A0A060W8U2_ONCMY Loading...

NADH dehydrogenase [ubiquinone] 1 alpha subcomplex subunit 9, mitochondrial

AlphaFold DB , UniProt , Accession A0A060W8U2, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene n/a, Length 380 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	40.8	Very low	30.9	Very low	241 Å²	241	137.5 Å²	137.5	100%	1.187	83%	0.834	S	S	*	*				0	78.7	0	-62.1	-162	-169.3	0	0	106.7
2	A	27.7	Very low	30.8	Very low	103 Å²	103	135.4 Å²	135.4	85%	0.851	83%	0.831	S	S	*	*				57.2	114.1	83.2	0	0	0	0	0	110.2
3	A	30	Very low	30.8	Very low	96 Å²	96	134.9 Å²	134.9	79%	0.793	83%	0.827	S	S	*	*			cis	-155.7	138.3	25	0	0	0	0	0	107.5
4	A	28.8	Very low	31.3	Very low	92 Å²	92	136.8 Å²	136.8	76%	0.76	83%	0.828	S	S	*	*			cis	54.1	112	39.6	0	0	0	0	0	114
5	V	27.2	Very low	31.5	Very low	135 Å²	135	134.7 Å²	134.7	82%	0.818	82%	0.818	S	S	*	*			trans	170.9	98.2	141	162.7	0	0	0	0	105.8
6	L	28.9	Very low	31.6	Very low	161 Å²	161	140.8 Å²	140.8	84%	0.843	82%	0.822	S	S	*	*				54.6	145.8	79.9	-96.1	162.1	0	0	0	116
7	V	29.8	Very low	31.6	Very low	125 Å²	125	144.1 Å²	144.1	76%	0.758	82%	0.824	S	S	*	*			trans	110.6	126.3	153.5	-177.7	0	0	0	0	112.5
8	S	29.2	Very low	31.8	Very low	99 Å²	99	142.4 Å²	142.4	69%	0.692	82%	0.823	S	S	*	*			cis	-171.2	154.4	-1.2	43.6	0	0	0	0	108.9
9	R	31.5	Very low	31.8	Very low	246 Å²	246	140.8 Å²	140.8	93%	0.928	82%	0.821	S	S	*	*			trans	-76.5	155.7	154.2	-78.2	179.9	164.4	179.4	-4.4	110.1
10	P	35.2	Very low	32.3	Very low	125 Å²	125	139.6 Å²	139.6	81%	0.812	82%	0.82	S	S	*	*				-132.3	159.6	117.3	35	-23.8	0	0	0	113.6
11	A	30.8	Very low	32.2	Very low	89 Å²	89	139 Å²	139	74%	0.736	82%	0.822	S	S	*	*			trans	-83.1	171.4	178.5	0	0	0	0	0	112.7
12	S	29.7	Very low	32	Very low	113 Å²	113	132.8 Å²	132.8	79%	0.79	80%	0.803	S	S	*	*			trans	72.1	125.3	174.6	74.9	0	0	0	0	113.8
13	V	30.5	Very low	32.4	Very low	129 Å²	129	133.4 Å²	133.4	78%	0.782	80%	0.798	S	S	*	*				-159.1	134.3	67.4	165.6	0	0	0	0	109.2
14	L	37.8	Very low	32.6	Very low	161 Å²	161	134.9 Å²	134.9	84%	0.843	80%	0.797	S	S	*	*			trans	-69.8	146.7	164.1	-78.3	163.2	0	0	0	109.8
15	P	34.6	Very low	33	Very low	105 Å²	105	136.4 Å²	136.4	68%	0.682	80%	0.796	S	S	*	*				-128.8	133.7	124.4	27.9	-14	0	0	0	111.8	F17	P15-F17 PolarHBondContact O-N 3.36Å
16	R	33.4	Very low	33.4	Very low	233 Å²	233	137.9 Å²	137.9	88%	0.879	80%	0.799	S	S	*	*			trans	-59.9	120.5	159.5	-74.7	175.4	170.1	171.9	-3.5	108.2
17	F	31.5	Very low	33.8	Very low	196 Å²	196	134.5 Å²	134.5	86%	0.86	79%	0.789	S	S	*	*			trans	-133.1	120.4	144	-88.6	-77	0	0	0	109.1	P15	P15-F17 PolarHBondContact O-N 3.36Å
18	S	35.2	Very low	34.2	Very low	115 Å²	115	133 Å²	133	80%	0.804	79%	0.789	S	S	*	*			trans	-66.3	125.2	173.3	48.5	0	0	0	0	110.9
19	S	31.6	Very low	34.7	Very low	112 Å²	112	135 Å²	135	78%	0.783	79%	0.791	S	S	*	*			trans	-158.1	121	149.5	55.2	0	0	0	0	109.5
20	S	42.3	Very low	35	Very low	115 Å²	115	128.1 Å²	128.1	80%	0.804	78%	0.778	S	S	*	*			trans	-50.4	125.2	174.2	51.2	0	0	0	0	113.3
21	C	29.1	Very low	34.8	Very low	128 Å²	128	130.2 Å²	130.2	87%	0.865	78%	0.782	S	S	*	*			trans	-156.5	106.3	153.2	-100.3	0	0	0	0	108.6
22	S	36.4	Very low	35.2	Very low	110 Å²	110	131.3 Å²	131.3	77%	0.769	78%	0.779	S	S	*	*			trans	-63.8	132	172.8	-44.1	0	0	0	0	110.1	V24	S22-V24 PolarHBondContact O-N 3.07Å
23	P	37.8	Very low	35.6	Very low	117 Å²	117	132 Å²	132	76%	0.76	78%	0.778	S	S	*	*			trans	-79.9	107	166.7	30.8	-27.4	0	0	0	107.8	V25	P23-V25 PolarHBondContact O-N 3.03Å
24	V	33.8	Very low	36	Very low	127 Å²	127	134.1 Å²	134.1	77%	0.77	78%	0.78	S	S	*	*			trans	-62	106.9	163.7	174.2	0	0	0	0	106.6	S22 L26	S22-V24 PolarHBondContact O-N 3.07Å; V24-L26 PolarHBondContact O-N 2.91Å
25	V	36.9	Very low	36.2	Very low	123 Å²	123	134.5 Å²	134.5	75%	0.745	78%	0.777	S	S	*	*			trans	-64.5	100.1	169.9	178.6	0	0	0	0	106.7	P23 S27	P23-V25 PolarHBondContact O-N 3.03Å; V25-S27 PolarHBondContact O-N 2.83Å
26	L	34.5	Very low	36.7	Very low	166 Å²	166	141 Å²	141	87%	0.869	79%	0.788	S	S	*	*			trans	-63.5	87.3	164.6	-91.7	151.2	0	0	0	107.3	V24 A28	V24-L26 PolarHBondContact O-N 2.91Å; L26-A28 PolarHBondContact O-N 3.25Å; L26-A28 VanDerWaalsContact O-N 3.07Å
27	S	38.3	Very low	37.9	Very low	90 Å²	90	139.5 Å²	139.5	63%	0.629	79%	0.788	S	S	*	*			trans	-61.4	109.5	165.8	54.4	0	0	0	0	107.4	V25 I29	V25-S27 PolarHBondContact O-N 2.83Å; S27-I29 VanDerWaalsContact C-N 3.32Å; S27-I29 PolarHBondContact O-N 2.96Å
28	A	38.7	Very low	40	Very low	94 Å²	94	135 Å²	135	78%	0.777	78%	0.777	S	S	*	*			trans	-62.5	99.4	168.5	0	0	0	0	0	107.1	L26 P30	L26-A28 PolarHBondContact O-N 3.25Å; L26-A28 VanDerWaalsContact O-N 3.07Å; A28-P30 VanDerWaalsContact O-CD 3.22Å; A28-P30 WeakPolarHBondContact O-CD 3.22Å
29	I	38.7	Very low	42.2	Very low	140 Å²	140	135 Å²	135	72%	0.718	76%	0.763	S	S	*	*			trans	-61	114.4	167.4	-60.7	169.7	0	0	0	105	S27 L31	S27-I29 VanDerWaalsContact C-N 3.32Å; S27-I29 PolarHBondContact O-N 2.96Å; I29-L31 PolarHBondContact O-N 2.87Å
30	P	37.3	Very low	44.8	Very low	103 Å²	103	135.2 Å²	135.2	67%	0.669	75%	0.752	S	S	*	*			trans	-61.8	120.1	166.9	26.5	-29.1	0	0	0	105.1	A28 T32	A28-P30 VanDerWaalsContact O-CD 3.22Å; A28-P30 WeakPolarHBondContact O-CD 3.22Å; P30-T32 PolarHBondContact O-N 2.74Å
31	L	32.1	Very low	46.8	Very low	168 Å²	168	132.6 Å²	132.6	88%	0.88	74%	0.738	S	S	*	*			trans	-56.7	85.3	164.5	-83.8	154.9	0	0	0	106.4	I29 V33	I29-L31 PolarHBondContact O-N 2.87Å; L31-V33 VanDerWaalsContact C-N 3.27Å; L31-V33 PolarHBondContact O-N 3.04Å
32	T	38.3	Very low	49.5	Very low	112 Å²	112	128.6 Å²	128.6	69%	0.687	71%	0.709	S	S	*	*			trans	-59.1	102.9	164.7	43.5	0	0	0	0	104.4	P30 Q34	P30-T32 PolarHBondContact O-N 2.74Å; T32-Q34 PolarHBondContact O-N 2.77Å
