113	V219 Y377	S188-V219 WeakPolarHBondContact OG-CG2 3.45Å; S188-Y377 VanDerWaalsContact O-CE1 3.27Å; S188-Y377 WeakPolarHBondContact O-CE1 3.21Å
189	E	69.4	Low	85.4	Confident	54 Å²	54	62.8 Å²	62.8	25%	0.252	36%	0.361	S	S	.	.	S	Bend	trans	-97.9	-16.9	-177.6	-67.8	-176.5	-171	0	0	112.8	D187 A191 V219 R243	D187-E189 VanDerWaalsContact C-N 3.33Å; D187-E189 PolarHBondContact O-N 3.39Å; D187-E189 PolarHBondContact OD1-N 2.96Å; E189-A191 PolarHBondContact O-N 3.3Å; E189-V219 HydrophobicContact CB-CG2 4.09Å; E189-V219 HydrophobicContact CG-CG2 3.83Å; E189-R243 VanDerWaalsContact CD-NH2 3.33Å; E189-R243 IonicContact OE1-CZ 3.36Å; E189-R243 IonicContact OE1-NE 3.93Å; E189-R243 IonicContact OE1-NH2 3.26Å; E189-R243 PolarHBondContact OE1-NH2 3.38Å; E189-R243 IonicContact OE2-CZ 3.83Å; E189-R243 IonicContact OE2-NE 2.72Å; E189-R243 IonicContact OE2-NH2 2.81Å; E189-R243 PolarHBondContact OE2-NH2 3.49Å
190	G	63.8	Low	84.8	Confident	55 Å²	55	61.8 Å²	61.8	57%	0.567	37%	0.372	S	S	*	.			trans	69.3	14.7	177.6	0	0	0	0	0	113.8	D187	D187-G190 VanDerWaalsContact CG-N 3.31Å; D187-G190 PolarHBondContact OD1-N 2.77Å; D187-G190 WeakPolarHBondContact OD2-CA 3.49Å
191	A	63.2	Low	84	Confident	66 Å²	66	62.8 Å²	62.8	55%	0.545	39%	0.387	S	S	.	.	S	Bend	trans	-87.3	-10.7	-175.6	0	0	0	0	0	113	D187 E189 E193	D187-A191 PolarHBondContact OD2-N 2.96Å; E189-A191 PolarHBondContact O-N 3.3Å; A191-E193 PolarHBondContact O-N 3.45Å
192	G	66.6	Low	83	Confident	59 Å²	59	70.2 Å²	70.2	61%	0.608	41%	0.413	S	S	*	.			trans	72.1	2.7	176.3	0	0	0	0	0	115.7	D187 L194	D187-G192 PolarHBondContact OD2-N 3.44Å; D187-G192 VanDerWaalsContact OD2-N 3.16Å; G192-L194 VanDerWaalsContact C-N 3.27Å; G192-L194 PolarHBondContact O-N 3.3Å; G192-L194 VanDerWaalsContact O-N 3.12Å
193	E	81.5	Confident	82.1	Confident	76 Å²	76	69.9 Å²	69.9	36%	0.355	41%	0.412	S	S	.	.			trans	-88.4	57.4	179.1	-60	-166.7	142.1	0	0	112	A191 A244 E245	A191-E193 PolarHBondContact O-N 3.45Å; E193-A244 WeakPolarHBondContact O-CB 3.35Å; E193-A244 PolarHBondContact O-N 3.02Å; E193-E245 WeakPolarHBondContact OE1-CG 3.22Å; E193-E245 VanDerWaalsContact OE2-CB 3.27Å; E193-E245 WeakPolarHBondContact OE2-CB 3.4Å
194	L	89.9	Confident	80.9	Confident	30 Å²	30	76 Å²	76	16%	0.157	44%	0.435	C	S	.	.	P	Polyproline II helix	trans	-101.1	143.5	-175.8	-58	179.1	0	0	0	112.5	D187 G192 F216 V219	D187-L194 HydrophobicContact CB-CD1 3.85Å; G192-L194 VanDerWaalsContact C-N 3.27Å; G192-L194 PolarHBondContact O-N 3.3Å; G192-L194 VanDerWaalsContact O-N 3.12Å; L194-F216 HydrophobicContact CB-CB 4.2Å; L194-F216 HydrophobicContact CB-CD1 3.78Å; L194-F216 HydrophobicContact CB-CE1 4.5Å; L194-F216 HydrophobicContact CB-CG 4.14Å; L194-F216 HydrophobicContact CD1-CB 4.19Å; L194-F216 HydrophobicContact CD1-CD1 3.96Å; L194-F216 HydrophobicContact CD1-CD2 4.02Å; L194-F216 HydrophobicContact CD1-CE1 4.37Å; L194-F216 HydrophobicContact CD1-CE2 4.4Å; L194-F216 HydrophobicContact CD1-CG 3.78Å; L194-V219 HydrophobicContact CD2-CG1 3.34Å
195	F	93.6	Very high	79.9	Confident	80 Å²	80	78.6 Å²	78.6	35%	0.351	45%	0.451	S	S	.	.	P	Polyproline II helix	trans	-84.3	117.5	163.4	-73.5	-75.7	0	0	0	109.8	F216 L217 F242 R243 A244 A254	F195-F216 CarbonylContact O-C 3.59Å; F195-F216 WeakPolarHBondContact O-CA 3.2Å; F195-L217 HydrophobicContact CB-CB 4.23Å; F195-L217 HydrophobicContact CB-CD1 3.94Å; F195-L217 HydrophobicContact CB-CG 4.28Å; F195-L217 HydrophobicContact CG-CD1 4.44Å; F195-L217 PolarHBondContact O-N 3Å; F195-F242 HydrophobicContact CD2-CB 3.98Å; F195-F242 HydrophobicContact CE2-CB 4.45Å; F195-R243 WeakPolarHBondContact CE2-O 3.33Å; F195-A244 HydrophobicContact CD1-CB 4.26Å; F195-A244 HydrophobicContact CD2-CB 4.06Å; F195-A244 HydrophobicContact CE1-CB 4.13Å; F195-A244 HydrophobicContact CE2-CB 3.94Å; F195-A244 HydrophobicContact CG-CB 4.22Å; F195-A244 HydrophobicContact CZ-CB 3.97Å; F195-A254 HydrophobicContact CE2-CB 4.08Å; F195-A254 HydrophobicContact CZ-CB 4.01Å
196	Q	92.8	Very high	78.5	Confident	109 Å²	109	81 Å²	81	51%	0.509	47%	0.465	S	S	.	.	B	Isolated β-bridge	trans	-79.1	139.4	173.4	-174.8	172.2	-23.6	0	0	111.3	E198 F216	Q196-E198 PolarHBondContact NE2-OE1 3.42Å; Q196-E198 VanDerWaalsContact NE2-OE1 3.13Å; Q196-F216 HydrophobicContact CB-CD1 4.03Å; Q196-F216 HydrophobicContact CB-CE1 4.07Å; Q196-F216 HydrophobicContact CG-CD1 4.4Å; Q196-F216 HydrophobicContact CG-CE1 4.17Å
197	L	91.7	Very high	77.8	Confident	61 Å²	61	89.5 Å²	89.5	32%	0.319	50%	0.504	S	S	.	.			trans	-107.9	127	-179.7	-65.2	174.2	0	0	0	110.7	I183 A215 L217	I183-L197 HydrophobicContact CB-CD1 4.32Å; I183-L197 HydrophobicContact CD1-CD1 4.21Å; I183-L197 HydrophobicContact CG1-CD1 3.75Å; I183-L197 HydrophobicContact CG2-CD1 4Å; L197-A215 HydrophobicContact CB-CB 4.47Å; L197-A215 PolarHBondContact N-O 3.12Å; L197-L217 HydrophobicContact CD1-CD2 3.86Å; L197-L217 HydrophobicContact CD1-CG 4.15Å; L197-L217 HydrophobicContact CD2-CD1 4.34Å; L197-L217 HydrophobicContact CD2-CD2 4.07Å; L197-L217 HydrophobicContact CD2-CG 3.9Å; L197-L217 HydrophobicContact CG-CD2 4.35Å; L197-L217 HydrophobicContact CG-CG 4.15Å
198	E	89.9	Confident	77.8	Confident	148 Å²	148	92.5 Å²	92.5	69%	0.692	52%	0.517	S	S	*	.			trans	-129.9	139.4	174.9	-64.6	-174.7	172.5	0	0	110.3	Q196	Q196-E198 PolarHBondContact NE2-OE1 3.42Å; Q196-E198 VanDerWaalsContact NE2-OE1 3.13Å
199	P	87.9	Confident	78.5	Confident	54 Å²	54	95.2 Å²	95.2	35%	0.351	53%	0.532	S	S	.	.			trans	-64.9	139.7	173.6	28.8	-33.8	0	0	0	110	G201 L203 F210	P199-G201 PolarHBondContact O-N 2.9Å; P199-L203 HydrophobicContact CG-CD1 3.94Å; P199-L203 HydrophobicContact CG-CD2 4.05Å; P199-L203 HydrophobicContact CG-CG 3.95Å; P199-F210 HydrophobicContact CB-CD2 4.28Å; P199-F210 HydrophobicContact CG-CB 4.19Å; P199-F210 HydrophobicContact CG-CD2 4.34Å
200	S	85.8	Confident	79.4	Confident	139 Å²	139	98.8 Å²	98.8	97%	0.972	55%	0.546	S	S	*	.	S	Bend	trans	-69.3	-23.1	178.3	59	0	0	0	0	113.6
201	G	82.1	Confident	80.6	Confident	46 Å²	46	100.9 Å²	100.9	47%	0.474	54%	0.54	S	S	.	.	S	Bend	trans	-83.5	149.3	176.3	0	0	0	0	0	112.1	P199 L203	P199-G201 PolarHBondContact O-N 2.9Å; G201-L203 PolarHBondContact O-N 2.88Å
202	K	75	Confident	81.8	Confident	214 Å²	214	104.3 Å²	104.3	93%	0.93	55%	0.549	S	S	*	.	P	Polyproline II helix	trans	-63.7	124.1	172.3	-67.2	-173.9	178.7	-175.2	0	109.9
203	L	78.1	Confident	82.9	Confident	63 Å²	63	104.7 Å²	104.7	33%	0.33	54%	0.539	S	S	.	.	P	Polyproline II helix	trans	-67.3	151.1	166.7	-67.2	171.9	0	0	0	109.6	P199 G201 V205 E208 F210	P199-L203 HydrophobicContact CG-CD1 3.94Å; P199-L203 HydrophobicContact CG-CD2 4.05Å; P199-L203 HydrophobicContact CG-CG 3.95Å; G201-L203 PolarHBondContact O-N 2.88Å; L203-V205 PolarHBondContact O-N 3.48Å; L203-E208 WeakPolarHBondContact CD1-O 3.46Å; L203-F210 HydrophobicContact CD2-CD2 4.48Å
204	K	71.8	Confident	83.2	Confident	213 Å²	213	104 Å²	104	93%	0.926	54%	0.542	S	S	*	.	S	Bend	trans	-63.8	-29.3	-175	-72.4	-176.2	-179.9	177.3	0	112.2
205	V	72.3	Confident	83.4	Confident	65 Å²	65	103 Å²	103	39%	0.394	54%	0.538	S	S	.	.	S	Bend	trans	-115.4	125.1	177.2	-174.6	0	0	0	0	107.6	L203 E207 E208	L203-V205 PolarHBondContact O-N 3.48Å; V205-E207 PolarHBondContact O-N 3.41Å; V205-E208 HydrophobicContact CB-CB 4.36Å; V205-E208 VanDerWaalsContact CB-CD 3.43Å; V205-E208 HydrophobicContact CB-CG 3.79Å; V205-E208 HydrophobicContact CG1-CG 4.09Å; V205-E208 HydrophobicContact CG2-CG 4.48Å; V205-E208 WeakPolarHBondContact CG2-OE1 3.35Å; V205-E208 PolarHBondContact O-N 3.48Å
206	P	59.6	Low	83.4	Confident	110 Å²	110	101 Å²	101	71%	0.714	53%	0.529	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.6	135.1	168.6	-17.8	30.4	0	0	0	109.1
207	E	68.6	Low	83.6	Confident	197 Å²	197	97.4 Å²	97.4	92%	0.921	51%	0.513	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.5	-0.1	-179.8	-49.1	175.2	-179.3	0	0	117.2	V205	V205-E207 PolarHBondContact O-N 3.41Å
208	E	80.4	Confident	83.7	Confident	100 Å²	100	94.8 Å²	94.8	47%	0.467	50%	0.499	S	S	.	.			trans	-74.9	140.9	168	-81.9	179.8	178	0	0	111.1	L203 V205	L203-E208 WeakPolarHBondContact CD1-O 3.46Å; V205-E208 HydrophobicContact CB-CB 4.36Å; V205-E208 VanDerWaalsContact CB-CD 3.43Å; V205-E208 HydrophobicContact CB-CG 3.79Å; V205-E208 HydrophobicContact CG1-CG 4.09Å; V205-E208 HydrophobicContact CG2-CG 4.48Å; V205-E208 WeakPolarHBondContact CG2-OE1 3.35Å; V205-E208 PolarHBondContact O-N 3.48Å
209	N	84.4	Confident	84	Confident	61 Å²	61	88 Å²	88	33%	0.326	47%	0.468	S	S	.	.			trans	-87.3	147.7	166.9	-71.3	-54.9	0	0	0	109.9	F211 N212 V213	N209-F211 PolarHBondContact O-N 3.32Å; N209-F211 VanDerWaalsContact O-N 3.17Å; N209-N212 PolarHBondContact O-N 3.23Å; N209-V213 WeakPolarHBondContact CB-O 3.47Å
210	F	88.3	Confident	84.3	Confident	128 Å²	128	85.7 Å²	85.7	56%	0.561	45%	0.454	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.4	-36.3	178.5	-176.2	-89.1	0	0	0	113	P199 L203	P199-F210 HydrophobicContact CB-CD2 4.28Å; P199-F210 HydrophobicContact CG-CB 4.19Å; P199-F210 HydrophobicContact CG-CD2 4.34Å; L203-F210 HydrophobicContact CD2-CD2 4.48Å
211	F	89.7	Confident	84.9	Confident	100 Å²	100	79.1 Å²	79.1	44%	0.439	41%	0.408	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.1	16.8	178.8	-62	-77.2	0	0	0	113.1	I183 N209 V213 A215	I183-F211 HydrophobicContact CD1-CZ 4.29Å; I183-F211 HydrophobicContact CG2-CD2 4.38Å; I183-F211 HydrophobicContact CG2-CE2 3.74Å; I183-F211 HydrophobicContact CG2-CZ 4.09Å; N209-F211 PolarHBondContact O-N 3.32Å; N209-F211 VanDerWaalsContact O-N 3.17Å; F211-V213 HydrophobicContact CB-CG2 4.24Å; F211-V213 PolarHBondContact O-N 2.64Å; F211-A215 HydrophobicContact CD2-CB 3.59Å; F211-A215 HydrophobicContact CE2-CB 4.05Å
212	N	88.8	Confident	85.6	Confident	137 Å²	137	77.7 Å²	77.7	73%	0.733	39%	0.389	S	S	*	.	S	Bend	trans	58.7	-0.2	-169.9	-55.3	-43.1	0	0	0	115.2	N209	N209-N212 PolarHBondContact O-N 3.23Å
213	V	88.7	Confident	86.6	Confident	67 Å²	67	67.7 Å²	67.7	41%	0.406	35%	0.345	S	S	.	.	S	Bend	trans	-137.2	156.6	173.6	-62.7	0	0	0	0	108.9	N209 F211 A215	N209-V213 WeakPolarHBondContact CB-O 3.47Å; F211-V213 HydrophobicContact CB-CG2 4.24Å; F211-V213 PolarHBondContact O-N 2.64Å; V213-A215 PolarHBondContact O-N 2.66Å
214	P	88.8	Confident	87.5	Confident	62 Å²	62	67 Å²	67	40%	0.403	34%	0.34	S	S	.	.			trans	-54.8	138.6	170.6	-24.5	35.1	0	0	0	110.9	S185 F216	S185-P214 WeakPolarHBondContact CA-O 3.32Å; S185-P214 WeakPolarHBondContact CB-O 3.39Å; P214-F216 HydrophobicContact CB-CE2 3.76Å; P214-F216 HydrophobicContact CB-CZ 3.64Å
215	A	92.6	Very high	88.8	Confident	9 Å²	9	56.8 Å²	56.8	7%	0.074	30%	0.296	C	S	.	.			trans	-123.4	139	-179.3	0	0	0	0	0	110.6	I183 L197 F211 V213	I183-A215 HydrophobicContact CG2-CB 4.03Å; L197-A215 HydrophobicContact CB-CB 4.47Å; L197-A215 PolarHBondContact N-O 3.12Å; F211-A215 HydrophobicContact CD2-CB 3.59Å; F211-A215 HydrophobicContact CE2-CB 4.05Å; V213-A215 PolarHBondContact O-N 2.66Å
216	F	94.6	Very high	90	Very high	39 Å²	39	54 Å²	54	17%	0.171	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	161.2	-174.7	-50.5	-80	0	0	0	110.6	I183 T184 L194 F195 Q196 P214	I183-F216 WeakPolarHBondContact CA-O 3.28Å; T184-F216 PolarHBondContact N-O 2.89Å; T184-F216 PolarHBondContact O-N 2.82Å; L194-F216 HydrophobicContact CB-CB 4.2Å; L194-F216 HydrophobicContact CB-CD1 3.78Å; L194-F216 HydrophobicContact CB-CE1 4.5Å; L194-F216 HydrophobicContact CB-CG 4.14Å; L194-F216 HydrophobicContact CD1-CB 4.19Å; L194-F216 HydrophobicContact CD1-CD1 3.96Å; L194-F216 HydrophobicContact CD1-CD2 4.02Å; L194-F216 HydrophobicContact CD1-CE1 4.37Å; L194-F216 HydrophobicContact CD1-CE2 4.4Å; L194-F216 HydrophobicContact CD1-CG 3.78Å; F195-F216 CarbonylContact O-C 3.59Å; F195-F216 WeakPolarHBondContact O-CA 3.2Å; Q196-F216 HydrophobicContact CB-CD1 4.03Å; Q196-F216 HydrophobicContact CB-CE1 4.07Å; Q196-F216 HydrophobicContact CG-CD1 4.4Å; Q196-F216 HydrophobicContact CG-CE1 4.17Å; P214-F216 HydrophobicContact CB-CE2 3.76Å; P214-F216 HydrophobicContact CB-CZ 3.64Å
217	L	96.1	Very high	91.8	Very high	32 Å²	32	51.6 Å²	51.6	17%	0.168	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	134.4	161.9	-66.5	174.3	0	0	0	109.7	I182 F195 L197 F242	I182-L217 HydrophobicContact CG2-CD2 3.76Å; F195-L217 HydrophobicContact CB-CB 4.23Å; F195-L217 HydrophobicContact CB-CD1 3.94Å; F195-L217 HydrophobicContact CB-CG 4.28Å; F195-L217 HydrophobicContact CG-CD1 4.44Å; F195-L217 PolarHBondContact O-N 3Å; L197-L217 HydrophobicContact CD1-CD2 3.86Å; L197-L217 HydrophobicContact CD1-CG 4.15Å; L197-L217 HydrophobicContact CD2-CD1 4.34Å; L197-L217 HydrophobicContact CD2-CD2 4.07Å; L197-L217 HydrophobicContact CD2-CG 3.9Å; L197-L217 HydrophobicContact CG-CD2 4.35Å; L197-L217 HydrophobicContact CG-CG 4.15Å; L217-F242 HydrophobicContact CB-CB 3.83Å; L217-F242 HydrophobicContact CB-CD1 4.41Å; L217-F242 HydrophobicContact CB-CD2 3.6Å; L217-F242 HydrophobicContact CB-CE2 4.27Å; L217-F242 HydrophobicContact CB-CG 3.68Å; L217-F242 HydrophobicContact CD1-CB 4.39Å; L217-F242 HydrophobicContact CD1-CD1 3.68Å; L217-F242 HydrophobicContact CD1-CD2 4.25Å; L217-F242 HydrophobicContact CD1-CE1 3.93Å; L217-F242 HydrophobicContact CD1-CE2 4.5Å; L217-F242 HydrophobicContact CD1-CG 3.84Å; L217-F242 HydrophobicContact CD1-CZ 4.34Å; L217-F242 HydrophobicContact CD2-CD2 4.34Å; L217-F242 HydrophobicContact CD2-CE2 4.17Å; L217-F242 HydrophobicContact CD2-CZ 4.36Å; L217-F242 HydrophobicContact CG-CD2 4.28Å; L217-F242 HydrophobicContact CG-CG 4.28Å
218	T	95.4	Very high	93.2	Very high	6 Å²	6	45 Å²	45	4%	0.037	23%	0.232	C	C	.	.			trans	-66.6	139.1	-175	-166	0	0	0	0	113.1	I182 S220 T241 F242	I182-T218 WeakPolarHBondContact O-CB 3.28Å; I182-T218 PolarHBondContact O-N 2.97Å; T218-S220 PolarHBondContact OG1-N 3.12Å; T218-S220 PolarHBondContact OG1-O 3.14Å; T218-T241 WeakPolarHBondContact O-CA 3.32Å; T218-F242 PolarHBondContact O-N 3.43Å
219	V	94.6	Very high	94	Very high	6 Å²	6	40.6 Å²	40.6	4%	0.036	21%	0.212	C	C	.	.	S	Bend	trans	-85.5	-23.5	168.6	-61.7	0	0	0	0	111.6	S188 E189 L194 T241 F242 R243	S188-V219 WeakPolarHBondContact OG-CG2 3.45Å; E189-V219 HydrophobicContact CB-CG2 4.09Å; E189-V219 HydrophobicContact CG-CG2 3.83Å; L194-V219 HydrophobicContact CD2-CG1 3.34Å; V219-T241 WeakPolarHBondContact O-CB 3.18Å; V219-T241 WeakPolarHBondContact O-CG2 3.4Å; V219-F242 VanDerWaalsContact CG1-O 3.23Å; V219-F242 WeakPolarHBondContact CG1-O 3.43Å; V219-R243 HydrophobicContact CG1-CG 4.36Å
220	S	95.9	Very high	94.4	Very high	6 Å²	6	41 Å²	41	4%	0.042	23%	0.23	C	C	.	.			trans	-164	145.1	-176.7	164.2	0	0	0	0	112	T218 Q222 E260	T218-S220 PolarHBondContact OG1-N 3.12Å; T218-S220 PolarHBondContact OG1-O 3.14Å; S220-Q222 VanDerWaalsContact C-N 3.31Å; S220-Q222 WeakPolarHBondContact OG-CB 3.29Å; S220-Q222 PolarHBondContact OG-N 3.47Å; S220-E260 VanDerWaalsContact CB-OE1 3.27Å; S220-E260 WeakPolarHBondContact CB-OE1 2.98Å; S220-E260 PolarHBondContact OG-OE1 2.95Å
221	G	96.9	Very high	94.8	Very high	1 Å²	1	38.6 Å²	38.6	1%	0.01	23%	0.234	C	C	.	.	S	Bend	trans	-81.5	-4.8	171.7	0	0	0	0	0	114.3	L223 H224 L225 E260	G221-L223 PolarHBondContact O-N 3.46Å; G221-H224 WeakPolarHBondContact O-CB 3.45Å; G221-H224 PolarHBondContact O-N 3.19Å; G221-L225 PolarHBondContact O-N 2.89Å; G221-L225 VanDerWaalsContact O-N 3.09Å; G221-E260 WeakPolarHBondContact CA-OE2 3.19Å; G221-E260 PolarHBondContact N-OE1 2.77Å; G221-E260 PolarHBondContact N-OE2 3.03Å
222	Q	97.5	Very high	95.2	Very high	16 Å²	16	38.1 Å²	38.1	8%	0.075	23%	0.232	C	C	.	.	H	α-helix	trans	-49.6	-53.6	-167.5	-174.1	-166.7	-73.4	0	0	113.8	S220 H224 L225 E226 Y377 R408	S220-Q222 VanDerWaalsContact C-N 3.31Å; S220-Q222 WeakPolarHBondContact OG-CB 3.29Å; S220-Q222 PolarHBondContact OG-N 3.47Å; Q222-H224 PolarHBondContact O-N 3.27Å; Q222-H224 VanDerWaalsContact O-N 3.14Å; Q222-L225 WeakPolarHBondContact O-CA 3.29Å; Q222-L225 WeakPolarHBondContact O-CB 3.42Å; Q222-L225 PolarHBondContact O-N 2.91Å; Q222-E226 PolarHBondContact NE2-OE1 2.99Å; Q222-E226 PolarHBondContact O-N 3.47Å; Q222-Y377 VanDerWaalsContact NE2-CD2 3.3Å; Q222-Y377 VanDerWaalsContact NE2-CZ 3.31Å; Q222-Y377 PolarHBondContact OE1-OH 3.48Å; Q222-R408 VanDerWaalsContact CD-NH2 3.29Å; Q222-R408 VanDerWaalsContact OE1-CZ 3.29Å
223	L	96	Very high	95.6	Very high	3 Å²	3	35.3 Å²	35.3	2%	0.016	22%	0.22	C	C	.	.	H	α-helix	trans	-61.7	-30	-175.2	-57.5	-178.5	0	0	0	112.4	N186 G221 V227 Y428 W430 Y431	N186-L223 HydrophobicContact CB-CD1 4.41Å; G221-L223 PolarHBondContact O-N 3.46Å; L223-V227 PolarHBondContact O-N 3.05Å; L223-Y428 HydrophobicContact CD1-CD1 4.5Å; L223-Y428 HydrophobicContact CD1-CE1 3.67Å; L223-W430 HydrophobicContact CB-CH2 3.94Å; L223-Y431 HydrophobicContact CD2-CD2 4.23Å; L223-Y431 HydrophobicContact CD2-CE1 4.41Å; L223-Y431 HydrophobicContact CD2-CE2 3.61Å
224	H	97.4	Very high	96	Very high	48 Å²	48	35 Å²	35	22%	0.222	21%	0.214	C	C	.	.	H	α-helix	trans	-75.1	-36.9	174.1	-61.9	93.5	0	0	0	111.4	T180 P181 G221 Q222 E226 V227 M228	T180-H224 HydrophobicContact CG2-CB 3.82Å; P181-H224 VanDerWaalsContact CG-CE1 3.43Å; P181-H224 WeakPolarHBondContact CG-CE1 3.48Å; P181-H224 WeakPolarHBondContact CG-NE2 3.4Å; G221-H224 WeakPolarHBondContact O-CB 3.45Å; G221-H224 PolarHBondContact O-N 3.19Å; Q222-H224 PolarHBondContact O-N 3.27Å; Q222-H224 VanDerWaalsContact O-N 3.14Å; H224-E226 VanDerWaalsContact C-N 3.3Å; H224-E226 PolarHBondContact O-N 2.82Å; H224-V227 WeakPolarHBondContact O-CB 3.29Å; H224-V227 PolarHBondContact O-N 2.94Å; H224-M228 WeakPolarHBondContact O-CG 3.38Å; H224-M228 PolarHBondContact O-N 3.43Å; H224-M228 VanDerWaalsContact O-N 3.13Å
225	L	98.3	Very high	96.5	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-63.5	-35.9	173.6	-66.8	-178.3	0	0	0	112	I178 T180 G221 Q222 V227 M228 S229 V235 T237 E260 E262	I178-L225 HydrophobicContact CB-CD2 3.91Å; I178-L225 HydrophobicContact CG1-CD2 4.3Å; I178-L225 HydrophobicContact CG2-CD2 4.24Å; T180-L225 HydrophobicContact CG2-CD2 3.9Å; T180-L225 HydrophobicContact CG2-CG 4.08Å; G221-L225 PolarHBondContact O-N 2.89Å; G221-L225 VanDerWaalsContact O-N 3.09Å; Q222-L225 WeakPolarHBondContact O-CA 3.29Å; Q222-L225 WeakPolarHBondContact O-CB 3.42Å; Q222-L225 PolarHBondContact O-N 2.91Å; L225-V227 VanDerWaalsContact C-N 3.31Å; L225-V227 PolarHBondContact O-N 3.1Å; L225-M228 CarbonylContact O-C 3.5Å; L225-M228 PolarHBondContact O-N 3.47Å; L225-M228 VanDerWaalsContact O-N 3.11Å; L225-S229 WeakPolarHBondContact O-CB 3.47Å; L225-S229 PolarHBondContact O-N 2.66Å; L225-V235 HydrophobicContact CB-CG2 4.06Å; L225-V235 HydrophobicContact CD2-CB 4.35Å; L225-V235 HydrophobicContact CD2-CG2 3.99Å; L225-T237 HydrophobicContact CD1-CG2 3.91Å; L225-T237 HydrophobicContact CD2-CG2 4.47Å; L225-T237 HydrophobicContact CG-CG2 4.4Å; L225-E260 HydrophobicContact CD1-CB 3.82Å; L225-E260 WeakPolarHBondContact CD1-O 3.39Å; L225-E262 HydrophobicContact CB-CB 3.78Å
226	E	97.9	Very high	96.8	Very high	5 Å²	5	31.9 Å²	31.9	2%	0.023	19%	0.193	C	C	.	.	H	α-helix	trans	-63.3	-33.9	173.6	-69.4	-176.8	-120	0	0	113	Q222 H224 S229 E262 R408 Y431 L434 R435 H442	Q222-E226 PolarHBondContact NE2-OE1 2.99Å; Q222-E226 PolarHBondContact O-N 3.47Å; H224-E226 VanDerWaalsContact C-N 3.3Å; H224-E226 PolarHBondContact O-N 2.82Å; E226-S229 WeakPolarHBondContact CA-OG 3.26Å; E226-S229 PolarHBondContact O-OG 3.48Å; E226-E262 HydrophobicContact CG-CG 3.94Å; E226-R408 HydrophobicContact CG-CG 4.41Å; E226-Y431 HydrophobicContact CB-CE2 4.33Å; E226-Y431 PolarHBondContact OE1-OH 3.43Å; E226-Y431 WeakPolarHBondContact OE2-CE2 3.26Å; E226-Y431 PolarHBondContact OE2-OH 3.41Å; E226-L434 HydrophobicContact CB-CD1 4.45Å; E226-R435 IonicContact OE2-CZ 3.73Å; E226-R435 IonicContact OE2-NH1 3.77Å; E226-R435 PolarHBondContact OE2-NH1 3.25Å; E226-R435 IonicContact OE2-NH2 2.75Å; E226-R435 PolarHBondContact OE2-NH2 3.34Å; E226-H442 IonicContact OE2-NE2 2.66Å; E226-H442 PolarHBondContact OE2-NE2 3.4Å
227	V	97.4	Very high	97	Very high	61 Å²	61	30.1 Å²	30.1	37%	0.37	19%	0.185	S	C	.	.	H	α-helix	trans	-64.4	-45.5	170.9	178.3	0	0	0	0	110.1	L223 H224 L225 S229 G230 W430 L434	L223-V227 PolarHBondContact O-N 3.05Å; H224-V227 WeakPolarHBondContact O-CB 3.29Å; H224-V227 PolarHBondContact O-N 2.94Å; L225-V227 VanDerWaalsContact C-N 3.31Å; L225-V227 PolarHBondContact O-N 3.1Å; V227-S229 VanDerWaalsContact C-N 3.33Å; V227-S229 PolarHBondContact O-N 2.82Å; V227-G230 PolarHBondContact O-N 3.3Å; V227-W430 HydrophobicContact CG2-CE3 4.28Å; V227-W430 HydrophobicContact CG2-CZ3 3.65Å; V227-L434 HydrophobicContact CG2-CD1 4Å; V227-L434 HydrophobicContact CG2-CD2 4.23Å
228	M	98.2	Very high	97.1	Very high	58 Å²	58	29.8 Å²	29.8	29%	0.286	18%	0.183	S	C	.	.	H	α-helix	trans	-70.1	-30.9	-178	-61.4	-52.2	-71.5	0	0	112.5	I178 H224 L225 G230 A231 F232 V235	I178-M228 HydrophobicContact CD1-CB 4.49Å; I178-M228 HydrophobicContact CD1-CE 3.75Å; I178-M228 HydrophobicContact CD1-CG 4.37Å; I178-M228 HydrophobicContact CG1-CB 4.17Å; I178-M228 HydrophobicContact CG1-CG 4.14Å; I178-M228 HydrophobicContact CG2-CG 3.82Å; H224-M228 WeakPolarHBondContact O-CG 3.38Å; H224-M228 PolarHBondContact O-N 3.43Å; H224-M228 VanDerWaalsContact O-N 3.13Å; L225-M228 CarbonylContact O-C 3.5Å; L225-M228 PolarHBondContact O-N 3.47Å; L225-M228 VanDerWaalsContact O-N 3.11Å; M228-G230 PolarHBondContact O-N 2.89Å; M228-A231 PolarHBondContact O-N 3.06Å; M228-F232 HydrophobicContact CE-CD2 4.08Å; M228-F232 HydrophobicContact CE-CE2 3.7Å; M228-F232 PolarHBondContact O-N 2.83Å; M228-V235 HydrophobicContact CB-CG1 4.05Å; M228-V235 HydrophobicContact CB-CG2 4.32Å
229	S	96	Very high	97.3	Very high	7 Å²	7	30.3 Å²	30.3	5%	0.049	19%	0.189	C	C	.	.	H	α-helix	trans	-67.4	-23.1	179.4	72.8	0	0	0	0	112.6	L225 E226 V227 A231 F232 S264	L225-S229 WeakPolarHBondContact O-CB 3.47Å; L225-S229 PolarHBondContact O-N 2.66Å; E226-S229 WeakPolarHBondContact CA-OG 3.26Å; E226-S229 PolarHBondContact O-OG 3.48Å; V227-S229 VanDerWaalsContact C-N 3.33Å; V227-S229 PolarHBondContact O-N 2.82Å; S229-A231 PolarHBondContact O-N 3.47Å; S229-F232 CarbonylContact C-O 3.58Å; S229-F232 WeakPolarHBondContact CA-O 3.38Å; S229-F232 VanDerWaalsContact O-O 3.14Å; S229-S264 WeakPolarHBondContact CB-OG 3.46Å; S229-S264 PolarHBondContact O-OG 2.96Å
230	G	93.6	Very high	97.4	Very high	69 Å²	69	31.4 Å²	31.4	71%	0.711	20%	0.196	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.4	-19.8	169.4	0	0	0	0	0	114.3	V227 M228	V227-G230 PolarHBondContact O-N 3.3Å; M228-G230 PolarHBondContact O-N 2.89Å
231	A	95.9	Very high	97.4	Very high	79 Å²	79	31.2 Å²	31.2	65%	0.653	20%	0.195	S	C	*	.	T	Hydrogen-bonded Turn	trans	-110.8	-31.2	177.6	0	0	0	0	0	113.4	M228 S229	M228-A231 PolarHBondContact O-N 3.06Å; S229-A231 PolarHBondContact O-N 3.47Å
232	F	97.8	Very high	97.4	Very high	89 Å²	89	32.2 Å²	32.2	39%	0.39	20%	0.199	S	C	.	.	S	Bend	trans	-125.9	121.1	-179.1	-55.8	-78.1	0	0	0	108.8	V176 M228 S229 Q234 V235	V176-F232 HydrophobicContact CG2-CB 4.28Å; V176-F232 HydrophobicContact CG2-CD1 4Å; V176-F232 HydrophobicContact CG2-CG 4.24Å; M228-F232 HydrophobicContact CE-CD2 4.08Å; M228-F232 HydrophobicContact CE-CE2 3.7Å; M228-F232 PolarHBondContact O-N 2.83Å; S229-F232 CarbonylContact C-O 3.58Å; S229-F232 WeakPolarHBondContact CA-O 3.38Å; S229-F232 VanDerWaalsContact O-O 3.14Å; F232-Q234 PolarHBondContact O-N 3.42Å; F232-V235 HydrophobicContact CB-CG1 3.59Å; F232-V235 HydrophobicContact CD2-CG1 4.37Å; F232-V235 HydrophobicContact CG-CG1 4.36Å
233	T	97.3	Very high	97.2	Very high	78 Å²	78	34.9 Å²	34.9	48%	0.479	21%	0.208	S	C	.	.	S	Bend	trans	-61.5	-19.9	-171	53.8	0	0	0	0	114.9	I263 S264 F265	T233-I263 WeakPolarHBondContact O-CA 3.39Å; T233-S264 PolarHBondContact O-N 2.98Å; T233-F265 HydrophobicContact CG2-CD2 4.13Å; T233-F265 HydrophobicContact CG2-CE2 3.91Å
234	Q	98.3	Very high	97.1	Very high	62 Å²	62	36.6 Å²	36.6	29%	0.29	22%	0.223	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	117.4	-178.8	-71.8	179.6	91	0	0	109.1	F175 V176 F232 I263	F175-Q234 WeakPolarHBondContact CA-O 3.14Å; F175-Q234 HydrophobicContact CB-CB 4.45Å; F175-Q234 HydrophobicContact CD1-CB 3.72Å; F175-Q234 HydrophobicContact CD2-CB 4.08Å; F175-Q234 HydrophobicContact CE1-CB 3.88Å; F175-Q234 HydrophobicContact CE1-CG 4.31Å; F175-Q234 HydrophobicContact CE2-CB 4.23Å; F175-Q234 HydrophobicContact CE2-CG 4.35Å; F175-Q234 HydrophobicContact CG-CB 3.81Å; F175-Q234 HydrophobicContact CZ-CB 4.13Å; F175-Q234 HydrophobicContact CZ-CG 4.17Å; V176-Q234 PolarHBondContact N-O 3.13Å; F232-Q234 PolarHBondContact O-N 3.42Å; Q234-I263 HydrophobicContact CG-CG1 4.41Å; Q234-I263 HydrophobicContact CG-CG2 3.84Å
235	V	98.8	Very high	96.6	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	151.3	-179.6	-64.4	0	0	0	0	111.1	V176 I178 L225 M228 F232 A261 E262	V176-V235 HydrophobicContact CB-CG1 4.41Å; V176-V235 WeakPolarHBondContact O-CA 3.47Å; I178-V235 HydrophobicContact CD1-CG1 4.42Å; I178-V235 HydrophobicContact CG1-CB 3.89Å; I178-V235 HydrophobicContact CG1-CG1 3.98Å; L225-V235 HydrophobicContact CB-CG2 4.06Å; L225-V235 HydrophobicContact CD2-CB 4.35Å; L225-V235 HydrophobicContact CD2-CG2 3.99Å; M228-V235 HydrophobicContact CB-CG1 4.05Å; M228-V235 HydrophobicContact CB-CG2 4.32Å; F232-V235 HydrophobicContact CB-CG1 3.59Å; F232-V235 HydrophobicContact CD2-CG1 4.37Å; F232-V235 HydrophobicContact CG-CG1 4.36Å; V235-A261 VanDerWaalsContact O-CA 3.31Å; V235-A261 WeakPolarHBondContact O-CA 3.37Å; V235-E262 HydrophobicContact CG2-CB 3.86Å; V235-E262 PolarHBondContact N-O 2.88Å; V235-E262 PolarHBondContact O-N 2.91Å