33	V	39.7	Very low	52	Low	127 Å²	127	127.3 Å²	127.3	77%	0.77	69%	0.692	S	S	*	*			trans	-49.6	99.5	159.4	174.8	0	0	0	0	104.5	L31 Q35	L31-V33 VanDerWaalsContact C-N 3.27Å; L31-V33 PolarHBondContact O-N 3.04Å; V33-Q35 PolarHBondContact O-N 2.67Å
34	Q	37.5	Very low	54.6	Low	174 Å²	174	126 Å²	126	81%	0.813	68%	0.684	S	S	*	*			trans	-63.2	90.5	169.6	-86.6	-176.2	-19	0	0	104.8	T32 R36	T32-Q34 PolarHBondContact O-N 2.77Å; Q34-R36 VanDerWaalsContact C-N 3.28Å; Q34-R36 PolarHBondContact O-N 3.42Å
35	Q	43.3	Very low	57.3	Low	170 Å²	170	127.3 Å²	127.3	79%	0.794	68%	0.675	S	S	*	*			trans	-54.7	105.3	159.2	-79.3	-175.4	-22	0	0	104.6	V33 K37	V33-Q35 PolarHBondContact O-N 2.67Å; Q35-K37 PolarHBondContact O-N 2.84Å
36	R	45.4	Very low	60	Low	241 Å²	241	124.8 Å²	124.8	91%	0.909	67%	0.674	S	S	*	*			trans	-50.3	108.6	171.8	-95.3	-178.9	171	175.6	-3.1	106.2	Q34 V38	Q34-R36 VanDerWaalsContact C-N 3.28Å; Q34-R36 PolarHBondContact O-N 3.42Å; R36-V38 PolarHBondContact O-N 3.22Å
37	K	58	Low	62.7	Low	201 Å²	201	127.3 Å²	127.3	87%	0.874	68%	0.678	S	S	*	*			trans	-61.8	115	178.2	-73.9	-177.9	178.1	178.6	0	106.9	Q35 H39	Q35-K37 PolarHBondContact O-N 2.84Å; K37-H39 PolarHBondContact O-N 2.84Å
38	V	74.9	Confident	65.1	Low	102 Å²	102	125.4 Å²	125.4	62%	0.618	67%	0.673	S	S	*	*			trans	-56	131.5	171	-179.8	0	0	0	0	107.4	R36 H40 V42	R36-V38 PolarHBondContact O-N 3.22Å; V38-H40 PolarHBondContact O-N 3.44Å; V38-V42 HydrophobicContact CG1-CB 3.94Å; V38-V42 HydrophobicContact CG1-CG1 3.88Å
39	H	82.6	Confident	67.7	Low	114 Å²	114	122.4 Å²	122.4	53%	0.528	65%	0.651	S	S	.	*			trans	-58.4	137.6	-177.2	-173.2	-98.7	0	0	0	110.2	K37 A41 V42	K37-H39 PolarHBondContact O-N 2.84Å; H39-A41 WeakPolarHBondContact ND1-CB 3.26Å; H39-A41 PolarHBondContact ND1-N 3.42Å; H39-A41 PolarHBondContact O-N 3.46Å; H39-V42 HydrophobicContact CB-CG2 4.12Å; H39-V42 WeakPolarHBondContact O-CB 3.12Å; H39-V42 PolarHBondContact O-N 3.05Å
40	H	85.1	Confident	70.3	Confident	117 Å²	117	120.7 Å²	120.7	54%	0.542	64%	0.635	S	S	.	*	G	3₁₀ helix	trans	-57.8	-28.3	-172.2	68	-83.3	0	0	0	113.9	V38 V42	V38-H40 PolarHBondContact O-N 3.44Å; H40-V42 VanDerWaalsContact C-N 3.32Å
41	A	83.6	Confident	73	Confident	61 Å²	61	120.1 Å²	120.1	50%	0.504	63%	0.634	S	S	.	*	G	3₁₀ helix	trans	-74.2	-21	176.8	0	0	0	0	0	113.6	H39 I43	H39-A41 WeakPolarHBondContact ND1-CB 3.26Å; H39-A41 PolarHBondContact ND1-N 3.42Å; H39-A41 PolarHBondContact O-N 3.46Å; A41-I43 VanDerWaalsContact C-N 3.31Å
42	V	87.2	Confident	75.9	Confident	43 Å²	43	113 Å²	113	26%	0.261	60%	0.598	S	S	.	*	G	3₁₀ helix	trans	-87.5	-6.6	179.9	-179.4	0	0	0	0	110.8	V38 H39 H40 G55 N126	V38-V42 HydrophobicContact CG1-CB 3.94Å; V38-V42 HydrophobicContact CG1-CG1 3.88Å; H39-V42 HydrophobicContact CB-CG2 4.12Å; H39-V42 WeakPolarHBondContact O-CB 3.12Å; H39-V42 PolarHBondContact O-N 3.05Å; H40-V42 VanDerWaalsContact C-N 3.32Å; V42-G55 WeakPolarHBondContact CG1-O 3.31Å; V42-G55 WeakPolarHBondContact O-CA 3.27Å; V42-N126 WeakPolarHBondContact CG1-ND2 3.39Å
43	I	89.4	Confident	78.5	Confident	83 Å²	83	109.4 Å²	109.4	43%	0.426	58%	0.578	S	S	.	*	S	Bend	trans	-72.5	127.6	176.9	-59.2	175.6	0	0	0	108.9	A41 R45 S53	A41-I43 VanDerWaalsContact C-N 3.31Å; I43-R45 PolarHBondContact O-N 3Å; I43-S53 PolarHBondContact O-OG 3.28Å
44	P	90.5	Very high	80.9	Confident	90 Å²	90	104.5 Å²	104.5	58%	0.584	55%	0.549	S	S	*	.			trans	-65.1	134.6	178.6	25.5	-33	0	0	0	111	S53	P44-S53 CarbonylContact C-O 3.49Å; P44-S53 WeakPolarHBondContact CA-O 3.39Å
45	R	91.8	Very high	83.4	Confident	155 Å²	155	97 Å²	97	59%	0.585	52%	0.519	S	S	*	.	B	Isolated β-bridge	trans	-135.1	149	178	-57.6	-178.2	-178	179.7	0.2	110.9	I43 S52 S53	I43-R45 PolarHBondContact O-N 3Å; R45-S52 VanDerWaalsContact O-CB 3.27Å; R45-S52 WeakPolarHBondContact O-CB 2.97Å; R45-S53 VanDerWaalsContact CB-OG 3.31Å; R45-S53 WeakPolarHBondContact CB-OG 3.32Å; R45-S53 PolarHBondContact N-O 3.07Å; R45-S53 PolarHBondContact N-OG 3.37Å; R45-S53 PolarHBondContact O-N 3.09Å
46	G	92.1	Very high	85.8	Confident	70 Å²	70	90 Å²	90	72%	0.722	49%	0.488	S	S	*	.	S	Bend	trans	89.8	-172.3	178.2	0	0	0	0	0	113.3	G48	G46-G48 VanDerWaalsContact C-N 3.29Å; G46-G48 PolarHBondContact O-N 3.35Å
47	K	92.2	Very high	88.2	Confident	218 Å²	218	79.1 Å²	79.1	95%	0.948	45%	0.449	S	S	*	.	S	Bend	trans	-87.5	9.7	-173.8	-64.2	-177.9	178	179.7	0	113.7	S52	K47-S52 PolarHBondContact N-OG 2.93Å
48	G	88.8	Confident	90	Very high	50 Å²	50	69.6 Å²	69.6	52%	0.515	41%	0.407	S	S	.	.	S	Bend	trans	78.2	32.7	-179.7	0	0	0	0	0	114.6	G46 S52	G46-G48 VanDerWaalsContact C-N 3.29Å; G46-G48 PolarHBondContact O-N 3.35Å; G48-S52 PolarHBondContact N-OG 3.05Å
49	G	92.6	Very high	91.1	Very high	31 Å²	31	64.7 Å²	64.7	32%	0.32	38%	0.378	S	S	.	.	S	Bend	trans	-103.7	-170.9	174.9	0	0	0	0	0	113.3	S51 S52 R77 M78 G79	G49-S51 VanDerWaalsContact C-N 3.34Å; G49-S51 PolarHBondContact O-N 2.87Å; G49-S52 PolarHBondContact N-OG 3.29Å; G49-S52 VanDerWaalsContact O-CB 3.26Å; G49-S52 WeakPolarHBondContact O-CB 3.48Å; G49-S52 PolarHBondContact O-N 3.22Å; G49-R77 CarbonylContact C-O 3.5Å; G49-M78 CarbonylContact O-C 3.6Å; G49-G79 PolarHBondContact O-N 3.37Å
50	R	93.7	Very high	91.8	Very high	104 Å²	104	59.3 Å²	59.3	39%	0.392	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.6	-43	-177	-179.1	-172.9	175	94.8	-14	114.1	R77 G79 P98 M99 G100 D101	R50-R77 PolarHBondContact N-O 2.6Å; R50-G79 VanDerWaalsContact O-CA 3.3Å; R50-G79 WeakPolarHBondContact O-CA 3.32Å; R50-P98 VanDerWaalsContact CZ-O 3.3Å; R50-P98 PolarHBondContact NH1-O 3.05Å; R50-P98 PolarHBondContact NH2-O 3.22Å; R50-M99 VanDerWaalsContact NH1-C 3.3Å; R50-M99 PolarHBondContact NH1-O 2.86Å; R50-G100 VanDerWaalsContact CZ-C 3.4Å; R50-G100 PolarHBondContact NH2-O 3.48Å; R50-D101 HydrophobicContact CG-CB 4.14Å