236	F	98.9	Very high	96.1	Very high	4 Å²	4	43.2 Å²	43.2	2%	0.018	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	157.2	172.1	81.7	-72.1	0	0	0	111.7	H167 F170 F175 V176 H177 I178 E260 A261	H167-F236 AromaticContact CE1-CE2 3.96Å; H167-F236 AromaticContact ND1-CE2 3.72Å; H167-F236 AromaticContact ND1-CZ 3.6Å; F170-F236 HydrophobicContact CB-CD1 3.63Å; F170-F236 HydrophobicContact CB-CD2 4.13Å; F170-F236 HydrophobicContact CB-CE1 3.42Å; F170-F236 VanDerWaalsContact CB-CE1 3.42Å; F170-F236 HydrophobicContact CB-CE2 3.96Å; F170-F236 HydrophobicContact CB-CG 3.96Å; F170-F236 HydrophobicContact CB-CZ 3.59Å; F170-F236 HydrophobicContact CD1-CB 3.94Å; F170-F236 HydrophobicContact CD1-CD1 4.14Å; F170-F236 HydrophobicContact CD1-CD2 4.39Å; F170-F236 AromaticContact CD1-CG 3.91Å; F170-F236 HydrophobicContact CD1-CG 3.91Å; F170-F236 HydrophobicContact CD2-CB 4.33Å; F170-F236 HydrophobicContact CD2-CD1 4.35Å; F170-F236 AromaticContact CD2-CD2 3.41Å; F170-F236 HydrophobicContact CD2-CD2 3.41Å; F170-F236 VanDerWaalsContact CD2-CD2 3.41Å; F170-F236 AromaticContact CD2-CE2 3.66Å; F170-F236 HydrophobicContact CD2-CE2 3.66Å; F170-F236 AromaticContact CD2-CG 3.78Å; F170-F236 HydrophobicContact CD2-CG 3.78Å; F170-F236 HydrophobicContact CD2-CZ 4.2Å; F170-F236 HydrophobicContact CE1-CB 3.94Å; F170-F236 HydrophobicContact CE1-CG 4.33Å; F170-F236 HydrophobicContact CE2-CB 4.34Å; F170-F236 AromaticContact CE2-CD2 3.85Å; F170-F236 HydrophobicContact CE2-CD2 3.85Å; F170-F236 HydrophobicContact CE2-CE2 4.44Å; F170-F236 HydrophobicContact CE2-CG 4.22Å; F170-F236 HydrophobicContact CG-CB 4.13Å; F170-F236 AromaticContact CG-CD1 3.8Å; F170-F236 HydrophobicContact CG-CD1 3.8Å; F170-F236 AromaticContact CG-CD2 3.73Å; F170-F236 HydrophobicContact CG-CD2 3.73Å; F170-F236 HydrophobicContact CG-CE1 4.04Å; F170-F236 AromaticContact CG-CE2 3.99Å; F170-F236 HydrophobicContact CG-CE2 3.99Å; F170-F236 AromaticContact CG-CG 3.6Å; F170-F236 HydrophobicContact CG-CG 3.6Å; F170-F236 HydrophobicContact CG-CZ 4.12Å; F170-F236 HydrophobicContact CZ-CB 4.14Å; F170-F236 HydrophobicContact CZ-CD2 4.48Å; F170-F236 HydrophobicContact CZ-CG 4.47Å; F175-F236 HydrophobicContact CB-CD1 3.71Å; F175-F236 HydrophobicContact CB-CE1 4.27Å; F175-F236 HydrophobicContact CD1-CB 4.3Å; V176-F236 PolarHBondContact O-N 3.27Å; H177-F236 CarbonylContact C-O 3.57Å; H177-F236 VanDerWaalsContact CA-CE1 3.47Å; H177-F236 WeakPolarHBondContact CA-O 3.22Å; H177-F236 HydrophobicContact CB-CD1 4.18Å; H177-F236 HydrophobicContact CB-CE1 3.45Å; H177-F236 VanDerWaalsContact CB-CE1 3.45Å; H177-F236 HydrophobicContact CB-CE2 4.45Å; H177-F236 HydrophobicContact CB-CZ 3.62Å; H177-F236 AromaticContact CD2-CE2 3.63Å; H177-F236 AromaticContact CD2-CZ 3.69Å; H177-F236 PolarHBondContact CD2-O 3.41Å; H177-F236 AromaticContact CG-CZ 3.76Å; I178-F236 PolarHBondContact N-O 3.3Å; F236-E260 CarbonylContact C-O 3.57Å; F236-E260 WeakPolarHBondContact CA-O 3.3Å; F236-E260 WeakPolarHBondContact CB-O 3.45Å; F236-A261 HydrophobicContact CB-CB 4.13Å
237	T	98.8	Very high	95.6	Very high	3 Å²	3	44.1 Å²	44.1	2%	0.018	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	149.5	168.3	-170.9	0	0	0	0	109.2	I178 T180 L225 V259 E260	I178-T237 WeakPolarHBondContact O-CA 3.4Å; I178-T237 VanDerWaalsContact O-CB 3.24Å; I178-T237 WeakPolarHBondContact O-CB 3.25Å; I178-T237 PolarHBondContact O-OG1 2.92Å; I178-T237 VanDerWaalsContact O-OG1 3.05Å; T180-T237 HydrophobicContact CG2-CG2 4.32Å; T180-T237 PolarHBondContact OG1-OG1 3.16Å; L225-T237 HydrophobicContact CD1-CG2 3.91Å; L225-T237 HydrophobicContact CD2-CG2 4.47Å; L225-T237 HydrophobicContact CG-CG2 4.4Å; T237-V259 WeakPolarHBondContact O-CA 3.41Å; T237-E260 HydrophobicContact CG2-CB 3.87Å; T237-E260 HydrophobicContact CG2-CG 4.24Å; T237-E260 WeakPolarHBondContact CG2-OE2 3.4Å; T237-E260 PolarHBondContact N-O 3.5Å; T237-E260 PolarHBondContact O-N 3.25Å
238	F	98.8	Very high	95.1	Very high	25 Å²	25	46.8 Å²	46.8	11%	0.11	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	102.4	165.9	-167.9	153.8	0	0	0	107	T163 I166 H167 H177 Y257 M258 V259 F449	T163-F238 HydrophobicContact CG2-CD1 4.42Å; T163-F238 HydrophobicContact CG2-CE1 3.84Å; T163-F238 HydrophobicContact CG2-CZ 4.14Å; I166-F238 HydrophobicContact CB-CE1 4.31Å; I166-F238 HydrophobicContact CD1-CE1 4.06Å; I166-F238 HydrophobicContact CG2-CD1 4.02Å; I166-F238 HydrophobicContact CG2-CE1 4.14Å; H167-F238 AromaticContact NE2-CD1 3.72Å; H177-F238 PolarHBondContact NE2-N 2.9Å; F238-Y257 HydrophobicContact CD2-CD1 4.14Å; F238-Y257 AromaticContact CE2-CD1 3.88Å; F238-Y257 HydrophobicContact CE2-CD1 3.88Å; F238-Y257 HydrophobicContact CE2-CG 4.28Å; F238-M258 WeakPolarHBondContact CA-O 3.33Å; F238-V259 HydrophobicContact CD1-CG2 3.75Å; F238-V259 HydrophobicContact CD2-CG2 4.07Å; F238-V259 HydrophobicContact CE1-CG2 3.8Å; F238-V259 HydrophobicContact CE2-CG2 4.16Å; F238-V259 HydrophobicContact CG-CG2 3.88Å; F238-V259 HydrophobicContact CZ-CG2 4.02Å; F238-F449 HydrophobicContact CE2-CB 4.37Å; F238-F449 AromaticContact CE2-CD1 3.85Å; F238-F449 HydrophobicContact CE2-CD1 3.85Å; F238-F449 HydrophobicContact CE2-CE1 4.28Å; F238-F449 HydrophobicContact CE2-CG 4.08Å; F238-F449 HydrophobicContact CZ-CB 4.35Å; F238-F449 AromaticContact CZ-CD1 3.54Å; F238-F449 HydrophobicContact CZ-CD1 3.54Å; F238-F449 AromaticContact CZ-CD2 3.91Å; F238-F449 HydrophobicContact CZ-CD2 3.91Å; F238-F449 AromaticContact CZ-CE1 3.64Å; F238-F449 HydrophobicContact CZ-CE1 3.64Å; F238-F449 HydrophobicContact CZ-CE2 4.03Å; F238-F449 AromaticContact CZ-CG 3.68Å; F238-F449 HydrophobicContact CZ-CG 3.68Å; F238-F449 AromaticContact CZ-CZ 3.9Å; F238-F449 HydrophobicContact CZ-CZ 3.9Å
239	G	98.1	Very high	94.7	Very high	16 Å²	16	45.8 Å²	45.8	17%	0.165	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.5	169	-173.1	0	0	0	0	0	114	Y257 M258	G239-Y257 WeakPolarHBondContact O-CA 3.47Å; G239-M258 PolarHBondContact N-O 3.36Å; G239-M258 VanDerWaalsContact N-O 3.13Å; G239-M258 PolarHBondContact O-N 2.91Å
240	P	97.9	Very high	94.4	Very high	29 Å²	29	52.4 Å²	52.4	19%	0.188	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	141.2	174.3	32.2	-34.4	0	0	0	111.1	I182 F242 F256 Y257	I182-P240 HydrophobicContact CD1-CG 3.69Å; I182-P240 HydrophobicContact CG1-CG 4.22Å; P240-F242 HydrophobicContact CB-CE2 4.15Å; P240-F242 HydrophobicContact CB-CZ 4.12Å; P240-F242 HydrophobicContact CG-CE2 4.45Å; P240-F256 CarbonylContact C-O 3.57Å; P240-F256 VanDerWaalsContact CA-O 3.3Å; P240-F256 WeakPolarHBondContact CA-O 3.18Å; P240-Y257 HydrophobicContact CB-CE1 4.41Å
241	T	96.6	Very high	94.1	Very high	3 Å²	3	51 Å²	51	2%	0.018	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	157.8	172.8	54.4	0	0	0	0	109.6	T218 V219 F256 M258	T218-T241 WeakPolarHBondContact O-CA 3.32Å; V219-T241 WeakPolarHBondContact O-CB 3.18Å; V219-T241 WeakPolarHBondContact O-CG2 3.4Å; T241-F256 PolarHBondContact N-O 3.13Å; T241-F256 PolarHBondContact O-N 3.31Å; T241-F256 VanDerWaalsContact O-O 3.13Å; T241-F256 VanDerWaalsContact OG1-CD2 3.28Å; T241-F256 WeakPolarHBondContact OG1-CD2 3.43Å; T241-F256 WeakPolarHBondContact OG1-CE2 3.41Å; T241-F256 WeakPolarHBondContact OG1-CZ 3.49Å; T241-M258 HydrophobicContact CG2-CB 3.82Å; T241-M258 HydrophobicContact CG2-CG 3.74Å; T241-M258 WeakPolarHBondContact OG1-CG 3.45Å
242	F	96.3	Very high	93.9	Very high	22 Å²	22	49.6 Å²	49.6	10%	0.096	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	139.3	-168.3	-53.9	-97.7	0	0	0	110.5	I182 F195 L217 T218 V219 P240 A254 E255	I182-F242 HydrophobicContact CG2-CE2 3.68Å; I182-F242 HydrophobicContact CG2-CZ 4.32Å; F195-F242 HydrophobicContact CD2-CB 3.98Å; F195-F242 HydrophobicContact CE2-CB 4.45Å; L217-F242 HydrophobicContact CB-CB 3.83Å; L217-F242 HydrophobicContact CB-CD1 4.41Å; L217-F242 HydrophobicContact CB-CD2 3.6Å; L217-F242 HydrophobicContact CB-CE2 4.27Å; L217-F242 HydrophobicContact CB-CG 3.68Å; L217-F242 HydrophobicContact CD1-CB 4.39Å; L217-F242 HydrophobicContact CD1-CD1 3.68Å; L217-F242 HydrophobicContact CD1-CD2 4.25Å; L217-F242 HydrophobicContact CD1-CE1 3.93Å; L217-F242 HydrophobicContact CD1-CE2 4.5Å; L217-F242 HydrophobicContact CD1-CG 3.84Å; L217-F242 HydrophobicContact CD1-CZ 4.34Å; L217-F242 HydrophobicContact CD2-CD2 4.34Å; L217-F242 HydrophobicContact CD2-CE2 4.17Å; L217-F242 HydrophobicContact CD2-CZ 4.36Å; L217-F242 HydrophobicContact CG-CD2 4.28Å; L217-F242 HydrophobicContact CG-CG 4.28Å; T218-F242 PolarHBondContact O-N 3.43Å; V219-F242 VanDerWaalsContact CG1-O 3.23Å; V219-F242 WeakPolarHBondContact CG1-O 3.43Å; P240-F242 HydrophobicContact CB-CE2 4.15Å; P240-F242 HydrophobicContact CB-CZ 4.12Å; P240-F242 HydrophobicContact CG-CE2 4.45Å; F242-A254 WeakPolarHBondContact CA-O 3.4Å; F242-E255 HydrophobicContact CD1-CB 3.96Å; F242-E255 HydrophobicContact CD1-CG 4.01Å; F242-E255 HydrophobicContact CE1-CB 3.98Å; F242-E255 HydrophobicContact CE1-CG 3.56Å; F242-E255 HydrophobicContact CZ-CG 4.24Å
243	R	93.8	Very high	93.8	Very high	72 Å²	72	46 Å²	46	27%	0.272	23%	0.234	S	C	.	.			trans	-135.7	128.7	172.9	-70.4	-176	-179.5	171.5	1.6	109.6	E189 F195 V219 E245 A254 F256	E189-R243 VanDerWaalsContact CD-NH2 3.33Å; E189-R243 IonicContact OE1-CZ 3.36Å; E189-R243 IonicContact OE1-NE 3.93Å; E189-R243 IonicContact OE1-NH2 3.26Å; E189-R243 PolarHBondContact OE1-NH2 3.38Å; E189-R243 IonicContact OE2-CZ 3.83Å; E189-R243 IonicContact OE2-NE 2.72Å; E189-R243 IonicContact OE2-NH2 2.81Å; E189-R243 PolarHBondContact OE2-NH2 3.49Å; F195-R243 WeakPolarHBondContact CE2-O 3.33Å; V219-R243 HydrophobicContact CG1-CG 4.36Å; R243-E245 PolarHBondContact O-N 3.11Å; R243-A254 PolarHBondContact N-O 2.9Å; R243-A254 WeakPolarHBondContact O-CA 3.45Å; R243-F256 HydrophobicContact CB-CE1 4.11Å; R243-F256 HydrophobicContact CG-CE1 3.81Å; R243-F256 HydrophobicContact CG-CZ 3.9Å
244	A	92.3	Very high	93.7	Very high	39 Å²	39	42.8 Å²	42.8	32%	0.322	22%	0.216	S	C	.	.			trans	-88.5	29.3	-179.5	0	0	0	0	0	112.9	E193 F195 N246	E193-A244 WeakPolarHBondContact O-CB 3.35Å; E193-A244 PolarHBondContact O-N 3.02Å; F195-A244 HydrophobicContact CD1-CB 4.26Å; F195-A244 HydrophobicContact CD2-CB 4.06Å; F195-A244 HydrophobicContact CE1-CB 4.13Å; F195-A244 HydrophobicContact CE2-CB 3.94Å; F195-A244 HydrophobicContact CG-CB 4.22Å; F195-A244 HydrophobicContact CZ-CB 3.97Å; A244-N246 PolarHBondContact O-N 3.13Å
245	E	87.7	Confident	93.7	Very high	59 Å²	59	42.7 Å²	42.7	28%	0.276	22%	0.215	S	C	.	.			trans	-65.2	127.8	175.5	-164.6	-168.9	163.8	0	0	110.1	E193 R243 S247 H252 P472	E193-E245 WeakPolarHBondContact OE1-CG 3.22Å; E193-E245 VanDerWaalsContact OE2-CB 3.27Å; E193-E245 WeakPolarHBondContact OE2-CB 3.4Å; R243-E245 PolarHBondContact O-N 3.11Å; E245-S247 PolarHBondContact O-N 3.22Å; E245-S247 WeakPolarHBondContact OE1-CB 3.47Å; E245-S247 PolarHBondContact OE1-OG 3.48Å; E245-H252 IonicContact OE1-CE1 3.73Å; E245-H252 IonicContact OE1-ND1 2.66Å; E245-H252 IonicContact OE2-CD2 3.88Å; E245-H252 IonicContact OE2-CE1 3.79Å; E245-H252 IonicContact OE2-CG 3.39Å; E245-H252 IonicContact OE2-ND1 3.7Å; E245-H252 PolarHBondContact OE2-ND1 3.2Å; E245-H252 IonicContact OE2-NE2 3.54Å; E245-P472 VanDerWaalsContact O-CG 3.27Å; E245-P472 WeakPolarHBondContact O-CG 3.43Å
246	N	87.5	Confident	93.6	Very high	127 Å²	127	43.7 Å²	43.7	68%	0.679	22%	0.219	S	C	*	.			trans	-81	54.7	175.1	-167.7	20.7	0	0	0	112.2	A244 P472	A244-N246 PolarHBondContact O-N 3.13Å; N246-P472 WeakPolarHBondContact OD1-CB 3.36Å
247	S	86.9	Confident	93.6	Very high	25 Å²	25	47.1 Å²	47.1	18%	0.175	23%	0.233	C	C	.	.			trans	-118	120.4	-176.7	-169.7	0	0	0	0	112.2	E245 S249 H252 P472	E245-S247 PolarHBondContact O-N 3.22Å; E245-S247 WeakPolarHBondContact OE1-CB 3.47Å; E245-S247 PolarHBondContact OE1-OG 3.48Å; S247-S249 VanDerWaalsContact C-N 3.32Å; S247-H252 PolarHBondContact OG-ND1 2.82Å; S247-P472 WeakPolarHBondContact O-CD 3.16Å
248	Q	87.8	Confident	93.6	Very high	116 Å²	116	47.9 Å²	47.9	54%	0.542	24%	0.236	S	C	.	.			trans	-95.6	22.1	177.4	-67.2	-172.7	47.6	0	0	113.3	K463 P472 H473	Q248-K463 PolarHBondContact O-NZ 3.09Å; Q248-P472 HydrophobicContact CG-CB 4.05Å; Q248-P472 HydrophobicContact CG-CG 4.45Å; Q248-H473 PolarHBondContact NE2-CD2 3.23Å; Q248-H473 VanDerWaalsContact NE2-CD2 3.28Å
249	S	89.6	Confident	93.6	Very high	38 Å²	38	46.7 Å²	46.7	27%	0.266	23%	0.231	S	C	.	.			trans	-59.4	167.9	-177.6	90.4	0	0	0	0	112.7	S247 R251 H252 K463	S247-S249 VanDerWaalsContact C-N 3.32Å; S249-R251 PolarHBondContact O-N 2.73Å; S249-R251 PolarHBondContact OG-N 2.99Å; S249-H252 PolarHBondContact OG-N 2.77Å; S249-H252 PolarHBondContact OG-ND1 3Å; S249-K463 PolarHBondContact O-NZ 3.08Å
250	R	89.4	Confident	93.6	Very high	146 Å²	146	46.5 Å²	46.5	55%	0.551	23%	0.226	S	C	*	.	T	Hydrogen-bonded Turn	trans	-73.8	2.3	174	-62.8	-171.6	-178.8	173.3	2.7	113.4	D460 N461 I462	R250-D460 WeakPolarHBondContact CD-OD2 3.49Å; R250-D460 IonicContact CZ-OD2 3.41Å; R250-D460 IonicContact NE-OD2 3.76Å; R250-D460 IonicContact NH1-OD2 3.52Å; R250-D460 PolarHBondContact NH1-OD2 3.05Å; R250-N461 HydrophobicContact CB-CB 4.47Å; R250-I462 WeakPolarHBondContact O-CB 3.4Å; R250-I462 WeakPolarHBondContact O-CG2 3.19Å; R250-I462 PolarHBondContact O-N 3.42Å
251	R	88.3	Confident	93.7	Very high	40 Å²	40	45.1 Å²	45.1	15%	0.151	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	-128.7	-6.6	-168.1	-60.3	173.2	176.9	-139.7	-28.5	114	S249 T349 K353 G398 V399 I462	S249-R251 PolarHBondContact O-N 2.73Å; S249-R251 PolarHBondContact OG-N 2.99Å; R251-T349 PolarHBondContact NH1-OG1 2.74Å; R251-K353 VanDerWaalsContact NH2-NZ 3.19Å; R251-G398 PolarHBondContact NH2-O 2.99Å; R251-V399 PolarHBondContact NH1-O 3.47Å; R251-V399 PolarHBondContact NH2-O 2.72Å; R251-I462 WeakPolarHBondContact O-CD1 3.31Å
252	H	91.5	Very high	93.8	Very high	49 Å²	49	45 Å²	45	23%	0.227	22%	0.217	C	C	.	.			trans	-114.3	141.3	-178.1	-60.3	139	0	0	0	111.2	E245 S247 S249	E245-H252 IonicContact OE1-CE1 3.73Å; E245-H252 IonicContact OE1-ND1 2.66Å; E245-H252 IonicContact OE2-CD2 3.88Å; E245-H252 IonicContact OE2-CE1 3.79Å; E245-H252 IonicContact OE2-CG 3.39Å; E245-H252 IonicContact OE2-ND1 3.7Å; E245-H252 PolarHBondContact OE2-ND1 3.2Å; E245-H252 IonicContact OE2-NE2 3.54Å; S247-H252 PolarHBondContact OG-ND1 2.82Å; S249-H252 PolarHBondContact OG-N 2.77Å; S249-H252 PolarHBondContact OG-ND1 3Å
253	L	95.4	Very high	93.9	Very high	12 Å²	12	44.7 Å²	44.7	6%	0.063	22%	0.215	C	C	.	.			trans	-131.6	149	170.5	-67.5	172.9	0	0	0	107	E255 F256 E450 I462 K463 I466 P469 R470	L253-E255 WeakPolarHBondContact CB-O 3.4Å; L253-F256 HydrophobicContact CB-CB 4.18Å; L253-F256 HydrophobicContact CB-CD1 4.44Å; L253-F256 HydrophobicContact CD1-CB 4.19Å; L253-F256 WeakPolarHBondContact O-CD1 3.25Å; L253-E450 HydrophobicContact CD1-CB 4.35Å; L253-E450 HydrophobicContact CD1-CG 3.88Å; L253-I462 HydrophobicContact CD1-CD1 4.26Å; L253-I462 HydrophobicContact CD1-CG1 4.03Å; L253-I462 HydrophobicContact CD1-CG2 4.33Å; L253-I462 HydrophobicContact CD2-CG2 4.02Å; L253-I462 HydrophobicContact CG-CD1 4.39Å; L253-I462 HydrophobicContact CG-CG1 4.33Å; L253-I462 HydrophobicContact CG-CG2 3.79Å; L253-K463 HydrophobicContact CD2-CG 3.98Å; L253-I466 HydrophobicContact CD1-CG2 4.04Å; L253-P469 HydrophobicContact CD2-CB 3.72Å; L253-R470 CarbonylContact C-O 3.54Å; L253-R470 WeakPolarHBondContact CA-O 3.27Å
254	A	96.1	Very high	94.1	Very high	12 Å²	12	41.7 Å²	41.7	10%	0.099	21%	0.206	C	C	.	.	S	Bend	trans	-80.1	-24.6	172.6	0	0	0	0	0	112.4	F195 F242 R243 R470	F195-A254 HydrophobicContact CE2-CB 4.08Å; F195-A254 HydrophobicContact CZ-CB 4.01Å; F242-A254 WeakPolarHBondContact CA-O 3.4Å; R243-A254 PolarHBondContact N-O 2.9Å; R243-A254 WeakPolarHBondContact O-CA 3.45Å; A254-R470 HydrophobicContact CB-CB 4.33Å; A254-R470 PolarHBondContact N-O 2.91Å
255	E	97.3	Very high	94.3	Very high	59 Å²	59	46.3 Å²	46.3	28%	0.276	22%	0.219	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	122.2	174.2	177.7	-172.8	127.1	0	0	107.6	F242 L253 R470	F242-E255 HydrophobicContact CD1-CB 3.96Å; F242-E255 HydrophobicContact CD1-CG 4.01Å; F242-E255 HydrophobicContact CE1-CB 3.98Å; F242-E255 HydrophobicContact CE1-CG 3.56Å; F242-E255 HydrophobicContact CZ-CG 4.24Å; L253-E255 WeakPolarHBondContact CB-O 3.4Å; E255-R470 HydrophobicContact CB-CB 3.83Å; E255-R470 HydrophobicContact CB-CG 3.9Å
256	F	97.4	Very high	94.7	Very high	22 Å²	22	43.9 Å²	43.9	10%	0.096	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.2	170.9	-178.3	56.3	-83.4	0	0	0	109.8	P240 T241 R243 L253 M258 E450	P240-F256 CarbonylContact C-O 3.57Å; P240-F256 VanDerWaalsContact CA-O 3.3Å; P240-F256 WeakPolarHBondContact CA-O 3.18Å; T241-F256 PolarHBondContact N-O 3.13Å; T241-F256 PolarHBondContact O-N 3.31Å; T241-F256 VanDerWaalsContact O-O 3.13Å; T241-F256 VanDerWaalsContact OG1-CD2 3.28Å; T241-F256 WeakPolarHBondContact OG1-CD2 3.43Å; T241-F256 WeakPolarHBondContact OG1-CE2 3.41Å; T241-F256 WeakPolarHBondContact OG1-CZ 3.49Å; R243-F256 HydrophobicContact CB-CE1 4.11Å; R243-F256 HydrophobicContact CG-CE1 3.81Å; R243-F256 HydrophobicContact CG-CZ 3.9Å; L253-F256 HydrophobicContact CB-CB 4.18Å; L253-F256 HydrophobicContact CB-CD1 4.44Å; L253-F256 HydrophobicContact CD1-CB 4.19Å; L253-F256 WeakPolarHBondContact O-CD1 3.25Å; F256-M258 HydrophobicContact CD2-CG 3.9Å; F256-M258 HydrophobicContact CD2-SD 4.18Å; F256-M258 HydrophobicContact CE2-CG 3.57Å; F256-M258 HydrophobicContact CE2-SD 3.75Å; F256-E450 WeakPolarHBondContact CB-OE2 3.27Å
257	Y	98.6	Very high	94.9	Very high	76 Å²	76	42.9 Å²	42.9	30%	0.298	20%	0.203	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	134	179.5	-76.3	-108	0	0	0	110.2	F238 G239 P240 F449 E450	F238-Y257 HydrophobicContact CD2-CD1 4.14Å; F238-Y257 AromaticContact CE2-CD1 3.88Å; F238-Y257 HydrophobicContact CE2-CD1 3.88Å; F238-Y257 HydrophobicContact CE2-CG 4.28Å; G239-Y257 WeakPolarHBondContact O-CA 3.47Å; P240-Y257 HydrophobicContact CB-CE1 4.41Å; Y257-F449 VanDerWaalsContact O-CB 3.27Å; Y257-F449 WeakPolarHBondContact O-CB 3.28Å; Y257-F449 PolarHBondContact O-N 3.32Å; Y257-E450 PolarHBondContact N-OE2 2.89Å
258	M	98.4	Very high	95.3	Very high	19 Å²	19	43.8 Å²	43.8	9%	0.094	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	140.2	175.5	-73.8	-72.4	-75.2	0	0	110	F238 G239 T241 F256 E260	F238-M258 WeakPolarHBondContact CA-O 3.33Å; G239-M258 PolarHBondContact N-O 3.36Å; G239-M258 VanDerWaalsContact N-O 3.13Å; G239-M258 PolarHBondContact O-N 2.91Å; T241-M258 HydrophobicContact CG2-CB 3.82Å; T241-M258 HydrophobicContact CG2-CG 3.74Å; T241-M258 WeakPolarHBondContact OG1-CG 3.45Å; F256-M258 HydrophobicContact CD2-CG 3.9Å; F256-M258 HydrophobicContact CD2-SD 4.18Å; F256-M258 HydrophobicContact CE2-CG 3.57Å; F256-M258 HydrophobicContact CE2-SD 3.75Å; M258-E260 HydrophobicContact CB-CG 3.87Å; M258-E260 HydrophobicContact CE-CG 4.25Å
259	V	98.9	Very high	95.8	Very high	0 Å²	0	39 Å²	39	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	112.3	166.6	-180	0	0	0	0	106.3	I166 F170 T237 F238 G446 M447	I166-V259 HydrophobicContact CD1-CG2 4.29Å; I166-V259 HydrophobicContact CG2-CG1 3.78Å; I166-V259 HydrophobicContact CG2-CG2 4.14Å; F170-V259 HydrophobicContact CE2-CG1 3.49Å; F170-V259 VanDerWaalsContact CE2-CG1 3.49Å; F170-V259 HydrophobicContact CZ-CG1 4.06Å; T237-V259 WeakPolarHBondContact O-CA 3.41Å; F238-V259 HydrophobicContact CD1-CG2 3.75Å; F238-V259 HydrophobicContact CD2-CG2 4.07Å; F238-V259 HydrophobicContact CE1-CG2 3.8Å; F238-V259 HydrophobicContact CE2-CG2 4.16Å; F238-V259 HydrophobicContact CG-CG2 3.88Å; F238-V259 HydrophobicContact CZ-CG2 4.02Å; V259-G446 CarbonylContact O-C 3.52Å; V259-G446 WeakPolarHBondContact O-CA 3.26Å; V259-M447 HydrophobicContact CB-CB 4.34Å; V259-M447 HydrophobicContact CB-CE 4.02Å; V259-M447 HydrophobicContact CG2-CE 3.91Å; V259-M447 PolarHBondContact N-O 3.15Å; V259-M447 PolarHBondContact O-N 3.33Å
260	E	98.8	Very high	96.2	Very high	11 Å²	11	42 Å²	42	5%	0.051	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	138	-174.4	-46.8	171.6	99	0	0	109.5	S220 G221 L225 F236 T237 M258 F445	S220-E260 VanDerWaalsContact CB-OE1 3.27Å; S220-E260 WeakPolarHBondContact CB-OE1 2.98Å; S220-E260 PolarHBondContact OG-OE1 2.95Å; G221-E260 WeakPolarHBondContact CA-OE2 3.19Å; G221-E260 PolarHBondContact N-OE1 2.77Å; G221-E260 PolarHBondContact N-OE2 3.03Å; L225-E260 HydrophobicContact CD1-CB 3.82Å; L225-E260 WeakPolarHBondContact CD1-O 3.39Å; F236-E260 CarbonylContact C-O 3.57Å; F236-E260 WeakPolarHBondContact CA-O 3.3Å; F236-E260 WeakPolarHBondContact CB-O 3.45Å; T237-E260 HydrophobicContact CG2-CB 3.87Å; T237-E260 HydrophobicContact CG2-CG 4.24Å; T237-E260 WeakPolarHBondContact CG2-OE2 3.4Å; T237-E260 PolarHBondContact N-O 3.5Å; T237-E260 PolarHBondContact O-N 3.25Å; M258-E260 HydrophobicContact CB-CG 3.87Å; M258-E260 HydrophobicContact CE-CG 4.25Å; E260-F445 CarbonylContact C-O 3.49Å; E260-F445 VanDerWaalsContact CA-O 3.25Å; E260-F445 WeakPolarHBondContact CA-O 3.37Å
261	A	98.8	Very high	96.5	Very high	1 Å²	1	38.1 Å²	38.1	1%	0.008	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	144.6	-178.8	0	0	0	0	0	110.6	F170 F175 V235 F236 G444 F445	F170-A261 HydrophobicContact CE1-CB 3.74Å; F170-A261 HydrophobicContact CZ-CB 3.95Å; F175-A261 HydrophobicContact CE1-CB 4.01Å; V235-A261 VanDerWaalsContact O-CA 3.31Å; V235-A261 WeakPolarHBondContact O-CA 3.37Å; F236-A261 HydrophobicContact CB-CB 4.13Å; A261-G444 CarbonylContact O-C 3.57Å; A261-G444 WeakPolarHBondContact O-CA 3.31Å; A261-F445 HydrophobicContact CB-CE1 4Å; A261-F445 HydrophobicContact CB-CE2 4.03Å; A261-F445 HydrophobicContact CB-CZ 3.7Å; A261-F445 PolarHBondContact N-O 3.04Å; A261-F445 PolarHBondContact O-N 2.83Å
262	E	98.8	Very high	96.9	Very high	1 Å²	1	36.2 Å²	36.2	1%	0.005	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	133.6	177	-159.5	69.8	-151.2	0	0	109.1	L225 E226 V235 R408 H442 G444	L225-E262 HydrophobicContact CB-CB 3.78Å; E226-E262 HydrophobicContact CG-CG 3.94Å; V235-E262 HydrophobicContact CG2-CB 3.86Å; V235-E262 PolarHBondContact N-O 2.88Å; V235-E262 PolarHBondContact O-N 2.91Å; E262-R408 WeakPolarHBondContact OE1-CG 3.42Å; E262-R408 IonicContact OE1-CZ 2.69Å; E262-R408 IonicContact OE1-NE 3.44Å; E262-R408 PolarHBondContact OE1-NE 3.39Å; E262-R408 IonicContact OE1-NH2 3.54Å; E262-R408 IonicContact OE2-CZ 2.69Å; E262-R408 IonicContact OE2-NE 3.26Å; E262-R408 PolarHBondContact OE2-NE 3.49Å; E262-R408 IonicContact OE2-NH2 3.7Å; E262-R408 PolarHBondContact OE2-NH2 3.12Å; E262-H442 IonicContact OE1-CD2 3.14Å; E262-H442 PolarHBondContact OE1-CD2 3.14Å; E262-G444 WeakPolarHBondContact OE2-CA 3.33Å
263	I	98.6	Very high	97.3	Very high	14 Å²	14	34.1 Å²	34.1	7%	0.072	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	124.9	-171.2	-52.6	162.8	0	0	0	108.8	F175 T233 Q234 V266 L272 V275 H442 G443	F175-I263 HydrophobicContact CE1-CD1 4.15Å; F175-I263 HydrophobicContact CE1-CG1 3.7Å; F175-I263 HydrophobicContact CZ-CD1 3.83Å; F175-I263 HydrophobicContact CZ-CG1 3.8Å; T233-I263 WeakPolarHBondContact O-CA 3.39Å; Q234-I263 HydrophobicContact CG-CG1 4.41Å; Q234-I263 HydrophobicContact CG-CG2 3.84Å; I263-V266 HydrophobicContact CB-CG2 3.65Å; I263-V266 HydrophobicContact CG2-CG2 3.42Å; I263-V266 VanDerWaalsContact CG2-CG2 3.42Å; I263-V266 WeakPolarHBondContact O-CG2 3.25Å; I263-L272 HydrophobicContact CD1-CD2 4.19Å; I263-V275 HydrophobicContact CD1-CB 4.4Å; I263-V275 HydrophobicContact CD1-CG1 4.27Å; I263-V275 HydrophobicContact CD1-CG2 4.01Å; I263-H442 VanDerWaalsContact O-CA 3.26Å; I263-H442 WeakPolarHBondContact O-CA 3.43Å; I263-H442 VanDerWaalsContact O-CB 3.25Å; I263-H442 WeakPolarHBondContact O-CB 3.27Å; I263-G443 PolarHBondContact N-O 3.29Å; I263-G443 PolarHBondContact O-N 3.02Å
264	S	98.1	Very high	97.4	Very high	10 Å²	10	38.3 Å²	38.3	7%	0.07	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85	156.3	175.7	-64.8	0	0	0	0	111.5	S229 T233 V266	S229-S264 WeakPolarHBondContact CB-OG 3.46Å; S229-S264 PolarHBondContact O-OG 2.96Å; T233-S264 PolarHBondContact O-N 2.98Å; S264-V266 VanDerWaalsContact C-N 3.32Å
265	F	97.3	Very high	97.5	Very high	135 Å²	135	39 Å²	39	59%	0.592	19%	0.192	S	C	*	.	S	Bend	trans	64.4	31.4	-177.3	-51.8	-79.8	0	0	0	114.4	T233 V440 P441	T233-F265 HydrophobicContact CG2-CD2 4.13Å; T233-F265 HydrophobicContact CG2-CE2 3.91Å; F265-V440 HydrophobicContact CD1-CB 4.22Å; F265-V440 HydrophobicContact CD1-CG1 4.11Å; F265-V440 HydrophobicContact CE1-CB 4.1Å; F265-V440 HydrophobicContact CE1-CG1 3.49Å; F265-V440 VanDerWaalsContact CE1-CG1 3.49Å; F265-V440 HydrophobicContact CZ-CG1 3.84Å; F265-P441 CarbonylContact C-O 3.59Å; F265-P441 WeakPolarHBondContact CA-O 3.25Å; F265-P441 PolarHBondContact N-O 3.49Å
266	V	95.3	Very high	97.6	Very high	9 Å²	9	36.2 Å²	36.2	6%	0.055	18%	0.179	C	C	.	.			trans	-97.1	120.9	176.7	-178.5	0	0	0	0	109.9	I263 S264 S268 D271 L272 L407 P441	I263-V266 HydrophobicContact CB-CG2 3.65Å; I263-V266 HydrophobicContact CG2-CG2 3.42Å; I263-V266 VanDerWaalsContact CG2-CG2 3.42Å; I263-V266 WeakPolarHBondContact O-CG2 3.25Å; S264-V266 VanDerWaalsContact C-N 3.32Å; V266-S268 WeakPolarHBondContact CG1-O 3.39Å; V266-D271 HydrophobicContact CG1-CB 3.67Å; V266-L272 HydrophobicContact CG1-CD2 4.09Å; V266-L272 HydrophobicContact CG1-CG 4.05Å; V266-L272 HydrophobicContact CG2-CD2 4.48Å; V266-L407 HydrophobicContact CB-CD2 4.39Å; V266-L407 HydrophobicContact CG1-CD2 3.69Å; V266-P441 PolarHBondContact N-O 3.48Å; V266-P441 CarbonylContact O-C 3.6Å; V266-P441 WeakPolarHBondContact O-CB 3.29Å
267	N	91.3	Very high	97.6	Very high	106 Å²	106	36.9 Å²	36.9	57%	0.567	18%	0.182	S	C	*	.			trans	-106.3	-15.3	-173.7	-66.2	-73	0	0	0	113.3	D271 P441	N267-D271 PolarHBondContact N-OD2 2.79Å; N267-P441 WeakPolarHBondContact OD1-CB 3.39Å; N267-P441 WeakPolarHBondContact OD1-CG 3.24Å
268	S	95.8	Very high	97.6	Very high	43 Å²	43	37.4 Å²	37.4	30%	0.301	19%	0.188	S	C	.	.	S	Bend	trans	-139	155	-175.5	75.3	0	0	0	0	112.3	V266 Q270 D271	V266-S268 WeakPolarHBondContact CG1-O 3.39Å; S268-Q270 PolarHBondContact O-N 2.98Å; S268-Q270 WeakPolarHBondContact OG-CB 3.48Å; S268-Q270 PolarHBondContact OG-N 2.69Å; S268-D271 PolarHBondContact N-OD2 2.91Å; S268-D271 VanDerWaalsContact N-OD2 3.11Å; S268-D271 PolarHBondContact O-N 3.38Å; S268-D271 PolarHBondContact OG-N 2.75Å; S268-D271 PolarHBondContact OG-OD2 3.46Å
269	L	97.9	Very high	97.6	Very high	16 Å²	16	36.5 Å²	36.5	8%	0.084	18%	0.183	C	C	.	.	H	α-helix	trans	-61.6	-26.3	169.1	-73.9	179.2	0	0	0	112.3	D271 L272 M273 I367 A390 A391 V392 L407	L269-D271 VanDerWaalsContact C-N 3.28Å; L269-D271 PolarHBondContact O-N 2.68Å; L269-L272 HydrophobicContact CD2-CD1 4.36Å; L269-L272 PolarHBondContact O-N 3.29Å; L269-M273 HydrophobicContact CB-CE 4.33Å; L269-M273 WeakPolarHBondContact O-CB 3.23Å; L269-M273 VanDerWaalsContact O-CG 3.3Å; L269-M273 WeakPolarHBondContact O-CG 3.39Å; L269-M273 PolarHBondContact O-N 3.5Å; L269-I367 HydrophobicContact CD1-CB 3.87Å; L269-I367 HydrophobicContact CD1-CG2 4.03Å; L269-A390 HydrophobicContact CD1-CB 4.32Å; L269-A390 HydrophobicContact CD2-CB 4.32Å; L269-A390 WeakPolarHBondContact CD2-O 3.31Å; L269-A390 HydrophobicContact CG-CB 4.19Å; L269-A391 WeakPolarHBondContact CD1-O 3.4Å; L269-V392 HydrophobicContact CD2-CB 4.19Å; L269-V392 HydrophobicContact CD2-CG1 3.99Å; L269-L407 HydrophobicContact CD2-CG 4.25Å
270	Q	97.8	Very high	97.6	Very high	100 Å²	100	36.5 Å²	36.5	47%	0.467	18%	0.183	S	C	.	.	H	α-helix	trans	-60.1	-41	179.6	-174.4	61.4	45.2	0	0	111.7	S268 L272 M273 Q274	S268-Q270 PolarHBondContact O-N 2.98Å; S268-Q270 WeakPolarHBondContact OG-CB 3.48Å; S268-Q270 PolarHBondContact OG-N 2.69Å; Q270-L272 VanDerWaalsContact C-N 3.35Å; Q270-L272 PolarHBondContact O-N 2.69Å; Q270-M273 HydrophobicContact CB-CE 4.47Å; Q270-M273 PolarHBondContact O-N 3.15Å; Q270-Q274 PolarHBondContact O-N 2.91Å
271	D	96.2	Very high	97.6	Very high	65 Å²	65	37.5 Å²	37.5	35%	0.348	19%	0.188	S	C	.	.	H	α-helix	trans	-61.3	-43.6	177.8	-56.8	-45	0	0	0	110.9	V266 N267 S268 L269 V275	V266-D271 HydrophobicContact CG1-CB 3.67Å; N267-D271 PolarHBondContact N-OD2 2.79Å; S268-D271 PolarHBondContact N-OD2 2.91Å; S268-D271 VanDerWaalsContact N-OD2 3.11Å; S268-D271 PolarHBondContact O-N 3.38Å; S268-D271 PolarHBondContact OG-N 2.75Å; S268-D271 PolarHBondContact OG-OD2 3.46Å; L269-D271 VanDerWaalsContact C-N 3.28Å; L269-D271 PolarHBondContact O-N 2.68Å; D271-V275 PolarHBondContact O-N 2.79Å
272	L	97.6	Very high	97.6	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-68.4	-44.9	176.6	-64.7	-177.9	0	0	0	112.2	I263 V266 L269 Q270 Q274 V275 I276 G406 L407	I263-L272 HydrophobicContact CD1-CD2 4.19Å; V266-L272 HydrophobicContact CG1-CD2 4.09Å; V266-L272 HydrophobicContact CG1-CG 4.05Å; V266-L272 HydrophobicContact CG2-CD2 4.48Å; L269-L272 HydrophobicContact CD2-CD1 4.36Å; L269-L272 PolarHBondContact O-N 3.29Å; Q270-L272 VanDerWaalsContact C-N 3.35Å; Q270-L272 PolarHBondContact O-N 2.69Å; L272-Q274 PolarHBondContact O-N 3.15Å; L272-V275 PolarHBondContact O-N 3.11Å; L272-V275 VanDerWaalsContact O-N 3.16Å; L272-I276 WeakPolarHBondContact O-CG1 3.44Å; L272-I276 PolarHBondContact O-N 3.39Å; L272-G406 WeakPolarHBondContact CD1-O 3.41Å; L272-L407 HydrophobicContact CD1-CD2 4.07Å; L272-L407 HydrophobicContact CG-CD2 4.47Å
273	M	98.5	Very high	97.6	Very high	6 Å²	6	38.7 Å²	38.7	3%	0.03	20%	0.197	C	C	.	.	H	α-helix	trans	-59.6	-37.9	179.7	-73.7	-172.8	-61.6	0	0	111.5	L269 Q270 I276 E277 I320 F365 I367 V392	L269-M273 HydrophobicContact CB-CE 4.33Å; L269-M273 WeakPolarHBondContact O-CB 3.23Å; L269-M273 VanDerWaalsContact O-CG 3.3Å; L269-M273 WeakPolarHBondContact O-CG 3.39Å; L269-M273 PolarHBondContact O-N 3.5Å; Q270-M273 HydrophobicContact CB-CE 4.47Å; Q270-M273 PolarHBondContact O-N 3.15Å; M273-I276 PolarHBondContact O-N 3.05Å; M273-E277 WeakPolarHBondContact O-CB 3.11Å; M273-E277 PolarHBondContact O-N 3.28Å; M273-I320 HydrophobicContact CE-CD1 3.63Å; M273-I320 HydrophobicContact CE-CG1 4.16Å; M273-I320 HydrophobicContact CE-CG2 4.27Å; M273-I320 HydrophobicContact SD-CD1 4.08Å; M273-I320 HydrophobicContact SD-CG1 3.98Å; M273-I320 HydrophobicContact SD-CG2 4.22Å; M273-F365 HydrophobicContact CB-CD1 4.4Å; M273-F365 HydrophobicContact CB-CD2 4.29Å; M273-F365 HydrophobicContact CB-CE1 4.06Å; M273-F365 HydrophobicContact CB-CE2 3.94Å; M273-F365 HydrophobicContact CB-CG 4.49Å; M273-F365 HydrophobicContact CB-CZ 3.82Å; M273-F365 HydrophobicContact CG-CD1 3.73Å; M273-F365 HydrophobicContact CG-CD2 4.16Å; M273-F365 HydrophobicContact CG-CE1 3.81Å; M273-F365 HydrophobicContact CG-CE2 4.23Å; M273-F365 HydrophobicContact CG-CG 3.9Å; M273-F365 HydrophobicContact CG-CZ 4.07Å; M273-F365 WeakPolarHBondContact O-CZ 3.48Å; M273-F365 HydrophobicContact SD-CB 3.6Å; M273-F365 HydrophobicContact SD-CD1 3.96Å; M273-F365 HydrophobicContact SD-CD2 3.85Å; M273-F365 HydrophobicContact SD-CE2 4.47Å; M273-F365 HydrophobicContact SD-CG 3.55Å; M273-F365 VanDerWaalsContact SD-CG 3.55Å; M273-I367 HydrophobicContact CE-CG2 4.43Å; M273-I367 HydrophobicContact SD-CG2 3.77Å; M273-V392 HydrophobicContact CG-CG2 3.84Å; M273-V392 HydrophobicContact SD-CG2 4.02Å
274	Q	97.9	Very high	97.6	Very high	100 Å²	100	38 Å²	38	47%	0.467	19%	0.194	S	C	.	.	H	α-helix	trans	-60.8	-49.2	174.6	-177.8	176.3	-6.6	0	0	111.5	Q270 L272 I276 E277 E278	Q270-Q274 PolarHBondContact O-N 2.91Å; L272-Q274 PolarHBondContact O-N 3.15Å; Q274-I276 VanDerWaalsContact C-N 3.32Å; Q274-I276 PolarHBondContact O-N 3.1Å; Q274-E277 PolarHBondContact O-N 3.37Å; Q274-E278 HydrophobicContact CG-CG 4.4Å; Q274-E278 VanDerWaalsContact CG-OE1 3.29Å; Q274-E278 WeakPolarHBondContact CG-OE1 3.38Å; Q274-E278 PolarHBondContact NE2-OE1 2.99Å; Q274-E278 WeakPolarHBondContact O-CB 3.39Å; Q274-E278 WeakPolarHBondContact O-CG 3.4Å; Q274-E278 PolarHBondContact O-N 3.15Å
275	V	98.2	Very high	97.6	Very high	25 Å²	25	42.7 Å²	42.7	15%	0.152	22%	0.216	C	C	.	.	H	α-helix	trans	-63.1	-39.9	179	179.4	0	0	0	0	111.3	F175 I263 D271 L272 L279 F445	F175-V275 HydrophobicContact CZ-CG1 4.32Å; I263-V275 HydrophobicContact CD1-CB 4.4Å; I263-V275 HydrophobicContact CD1-CG1 4.27Å; I263-V275 HydrophobicContact CD1-CG2 4.01Å; D271-V275 PolarHBondContact O-N 2.79Å; L272-V275 PolarHBondContact O-N 3.11Å; L272-V275 VanDerWaalsContact O-N 3.16Å; V275-L279 WeakPolarHBondContact O-CB 3.26Å; V275-L279 PolarHBondContact O-N 3.38Å; V275-F445 HydrophobicContact CB-CE1 4.23Å; V275-F445 HydrophobicContact CG1-CE1 3.77Å; V275-F445 HydrophobicContact CG1-CZ 3.92Å
276	I	98.8	Very high	97.6	Very high	1 Å²	1	38.6 Å²	38.6	1%	0.005	20%	0.199	C	C	.	.	H	α-helix	trans	-61.8	-48	176.4	-69.4	165.9	0	0	0	111	L272 M273 Q274 L279 F280 F365 V392 L394 F403 F445	L272-I276 WeakPolarHBondContact O-CG1 3.44Å; L272-I276 PolarHBondContact O-N 3.39Å; M273-I276 PolarHBondContact O-N 3.05Å; Q274-I276 VanDerWaalsContact C-N 3.32Å; Q274-I276 PolarHBondContact O-N 3.1Å; I276-L279 PolarHBondContact O-N 3.49Å; I276-F280 PolarHBondContact O-N 3.16Å; I276-F365 HydrophobicContact CB-CE1 4.14Å; I276-F365 HydrophobicContact CB-CZ 4.22Å; I276-F365 HydrophobicContact CD1-CE1 4.32Å; I276-F365 HydrophobicContact CG2-CE1 3.76Å; I276-F365 HydrophobicContact CG2-CZ 3.98Å; I276-V392 HydrophobicContact CD1-CG1 4.44Å; I276-L394 HydrophobicContact CG2-CB 4.43Å; I276-L394 HydrophobicContact CG2-CD2 3.82Å; I276-F403 HydrophobicContact CB-CD1 4.4Å; I276-F403 HydrophobicContact CG1-CD1 4.05Å; I276-F403 HydrophobicContact CG1-CE1 4.43Å; I276-F403 HydrophobicContact CG2-CB 4.17Å; I276-F403 HydrophobicContact CG2-CD1 3.66Å; I276-F403 HydrophobicContact CG2-CD2 3.78Å; I276-F403 HydrophobicContact CG2-CE1 3.85Å; I276-F403 HydrophobicContact CG2-CE2 3.98Å; I276-F403 HydrophobicContact CG2-CG 3.61Å; I276-F403 HydrophobicContact CG2-CZ 4Å; I276-F445 HydrophobicContact CD1-CB 3.88Å; I276-F445 HydrophobicContact CD1-CD1 3.99Å; I276-F445 HydrophobicContact CD1-CG 3.94Å; I276-F445 HydrophobicContact CG1-CB 4.16Å; I276-F445 HydrophobicContact CG1-CD1 3.55Å; I276-F445 HydrophobicContact CG1-CD2 4.05Å; I276-F445 HydrophobicContact CG1-CE1 3.87Å; I276-F445 HydrophobicContact CG1-CE2 4.34Å; I276-F445 HydrophobicContact CG1-CG 3.64Å; I276-F445 HydrophobicContact CG1-CZ 4.25Å
277	E	98.6	Very high	97.8	Very high	36 Å²	36	38.2 Å²	38.2	17%	0.168	20%	0.197	C	C	.	.	H	α-helix	trans	-64.3	-44.4	179.6	179	167.7	170.9	0	0	111.6	M273 Q274 F280 K281 F318 F365	M273-E277 WeakPolarHBondContact O-CB 3.11Å; M273-E277 PolarHBondContact O-N 3.28Å; Q274-E277 PolarHBondContact O-N 3.37Å; E277-F280 PolarHBondContact O-N 3.39Å; E277-K281 HydrophobicContact CG-CD 3.98Å; E277-K281 HydrophobicContact CG-CG 4.5Å; E277-K281 WeakPolarHBondContact O-CB 3.32Å; E277-K281 WeakPolarHBondContact O-CG 3.45Å; E277-K281 PolarHBondContact O-N 3.38Å; E277-K281 WeakPolarHBondContact OE1-CE 3.46Å; E277-K281 IonicContact OE1-NZ 2.84Å; E277-K281 PolarHBondContact OE1-NZ 2.88Å; E277-F318 HydrophobicContact CB-CD2 3.83Å; E277-F318 HydrophobicContact CB-CE2 3.93Å; E277-F318 HydrophobicContact CG-CD1 4.42Å; E277-F318 HydrophobicContact CG-CD2 3.68Å; E277-F318 HydrophobicContact CG-CE1 4.41Å; E277-F318 HydrophobicContact CG-CE2 3.71Å; E277-F318 HydrophobicContact CG-CG 4.06Å; E277-F318 HydrophobicContact CG-CZ 4.08Å; E277-F365 HydrophobicContact CB-CZ 4.35Å
278	E	98.5	Very high	98.1	Very high	87 Å²	87	35.7 Å²	35.7	41%	0.407	18%	0.183	S	C	.	.	H	α-helix	trans	-62.6	-46.1	176.6	-74.1	177.2	-169.9	0	0	111.7	F169 Q274 F280 K281 A282	F169-E278 HydrophobicContact CE2-CB 4.11Å; F169-E278 HydrophobicContact CZ-CB 4.25Å; Q274-E278 HydrophobicContact CG-CG 4.4Å; Q274-E278 VanDerWaalsContact CG-OE1 3.29Å; Q274-E278 WeakPolarHBondContact CG-OE1 3.38Å; Q274-E278 PolarHBondContact NE2-OE1 2.99Å; Q274-E278 WeakPolarHBondContact O-CB 3.39Å; Q274-E278 WeakPolarHBondContact O-CG 3.4Å; Q274-E278 PolarHBondContact O-N 3.15Å; E278-F280 PolarHBondContact O-N 3.37Å; E278-K281 PolarHBondContact O-N 3.39Å; E278-A282 WeakPolarHBondContact O-CB 3.31Å; E278-A282 PolarHBondContact O-N 3.21Å
279	L	98.8	Very high	98.2	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-57.3	-50.9	176	171.4	61.4	0	0	0	110.8	F169 F170 V275 I276 T283 F403 F445	F169-L279 HydrophobicContact CB-CD1 4.29Å; F169-L279 HydrophobicContact CD1-CB 4.14Å; F169-L279 HydrophobicContact CD1-CD1 3.35Å; F169-L279 HydrophobicContact CD1-CG 4.28Å; F169-L279 HydrophobicContact CE1-CB 3.64Å; F169-L279 HydrophobicContact CE1-CD1 3.75Å; F169-L279 HydrophobicContact CE1-CG 4.2Å; F169-L279 HydrophobicContact CE2-CB 4.35Å; F169-L279 HydrophobicContact CG-CD1 3.82Å; F169-L279 HydrophobicContact CZ-CB 3.76Å; F170-L279 HydrophobicContact CE2-CD1 4.04Å; F170-L279 HydrophobicContact CE2-CD2 4.16Å; F170-L279 HydrophobicContact CZ-CD1 4.33Å; F170-L279 HydrophobicContact CZ-CD2 3.83Å; V275-L279 WeakPolarHBondContact O-CB 3.26Å; V275-L279 PolarHBondContact O-N 3.38Å; I276-L279 PolarHBondContact O-N 3.49Å; L279-T283 HydrophobicContact CD1-CG2 3.62Å; L279-T283 WeakPolarHBondContact O-CB 3.49Å; L279-T283 WeakPolarHBondContact O-CG2 3.12Å; L279-T283 PolarHBondContact O-N 2.92Å; L279-T283 VanDerWaalsContact O-N 3.1Å; L279-T283 PolarHBondContact O-OG1 2.83Å; L279-F403 HydrophobicContact CD2-CE1 3.89Å; L279-F403 HydrophobicContact CD2-CZ 4.23Å; L279-F445 HydrophobicContact CD2-CE2 3.7Å; L279-F445 HydrophobicContact CD2-CZ 4.02Å
280	F	98.7	Very high	98.2	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-60.7	-50	179.7	177.3	-90.3	0	0	0	111.7	I276 E277 E278 T283 T284 M313 L314 F318 L402 F403 Y452	I276-F280 PolarHBondContact O-N 3.16Å; E277-F280 PolarHBondContact O-N 3.39Å; E278-F280 PolarHBondContact O-N 3.37Å; F280-T283 PolarHBondContact O-OG1 3.26Å; F280-T284 WeakPolarHBondContact O-CB 3.27Å; F280-T284 PolarHBondContact O-N 3.34Å; F280-T284 VanDerWaalsContact O-N 3.12Å; F280-T284 PolarHBondContact O-OG1 2.91Å; F280-M313 HydrophobicContact CZ-CE 4.4Å; F280-L314 HydrophobicContact CD1-CD2 4.44Å; F280-L314 HydrophobicContact CE1-CD2 4.11Å; F280-F318 HydrophobicContact CD1-CE2 4.28Å; F280-F318 AromaticContact CD1-CZ 3.63Å; F280-F318 HydrophobicContact CD1-CZ 3.63Å; F280-F318 HydrophobicContact CE1-CZ 4.09Å; F280-F318 HydrophobicContact CG-CZ 4.35Å; F280-L402 HydrophobicContact CD2-CD2 3.73Å; F280-L402 HydrophobicContact CE2-CD2 3.71Å; F280-F403 HydrophobicContact CB-CE2 4.35Å; F280-F403 HydrophobicContact CB-CZ 4.43Å; F280-F403 HydrophobicContact CD2-CE2 4.41Å; F280-Y452 HydrophobicContact CD2-CD2 4.12Å; F280-Y452 HydrophobicContact CD2-CE2 4.05Å; F280-Y452 HydrophobicContact CE2-CD2 4.24Å; F280-Y452 HydrophobicContact CE2-CE2 4.2Å
281	K	98.6	Very high	98.1	Very high	33 Å²	33	37.8 Å²	37.8	14%	0.143	20%	0.197	C	C	.	.	H	α-helix	trans	-65.6	-49.6	-177.1	-75.2	-179.2	171.1	175.7	0	111.5	E277 E278 T284 M285 L314 N316 F318	E277-K281 HydrophobicContact CG-CD 3.98Å; E277-K281 HydrophobicContact CG-CG 4.5Å; E277-K281 WeakPolarHBondContact O-CB 3.32Å; E277-K281 WeakPolarHBondContact O-CG 3.45Å; E277-K281 PolarHBondContact O-N 3.38Å; E277-K281 WeakPolarHBondContact OE1-CE 3.46Å; E277-K281 IonicContact OE1-NZ 2.84Å; E277-K281 PolarHBondContact OE1-NZ 2.88Å; E278-K281 PolarHBondContact O-N 3.39Å; K281-T284 PolarHBondContact O-N 3.32Å; K281-M285 HydrophobicContact CB-CE 4.34Å; K281-M285 WeakPolarHBondContact O-CB 3.34Å; K281-M285 WeakPolarHBondContact O-CE 3.26Å; K281-M285 VanDerWaalsContact O-CG 3.28Å; K281-M285 WeakPolarHBondContact O-CG 3.47Å; K281-M285 PolarHBondContact O-N 3.4Å; K281-L314 HydrophobicContact CB-CD2 4.34Å; K281-L314 HydrophobicContact CG-CD2 4.05Å; K281-N316 WeakPolarHBondContact CE-O 3.44Å; K281-N316 PolarHBondContact NZ-O 2.94Å; K281-F318 HydrophobicContact CG-CZ 4.41Å
282	A	98.4	Very high	98.1	Very high	26 Å²	26	38 Å²	38	22%	0.215	20%	0.202	C	C	.	.	H	α-helix	trans	-63.2	-48.9	-176.4	0	0	0	0	0	111.9	F169 E278 T284 M285 M286	F169-A282 HydrophobicContact CD2-CB 3.87Å; F169-A282 HydrophobicContact CE2-CB 4.31Å; E278-A282 WeakPolarHBondContact O-CB 3.31Å; E278-A282 PolarHBondContact O-N 3.21Å; A282-T284 PolarHBondContact O-N 3.03Å; A282-M285 PolarHBondContact O-N 3.45Å; A282-M286 HydrophobicContact CB-CE 4.36Å; A282-M286 WeakPolarHBondContact O-CG 3.22Å; A282-M286 PolarHBondContact O-N 3.15Å
283	T	98.6	Very high	98	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-64.3	-41	-179.9	57.5	0	0	0	0	112.2	A165 I166 F169 L279 F280 M286 V287 Y452	A165-T283 HydrophobicContact CB-CG2 4.49Å; I166-T283 HydrophobicContact CB-CG2 4.37Å; I166-T283 HydrophobicContact CG1-CG2 3.71Å; F169-T283 HydrophobicContact CB-CG2 4.12Å; L279-T283 HydrophobicContact CD1-CG2 3.62Å; L279-T283 WeakPolarHBondContact O-CB 3.49Å; L279-T283 WeakPolarHBondContact O-CG2 3.12Å; L279-T283 PolarHBondContact O-N 2.92Å; L279-T283 VanDerWaalsContact O-N 3.1Å; L279-T283 PolarHBondContact O-OG1 2.83Å; F280-T283 PolarHBondContact O-OG1 3.26Å; T283-M286 HydrophobicContact CG2-CE 4.25Å; T283-M286 PolarHBondContact O-N 3.37Å; T283-V287 WeakPolarHBondContact O-CG2 3.43Å; T283-V287 PolarHBondContact O-N 3.32Å; T283-Y452 PolarHBondContact OG1-OH 3.45Å
284	T	98.6	Very high	98	Very high	1 Å²	1	43.4 Å²	43.4	1%	0.006	23%	0.228	C	C	.	.	H	α-helix	trans	-64.4	-45.5	176.8	-56.9	0	0	0	0	111.3	F280 K281 A282 M286 V287 L288 L310 L314 Y452 I456	F280-T284 WeakPolarHBondContact O-CB 3.27Å; F280-T284 PolarHBondContact O-N 3.34Å; F280-T284 VanDerWaalsContact O-N 3.12Å; F280-T284 PolarHBondContact O-OG1 2.91Å; K281-T284 PolarHBondContact O-N 3.32Å; A282-T284 PolarHBondContact O-N 3.03Å; T284-M286 VanDerWaalsContact C-N 3.33Å; T284-M286 PolarHBondContact O-N 2.78Å; T284-V287 PolarHBondContact O-N 3.27Å; T284-L288 HydrophobicContact CG2-CD1 4.17Å; T284-L288 HydrophobicContact CG2-CG 4.35Å; T284-L288 VanDerWaalsContact O-CG 3.26Å; T284-L288 WeakPolarHBondContact O-CG 3.26Å; T284-L288 PolarHBondContact O-N 3.11Å; T284-L310 HydrophobicContact CG2-CD1 3.83Å; T284-L310 HydrophobicContact CG2-CD2 4.11Å; T284-L310 HydrophobicContact CG2-CG 4.24Å; T284-L314 HydrophobicContact CG2-CD1 3.96Å; T284-L314 HydrophobicContact CG2-CD2 4.06Å; T284-L314 HydrophobicContact CG2-CG 4.46Å; T284-Y452 VanDerWaalsContact CA-OH 3.29Å; T284-Y452 WeakPolarHBondContact CA-OH 3.39Å; T284-Y452 PolarHBondContact N-OH 3.11Å; T284-Y452 VanDerWaalsContact N-OH 3.14Å; T284-Y452 WeakPolarHBondContact OG1-CE2 3.32Å; T284-Y452 PolarHBondContact OG1-OH 3.34Å; T284-Y452 VanDerWaalsContact OG1-OH 3.12Å; T284-I456 HydrophobicContact CG2-CB 4.47Å; T284-I456 HydrophobicContact CG2-CG2 3.9Å
285	M	98.4	Very high	98	Very high	108 Å²	108	38.9 Å²	38.9	53%	0.532	21%	0.207	S	C	.	.	H	α-helix	trans	-60.9	-41	176.5	-73.5	-173.8	-65.8	0	0	112.2	K281 A282 L288 S289	K281-M285 HydrophobicContact CB-CE 4.34Å; K281-M285 WeakPolarHBondContact O-CB 3.34Å; K281-M285 WeakPolarHBondContact O-CE 3.26Å; K281-M285 VanDerWaalsContact O-CG 3.28Å; K281-M285 WeakPolarHBondContact O-CG 3.47Å; K281-M285 PolarHBondContact O-N 3.4Å; A282-M285 PolarHBondContact O-N 3.45Å; M285-L288 PolarHBondContact O-N 3.46Å; M285-S289 WeakPolarHBondContact O-CB 3.41Å; M285-S289 PolarHBondContact O-N 2.98Å; M285-S289 PolarHBondContact O-OG 3.19Å
286	M	98.3	Very high	97.9	Very high	48 Å²	48	41.6 Å²	41.6	24%	0.236	22%	0.218	C	C	.	.	H	α-helix	trans	-59.3	-50.2	174.8	-75.5	-173.6	-84.7	0	0	111.3	A165 F169 A282 T283 T284 L288 S289 H290	A165-M286 HydrophobicContact CB-CB 3.88Å; A165-M286 HydrophobicContact CB-CE 4.02Å; A165-M286 HydrophobicContact CB-SD 4.17Å; A165-M286 WeakPolarHBondContact O-CE 3.21Å; F169-M286 HydrophobicContact CB-CE 4.29Å; A282-M286 HydrophobicContact CB-CE 4.36Å; A282-M286 WeakPolarHBondContact O-CG 3.22Å; A282-M286 PolarHBondContact O-N 3.15Å; T283-M286 HydrophobicContact CG2-CE 4.25Å; T283-M286 PolarHBondContact O-N 3.37Å; T284-M286 VanDerWaalsContact C-N 3.33Å; T284-M286 PolarHBondContact O-N 2.78Å; M286-L288 PolarHBondContact O-N 2.92Å; M286-S289 PolarHBondContact O-N 3.25Å; M286-S289 VanDerWaalsContact O-N 3.13Å; M286-S289 PolarHBondContact O-OG 3.32Å; M286-H290 WeakPolarHBondContact O-CB 3.34Å; M286-H290 PolarHBondContact O-N 2.84Å
287	V	98.5	Very high	97.8	Very high	1 Å²	1	42.8 Å²	42.8	1%	0.006	22%	0.224	C	C	.	.	H	α-helix	trans	-58.1	-46.7	177.7	170	0	0	0	0	111.9	I158 E161 A162 A165 T283 T284 S289 H290 C291 V295 I456	I158-V287 HydrophobicContact CG2-CG1 3.7Å; E161-V287 HydrophobicContact CG-CG2 4.44Å; A162-V287 HydrophobicContact CB-CG2 3.81Å; A165-V287 HydrophobicContact CB-CG2 4.43Å; T283-V287 WeakPolarHBondContact O-CG2 3.43Å; T283-V287 PolarHBondContact O-N 3.32Å; T284-V287 PolarHBondContact O-N 3.27Å; V287-S289 PolarHBondContact O-N 3.45Å; V287-H290 PolarHBondContact O-N 2.77Å; V287-C291 PolarHBondContact O-N 3.31Å; V287-V295 HydrophobicContact CG1-CG2 4.22Å; V287-I456 HydrophobicContact CG1-CD1 4.03Å
288	L	97.8	Very high	97.7	Very high	53 Å²	53	41.1 Å²	41.1	28%	0.277	22%	0.216	S	C	.	.	H	α-helix	trans	-61.2	-34.8	178.5	-68.6	179.9	0	0	0	112.3	T284 M285 M286 V295 L310 L314	T284-L288 HydrophobicContact CG2-CD1 4.17Å; T284-L288 HydrophobicContact CG2-CG 4.35Å; T284-L288 VanDerWaalsContact O-CG 3.26Å; T284-L288 WeakPolarHBondContact O-CG 3.26Å; T284-L288 PolarHBondContact O-N 3.11Å; M285-L288 PolarHBondContact O-N 3.46Å; M286-L288 PolarHBondContact O-N 2.92Å; L288-V295 HydrophobicContact CD2-CB 4.4Å; L288-V295 HydrophobicContact CD2-CG1 3.69Å; L288-V295 HydrophobicContact CD2-CG2 4.29Å; L288-L310 HydrophobicContact CD1-CD2 3.98Å; L288-L310 HydrophobicContact CD2-CD2 3.86Å; L288-L310 HydrophobicContact CG-CD2 4.34Å; L288-L314 HydrophobicContact CD1-CD1 3.77Å
289	S	97.8	Very high	97.6	Very high	74 Å²	74	37.4 Å²	37.4	52%	0.517	20%	0.199	S	C	.	.	H	α-helix	trans	-78.3	-36.7	-179.9	75.5	0	0	0	0	113.6	M285 M286 V287	M285-S289 WeakPolarHBondContact O-CB 3.41Å; M285-S289 PolarHBondContact O-N 2.98Å; M285-S289 PolarHBondContact O-OG 3.19Å; M286-S289 PolarHBondContact O-N 3.25Å; M286-S289 VanDerWaalsContact O-N 3.13Å; M286-S289 PolarHBondContact O-OG 3.32Å; V287-S289 PolarHBondContact O-N 3.45Å
290	H	97	Very high	97.4	Very high	115 Å²	115	43.6 Å²	43.6	53%	0.532	23%	0.226	S	C	.	.	H	α-helix	trans	-91.2	-24.7	-173.8	-68.6	170.5	0	0	0	113.5	E161 M286 V287	E161-H290 HydrophobicContact CG-CB 3.83Å; E161-H290 IonicContact OE1-CE1 3.39Å; E161-H290 IonicContact OE1-CG 3.03Å; E161-H290 IonicContact OE1-ND1 2.92Å; E161-H290 PolarHBondContact OE1-ND1 3.34Å; M286-H290 WeakPolarHBondContact O-CB 3.34Å; M286-H290 PolarHBondContact O-N 2.84Å; V287-H290 PolarHBondContact O-N 2.77Å
291	C	96	Very high	97	Very high	15 Å²	15	47.6 Å²	47.6	10%	0.101	24%	0.244	C	C	.	.	S	Bend	trans	-126.7	46.4	-179.3	-70.1	0	0	0	0	113.4	I158 V287 E293 D294 V295	I158-C291 HydrophobicContact CG1-CB 4.15Å; V287-C291 PolarHBondContact O-N 3.31Å; C291-E293 PolarHBondContact O-N 3.22Å; C291-D294 HydrophobicContact CB-CB 4.3Å; C291-D294 PolarHBondContact O-N 2.86Å; C291-V295 WeakPolarHBondContact O-CG2 3.42Å; C291-V295 PolarHBondContact O-N 3.25Å
292	P	96.6	Very high	96.7	Very high	70 Å²	70	48.3 Å²	48.3	46%	0.455	25%	0.249	S	C	.	.	H	α-helix	trans	-61.8	-40.1	-170.2	24.9	-34.6	0	0	0	113.1	E296	P292-E296 VanDerWaalsContact O-CB 3.25Å; P292-E296 WeakPolarHBondContact O-CB 3.32Å; P292-E296 PolarHBondContact O-N 3.43Å
293	E	96	Very high	96.5	Very high	107 Å²	107	47.8 Å²	47.8	50%	0.5	24%	0.244	S	C	.	.	H	α-helix	trans	-68.6	-41.4	-178.4	-66	154.2	-166.8	0	0	112.2	L70 C291 L297	L70-E293 HydrophobicContact CD2-CB 4.33Å; C291-E293 PolarHBondContact O-N 3.22Å; E293-L297 PolarHBondContact O-N 2.93Å
294	D	97.8	Very high	96.3	Very high	11 Å²	11	53 Å²	53	6%	0.059	28%	0.278	C	S	.	.	H	α-helix	trans	-66.3	-42.6	178.2	-78.2	-39.6	0	0	0	111	L70 S154 R157 I158 C291 C298	L70-D294 WeakPolarHBondContact CB-OD1 3.3Å; S154-D294 WeakPolarHBondContact CA-OD1 3.13Å; S154-D294 VanDerWaalsContact CB-OD1 3.24Å; S154-D294 WeakPolarHBondContact CB-OD1 3.48Å; S154-D294 PolarHBondContact OG-OD1 2.96Å; R157-D294 IonicContact CZ-OD1 3.77Å; R157-D294 IonicContact CZ-OD2 2.72Å; R157-D294 IonicContact NE-OD1 3.75Å; R157-D294 PolarHBondContact NE-OD1 3.24Å; R157-D294 IonicContact NE-OD2 2.68Å; R157-D294 PolarHBondContact NE-OD2 2.84Å; R157-D294 IonicContact NH2-OD1 3.56Å; R157-D294 PolarHBondContact NH2-OD1 3.16Å; R157-D294 IonicContact NH2-OD2 3.38Å; I158-D294 HydrophobicContact CD1-CB 3.81Å; I158-D294 HydrophobicContact CG1-CB 3.78Å; C291-D294 HydrophobicContact CB-CB 4.3Å; C291-D294 PolarHBondContact O-N 2.86Å; D294-C298 PolarHBondContact O-N 3.48Å; D294-C298 PolarHBondContact O-SG 3.1Å
295	V	97.8	Very high	96.1	Very high	6 Å²	6	54.7 Å²	54.7	4%	0.036	30%	0.296	C	S	.	.	H	α-helix	trans	-66.5	-46.8	177.1	173.4	0	0	0	0	110.8	I158 V287 L288 C291 L297 C298 H299 L457	I158-V295 HydrophobicContact CD1-CG2 3.83Å; I158-V295 HydrophobicContact CG1-CG2 4.14Å; V287-V295 HydrophobicContact CG1-CG2 4.22Å; L288-V295 HydrophobicContact CD2-CB 4.4Å; L288-V295 HydrophobicContact CD2-CG1 3.69Å; L288-V295 HydrophobicContact CD2-CG2 4.29Å; C291-V295 WeakPolarHBondContact O-CG2 3.42Å; C291-V295 PolarHBondContact O-N 3.25Å; V295-L297 VanDerWaalsContact C-N 3.28Å; V295-L297 PolarHBondContact O-N 3.09Å; V295-C298 WeakPolarHBondContact O-CA 3.32Å; V295-C298 WeakPolarHBondContact O-CB 3.35Å; V295-C298 PolarHBondContact O-N 3.15Å; V295-H299 WeakPolarHBondContact CG1-CE1 3Å; V295-H299 PolarHBondContact O-N 3.26Å; V295-L457 HydrophobicContact CG2-CD2 4.36Å
296	E	97.2	Very high	96	Very high	81 Å²	81	50.7 Å²	50.7	38%	0.379	28%	0.276	S	S	.	.	H	α-helix	trans	-61.8	-36.5	179.6	-177.2	66.7	-141.4	0	0	111.4	P292 C298 H299 K300 K307	P292-E296 VanDerWaalsContact O-CB 3.25Å; P292-E296 WeakPolarHBondContact O-CB 3.32Å; P292-E296 PolarHBondContact O-N 3.43Å; E296-C298 VanDerWaalsContact C-N 3.32Å; E296-C298 PolarHBondContact O-N 3.14Å; E296-H299 PolarHBondContact O-N 3.19Å; E296-K300 WeakPolarHBondContact O-CB 3.47Å; E296-K300 PolarHBondContact O-N 3.43Å; E296-K307 IonicContact OE2-NZ 3.8Å; E296-K307 PolarHBondContact OE2-NZ 3.29Å
297	L	95.9	Very high	95.9	Very high	26 Å²	26	52.4 Å²	52.4	14%	0.136	28%	0.282	C	S	.	.	H	α-helix	trans	-57.1	-46.1	171.1	-174.7	91.3	0	0	0	111.4	L70 N150 V151 S154 E293 V295 K300 F301	L70-L297 HydrophobicContact CD1-CD1 4.32Å; L70-L297 HydrophobicContact CD1-CD2 3.96Å; L70-L297 HydrophobicContact CD2-CB 3.95Å; L70-L297 HydrophobicContact CD2-CD1 4.1Å; L70-L297 HydrophobicContact CD2-CD2 4.41Å; L70-L297 HydrophobicContact CD2-CG 4.36Å; N150-L297 HydrophobicContact CB-CD2 4.19Å; V151-L297 HydrophobicContact CG2-CD2 4.34Å; S154-L297 VanDerWaalsContact OG-CD2 3.24Å; S154-L297 WeakPolarHBondContact OG-CD2 3.24Å; E293-L297 PolarHBondContact O-N 2.93Å; V295-L297 VanDerWaalsContact C-N 3.28Å; V295-L297 PolarHBondContact O-N 3.09Å; L297-K300 PolarHBondContact O-N 3.02Å; L297-F301 HydrophobicContact CD1-CD2 3.73Å; L297-F301 HydrophobicContact CD1-CE2 3.81Å; L297-F301 HydrophobicContact CG-CD2 4.05Å; L297-F301 WeakPolarHBondContact O-CD2 3.22Å; L297-F301 PolarHBondContact O-N 2.94Å
298	C	95.5	Very high	95.8	Very high	1 Å²	1	57.7 Å²	57.7	1%	0.007	31%	0.31	C	S	.	.	H	α-helix	trans	-65.3	-49.6	-179.9	-62.6	0	0	0	0	111.1	D294 V295 E296 K300 F301 I302 A303 L457	D294-C298 PolarHBondContact O-N 3.48Å; D294-C298 PolarHBondContact O-SG 3.1Å; V295-C298 WeakPolarHBondContact O-CA 3.32Å; V295-C298 WeakPolarHBondContact O-CB 3.35Å; V295-C298 PolarHBondContact O-N 3.15Å; E296-C298 VanDerWaalsContact C-N 3.32Å; E296-C298 PolarHBondContact O-N 3.14Å; C298-K300 VanDerWaalsContact C-N 3.26Å; C298-K300 PolarHBondContact O-N 3.08Å; C298-F301 PolarHBondContact O-N 3.26Å; C298-I302 WeakPolarHBondContact O-CA 3.27Å; C298-I302 VanDerWaalsContact O-CB 3.26Å; C298-I302 WeakPolarHBondContact O-CB 3.3Å; C298-I302 PolarHBondContact O-N 2.8Å; C298-A303 PolarHBondContact O-N 3.05Å; C298-A303 VanDerWaalsContact O-N 3.1Å; C298-L457 HydrophobicContact CB-CD2 4.36Å
299	H	96.5	Very high	95.7	Very high	10 Å²	10	58.3 Å²	58.3	5%	0.046	31%	0.313	C	S	.	.	H	α-helix	trans	-63	-32.2	178.6	-65.8	172.9	0	0	0	112.4	V295 E296 A303 P304 K307 I456	V295-H299 WeakPolarHBondContact CG1-CE1 3Å; V295-H299 PolarHBondContact O-N 3.26Å; E296-H299 PolarHBondContact O-N 3.19Å; H299-A303 CarbonylContact O-C 3.57Å; H299-P304 WeakPolarHBondContact O-CA 3.42Å; H299-P304 VanDerWaalsContact O-N 3.11Å; H299-K307 HydrophobicContact CB-CB 4.4Å; H299-I456 PolarHBondContact NE2-O 3.43Å
300	K	95.3	Very high	95.7	Very high	129 Å²	129	54.9 Å²	54.9	56%	0.561	29%	0.289	S	S	*	.	H	α-helix	trans	-76.9	-39.7	179.2	-176	171.4	-178.5	170.2	0	113.9	E296 L297 C298	E296-K300 WeakPolarHBondContact O-CB 3.47Å; E296-K300 PolarHBondContact O-N 3.43Å; L297-K300 PolarHBondContact O-N 3.02Å; C298-K300 VanDerWaalsContact C-N 3.26Å; C298-K300 PolarHBondContact O-N 3.08Å
301	F	91.4	Very high	95.6	Very high	85 Å²	85	52.8 Å²	52.8	37%	0.373	28%	0.279	S	S	.	.	H	α-helix	trans	-113.4	-18.9	-168.1	-63.6	-61.6	0	0	0	114.9	L297 C298	L297-F301 HydrophobicContact CD1-CD2 3.73Å; L297-F301 HydrophobicContact CD1-CE2 3.81Å; L297-F301 HydrophobicContact CG-CD2 4.05Å; L297-F301 WeakPolarHBondContact O-CD2 3.22Å; L297-F301 PolarHBondContact O-N 2.94Å; C298-F301 PolarHBondContact O-N 3.26Å
302	I	91.6	Very high	95.7	Very high	48 Å²	48	55.8 Å²	55.8	25%	0.246	29%	0.292	C	S	.	.	T	Hydrogen-bonded Turn	trans	-106.4	-47.3	179.9	-52.9	-58.9	0	0	0	110.6	L136 V151 C298 V459	L136-I302 HydrophobicContact CD1-CD1 4.38Å; V151-I302 HydrophobicContact CG1-CD1 3.61Å; V151-I302 HydrophobicContact CG1-CG1 3.86Å; V151-I302 HydrophobicContact CG2-CD1 4.1Å; C298-I302 WeakPolarHBondContact O-CA 3.27Å; C298-I302 VanDerWaalsContact O-CB 3.26Å; C298-I302 WeakPolarHBondContact O-CB 3.3Å; C298-I302 PolarHBondContact O-N 2.8Å; I302-V459 HydrophobicContact CG2-CG2 4.16Å
303	A	93.5	Very high	95.7	Very high	14 Å²	14	52.5 Å²	52.5	12%	0.116	27%	0.27	C	S	.	.			trans	-136.7	72.6	-174.9	0	0	0	0	0	112.7	C298 H299 G305 Q306 G458	C298-A303 PolarHBondContact O-N 3.05Å; C298-A303 VanDerWaalsContact O-N 3.1Å; H299-A303 CarbonylContact O-C 3.57Å; A303-G305 PolarHBondContact O-N 3Å; A303-Q306 HydrophobicContact CB-CB 3.77Å; A303-Q306 HydrophobicContact CB-CG 4.42Å; A303-Q306 WeakPolarHBondContact O-CB 3.28Å; A303-Q306 PolarHBondContact O-N 3.41Å; A303-G458 WeakPolarHBondContact CB-O 3.08Å