51	S	94.1	Very high	92.4	Very high	92 Å²	92	53.7 Å²	53.7	64%	0.643	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.6	12.8	-178.7	-50.5	0	0	0	0	113.2	G49 D101	G49-S51 VanDerWaalsContact C-N 3.34Å; G49-S51 PolarHBondContact O-N 2.87Å; S51-D101 WeakPolarHBondContact CA-OD2 3.18Å; S51-D101 WeakPolarHBondContact CB-OD2 3.44Å; S51-D101 PolarHBondContact OG-OD2 3.35Å
52	S	94	Very high	93	Very high	19 Å²	19	51.6 Å²	51.6	13%	0.133	31%	0.311	C	S	.	.	S	Bend	trans	-82.2	172.4	172.4	-61.2	0	0	0	0	110.1	R45 K47 G48 G49 G79	R45-S52 VanDerWaalsContact O-CB 3.27Å; R45-S52 WeakPolarHBondContact O-CB 2.97Å; K47-S52 PolarHBondContact N-OG 2.93Å; G48-S52 PolarHBondContact N-OG 3.05Å; G49-S52 PolarHBondContact N-OG 3.29Å; G49-S52 VanDerWaalsContact O-CB 3.26Å; G49-S52 WeakPolarHBondContact O-CB 3.48Å; G49-S52 PolarHBondContact O-N 3.22Å; S52-G79 CarbonylContact O-C 3.51Å; S52-G79 WeakPolarHBondContact O-CA 3.29Å; S52-G79 VanDerWaalsContact O-O 3.06Å
53	S	92.2	Very high	93.4	Very high	36 Å²	36	49.5 Å²	49.5	25%	0.252	30%	0.298	S	S	.	.	B	Isolated β-bridge	trans	-111.9	126	166.6	65.1	0	0	0	0	108.6	I43 P44 R45 G79	I43-S53 PolarHBondContact O-OG 3.28Å; P44-S53 CarbonylContact C-O 3.49Å; P44-S53 WeakPolarHBondContact CA-O 3.39Å; R45-S53 VanDerWaalsContact CB-OG 3.31Å; R45-S53 WeakPolarHBondContact CB-OG 3.32Å; R45-S53 PolarHBondContact N-O 3.07Å; R45-S53 PolarHBondContact N-OG 3.37Å; R45-S53 PolarHBondContact O-N 3.09Å; S53-G79 WeakPolarHBondContact CA-O 3.43Å
54	S	90	Very high	93.6	Very high	24 Å²	24	48 Å²	48	17%	0.168	29%	0.293	C	S	.	.			trans	-91.3	-16.8	179	68.4	0	0	0	0	113.5	V56 G79 S80	S54-V56 PolarHBondContact O-N 3.24Å; S54-V56 WeakPolarHBondContact OG-CB 3.21Å; S54-V56 PolarHBondContact OG-N 3.19Å; S54-V56 VanDerWaalsContact OG-N 3.09Å; S54-G79 PolarHBondContact N-O 3.24Å; S54-S80 WeakPolarHBondContact CB-OG 3.3Å; S54-S80 VanDerWaalsContact OG-CA 3.22Å; S54-S80 WeakPolarHBondContact OG-CA 3.14Å; S54-S80 VanDerWaalsContact OG-CB 3.29Å; S54-S80 WeakPolarHBondContact OG-CB 3.18Å; S54-S80 PolarHBondContact OG-OG 2.73Å
55	G	90.3	Very high	93.7	Very high	17 Å²	17	45.1 Å²	45.1	18%	0.175	28%	0.28	C	S	.	.	S	Bend	trans	79.3	0.1	-168.9	0	0	0	0	0	114.5	V42 N126	V42-G55 WeakPolarHBondContact CG1-O 3.31Å; V42-G55 WeakPolarHBondContact O-CA 3.27Å; G55-N126 PolarHBondContact O-ND2 3.09Å
56	V	93.6	Very high	93.9	Very high	23 Å²	23	39.7 Å²	39.7	14%	0.139	26%	0.261	C	S	.	.			trans	-92.8	114.9	177.3	-178.7	0	0	0	0	108.8	S54 A58 L75 S80 Q81 V127 I256	S54-V56 PolarHBondContact O-N 3.24Å; S54-V56 WeakPolarHBondContact OG-CB 3.21Å; S54-V56 PolarHBondContact OG-N 3.19Å; S54-V56 VanDerWaalsContact OG-N 3.09Å; V56-A58 HydrophobicContact CG1-CB 4.06Å; V56-L75 HydrophobicContact CG1-CD2 4.38Å; V56-S80 WeakPolarHBondContact O-CB 3.43Å; V56-Q81 PolarHBondContact O-N 3.35Å; V56-V127 HydrophobicContact CG1-CG2 4.17Å; V56-I256 HydrophobicContact CG1-CG2 4.14Å; V56-I256 HydrophobicContact CG2-CG2 4.18Å
57	A	94.7	Very high	94.2	Very high	12 Å²	12	37.1 Å²	37.1	10%	0.099	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	107.7	163.2	0	0	0	0	0	107.8	Q81 H124 N126 V127	A57-Q81 WeakPolarHBondContact CA-O 3.5Å; A57-H124 WeakPolarHBondContact CB-O 3.46Å; A57-N126 PolarHBondContact O-N 3.19Å; A57-V127 PolarHBondContact O-N 3.43Å; A57-V127 VanDerWaalsContact O-N 3.12Å
58	A	96.6	Very high	94.4	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	129.4	-172.5	0	0	0	0	0	112.1	V56 V60 L75 Q81 I82 V83 V127	V56-A58 HydrophobicContact CG1-CB 4.06Å; A58-V60 HydrophobicContact CB-CG2 4.45Å; A58-L75 HydrophobicContact CB-CD1 4Å; A58-Q81 PolarHBondContact N-O 3.13Å; A58-I82 CarbonylContact O-C 3.58Å; A58-I82 WeakPolarHBondContact O-CA 3.3Å; A58-V83 PolarHBondContact O-N 3.4Å; A58-V127 CarbonylContact C-O 3.18Å; A58-V127 VanDerWaalsContact CA-O 3.3Å; A58-V127 WeakPolarHBondContact CA-O 3.41Å; A58-V127 HydrophobicContact CB-CB 4.39Å
59	T	97.8	Very high	94.7	Very high	0 Å²	0	27 Å²	27	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	120.3	165.1	-56.4	0	0	0	0	109.2	F61 V83 P85 A121 L122 S125 V127 I129	T59-F61 HydrophobicContact CG2-CD2 4.18Å; T59-F61 HydrophobicContact CG2-CE2 3.73Å; T59-F61 HydrophobicContact CG2-CZ 3.93Å; T59-V83 WeakPolarHBondContact CA-O 3.46Å; T59-V83 HydrophobicContact CG2-CB 4.44Å; T59-V83 HydrophobicContact CG2-CG1 4.43Å; T59-P85 HydrophobicContact CG2-CG 3.74Å; T59-A121 HydrophobicContact CG2-CB 4.28Å; T59-A121 WeakPolarHBondContact CG2-O 3.23Å; T59-A121 PolarHBondContact OG1-O 3.01Å; T59-L122 HydrophobicContact CG2-CD2 4.12Å; T59-S125 VanDerWaalsContact OG1-CB 3.27Å; T59-S125 WeakPolarHBondContact OG1-CB 3.32Å; T59-S125 PolarHBondContact OG1-OG 2.7Å; T59-V127 PolarHBondContact N-O 3.15Å; T59-I129 PolarHBondContact O-N 3.18Å
60	V	97.8	Very high	94.9	Very high	0 Å²	0	27 Å²	27	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	93.9	-177.4	-172.5	0	0	0	0	110.4	A58 A63 V72 L75 I82 V83 P85 I129 L131	A58-V60 HydrophobicContact CB-CG2 4.45Å; V60-A63 HydrophobicContact CB-CB 4.23Å; V60-A63 HydrophobicContact CG1-CB 4Å; V60-A63 WeakPolarHBondContact O-CB 3.22Å; V60-A63 PolarHBondContact O-N 3.27Å; V60-V72 HydrophobicContact CB-CG2 4.49Å; V60-V72 HydrophobicContact CG1-CG2 4.36Å; V60-L75 HydrophobicContact CG2-CD1 4Å; V60-I82 HydrophobicContact CG2-CG2 3.94Å; V60-V83 PolarHBondContact N-O 2.92Å; V60-P85 WeakPolarHBondContact O-CD 3.2Å; V60-I129 HydrophobicContact CG1-CB 4.43Å; V60-I129 HydrophobicContact CG2-CB 4.43Å; V60-I129 HydrophobicContact CG2-CD1 4.07Å; V60-L131 HydrophobicContact CG1-CD1 3.89Å