304	P	94.9	Very high	95.7	Very high	110 Å²	110	48.8 Å²	48.8	71%	0.714	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.9	130.2	174.2	-25.7	35.4	0	0	0	111.9	H299	H299-P304 WeakPolarHBondContact O-CA 3.42Å; H299-P304 VanDerWaalsContact O-N 3.11Å
305	G	94.4	Very high	95.7	Very high	37 Å²	37	55.5 Å²	55.5	38%	0.381	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	89.9	-10.7	-176	0	0	0	0	0	114.7	A303 K307 D308 I309	A303-G305 PolarHBondContact O-N 3Å; G305-K307 PolarHBondContact O-N 2.81Å; G305-D308 PolarHBondContact O-N 2.75Å; G305-I309 PolarHBondContact O-N 2.77Å
306	Q	96.2	Very high	95.7	Very high	23 Å²	23	58 Å²	58	11%	0.107	30%	0.295	C	S	.	.	H	α-helix	trans	-61.2	-33.3	179.4	-174.1	61.1	27.4	0	0	112.8	A303 D308 I309 L310 C455	A303-Q306 HydrophobicContact CB-CB 3.77Å; A303-Q306 HydrophobicContact CB-CG 4.42Å; A303-Q306 WeakPolarHBondContact O-CB 3.28Å; A303-Q306 PolarHBondContact O-N 3.41Å; Q306-D308 VanDerWaalsContact C-N 3.35Å; Q306-D308 PolarHBondContact O-N 2.51Å; Q306-I309 PolarHBondContact O-N 3.44Å; Q306-L310 WeakPolarHBondContact O-CB 3.4Å; Q306-L310 PolarHBondContact O-N 3.07Å; Q306-C455 PolarHBondContact NE2-O 2.93Å
307	K	96.2	Very high	95.6	Very high	85 Å²	85	60.1 Å²	60.1	37%	0.37	31%	0.309	S	S	.	.	H	α-helix	trans	-55.3	-49.3	175.6	-174.9	174.4	-174.3	165	0	112	E296 H299 G305 I309 L310 E311	E296-K307 IonicContact OE2-NZ 3.8Å; E296-K307 PolarHBondContact OE2-NZ 3.29Å; H299-K307 HydrophobicContact CB-CB 4.4Å; G305-K307 PolarHBondContact O-N 2.81Å; K307-I309 PolarHBondContact O-N 3.03Å; K307-L310 PolarHBondContact O-N 2.89Å; K307-E311 WeakPolarHBondContact O-CB 3.47Å; K307-E311 WeakPolarHBondContact O-CG 3.16Å; K307-E311 PolarHBondContact O-N 3.26Å
308	D	96.6	Very high	95.7	Very high	112 Å²	112	59.5 Å²	59.5	60%	0.599	31%	0.306	S	S	*	.	H	α-helix	trans	-67.1	-39.4	-178.5	-58.9	-35.1	0	0	0	111.2	G305 Q306 H312	G305-D308 PolarHBondContact O-N 2.75Å; Q306-D308 VanDerWaalsContact C-N 3.35Å; Q306-D308 PolarHBondContact O-N 2.51Å; D308-H312 VanDerWaalsContact O-CB 3.26Å; D308-H312 WeakPolarHBondContact O-CB 3.39Å; D308-H312 PolarHBondContact O-N 2.81Å
309	I	95.9	Very high	95.8	Very high	65 Å²	65	62.9 Å²	62.9	33%	0.333	32%	0.323	S	S	.	.	H	α-helix	trans	-61.3	-48.3	174.6	-60.6	171.8	0	0	0	110	G305 Q306 K307 H312 M313 P397	G305-I309 PolarHBondContact O-N 2.77Å; Q306-I309 PolarHBondContact O-N 3.44Å; K307-I309 PolarHBondContact O-N 3.03Å; I309-H312 WeakPolarHBondContact O-CB 3.4Å; I309-H312 PolarHBondContact O-N 2.9Å; I309-M313 HydrophobicContact CG2-CE 4.31Å; I309-M313 VanDerWaalsContact O-CG 3.31Å; I309-M313 WeakPolarHBondContact O-CG 3.26Å; I309-M313 PolarHBondContact O-N 2.87Å; I309-P397 HydrophobicContact CG2-CB 3.95Å; I309-P397 HydrophobicContact CG2-CG 4.42Å
310	L	96.6	Very high	95.9	Very high	2 Å²	2	65.8 Å²	65.8	1%	0.01	34%	0.339	C	S	.	.	H	α-helix	trans	-63.2	-46.2	-179.9	-171.9	62.3	0	0	0	112	T284 L288 Q306 K307 H312 M313 L314 I456	T284-L310 HydrophobicContact CG2-CD1 3.83Å; T284-L310 HydrophobicContact CG2-CD2 4.11Å; T284-L310 HydrophobicContact CG2-CG 4.24Å; L288-L310 HydrophobicContact CD1-CD2 3.98Å; L288-L310 HydrophobicContact CD2-CD2 3.86Å; L288-L310 HydrophobicContact CG-CD2 4.34Å; Q306-L310 WeakPolarHBondContact O-CB 3.4Å; Q306-L310 PolarHBondContact O-N 3.07Å; K307-L310 PolarHBondContact O-N 2.89Å; L310-H312 VanDerWaalsContact C-N 3.29Å; L310-H312 PolarHBondContact O-N 2.75Å; L310-M313 HydrophobicContact CB-CE 4.33Å; L310-M313 HydrophobicContact CD1-CE 3.52Å; L310-M313 PolarHBondContact O-N 3.48Å; L310-L314 HydrophobicContact CG-CD1 4.23Å; L310-L314 VanDerWaalsContact O-CG 3.3Å; L310-L314 WeakPolarHBondContact O-CG 3.12Å; L310-L314 PolarHBondContact O-N 2.86Å; L310-I456 HydrophobicContact CD1-CB 4.37Å; L310-I456 HydrophobicContact CD1-CG2 4.25Å; L310-I456 HydrophobicContact CD2-CB 4.37Å
311	E	96.5	Very high	96	Very high	71 Å²	71	60.7 Å²	60.7	33%	0.332	32%	0.317	S	S	.	.	H	α-helix	trans	-60.7	-39.5	175	-75.5	-171.9	-159	0	0	112.1	K307 L314 K315	K307-E311 WeakPolarHBondContact O-CB 3.47Å; K307-E311 WeakPolarHBondContact O-CG 3.16Å; K307-E311 PolarHBondContact O-N 3.26Å; E311-L314 PolarHBondContact O-N 3.03Å; E311-K315 WeakPolarHBondContact O-CB 3.41Å; E311-K315 WeakPolarHBondContact O-CD 3.46Å; E311-K315 WeakPolarHBondContact O-CG 3.41Å; E311-K315 PolarHBondContact O-N 3.07Å; E311-K315 IonicContact OE2-NZ 3.24Å; E311-K315 PolarHBondContact OE2-NZ 3.11Å
312	H	96.8	Very high	96.3	Very high	79 Å²	79	57.8 Å²	57.8	37%	0.366	31%	0.307	S	S	.	.	H	α-helix	trans	-64.2	-44.1	175.9	-175	63.9	0	0	0	111.5	D308 I309 L310 L314 K315 N316 G360 I362	D308-H312 VanDerWaalsContact O-CB 3.26Å; D308-H312 WeakPolarHBondContact O-CB 3.39Å; D308-H312 PolarHBondContact O-N 2.81Å; I309-H312 WeakPolarHBondContact O-CB 3.4Å; I309-H312 PolarHBondContact O-N 2.9Å; L310-H312 VanDerWaalsContact C-N 3.29Å; L310-H312 PolarHBondContact O-N 2.75Å; H312-L314 PolarHBondContact O-N 3.28Å; H312-K315 PolarHBondContact O-N 3.38Å; H312-N316 PolarHBondContact CE1-ND2 3.08Å; H312-N316 VanDerWaalsContact CE1-ND2 3.31Å; H312-N316 PolarHBondContact ND1-ND2 2.82Å; H312-N316 PolarHBondContact O-N 3.46Å; H312-N316 PolarHBondContact O-ND2 2.92Å; H312-G360 PolarHBondContact NE2-O 3.2Å; H312-I362 VanDerWaalsContact CD2-CG2 3.47Å; H312-I362 WeakPolarHBondContact CD2-CG2 3.23Å; H312-I362 VanDerWaalsContact NE2-CG2 3.26Å; H312-I362 WeakPolarHBondContact NE2-CG2 3.21Å
313	M	96.6	Very high	96.7	Very high	0 Å²	0	55.5 Å²	55.5	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-60.3	-44.3	174.8	-66.3	-170.7	-69	0	0	112.1	F280 I309 L310 P363 P397	F280-M313 HydrophobicContact CZ-CE 4.4Å; I309-M313 HydrophobicContact CG2-CE 4.31Å; I309-M313 VanDerWaalsContact O-CG 3.31Å; I309-M313 WeakPolarHBondContact O-CG 3.26Å; I309-M313 PolarHBondContact O-N 2.87Å; L310-M313 HydrophobicContact CB-CE 4.33Å; L310-M313 HydrophobicContact CD1-CE 3.52Å; L310-M313 PolarHBondContact O-N 3.48Å; M313-P363 HydrophobicContact CB-CG 4.09Å; M313-P363 HydrophobicContact CG-CG 4.03Å; M313-P363 HydrophobicContact SD-CG 3.99Å; M313-P397 HydrophobicContact CG-CG 4.02Å; M313-P397 HydrophobicContact SD-CB 4.24Å; M313-P397 WeakPolarHBondContact SD-CD 3.32Å; M313-P397 HydrophobicContact SD-CG 3.62Å
314	L	97.1	Very high	96.8	Very high	30 Å²	30	57.3 Å²	57.3	16%	0.157	31%	0.305	C	S	.	.	H	α-helix	trans	-70.4	-32	-176.6	-67.9	174.2	0	0	0	113.2	F280 K281 T284 L288 L310 E311 H312	F280-L314 HydrophobicContact CD1-CD2 4.44Å; F280-L314 HydrophobicContact CE1-CD2 4.11Å; K281-L314 HydrophobicContact CB-CD2 4.34Å; K281-L314 HydrophobicContact CG-CD2 4.05Å; T284-L314 HydrophobicContact CG2-CD1 3.96Å; T284-L314 HydrophobicContact CG2-CD2 4.06Å; T284-L314 HydrophobicContact CG2-CG 4.46Å; L288-L314 HydrophobicContact CD1-CD1 3.77Å; L310-L314 HydrophobicContact CG-CD1 4.23Å; L310-L314 VanDerWaalsContact O-CG 3.3Å; L310-L314 WeakPolarHBondContact O-CG 3.12Å; L310-L314 PolarHBondContact O-N 2.86Å; E311-L314 PolarHBondContact O-N 3.03Å; H312-L314 PolarHBondContact O-N 3.28Å
315	K	97	Very high	96.9	Very high	151 Å²	151	56.6 Å²	56.6	66%	0.657	29%	0.292	S	S	*	.	H	α-helix	trans	-78	-23.1	-179	-73.3	168.6	-168.7	161.9	0	113.7	E311 H312	E311-K315 WeakPolarHBondContact O-CB 3.41Å; E311-K315 WeakPolarHBondContact O-CD 3.46Å; E311-K315 WeakPolarHBondContact O-CG 3.41Å; E311-K315 PolarHBondContact O-N 3.07Å; E311-K315 IonicContact OE2-NZ 3.24Å; E311-K315 PolarHBondContact OE2-NZ 3.11Å; H312-K315 PolarHBondContact O-N 3.38Å
316	N	97.1	Very high	97.1	Very high	59 Å²	59	54.8 Å²	54.8	32%	0.316	27%	0.274	S	S	.	.	S	Bend	trans	-100.1	157.3	-176.1	-71.5	-83	0	0	0	111.6	K281 H312 I362	K281-N316 WeakPolarHBondContact CE-O 3.44Å; K281-N316 PolarHBondContact NZ-O 2.94Å; H312-N316 PolarHBondContact CE1-ND2 3.08Å; H312-N316 VanDerWaalsContact CE1-ND2 3.31Å; H312-N316 PolarHBondContact ND1-ND2 2.82Å; H312-N316 PolarHBondContact O-N 3.46Å; H312-N316 PolarHBondContact O-ND2 2.92Å; N316-I362 HydrophobicContact CB-CD1 4.4Å; N316-I362 HydrophobicContact CB-CG2 3.89Å
317	N	95.3	Very high	97.2	Very high	125 Å²	125	53.9 Å²	53.9	67%	0.668	27%	0.27	S	S	*	.	P	Polyproline II helix	trans	-77.7	148.9	167.6	-63.3	-24.2	0	0	0	109.3
318	F	97.8	Very high	97.3	Very high	13 Å²	13	54.9 Å²	54.9	6%	0.057	28%	0.276	C	S	.	.	P	Polyproline II helix	trans	-76.8	138.5	178.7	-62.4	-3.8	0	0	0	109.7	E277 F280 K281 P363 F365 L394	E277-F318 HydrophobicContact CB-CD2 3.83Å; E277-F318 HydrophobicContact CB-CE2 3.93Å; E277-F318 HydrophobicContact CG-CD1 4.42Å; E277-F318 HydrophobicContact CG-CD2 3.68Å; E277-F318 HydrophobicContact CG-CE1 4.41Å; E277-F318 HydrophobicContact CG-CE2 3.71Å; E277-F318 HydrophobicContact CG-CG 4.06Å; E277-F318 HydrophobicContact CG-CZ 4.08Å; F280-F318 HydrophobicContact CD1-CE2 4.28Å; F280-F318 AromaticContact CD1-CZ 3.63Å; F280-F318 HydrophobicContact CD1-CZ 3.63Å; F280-F318 HydrophobicContact CE1-CZ 4.09Å; F280-F318 HydrophobicContact CG-CZ 4.35Å; K281-F318 HydrophobicContact CG-CZ 4.41Å; F318-P363 WeakPolarHBondContact CA-O 3.49Å; F318-P363 HydrophobicContact CB-CB 4.43Å; F318-P363 HydrophobicContact CD1-CB 3.68Å; F318-P363 HydrophobicContact CD1-CG 3.74Å; F318-P363 HydrophobicContact CD2-CB 3.91Å; F318-P363 HydrophobicContact CE1-CB 3.83Å; F318-P363 HydrophobicContact CE1-CG 3.46Å; F318-P363 VanDerWaalsContact CE1-CG 3.46Å; F318-P363 HydrophobicContact CE2-CB 4.02Å; F318-P363 HydrophobicContact CE2-CG 4.3Å; F318-P363 HydrophobicContact CG-CB 3.75Å; F318-P363 HydrophobicContact CG-CG 4.31Å; F318-P363 HydrophobicContact CZ-CB 3.98Å; F318-P363 HydrophobicContact CZ-CG 3.76Å; F318-F365 HydrophobicContact CB-CD2 3.83Å; F318-F365 HydrophobicContact CB-CE2 3.58Å; F318-F365 AromaticContact CD2-CE2 3.7Å; F318-F365 HydrophobicContact CD2-CE2 3.7Å; F318-F365 AromaticContact CD2-CZ 3.91Å; F318-F365 HydrophobicContact CD2-CZ 3.91Å; F318-F365 HydrophobicContact CG-CE2 4.16Å; F318-L394 HydrophobicContact CD2-CD1 3.82Å; F318-L394 HydrophobicContact CD2-CD2 4.03Å; F318-L394 HydrophobicContact CE2-CD1 4.34Å; F318-L394 HydrophobicContact CE2-CD2 3.78Å; F318-L394 HydrophobicContact CG-CD1 4.5Å
319	L	98	Very high	97.3	Very high	72 Å²	72	51 Å²	51	38%	0.377	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	153	179.4	-69.1	174.7	0	0	0	110.2	C359 I362 P363 V364 F365	L319-C359 HydrophobicContact CD1-CB 3.75Å; L319-I362 HydrophobicContact CD1-CD1 3.63Å; L319-I362 HydrophobicContact CD1-CG1 3.97Å; L319-I362 HydrophobicContact CD2-CD1 4.4Å; L319-I362 HydrophobicContact CG-CD1 3.63Å; L319-I362 HydrophobicContact CG-CG1 4.22Å; L319-P363 PolarHBondContact N-O 3.49Å; L319-V364 HydrophobicContact CB-CG1 4.25Å; L319-V364 HydrophobicContact CB-CG2 4.42Å; L319-V364 CarbonylContact O-C 3.55Å; L319-V364 WeakPolarHBondContact O-CA 3.35Å; L319-F365 PolarHBondContact O-N 2.99Å
320	I	98.6	Very high	97.4	Very high	72 Å²	72	48 Å²	48	37%	0.369	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	125.5	177.2	-56.3	163.6	0	0	0	107	M273 F365 I367	M273-I320 HydrophobicContact CE-CD1 3.63Å; M273-I320 HydrophobicContact CE-CG1 4.16Å; M273-I320 HydrophobicContact CE-CG2 4.27Å; M273-I320 HydrophobicContact SD-CD1 4.08Å; M273-I320 HydrophobicContact SD-CG1 3.98Å; M273-I320 HydrophobicContact SD-CG2 4.22Å; I320-F365 WeakPolarHBondContact CA-O 3.38Å; I320-F365 HydrophobicContact CG1-CB 4.17Å; I320-F365 HydrophobicContact CG1-CD2 4.09Å; I320-I367 HydrophobicContact CG2-CD1 3.82Å; I320-I367 HydrophobicContact CG2-CG1 4.14Å; I320-I367 HydrophobicContact CG2-CG2 4.14Å
321	I	98.4	Very high	97.4	Very high	22 Å²	22	54 Å²	54	11%	0.113	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	148.9	170.3	62.8	176.7	0	0	0	109.1	A326 I329 L355 V364 F365 I366 I367	I321-A326 HydrophobicContact CD1-CB 3.93Å; I321-A326 HydrophobicContact CG1-CB 4.49Å; I321-I329 HydrophobicContact CD1-CD1 4.15Å; I321-L355 HydrophobicContact CD1-CD2 4.23Å; I321-V364 HydrophobicContact CD1-CG1 4.02Å; I321-V364 HydrophobicContact CG1-CG1 3.84Å; I321-F365 PolarHBondContact N-O 2.92Å; I321-I366 HydrophobicContact CD1-CD1 3.51Å; I321-I366 HydrophobicContact CG1-CD1 3.34Å; I321-I366 CarbonylContact O-C 3.56Å; I321-I366 VanDerWaalsContact O-CA 3.31Å; I321-I366 WeakPolarHBondContact O-CA 3.34Å; I321-I367 PolarHBondContact O-N 3.03Å
322	S	98.1	Very high	97.4	Very high	24 Å²	24	58.2 Å²	58.2	17%	0.168	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	157.9	171.2	65.4	0	0	0	0	111.3	T324 E325 A326 I367	S322-T324 PolarHBondContact O-N 2.88Å; S322-E325 WeakPolarHBondContact CB-OE2 3.34Å; S322-E325 PolarHBondContact N-OE2 2.77Å; S322-E325 PolarHBondContact O-N 3.09Å; S322-E325 WeakPolarHBondContact OG-CB 3.31Å; S322-E325 VanDerWaalsContact OG-CG 3.24Å; S322-E325 WeakPolarHBondContact OG-CG 3.49Å; S322-E325 PolarHBondContact OG-N 3.27Å; S322-E325 VanDerWaalsContact OG-N 3.16Å; S322-E325 PolarHBondContact OG-OE2 3.34Å; S322-A326 WeakPolarHBondContact O-CB 3.16Å; S322-A326 PolarHBondContact O-N 2.89Å; S322-I367 CarbonylContact C-O 3.53Å; S322-I367 WeakPolarHBondContact CA-O 3.45Å
323	Y	98.1	Very high	97.3	Very high	0 Å²	0	55.3 Å²	55.3	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-55.3	-40.7	170.4	169.3	-91	0	0	0	111.7	A326 V327 E342 W343 G344 I345 L347 I367 N368 Y369 P370 I373	Y323-A326 WeakPolarHBondContact O-CB 3.4Å; Y323-A326 PolarHBondContact O-N 3.04Å; Y323-V327 HydrophobicContact CD1-CG2 4.27Å; Y323-V327 HydrophobicContact CD2-CG2 4.46Å; Y323-V327 HydrophobicContact CE1-CG2 3.74Å; Y323-V327 HydrophobicContact CE2-CG2 3.97Å; Y323-V327 WeakPolarHBondContact O-CG2 3.49Å; Y323-V327 PolarHBondContact O-N 3.15Å; Y323-E342 PolarHBondContact OH-O 3.12Å; Y323-E342 VanDerWaalsContact OH-O 3.08Å; Y323-W343 AromaticContact CD1-CD1 3.99Å; Y323-W343 AromaticContact CD1-NE1 3.83Å; Y323-W343 AromaticContact CE1-CD1 3.63Å; Y323-W343 HydrophobicContact CE1-CD2 4.23Å; Y323-W343 AromaticContact CE1-CG 3.9Å; Y323-W343 HydrophobicContact CE1-CG 3.9Å; Y323-W343 AromaticContact CE1-NE1 3.79Å; Y323-G344 PolarHBondContact OH-N 3.42Å; Y323-I345 PolarHBondContact OH-N 2.92Å; Y323-I345 VanDerWaalsContact OH-N 3.16Å; Y323-I345 PolarHBondContact OH-O 3.41Å; Y323-L347 HydrophobicContact CD2-CG 4.41Å; Y323-L347 HydrophobicContact CE2-CD2 4.2Å; Y323-L347 HydrophobicContact CE2-CG 4.16Å; Y323-I367 PolarHBondContact N-O 2.95Å; Y323-N368 WeakPolarHBondContact CB-O 3.32Å; Y323-Y369 AromaticContact CD2-CD1 3.42Å; Y323-Y369 HydrophobicContact CD2-CD1 3.42Å; Y323-Y369 VanDerWaalsContact CD2-CD1 3.42Å; Y323-Y369 AromaticContact CD2-CE1 3.52Å; Y323-Y369 HydrophobicContact CD2-CE1 3.52Å; Y323-Y369 HydrophobicContact CD2-CG 4.28Å; Y323-Y369 HydrophobicContact CE2-CD1 4.01Å; Y323-Y369 HydrophobicContact CE2-CE1 4.13Å; Y323-Y369 HydrophobicContact CG-CD1 4.08Å; Y323-Y369 HydrophobicContact CG-CE1 4.44Å; Y323-P370 VanDerWaalsContact CD1-CD 3.41Å; Y323-P370 HydrophobicContact CD1-CG 3.65Å; Y323-P370 VanDerWaalsContact CE1-CD 3.49Å; Y323-P370 HydrophobicContact CE1-CG 3.26Å; Y323-P370 HydrophobicContact CE2-CG 4.45Å; Y323-P370 HydrophobicContact CG-CG 4.38Å; Y323-I373 HydrophobicContact CE2-CD1 4.45Å
324	T	96.7	Very high	97	Very high	51 Å²	51	61.4 Å²	61.4	31%	0.313	32%	0.318	S	S	.	.	H	α-helix	trans	-60.7	-48.9	178.9	-59.6	0	0	0	0	111	S322 A326 V327 E328 W343	S322-T324 PolarHBondContact O-N 2.88Å; T324-A326 VanDerWaalsContact C-N 3.32Å; T324-A326 PolarHBondContact O-N 3.03Å; T324-V327 PolarHBondContact O-N 2.97Å; T324-E328 WeakPolarHBondContact O-CG 3.43Å; T324-E328 PolarHBondContact O-N 2.72Å; T324-W343 PolarHBondContact OG1-NE1 2.95Å; T324-W343 VanDerWaalsContact OG1-NE1 3.11Å
325	E	97.8	Very high	96.8	Very high	95 Å²	95	63.9 Å²	63.9	44%	0.444	33%	0.328	S	S	.	.	H	α-helix	trans	-61.7	-39.8	174.6	-70.8	164.2	126	0	0	111.7	S322 V327 E328 I329	S322-E325 WeakPolarHBondContact CB-OE2 3.34Å; S322-E325 PolarHBondContact N-OE2 2.77Å; S322-E325 PolarHBondContact O-N 3.09Å; S322-E325 WeakPolarHBondContact OG-CB 3.31Å; S322-E325 VanDerWaalsContact OG-CG 3.24Å; S322-E325 WeakPolarHBondContact OG-CG 3.49Å; S322-E325 PolarHBondContact OG-N 3.27Å; S322-E325 VanDerWaalsContact OG-N 3.16Å; S322-E325 PolarHBondContact OG-OE2 3.34Å; E325-V327 VanDerWaalsContact C-N 3.35Å; E325-V327 PolarHBondContact O-N 3.25Å; E325-E328 PolarHBondContact O-N 3.38Å; E325-I329 VanDerWaalsContact O-CG1 3.31Å; E325-I329 WeakPolarHBondContact O-CG1 3.3Å; E325-I329 PolarHBondContact O-N 2.69Å
326	A	98.3	Very high	96.5	Very high	0 Å²	0	64.4 Å²	64.4	0%	0	34%	0.338	C	S	.	.	H	α-helix	trans	-59.8	-44	177.1	0	0	0	0	0	111.8	I321 S322 Y323 T324 I329 L330 L355 I366	I321-A326 HydrophobicContact CD1-CB 3.93Å; I321-A326 HydrophobicContact CG1-CB 4.49Å; S322-A326 WeakPolarHBondContact O-CB 3.16Å; S322-A326 PolarHBondContact O-N 2.89Å; Y323-A326 WeakPolarHBondContact O-CB 3.4Å; Y323-A326 PolarHBondContact O-N 3.04Å; T324-A326 VanDerWaalsContact C-N 3.32Å; T324-A326 PolarHBondContact O-N 3.03Å; A326-I329 PolarHBondContact O-N 3.28Å; A326-L330 WeakPolarHBondContact O-CD1 3.4Å; A326-L330 WeakPolarHBondContact O-CG 3.34Å; A326-L330 PolarHBondContact O-N 3.13Å; A326-L355 HydrophobicContact CB-CD1 3.89Å; A326-L355 HydrophobicContact CB-CD2 3.97Å; A326-I366 HydrophobicContact CB-CD1 4.31Å; A326-I366 HydrophobicContact CB-CG2 4.36Å
327	V	97.8	Very high	96.4	Very high	4 Å²	4	63.1 Å²	63.1	2%	0.024	33%	0.33	C	S	.	.	H	α-helix	trans	-64.6	-39.4	175.3	172	0	0	0	0	111.5	Y323 T324 E325 L330 K331 W343	Y323-V327 HydrophobicContact CD1-CG2 4.27Å; Y323-V327 HydrophobicContact CD2-CG2 4.46Å; Y323-V327 HydrophobicContact CE1-CG2 3.74Å; Y323-V327 HydrophobicContact CE2-CG2 3.97Å; Y323-V327 WeakPolarHBondContact O-CG2 3.49Å; Y323-V327 PolarHBondContact O-N 3.15Å; T324-V327 PolarHBondContact O-N 2.97Å; E325-V327 VanDerWaalsContact C-N 3.35Å; E325-V327 PolarHBondContact O-N 3.25Å; V327-L330 PolarHBondContact O-N 3.17Å; V327-K331 HydrophobicContact CG1-CD 4.11Å; V327-K331 HydrophobicContact CG1-CG 4.44Å; V327-K331 WeakPolarHBondContact O-CG 3.4Å; V327-K331 PolarHBondContact O-N 3.01Å; V327-W343 HydrophobicContact CG1-CB 4.44Å
328	E	97.7	Very high	96.4	Very high	106 Å²	106	62.8 Å²	62.8	50%	0.495	33%	0.333	S	S	.	.	H	α-helix	trans	-63.1	-45	176	-71.3	176.7	175.7	0	0	112.1	T324 E325 L330 K331 Q332	T324-E328 WeakPolarHBondContact O-CG 3.43Å; T324-E328 PolarHBondContact O-N 2.72Å; E325-E328 PolarHBondContact O-N 3.38Å; E328-L330 VanDerWaalsContact C-N 3.3Å; E328-L330 PolarHBondContact O-N 3.26Å; E328-K331 PolarHBondContact O-N 3.27Å; E328-Q332 WeakPolarHBondContact O-CG 3.49Å; E328-Q332 PolarHBondContact O-N 3.29Å
329	I	97.9	Very high	96.2	Very high	30 Å²	30	67.5 Å²	67.5	15%	0.154	35%	0.353	C	S	.	.	H	α-helix	trans	-57.7	-44.8	174.4	-70.9	164.8	0	0	0	110.5	I321 E325 A326 Q332 A333 Y354 L355 H358	I321-I329 HydrophobicContact CD1-CD1 4.15Å; E325-I329 VanDerWaalsContact O-CG1 3.31Å; E325-I329 WeakPolarHBondContact O-CG1 3.3Å; E325-I329 PolarHBondContact O-N 2.69Å; A326-I329 PolarHBondContact O-N 3.28Å; I329-Q332 PolarHBondContact O-N 2.85Å; I329-A333 PolarHBondContact O-N 2.92Å; I329-Y354 HydrophobicContact CG2-CE1 3.99Å; I329-L355 HydrophobicContact CB-CD2 4.16Å; I329-L355 HydrophobicContact CG2-CD2 3.89Å; I329-H358 HydrophobicContact CG2-CB 4.43Å
330	L	97.8	Very high	96.1	Very high	2 Å²	2	68.6 Å²	68.6	1%	0.01	36%	0.363	C	S	.	.	H	α-helix	trans	-65.7	-40.2	179.6	-69.7	163.7	0	0	0	112.1	A326 V327 E328 Q332 A333 F337 P341 L347 H351 Y354 L355	A326-L330 WeakPolarHBondContact O-CD1 3.4Å; A326-L330 WeakPolarHBondContact O-CG 3.34Å; A326-L330 PolarHBondContact O-N 3.13Å; V327-L330 PolarHBondContact O-N 3.17Å; E328-L330 VanDerWaalsContact C-N 3.3Å; E328-L330 PolarHBondContact O-N 3.26Å; L330-Q332 VanDerWaalsContact C-N 3.28Å; L330-Q332 PolarHBondContact O-N 3.36Å; L330-A333 WeakPolarHBondContact O-CB 3.3Å; L330-A333 PolarHBondContact O-N 3.15Å; L330-A333 VanDerWaalsContact O-N 3.16Å; L330-F337 HydrophobicContact CB-CE2 4.42Å; L330-F337 HydrophobicContact CD2-CE1 4Å; L330-F337 HydrophobicContact CD2-CE2 4.09Å; L330-F337 HydrophobicContact CD2-CZ 3.46Å; L330-F337 VanDerWaalsContact CD2-CZ 3.46Å; L330-F337 WeakPolarHBondContact O-CE2 3.48Å; L330-P341 HydrophobicContact CB-CB 3.56Å; L330-P341 HydrophobicContact CB-CG 3.76Å; L330-P341 HydrophobicContact CD1-CB 4.01Å; L330-P341 HydrophobicContact CG-CB 4.37Å; L330-L347 HydrophobicContact CD1-CD2 3.68Å; L330-H351 HydrophobicContact CD1-CB 3.74Å; L330-H351 HydrophobicContact CD2-CB 3.84Å; L330-H351 HydrophobicContact CG-CB 4.48Å; L330-Y354 HydrophobicContact CD2-CD1 3.7Å; L330-Y354 HydrophobicContact CD2-CG 4.32Å; L330-L355 HydrophobicContact CD1-CD1 4.21Å; L330-L355 HydrophobicContact CD1-CD2 4.5Å; L330-L355 HydrophobicContact CD1-CG 4.42Å; L330-L355 HydrophobicContact CD2-CD2 4.38Å; L330-L355 HydrophobicContact CD2-CG 4.17Å; L330-L355 HydrophobicContact CG-CD2 4.07Å; L330-L355 HydrophobicContact CG-CG 4.25Å
331	K	96.4	Very high	95.9	Very high	129 Å²	129	65.8 Å²	65.8	56%	0.561	35%	0.349	S	S	*	.	H	α-helix	trans	-67.4	-28.3	176.8	-75.4	177.5	175.1	-179.2	0	113.2	V327 E328 A333 P341	V327-K331 HydrophobicContact CG1-CD 4.11Å; V327-K331 HydrophobicContact CG1-CG 4.44Å; V327-K331 WeakPolarHBondContact O-CG 3.4Å; V327-K331 PolarHBondContact O-N 3.01Å; E328-K331 PolarHBondContact O-N 3.27Å; K331-A333 VanDerWaalsContact C-N 3.31Å; K331-P341 WeakPolarHBondContact CE-O 3.31Å; K331-P341 HydrophobicContact CG-CG 4.36Å
332	Q	96.1	Very high	95.7	Very high	159 Å²	159	69.4 Å²	69.4	74%	0.743	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.3	-6.6	175.4	-67.2	175.2	15.8	0	0	113	E328 I329 L330	E328-Q332 WeakPolarHBondContact O-CG 3.49Å; E328-Q332 PolarHBondContact O-N 3.29Å; I329-Q332 PolarHBondContact O-N 2.85Å; L330-Q332 VanDerWaalsContact C-N 3.28Å; L330-Q332 PolarHBondContact O-N 3.36Å
333	A	94.5	Very high	95.6	Very high	18 Å²	18	72 Å²	72	15%	0.149	37%	0.372	C	S	.	.			trans	-64.8	137.5	179.5	0	0	0	0	0	111.1	I329 L330 K331 Q335 F337 Y354	I329-A333 PolarHBondContact O-N 2.92Å; L330-A333 WeakPolarHBondContact O-CB 3.3Å; L330-A333 PolarHBondContact O-N 3.15Å; L330-A333 VanDerWaalsContact O-N 3.16Å; K331-A333 VanDerWaalsContact C-N 3.31Å; A333-Q335 HydrophobicContact CB-CG 4.19Å; A333-Q335 PolarHBondContact O-N 2.74Å; A333-F337 HydrophobicContact CB-CE2 3.78Å; A333-F337 HydrophobicContact CB-CZ 4.07Å; A333-Y354 HydrophobicContact CB-CD1 4.42Å; A333-Y354 HydrophobicContact CB-CE1 3.65Å; A333-Y354 HydrophobicContact CB-CE2 3.93Å; A333-Y354 WeakPolarHBondContact CB-OH 3.45Å
334	S	90.9	Very high	95.4	Very high	128 Å²	128	73.2 Å²	73.2	90%	0.895	39%	0.385	S	S	*	.	S	Bend	trans	-77.3	-7.1	175.5	55.5	0	0	0	0	114
335	Q	91.5	Very high	95.3	Very high	81 Å²	81	74.6 Å²	74.6	38%	0.379	39%	0.389	S	S	.	.	S	Bend	trans	-90.8	145.9	179.8	68.4	174.6	19.1	0	0	111.3	A333 F337 Y354	A333-Q335 HydrophobicContact CB-CG 4.19Å; A333-Q335 PolarHBondContact O-N 2.74Å; Q335-F337 HydrophobicContact CG-CE1 4.18Å; Q335-F337 HydrophobicContact CG-CE2 4.11Å; Q335-F337 HydrophobicContact CG-CZ 3.86Å; Q335-Y354 HydrophobicContact CG-CD2 4.09Å; Q335-Y354 HydrophobicContact CG-CE2 4.1Å
336	N	91.4	Very high	95.1	Very high	162 Å²	162	73.9 Å²	73.9	87%	0.866	39%	0.388	S	S	*	.	P	Polyproline II helix	trans	-81.7	125.3	172.2	-65.1	-36.5	0	0	0	109.4
337	F	95.5	Very high	95	Very high	33 Å²	33	74.7 Å²	74.7	15%	0.145	39%	0.393	C	S	.	.	P	Polyproline II helix	trans	-91.1	150.9	171.6	-63.3	-78.1	0	0	0	110.6	L330 A333 Q335 F339 P341 E350 H351 Y354	L330-F337 HydrophobicContact CB-CE2 4.42Å; L330-F337 HydrophobicContact CD2-CE1 4Å; L330-F337 HydrophobicContact CD2-CE2 4.09Å; L330-F337 HydrophobicContact CD2-CZ 3.46Å; L330-F337 VanDerWaalsContact CD2-CZ 3.46Å; L330-F337 WeakPolarHBondContact O-CE2 3.48Å; A333-F337 HydrophobicContact CB-CE2 3.78Å; A333-F337 HydrophobicContact CB-CZ 4.07Å; Q335-F337 HydrophobicContact CG-CE1 4.18Å; Q335-F337 HydrophobicContact CG-CE2 4.11Å; Q335-F337 HydrophobicContact CG-CZ 3.86Å; F337-F339 WeakPolarHBondContact CB-O 3.46Å; F337-P341 HydrophobicContact CD2-CG 4.12Å; F337-P341 HydrophobicContact CE2-CG 4.39Å; F337-E350 HydrophobicContact CD1-CB 4.4Å; F337-E350 HydrophobicContact CD1-CG 3.89Å; F337-H351 AromaticContact CD1-CD2 3.49Å; F337-H351 VanDerWaalsContact CD1-CD2 3.49Å; F337-H351 WeakPolarHBondContact CD1-CD2 3.49Å; F337-H351 AromaticContact CD1-NE2 3.99Å; F337-H351 AromaticContact CE1-CD2 3.75Å; F337-H351 AromaticContact CG-CD2 3.86Å; F337-H351 AromaticContact CG-NE2 3.95Å; F337-Y354 HydrophobicContact CE1-CG 4.27Å; F337-Y354 HydrophobicContact CZ-CD1 4.09Å; F337-Y354 HydrophobicContact CZ-CD2 4.35Å; F337-Y354 AromaticContact CZ-CG 3.89Å; F337-Y354 HydrophobicContact CZ-CG 3.89Å
338	T	95.2	Very high	94.9	Very high	118 Å²	118	77.8 Å²	77.8	72%	0.724	41%	0.407	S	S	*	.	S	Bend	trans	-70.2	-40.1	172.3	-51.3	0	0	0	0	110.4	E350	T338-E350 WeakPolarHBondContact CA-OE1 3.31Å; T338-E350 VanDerWaalsContact CB-OE1 3.27Å; T338-E350 WeakPolarHBondContact CB-OE1 3.38Å; T338-E350 VanDerWaalsContact N-CD 3.33Å; T338-E350 PolarHBondContact N-OE1 3.27Å; T338-E350 PolarHBondContact N-OE2 3.41Å
339	F	93.7	Very high	94.6	Very high	112 Å²	112	75.5 Å²	75.5	49%	0.491	40%	0.4	S	S	.	.	S	Bend	trans	-103.3	127.6	174.7	-58.9	-81.2	0	0	0	109.2	F337 P341 Q348 E350 H351	F337-F339 WeakPolarHBondContact CB-O 3.46Å; F339-P341 WeakPolarHBondContact O-CD 3.49Å; F339-Q348 HydrophobicContact CB-CG 3.84Å; F339-Q348 HydrophobicContact CD1-CG 4.45Å; F339-Q348 HydrophobicContact CD2-CB 4.05Å; F339-Q348 HydrophobicContact CD2-CG 3.73Å; F339-Q348 HydrophobicContact CE2-CG 4.43Å; F339-Q348 HydrophobicContact CG-CB 4.5Å; F339-Q348 HydrophobicContact CG-CG 3.75Å; F339-E350 VanDerWaalsContact CD2-OE1 3.26Å; F339-E350 WeakPolarHBondContact CD2-OE1 3.3Å; F339-E350 PolarHBondContact N-OE1 3.36Å; F339-H351 PolarHBondContact O-CE1 3.32Å; F339-H351 PolarHBondContact O-NE2 2.95Å
340	T	95	Very high	94.5	Very high	94 Å²	94	76.2 Å²	76.2	58%	0.577	40%	0.403	S	S	*	.			trans	-69.5	126.6	179.3	-54.4	0	0	0	0	110	E342	T340-E342 HydrophobicContact CG2-CG 3.96Å; T340-E342 PolarHBondContact O-N 2.92Å
341	P	94.4	Very high	94.5	Very high	13 Å²	13	76.3 Å²	76.3	8%	0.084	40%	0.403	C	S	.	.			trans	-73.4	111.5	175.3	29.1	-33.9	0	0	0	110.3	L330 K331 F337 F339	L330-P341 HydrophobicContact CB-CB 3.56Å; L330-P341 HydrophobicContact CB-CG 3.76Å; L330-P341 HydrophobicContact CD1-CB 4.01Å; L330-P341 HydrophobicContact CG-CB 4.37Å; K331-P341 WeakPolarHBondContact CE-O 3.31Å; K331-P341 HydrophobicContact CG-CG 4.36Å; F337-P341 HydrophobicContact CD2-CG 4.12Å; F337-P341 HydrophobicContact CE2-CG 4.39Å; F339-P341 WeakPolarHBondContact O-CD 3.49Å