61	F	97.4	Very high	95.1	Very high	0 Å²	0	22 Å²	22	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	135	170.6	-65	-80.4	0	0	0	110	T59 P85 W110 I118 A121 L122 V128 I129 L131 V132 I154	T59-F61 HydrophobicContact CG2-CD2 4.18Å; T59-F61 HydrophobicContact CG2-CE2 3.73Å; T59-F61 HydrophobicContact CG2-CZ 3.93Å; F61-P85 HydrophobicContact CD1-CB 3.98Å; F61-P85 HydrophobicContact CD1-CG 3.38Å; F61-P85 HydrophobicContact CE1-CB 3.86Å; F61-P85 HydrophobicContact CE1-CG 3.56Å; F61-P85 HydrophobicContact CG-CG 3.94Å; F61-P85 HydrophobicContact CZ-CG 4.24Å; F61-W110 HydrophobicContact CD1-CD2 4.21Å; F61-W110 AromaticContact CD1-CE2 3.84Å; F61-W110 HydrophobicContact CD1-CE3 4.37Å; F61-W110 AromaticContact CD1-CH2 3.86Å; F61-W110 HydrophobicContact CD1-CH2 3.86Å; F61-W110 AromaticContact CD1-CZ2 3.68Å; F61-W110 HydrophobicContact CD1-CZ2 3.68Å; F61-W110 HydrophobicContact CD1-CZ3 4.18Å; F61-W110 HydrophobicContact CE1-CD2 4.06Å; F61-W110 HydrophobicContact CE1-CE3 4.04Å; F61-W110 HydrophobicContact CE1-CH2 4.28Å; F61-W110 HydrophobicContact CE1-CZ2 4.31Å; F61-W110 HydrophobicContact CE1-CZ3 4.13Å; F61-I118 HydrophobicContact CZ-CG2 4.09Å; F61-A121 HydrophobicContact CZ-CB 4.43Å; F61-L122 HydrophobicContact CE2-CD2 4.02Å; F61-L122 HydrophobicContact CZ-CD2 4.4Å; F61-L122 HydrophobicContact CZ-CG 4.48Å; F61-V128 HydrophobicContact CD2-CG1 3.92Å; F61-V128 HydrophobicContact CE2-CG1 3.84Å; F61-I129 PolarHBondContact N-O 2.87Å; F61-L131 WeakPolarHBondContact O-CA 3.43Å; F61-L131 VanDerWaalsContact O-CB 3.26Å; F61-L131 WeakPolarHBondContact O-CB 3.47Å; F61-L131 PolarHBondContact O-N 2.64Å; F61-V132 HydrophobicContact CB-CG2 3.64Å; F61-I154 HydrophobicContact CB-CD1 4.38Å; F61-I154 HydrophobicContact CD1-CD1 4.3Å; F61-I154 HydrophobicContact CD2-CD1 3.98Å; F61-I154 HydrophobicContact CD2-CG1 4.44Å; F61-I154 HydrophobicContact CD2-CG2 4.1Å; F61-I154 HydrophobicContact CE2-CD1 4.31Å; F61-I154 HydrophobicContact CE2-CG1 4.29Å; F61-I154 HydrophobicContact CE2-CG2 3.92Å; F61-I154 HydrophobicContact CG-CD1 3.97Å; F61-I154 HydrophobicContact CZ-CG1 4.47Å
62	G	95.3	Very high	95.3	Very high	16 Å²	16	17.6 Å²	17.6	17%	0.165	11%	0.112	C	C	.	.	T	Hydrogen-bonded Turn	trans	78	19	-175.4	0	0	0	0	0	114.3	T64 G65	G62-T64 PolarHBondContact O-N 3.42Å; G62-G65 PolarHBondContact O-N 2.93Å; G62-G65 VanDerWaalsContact O-N 3.11Å
63	A	95.7	Very high	95.4	Very high	0 Å²	0	19.5 Å²	19.5	0%	0	12%	0.12	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.6	-29.9	175.7	0	0	0	0	0	114	V60 G65 G68 R69 V72 I84	V60-A63 HydrophobicContact CB-CB 4.23Å; V60-A63 HydrophobicContact CG1-CB 4Å; V60-A63 WeakPolarHBondContact O-CB 3.22Å; V60-A63 PolarHBondContact O-N 3.27Å; A63-G65 PolarHBondContact O-N 3.3Å; A63-G68 CarbonylContact O-C 3.6Å; A63-G68 VanDerWaalsContact O-C 3.28Å; A63-G68 WeakPolarHBondContact O-CA 3.38Å; A63-R69 PolarHBondContact O-N 2.97Å; A63-V72 HydrophobicContact CB-CG2 3.92Å; A63-I84 HydrophobicContact CB-CG1 4.39Å; A63-I84 HydrophobicContact CB-CG2 3.64Å
64	T	94.6	Very high	95.6	Very high	50 Å²	50	21.1 Å²	21.1	31%	0.307	12%	0.121	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.7	-13.8	179.9	53.8	0	0	0	0	113.7	G62 H86 C88 L93 Y95	G62-T64 PolarHBondContact O-N 3.42Å; T64-H86 HydrophobicContact CG2-CB 4.26Å; T64-C88 WeakPolarHBondContact CG2-SG 3.4Å; T64-L93 HydrophobicContact CG2-CD2 3.39Å; T64-L93 HydrophobicContact CG2-CG 4.46Å; T64-Y95 PolarHBondContact O-OH 3.11Å
65	G	93.5	Very high	95.9	Very high	30 Å²	30	20 Å²	20	31%	0.309	11%	0.113	S	C	.	.	S	Bend	trans	-80.8	-171.8	-176.1	0	0	0	0	0	114.9	G62 A63 R69	G62-G65 PolarHBondContact O-N 2.93Å; G62-G65 VanDerWaalsContact O-N 3.11Å; A63-G65 PolarHBondContact O-N 3.3Å; G65-R69 PolarHBondContact O-NE 3.23Å
66	F	95.6	Very high	96.1	Very high	42 Å²	42	19.2 Å²	19.2	18%	0.184	11%	0.105	C	C	.	.	H	α-helix	trans	-63.8	-51.6	177.3	169.3	-119	0	0	0	112.3	R69 Y70 M208 E212 D213 V245	F66-R69 VanDerWaalsContact O-CG 3.31Å; F66-R69 WeakPolarHBondContact O-CG 3.29Å; F66-Y70 AromaticContact CD2-CE2 3.95Å; F66-Y70 HydrophobicContact CD2-CE2 3.95Å; F66-Y70 AromaticContact CE2-CE2 3.67Å; F66-Y70 HydrophobicContact CE2-CE2 3.67Å; F66-Y70 HydrophobicContact CZ-CE2 4.35Å; F66-Y70 WeakPolarHBondContact O-CD2 3.41Å; F66-Y70 WeakPolarHBondContact O-CE2 3.22Å; F66-M208 HydrophobicContact CE1-CB 4.08Å; F66-E212 HydrophobicContact CD2-CB 3.97Å; F66-E212 HydrophobicContact CE2-CB 4.31Å; F66-D213 HydrophobicContact CE1-CB 4.22Å; F66-D213 HydrophobicContact CE2-CB 4.3Å; F66-D213 HydrophobicContact CZ-CB 3.84Å; F66-V245 HydrophobicContact CD1-CG2 4.22Å; F66-V245 HydrophobicContact CE1-CB 3.87Å; F66-V245 HydrophobicContact CE1-CG2 3.56Å; F66-V245 HydrophobicContact CE2-CG1 4.31Å; F66-V245 HydrophobicContact CE2-CG2 4.3Å; F66-V245 HydrophobicContact CZ-CB 3.62Å; F66-V245 HydrophobicContact CZ-CG1 3.78Å; F66-V245 HydrophobicContact CZ-CG2 3.62Å
67	L	96.8	Very high	96.2	Very high	15 Å²	15	24.8 Å²	24.8	8%	0.079	12%	0.123	C	C	.	.	H	α-helix	trans	-75.5	-36.1	-179.8	179.6	58.2	0	0	0	112	R69 Y70 V71 L131 V169 M208 V245 V248 A249 I252	L67-R69 PolarHBondContact O-N 2.65Å; L67-Y70 PolarHBondContact O-N 3.09Å; L67-Y70 VanDerWaalsContact O-N 3.07Å; L67-V71 HydrophobicContact CD1-CG2 4.2Å; L67-V71 HydrophobicContact CG-CG2 4.19Å; L67-V71 PolarHBondContact O-N 3.31Å; L67-V71 VanDerWaalsContact O-N 3.15Å; L67-L131 HydrophobicContact CD2-CD2 3.87Å; L67-L131 HydrophobicContact CG-CD1 4.34Å; L67-L131 HydrophobicContact CG-CD2 4.36Å; L67-V169 HydrophobicContact CD2-CG1 4.32Å; L67-M208 HydrophobicContact CD1-SD 4.23Å; L67-M208 HydrophobicContact CD2-CE 4.23Å; L67-M208 HydrophobicContact CD2-SD 4.02Å; L67-V245 HydrophobicContact CD1-CG2 3.76Å; L67-V248 HydrophobicContact CD1-CB 4.38Å; L67-V248 HydrophobicContact CD1-CG1 4.01Å; L67-V248 HydrophobicContact CD2-CG1 4.13Å; L67-A249 HydrophobicContact CD1-CB 4.45Å; L67-I252 HydrophobicContact CD2-CD1 4.18Å
68	G	96.3	Very high	96.2	Very high	1 Å²	1	26 Å²	26	1%	0.01	13%	0.128	C	C	.	.	H	α-helix	trans	-54.1	-46.8	-176.8	0	0	0	0	0	113.9	A63 Y70 V71 V72	A63-G68 CarbonylContact O-C 3.6Å; A63-G68 VanDerWaalsContact O-C 3.28Å; A63-G68 WeakPolarHBondContact O-CA 3.38Å; G68-Y70 VanDerWaalsContact C-N 3.28Å; G68-Y70 PolarHBondContact O-N 2.7Å; G68-V71 PolarHBondContact O-N 2.86Å; G68-V72 WeakPolarHBondContact O-CG2 3.37Å; G68-V72 PolarHBondContact O-N 2.98Å
69	R	96.1	Very high	96	Very high	55 Å²	55	26.1 Å²	26.1	21%	0.208	13%	0.129	C	C	.	.	H	α-helix	trans	-58.3	-36.6	177.5	72.1	-172.9	60.1	-165.8	-9.3	113.4	A63 G65 F66 L67 N73 Y95 L96 M99 E212	A63-R69 PolarHBondContact O-N 2.97Å; G65-R69 PolarHBondContact O-NE 3.23Å; F66-R69 VanDerWaalsContact O-CG 3.31Å; F66-R69 WeakPolarHBondContact O-CG 3.29Å; L67-R69 PolarHBondContact O-N 2.65Å; R69-N73 WeakPolarHBondContact O-CB 3.36Å; R69-N73 PolarHBondContact O-N 3.16Å; R69-Y95 HydrophobicContact CB-CE2 3.85Å; R69-Y95 PolarHBondContact NH2-OH 3.26Å; R69-L96 HydrophobicContact CB-CD2 4.11Å; R69-M99 HydrophobicContact CB-CE 4.37Å; R69-E212 IonicContact CZ-OE1 3.34Å; R69-E212 VanDerWaalsContact NH1-CD 3.34Å; R69-E212 IonicContact NH1-OE1 3.23Å; R69-E212 PolarHBondContact NH1-OE1 3.31Å
70	Y	97.4	Very high	95.9	Very high	30 Å²	30	26.1 Å²	26.1	12%	0.118	13%	0.129	C	C	.	.	H	α-helix	trans	-74.3	-38	179.7	-66.9	-80.7	0	0	0	111.3	F66 L67 G68 R74 E212 V245 V246	F66-Y70 AromaticContact CD2-CE2 3.95Å; F66-Y70 HydrophobicContact CD2-CE2 3.95Å; F66-Y70 AromaticContact CE2-CE2 3.67Å; F66-Y70 HydrophobicContact CE2-CE2 3.67Å; F66-Y70 HydrophobicContact CZ-CE2 4.35Å; F66-Y70 WeakPolarHBondContact O-CD2 3.41Å; F66-Y70 WeakPolarHBondContact O-CE2 3.22Å; L67-Y70 PolarHBondContact O-N 3.09Å; L67-Y70 VanDerWaalsContact O-N 3.07Å; G68-Y70 VanDerWaalsContact C-N 3.28Å; G68-Y70 PolarHBondContact O-N 2.7Å; Y70-R74 WeakPolarHBondContact O-CB 3.4Å; Y70-R74 WeakPolarHBondContact O-CG 3.49Å; Y70-R74 PolarHBondContact O-N 2.73Å; Y70-R74 VanDerWaalsContact O-N 3.1Å; Y70-E212 PolarHBondContact OH-OE2 3.05Å; Y70-V245 HydrophobicContact CD1-CG1 4.44Å; Y70-V245 HydrophobicContact CD2-CG1 4.02Å; Y70-V245 HydrophobicContact CD2-CG2 3.63Å; Y70-V245 HydrophobicContact CE1-CG1 4.19Å; Y70-V245 HydrophobicContact CE2-CG1 3.8Å; Y70-V245 HydrophobicContact CE2-CG2 4.02Å; Y70-V245 HydrophobicContact CG-CG1 4.37Å; Y70-V245 HydrophobicContact CG-CG2 4.24Å; Y70-V246 HydrophobicContact CD1-CG2 4.16Å; Y70-V246 HydrophobicContact CE1-CG2 4.27Å
71	V	97.5	Very high	95.8	Very high	0 Å²	0	30 Å²	30	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-65.5	-48.9	175.3	176.3	0	0	0	0	110.5	L67 G68 N73 R74 L75 I129 L131 A249 I252	L67-V71 HydrophobicContact CD1-CG2 4.2Å; L67-V71 HydrophobicContact CG-CG2 4.19Å; L67-V71 PolarHBondContact O-N 3.31Å; L67-V71 VanDerWaalsContact O-N 3.15Å; G68-V71 PolarHBondContact O-N 2.86Å; V71-N73 PolarHBondContact O-N 2.75Å; V71-R74 PolarHBondContact O-N 2.9Å; V71-L75 HydrophobicContact CG1-CD1 3.98Å; V71-L75 HydrophobicContact CG1-CG 4.47Å; V71-L75 WeakPolarHBondContact O-CG 3.5Å; V71-L75 PolarHBondContact O-N 2.91Å; V71-I129 HydrophobicContact CG1-CD1 3.77Å; V71-L131 HydrophobicContact CB-CD1 4.34Å; V71-L131 HydrophobicContact CG2-CD1 4.08Å; V71-A249 HydrophobicContact CG2-CB 4.08Å; V71-I252 HydrophobicContact CG1-CG2 4.33Å; V71-I252 HydrophobicContact CG2-CD1 3.81Å
72	V	97.3	Very high	95.8	Very high	0 Å²	0	30 Å²	30	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-60.3	-46.3	177.6	172	0	0	0	0	111.2	V60 A63 G68 R74 L75 G76 I82 I84 L96 M99 I105	V60-V72 HydrophobicContact CB-CG2 4.49Å; V60-V72 HydrophobicContact CG1-CG2 4.36Å; A63-V72 HydrophobicContact CB-CG2 3.92Å; G68-V72 WeakPolarHBondContact O-CG2 3.37Å; G68-V72 PolarHBondContact O-N 2.98Å; V72-R74 VanDerWaalsContact C-N 3.28Å; V72-R74 PolarHBondContact O-N 2.79Å; V72-L75 PolarHBondContact O-N 3.5Å; V72-G76 PolarHBondContact O-N 3.37Å; V72-I82 HydrophobicContact CG1-CD1 4.02Å; V72-I82 HydrophobicContact CG2-CG2 4.4Å; V72-I82 WeakPolarHBondContact O-CD1 3.45Å; V72-I84 HydrophobicContact CG1-CD1 3.82Å; V72-I84 HydrophobicContact CG2-CD1 4.08Å; V72-L96 HydrophobicContact CB-CD2 4.41Å; V72-L96 HydrophobicContact CG1-CD2 4.25Å; V72-M99 HydrophobicContact CG1-CB 4.47Å; V72-M99 HydrophobicContact CG1-SD 4.21Å; V72-I105 HydrophobicContact CG1-CD1 4.49Å
73	N	97.1	Very high	95.9	Very high	58 Å²	58	30 Å²	30	31%	0.31	14%	0.144	S	C	.	.	H	α-helix	trans	-55.1	-46.6	176	-174.9	-23.2	0	0	0	111.3	R69 V71 G76 R77 M99	R69-N73 WeakPolarHBondContact O-CB 3.36Å; R69-N73 PolarHBondContact O-N 3.16Å; V71-N73 PolarHBondContact O-N 2.75Å; N73-G76 PolarHBondContact O-N 3.02Å; N73-R77 WeakPolarHBondContact O-CB 3.39Å; N73-R77 WeakPolarHBondContact O-CG 3.47Å; N73-R77 PolarHBondContact O-N 2.87Å; N73-R77 WeakPolarHBondContact OD1-CD 3.41Å; N73-M99 HydrophobicContact CB-CE 4.48Å; N73-M99 HydrophobicContact CB-CG 4.36Å; N73-M99 HydrophobicContact CB-SD 3.71Å
74	R	96.1	Very high	95.9	Very high	70 Å²	70	30 Å²	30	26%	0.264	14%	0.144	S	C	.	.	H	α-helix	trans	-71.4	-36.6	-177.3	-70.3	-78.9	-172	-177.8	-0.4	113.1	Y70 V71 V72 I253	Y70-R74 WeakPolarHBondContact O-CB 3.4Å; Y70-R74 WeakPolarHBondContact O-CG 3.49Å; Y70-R74 PolarHBondContact O-N 2.73Å; Y70-R74 VanDerWaalsContact O-N 3.1Å; V71-R74 PolarHBondContact O-N 2.9Å; V72-R74 VanDerWaalsContact C-N 3.28Å; V72-R74 PolarHBondContact O-N 2.79Å; R74-I253 HydrophobicContact CB-CD1 3.03Å; R74-I253 HydrophobicContact CG-CD1 4.12Å