342	E	95	Very high	94.5	Very high	98 Å²	98	71.2 Å²	71.2	46%	0.458	38%	0.381	S	S	.	.			trans	-129.9	148.3	177.3	-61.1	-174.5	176.7	0	0	111.1	Y323 T340 G344 I345	Y323-E342 PolarHBondContact OH-O 3.12Å; Y323-E342 VanDerWaalsContact OH-O 3.08Å; T340-E342 HydrophobicContact CG2-CG 3.96Å; T340-E342 PolarHBondContact O-N 2.92Å; E342-G344 PolarHBondContact O-N 3.44Å; E342-I345 HydrophobicContact CB-CD1 3.84Å; E342-I345 HydrophobicContact CB-CG1 4.17Å; E342-I345 HydrophobicContact CG-CD1 4.45Å; E342-I345 PolarHBondContact O-N 3.05Å
343	W	96.3	Very high	94.5	Very high	79 Å²	79	68.2 Å²	68.2	30%	0.299	37%	0.366	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.8	132.6	178	-167	101.6	0	0	0	109.2	Y323 T324 V327 P370 Q386 T388	Y323-W343 AromaticContact CD1-CD1 3.99Å; Y323-W343 AromaticContact CD1-NE1 3.83Å; Y323-W343 AromaticContact CE1-CD1 3.63Å; Y323-W343 HydrophobicContact CE1-CD2 4.23Å; Y323-W343 AromaticContact CE1-CG 3.9Å; Y323-W343 HydrophobicContact CE1-CG 3.9Å; Y323-W343 AromaticContact CE1-NE1 3.79Å; T324-W343 PolarHBondContact OG1-NE1 2.95Å; T324-W343 VanDerWaalsContact OG1-NE1 3.11Å; V327-W343 HydrophobicContact CG1-CB 4.44Å; W343-P370 HydrophobicContact CD2-CG 4.31Å; W343-P370 HydrophobicContact CE3-CG 4.42Å; W343-P370 HydrophobicContact CH2-CB 3.75Å; W343-P370 HydrophobicContact CH2-CG 3.96Å; W343-P370 HydrophobicContact CZ2-CB 4.11Å; W343-P370 HydrophobicContact CZ2-CG 3.87Å; W343-P370 HydrophobicContact CZ3-CB 4.07Å; W343-P370 HydrophobicContact CZ3-CG 4.25Å; W343-Q386 HydrophobicContact CH2-CB 3.66Å; W343-Q386 HydrophobicContact CH2-CG 4.37Å; W343-Q386 HydrophobicContact CZ2-CB 4.17Å; W343-Q386 HydrophobicContact CZ3-CB 4.14Å; W343-Q386 HydrophobicContact CZ3-CG 4.36Å; W343-T388 HydrophobicContact CZ2-CG2 4.31Å
344	G	93.9	Very high	94.6	Very high	26 Å²	26	69.3 Å²	69.3	27%	0.268	37%	0.366	S	S	.	.	T	Hydrogen-bonded Turn	trans	91.1	1.5	-174.5	0	0	0	0	0	114	Y323 E342 I373	Y323-G344 PolarHBondContact OH-N 3.42Å; E342-G344 PolarHBondContact O-N 3.44Å; G344-I373 WeakPolarHBondContact O-CG2 3.42Å
345	I	94.1	Very high	94.9	Very high	80 Å²	80	63.2 Å²	63.2	41%	0.41	32%	0.324	S	S	.	.	S	Bend	trans	-111.3	141.8	174	-54	-172.5	0	0	0	109.8	Y323 E342	Y323-I345 PolarHBondContact OH-N 2.92Å; Y323-I345 VanDerWaalsContact OH-N 3.16Å; Y323-I345 PolarHBondContact OH-O 3.41Å; E342-I345 HydrophobicContact CB-CD1 3.84Å; E342-I345 HydrophobicContact CB-CG1 4.17Å; E342-I345 HydrophobicContact CG-CD1 4.45Å; E342-I345 PolarHBondContact O-N 3.05Å
346	N	94	Very high	95.2	Very high	79 Å²	79	59.5 Å²	59.5	42%	0.422	31%	0.307	S	S	.	.	P	Polyproline II helix	trans	-58.6	136.7	175.3	-84.5	-40.5	0	0	0	111.8	Q348 I373	N346-Q348 PolarHBondContact O-NE2 2.93Å; N346-I373 WeakPolarHBondContact OD1-CD1 3.49Å
347	L	96.1	Very high	95.5	Very high	18 Å²	18	58.5 Å²	58.5	9%	0.094	30%	0.295	C	S	.	.	P	Polyproline II helix	trans	-63.7	138.6	171.3	-61.4	-178.9	0	0	0	109.3	Y323 L330 H351 E352 L355 I366 Y369	Y323-L347 HydrophobicContact CD2-CG 4.41Å; Y323-L347 HydrophobicContact CE2-CD2 4.2Å; Y323-L347 HydrophobicContact CE2-CG 4.16Å; L330-L347 HydrophobicContact CD1-CD2 3.68Å; L347-H351 HydrophobicContact CB-CB 4.33Å; L347-H351 HydrophobicContact CD2-CB 4.24Å; L347-E352 HydrophobicContact CB-CG 4.44Å; L347-L355 HydrophobicContact CD1-CD1 3.96Å; L347-I366 HydrophobicContact CD1-CG2 4.45Å; L347-Y369 HydrophobicContact CD1-CE1 4.37Å
348	Q	94.8	Very high	95.5	Very high	69 Å²	69	62 Å²	62	32%	0.322	31%	0.311	S	S	.	.	P	Polyproline II helix	trans	-99.5	162	176.3	-61.4	-59.5	-48.8	0	0	109.2	F339 N346 E350 H351 E352	F339-Q348 HydrophobicContact CB-CG 3.84Å; F339-Q348 HydrophobicContact CD1-CG 4.45Å; F339-Q348 HydrophobicContact CD2-CB 4.05Å; F339-Q348 HydrophobicContact CD2-CG 3.73Å; F339-Q348 HydrophobicContact CE2-CG 4.43Å; F339-Q348 HydrophobicContact CG-CB 4.5Å; F339-Q348 HydrophobicContact CG-CG 3.75Å; N346-Q348 PolarHBondContact O-NE2 2.93Å; Q348-E350 HydrophobicContact CB-CG 4.39Å; Q348-E350 PolarHBondContact O-N 3.4Å; Q348-H351 PolarHBondContact N-ND1 3.17Å; Q348-H351 VanDerWaalsContact N-ND1 3.16Å; Q348-H351 WeakPolarHBondContact O-CA 3.4Å; Q348-H351 VanDerWaalsContact O-CB 3.25Å; Q348-H351 WeakPolarHBondContact O-CB 3.25Å; Q348-H351 PolarHBondContact O-N 3.35Å; Q348-E352 PolarHBondContact O-N 2.77Å
349	T	92.9	Very high	95.5	Very high	57 Å²	57	57.3 Å²	57.3	35%	0.35	28%	0.283	S	S	.	.	H	α-helix	trans	-48.2	-37.8	177	-86.9	0	0	0	0	113.7	R251 K353	R251-T349 PolarHBondContact NH1-OG1 2.74Å; T349-K353 HydrophobicContact CG2-CD 4.26Å; T349-K353 WeakPolarHBondContact O-CB 3.41Å; T349-K353 VanDerWaalsContact O-CG 3.29Å; T349-K353 WeakPolarHBondContact O-CG 3.39Å; T349-K353 PolarHBondContact O-N 2.92Å; T349-K353 VanDerWaalsContact O-N 3.09Å
350	E	94.6	Very high	95.6	Very high	46 Å²	46	54 Å²	54	22%	0.215	28%	0.281	C	S	.	.	H	α-helix	trans	-69.5	-34	178.1	64.1	178.1	156.3	0	0	112.8	F337 T338 F339 Q348 Y354	F337-E350 HydrophobicContact CD1-CB 4.4Å; F337-E350 HydrophobicContact CD1-CG 3.89Å; T338-E350 WeakPolarHBondContact CA-OE1 3.31Å; T338-E350 VanDerWaalsContact CB-OE1 3.27Å; T338-E350 WeakPolarHBondContact CB-OE1 3.38Å; T338-E350 VanDerWaalsContact N-CD 3.33Å; T338-E350 PolarHBondContact N-OE1 3.27Å; T338-E350 PolarHBondContact N-OE2 3.41Å; F339-E350 VanDerWaalsContact CD2-OE1 3.26Å; F339-E350 WeakPolarHBondContact CD2-OE1 3.3Å; F339-E350 PolarHBondContact N-OE1 3.36Å; Q348-E350 HydrophobicContact CB-CG 4.39Å; Q348-E350 PolarHBondContact O-N 3.4Å; E350-Y354 WeakPolarHBondContact O-CB 3.43Å; E350-Y354 PolarHBondContact O-N 3.35Å; E350-Y354 VanDerWaalsContact O-N 3.12Å
351	H	97.4	Very high	95.6	Very high	4 Å²	4	53.2 Å²	53.2	2%	0.019	27%	0.273	C	S	.	.	H	α-helix	trans	-66.9	-50.2	174.4	-55.5	157.8	0	0	0	110.1	L330 F337 F339 L347 Q348 K353 Y354 L355	L330-H351 HydrophobicContact CD1-CB 3.74Å; L330-H351 HydrophobicContact CD2-CB 3.84Å; L330-H351 HydrophobicContact CG-CB 4.48Å; F337-H351 AromaticContact CD1-CD2 3.49Å; F337-H351 VanDerWaalsContact CD1-CD2 3.49Å; F337-H351 WeakPolarHBondContact CD1-CD2 3.49Å; F337-H351 AromaticContact CD1-NE2 3.99Å; F337-H351 AromaticContact CE1-CD2 3.75Å; F337-H351 AromaticContact CG-CD2 3.86Å; F337-H351 AromaticContact CG-NE2 3.95Å; F339-H351 PolarHBondContact O-CE1 3.32Å; F339-H351 PolarHBondContact O-NE2 2.95Å; L347-H351 HydrophobicContact CB-CB 4.33Å; L347-H351 HydrophobicContact CD2-CB 4.24Å; Q348-H351 PolarHBondContact N-ND1 3.17Å; Q348-H351 VanDerWaalsContact N-ND1 3.16Å; Q348-H351 WeakPolarHBondContact O-CA 3.4Å; Q348-H351 VanDerWaalsContact O-CB 3.25Å; Q348-H351 WeakPolarHBondContact O-CB 3.25Å; Q348-H351 PolarHBondContact O-N 3.35Å; H351-K353 VanDerWaalsContact C-N 3.35Å; H351-K353 PolarHBondContact O-N 2.93Å; H351-Y354 WeakPolarHBondContact O-CB 3.46Å; H351-Y354 PolarHBondContact O-N 3.06Å; H351-Y354 VanDerWaalsContact O-N 3.12Å; H351-L355 WeakPolarHBondContact O-CG 3.48Å; H351-L355 PolarHBondContact O-N 3.36Å
352	E	97.4	Very high	95.7	Very high	21 Å²	21	53.4 Å²	53.4	10%	0.098	27%	0.273	C	S	.	.	H	α-helix	trans	-56.8	-47.7	179.6	-66.1	167.6	-159.7	0	0	111.8	L347 Q348 Y354 L355 V356 L395 G400 E401	L347-E352 HydrophobicContact CB-CG 4.44Å; Q348-E352 PolarHBondContact O-N 2.77Å; E352-Y354 VanDerWaalsContact C-N 3.31Å; E352-Y354 PolarHBondContact O-N 2.94Å; E352-L355 PolarHBondContact O-N 3.04Å; E352-V356 WeakPolarHBondContact O-CG2 3.2Å; E352-V356 PolarHBondContact O-N 3.32Å; E352-V356 VanDerWaalsContact O-N 3.07Å; E352-L395 HydrophobicContact CB-CD1 3.95Å; E352-L395 HydrophobicContact CB-CD2 4.12Å; E352-L395 HydrophobicContact CG-CD1 4.06Å; E352-L395 HydrophobicContact CG-CD2 3.77Å; E352-G400 VanDerWaalsContact OE2-CA 3.28Å; E352-G400 WeakPolarHBondContact OE2-CA 3.46Å; E352-E401 PolarHBondContact OE2-N 3.47Å
353	K	95.3	Very high	95.9	Very high	96 Å²	96	48.8 Å²	48.8	42%	0.417	25%	0.251	S	S	.	.	H	α-helix	trans	-61.7	-40	177.5	-76.2	178.8	178.6	-177.6	0	112.3	R251 T349 H351 K357	R251-K353 VanDerWaalsContact NH2-NZ 3.19Å; T349-K353 HydrophobicContact CG2-CD 4.26Å; T349-K353 WeakPolarHBondContact O-CB 3.41Å; T349-K353 VanDerWaalsContact O-CG 3.29Å; T349-K353 WeakPolarHBondContact O-CG 3.39Å; T349-K353 PolarHBondContact O-N 2.92Å; T349-K353 VanDerWaalsContact O-N 3.09Å; H351-K353 VanDerWaalsContact C-N 3.35Å; H351-K353 PolarHBondContact O-N 2.93Å; K353-K357 WeakPolarHBondContact O-CB 3.38Å; K353-K357 PolarHBondContact O-N 2.62Å; K353-K357 VanDerWaalsContact O-N 3.11Å
354	Y	97.2	Very high	96	Very high	41 Å²	41	45 Å²	45	16%	0.161	24%	0.237	C	C	.	.	H	α-helix	trans	-64.9	-46.5	177.7	179.1	-94.9	0	0	0	111.3	I329 L330 A333 Q335 F337 E350 H351 E352 V356 K357 H358	I329-Y354 HydrophobicContact CG2-CE1 3.99Å; L330-Y354 HydrophobicContact CD2-CD1 3.7Å; L330-Y354 HydrophobicContact CD2-CG 4.32Å; A333-Y354 HydrophobicContact CB-CD1 4.42Å; A333-Y354 HydrophobicContact CB-CE1 3.65Å; A333-Y354 HydrophobicContact CB-CE2 3.93Å; A333-Y354 WeakPolarHBondContact CB-OH 3.45Å; Q335-Y354 HydrophobicContact CG-CD2 4.09Å; Q335-Y354 HydrophobicContact CG-CE2 4.1Å; F337-Y354 HydrophobicContact CE1-CG 4.27Å; F337-Y354 HydrophobicContact CZ-CD1 4.09Å; F337-Y354 HydrophobicContact CZ-CD2 4.35Å; F337-Y354 AromaticContact CZ-CG 3.89Å; F337-Y354 HydrophobicContact CZ-CG 3.89Å; E350-Y354 WeakPolarHBondContact O-CB 3.43Å; E350-Y354 PolarHBondContact O-N 3.35Å; E350-Y354 VanDerWaalsContact O-N 3.12Å; H351-Y354 WeakPolarHBondContact O-CB 3.46Å; H351-Y354 PolarHBondContact O-N 3.06Å; H351-Y354 VanDerWaalsContact O-N 3.12Å; E352-Y354 VanDerWaalsContact C-N 3.31Å; E352-Y354 PolarHBondContact O-N 2.94Å; Y354-V356 PolarHBondContact O-N 2.82Å; Y354-K357 PolarHBondContact O-N 2.81Å; Y354-K357 VanDerWaalsContact O-N 3.16Å; Y354-H358 HydrophobicContact CD1-CB 4.48Å; Y354-H358 HydrophobicContact CE1-CB 4.17Å; Y354-H358 WeakPolarHBondContact O-CB 3.47Å; Y354-H358 PolarHBondContact O-N 3.33Å
355	L	98.1	Very high	96.2	Very high	0 Å²	0	43.9 Å²	43.9	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-57.5	-49.9	178.9	-71	167.4	0	0	0	111.2	I321 A326 I329 L330 L347 H351 E352 K357 H358 C359 I366 L395	I321-L355 HydrophobicContact CD1-CD2 4.23Å; A326-L355 HydrophobicContact CB-CD1 3.89Å; A326-L355 HydrophobicContact CB-CD2 3.97Å; I329-L355 HydrophobicContact CB-CD2 4.16Å; I329-L355 HydrophobicContact CG2-CD2 3.89Å; L330-L355 HydrophobicContact CD1-CD1 4.21Å; L330-L355 HydrophobicContact CD1-CD2 4.5Å; L330-L355 HydrophobicContact CD1-CG 4.42Å; L330-L355 HydrophobicContact CD2-CD2 4.38Å; L330-L355 HydrophobicContact CD2-CG 4.17Å; L330-L355 HydrophobicContact CG-CD2 4.07Å; L330-L355 HydrophobicContact CG-CG 4.25Å; L347-L355 HydrophobicContact CD1-CD1 3.96Å; H351-L355 WeakPolarHBondContact O-CG 3.48Å; H351-L355 PolarHBondContact O-N 3.36Å; E352-L355 PolarHBondContact O-N 3.04Å; L355-K357 VanDerWaalsContact C-N 3.29Å; L355-K357 PolarHBondContact O-N 2.97Å; L355-H358 WeakPolarHBondContact O-CB 3.39Å; L355-H358 PolarHBondContact O-N 3.23Å; L355-C359 VanDerWaalsContact O-CB 3.32Å; L355-C359 WeakPolarHBondContact O-CB 3.37Å; L355-C359 PolarHBondContact O-N 2.78Å; L355-C359 PolarHBondContact O-SG 2.91Å; L355-I366 HydrophobicContact CD1-CD1 4.29Å; L355-L395 HydrophobicContact CB-CD1 4.42Å; L355-L395 HydrophobicContact CD1-CD1 4.2Å
356	V	97.4	Very high	96.4	Very high	3 Å²	3	40 Å²	40	2%	0.018	21%	0.205	C	C	.	.	H	α-helix	trans	-59.1	-41.5	177.3	173.5	0	0	0	0	111.8	E352 Y354 C359 G360 N361 V364 L395 P397	E352-V356 WeakPolarHBondContact O-CG2 3.2Å; E352-V356 PolarHBondContact O-N 3.32Å; E352-V356 VanDerWaalsContact O-N 3.07Å; Y354-V356 PolarHBondContact O-N 2.82Å; V356-C359 PolarHBondContact O-N 2.84Å; V356-G360 PolarHBondContact O-N 3.44Å; V356-N361 WeakPolarHBondContact O-CA 3.18Å; V356-N361 PolarHBondContact O-N 3.06Å; V356-V364 HydrophobicContact CG2-CG2 4.48Å; V356-L395 HydrophobicContact CG2-CB 3.51Å; V356-P397 HydrophobicContact CG1-CB 4.14Å; V356-P397 HydrophobicContact CG1-CG 3.61Å
357	K	96.3	Very high	96.7	Very high	142 Å²	142	37.6 Å²	37.6	62%	0.617	19%	0.192	S	C	*	.	H	α-helix	trans	-66.4	-43.4	177	-176.2	-178.6	177.1	-175.2	0	112	K353 Y354 L355 C359 G360	K353-K357 WeakPolarHBondContact O-CB 3.38Å; K353-K357 PolarHBondContact O-N 2.62Å; K353-K357 VanDerWaalsContact O-N 3.11Å; Y354-K357 PolarHBondContact O-N 2.81Å; Y354-K357 VanDerWaalsContact O-N 3.16Å; L355-K357 VanDerWaalsContact C-N 3.29Å; L355-K357 PolarHBondContact O-N 2.97Å; K357-C359 VanDerWaalsContact C-N 3.25Å; K357-C359 PolarHBondContact O-N 3.05Å; K357-G360 PolarHBondContact O-N 3.05Å; K357-G360 VanDerWaalsContact O-N 3.13Å
358	H	96.3	Very high	96.7	Very high	105 Å²	105	38.9 Å²	38.9	49%	0.486	20%	0.199	S	C	.	.	H	α-helix	trans	-59.3	-40.5	176.9	-178.9	96.1	0	0	0	110.8	I329 Y354 L355 G360	I329-H358 HydrophobicContact CG2-CB 4.43Å; Y354-H358 HydrophobicContact CD1-CB 4.48Å; Y354-H358 HydrophobicContact CE1-CB 4.17Å; Y354-H358 WeakPolarHBondContact O-CB 3.47Å; Y354-H358 PolarHBondContact O-N 3.33Å; L355-H358 WeakPolarHBondContact O-CB 3.39Å; L355-H358 PolarHBondContact O-N 3.23Å; H358-G360 PolarHBondContact O-N 2.83Å
359	C	96.2	Very high	96.9	Very high	21 Å²	21	35.8 Å²	35.8	14%	0.142	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78	11.8	177.5	-69.3	0	0	0	0	114.4	L319 L355 V356 K357 I362 V364	L319-C359 HydrophobicContact CD1-CB 3.75Å; L355-C359 VanDerWaalsContact O-CB 3.32Å; L355-C359 WeakPolarHBondContact O-CB 3.37Å; L355-C359 PolarHBondContact O-N 2.78Å; L355-C359 PolarHBondContact O-SG 2.91Å; V356-C359 PolarHBondContact O-N 2.84Å; K357-C359 VanDerWaalsContact C-N 3.25Å; K357-C359 PolarHBondContact O-N 3.05Å; C359-I362 WeakPolarHBondContact O-CG1 3.11Å; C359-V364 HydrophobicContact CB-CG2 3.46Å; C359-V364 VanDerWaalsContact CB-CG2 3.46Å
360	G	95.4	Very high	97.1	Very high	42 Å²	42	33.2 Å²	33.2	43%	0.433	17%	0.168	S	C	.	.	T	Hydrogen-bonded Turn	trans	87.1	23.3	173.3	0	0	0	0	0	115.3	H312 V356 K357 H358 I362	H312-G360 PolarHBondContact NE2-O 3.2Å; V356-G360 PolarHBondContact O-N 3.44Å; K357-G360 PolarHBondContact O-N 3.05Å; K357-G360 VanDerWaalsContact O-N 3.13Å; H358-G360 PolarHBondContact O-N 2.83Å; G360-I362 VanDerWaalsContact C-N 3.31Å; G360-I362 PolarHBondContact O-N 3.28Å
361	N	95.3	Very high	97	Very high	78 Å²	78	32.8 Å²	32.8	42%	0.417	17%	0.167	S	C	.	.	S	Bend	trans	57	39.4	-179.1	-63.9	-56.5	0	0	0	113.8	V356 P397	V356-N361 WeakPolarHBondContact O-CA 3.18Å; V356-N361 PolarHBondContact O-N 3.06Å; N361-P397 HydrophobicContact CB-CG 4.5Å; N361-P397 VanDerWaalsContact O-CG 3.31Å; N361-P397 WeakPolarHBondContact O-CG 2.89Å
362	I	96.1	Very high	96.7	Very high	17 Å²	17	37.2 Å²	37.2	9%	0.087	21%	0.205	C	C	.	.	S	Bend	trans	-114.5	160	167.3	57.7	178.5	0	0	0	109.3	H312 N316 L319 C359 G360 V364	H312-I362 VanDerWaalsContact CD2-CG2 3.47Å; H312-I362 WeakPolarHBondContact CD2-CG2 3.23Å; H312-I362 VanDerWaalsContact NE2-CG2 3.26Å; H312-I362 WeakPolarHBondContact NE2-CG2 3.21Å; N316-I362 HydrophobicContact CB-CD1 4.4Å; N316-I362 HydrophobicContact CB-CG2 3.89Å; L319-I362 HydrophobicContact CD1-CD1 3.63Å; L319-I362 HydrophobicContact CD1-CG1 3.97Å; L319-I362 HydrophobicContact CD2-CD1 4.4Å; L319-I362 HydrophobicContact CG-CD1 3.63Å; L319-I362 HydrophobicContact CG-CG1 4.22Å; C359-I362 WeakPolarHBondContact O-CG1 3.11Å; G360-I362 VanDerWaalsContact C-N 3.31Å; G360-I362 PolarHBondContact O-N 3.28Å; I362-V364 WeakPolarHBondContact O-CG2 3.28Å
363	P	98.3	Very high	96.5	Very high	0 Å²	0	38 Å²	38	0%	0	21%	0.209	C	C	.	.			trans	-62.3	142.8	179.1	-24.6	38.5	0	0	0	112	M313 F318 L319 L394 L395 V396	M313-P363 HydrophobicContact CB-CG 4.09Å; M313-P363 HydrophobicContact CG-CG 4.03Å; M313-P363 HydrophobicContact SD-CG 3.99Å; F318-P363 WeakPolarHBondContact CA-O 3.49Å; F318-P363 HydrophobicContact CB-CB 4.43Å; F318-P363 HydrophobicContact CD1-CB 3.68Å; F318-P363 HydrophobicContact CD1-CG 3.74Å; F318-P363 HydrophobicContact CD2-CB 3.91Å; F318-P363 HydrophobicContact CE1-CB 3.83Å; F318-P363 HydrophobicContact CE1-CG 3.46Å; F318-P363 VanDerWaalsContact CE1-CG 3.46Å; F318-P363 HydrophobicContact CE2-CB 4.02Å; F318-P363 HydrophobicContact CE2-CG 4.3Å; F318-P363 HydrophobicContact CG-CB 3.75Å; F318-P363 HydrophobicContact CG-CG 4.31Å; F318-P363 HydrophobicContact CZ-CB 3.98Å; F318-P363 HydrophobicContact CZ-CG 3.76Å; L319-P363 PolarHBondContact N-O 3.49Å; P363-L394 HydrophobicContact CB-CD1 3.76Å; P363-L394 HydrophobicContact CB-CG 4.43Å; P363-L395 CarbonylContact C-O 3.07Å; P363-L395 VanDerWaalsContact CA-O 3.25Å; P363-L395 WeakPolarHBondContact CA-O 3.22Å; P363-V396 HydrophobicContact CB-CG1 4.21Å; P363-V396 HydrophobicContact CG-CG1 4.37Å
364	V	98.7	Very high	96.4	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	120.8	-175.6	-169.6	0	0	0	0	109.4	L319 I321 V356 C359 I362 I366 L395	L319-V364 HydrophobicContact CB-CG1 4.25Å; L319-V364 HydrophobicContact CB-CG2 4.42Å; L319-V364 CarbonylContact O-C 3.55Å; L319-V364 WeakPolarHBondContact O-CA 3.35Å; I321-V364 HydrophobicContact CD1-CG1 4.02Å; I321-V364 HydrophobicContact CG1-CG1 3.84Å; V356-V364 HydrophobicContact CG2-CG2 4.48Å; C359-V364 HydrophobicContact CB-CG2 3.46Å; C359-V364 VanDerWaalsContact CB-CG2 3.46Å; I362-V364 WeakPolarHBondContact O-CG2 3.28Å; V364-I366 HydrophobicContact CG1-CD1 3.91Å; V364-L395 PolarHBondContact N-O 3.2Å; V364-L395 PolarHBondContact O-N 3.12Å
365	F	98.9	Very high	96.1	Very high	2 Å²	2	34.8 Å²	34.8	1%	0.009	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	125.5	165.5	-68.3	-71.4	0	0	0	110	M273 I276 E277 F318 L319 I320 I321 V392 D393 L394	M273-F365 HydrophobicContact CB-CD1 4.4Å; M273-F365 HydrophobicContact CB-CD2 4.29Å; M273-F365 HydrophobicContact CB-CE1 4.06Å; M273-F365 HydrophobicContact CB-CE2 3.94Å; M273-F365 HydrophobicContact CB-CG 4.49Å; M273-F365 HydrophobicContact CB-CZ 3.82Å; M273-F365 HydrophobicContact CG-CD1 3.73Å; M273-F365 HydrophobicContact CG-CD2 4.16Å; M273-F365 HydrophobicContact CG-CE1 3.81Å; M273-F365 HydrophobicContact CG-CE2 4.23Å; M273-F365 HydrophobicContact CG-CG 3.9Å; M273-F365 HydrophobicContact CG-CZ 4.07Å; M273-F365 WeakPolarHBondContact O-CZ 3.48Å; M273-F365 HydrophobicContact SD-CB 3.6Å; M273-F365 HydrophobicContact SD-CD1 3.96Å; M273-F365 HydrophobicContact SD-CD2 3.85Å; M273-F365 HydrophobicContact SD-CE2 4.47Å; M273-F365 HydrophobicContact SD-CG 3.55Å; M273-F365 VanDerWaalsContact SD-CG 3.55Å; I276-F365 HydrophobicContact CB-CE1 4.14Å; I276-F365 HydrophobicContact CB-CZ 4.22Å; I276-F365 HydrophobicContact CD1-CE1 4.32Å; I276-F365 HydrophobicContact CG2-CE1 3.76Å; I276-F365 HydrophobicContact CG2-CZ 3.98Å; E277-F365 HydrophobicContact CB-CZ 4.35Å; F318-F365 HydrophobicContact CB-CD2 3.83Å; F318-F365 HydrophobicContact CB-CE2 3.58Å; F318-F365 AromaticContact CD2-CE2 3.7Å; F318-F365 HydrophobicContact CD2-CE2 3.7Å; F318-F365 AromaticContact CD2-CZ 3.91Å; F318-F365 HydrophobicContact CD2-CZ 3.91Å; F318-F365 HydrophobicContact CG-CE2 4.16Å; L319-F365 PolarHBondContact O-N 2.99Å; I320-F365 WeakPolarHBondContact CA-O 3.38Å; I320-F365 HydrophobicContact CG1-CB 4.17Å; I320-F365 HydrophobicContact CG1-CD2 4.09Å; I321-F365 PolarHBondContact N-O 2.92Å; F365-V392 HydrophobicContact CB-CG2 4.15Å; F365-V392 HydrophobicContact CD1-CG2 3.54Å; F365-V392 HydrophobicContact CE1-CG2 4.33Å; F365-V392 HydrophobicContact CG-CG2 4.24Å; F365-D393 CarbonylContact C-O 3.59Å; F365-D393 WeakPolarHBondContact CA-O 3.32Å; F365-L394 HydrophobicContact CD1-CB 3.93Å; F365-L394 HydrophobicContact CD1-CD1 3.72Å; F365-L394 HydrophobicContact CD1-CG 4.36Å; F365-L394 HydrophobicContact CD2-CD1 4.19Å; F365-L394 HydrophobicContact CE1-CB 3.84Å; F365-L394 HydrophobicContact CE1-CD1 3.72Å; F365-L394 HydrophobicContact CE1-CD2 4.27Å; F365-L394 HydrophobicContact CE1-CG 4.13Å; F365-L394 HydrophobicContact CE2-CD1 4.18Å; F365-L394 HydrophobicContact CG-CD1 3.98Å; F365-L394 HydrophobicContact CZ-CD1 3.95Å; F365-L394 HydrophobicContact CZ-CD2 4.41Å
366	I	98.8	Very high	95.9	Very high	0 Å²	0	36 Å²	36	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	121.2	167.7	-47.9	-57.6	0	0	0	107.5	I321 A326 L347 L355 V364 Y369 V392 D393 L395	I321-I366 HydrophobicContact CD1-CD1 3.51Å; I321-I366 HydrophobicContact CG1-CD1 3.34Å; I321-I366 CarbonylContact O-C 3.56Å; I321-I366 VanDerWaalsContact O-CA 3.31Å; I321-I366 WeakPolarHBondContact O-CA 3.34Å; A326-I366 HydrophobicContact CB-CD1 4.31Å; A326-I366 HydrophobicContact CB-CG2 4.36Å; L347-I366 HydrophobicContact CD1-CG2 4.45Å; L355-I366 HydrophobicContact CD1-CD1 4.29Å; V364-I366 HydrophobicContact CG1-CD1 3.91Å; I366-Y369 HydrophobicContact CB-CE2 3.99Å; I366-Y369 WeakPolarHBondContact CB-OH 3.48Å; I366-Y369 HydrophobicContact CG2-CE1 4.38Å; I366-Y369 HydrophobicContact CG2-CE2 3.77Å; I366-Y369 WeakPolarHBondContact O-CE2 3.39Å; I366-V392 VanDerWaalsContact O-CA 3.31Å; I366-V392 WeakPolarHBondContact O-CA 3.38Å; I366-D393 PolarHBondContact N-O 3.32Å; I366-D393 PolarHBondContact O-N 3.19Å; I366-L395 HydrophobicContact CD1-CD1 3.99Å; I366-L395 HydrophobicContact CG1-CD1 3.58Å; I366-L395 HydrophobicContact CG1-CG 3.89Å
367	I	98.6	Very high	95.7	Very high	28 Å²	28	36.5 Å²	36.5	14%	0.144	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	163.5	-176.5	64.9	168.8	0	0	0	112.8	L269 M273 I320 I321 S322 Y323 A391 V392	L269-I367 HydrophobicContact CD1-CB 3.87Å; L269-I367 HydrophobicContact CD1-CG2 4.03Å; M273-I367 HydrophobicContact CE-CG2 4.43Å; M273-I367 HydrophobicContact SD-CG2 3.77Å; I320-I367 HydrophobicContact CG2-CD1 3.82Å; I320-I367 HydrophobicContact CG2-CG1 4.14Å; I320-I367 HydrophobicContact CG2-CG2 4.14Å; I321-I367 PolarHBondContact O-N 3.03Å; S322-I367 CarbonylContact C-O 3.53Å; S322-I367 WeakPolarHBondContact CA-O 3.45Å; Y323-I367 PolarHBondContact N-O 2.95Å; I367-A391 CarbonylContact C-O 3.51Å; I367-A391 VanDerWaalsContact CA-O 3.27Å; I367-A391 WeakPolarHBondContact CA-O 3.42Å; I367-V392 HydrophobicContact CG2-CB 4.08Å; I367-V392 HydrophobicContact CG2-CG2 3.84Å
368	N	97.7	Very high	95.8	Very high	44 Å²	44	30.2 Å²	30.2	24%	0.235	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	60.8	61.3	170.3	-61.5	-21.2	0	0	0	113.4	Y323 N381 T388 V389 A391	Y323-N368 WeakPolarHBondContact CB-O 3.32Å; N368-N381 PolarHBondContact OD1-ND2 2.78Å; N368-T388 WeakPolarHBondContact O-CG2 3.31Å; N368-V389 VanDerWaalsContact CA-O 3.25Å; N368-V389 WeakPolarHBondContact CA-O 3.42Å; N368-A391 PolarHBondContact N-O 2.9Å
369	Y	97.8	Very high	95.8	Very high	5 Å²	5	28.2 Å²	28.2	2%	0.02	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	154.3	178.3	-80.4	-96.4	0	0	0	112.3	Y323 L347 I366 L371 I373 K374 T388 V389 A391 D393	Y323-Y369 AromaticContact CD2-CD1 3.42Å; Y323-Y369 HydrophobicContact CD2-CD1 3.42Å; Y323-Y369 VanDerWaalsContact CD2-CD1 3.42Å; Y323-Y369 AromaticContact CD2-CE1 3.52Å; Y323-Y369 HydrophobicContact CD2-CE1 3.52Å; Y323-Y369 HydrophobicContact CD2-CG 4.28Å; Y323-Y369 HydrophobicContact CE2-CD1 4.01Å; Y323-Y369 HydrophobicContact CE2-CE1 4.13Å; Y323-Y369 HydrophobicContact CG-CD1 4.08Å; Y323-Y369 HydrophobicContact CG-CE1 4.44Å; L347-Y369 HydrophobicContact CD1-CE1 4.37Å; I366-Y369 HydrophobicContact CB-CE2 3.99Å; I366-Y369 WeakPolarHBondContact CB-OH 3.48Å; I366-Y369 HydrophobicContact CG2-CE1 4.38Å; I366-Y369 HydrophobicContact CG2-CE2 3.77Å; I366-Y369 WeakPolarHBondContact O-CE2 3.39Å; Y369-L371 PolarHBondContact O-N 3.26Å; Y369-I373 HydrophobicContact CD1-CD1 4.41Å; Y369-K374 HydrophobicContact CG-CD 4.49Å; Y369-K374 HydrophobicContact CG-CG 4.44Å; Y369-T388 CarbonylContact O-C 3.57Å; Y369-T388 WeakPolarHBondContact O-CA 3.4Å; Y369-T388 WeakPolarHBondContact O-CB 3.48Å; Y369-V389 PolarHBondContact N-O 2.91Å; Y369-V389 WeakPolarHBondContact O-CG2 3.39Å; Y369-V389 PolarHBondContact O-N 3.43Å; Y369-A391 HydrophobicContact CD2-CB 3.96Å; Y369-A391 HydrophobicContact CG-CB 4.49Å; Y369-D393 HydrophobicContact CE2-CB 4.17Å; Y369-D393 VanDerWaalsContact CE2-OD2 3.28Å; Y369-D393 WeakPolarHBondContact CE2-OD2 3.39Å; Y369-D393 PolarHBondContact OH-OD2 3.11Å
370	P	96.9	Very high	95.8	Very high	2 Å²	2	28 Å²	28	1%	0.013	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-56.5	136.1	174.4	-23.5	32.9	0	0	0	111.8	Y323 W343 A372 I373	Y323-P370 VanDerWaalsContact CD1-CD 3.41Å; Y323-P370 HydrophobicContact CD1-CG 3.65Å; Y323-P370 VanDerWaalsContact CE1-CD 3.49Å; Y323-P370 HydrophobicContact CE1-CG 3.26Å; Y323-P370 HydrophobicContact CE2-CG 4.45Å; Y323-P370 HydrophobicContact CG-CG 4.38Å; W343-P370 HydrophobicContact CD2-CG 4.31Å; W343-P370 HydrophobicContact CE3-CG 4.42Å; W343-P370 HydrophobicContact CH2-CB 3.75Å; W343-P370 HydrophobicContact CH2-CG 3.96Å; W343-P370 HydrophobicContact CZ2-CB 4.11Å; W343-P370 HydrophobicContact CZ2-CG 3.87Å; W343-P370 HydrophobicContact CZ3-CB 4.07Å; W343-P370 HydrophobicContact CZ3-CG 4.25Å; P370-A372 PolarHBondContact O-N 3.04Å; P370-I373 HydrophobicContact CB-CD1 4.27Å; P370-I373 HydrophobicContact CB-CG1 4.13Å; P370-I373 HydrophobicContact CG-CD1 4Å; P370-I373 HydrophobicContact CG-CG1 4.38Å; P370-I373 WeakPolarHBondContact O-CG1 3.47Å; P370-I373 PolarHBondContact O-N 2.88Å
371	L	93.8	Very high	95.8	Very high	38 Å²	38	28.3 Å²	28.3	20%	0.199	16%	0.156	C	C	.	.	G	3₁₀ helix	trans	-57.8	-35.4	-177.7	-178.8	142.6	0	0	0	113.4	Y369 I373 D380 H387 V389 R418	Y369-L371 PolarHBondContact O-N 3.26Å; L371-I373 PolarHBondContact O-N 2.85Å; L371-D380 HydrophobicContact CD1-CB 4.41Å; L371-D380 WeakPolarHBondContact CD1-OD2 3.3Å; L371-H387 HydrophobicContact CB-CB 4.02Å; L371-H387 VanDerWaalsContact CB-O 3.32Å; L371-H387 WeakPolarHBondContact CB-O 3.07Å; L371-H387 HydrophobicContact CD1-CB 3.85Å; L371-H387 PolarHBondContact N-O 2.8Å; L371-V389 HydrophobicContact CB-CG1 3.92Å; L371-V389 HydrophobicContact CD1-CG1 3.95Å; L371-V389 HydrophobicContact CG-CG1 3.92Å; L371-R418 VanDerWaalsContact CD1-CZ 3.44Å
372	A	91.5	Very high	95.7	Very high	97 Å²	97	29.7 Å²	29.7	80%	0.802	16%	0.16	S	C	*	.	G	3₁₀ helix	trans	-69.3	-16.5	-176	0	0	0	0	0	114.8	P370	P370-A372 PolarHBondContact O-N 3.04Å
373	I	92.1	Very high	95.5	Very high	38 Å²	38	33.1 Å²	33.1	20%	0.195	18%	0.179	C	C	.	.	G	3₁₀ helix	trans	-114.2	8.8	-175.8	68.3	179.6	0	0	0	113.3	Y323 G344 N346 Y369 P370 L371	Y323-I373 HydrophobicContact CE2-CD1 4.45Å; G344-I373 WeakPolarHBondContact O-CG2 3.42Å; N346-I373 WeakPolarHBondContact OD1-CD1 3.49Å; Y369-I373 HydrophobicContact CD1-CD1 4.41Å; P370-I373 HydrophobicContact CB-CD1 4.27Å; P370-I373 HydrophobicContact CB-CG1 4.13Å; P370-I373 HydrophobicContact CG-CD1 4Å; P370-I373 HydrophobicContact CG-CG1 4.38Å; P370-I373 WeakPolarHBondContact O-CG1 3.47Å; P370-I373 PolarHBondContact O-N 2.88Å; L371-I373 PolarHBondContact O-N 2.85Å