75	L	96.3	Very high	96	Very high	1 Å²	1	27.8 Å²	27.8	1%	0.005	13%	0.13	C	C	.	.	H	α-helix	trans	-64.2	-45.2	171.7	-72.9	171.6	0	0	0	111.2	V56 A58 V60 V71 V72 R77 M78 S80 I82 I129 I253 I256	V56-L75 HydrophobicContact CG1-CD2 4.38Å; A58-L75 HydrophobicContact CB-CD1 4Å; V60-L75 HydrophobicContact CG2-CD1 4Å; V71-L75 HydrophobicContact CG1-CD1 3.98Å; V71-L75 HydrophobicContact CG1-CG 4.47Å; V71-L75 WeakPolarHBondContact O-CG 3.5Å; V71-L75 PolarHBondContact O-N 2.91Å; V72-L75 PolarHBondContact O-N 3.5Å; L75-R77 VanDerWaalsContact C-N 3.32Å; L75-R77 PolarHBondContact O-N 3.05Å; L75-M78 PolarHBondContact O-N 3.24Å; L75-M78 VanDerWaalsContact O-N 3.13Å; L75-S80 WeakPolarHBondContact O-CB 3.42Å; L75-S80 PolarHBondContact O-N 3.35Å; L75-S80 PolarHBondContact O-OG 2.86Å; L75-I82 HydrophobicContact CB-CD1 3.48Å; L75-I82 VanDerWaalsContact CB-CD1 3.48Å; L75-I82 HydrophobicContact CB-CG1 3.94Å; L75-I82 HydrophobicContact CD1-CD1 4.48Å; L75-I82 HydrophobicContact CD1-CG1 4.44Å; L75-I129 HydrophobicContact CD1-CD1 4.03Å; L75-I253 HydrophobicContact CD2-CD1 4.35Å; L75-I253 HydrophobicContact CD2-CG1 4.08Å; L75-I253 HydrophobicContact CG-CD1 4.23Å; L75-I253 HydrophobicContact CG-CG1 4.33Å; L75-I256 HydrophobicContact CD2-CD1 4.21Å
76	G	95.7	Very high	96.1	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-67.2	-32.9	-179.3	0	0	0	0	0	112.7	V72 N73 M78 G79 M99	V72-G76 PolarHBondContact O-N 3.37Å; N73-G76 PolarHBondContact O-N 3.02Å; G76-M78 PolarHBondContact O-N 3.49Å; G76-G79 PolarHBondContact O-N 3.04Å; G76-G79 VanDerWaalsContact O-N 3.09Å; G76-M99 CarbonylContact C-O 3.43Å
77	R	95.4	Very high	96.1	Very high	141 Å²	141	31.1 Å²	31.1	53%	0.532	13%	0.132	S	C	.	.	H	α-helix	trans	-62.8	-24.7	173	-79.5	177.1	66.3	166.1	6.6	114.1	G49 R50 N73 L75	G49-R77 CarbonylContact C-O 3.5Å; R50-R77 PolarHBondContact N-O 2.6Å; N73-R77 WeakPolarHBondContact O-CB 3.39Å; N73-R77 WeakPolarHBondContact O-CG 3.47Å; N73-R77 PolarHBondContact O-N 2.87Å; N73-R77 WeakPolarHBondContact OD1-CD 3.41Å; L75-R77 VanDerWaalsContact C-N 3.32Å; L75-R77 PolarHBondContact O-N 3.05Å
78	M	93.5	Very high	95.9	Very high	38 Å²	38	32 Å²	32	19%	0.187	14%	0.139	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90	-6.5	176.5	-68.3	177.7	37.6	0	0	113.3	G49 L75 G76 I253 K257	G49-M78 CarbonylContact O-C 3.6Å; L75-M78 PolarHBondContact O-N 3.24Å; L75-M78 VanDerWaalsContact O-N 3.13Å; G76-M78 PolarHBondContact O-N 3.49Å; M78-I253 HydrophobicContact SD-CG2 3.69Å; M78-K257 PolarHBondContact SD-NZ 3.01Å; M78-K257 VanDerWaalsContact SD-NZ 3.43Å
79	G	93.7	Very high	95.9	Very high	2 Å²	2	37.3 Å²	37.3	2%	0.021	17%	0.167	C	C	.	.	T	Hydrogen-bonded Turn	trans	73.5	35.5	-172.8	0	0	0	0	0	113.1	G49 R50 S52 S53 S54 G76	G49-G79 PolarHBondContact O-N 3.37Å; R50-G79 VanDerWaalsContact O-CA 3.3Å; R50-G79 WeakPolarHBondContact O-CA 3.32Å; S52-G79 CarbonylContact O-C 3.51Å; S52-G79 WeakPolarHBondContact O-CA 3.29Å; S52-G79 VanDerWaalsContact O-O 3.06Å; S53-G79 WeakPolarHBondContact CA-O 3.43Å; S54-G79 PolarHBondContact N-O 3.24Å; G76-G79 PolarHBondContact O-N 3.04Å; G76-G79 VanDerWaalsContact O-N 3.09Å
80	S	95.4	Very high	95.7	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	18%	0.181	C	C	.	.			trans	-83	146.6	170.4	-54.4	0	0	0	0	110.6	S54 V56 L75 Q104	S54-S80 WeakPolarHBondContact CB-OG 3.3Å; S54-S80 VanDerWaalsContact OG-CA 3.22Å; S54-S80 WeakPolarHBondContact OG-CA 3.14Å; S54-S80 VanDerWaalsContact OG-CB 3.29Å; S54-S80 WeakPolarHBondContact OG-CB 3.18Å; S54-S80 PolarHBondContact OG-OG 2.73Å; V56-S80 WeakPolarHBondContact O-CB 3.43Å; L75-S80 WeakPolarHBondContact O-CB 3.42Å; L75-S80 PolarHBondContact O-N 3.35Å; L75-S80 PolarHBondContact O-OG 2.86Å; S80-Q104 PolarHBondContact O-OE1 3.06Å
81	Q	95.6	Very high	95.6	Very high	82 Å²	82	46.5 Å²	46.5	38%	0.383	21%	0.208	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	133.3	170.4	-166.3	173.4	31.9	0	0	109.3	V56 A57 A58 Q104 I106	V56-Q81 PolarHBondContact O-N 3.35Å; A57-Q81 WeakPolarHBondContact CA-O 3.5Å; A58-Q81 PolarHBondContact N-O 3.13Å; Q81-Q104 CarbonylContact C-O 3.39Å; Q81-Q104 WeakPolarHBondContact CA-O 3.44Å; Q81-I106 HydrophobicContact CG-CD1 4.4Å
82	I	96.8	Very high	95.4	Very high	0 Å²	0	50.5 Å²	50.5	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	118.3	-171.1	-49.2	169.4	0	0	0	108.5	A58 V60 V72 L75 I84 Q104 I105 I106	A58-I82 CarbonylContact O-C 3.58Å; A58-I82 WeakPolarHBondContact O-CA 3.3Å; V60-I82 HydrophobicContact CG2-CG2 3.94Å; V72-I82 HydrophobicContact CG1-CD1 4.02Å; V72-I82 HydrophobicContact CG2-CG2 4.4Å; V72-I82 WeakPolarHBondContact O-CD1 3.45Å; L75-I82 HydrophobicContact CB-CD1 3.48Å; L75-I82 VanDerWaalsContact CB-CD1 3.48Å; L75-I82 HydrophobicContact CB-CG1 3.94Å; L75-I82 HydrophobicContact CD1-CD1 4.48Å; L75-I82 HydrophobicContact CD1-CG1 4.44Å; I82-I84 HydrophobicContact CG2-CD1 4.3Å; I82-I84 HydrophobicContact CG2-CG1 3.77Å; I82-Q104 PolarHBondContact N-O 2.72Å; I82-I105 WeakPolarHBondContact O-CA 3.47Å; I82-I106 PolarHBondContact O-N 3.49Å
83	V	97	Very high	95.2	Very high	16 Å²	16	50.6 Å²	50.6	10%	0.097	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	122	167	-176.8	0	0	0	0	107.8	A58 T59 V60 P85 M108	A58-V83 PolarHBondContact O-N 3.4Å; T59-V83 WeakPolarHBondContact CA-O 3.46Å; T59-V83 HydrophobicContact CG2-CB 4.44Å; T59-V83 HydrophobicContact CG2-CG1 4.43Å; V60-V83 PolarHBondContact N-O 2.92Å; V83-P85 WeakPolarHBondContact O-CD 3.34Å; V83-M108 HydrophobicContact CG1-CG 4.26Å; V83-M108 HydrophobicContact CG1-SD 3.62Å
84	I	97.1	Very high	95.1	Very high	0 Å²	0	52.7 Å²	52.7	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	90.5	-179.2	-61	-175.1	0	0	0	108.3	A63 V72 I82 H86 L93 L96 I105 I106 F107 M108	A63-I84 HydrophobicContact CB-CG1 4.39Å; A63-I84 HydrophobicContact CB-CG2 3.64Å; V72-I84 HydrophobicContact CG1-CD1 3.82Å; V72-I84 HydrophobicContact CG2-CD1 4.08Å; I82-I84 HydrophobicContact CG2-CD1 4.3Å; I82-I84 HydrophobicContact CG2-CG1 3.77Å; I84-H86 PolarHBondContact O-N 3.31Å; I84-L93 HydrophobicContact CG2-CD2 4.28Å; I84-L96 HydrophobicContact CD1-CD1 4.11Å; I84-L96 HydrophobicContact CG2-CD1 4.41Å; I84-I105 HydrophobicContact CD1-CG2 3.53Å; I84-I105 HydrophobicContact CG1-CG2 4.16Å; I84-I106 PolarHBondContact N-O 2.87Å; I84-F107 HydrophobicContact CB-CD1 3.98Å; I84-F107 HydrophobicContact CB-CE1 4.29Å; I84-F107 HydrophobicContact CD1-CE1 4Å; I84-F107 HydrophobicContact CG2-CD1 4.01Å; I84-F107 HydrophobicContact CG2-CE1 4.24Å; I84-M108 PolarHBondContact O-N 3.2Å; I84-M108 VanDerWaalsContact O-N 3.08Å