374	K	92.9	Very high	94.7	Very high	38 Å²	38	34.5 Å²	34.5	17%	0.165	19%	0.193	C	C	.	.	S	Bend	trans	-123	156.1	178.9	-73.9	-67.4	-173.9	175.2	0	111	Y369 M378 V389 A391 D393	Y369-K374 HydrophobicContact CG-CD 4.49Å; Y369-K374 HydrophobicContact CG-CG 4.44Å; K374-M378 HydrophobicContact CB-SD 3.71Å; K374-M378 HydrophobicContact CD-CE 4.12Å; K374-M378 HydrophobicContact CD-SD 3.85Å; K374-M378 HydrophobicContact CG-SD 3.91Å; K374-V389 HydrophobicContact CB-CG2 3.66Å; K374-V389 HydrophobicContact CG-CG2 3.82Å; K374-A391 HydrophobicContact CD-CB 4.25Å; K374-A391 HydrophobicContact CG-CB 4.26Å; K374-D393 IonicContact NZ-OD1 3.58Å; K374-D393 PolarHBondContact NZ-OD1 2.82Å; K374-D393 IonicContact NZ-OD2 3.8Å; K374-D393 PolarHBondContact NZ-OD2 2.85Å
375	P	92.1	Very high	93.7	Very high	30 Å²	30	41 Å²	41	20%	0.195	24%	0.235	C	C	.	.			trans	-60.7	156.7	-175.2	-27.6	38	0	0	0	114.4	Y377 M378	P375-Y377 HydrophobicContact CB-CD1 3.67Å; P375-Y377 HydrophobicContact CB-CD2 4.4Å; P375-Y377 HydrophobicContact CB-CE1 3.22Å; P375-Y377 HydrophobicContact CB-CE2 4.02Å; P375-Y377 HydrophobicContact CB-CG 4.25Å; P375-Y377 VanDerWaalsContact CB-CZ 3.43Å; P375-Y377 HydrophobicContact CG-CE1 3.88Å; P375-Y377 HydrophobicContact CG-CE2 4.37Å; P375-Y377 PolarHBondContact O-N 2.8Å; P375-M378 PolarHBondContact O-N 3.2Å; P375-M378 VanDerWaalsContact O-N 3.13Å
376	F	92.4	Very high	93	Very high	25 Å²	25	47.2 Å²	47.2	11%	0.11	26%	0.264	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.9	-27.8	-175.9	69	-91.9	0	0	0	113.9	M378 L415 R418 L419 Y428 Y431	F376-M378 VanDerWaalsContact C-N 3.33Å; F376-M378 PolarHBondContact O-N 3.18Å; F376-L415 HydrophobicContact CD2-CD1 3.82Å; F376-L415 HydrophobicContact CE2-CD1 4.23Å; F376-R418 HydrophobicContact CB-CB 4.35Å; F376-R418 VanDerWaalsContact O-CD 3.29Å; F376-R418 WeakPolarHBondContact O-CD 3.44Å; F376-L419 HydrophobicContact CD2-CD2 3.57Å; F376-L419 HydrophobicContact CD2-CG 4.11Å; F376-L419 HydrophobicContact CE2-CD2 3.64Å; F376-L419 HydrophobicContact CE2-CG 4.4Å; F376-L419 HydrophobicContact CG-CD2 4.11Å; F376-L419 HydrophobicContact CZ-CD2 4.21Å; F376-Y428 HydrophobicContact CZ-CE1 4.47Å; F376-Y431 HydrophobicContact CE2-CD1 4.06Å; F376-Y431 AromaticContact CE2-CE1 3.74Å; F376-Y431 HydrophobicContact CE2-CE1 3.74Å; F376-Y431 HydrophobicContact CZ-CE1 4.48Å
377	Y	94.6	Very high	92.5	Very high	15 Å²	15	50.9 Å²	50.9	6%	0.059	28%	0.281	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.6	-9	-176.7	56.8	-107.9	0	0	0	114.2	S188 Q222 P375 R408 E409 Y431	S188-Y377 VanDerWaalsContact O-CE1 3.27Å; S188-Y377 WeakPolarHBondContact O-CE1 3.21Å; Q222-Y377 VanDerWaalsContact NE2-CD2 3.3Å; Q222-Y377 VanDerWaalsContact NE2-CZ 3.31Å; Q222-Y377 PolarHBondContact OE1-OH 3.48Å; P375-Y377 HydrophobicContact CB-CD1 3.67Å; P375-Y377 HydrophobicContact CB-CD2 4.4Å; P375-Y377 HydrophobicContact CB-CE1 3.22Å; P375-Y377 HydrophobicContact CB-CE2 4.02Å; P375-Y377 HydrophobicContact CB-CG 4.25Å; P375-Y377 VanDerWaalsContact CB-CZ 3.43Å; P375-Y377 HydrophobicContact CG-CE1 3.88Å; P375-Y377 HydrophobicContact CG-CE2 4.37Å; P375-Y377 PolarHBondContact O-N 2.8Å; Y377-R408 CarbonylContact O-C 3.58Å; Y377-R408 VanDerWaalsContact O-CA 3.31Å; Y377-R408 WeakPolarHBondContact O-CA 3.41Å; Y377-E409 PolarHBondContact O-N 2.91Å; Y377-Y431 VanDerWaalsContact CB-OH 3.28Å; Y377-Y431 WeakPolarHBondContact CB-OH 3.46Å
378	M	96.6	Very high	92.4	Very high	10 Å²	10	49.8 Å²	49.8	5%	0.049	28%	0.276	C	S	.	.	B	Isolated β-bridge	trans	-79.1	130.2	-177.1	-67.3	-161.3	171.5	0	0	111.9	K374 P375 F376 D380 V389 A391 R418	K374-M378 HydrophobicContact CB-SD 3.71Å; K374-M378 HydrophobicContact CD-CE 4.12Å; K374-M378 HydrophobicContact CD-SD 3.85Å; K374-M378 HydrophobicContact CG-SD 3.91Å; P375-M378 PolarHBondContact O-N 3.2Å; P375-M378 VanDerWaalsContact O-N 3.13Å; F376-M378 VanDerWaalsContact C-N 3.33Å; F376-M378 PolarHBondContact O-N 3.18Å; M378-D380 PolarHBondContact O-N 3.06Å; M378-V389 HydrophobicContact CB-CB 3.89Å; M378-V389 HydrophobicContact CB-CG1 4.24Å; M378-V389 HydrophobicContact CB-CG2 4.02Å; M378-V389 HydrophobicContact SD-CG2 4.17Å; M378-A391 HydrophobicContact CE-CB 4.21Å; M378-A391 HydrophobicContact SD-CB 3.41Å; M378-A391 WeakPolarHBondContact SD-CB 3.5Å; M378-R418 VanDerWaalsContact O-CZ 3.23Å; M378-R418 PolarHBondContact O-NH1 2.94Å; M378-R418 PolarHBondContact O-NH2 3.02Å
379	R	97.3	Very high	92.4	Very high	63 Å²	63	47.7 Å²	47.7	24%	0.238	26%	0.264	C	S	.	.	P	Polyproline II helix	trans	-58.2	128.9	-175.6	-171	178.4	-168.5	-126.2	4.4	112.4	V389 A390 L407 E409 E410	R379-V389 CarbonylContact O-C 3.48Å; R379-V389 WeakPolarHBondContact O-CA 3.37Å; R379-V389 WeakPolarHBondContact O-CB 3.25Å; R379-A390 HydrophobicContact CB-CB 4.28Å; R379-A390 PolarHBondContact O-N 3.47Å; R379-L407 HydrophobicContact CB-CB 3.92Å; R379-L407 PolarHBondContact N-O 3.02Å; R379-E409 WeakPolarHBondContact CA-OE2 3.45Å; R379-E410 WeakPolarHBondContact CD-OE2 3.27Å; R379-E410 IonicContact CZ-OE1 3.68Å; R379-E410 IonicContact NE-OE1 3.48Å; R379-E410 PolarHBondContact NE-OE1 3.29Å; R379-E410 IonicContact NE-OE2 2.74Å; R379-E410 PolarHBondContact NE-OE2 3.28Å; R379-E410 IonicContact NH2-OE1 2.81Å; R379-E410 PolarHBondContact NH2-OE1 2.83Å
380	D	96.4	Very high	92.4	Very high	15 Å²	15	47.5 Å²	47.5	8%	0.08	26%	0.264	C	S	.	.	B	Isolated β-bridge	trans	-69.2	130.5	173.4	-156	-45.7	0	0	0	111.2	L371 M378 E382 H387 E409 R411 F414 R418	L371-D380 HydrophobicContact CD1-CB 4.41Å; L371-D380 WeakPolarHBondContact CD1-OD2 3.3Å; M378-D380 PolarHBondContact O-N 3.06Å; D380-E382 VanDerWaalsContact C-N 3.35Å; D380-E382 HydrophobicContact CB-CG 4.48Å; D380-E382 PolarHBondContact OD1-N 2.71Å; D380-H387 IonicContact OD1-CE1 3.83Å; D380-H387 IonicContact OD1-CG 3.06Å; D380-H387 IonicContact OD1-ND1 2.84Å; D380-H387 PolarHBondContact OD1-ND1 2.95Å; D380-H387 IonicContact OD2-ND1 3.43Å; D380-H387 PolarHBondContact OD2-ND1 2.64Å; D380-E409 PolarHBondContact N-OE2 3.24Å; D380-R411 PolarHBondContact O-NH2 2.74Å; D380-F414 HydrophobicContact CB-CD1 4.26Å; D380-R418 VanDerWaalsContact CB-NH2 3.34Å; D380-R418 IonicContact OD2-NH2 2.74Å
381	N	96.1	Very high	92.5	Very high	50 Å²	50	47.4 Å²	47.4	27%	0.267	26%	0.264	S	S	.	.			trans	-80	-16.1	176.6	-76.2	-26.9	0	0	0	113.3	N368 D383 T388 A390	N368-N381 PolarHBondContact OD1-ND2 2.78Å; N381-D383 HydrophobicContact CB-CB 4.15Å; N381-D383 PolarHBondContact O-N 2.85Å; N381-D383 VanDerWaalsContact O-N 3.16Å; N381-T388 WeakPolarHBondContact CB-O 3.26Å; N381-T388 PolarHBondContact N-O 2.89Å; N381-T388 PolarHBondContact ND2-OG1 2.84Å; N381-A390 WeakPolarHBondContact OD1-CB 3.18Å; N381-A390 PolarHBondContact OD1-N 3.07Å
382	E	92.5	Very high	92.7	Very high	107 Å²	107	45.7 Å²	45.7	50%	0.5	25%	0.254	S	S	.	.			trans	52.8	32.3	-176.5	-59.1	179.3	93.3	0	0	113.3	D380 G384 R411 F414	D380-E382 VanDerWaalsContact C-N 3.35Å; D380-E382 HydrophobicContact CB-CG 4.48Å; D380-E382 PolarHBondContact OD1-N 2.71Å; E382-G384 VanDerWaalsContact C-N 3.29Å; E382-G384 PolarHBondContact O-N 2.95Å; E382-R411 IonicContact OE2-CZ 2.86Å; E382-R411 IonicContact OE2-NH1 2.77Å; E382-R411 PolarHBondContact OE2-NH1 3.24Å; E382-F414 HydrophobicContact CG-CE1 4Å; E382-F414 HydrophobicContact CG-CZ 4.46Å; E382-F414 VanDerWaalsContact OE1-CZ 3.27Å; E382-F414 WeakPolarHBondContact OE1-CZ 3.44Å
383	D	90.8	Very high	93.1	Very high	88 Å²	88	41.6 Å²	41.6	47%	0.471	22%	0.219	S	C	.	.			trans	-86.7	7.7	-169	60.7	-21.4	0	0	0	114.4	N381 T388	N381-D383 HydrophobicContact CB-CB 4.15Å; N381-D383 PolarHBondContact O-N 2.85Å; N381-D383 VanDerWaalsContact O-N 3.16Å; D383-T388 VanDerWaalsContact CG-OG1 3.28Å; D383-T388 PolarHBondContact OD1-N 3.02Å; D383-T388 PolarHBondContact OD1-OG1 2.79Å; D383-T388 WeakPolarHBondContact OD2-CB 3.31Å; D383-T388 WeakPolarHBondContact OD2-CG2 3.27Å; D383-T388 PolarHBondContact OD2-OG1 3.46Å
384	G	82.3	Confident	93.4	Very high	29 Å²	29	39.9 Å²	39.9	30%	0.299	21%	0.21	S	C	.	.	S	Bend	trans	142.3	-165.7	172.3	0	0	0	0	0	113.4	E382 Q386 H387	E382-G384 VanDerWaalsContact C-N 3.29Å; E382-G384 PolarHBondContact O-N 2.95Å; G384-Q386 VanDerWaalsContact C-N 3.26Å; G384-Q386 PolarHBondContact O-N 2.84Å; G384-H387 PolarHBondContact O-CD2 2.77Å; G384-H387 PolarHBondContact O-NE2 2.95Å
385	P	78.1	Confident	93.7	Very high	137 Å²	137	38.1 Å²	38.1	89%	0.89	20%	0.203	S	C	*	.	S	Bend	trans	-63.6	-29.3	-177.2	-22.4	33.3	0	0	0	114.2
386	Q	83.4	Confident	93.9	Very high	133 Å²	133	36.7 Å²	36.7	62%	0.621	19%	0.194	S	C	*	.	S	Bend	trans	-101.9	74.1	174.8	-73	-174.8	3.5	0	0	108.7	W343 G384 T388	W343-Q386 HydrophobicContact CH2-CB 3.66Å; W343-Q386 HydrophobicContact CH2-CG 4.37Å; W343-Q386 HydrophobicContact CZ2-CB 4.17Å; W343-Q386 HydrophobicContact CZ3-CB 4.14Å; W343-Q386 HydrophobicContact CZ3-CG 4.36Å; G384-Q386 VanDerWaalsContact C-N 3.26Å; G384-Q386 PolarHBondContact O-N 2.84Å; Q386-T388 PolarHBondContact O-N 2.95Å
387	H	89.3	Confident	94	Very high	77 Å²	77	36.1 Å²	36.1	36%	0.356	19%	0.192	S	C	.	.			trans	-53.1	132.5	-175.2	-70.5	-107.6	0	0	0	112.4	L371 D380 G384	L371-H387 HydrophobicContact CB-CB 4.02Å; L371-H387 VanDerWaalsContact CB-O 3.32Å; L371-H387 WeakPolarHBondContact CB-O 3.07Å; L371-H387 HydrophobicContact CD1-CB 3.85Å; L371-H387 PolarHBondContact N-O 2.8Å; D380-H387 IonicContact OD1-CE1 3.83Å; D380-H387 IonicContact OD1-CG 3.06Å; D380-H387 IonicContact OD1-ND1 2.84Å; D380-H387 PolarHBondContact OD1-ND1 2.95Å; D380-H387 IonicContact OD2-ND1 3.43Å; D380-H387 PolarHBondContact OD2-ND1 2.64Å; G384-H387 PolarHBondContact O-CD2 2.77Å; G384-H387 PolarHBondContact O-NE2 2.95Å
388	T	96.7	Very high	93.7	Very high	4 Å²	4	38.2 Å²	38.2	3%	0.025	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	165.4	162	71.1	0	0	0	0	111	W343 N368 Y369 N381 D383 Q386	W343-T388 HydrophobicContact CZ2-CG2 4.31Å; N368-T388 WeakPolarHBondContact O-CG2 3.31Å; Y369-T388 CarbonylContact O-C 3.57Å; Y369-T388 WeakPolarHBondContact O-CA 3.4Å; Y369-T388 WeakPolarHBondContact O-CB 3.48Å; N381-T388 WeakPolarHBondContact CB-O 3.26Å; N381-T388 PolarHBondContact N-O 2.89Å; N381-T388 PolarHBondContact ND2-OG1 2.84Å; D383-T388 VanDerWaalsContact CG-OG1 3.28Å; D383-T388 PolarHBondContact OD1-N 3.02Å; D383-T388 PolarHBondContact OD1-OG1 2.79Å; D383-T388 WeakPolarHBondContact OD2-CB 3.31Å; D383-T388 WeakPolarHBondContact OD2-CG2 3.27Å; D383-T388 PolarHBondContact OD2-OG1 3.46Å; Q386-T388 PolarHBondContact O-N 2.95Å
389	V	97.4	Very high	93.5	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	149.6	172	-69.7	0	0	0	0	110.4	N368 Y369 L371 K374 M378 R379 A391	N368-V389 VanDerWaalsContact CA-O 3.25Å; N368-V389 WeakPolarHBondContact CA-O 3.42Å; Y369-V389 PolarHBondContact N-O 2.91Å; Y369-V389 WeakPolarHBondContact O-CG2 3.39Å; Y369-V389 PolarHBondContact O-N 3.43Å; L371-V389 HydrophobicContact CB-CG1 3.92Å; L371-V389 HydrophobicContact CD1-CG1 3.95Å; L371-V389 HydrophobicContact CG-CG1 3.92Å; K374-V389 HydrophobicContact CB-CG2 3.66Å; K374-V389 HydrophobicContact CG-CG2 3.82Å; M378-V389 HydrophobicContact CB-CB 3.89Å; M378-V389 HydrophobicContact CB-CG1 4.24Å; M378-V389 HydrophobicContact CB-CG2 4.02Å; M378-V389 HydrophobicContact SD-CG2 4.17Å; R379-V389 CarbonylContact O-C 3.48Å; R379-V389 WeakPolarHBondContact O-CA 3.37Å; R379-V389 WeakPolarHBondContact O-CB 3.25Å; V389-A391 HydrophobicContact CG2-CB 3.97Å; V389-A391 PolarHBondContact O-N 3.31Å
390	A	98	Very high	93.4	Very high	2 Å²	2	35.4 Å²	35.4	2%	0.017	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	68.7	173.8	0	0	0	0	0	111	L269 R379 N381 G406 L407	L269-A390 HydrophobicContact CD1-CB 4.32Å; L269-A390 HydrophobicContact CD2-CB 4.32Å; L269-A390 WeakPolarHBondContact CD2-O 3.31Å; L269-A390 HydrophobicContact CG-CB 4.19Å; R379-A390 HydrophobicContact CB-CB 4.28Å; R379-A390 PolarHBondContact O-N 3.47Å; N381-A390 WeakPolarHBondContact OD1-CB 3.18Å; N381-A390 PolarHBondContact OD1-N 3.07Å; A390-G406 CarbonylContact O-C 3.59Å; A390-G406 WeakPolarHBondContact O-CA 3.15Å; A390-L407 HydrophobicContact CB-CB 3.91Å; A390-L407 HydrophobicContact CB-CD1 3.97Å; A390-L407 HydrophobicContact CB-CG 3.99Å; A390-L407 PolarHBondContact O-N 2.87Å
391	A	98.2	Very high	93.4	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	151.8	175.9	0	0	0	0	0	109.7	L269 I367 N368 Y369 K374 M378 V389 G405	L269-A391 WeakPolarHBondContact CD1-O 3.4Å; I367-A391 CarbonylContact C-O 3.51Å; I367-A391 VanDerWaalsContact CA-O 3.27Å; I367-A391 WeakPolarHBondContact CA-O 3.42Å; N368-A391 PolarHBondContact N-O 2.9Å; Y369-A391 HydrophobicContact CD2-CB 3.96Å; Y369-A391 HydrophobicContact CG-CB 4.49Å; K374-A391 HydrophobicContact CD-CB 4.25Å; K374-A391 HydrophobicContact CG-CB 4.26Å; M378-A391 HydrophobicContact CE-CB 4.21Å; M378-A391 HydrophobicContact SD-CB 3.41Å; M378-A391 WeakPolarHBondContact SD-CB 3.5Å; V389-A391 HydrophobicContact CG2-CB 3.97Å; V389-A391 PolarHBondContact O-N 3.31Å; A391-G405 CarbonylContact C-O 3.52Å; A391-G405 WeakPolarHBondContact CA-O 3.44Å
392	V	98.6	Very high	93.5	Very high	1 Å²	1	35.5 Å²	35.5	1%	0.006	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	132.7	174	58.1	0	0	0	0	110.6	L269 M273 I276 F365 I366 I367 G404 G405	L269-V392 HydrophobicContact CD2-CB 4.19Å; L269-V392 HydrophobicContact CD2-CG1 3.99Å; M273-V392 HydrophobicContact CG-CG2 3.84Å; M273-V392 HydrophobicContact SD-CG2 4.02Å; I276-V392 HydrophobicContact CD1-CG1 4.44Å; F365-V392 HydrophobicContact CB-CG2 4.15Å; F365-V392 HydrophobicContact CD1-CG2 3.54Å; F365-V392 HydrophobicContact CE1-CG2 4.33Å; F365-V392 HydrophobicContact CG-CG2 4.24Å; I366-V392 VanDerWaalsContact O-CA 3.31Å; I366-V392 WeakPolarHBondContact O-CA 3.38Å; I367-V392 HydrophobicContact CG2-CB 4.08Å; I367-V392 HydrophobicContact CG2-CG2 3.84Å; V392-G404 CarbonylContact O-C 3.52Å; V392-G405 PolarHBondContact N-O 2.58Å; V392-G405 PolarHBondContact O-N 2.83Å
393	D	98.6	Very high	93.8	Very high	12 Å²	12	30.5 Å²	30.5	6%	0.064	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	134.8	168.7	-58.1	-17.2	0	0	0	108.8	F365 I366 Y369 K374 E401 F403	F365-D393 CarbonylContact C-O 3.59Å; F365-D393 WeakPolarHBondContact CA-O 3.32Å; I366-D393 PolarHBondContact N-O 3.32Å; I366-D393 PolarHBondContact O-N 3.19Å; Y369-D393 HydrophobicContact CE2-CB 4.17Å; Y369-D393 VanDerWaalsContact CE2-OD2 3.28Å; Y369-D393 WeakPolarHBondContact CE2-OD2 3.39Å; Y369-D393 PolarHBondContact OH-OD2 3.11Å; K374-D393 IonicContact NZ-OD1 3.58Å; K374-D393 PolarHBondContact NZ-OD1 2.82Å; K374-D393 IonicContact NZ-OD2 3.8Å; K374-D393 PolarHBondContact NZ-OD2 2.85Å; D393-E401 HydrophobicContact CB-CG 4.38Å; D393-F403 CarbonylContact C-O 3.5Å; D393-F403 VanDerWaalsContact CA-O 3.25Å; D393-F403 WeakPolarHBondContact CA-O 3.47Å
394	L	98.8	Very high	94.1	Very high	1 Å²	1	27.3 Å²	27.3	1%	0.005	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	113.9	172	-178.6	62.9	0	0	0	109.6	I276 F318 P363 F365 V396 L402 F403	I276-L394 HydrophobicContact CG2-CB 4.43Å; I276-L394 HydrophobicContact CG2-CD2 3.82Å; F318-L394 HydrophobicContact CD2-CD1 3.82Å; F318-L394 HydrophobicContact CD2-CD2 4.03Å; F318-L394 HydrophobicContact CE2-CD1 4.34Å; F318-L394 HydrophobicContact CE2-CD2 3.78Å; F318-L394 HydrophobicContact CG-CD1 4.5Å; P363-L394 HydrophobicContact CB-CD1 3.76Å; P363-L394 HydrophobicContact CB-CG 4.43Å; F365-L394 HydrophobicContact CD1-CB 3.93Å; F365-L394 HydrophobicContact CD1-CD1 3.72Å; F365-L394 HydrophobicContact CD1-CG 4.36Å; F365-L394 HydrophobicContact CD2-CD1 4.19Å; F365-L394 HydrophobicContact CE1-CB 3.84Å; F365-L394 HydrophobicContact CE1-CD1 3.72Å; F365-L394 HydrophobicContact CE1-CD2 4.27Å; F365-L394 HydrophobicContact CE1-CG 4.13Å; F365-L394 HydrophobicContact CE2-CD1 4.18Å; F365-L394 HydrophobicContact CG-CD1 3.98Å; F365-L394 HydrophobicContact CZ-CD1 3.95Å; F365-L394 HydrophobicContact CZ-CD2 4.41Å; L394-V396 HydrophobicContact CD2-CG1 4.37Å; L394-V396 HydrophobicContact CG-CG1 4.23Å; L394-L402 PolarHBondContact O-N 3.47Å; L394-F403 HydrophobicContact CB-CB 3.92Å; L394-F403 HydrophobicContact CB-CD2 4.08Å; L394-F403 HydrophobicContact CB-CG 4.39Å; L394-F403 HydrophobicContact CD2-CD2 3.72Å; L394-F403 HydrophobicContact CD2-CE2 4.06Å; L394-F403 HydrophobicContact CG-CD2 4.42Å; L394-F403 PolarHBondContact N-O 3.16Å
395	L	98.6	Very high	94.9	Very high	1 Å²	1	26 Å²	26	1%	0.005	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	132.2	173.7	-51.4	-175.9	0	0	0	110.4	E352 L355 V356 P363 V364 I366 G400 E401	E352-L395 HydrophobicContact CB-CD1 3.95Å; E352-L395 HydrophobicContact CB-CD2 4.12Å; E352-L395 HydrophobicContact CG-CD1 4.06Å; E352-L395 HydrophobicContact CG-CD2 3.77Å; L355-L395 HydrophobicContact CB-CD1 4.42Å; L355-L395 HydrophobicContact CD1-CD1 4.2Å; V356-L395 HydrophobicContact CG2-CB 3.51Å; P363-L395 CarbonylContact C-O 3.07Å; P363-L395 VanDerWaalsContact CA-O 3.25Å; P363-L395 WeakPolarHBondContact CA-O 3.22Å; V364-L395 PolarHBondContact N-O 3.2Å; V364-L395 PolarHBondContact O-N 3.12Å; I366-L395 HydrophobicContact CD1-CD1 3.99Å; I366-L395 HydrophobicContact CG1-CD1 3.58Å; I366-L395 HydrophobicContact CG1-CG 3.89Å; L395-G400 CarbonylContact C-O 3.55Å; L395-G400 WeakPolarHBondContact CA-O 3.49Å; L395-E401 HydrophobicContact CD2-CB 4.02Å
396	V	97.5	Very high	95.8	Very high	1 Å²	1	19.5 Å²	19.5	1%	0.006	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	149.7	178	-56.5	0	0	0	0	112.3	P363 L394 G398 V399 G400 L402 C455	P363-V396 HydrophobicContact CB-CG1 4.21Å; P363-V396 HydrophobicContact CG-CG1 4.37Å; L394-V396 HydrophobicContact CD2-CG1 4.37Å; L394-V396 HydrophobicContact CG-CG1 4.23Å; V396-G398 PolarHBondContact O-N 3.13Å; V396-V399 HydrophobicContact CG2-CB 3.73Å; V396-V399 HydrophobicContact CG2-CG2 4.18Å; V396-V399 PolarHBondContact O-N 3.43Å; V396-G400 PolarHBondContact N-O 3.1Å; V396-G400 PolarHBondContact O-N 3.3Å; V396-L402 HydrophobicContact CG1-CB 3.94Å; V396-L402 HydrophobicContact CG1-CD2 3.76Å; V396-L402 HydrophobicContact CG2-CB 3.95Å; V396-L402 HydrophobicContact CG2-CD2 4.23Å; V396-C455 HydrophobicContact CG2-CB 4.15Å
397	P	94.8	Very high	96.5	Very high	12 Å²	12	13.4 Å²	13.4	8%	0.078	9%	0.088	C	C	.	.	T	Hydrogen-bonded Turn	trans	-47	134.4	174.9	-31.4	33	0	0	0	114.1	I309 M313 V356 N361 V399	I309-P397 HydrophobicContact CG2-CB 3.95Å; I309-P397 HydrophobicContact CG2-CG 4.42Å; M313-P397 HydrophobicContact CG-CG 4.02Å; M313-P397 HydrophobicContact SD-CB 4.24Å; M313-P397 WeakPolarHBondContact SD-CD 3.32Å; M313-P397 HydrophobicContact SD-CG 3.62Å; V356-P397 HydrophobicContact CG1-CB 4.14Å; V356-P397 HydrophobicContact CG1-CG 3.61Å; N361-P397 HydrophobicContact CB-CG 4.5Å; N361-P397 VanDerWaalsContact O-CG 3.31Å; N361-P397 WeakPolarHBondContact O-CG 2.89Å; P397-V399 PolarHBondContact O-N 3.28Å
398	G	87.7	Confident	97	Very high	60 Å²	60	9.8 Å²	9.8	62%	0.619	7%	0.071	S	C	*	.	T	Hydrogen-bonded Turn	trans	76.7	-42.4	177.4	0	0	0	0	0	114.8	R251 V396	R251-G398 PolarHBondContact NH2-O 2.99Å; V396-G398 PolarHBondContact O-N 3.13Å
399	V	92.3	Very high	97	Very high	14 Å²	14	9.6 Å²	9.6	9%	0.085	7%	0.07	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.5	-47.5	-176.3	-175.4	0	0	0	0	111.7	R251 V396 P397 R451 Q454 C455	R251-V399 PolarHBondContact NH1-O 3.47Å; R251-V399 PolarHBondContact NH2-O 2.72Å; V396-V399 HydrophobicContact CG2-CB 3.73Å; V396-V399 HydrophobicContact CG2-CG2 4.18Å; V396-V399 PolarHBondContact O-N 3.43Å; P397-V399 PolarHBondContact O-N 3.28Å; V399-R451 HydrophobicContact CG1-CB 4.16Å; V399-R451 HydrophobicContact CG1-CG 4.26Å; V399-Q454 HydrophobicContact CG2-CB 4.28Å; V399-C455 HydrophobicContact CG2-CB 3.92Å
400	G	94.6	Very high	97	Very high	0 Å²	0	10.7 Å²	10.7	0%	0	8%	0.075	C	C	.	.	E	Extended strand (participates in β ladder)	trans	94.7	-138.8	-165	0	0	0	0	0	109.9	E352 L395 V396 L402	E352-G400 VanDerWaalsContact OE2-CA 3.28Å; E352-G400 WeakPolarHBondContact OE2-CA 3.46Å; L395-G400 CarbonylContact C-O 3.55Å; L395-G400 WeakPolarHBondContact CA-O 3.49Å; V396-G400 PolarHBondContact N-O 3.1Å; V396-G400 PolarHBondContact O-N 3.3Å; G400-L402 PolarHBondContact O-N 3.37Å
401	E	97.1	Very high	97	Very high	63 Å²	63	13.1 Å²	13.1	29%	0.294	8%	0.084	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-57.7	120.8	179.5	-172.7	-157.6	167.4	0	0	113.1	E352 D393 L395 R451	E352-E401 PolarHBondContact OE2-N 3.47Å; D393-E401 HydrophobicContact CB-CG 4.38Å; L395-E401 HydrophobicContact CD2-CB 4.02Å; E401-R451 VanDerWaalsContact O-CD 3.3Å; E401-R451 WeakPolarHBondContact O-CD 3.07Å; E401-R451 PolarHBondContact O-NH1 3.42Å; E401-R451 IonicContact OE2-NH1 3.64Å
402	L	97.9	Very high	96.9	Very high	4 Å²	4	14.8 Å²	14.8	2%	0.021	9%	0.091	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	-40	174.5	178	59.6	0	0	0	112.8	F280 L394 V396 G400 M447 G448 R451 Y452	F280-L402 HydrophobicContact CD2-CD2 3.73Å; F280-L402 HydrophobicContact CE2-CD2 3.71Å; L394-L402 PolarHBondContact O-N 3.47Å; V396-L402 HydrophobicContact CG1-CB 3.94Å; V396-L402 HydrophobicContact CG1-CD2 3.76Å; V396-L402 HydrophobicContact CG2-CB 3.95Å; V396-L402 HydrophobicContact CG2-CD2 4.23Å; G400-L402 PolarHBondContact O-N 3.37Å; L402-M447 HydrophobicContact CD1-CG 4.17Å; L402-M447 HydrophobicContact CG-CG 4.32Å; L402-G448 PolarHBondContact O-N 3.09Å; L402-R451 HydrophobicContact CD1-CB 3.79Å; L402-Y452 VanDerWaalsContact CD1-N 3.27Å
403	F	98.6	Very high	96.8	Very high	1 Å²	1	21.3 Å²	21.3	0%	0.004	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	144.9	174.4	-66.4	-107.5	0	0	0	109.8	I276 L279 F280 D393 L394 F445 G446 M447	I276-F403 HydrophobicContact CB-CD1 4.4Å; I276-F403 HydrophobicContact CG1-CD1 4.05Å; I276-F403 HydrophobicContact CG1-CE1 4.43Å; I276-F403 HydrophobicContact CG2-CB 4.17Å; I276-F403 HydrophobicContact CG2-CD1 3.66Å; I276-F403 HydrophobicContact CG2-CD2 3.78Å; I276-F403 HydrophobicContact CG2-CE1 3.85Å; I276-F403 HydrophobicContact CG2-CE2 3.98Å; I276-F403 HydrophobicContact CG2-CG 3.61Å; I276-F403 HydrophobicContact CG2-CZ 4Å; L279-F403 HydrophobicContact CD2-CE1 3.89Å; L279-F403 HydrophobicContact CD2-CZ 4.23Å; F280-F403 HydrophobicContact CB-CE2 4.35Å; F280-F403 HydrophobicContact CB-CZ 4.43Å; F280-F403 HydrophobicContact CD2-CE2 4.41Å; D393-F403 CarbonylContact C-O 3.5Å; D393-F403 VanDerWaalsContact CA-O 3.25Å; D393-F403 WeakPolarHBondContact CA-O 3.47Å; L394-F403 HydrophobicContact CB-CB 3.92Å; L394-F403 HydrophobicContact CB-CD2 4.08Å; L394-F403 HydrophobicContact CB-CG 4.39Å; L394-F403 HydrophobicContact CD2-CD2 3.72Å; L394-F403 HydrophobicContact CD2-CE2 4.06Å; L394-F403 HydrophobicContact CG-CD2 4.42Å; L394-F403 PolarHBondContact N-O 3.16Å; F403-F445 AromaticContact CD1-CD2 3.74Å; F403-F445 HydrophobicContact CD1-CD2 3.74Å; F403-F445 HydrophobicContact CD1-CE2 4.21Å; F403-F445 HydrophobicContact CD1-CG 4.47Å; F403-F445 HydrophobicContact CE1-CD2 4.01Å; F403-F445 AromaticContact CE1-CE2 4Å; F403-F445 HydrophobicContact CE1-CE2 4Å; F403-G446 VanDerWaalsContact CA-O 3.3Å; F403-G446 WeakPolarHBondContact CA-O 3.3Å; F403-M447 HydrophobicContact CD1-CB 3.66Å; F403-M447 HydrophobicContact CD1-CG 4.04Å; F403-M447 HydrophobicContact CD2-CG 4.2Å; F403-M447 HydrophobicContact CE1-CB 3.47Å; F403-M447 VanDerWaalsContact CE1-CB 3.47Å; F403-M447 HydrophobicContact CE1-CG 3.67Å; F403-M447 HydrophobicContact CE1-SD 3.78Å; F403-M447 HydrophobicContact CE2-CB 4.5Å; F403-M447 HydrophobicContact CE2-CG 3.83Å; F403-M447 HydrophobicContact CE2-SD 3.77Å; F403-M447 HydrophobicContact CG-CB 4.28Å; F403-M447 HydrophobicContact CG-CG 4.3Å; F403-M447 HydrophobicContact CZ-CB 3.94Å; F403-M447 HydrophobicContact CZ-CG 3.56Å; F403-M447 HydrophobicContact CZ-SD 3.23Å; F403-M447 WeakPolarHBondContact CZ-SD 3.34Å
404	G	98.2	Very high	96.7	Very high	21 Å²	21	23.7 Å²	23.7	22%	0.216	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	137.8	166.1	0	0	0	0	0	109.7	V392 F445 G446	V392-G404 CarbonylContact O-C 3.52Å; G404-F445 CarbonylContact O-C 3.58Å; G404-F445 VanDerWaalsContact O-CA 3.31Å; G404-F445 WeakPolarHBondContact O-CA 3.45Å; G404-G446 PolarHBondContact N-O 3.33Å; G404-G446 VanDerWaalsContact N-O 3.08Å; G404-G446 PolarHBondContact O-N 3.28Å
405	G	97.9	Very high	96.6	Very high	2 Å²	2	23.7 Å²	23.7	2%	0.021	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-169	-171.2	-174.4	0	0	0	0	0	113.5	A391 V392 G444	A391-G405 CarbonylContact C-O 3.52Å; A391-G405 WeakPolarHBondContact CA-O 3.44Å; V392-G405 PolarHBondContact N-O 2.58Å; V392-G405 PolarHBondContact O-N 2.83Å; G405-G444 CarbonylContact C-O 3.43Å; G405-G444 WeakPolarHBondContact CA-O 3.44Å
406	G	98.3	Very high	96.5	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	164.2	174.5	178.3	0	0	0	0	0	113.6	L272 A390 G443 G444	L272-G406 WeakPolarHBondContact CD1-O 3.41Å; A390-G406 CarbonylContact O-C 3.59Å; A390-G406 WeakPolarHBondContact O-CA 3.15Å; G406-G443 VanDerWaalsContact O-CA 3.26Å; G406-G443 WeakPolarHBondContact O-CA 3.48Å; G406-G444 PolarHBondContact N-O 3.44Å; G406-G444 PolarHBondContact O-N 3.19Å
407	L	98.5	Very high	96.3	Very high	5 Å²	5	31.5 Å²	31.5	3%	0.026	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	143.6	167.9	-56.8	-178.4	0	0	0	109.5	V266 L269 L272 R379 A390	V266-L407 HydrophobicContact CB-CD2 4.39Å; V266-L407 HydrophobicContact CG1-CD2 3.69Å; L269-L407 HydrophobicContact CD2-CG 4.25Å; L272-L407 HydrophobicContact CD1-CD2 4.07Å; L272-L407 HydrophobicContact CG-CD2 4.47Å; R379-L407 HydrophobicContact CB-CB 3.92Å; R379-L407 PolarHBondContact N-O 3.02Å; A390-L407 HydrophobicContact CB-CB 3.91Å; A390-L407 HydrophobicContact CB-CD1 3.97Å; A390-L407 HydrophobicContact CB-CG 3.99Å; A390-L407 PolarHBondContact O-N 2.87Å