85	P	96.6	Very high	95	Very high	2 Å²	2	53.3 Å²	53.3	1%	0.013	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	115.4	170.9	30.6	-35.4	0	0	0	109.1	T59 V60 F61 V83 M108 W110 A121	T59-P85 HydrophobicContact CG2-CG 3.74Å; V60-P85 WeakPolarHBondContact O-CD 3.2Å; F61-P85 HydrophobicContact CD1-CB 3.98Å; F61-P85 HydrophobicContact CD1-CG 3.38Å; F61-P85 HydrophobicContact CE1-CB 3.86Å; F61-P85 HydrophobicContact CE1-CG 3.56Å; F61-P85 HydrophobicContact CG-CG 3.94Å; F61-P85 HydrophobicContact CZ-CG 4.24Å; V83-P85 WeakPolarHBondContact O-CD 3.34Å; P85-M108 CarbonylContact C-O 3.59Å; P85-M108 VanDerWaalsContact CA-O 3.24Å; P85-M108 WeakPolarHBondContact CA-O 3.33Å; P85-W110 VanDerWaalsContact C-NE1 3.29Å; P85-W110 HydrophobicContact CB-CB 4.42Å; P85-W110 HydrophobicContact CB-CD2 4.39Å; P85-W110 HydrophobicContact CB-CG 3.83Å; P85-W110 PolarHBondContact O-NE1 3.1Å; P85-W110 VanDerWaalsContact O-NE1 3.11Å; P85-A121 HydrophobicContact CB-CB 4.25Å
86	H	95.6	Very high	95	Very high	9 Å²	9	53.3 Å²	53.3	4%	0.042	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	154.2	178.2	70.9	86.5	0	0	0	112.9	T64 I84 C88 L93 M108 E109 W110	T64-H86 HydrophobicContact CG2-CB 4.26Å; I84-H86 PolarHBondContact O-N 3.31Å; H86-C88 PolarHBondContact ND1-O 3.47Å; H86-L93 HydrophobicContact CB-CD1 3.71Å; H86-L93 HydrophobicContact CB-CD2 3.86Å; H86-L93 HydrophobicContact CB-CG 4.33Å; H86-L93 WeakPolarHBondContact CD2-CD1 3.49Å; H86-L93 WeakPolarHBondContact NE2-CD1 3.36Å; H86-M108 PolarHBondContact CD2-O 3.33Å; H86-M108 PolarHBondContact N-O 3.24Å; H86-E109 WeakPolarHBondContact CE1-CG 3.24Å; H86-E109 IonicContact CE1-OE1 2.7Å; H86-E109 WeakPolarHBondContact O-CA 3.44Å; H86-W110 VanDerWaalsContact C-CD1 3.5Å; H86-W110 VanDerWaalsContact N-CD1 3.33Å; H86-W110 VanDerWaalsContact O-CD1 3.25Å; H86-W110 PolarHBondContact O-N 3.22Å; H86-W110 VanDerWaalsContact O-N 3.09Å
87	R	94.8	Very high	95	Very high	134 Å²	134	58.7 Å²	58.7	51%	0.506	26%	0.262	S	S	.	.			trans	-118.8	-24	171	-173.3	-167.1	-175.1	114.5	22.5	111.9	D111 Y141	R87-D111 IonicContact CZ-OD1 2.76Å; R87-D111 IonicContact NH1-OD1 2.86Å; R87-D111 PolarHBondContact NH1-OD1 2.94Å; R87-D111 IonicContact NH2-OD1 3.92Å; R87-D111 PolarHBondContact NH2-OD1 3.12Å; R87-D111 IonicContact NH2-OD2 3.57Å; R87-Y141 VanDerWaalsContact CZ-OH 3.27Å; R87-Y141 VanDerWaalsContact NH1-CE2 3.32Å; R87-Y141 PolarHBondContact NH1-OH 2.91Å; R87-Y141 PolarHBondContact NH2-OH 2.82Å
88	C	93.3	Very high	95	Very high	34 Å²	34	56.1 Å²	56.1	23%	0.23	26%	0.263	C	S	.	.	S	Bend	trans	-69.3	168.4	174.9	62.8	0	0	0	0	110.3	T64 H86 D92	T64-C88 WeakPolarHBondContact CG2-SG 3.4Å; H86-C88 PolarHBondContact ND1-O 3.47Å; C88-D92 HydrophobicContact CB-CB 4.13Å
89	D	95.4	Very high	95.1	Very high	112 Å²	112	55.8 Å²	55.8	60%	0.599	26%	0.262	S	S	*	.			trans	-63.2	158.7	175.5	-176.6	38.1	0	0	0	111.6	Y91 D92	D89-Y91 PolarHBondContact O-N 3.17Å; D89-Y91 WeakPolarHBondContact OD2-CB 3.2Å; D89-Y91 PolarHBondContact OD2-N 3.38Å; D89-D92 PolarHBondContact O-N 3.03Å
90	Q	92.4	Very high	95.1	Very high	108 Å²	108	56 Å²	56	51%	0.505	26%	0.264	S	S	.	.	G	3₁₀ helix	trans	-62.8	-28.7	-179.6	-171.2	170.1	-47.9	0	0	112.6	D92 L93	Q90-D92 VanDerWaalsContact C-N 3.3Å; Q90-D92 PolarHBondContact O-N 3.45Å; Q90-L93 PolarHBondContact O-N 3.32Å
91	Y	95.4	Very high	95.1	Very high	170 Å²	170	58.1 Å²	58.1	67%	0.667	28%	0.275	S	S	*	.	G	3₁₀ helix	trans	-58.9	-41.7	176.2	-174.7	-97.6	0	0	0	112.3	D89 L93 M94	D89-Y91 PolarHBondContact O-N 3.17Å; D89-Y91 WeakPolarHBondContact OD2-CB 3.2Å; D89-Y91 PolarHBondContact OD2-N 3.38Å; Y91-L93 PolarHBondContact O-N 2.99Å; Y91-L93 VanDerWaalsContact O-N 3.1Å; Y91-M94 HydrophobicContact CD2-SD 4.31Å; Y91-M94 WeakPolarHBondContact O-CG 3.43Å; Y91-M94 PolarHBondContact O-N 2.99Å
92	D	93.2	Very high	95.1	Very high	84 Å²	84	61.7 Å²	61.7	45%	0.449	30%	0.296	S	S	.	.	G	3₁₀ helix	trans	-70.1	-8.2	-178.2	-68.1	-27.9	0	0	0	113.3	C88 D89 Q90 Y95	C88-D92 HydrophobicContact CB-CB 4.13Å; D89-D92 PolarHBondContact O-N 3.03Å; Q90-D92 VanDerWaalsContact C-N 3.3Å; Q90-D92 PolarHBondContact O-N 3.45Å; D92-Y95 WeakPolarHBondContact O-CD1 3.27Å; D92-Y95 WeakPolarHBondContact O-CE1 3.45Å
93	L	93.3	Very high	94.9	Very high	2 Å²	2	64.5 Å²	64.5	1%	0.01	32%	0.324	C	S	.	.	G	3₁₀ helix	trans	-102.6	-10.2	179.8	-62.7	161.8	0	0	0	112.7	T64 I84 H86 Q90 Y91 Y95 L96 F107	T64-L93 HydrophobicContact CG2-CD2 3.39Å; T64-L93 HydrophobicContact CG2-CG 4.46Å; I84-L93 HydrophobicContact CG2-CD2 4.28Å; H86-L93 HydrophobicContact CB-CD1 3.71Å; H86-L93 HydrophobicContact CB-CD2 3.86Å; H86-L93 HydrophobicContact CB-CG 4.33Å; H86-L93 WeakPolarHBondContact CD2-CD1 3.49Å; H86-L93 WeakPolarHBondContact NE2-CD1 3.36Å; Q90-L93 PolarHBondContact O-N 3.32Å; Y91-L93 PolarHBondContact O-N 2.99Å; Y91-L93 VanDerWaalsContact O-N 3.1Å; L93-Y95 PolarHBondContact O-N 2.58Å; L93-Y95 VanDerWaalsContact O-N 3.12Å; L93-L96 HydrophobicContact CD2-CD1 3.87Å; L93-L96 WeakPolarHBondContact O-CB 3.46Å; L93-L96 PolarHBondContact O-N 2.74Å; L93-F107 HydrophobicContact CB-CD1 4.33Å; L93-F107 HydrophobicContact CB-CE1 3.99Å; L93-F107 HydrophobicContact CD1-CD1 4.08Å; L93-F107 HydrophobicContact CD2-CD1 4.32Å; L93-F107 HydrophobicContact CD2-CE1 4.28Å