408	R	97.9	Very high	96.2	Very high	2 Å²	2	32 Å²	32	1%	0.008	17%	0.167	C	C	.	.	B	Isolated β-bridge	trans	-90	147.1	177.5	-43.6	-50.5	177	178.1	6.9	109.6	Q222 E226 E262 Y377 E410 H442 G444	Q222-R408 VanDerWaalsContact CD-NH2 3.29Å; Q222-R408 VanDerWaalsContact OE1-CZ 3.29Å; E226-R408 HydrophobicContact CG-CG 4.41Å; E262-R408 WeakPolarHBondContact OE1-CG 3.42Å; E262-R408 IonicContact OE1-CZ 2.69Å; E262-R408 IonicContact OE1-NE 3.44Å; E262-R408 PolarHBondContact OE1-NE 3.39Å; E262-R408 IonicContact OE1-NH2 3.54Å; E262-R408 IonicContact OE2-CZ 2.69Å; E262-R408 IonicContact OE2-NE 3.26Å; E262-R408 PolarHBondContact OE2-NE 3.49Å; E262-R408 IonicContact OE2-NH2 3.7Å; E262-R408 PolarHBondContact OE2-NH2 3.12Å; Y377-R408 CarbonylContact O-C 3.58Å; Y377-R408 VanDerWaalsContact O-CA 3.31Å; Y377-R408 WeakPolarHBondContact O-CA 3.41Å; R408-E410 PolarHBondContact O-N 3.27Å; R408-E410 VanDerWaalsContact O-OE2 3.1Å; R408-H442 VanDerWaalsContact CB-NE2 3.32Å; R408-H442 WeakPolarHBondContact CB-NE2 3.45Å; R408-H442 WeakPolarHBondContact CG-CD2 3.48Å; R408-H442 WeakPolarHBondContact CG-NE2 3.36Å; R408-H442 PolarHBondContact N-O 3.49Å; R408-G444 VanDerWaalsContact NH2-C 3.26Å; R408-G444 VanDerWaalsContact NH2-CA 3.28Å; R408-G444 PolarHBondContact NH2-O 3.27Å
409	E	97.6	Very high	96.4	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	14%	0.138	C	C	.	.			trans	-70.5	96.9	176.2	-173.8	51.6	-101.3	0	0	109.1	Y377 R379 D380 R411 F414 L415 R435	Y377-E409 PolarHBondContact O-N 2.91Å; R379-E409 WeakPolarHBondContact CA-OE2 3.45Å; D380-E409 PolarHBondContact N-OE2 3.24Å; E409-R411 VanDerWaalsContact C-N 3.33Å; E409-R411 VanDerWaalsContact OE1-CB 3.24Å; E409-R411 WeakPolarHBondContact OE1-CB 3.46Å; E409-R411 IonicContact OE1-CZ 2.94Å; E409-R411 PolarHBondContact OE1-N 2.88Å; E409-R411 VanDerWaalsContact OE1-N 3.12Å; E409-R411 IonicContact OE1-NE 2.69Å; E409-R411 PolarHBondContact OE1-NE 3.29Å; E409-R411 IonicContact OE1-NH2 2.99Å; E409-R411 PolarHBondContact OE1-NH2 3.4Å; E409-R411 IonicContact OE2-CZ 2.64Å; E409-R411 IonicContact OE2-NE 3.98Å; E409-R411 IonicContact OE2-NH2 3.78Å; E409-R411 PolarHBondContact OE2-NH2 2.88Å; E409-F414 HydrophobicContact CG-CB 3.79Å; E409-L415 HydrophobicContact CB-CB 4.45Å; E409-L415 HydrophobicContact CB-CD1 4.48Å; E409-L415 HydrophobicContact CG-CB 3.97Å; E409-R435 PolarHBondContact O-NE 3.34Å; E409-R435 PolarHBondContact O-NH2 3.18Å
410	E	97.4	Very high	96.4	Very high	22 Å²	22	31.2 Å²	31.2	10%	0.103	16%	0.157	C	C	.	.			trans	-83	-13.6	-177.7	79.6	-74.3	-173.8	0	0	112.5	R379 R408 R435 S439 V440 P441	R379-E410 WeakPolarHBondContact CD-OE2 3.27Å; R379-E410 IonicContact CZ-OE1 3.68Å; R379-E410 IonicContact NE-OE1 3.48Å; R379-E410 PolarHBondContact NE-OE1 3.29Å; R379-E410 IonicContact NE-OE2 2.74Å; R379-E410 PolarHBondContact NE-OE2 3.28Å; R379-E410 IonicContact NH2-OE1 2.81Å; R379-E410 PolarHBondContact NH2-OE1 2.83Å; R408-E410 PolarHBondContact O-N 3.27Å; R408-E410 VanDerWaalsContact O-OE2 3.1Å; E410-R435 WeakPolarHBondContact O-CG 3.28Å; E410-S439 PolarHBondContact O-OG 3.44Å; E410-V440 WeakPolarHBondContact CB-O 3.46Å; E410-P441 HydrophobicContact CG-CG 4.5Å
411	R	97.3	Very high	96.2	Very high	54 Å²	54	39.4 Å²	39.4	20%	0.204	19%	0.187	C	C	.	.			trans	-90.4	117	-176.7	-56.5	165.3	-68.9	-170.5	-2.8	109.6	D380 E382 E409 H413 F414 L415	D380-R411 PolarHBondContact O-NH2 2.74Å; E382-R411 IonicContact OE2-CZ 2.86Å; E382-R411 IonicContact OE2-NH1 2.77Å; E382-R411 PolarHBondContact OE2-NH1 3.24Å; E409-R411 VanDerWaalsContact C-N 3.33Å; E409-R411 VanDerWaalsContact OE1-CB 3.24Å; E409-R411 WeakPolarHBondContact OE1-CB 3.46Å; E409-R411 IonicContact OE1-CZ 2.94Å; E409-R411 PolarHBondContact OE1-N 2.88Å; E409-R411 VanDerWaalsContact OE1-N 3.12Å; E409-R411 IonicContact OE1-NE 2.69Å; E409-R411 PolarHBondContact OE1-NE 3.29Å; E409-R411 IonicContact OE1-NH2 2.99Å; E409-R411 PolarHBondContact OE1-NH2 3.4Å; E409-R411 IonicContact OE2-CZ 2.64Å; E409-R411 IonicContact OE2-NE 3.98Å; E409-R411 IonicContact OE2-NH2 3.78Å; E409-R411 PolarHBondContact OE2-NH2 2.88Å; R411-H413 PolarHBondContact O-N 2.97Å; R411-F414 HydrophobicContact CB-CB 4.36Å; R411-F414 HydrophobicContact CB-CD2 3.86Å; R411-F414 HydrophobicContact CB-CG 4.42Å; R411-F414 PolarHBondContact O-N 3.36Å; R411-L415 PolarHBondContact O-N 3.07Å
412	Y	97.6	Very high	95.6	Very high	35 Å²	35	40.1 Å²	40.1	14%	0.137	20%	0.199	C	C	.	.	H	α-helix	trans	-49	-53	-175	178.8	-87.8	0	0	0	113.6	F414 L415 E416 L432 R435 R436	Y412-F414 PolarHBondContact O-N 2.8Å; Y412-L415 PolarHBondContact O-N 3.42Å; Y412-E416 HydrophobicContact CE1-CB 4.18Å; Y412-E416 VanDerWaalsContact CE1-CD 3.49Å; Y412-E416 HydrophobicContact CE1-CG 4.41Å; Y412-E416 WeakPolarHBondContact CE1-OE1 3.37Å; Y412-E416 WeakPolarHBondContact CE1-OE2 3.24Å; Y412-E416 WeakPolarHBondContact O-CB 3.29Å; Y412-E416 PolarHBondContact O-N 3.48Å; Y412-E416 PolarHBondContact OH-OE1 2.81Å; Y412-L432 HydrophobicContact CD2-CD2 4.24Å; Y412-L432 HydrophobicContact CE2-CB 3.89Å; Y412-L432 HydrophobicContact CE2-CD2 3.98Å; Y412-L432 HydrophobicContact CE2-CG 4.39Å; Y412-R435 HydrophobicContact CD2-CB 4.31Å; Y412-R436 HydrophobicContact CD2-CG 3.46Å; Y412-R436 VanDerWaalsContact CD2-CG 3.46Å; Y412-R436 HydrophobicContact CE2-CG 3.55Å; Y412-R436 HydrophobicContact CG-CG 4.43Å; Y412-R436 PolarHBondContact OH-NH2 3.11Å
413	H	96.2	Very high	95.2	Very high	138 Å²	138	43.1 Å²	43.1	64%	0.639	23%	0.231	S	C	*	.	H	α-helix	trans	-66.4	-35.3	-173.7	-64.2	-59.5	0	0	0	113.3	R411 E417	R411-H413 PolarHBondContact O-N 2.97Å; H413-E417 WeakPolarHBondContact O-CB 3.27Å; H413-E417 PolarHBondContact O-N 2.89Å
414	F	95.3	Very high	94.7	Very high	62 Å²	62	45.7 Å²	45.7	27%	0.272	25%	0.245	S	C	.	.	H	α-helix	trans	-68	-45	177.6	-76.5	-104.9	0	0	0	110.9	D380 E382 E409 R411 Y412 E417 R418	D380-F414 HydrophobicContact CB-CD1 4.26Å; E382-F414 HydrophobicContact CG-CE1 4Å; E382-F414 HydrophobicContact CG-CZ 4.46Å; E382-F414 VanDerWaalsContact OE1-CZ 3.27Å; E382-F414 WeakPolarHBondContact OE1-CZ 3.44Å; E409-F414 HydrophobicContact CG-CB 3.79Å; R411-F414 HydrophobicContact CB-CB 4.36Å; R411-F414 HydrophobicContact CB-CD2 3.86Å; R411-F414 HydrophobicContact CB-CG 4.42Å; R411-F414 PolarHBondContact O-N 3.36Å; Y412-F414 PolarHBondContact O-N 2.8Å; F414-E417 PolarHBondContact O-N 2.64Å; F414-R418 PolarHBondContact O-N 2.96Å; F414-R418 VanDerWaalsContact O-N 3.14Å
415	L	96.5	Very high	94.2	Very high	0 Å²	0	46.4 Å²	46.4	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-65.8	-42.6	177.9	-177.1	59.6	0	0	0	111.8	F376 E409 R411 Y412 E417 R418 L419 Y431 L432 R435	F376-L415 HydrophobicContact CD2-CD1 3.82Å; F376-L415 HydrophobicContact CE2-CD1 4.23Å; E409-L415 HydrophobicContact CB-CB 4.45Å; E409-L415 HydrophobicContact CB-CD1 4.48Å; E409-L415 HydrophobicContact CG-CB 3.97Å; R411-L415 PolarHBondContact O-N 3.07Å; Y412-L415 PolarHBondContact O-N 3.42Å; L415-E417 PolarHBondContact O-N 2.91Å; L415-R418 PolarHBondContact O-N 2.99Å; L415-L419 HydrophobicContact CD1-CD1 4.36Å; L415-L419 HydrophobicContact CD1-CG 4.42Å; L415-L419 HydrophobicContact CG-CD1 4.11Å; L415-L419 WeakPolarHBondContact O-CG 3.44Å; L415-L419 PolarHBondContact O-N 2.99Å; L415-Y431 HydrophobicContact CD1-CE1 4.11Å; L415-Y431 HydrophobicContact CD2-CD1 3.85Å; L415-Y431 HydrophobicContact CD2-CE1 3.75Å; L415-L432 HydrophobicContact CB-CD2 4.13Å; L415-L432 HydrophobicContact CD2-CD2 4.01Å; L415-L432 HydrophobicContact CG-CD2 3.88Å; L415-R435 HydrophobicContact CD2-CG 4.2Å
416	E	96.5	Very high	93.8	Very high	64 Å²	64	55 Å²	55	30%	0.299	28%	0.284	S	S	.	.	H	α-helix	trans	-59.8	-45	177.4	-178.9	178.3	-116.8	0	0	111.5	Y412 R418 L419 A420 L432	Y412-E416 HydrophobicContact CE1-CB 4.18Å; Y412-E416 VanDerWaalsContact CE1-CD 3.49Å; Y412-E416 HydrophobicContact CE1-CG 4.41Å; Y412-E416 WeakPolarHBondContact CE1-OE1 3.37Å; Y412-E416 WeakPolarHBondContact CE1-OE2 3.24Å; Y412-E416 WeakPolarHBondContact O-CB 3.29Å; Y412-E416 PolarHBondContact O-N 3.48Å; Y412-E416 PolarHBondContact OH-OE1 2.81Å; E416-R418 PolarHBondContact O-N 3.13Å; E416-L419 PolarHBondContact O-N 3.06Å; E416-A420 VanDerWaalsContact O-CB 3.3Å; E416-A420 WeakPolarHBondContact O-CB 3.27Å; E416-A420 PolarHBondContact O-N 3.41Å; E416-L432 HydrophobicContact CB-CD1 4.48Å; E416-L432 HydrophobicContact CB-CD2 3.94Å; E416-L432 HydrophobicContact CG-CD1 4.49Å
417	E	94.3	Very high	93.2	Very high	103 Å²	103	58.8 Å²	58.8	48%	0.481	31%	0.307	S	S	.	.	H	α-helix	trans	-62.5	-42.9	177.5	-171.7	-179.3	176.7	0	0	111.8	H413 F414 L415 A420 R421	H413-E417 WeakPolarHBondContact O-CB 3.27Å; H413-E417 PolarHBondContact O-N 2.89Å; F414-E417 PolarHBondContact O-N 2.64Å; L415-E417 PolarHBondContact O-N 2.91Å; E417-A420 PolarHBondContact O-N 2.79Å; E417-R421 WeakPolarHBondContact O-CG 3.35Å; E417-R421 PolarHBondContact O-N 2.74Å; E417-R421 VanDerWaalsContact O-N 3.08Å; E417-R421 IonicContact OE1-CZ 3.45Å; E417-R421 IonicContact OE1-NE 3.53Å; E417-R421 IonicContact OE1-NH2 2.99Å; E417-R421 PolarHBondContact OE1-NH2 2.93Å
418	R	91.8	Very high	92.9	Very high	22 Å²	22	58.8 Å²	58.8	8%	0.083	31%	0.307	C	S	.	.	H	α-helix	trans	-64	-44	177.1	-72.8	-160.1	-174.7	175	21.1	112.5	L371 F376 M378 D380 F414 L415 E416 A420 R421 S422	L371-R418 VanDerWaalsContact CD1-CZ 3.44Å; F376-R418 HydrophobicContact CB-CB 4.35Å; F376-R418 VanDerWaalsContact O-CD 3.29Å; F376-R418 WeakPolarHBondContact O-CD 3.44Å; M378-R418 VanDerWaalsContact O-CZ 3.23Å; M378-R418 PolarHBondContact O-NH1 2.94Å; M378-R418 PolarHBondContact O-NH2 3.02Å; D380-R418 VanDerWaalsContact CB-NH2 3.34Å; D380-R418 IonicContact OD2-NH2 2.74Å; F414-R418 PolarHBondContact O-N 2.96Å; F414-R418 VanDerWaalsContact O-N 3.14Å; L415-R418 PolarHBondContact O-N 2.99Å; E416-R418 PolarHBondContact O-N 3.13Å; R418-A420 VanDerWaalsContact C-N 3.33Å; R418-A420 PolarHBondContact O-N 2.85Å; R418-R421 PolarHBondContact O-N 2.88Å; R418-S422 PolarHBondContact O-N 3.45Å
419	L	92.5	Very high	92.7	Very high	0 Å²	0	61.9 Å²	61.9	0%	0	32%	0.321	C	S	.	.	H	α-helix	trans	-63.5	-39.5	176	-73.8	170.7	0	0	0	111.8	F376 L415 E416 R421 S422 G423 L424 Y428 L432	F376-L419 HydrophobicContact CD2-CD2 3.57Å; F376-L419 HydrophobicContact CD2-CG 4.11Å; F376-L419 HydrophobicContact CE2-CD2 3.64Å; F376-L419 HydrophobicContact CE2-CG 4.4Å; F376-L419 HydrophobicContact CG-CD2 4.11Å; F376-L419 HydrophobicContact CZ-CD2 4.21Å; L415-L419 HydrophobicContact CD1-CD1 4.36Å; L415-L419 HydrophobicContact CD1-CG 4.42Å; L415-L419 HydrophobicContact CG-CD1 4.11Å; L415-L419 WeakPolarHBondContact O-CG 3.44Å; L415-L419 PolarHBondContact O-N 2.99Å; E416-L419 PolarHBondContact O-N 3.06Å; L419-R421 PolarHBondContact O-N 3Å; L419-S422 CarbonylContact O-C 3.35Å; L419-S422 PolarHBondContact O-N 3.06Å; L419-G423 PolarHBondContact O-N 3.16Å; L419-G423 VanDerWaalsContact O-N 3.11Å; L419-L424 HydrophobicContact CD2-CB 3.87Å; L419-L424 PolarHBondContact O-N 3.41Å; L419-Y428 HydrophobicContact CD2-CD2 3.92Å; L419-Y428 HydrophobicContact CD2-CG 4.17Å; L419-L432 HydrophobicContact CD1-CD1 4.01Å; L419-L432 HydrophobicContact CD1-CD2 4.03Å; L419-L432 HydrophobicContact CD1-CG 3.77Å
420	A	93.2	Very high	92.6	Very high	58 Å²	58	66 Å²	66	48%	0.479	34%	0.337	S	S	.	.	H	α-helix	trans	-63.2	-40.8	178.7	0	0	0	0	0	112	E416 E417 R418 S422 G423 T425	E416-A420 VanDerWaalsContact O-CB 3.3Å; E416-A420 WeakPolarHBondContact O-CB 3.27Å; E416-A420 PolarHBondContact O-N 3.41Å; E417-A420 PolarHBondContact O-N 2.79Å; R418-A420 VanDerWaalsContact C-N 3.33Å; R418-A420 PolarHBondContact O-N 2.85Å; A420-S422 PolarHBondContact O-N 2.57Å; A420-G423 PolarHBondContact O-N 3.44Å; A420-G423 VanDerWaalsContact O-N 3.09Å; A420-T425 VanDerWaalsContact CA-OG1 3.28Å; A420-T425 WeakPolarHBondContact CA-OG1 3.17Å; A420-T425 PolarHBondContact N-OG1 3Å
421	R	89.4	Confident	92.4	Very high	172 Å²	172	65 Å²	65	65%	0.649	33%	0.332	S	S	*	.	H	α-helix	trans	-60.9	-28.6	176.1	-70.9	172.3	-174.5	-173.6	3.3	113.1	E417 R418 L419	E417-R421 WeakPolarHBondContact O-CG 3.35Å; E417-R421 PolarHBondContact O-N 2.74Å; E417-R421 VanDerWaalsContact O-N 3.08Å; E417-R421 IonicContact OE1-CZ 3.45Å; E417-R421 IonicContact OE1-NE 3.53Å; E417-R421 IonicContact OE1-NH2 2.99Å; E417-R421 PolarHBondContact OE1-NH2 2.93Å; R418-R421 PolarHBondContact O-N 2.88Å; L419-R421 PolarHBondContact O-N 3Å
422	S	85.5	Confident	92.4	Very high	78 Å²	78	62.4 Å²	62.4	55%	0.545	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.3	0.1	177.6	-60.3	0	0	0	0	113.8	R418 L419 A420 L424	R418-S422 PolarHBondContact O-N 3.45Å; L419-S422 CarbonylContact O-C 3.35Å; L419-S422 PolarHBondContact O-N 3.06Å; A420-S422 PolarHBondContact O-N 2.57Å; S422-L424 VanDerWaalsContact C-N 3.27Å; S422-L424 PolarHBondContact O-N 2.78Å
423	G	88.5	Confident	92.4	Very high	66 Å²	66	63 Å²	63	68%	0.68	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.8	25.4	-176.5	0	0	0	0	0	113.8	L419 A420	L419-G423 PolarHBondContact O-N 3.16Å; L419-G423 VanDerWaalsContact O-N 3.11Å; A420-G423 PolarHBondContact O-N 3.44Å; A420-G423 VanDerWaalsContact O-N 3.09Å
424	L	88.4	Confident	92.5	Very high	56 Å²	56	58.8 Å²	58.8	29%	0.293	31%	0.31	S	S	.	.			trans	-106.9	-0.3	-170.1	-71.7	-179.1	0	0	0	114	L419 S422 E426 V427 Y428	L419-L424 HydrophobicContact CD2-CB 3.87Å; L419-L424 PolarHBondContact O-N 3.41Å; S422-L424 VanDerWaalsContact C-N 3.27Å; S422-L424 PolarHBondContact O-N 2.78Å; L424-E426 PolarHBondContact O-N 3.03Å; L424-V427 PolarHBondContact O-N 2.69Å; L424-Y428 HydrophobicContact CB-CD2 3.94Å; L424-Y428 HydrophobicContact CB-CE2 4.32Å; L424-Y428 HydrophobicContact CD1-CE2 4.18Å; L424-Y428 HydrophobicContact CD2-CE2 4.35Å; L424-Y428 PolarHBondContact O-N 2.79Å; L424-Y428 VanDerWaalsContact O-N 3.09Å
425	T	88.6	Confident	92.6	Very high	35 Å²	35	56.5 Å²	56.5	22%	0.215	30%	0.3	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.4	-47.3	-173.6	-51.9	0	0	0	0	113.3	A420 V427 Y428 Q429 L432	A420-T425 VanDerWaalsContact CA-OG1 3.28Å; A420-T425 WeakPolarHBondContact CA-OG1 3.17Å; A420-T425 PolarHBondContact N-OG1 3Å; T425-V427 PolarHBondContact O-N 3.09Å; T425-Y428 CarbonylContact O-C 3.47Å; T425-Y428 PolarHBondContact O-N 3.38Å; T425-Q429 PolarHBondContact O-N 2.9Å; T425-Q429 VanDerWaalsContact O-N 3.1Å; T425-L432 HydrophobicContact CG2-CD1 4.02Å
426	E	88	Confident	92.6	Very high	183 Å²	183	62 Å²	62	86%	0.855	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.9	-40.5	-178.2	-64.9	-172.6	171.6	0	0	112	L424 Y428	L424-E426 PolarHBondContact O-N 3.03Å; E426-Y428 VanDerWaalsContact C-N 3.33Å; E426-Y428 PolarHBondContact O-N 2.84Å
427	V	87.2	Confident	92.5	Very high	80 Å²	80	66.8 Å²	66.8	49%	0.485	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.6	-37.8	180	-180	0	0	0	0	111.3	L424 T425 W430	L424-V427 PolarHBondContact O-N 2.69Å; T425-V427 PolarHBondContact O-N 3.09Å; V427-W430 PolarHBondContact O-NE1 3.42Å
428	Y	91.4	Very high	92.5	Very high	5 Å²	5	65 Å²	65	2%	0.02	35%	0.35	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104.8	24.5	-175.9	-71.4	-74.7	0	0	0	113.8	N186 D187 L223 F376 L419 L424 T425 E426 W430 Y431 L432	N186-Y428 HydrophobicContact CB-CE1 4.43Å; D187-Y428 PolarHBondContact N-OH 3.16Å; D187-Y428 PolarHBondContact O-OH 3.29Å; L223-Y428 HydrophobicContact CD1-CD1 4.5Å; L223-Y428 HydrophobicContact CD1-CE1 3.67Å; F376-Y428 HydrophobicContact CZ-CE1 4.47Å; L419-Y428 HydrophobicContact CD2-CD2 3.92Å; L419-Y428 HydrophobicContact CD2-CG 4.17Å; L424-Y428 HydrophobicContact CB-CD2 3.94Å; L424-Y428 HydrophobicContact CB-CE2 4.32Å; L424-Y428 HydrophobicContact CD1-CE2 4.18Å; L424-Y428 HydrophobicContact CD2-CE2 4.35Å; L424-Y428 PolarHBondContact O-N 2.79Å; L424-Y428 VanDerWaalsContact O-N 3.09Å; T425-Y428 CarbonylContact O-C 3.47Å; T425-Y428 PolarHBondContact O-N 3.38Å; E426-Y428 VanDerWaalsContact C-N 3.33Å; E426-Y428 PolarHBondContact O-N 2.84Å; Y428-W430 HydrophobicContact CD1-CZ2 4.06Å; Y428-W430 HydrophobicContact CE1-CZ2 4.25Å; Y428-W430 PolarHBondContact O-N 3.12Å; Y428-Y431 WeakPolarHBondContact O-CB 3.38Å; Y428-Y431 PolarHBondContact O-N 3.12Å; Y428-L432 PolarHBondContact O-N 3.47Å
429	Q	94.1	Very high	92.8	Very high	66 Å²	66	66 Å²	66	31%	0.308	36%	0.361	S	S	.	.	H	α-helix	trans	-57.9	-38.2	177.3	-174.9	56.4	73.9	0	0	112.4	T425 Y431 L432 D433	T425-Q429 PolarHBondContact O-N 2.9Å; T425-Q429 VanDerWaalsContact O-N 3.1Å; Q429-Y431 VanDerWaalsContact C-N 3.27Å; Q429-Y431 PolarHBondContact O-N 3.43Å; Q429-L432 WeakPolarHBondContact O-CB 3.41Å; Q429-L432 PolarHBondContact O-N 2.92Å; Q429-D433 PolarHBondContact O-N 3.33Å
430	W	94	Very high	93	Very high	87 Å²	87	67.4 Å²	67.4	33%	0.33	37%	0.369	S	S	.	.	H	α-helix	trans	-64.7	-31.4	175.4	65.6	-92.5	0	0	0	112.6	L223 V227 V427 Y428 D433 L434	L223-W430 HydrophobicContact CB-CH2 3.94Å; V227-W430 HydrophobicContact CG2-CE3 4.28Å; V227-W430 HydrophobicContact CG2-CZ3 3.65Å; V427-W430 PolarHBondContact O-NE1 3.42Å; Y428-W430 HydrophobicContact CD1-CZ2 4.06Å; Y428-W430 HydrophobicContact CE1-CZ2 4.25Å; Y428-W430 PolarHBondContact O-N 3.12Å; W430-D433 WeakPolarHBondContact O-CB 3.48Å; W430-D433 PolarHBondContact O-N 2.77Å; W430-L434 HydrophobicContact CZ3-CD1 4.39Å
431	Y	95.3	Very high	93.2	Very high	0 Å²	0	66.5 Å²	66.5	0%	0	36%	0.358	C	S	.	.	H	α-helix	trans	-77.5	-33.9	179.6	-173.6	-112.4	0	0	0	111.1	L223 E226 F376 Y377 L415 Y428 Q429 D433 L434 R435	L223-Y431 HydrophobicContact CD2-CD2 4.23Å; L223-Y431 HydrophobicContact CD2-CE1 4.41Å; L223-Y431 HydrophobicContact CD2-CE2 3.61Å; E226-Y431 HydrophobicContact CB-CE2 4.33Å; E226-Y431 PolarHBondContact OE1-OH 3.43Å; E226-Y431 WeakPolarHBondContact OE2-CE2 3.26Å; E226-Y431 PolarHBondContact OE2-OH 3.41Å; F376-Y431 HydrophobicContact CE2-CD1 4.06Å; F376-Y431 AromaticContact CE2-CE1 3.74Å; F376-Y431 HydrophobicContact CE2-CE1 3.74Å; F376-Y431 HydrophobicContact CZ-CE1 4.48Å; Y377-Y431 VanDerWaalsContact CB-OH 3.28Å; Y377-Y431 WeakPolarHBondContact CB-OH 3.46Å; L415-Y431 HydrophobicContact CD1-CE1 4.11Å; L415-Y431 HydrophobicContact CD2-CD1 3.85Å; L415-Y431 HydrophobicContact CD2-CE1 3.75Å; Y428-Y431 WeakPolarHBondContact O-CB 3.38Å; Y428-Y431 PolarHBondContact O-N 3.12Å; Q429-Y431 VanDerWaalsContact C-N 3.27Å; Q429-Y431 PolarHBondContact O-N 3.43Å; Y431-D433 VanDerWaalsContact C-N 3.33Å; Y431-L434 HydrophobicContact CD2-CD1 3.68Å; Y431-L434 HydrophobicContact CE2-CD1 4.1Å; Y431-L434 WeakPolarHBondContact O-CB 3.44Å; Y431-L434 PolarHBondContact O-N 3.38Å; Y431-R435 PolarHBondContact OH-NH2 3.49Å
432	L	96.7	Very high	93.6	Very high	0 Å²	0	58.8 Å²	58.8	0%	0	33%	0.329	C	S	.	.	H	α-helix	trans	-64.2	-35.1	168	-78.6	172	0	0	0	112.5	Y412 L415 E416 L419 T425 Y428 Q429 L434 R435 R436	Y412-L432 HydrophobicContact CD2-CD2 4.24Å; Y412-L432 HydrophobicContact CE2-CB 3.89Å; Y412-L432 HydrophobicContact CE2-CD2 3.98Å; Y412-L432 HydrophobicContact CE2-CG 4.39Å; L415-L432 HydrophobicContact CB-CD2 4.13Å; L415-L432 HydrophobicContact CD2-CD2 4.01Å; L415-L432 HydrophobicContact CG-CD2 3.88Å; E416-L432 HydrophobicContact CB-CD1 4.48Å; E416-L432 HydrophobicContact CB-CD2 3.94Å; E416-L432 HydrophobicContact CG-CD1 4.49Å; L419-L432 HydrophobicContact CD1-CD1 4.01Å; L419-L432 HydrophobicContact CD1-CD2 4.03Å; L419-L432 HydrophobicContact CD1-CG 3.77Å; T425-L432 HydrophobicContact CG2-CD1 4.02Å; Y428-L432 PolarHBondContact O-N 3.47Å; Q429-L432 WeakPolarHBondContact O-CB 3.41Å; Q429-L432 PolarHBondContact O-N 2.92Å; L432-L434 PolarHBondContact O-N 3.48Å; L432-R435 WeakPolarHBondContact O-CA 3.28Å; L432-R435 WeakPolarHBondContact O-CB 3.25Å; L432-R435 PolarHBondContact O-N 2.89Å; L432-R436 PolarHBondContact O-N 3.48Å
433	D	97.3	Very high	94.2	Very high	48 Å²	48	55 Å²	55	26%	0.257	30%	0.303	S	S	.	.	H	α-helix	trans	-62.7	-30.7	176.8	-73	-21.5	0	0	0	112.5	Q429 W430 Y431 R435 R436 F437	Q429-D433 PolarHBondContact O-N 3.33Å; W430-D433 WeakPolarHBondContact O-CB 3.48Å; W430-D433 PolarHBondContact O-N 2.77Å; Y431-D433 VanDerWaalsContact C-N 3.33Å; D433-R435 PolarHBondContact O-N 3.13Å; D433-R435 VanDerWaalsContact O-N 3.15Å; D433-R436 PolarHBondContact O-N 3.37Å; D433-R436 WeakPolarHBondContact OD1-CD 3.36Å; D433-R436 IonicContact OD1-CZ 3.65Å; D433-R436 IonicContact OD1-NE 3.73Å; D433-R436 IonicContact OD1-NH1 2.64Å; D433-R436 PolarHBondContact OD1-NH1 3.26Å; D433-F437 HydrophobicContact CB-CD2 4.03Å; D433-F437 HydrophobicContact CB-CE2 3.95Å; D433-F437 WeakPolarHBondContact O-CD2 3.33Å; D433-F437 PolarHBondContact O-N 3.18Å; D433-F437 VanDerWaalsContact O-N 3.1Å
434	L	97.4	Very high	94.7	Very high	50 Å²	50	51.9 Å²	51.9	26%	0.262	27%	0.271	S	S	.	.	H	α-helix	trans	-57	-29.1	171.5	-55.3	-179.1	0	0	0	111.9	E226 V227 W430 Y431 L432	E226-L434 HydrophobicContact CB-CD1 4.45Å; V227-L434 HydrophobicContact CG2-CD1 4Å; V227-L434 HydrophobicContact CG2-CD2 4.23Å; W430-L434 HydrophobicContact CZ3-CD1 4.39Å; Y431-L434 HydrophobicContact CD2-CD1 3.68Å; Y431-L434 HydrophobicContact CE2-CD1 4.1Å; Y431-L434 WeakPolarHBondContact O-CB 3.44Å; Y431-L434 PolarHBondContact O-N 3.38Å; L432-L434 PolarHBondContact O-N 3.48Å
435	R	97.7	Very high	95.2	Very high	14 Å²	14	49.4 Å²	49.4	5%	0.053	26%	0.258	C	S	.	.	H	α-helix	trans	-89.4	-12.1	178.2	-77.5	66.6	177.3	161.8	4.2	113.1	E226 E409 E410 Y412 L415 Y431 L432 D433 S439 H442	E226-R435 IonicContact OE2-CZ 3.73Å; E226-R435 IonicContact OE2-NH1 3.77Å; E226-R435 PolarHBondContact OE2-NH1 3.25Å; E226-R435 IonicContact OE2-NH2 2.75Å; E226-R435 PolarHBondContact OE2-NH2 3.34Å; E409-R435 PolarHBondContact O-NE 3.34Å; E409-R435 PolarHBondContact O-NH2 3.18Å; E410-R435 WeakPolarHBondContact O-CG 3.28Å; Y412-R435 HydrophobicContact CD2-CB 4.31Å; L415-R435 HydrophobicContact CD2-CG 4.2Å; Y431-R435 PolarHBondContact OH-NH2 3.49Å; L432-R435 WeakPolarHBondContact O-CA 3.28Å; L432-R435 WeakPolarHBondContact O-CB 3.25Å; L432-R435 PolarHBondContact O-N 2.89Å; D433-R435 PolarHBondContact O-N 3.13Å; D433-R435 VanDerWaalsContact O-N 3.15Å; R435-S439 WeakPolarHBondContact O-CB 3.49Å; R435-H442 PolarHBondContact NH2-CE1 2.96Å; R435-H442 PolarHBondContact NH2-NE2 3.47Å
436	R	96.3	Very high	95.7	Very high	115 Å²	115	48.3 Å²	48.3	43%	0.434	25%	0.253	S	S	.	.	H	α-helix	trans	-89.9	-40.4	177.7	-66.1	-179.8	178	157.9	-4.8	112.5	Y412 L432 D433 G438	Y412-R436 HydrophobicContact CD2-CG 3.46Å; Y412-R436 VanDerWaalsContact CD2-CG 3.46Å; Y412-R436 HydrophobicContact CE2-CG 3.55Å; Y412-R436 HydrophobicContact CG-CG 4.43Å; Y412-R436 PolarHBondContact OH-NH2 3.11Å; L432-R436 PolarHBondContact O-N 3.48Å; D433-R436 PolarHBondContact O-N 3.37Å; D433-R436 WeakPolarHBondContact OD1-CD 3.36Å; D433-R436 IonicContact OD1-CZ 3.65Å; D433-R436 IonicContact OD1-NE 3.73Å; D433-R436 IonicContact OD1-NH1 2.64Å; D433-R436 PolarHBondContact OD1-NH1 3.26Å; R436-G438 PolarHBondContact O-N 2.92Å
437	F	95.8	Very high	96.2	Very high	164 Å²	164	39.6 Å²	39.6	72%	0.719	21%	0.212	S	C	*	.	S	Bend	trans	-106.3	70.7	-168.5	-56.1	-63.1	0	0	0	112	D433	D433-F437 HydrophobicContact CB-CD2 4.03Å; D433-F437 HydrophobicContact CB-CE2 3.95Å; D433-F437 WeakPolarHBondContact O-CD2 3.33Å; D433-F437 PolarHBondContact O-N 3.18Å; D433-F437 VanDerWaalsContact O-N 3.1Å
438	G	94.3	Very high	96.7	Very high	67 Å²	67	36.3 Å²	36.3	69%	0.691	20%	0.195	S	C	*	.	S	Bend	trans	85.4	41.3	176.5	0	0	0	0	0	114.1	R436	R436-G438 PolarHBondContact O-N 2.92Å
439	S	96.6	Very high	97	Very high	43 Å²	43	36.1 Å²	36.1	30%	0.301	19%	0.194	S	C	.	.			trans	-55.7	146.3	175.4	-161.1	0	0	0	0	112.2	E410 R435	E410-S439 PolarHBondContact O-OG 3.44Å; R435-S439 WeakPolarHBondContact O-CB 3.49Å
440	V	97	Very high	97.2	Very high	29 Å²	29	33.1 Å²	33.1	18%	0.176	18%	0.18	C	C	.	.			trans	-137	152.1	175.3	-61.8	0	0	0	0	109.5	F265 E410 H442	F265-V440 HydrophobicContact CD1-CB 4.22Å; F265-V440 HydrophobicContact CD1-CG1 4.11Å; F265-V440 HydrophobicContact CE1-CB 4.1Å; F265-V440 HydrophobicContact CE1-CG1 3.49Å; F265-V440 VanDerWaalsContact CE1-CG1 3.49Å; F265-V440 HydrophobicContact CZ-CG1 3.84Å; E410-V440 WeakPolarHBondContact CB-O 3.46Å; V440-H442 PolarHBondContact O-N 3.06Å; V440-H442 PolarHBondContact O-ND1 3.16Å
441	P	97.6	Very high	97.4	Very high	38 Å²	38	31.2 Å²	31.2	25%	0.247	17%	0.173	C	C	.	.			trans	-56.5	127.5	163.8	-24.6	36.2	0	0	0	109.5	F265 V266 N267 E410	F265-P441 CarbonylContact C-O 3.59Å; F265-P441 WeakPolarHBondContact CA-O 3.25Å; F265-P441 PolarHBondContact N-O 3.49Å; V266-P441 PolarHBondContact N-O 3.48Å; V266-P441 CarbonylContact O-C 3.6Å; V266-P441 WeakPolarHBondContact O-CB 3.29Å; N267-P441 WeakPolarHBondContact OD1-CB 3.39Å; N267-P441 WeakPolarHBondContact OD1-CG 3.24Å; E410-P441 HydrophobicContact CG-CG 4.5Å
442	H	98.4	Very high	97.6	Very high	10 Å²	10	31.2 Å²	31.2	5%	0.046	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150	162.2	-178.7	60.9	-71.8	0	0	0	109.9	E226 E262 I263 R408 R435 V440	E226-H442 IonicContact OE2-NE2 2.66Å; E226-H442 PolarHBondContact OE2-NE2 3.4Å; E262-H442 IonicContact OE1-CD2 3.14Å; E262-H442 PolarHBondContact OE1-CD2 3.14Å; I263-H442 VanDerWaalsContact O-CA 3.26Å; I263-H442 WeakPolarHBondContact O-CA 3.43Å; I263-H442 VanDerWaalsContact O-CB 3.25Å; I263-H442 WeakPolarHBondContact O-CB 3.27Å; R408-H442 VanDerWaalsContact CB-NE2 3.32Å; R408-H442 WeakPolarHBondContact CB-NE2 3.45Å; R408-H442 WeakPolarHBondContact CG-CD2 3.48Å; R408-H442 WeakPolarHBondContact CG-NE2 3.36Å; R408-H442 PolarHBondContact N-O 3.49Å; R435-H442 PolarHBondContact NH2-CE1 2.96Å; R435-H442 PolarHBondContact NH2-NE2 3.47Å; V440-H442 PolarHBondContact O-N 3.06Å; V440-H442 PolarHBondContact O-ND1 3.16Å
443	G	98.4	Very high	97.7	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-160.2	167.4	179.2	0	0	0	0	0	111.5	I263 G406	I263-G443 PolarHBondContact N-O 3.29Å; I263-G443 PolarHBondContact O-N 3.02Å; G406-G443 VanDerWaalsContact O-CA 3.26Å; G406-G443 WeakPolarHBondContact O-CA 3.48Å
444	G	98.4	Very high	97.6	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-162.4	179.7	-178.9	0	0	0	0	0	112.7	A261 E262 G405 G406 R408	A261-G444 CarbonylContact O-C 3.57Å; A261-G444 WeakPolarHBondContact O-CA 3.31Å; E262-G444 WeakPolarHBondContact OE2-CA 3.33Å; G405-G444 CarbonylContact C-O 3.43Å; G405-G444 WeakPolarHBondContact CA-O 3.44Å; G406-G444 PolarHBondContact N-O 3.44Å; G406-G444 PolarHBondContact O-N 3.19Å; R408-G444 VanDerWaalsContact NH2-C 3.26Å; R408-G444 VanDerWaalsContact NH2-CA 3.28Å; R408-G444 PolarHBondContact NH2-O 3.27Å
445	F	98.7	Very high	97.6	Very high	4 Å²	4	27 Å²	27	2%	0.018	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.8	158.5	-178	59.3	-97	0	0	0	110.8	F170 E260 A261 V275 I276 L279 F403 G404	F170-F445 HydrophobicContact CZ-CE2 4.5Å; F170-F445 HydrophobicContact CZ-CZ 4.38Å; E260-F445 CarbonylContact C-O 3.49Å; E260-F445 VanDerWaalsContact CA-O 3.25Å; E260-F445 WeakPolarHBondContact CA-O 3.37Å; A261-F445 HydrophobicContact CB-CE1 4Å; A261-F445 HydrophobicContact CB-CE2 4.03Å; A261-F445 HydrophobicContact CB-CZ 3.7Å; A261-F445 PolarHBondContact N-O 3.04Å; A261-F445 PolarHBondContact O-N 2.83Å; V275-F445 HydrophobicContact CB-CE1 4.23Å; V275-F445 HydrophobicContact CG1-CE1 3.77Å; V275-F445 HydrophobicContact CG1-CZ 3.92Å; I276-F445 HydrophobicContact CD1-CB 3.88Å; I276-F445 HydrophobicContact CD1-CD1 3.99Å; I276-F445 HydrophobicContact CD1-CG 3.94Å; I276-F445 HydrophobicContact CG1-CB 4.16Å; I276-F445 HydrophobicContact CG1-CD1 3.55Å; I276-F445 HydrophobicContact CG1-CD2 4.05Å; I276-F445 HydrophobicContact CG1-CE1 3.87Å; I276-F445 HydrophobicContact CG1-CE2 4.34Å; I276-F445 HydrophobicContact CG1-CG 3.64Å; I276-F445 HydrophobicContact CG1-CZ 4.25Å; L279-F445 HydrophobicContact CD2-CE2 3.7Å; L279-F445 HydrophobicContact CD2-CZ 4.02Å; F403-F445 AromaticContact CD1-CD2 3.74Å; F403-F445 HydrophobicContact CD1-CD2 3.74Å; F403-F445 HydrophobicContact CD1-CE2 4.21Å; F403-F445 HydrophobicContact CD1-CG 4.47Å; F403-F445 HydrophobicContact CE1-CD2 4.01Å; F403-F445 AromaticContact CE1-CE2 4Å; F403-F445 HydrophobicContact CE1-CE2 4Å; G404-F445 CarbonylContact O-C 3.58Å; G404-F445 VanDerWaalsContact O-CA 3.31Å; G404-F445 WeakPolarHBondContact O-CA 3.45Å
446	G	98.5	Very high	97.6	Very high	11 Å²	11	26.4 Å²	26.4	11%	0.113	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	140.3	168.3	0	0	0	0	0	110.8	V259 F403 G404	V259-G446 CarbonylContact O-C 3.52Å; V259-G446 WeakPolarHBondContact O-CA 3.26Å; F403-G446 VanDerWaalsContact CA-O 3.3Å; F403-G446 WeakPolarHBondContact CA-O 3.3Å; G404-G446 PolarHBondContact N-O 3.33Å; G404-G446 VanDerWaalsContact N-O 3.08Å; G404-G446 PolarHBondContact O-N 3.28Å
447	M	98.7	Very high	97.6	Very high	0 Å²	0	21 Å²	21	0%	0	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	123.5	172.1	-172.7	-171.9	61	0	0	109.6	I166 V259 L402 F403 F449 Y452	I166-M447 HydrophobicContact CD1-CE 3.83Å; V259-M447 HydrophobicContact CB-CB 4.34Å; V259-M447 HydrophobicContact CB-CE 4.02Å; V259-M447 HydrophobicContact CG2-CE 3.91Å; V259-M447 PolarHBondContact N-O 3.15Å; V259-M447 PolarHBondContact O-N 3.33Å; L402-M447 HydrophobicContact CD1-CG 4.17Å; L402-M447 HydrophobicContact CG-CG 4.32Å; F403-M447 HydrophobicContact CD1-CB 3.66Å; F403-M447 HydrophobicContact CD1-CG 4.04Å; F403-M447 HydrophobicContact CD2-CG 4.2Å; F403-M447 HydrophobicContact CE1-CB 3.47Å; F403-M447 VanDerWaalsContact CE1-CB 3.47Å; F403-M447 HydrophobicContact CE1-CG 3.67Å; F403-M447 HydrophobicContact CE1-SD 3.78Å; F403-M447 HydrophobicContact CE2-CB 4.5Å; F403-M447 HydrophobicContact CE2-CG 3.83Å; F403-M447 HydrophobicContact CE2-SD 3.77Å; F403-M447 HydrophobicContact CG-CB 4.28Å; F403-M447 HydrophobicContact CG-CG 4.3Å; F403-M447 HydrophobicContact CZ-CB 3.94Å; F403-M447 HydrophobicContact CZ-CG 3.56Å; F403-M447 HydrophobicContact CZ-SD 3.23Å; F403-M447 WeakPolarHBondContact CZ-SD 3.34Å; M447-F449 PolarHBondContact O-N 3.39Å; M447-Y452 HydrophobicContact CE-CG 4.19Å; M447-Y452 HydrophobicContact SD-CD2 3.97Å; M447-Y452 HydrophobicContact SD-CG 4.01Å
448	G	98.1	Very high	97.6	Very high	12 Å²	12	14.1 Å²	14.1	12%	0.124	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.9	111.3	171	0	0	0	0	0	110.6	L402 E450 R451 Y452	L402-G448 PolarHBondContact O-N 3.09Å; G448-E450 PolarHBondContact O-N 3.24Å; G448-R451 WeakPolarHBondContact O-CB 3.5Å; G448-R451 PolarHBondContact O-N 2.86Å; G448-R451 VanDerWaalsContact O-N 3.09Å; G448-Y452 PolarHBondContact O-N 2.72Å
449	F	98.7	Very high	97.6	Very high	1 Å²	1	11 Å²	11	0%	0.004	7%	0.071	C	C	.	.	H	α-helix	trans	-64.4	-39.4	-173.6	-178.4	-132.9	0	0	0	112.5	R159 A162 T163 I166 F238 Y257 M447 R451 Y452 L453	R159-F449 HydrophobicContact CG-CE1 3.64Å; R159-F449 HydrophobicContact CG-CZ 3.89Å; R159-F449 VanDerWaalsContact CZ-CE1 3.43Å; A162-F449 HydrophobicContact CB-CE2 3.84Å; A162-F449 HydrophobicContact CB-CZ 4.03Å; T163-F449 WeakPolarHBondContact OG1-CZ 3.33Å; I166-F449 HydrophobicContact CD1-CD2 3.79Å; I166-F449 HydrophobicContact CD1-CE2 3.65Å; F238-F449 HydrophobicContact CE2-CB 4.37Å; F238-F449 AromaticContact CE2-CD1 3.85Å; F238-F449 HydrophobicContact CE2-CD1 3.85Å; F238-F449 HydrophobicContact CE2-CE1 4.28Å; F238-F449 HydrophobicContact CE2-CG 4.08Å; F238-F449 HydrophobicContact CZ-CB 4.35Å; F238-F449 AromaticContact CZ-CD1 3.54Å; F238-F449 HydrophobicContact CZ-CD1 3.54Å; F238-F449 AromaticContact CZ-CD2 3.91Å; F238-F449 HydrophobicContact CZ-CD2 3.91Å; F238-F449 AromaticContact CZ-CE1 3.64Å; F238-F449 HydrophobicContact CZ-CE1 3.64Å; F238-F449 HydrophobicContact CZ-CE2 4.03Å; F238-F449 AromaticContact CZ-CG 3.68Å; F238-F449 HydrophobicContact CZ-CG 3.68Å; F238-F449 AromaticContact CZ-CZ 3.9Å; F238-F449 HydrophobicContact CZ-CZ 3.9Å; Y257-F449 VanDerWaalsContact O-CB 3.27Å; Y257-F449 WeakPolarHBondContact O-CB 3.28Å; Y257-F449 PolarHBondContact O-N 3.32Å; M447-F449 PolarHBondContact O-N 3.39Å; F449-R451 VanDerWaalsContact C-N 3.35Å; F449-R451 PolarHBondContact O-N 2.86Å; F449-Y452 HydrophobicContact CD2-CD1 4.11Å; F449-Y452 HydrophobicContact CE2-CD1 4.11Å; F449-Y452 WeakPolarHBondContact O-CB 3Å; F449-Y452 PolarHBondContact O-N 3.16Å; F449-L453 HydrophobicContact CD1-CD1 4.41Å; F449-L453 HydrophobicContact CE1-CD1 4.06Å; F449-L453 HydrophobicContact CE2-CD1 4.33Å; F449-L453 HydrophobicContact CE2-CD2 4.32Å; F449-L453 HydrophobicContact CE2-CG 4.21Å; F449-L453 HydrophobicContact CZ-CD1 4Å; F449-L453 HydrophobicContact CZ-CD2 4.41Å; F449-L453 HydrophobicContact CZ-CG 4.34Å; F449-L453 WeakPolarHBondContact O-CG 3.41Å; F449-L453 PolarHBondContact O-N 3.26Å
450	E	98.4	Very high	97.3	Very high	2 Å²	2	13.8 Å²	13.8	1%	0.009	8%	0.083	C	C	.	.	H	α-helix	trans	-65.1	-38.5	173.7	-72.2	68.4	-140.4	0	0	111.8	R159 L253 F256 Y257 G448 Y452 L453 Q454 I462 V465 I466	R159-E450 IonicContact CZ-OE1 2.8Å; R159-E450 IonicContact NH1-OE1 3.77Å; R159-E450 PolarHBondContact NH1-OE1 3Å; R159-E450 IonicContact NH2-OE1 3.04Å; R159-E450 PolarHBondContact NH2-OE1 3.34Å; L253-E450 HydrophobicContact CD1-CB 4.35Å; L253-E450 HydrophobicContact CD1-CG 3.88Å; F256-E450 WeakPolarHBondContact CB-OE2 3.27Å; Y257-E450 PolarHBondContact N-OE2 2.89Å; G448-E450 PolarHBondContact O-N 3.24Å; E450-Y452 VanDerWaalsContact C-N 3.31Å; E450-Y452 PolarHBondContact O-N 3.38Å; E450-L453 PolarHBondContact O-N 3.21Å; E450-Q454 WeakPolarHBondContact O-CG 3.45Å; E450-Q454 PolarHBondContact O-N 3.44Å; E450-I462 HydrophobicContact CB-CD1 3.75Å; E450-I462 HydrophobicContact CB-CG1 3.51Å; E450-I462 HydrophobicContact CG-CG1 4.39Å; E450-V465 HydrophobicContact CB-CG2 3.72Å; E450-V465 HydrophobicContact CG-CG2 3.98Å; E450-V465 WeakPolarHBondContact O-CG2 3.17Å; E450-I466 HydrophobicContact CG-CB 4.18Å
451	R	97.8	Very high	97.2	Very high	47 Å²	47	13.2 Å²	13.2	18%	0.177	8%	0.079	C	C	.	.	H	α-helix	trans	-64.9	-36.7	175	-72.8	-169.4	179.4	177.4	4	111.7	V399 E401 L402 G448 F449 Q454 C455 I462	V399-R451 HydrophobicContact CG1-CB 4.16Å; V399-R451 HydrophobicContact CG1-CG 4.26Å; E401-R451 VanDerWaalsContact O-CD 3.3Å; E401-R451 WeakPolarHBondContact O-CD 3.07Å; E401-R451 PolarHBondContact O-NH1 3.42Å; E401-R451 IonicContact OE2-NH1 3.64Å; L402-R451 HydrophobicContact CD1-CB 3.79Å; G448-R451 WeakPolarHBondContact O-CB 3.5Å; G448-R451 PolarHBondContact O-N 2.86Å; G448-R451 VanDerWaalsContact O-N 3.09Å; F449-R451 VanDerWaalsContact C-N 3.35Å; F449-R451 PolarHBondContact O-N 2.86Å; R451-Q454 PolarHBondContact O-N 2.93Å; R451-C455 WeakPolarHBondContact O-CB 3.22Å; R451-C455 PolarHBondContact O-N 3.06Å; R451-I462 HydrophobicContact CG-CD1 4.07Å
452	Y	98.6	Very high	97.2	Very high	0 Å²	0	11.7 Å²	11.7	0%	0	7%	0.068	C	C	.	.	H	α-helix	trans	-59.4	-48.5	172.6	169.9	-105.7	0	0	0	111.4	A162 F280 T283 T284 L402 M447 G448 F449 E450 Q454 C455 I456	A162-Y452 HydrophobicContact CB-CE1 3.98Å; F280-Y452 HydrophobicContact CD2-CD2 4.12Å; F280-Y452 HydrophobicContact CD2-CE2 4.05Å; F280-Y452 HydrophobicContact CE2-CD2 4.24Å; F280-Y452 HydrophobicContact CE2-CE2 4.2Å; T283-Y452 PolarHBondContact OG1-OH 3.45Å; T284-Y452 VanDerWaalsContact CA-OH 3.29Å; T284-Y452 WeakPolarHBondContact CA-OH 3.39Å; T284-Y452 PolarHBondContact N-OH 3.11Å; T284-Y452 VanDerWaalsContact N-OH 3.14Å; T284-Y452 WeakPolarHBondContact OG1-CE2 3.32Å; T284-Y452 PolarHBondContact OG1-OH 3.34Å; T284-Y452 VanDerWaalsContact OG1-OH 3.12Å; L402-Y452 VanDerWaalsContact CD1-N 3.27Å; M447-Y452 HydrophobicContact CE-CG 4.19Å; M447-Y452 HydrophobicContact SD-CD2 3.97Å; M447-Y452 HydrophobicContact SD-CG 4.01Å; G448-Y452 PolarHBondContact O-N 2.72Å; F449-Y452 HydrophobicContact CD2-CD1 4.11Å; F449-Y452 HydrophobicContact CE2-CD1 4.11Å; F449-Y452 WeakPolarHBondContact O-CB 3Å; F449-Y452 PolarHBondContact O-N 3.16Å; E450-Y452 VanDerWaalsContact C-N 3.31Å; E450-Y452 PolarHBondContact O-N 3.38Å; Y452-Q454 PolarHBondContact O-N 3.21Å; Y452-C455 WeakPolarHBondContact O-CB 3.47Å; Y452-C455 PolarHBondContact O-N 3.28Å; Y452-C455 VanDerWaalsContact O-N 3.15Å; Y452-I456 HydrophobicContact CD2-CG2 4.18Å; Y452-I456 HydrophobicContact CE1-CD1 3.81Å; Y452-I456 HydrophobicContact CE2-CG2 3.68Å; Y452-I456 PolarHBondContact O-N 3.32Å
453	L	98.4	Very high	97	Very high	0 Å²	0	11.8 Å²	11.8	0%	0	7%	0.069	C	C	.	.	H	α-helix	trans	-63.4	-39.7	176.4	-65.5	171.4	0	0	0	112.4	I158 R159 A162 F449 E450 C455 I456 L457 V465	I158-L453 HydrophobicContact CG2-CD2 4.35Å; R159-L453 HydrophobicContact CB-CD1 3.92Å; R159-L453 HydrophobicContact CG-CD1 3.79Å; A162-L453 HydrophobicContact CB-CD2 3.95Å; F449-L453 HydrophobicContact CD1-CD1 4.41Å; F449-L453 HydrophobicContact CE1-CD1 4.06Å; F449-L453 HydrophobicContact CE2-CD1 4.33Å; F449-L453 HydrophobicContact CE2-CD2 4.32Å; F449-L453 HydrophobicContact CE2-CG 4.21Å; F449-L453 HydrophobicContact CZ-CD1 4Å; F449-L453 HydrophobicContact CZ-CD2 4.41Å; F449-L453 HydrophobicContact CZ-CG 4.34Å; F449-L453 WeakPolarHBondContact O-CG 3.41Å; F449-L453 PolarHBondContact O-N 3.26Å; E450-L453 PolarHBondContact O-N 3.21Å; L453-C455 VanDerWaalsContact C-N 3.3Å; L453-C455 PolarHBondContact O-N 3.19Å; L453-I456 HydrophobicContact CD2-CD1 4.37Å; L453-L457 VanDerWaalsContact O-CB 3.27Å; L453-L457 WeakPolarHBondContact O-CB 3.45Å; L453-L457 VanDerWaalsContact O-CG 3.29Å; L453-L457 WeakPolarHBondContact O-CG 3.41Å; L453-L457 PolarHBondContact O-N 3.08Å; L453-L457 VanDerWaalsContact O-N 3.11Å; L453-V465 HydrophobicContact CB-CB 3.86Å; L453-V465 HydrophobicContact CB-CG1 3.99Å; L453-V465 HydrophobicContact CB-CG2 4.29Å; L453-V465 HydrophobicContact CD1-CB 4.23Å
454	Q	96.4	Very high	96.9	Very high	8 Å²	8	11.9 Å²	11.9	4%	0.037	7%	0.069	C	C	.	.	H	α-helix	trans	-59.2	-43.1	173	-73.3	-165.5	-77.3	0	0	111.6	V399 E450 R451 Y452 G458 V459 D460 N461 I462 V465	V399-Q454 HydrophobicContact CG2-CB 4.28Å; E450-Q454 WeakPolarHBondContact O-CG 3.45Å; E450-Q454 PolarHBondContact O-N 3.44Å; R451-Q454 PolarHBondContact O-N 2.93Å; Y452-Q454 PolarHBondContact O-N 3.21Å; Q454-G458 VanDerWaalsContact O-CA 3.26Å; Q454-G458 WeakPolarHBondContact O-CA 3.47Å; Q454-G458 PolarHBondContact O-N 3.41Å; Q454-V459 WeakPolarHBondContact CG-O 3.33Å; Q454-V459 PolarHBondContact NE2-O 2.89Å; Q454-V459 PolarHBondContact O-N 2.85Å; Q454-D460 PolarHBondContact NE2-O 3.05Å; Q454-D460 VanDerWaalsContact NE2-O 3.15Å; Q454-N461 VanDerWaalsContact NE2-C 3.3Å; Q454-I462 VanDerWaalsContact CD-CA 3.46Å; Q454-I462 HydrophobicContact CG-CB 4.38Å; Q454-I462 HydrophobicContact CG-CG1 4.32Å; Q454-V465 HydrophobicContact CG-CG1 4.2Å; Q454-V465 HydrophobicContact CG-CG2 4.04Å
455	C	96.8	Very high	96.8	Very high	1 Å²	1	11.9 Å²	11.9	1%	0.007	7%	0.069	C	C	.	.	H	α-helix	trans	-62.4	-54.3	179.8	-178.8	0	0	0	0	111.7	Q306 V396 V399 R451 Y452 L453 L457	Q306-C455 PolarHBondContact NE2-O 2.93Å; V396-C455 HydrophobicContact CG2-CB 4.15Å; V399-C455 HydrophobicContact CG2-CB 3.92Å; R451-C455 WeakPolarHBondContact O-CB 3.22Å; R451-C455 PolarHBondContact O-N 3.06Å; Y452-C455 WeakPolarHBondContact O-CB 3.47Å; Y452-C455 PolarHBondContact O-N 3.28Å; Y452-C455 VanDerWaalsContact O-N 3.15Å; L453-C455 VanDerWaalsContact C-N 3.3Å; L453-C455 PolarHBondContact O-N 3.19Å; C455-L457 VanDerWaalsContact C-N 3.31Å; C455-L457 PolarHBondContact O-N 3.42Å
456	I	97.6	Very high	96.8	Very high	3 Å²	3	12.1 Å²	12.1	2%	0.015	7%	0.07	C	C	.	.	H	α-helix	trans	-73	-25	-173.7	72.1	178	0	0	0	112.7	I158 T284 V287 H299 L310 Y452 L453	I158-I456 HydrophobicContact CG2-CD1 4.46Å; T284-I456 HydrophobicContact CG2-CB 4.47Å; T284-I456 HydrophobicContact CG2-CG2 3.9Å; V287-I456 HydrophobicContact CG1-CD1 4.03Å; H299-I456 PolarHBondContact NE2-O 3.43Å; L310-I456 HydrophobicContact CD1-CB 4.37Å; L310-I456 HydrophobicContact CD1-CG2 4.25Å; L310-I456 HydrophobicContact CD2-CB 4.37Å; Y452-I456 HydrophobicContact CD2-CG2 4.18Å; Y452-I456 HydrophobicContact CE1-CD1 3.81Å; Y452-I456 HydrophobicContact CE2-CG2 3.68Å; Y452-I456 PolarHBondContact O-N 3.32Å; L453-I456 HydrophobicContact CD2-CD1 4.37Å
457	L	96.9	Very high	96.5	Very high	0 Å²	0	13.6 Å²	13.6	0%	0	8%	0.078	C	C	.	.	H	α-helix	trans	-98.8	-15.9	-179.2	-56.4	-177.2	0	0	0	114.2	I155 I158 V295 C298 L453 C455 V459	I155-L457 HydrophobicContact CG1-CD1 4.09Å; I155-L457 HydrophobicContact CG2-CD1 4.25Å; I158-L457 HydrophobicContact CD1-CD1 4.18Å; I158-L457 HydrophobicContact CD1-CD2 3.67Å; I158-L457 HydrophobicContact CG2-CD1 4.26Å; I158-L457 HydrophobicContact CG2-CD2 4.15Å; V295-L457 HydrophobicContact CG2-CD2 4.36Å; C298-L457 HydrophobicContact CB-CD2 4.36Å; L453-L457 VanDerWaalsContact O-CB 3.27Å; L453-L457 WeakPolarHBondContact O-CB 3.45Å; L453-L457 VanDerWaalsContact O-CG 3.29Å; L453-L457 WeakPolarHBondContact O-CG 3.41Å; L453-L457 PolarHBondContact O-N 3.08Å; L453-L457 VanDerWaalsContact O-N 3.11Å; C455-L457 VanDerWaalsContact C-N 3.31Å; C455-L457 PolarHBondContact O-N 3.42Å; L457-V459 HydrophobicContact CB-CG2 3.73Å; L457-V459 HydrophobicContact CD1-CG2 4.47Å; L457-V459 PolarHBondContact O-N 3.02Å
458	G	94.7	Very high	96.4	Very high	20 Å²	20	18 Å²	18	21%	0.206	10%	0.098	C	C	.	.	T	Hydrogen-bonded Turn	trans	70	20.3	-173.9	0	0	0	0	0	113.4	A303 Q454 D460	A303-G458 WeakPolarHBondContact CB-O 3.08Å; Q454-G458 VanDerWaalsContact O-CA 3.26Å; Q454-G458 WeakPolarHBondContact O-CA 3.47Å; Q454-G458 PolarHBondContact O-N 3.41Å; G458-D460 PolarHBondContact O-N 3.41Å
459	V	94.3	Very high	96.3	Very high	3 Å²	3	18.2 Å²	18.2	2%	0.018	10%	0.096	C	C	.	.			trans	-73.1	115.8	-179.2	176.5	0	0	0	0	109.4	I155 I302 Q454 L457 N461 D464 V465	I155-V459 HydrophobicContact CD1-CG2 4.08Å; I302-V459 HydrophobicContact CG2-CG2 4.16Å; Q454-V459 WeakPolarHBondContact CG-O 3.33Å; Q454-V459 PolarHBondContact NE2-O 2.89Å; Q454-V459 PolarHBondContact O-N 2.85Å; L457-V459 HydrophobicContact CB-CG2 3.73Å; L457-V459 HydrophobicContact CD1-CG2 4.47Å; L457-V459 PolarHBondContact O-N 3.02Å; V459-N461 WeakPolarHBondContact CG1-O 3.44Å; V459-N461 PolarHBondContact O-N 3.16Å; V459-D464 HydrophobicContact CG1-CB 3.76Å; V459-V465 HydrophobicContact CB-CG1 3.86Å; V459-V465 HydrophobicContact CG1-CG1 3.9Å; V459-V465 HydrophobicContact CG2-CG1 4.08Å
460	D	91.7	Very high	96.2	Very high	101 Å²	101	20.3 Å²	20.3	54%	0.54	11%	0.105	S	C	.	.	S	Bend	trans	-66.8	-31.1	-172.8	178.6	61.7	0	0	0	114.4	R250 Q454 G458	R250-D460 WeakPolarHBondContact CD-OD2 3.49Å; R250-D460 IonicContact CZ-OD2 3.41Å; R250-D460 IonicContact NE-OD2 3.76Å; R250-D460 IonicContact NH1-OD2 3.52Å; R250-D460 PolarHBondContact NH1-OD2 3.05Å; Q454-D460 PolarHBondContact NE2-O 3.05Å; Q454-D460 VanDerWaalsContact NE2-O 3.15Å; G458-D460 PolarHBondContact O-N 3.41Å
461	N	95.1	Very high	96	Very high	17 Å²	17	22.2 Å²	22.2	9%	0.091	11%	0.113	C	C	.	.			trans	-114.7	121.2	-177.7	-164.6	-35.9	0	0	0	111.9	R250 Q454 V459 K463 D464	R250-N461 HydrophobicContact CB-CB 4.47Å; Q454-N461 VanDerWaalsContact NE2-C 3.3Å; V459-N461 WeakPolarHBondContact CG1-O 3.44Å; V459-N461 PolarHBondContact O-N 3.16Å; N461-K463 PolarHBondContact O-N 3.38Å; N461-K463 VanDerWaalsContact OD1-CB 3.3Å; N461-K463 WeakPolarHBondContact OD1-CB 3.47Å; N461-K463 VanDerWaalsContact OD1-CG 3.26Å; N461-K463 WeakPolarHBondContact OD1-CG 3.32Å; N461-K463 PolarHBondContact OD1-N 3.25Å; N461-K463 VanDerWaalsContact OD1-N 3.15Å; N461-D464 WeakPolarHBondContact O-CB 3.37Å; N461-D464 PolarHBondContact O-N 3.19Å
462	I	95.8	Very high	95.8	Very high	6 Å²	6	20.9 Å²	20.9	3%	0.031	11%	0.11	C	C	.	.	G	3₁₀ helix	trans	-59	-24.6	-176.2	-159.4	168.7	0	0	0	112.6	R250 R251 L253 E450 R451 Q454 D464 V465	R250-I462 WeakPolarHBondContact O-CB 3.4Å; R250-I462 WeakPolarHBondContact O-CG2 3.19Å; R250-I462 PolarHBondContact O-N 3.42Å; R251-I462 WeakPolarHBondContact O-CD1 3.31Å; L253-I462 HydrophobicContact CD1-CD1 4.26Å; L253-I462 HydrophobicContact CD1-CG1 4.03Å; L253-I462 HydrophobicContact CD1-CG2 4.33Å; L253-I462 HydrophobicContact CD2-CG2 4.02Å; L253-I462 HydrophobicContact CG-CD1 4.39Å; L253-I462 HydrophobicContact CG-CG1 4.33Å; L253-I462 HydrophobicContact CG-CG2 3.79Å; E450-I462 HydrophobicContact CB-CD1 3.75Å; E450-I462 HydrophobicContact CB-CG1 3.51Å; E450-I462 HydrophobicContact CG-CG1 4.39Å; R451-I462 HydrophobicContact CG-CD1 4.07Å; Q454-I462 VanDerWaalsContact CD-CA 3.46Å; Q454-I462 HydrophobicContact CG-CB 4.38Å; Q454-I462 HydrophobicContact CG-CG1 4.32Å; I462-D464 PolarHBondContact O-N 3.32Å; I462-D464 VanDerWaalsContact O-N 3.12Å; I462-V465 HydrophobicContact CG1-CG2 4.22Å; I462-V465 WeakPolarHBondContact O-CG2 3.26Å; I462-V465 PolarHBondContact O-N 3.29Å
463	K	95.7	Very high	95.4	Very high	11 Å²	11	28.5 Å²	28.5	5%	0.048	15%	0.146	C	C	.	.	G	3₁₀ helix	trans	-68.2	-8.1	177.5	-59.2	176	178.7	84.3	0	113.6	R146 Q248 S249 L253 N461 P469 F471	R146-K463 PolarHBondContact NH1-O 3.41Å; Q248-K463 PolarHBondContact O-NZ 3.09Å; S249-K463 PolarHBondContact O-NZ 3.08Å; L253-K463 HydrophobicContact CD2-CG 3.98Å; N461-K463 PolarHBondContact O-N 3.38Å; N461-K463 VanDerWaalsContact OD1-CB 3.3Å; N461-K463 WeakPolarHBondContact OD1-CB 3.47Å; N461-K463 VanDerWaalsContact OD1-CG 3.26Å; N461-K463 WeakPolarHBondContact OD1-CG 3.32Å; N461-K463 PolarHBondContact OD1-N 3.25Å; N461-K463 VanDerWaalsContact OD1-N 3.15Å; K463-P469 HydrophobicContact CB-CB 3.93Å; K463-P469 HydrophobicContact CB-CG 3.96Å; K463-P469 HydrophobicContact CG-CB 4.06Å; K463-P469 HydrophobicContact CG-CG 4.46Å; K463-F471 HydrophobicContact CD-CD1 3.79Å; K463-F471 HydrophobicContact CD-CE1 3.73Å; K463-F471 HydrophobicContact CD-CG 4.26Å; K463-F471 HydrophobicContact CD-CZ 4.13Å; K463-F471 HydrophobicContact CG-CD1 4.29Å; K463-F471 HydrophobicContact CG-CE1 4.5Å
464	D	96.2	Very high	95	Very high	3 Å²	3	29.4 Å²	29.4	2%	0.016	15%	0.152	C	C	.	.	G	3₁₀ helix	trans	-102.4	-8.4	-179.1	-58.7	-32.3	0	0	0	113.1	L136 R140 R146 L152 V459 N461 I462	L136-D464 WeakPolarHBondContact CB-OD2 3.17Å; L136-D464 HydrophobicContact CD1-CB 4.28Å; L136-D464 VanDerWaalsContact CD1-OD2 3.31Å; L136-D464 WeakPolarHBondContact CD1-OD2 3.34Å; R140-D464 IonicContact CZ-OD1 3.46Å; R140-D464 IonicContact CZ-OD2 3.45Å; R140-D464 IonicContact NH1-OD1 3.58Å; R140-D464 PolarHBondContact NH1-OD1 2.66Å; R140-D464 IonicContact NH1-OD2 3.98Å; R140-D464 PolarHBondContact NH1-OD2 3.12Å; R146-D464 IonicContact CZ-OD1 2.87Å; R146-D464 IonicContact NH1-OD1 3.41Å; R146-D464 IonicContact NH2-OD1 3.52Å; R146-D464 PolarHBondContact NH2-OD1 3.32Å; L152-D464 WeakPolarHBondContact CD1-O 3.33Å; V459-D464 HydrophobicContact CG1-CB 3.76Å; N461-D464 WeakPolarHBondContact O-CB 3.37Å; N461-D464 PolarHBondContact O-N 3.19Å; I462-D464 PolarHBondContact O-N 3.32Å; I462-D464 VanDerWaalsContact O-N 3.12Å
465	V	96.8	Very high	94.8	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	18%	0.181	C	C	.	.	S	Bend	trans	-101.9	2	176.9	-61.4	0	0	0	0	114.1	I155 R159 E450 L453 Q454 V459 I462	I155-V465 HydrophobicContact CG2-CB 4.39Å; I155-V465 HydrophobicContact CG2-CG1 4.33Å; R159-V465 PolarHBondContact NH1-O 2.92Å; R159-V465 VanDerWaalsContact NH1-O 3.15Å; E450-V465 HydrophobicContact CB-CG2 3.72Å; E450-V465 HydrophobicContact CG-CG2 3.98Å; E450-V465 WeakPolarHBondContact O-CG2 3.17Å; L453-V465 HydrophobicContact CB-CB 3.86Å; L453-V465 HydrophobicContact CB-CG1 3.99Å; L453-V465 HydrophobicContact CB-CG2 4.29Å; L453-V465 HydrophobicContact CD1-CB 4.23Å; Q454-V465 HydrophobicContact CG-CG1 4.2Å; Q454-V465 HydrophobicContact CG-CG2 4.04Å; V459-V465 HydrophobicContact CB-CG1 3.86Å; V459-V465 HydrophobicContact CG1-CG1 3.9Å; V459-V465 HydrophobicContact CG2-CG1 4.08Å; I462-V465 HydrophobicContact CG1-CG2 4.22Å; I462-V465 WeakPolarHBondContact O-CG2 3.26Å; I462-V465 PolarHBondContact O-N 3.29Å
466	I	96.7	Very high	94.3	Very high	8 Å²	8	39.1 Å²	39.1	4%	0.041	21%	0.21	C	C	.	.	S	Bend	trans	-123.8	141.4	171.8	-168.3	169.4	0	0	0	108.8	L253 E450 F468 P469	L253-I466 HydrophobicContact CD1-CG2 4.04Å; E450-I466 HydrophobicContact CG-CB 4.18Å; I466-F468 VanDerWaalsContact C-N 3.27Å; I466-F468 PolarHBondContact O-N 3.24Å; I466-P469 HydrophobicContact CG2-CB 3.66Å; I466-P469 HydrophobicContact CG2-CG 4.44Å
467	P	93.9	Very high	92.7	Very high	43 Å²	43	45.4 Å²	45.4	28%	0.279	24%	0.243	S	C	.	.	S	Bend	trans	-57	-43.4	-178.4	-20.2	24.5	0	0	0	112.9	L156	L156-P467 HydrophobicContact CD2-CB 4.26Å; L156-P467 HydrophobicContact CD2-CG 3.58Å
468	F	96.1	Very high	92.5	Very high	93 Å²	93	47.7 Å²	47.7	41%	0.408	26%	0.255	S	S	.	.	S	Bend	trans	-138.5	73.3	-162.2	-62.7	-39.6	0	0	0	110	P143 I466 L477	P143-F468 HydrophobicContact CB-CD1 4.12Å; P143-F468 HydrophobicContact CB-CE1 4.25Å; I466-F468 VanDerWaalsContact C-N 3.27Å; I466-F468 PolarHBondContact O-N 3.24Å; F468-L477 HydrophobicContact CB-CD1 3.27Å; F468-L477 HydrophobicContact CD1-CD1 2.96Å; F468-L477 HydrophobicContact CD1-CD2 3.94Å; F468-L477 HydrophobicContact CD1-CG 4.02Å; F468-L477 HydrophobicContact CD2-CD1 3.91Å; F468-L477 HydrophobicContact CE1-CD1 3.59Å; F468-L477 HydrophobicContact CE1-CD2 3.62Å; F468-L477 HydrophobicContact CE1-CG 4.23Å; F468-L477 HydrophobicContact CE2-CD1 4.45Å; F468-L477 HydrophobicContact CG-CD1 3.1Å; F468-L477 HydrophobicContact CG-CG 4.4Å; F468-L477 HydrophobicContact CZ-CD1 4.3Å; F468-L477 HydrophobicContact CZ-CD2 4.08Å
469	P	95.7	Very high	92.4	Very high	15 Å²	15	49.2 Å²	49.2	10%	0.097	26%	0.258	C	S	.	.			trans	-64	141.4	-173.2	27.1	-35.3	0	0	0	111.6	L253 K463 I466 F471	L253-P469 HydrophobicContact CD2-CB 3.72Å; K463-P469 HydrophobicContact CB-CB 3.93Å; K463-P469 HydrophobicContact CB-CG 3.96Å; K463-P469 HydrophobicContact CG-CB 4.06Å; K463-P469 HydrophobicContact CG-CG 4.46Å; I466-P469 HydrophobicContact CG2-CB 3.66Å; I466-P469 HydrophobicContact CG2-CG 4.44Å; P469-F471 HydrophobicContact CB-CD1 4.26Å; P469-F471 HydrophobicContact CG-CE1 4.42Å
470	R	96.1	Very high	92.3	Very high	46 Å²	46	51.7 Å²	51.7	17%	0.174	27%	0.271	C	S	.	.	B	Isolated β-bridge	trans	-108.3	131.2	166.1	-58.2	-64.7	176	-120.9	15.4	108.8	L253 A254 E255 L476	L253-R470 CarbonylContact C-O 3.54Å; L253-R470 WeakPolarHBondContact CA-O 3.27Å; A254-R470 HydrophobicContact CB-CB 4.33Å; A254-R470 PolarHBondContact N-O 2.91Å; E255-R470 HydrophobicContact CB-CB 3.83Å; E255-R470 HydrophobicContact CB-CG 3.9Å; R470-L476 PolarHBondContact NH1-O 2.86Å
471	F	94.3	Very high	92.4	Very high	41 Å²	41	48.8 Å²	48.8	18%	0.18	26%	0.255	C	S	.	.	B	Isolated β-bridge	trans	-156.6	167.3	178.1	60.3	-87.7	0	0	0	109	K463 P469 H473 S474	K463-F471 HydrophobicContact CD-CD1 3.79Å; K463-F471 HydrophobicContact CD-CE1 3.73Å; K463-F471 HydrophobicContact CD-CG 4.26Å; K463-F471 HydrophobicContact CD-CZ 4.13Å; K463-F471 HydrophobicContact CG-CD1 4.29Å; K463-F471 HydrophobicContact CG-CE1 4.5Å; P469-F471 HydrophobicContact CB-CD1 4.26Å; P469-F471 HydrophobicContact CG-CE1 4.42Å; F471-H473 PolarHBondContact O-N 3.49Å; F471-S474 WeakPolarHBondContact CE1-OG 3.42Å; F471-S474 WeakPolarHBondContact CZ-OG 3.11Å; F471-S474 PolarHBondContact N-O 3.16Å; F471-S474 CarbonylContact O-C 3.52Å; F471-S474 PolarHBondContact O-N 2.9Å; F471-S474 VanDerWaalsContact O-O 3.07Å
472	P	93.3	Very high	92.2	Very high	19 Å²	19	50.8 Å²	50.8	12%	0.123	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	-51.3	132.8	-178	-29.8	36.5	0	0	0	112.5	E245 N246 S247 Q248 S474	E245-P472 VanDerWaalsContact O-CG 3.27Å; E245-P472 WeakPolarHBondContact O-CG 3.43Å; N246-P472 WeakPolarHBondContact OD1-CB 3.36Å; S247-P472 WeakPolarHBondContact O-CD 3.16Å; Q248-P472 HydrophobicContact CG-CB 4.05Å; Q248-P472 HydrophobicContact CG-CG 4.45Å; P472-S474 PolarHBondContact O-N 2.83Å
473	H	90.9	Very high	91.9	Very high	161 Å²	161	53.8 Å²	53.8	75%	0.745	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.7	14.4	-175.5	-43.4	-77.7	0	0	0	115.7	Q248 F471	Q248-H473 PolarHBondContact NE2-CD2 3.23Å; Q248-H473 VanDerWaalsContact NE2-CD2 3.28Å; F471-H473 PolarHBondContact O-N 3.49Å
474	S	91.2	Very high	91.7	Very high	18 Å²	18	56.9 Å²	56.9	13%	0.126	30%	0.298	C	S	.	.	B	Isolated β-bridge	trans	-139.3	101.7	175.3	-162.8	0	0	0	0	112.3	F471 P472	F471-S474 WeakPolarHBondContact CE1-OG 3.42Å; F471-S474 WeakPolarHBondContact CZ-OG 3.11Å; F471-S474 PolarHBondContact N-O 3.16Å; F471-S474 CarbonylContact O-C 3.52Å; F471-S474 PolarHBondContact O-N 2.9Å; F471-S474 VanDerWaalsContact O-O 3.07Å; P472-S474 PolarHBondContact O-N 2.83Å
475	C	91.7	Very high	91.3	Very high	98 Å²	98	61 Å²	61	66%	0.662	32%	0.319	S	S	*	.			trans	-118.2	40.1	165	-163.1	0	0	0	0	109.3	L477	C475-L477 PolarHBondContact O-N 3.26Å; C475-L477 VanDerWaalsContact O-N 3.08Å
476	L	85.6	Confident	90.9	Very high	115 Å²	115	66.1 Å²	66.1	60%	0.602	35%	0.346	S	S	*	.			trans	-68.3	111.2	-179.4	-68	174.4	0	0	0	108.7	R470	R470-L476 PolarHBondContact NH1-O 2.86Å
477	L	65.1	Low	90.3	Very high	136 Å²	136	71.4 Å²	71.4	71%	0.712	37%	0.374	S	S	*	.			trans	173	0	145	-87.6	140.7	0	0	0	108.7	P143 F468 C475	P143-L477 HydrophobicContact CB-CD1 4.23Å; P143-L477 HydrophobicContact CB-CD2 4.19Å; P143-L477 HydrophobicContact CB-CG 4.23Å; P143-L477 HydrophobicContact CG-CD2 4.19Å; P143-L477 HydrophobicContact CG-CG 4.18Å; F468-L477 HydrophobicContact CB-CD1 3.27Å; F468-L477 HydrophobicContact CD1-CD1 2.96Å; F468-L477 HydrophobicContact CD1-CD2 3.94Å; F468-L477 HydrophobicContact CD1-CG 4.02Å; F468-L477 HydrophobicContact CD2-CD1 3.91Å; F468-L477 HydrophobicContact CE1-CD1 3.59Å; F468-L477 HydrophobicContact CE1-CD2 3.62Å; F468-L477 HydrophobicContact CE1-CG 4.23Å; F468-L477 HydrophobicContact CE2-CD1 4.45Å; F468-L477 HydrophobicContact CG-CD1 3.1Å; F468-L477 HydrophobicContact CG-CG 4.4Å; F468-L477 HydrophobicContact CZ-CD1 4.3Å; F468-L477 HydrophobicContact CZ-CD2 4.08Å; C475-L477 PolarHBondContact O-N 3.26Å; C475-L477 VanDerWaalsContact O-N 3.08Å

Retrieved 477 of 477 residues in 136.1 ms (Link to these results)

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