94	M	93.8	Very high	94.8	Very high	101 Å²	101	65.7 Å²	65.7	50%	0.498	33%	0.329	S	S	.	.	G	3₁₀ helix	trans	-59.1	-33.2	-170.1	-68.5	-159.6	79.4	0	0	112.5	Y91 L96 R97 P98	Y91-M94 HydrophobicContact CD2-SD 4.31Å; Y91-M94 WeakPolarHBondContact O-CG 3.43Å; Y91-M94 PolarHBondContact O-N 2.99Å; M94-L96 PolarHBondContact O-N 3.05Å; M94-R97 PolarHBondContact O-N 2.82Å; M94-P98 WeakPolarHBondContact O-CD 3.42Å
95	Y	95.1	Very high	94.8	Very high	84 Å²	84	66.9 Å²	66.9	33%	0.329	34%	0.335	S	S	.	.	G	3₁₀ helix	trans	-68.7	-16.5	177.4	69.2	-99.9	0	0	0	113.9	T64 R69 D92 L93 P98 M99	T64-Y95 PolarHBondContact O-OH 3.11Å; R69-Y95 HydrophobicContact CB-CE2 3.85Å; R69-Y95 PolarHBondContact NH2-OH 3.26Å; D92-Y95 WeakPolarHBondContact O-CD1 3.27Å; D92-Y95 WeakPolarHBondContact O-CE1 3.45Å; L93-Y95 PolarHBondContact O-N 2.58Å; L93-Y95 VanDerWaalsContact O-N 3.12Å; Y95-P98 WeakPolarHBondContact O-CD 3.14Å; Y95-M99 HydrophobicContact CD2-CE 4.04Å
96	L	95.8	Very high	94.8	Very high	0 Å²	0	69.9 Å²	69.9	0%	0	35%	0.35	C	S	.	.	G	3₁₀ helix	trans	-82.3	-26	176.7	-63.1	173.5	0	0	0	112.1	R69 V72 I84 L93 M94 P98 M99 I105 F107	R69-L96 HydrophobicContact CB-CD2 4.11Å; V72-L96 HydrophobicContact CB-CD2 4.41Å; V72-L96 HydrophobicContact CG1-CD2 4.25Å; I84-L96 HydrophobicContact CD1-CD1 4.11Å; I84-L96 HydrophobicContact CG2-CD1 4.41Å; L93-L96 HydrophobicContact CD2-CD1 3.87Å; L93-L96 WeakPolarHBondContact O-CB 3.46Å; L93-L96 PolarHBondContact O-N 2.74Å; M94-L96 PolarHBondContact O-N 3.05Å; L96-P98 VanDerWaalsContact C-CD 3.5Å; L96-M99 HydrophobicContact CD2-CE 3.92Å; L96-M99 HydrophobicContact CD2-SD 3.63Å; L96-M99 VanDerWaalsContact O-CB 3.24Å; L96-M99 WeakPolarHBondContact O-CB 3.28Å; L96-M99 WeakPolarHBondContact O-CG 3.35Å; L96-M99 PolarHBondContact O-N 3.27Å; L96-I105 VanDerWaalsContact O-CD1 3.28Å; L96-I105 WeakPolarHBondContact O-CD1 2.92Å; L96-F107 HydrophobicContact CB-CE1 4.3Å; L96-F107 HydrophobicContact CB-CZ 4.34Å
97	R	94.8	Very high	94.8	Very high	114 Å²	114	72.2 Å²	72.2	43%	0.43	36%	0.361	S	S	.	.	G	3₁₀ helix	trans	-55.1	-42.4	-177.6	-62.6	-175.7	174.9	-148	-2.7	113.6	M94 M99 F107	M94-R97 PolarHBondContact O-N 2.82Å; R97-M99 PolarHBondContact O-N 2.89Å; R97-M99 VanDerWaalsContact O-N 3.16Å; R97-F107 HydrophobicContact CG-CE2 3.85Å; R97-F107 HydrophobicContact CG-CZ 3.87Å
98	P	95.9	Very high	94.8	Very high	87 Å²	87	68 Å²	68	57%	0.565	35%	0.347	S	S	*	.	G	3₁₀ helix	trans	-69.3	-9.6	178.8	-20.2	34.5	0	0	0	114	R50 M94 Y95 L96	R50-P98 VanDerWaalsContact CZ-O 3.3Å; R50-P98 PolarHBondContact NH1-O 3.05Å; R50-P98 PolarHBondContact NH2-O 3.22Å; M94-P98 WeakPolarHBondContact O-CD 3.42Å; Y95-P98 WeakPolarHBondContact O-CD 3.14Å; L96-P98 VanDerWaalsContact C-CD 3.5Å
99	M	95.3	Very high	94.9	Very high	31 Å²	31	73.7 Å²	73.7	15%	0.153	37%	0.37	C	S	.	.	G	3₁₀ helix	trans	-79	-19.8	-171.3	-62.3	-173.3	-179.6	0	0	114.4	R50 R69 V72 N73 G76 Y95 L96 R97 I105	R50-M99 VanDerWaalsContact NH1-C 3.3Å; R50-M99 PolarHBondContact NH1-O 2.86Å; R69-M99 HydrophobicContact CB-CE 4.37Å; V72-M99 HydrophobicContact CG1-CB 4.47Å; V72-M99 HydrophobicContact CG1-SD 4.21Å; N73-M99 HydrophobicContact CB-CE 4.48Å; N73-M99 HydrophobicContact CB-CG 4.36Å; N73-M99 HydrophobicContact CB-SD 3.71Å; G76-M99 CarbonylContact C-O 3.43Å; Y95-M99 HydrophobicContact CD2-CE 4.04Å; L96-M99 HydrophobicContact CD2-CE 3.92Å; L96-M99 HydrophobicContact CD2-SD 3.63Å; L96-M99 VanDerWaalsContact O-CB 3.24Å; L96-M99 WeakPolarHBondContact O-CB 3.28Å; L96-M99 WeakPolarHBondContact O-CG 3.35Å; L96-M99 PolarHBondContact O-N 3.27Å; R97-M99 PolarHBondContact O-N 2.89Å; R97-M99 VanDerWaalsContact O-N 3.16Å; M99-I105 HydrophobicContact CB-CD1 4.22Å
100	G	93.8	Very high	94.9	Very high	6 Å²	6	69.7 Å²	69.7	6%	0.062	35%	0.347	C	S	.	.	S	Bend	trans	-128.6	157.5	-179.2	0	0	0	0	0	112.2	R50 I105	R50-G100 VanDerWaalsContact CZ-C 3.4Å; R50-G100 PolarHBondContact NH2-O 3.48Å; G100-I105 VanDerWaalsContact N-CD1 3.31Å
101	D	96.2	Very high	95	Very high	44 Å²	44	67.1 Å²	67.1	24%	0.235	34%	0.337	C	S	.	.			trans	-69.5	172.4	174.3	-150.6	-1.5	0	0	0	112	R50 S51 G103 Q104	R50-D101 HydrophobicContact CG-CB 4.14Å; S51-D101 WeakPolarHBondContact CA-OD2 3.18Å; S51-D101 WeakPolarHBondContact CB-OD2 3.44Å; S51-D101 PolarHBondContact OG-OD2 3.35Å; D101-G103 PolarHBondContact O-N 2.77Å; D101-Q104 HydrophobicContact CB-CG 3.86Å; D101-Q104 WeakPolarHBondContact O-CB 3.26Å; D101-Q104 PolarHBondContact O-N 3.28Å; D101-Q104 VanDerWaalsContact O-N 3.09Å
102	L	95.8	Very high	94.8	Very high	158 Å²	158	59.4 Å²	59.4	83%	0.827	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.9	133.1	176.4	-72.6	83	0	0	0	110.6	Q104	L102-Q104 PolarHBondContact O-N 2.78Å
103	G	93.1	Very high	94.7	Very high	58 Å²	58	62.7 Å²	62.7	60%	0.598	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	74.2	-4.8	-179.9	0	0	0	0	0	115.8	D101	D101-G103 PolarHBondContact O-N 2.77Å
104	Q	94.7	Very high	94.7	Very high	41 Å²	41	66.3 Å²	66.3	19%	0.192	33%	0.333	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.1	-33.8	-179.7	-63.1	-61.8	-25.2	0	0	112.8	S80 Q81 I82 D101 L102	S80-Q104 PolarHBondContact O-OE1 3.06Å; Q81-Q104 CarbonylContact C-O 3.39Å; Q81-Q104 WeakPolarHBondContact CA-O 3.44Å; I82-Q104 PolarHBondContact N-O 2.72Å; D101-Q104 HydrophobicContact CB-CG 3.86Å; D101-Q104 WeakPolarHBondContact O-CB 3.26Å; D101-Q104 PolarHBondContact O-N 3.28Å; D101-Q104 VanDerWaalsContact O-N 3.09Å; L102-Q104 PolarHBondContact O-N 2.78Å
105	I	96.3	Very high	94.7	Very high	26 Å²	26	66.9 Å²	66.9	13%	0.133	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	121.9	179.9	-61.3	175.7	0	0	0	109.3	V72 I82 I84 L96 M99 G100 F107	V72-I105 HydrophobicContact CG1-CD1 4.49Å; I82-I105 WeakPolarHBondContact O-CA 3.47Å; I84-I105 HydrophobicContact CD1-CG2 3.53Å; I84-I105 HydrophobicContact CG1-CG2 4.16Å; L96-I105 VanDerWaalsContact O-CD1 3.28Å; L96-I105 WeakPolarHBondContact O-CD1 2.92Å; M99-I105 HydrophobicContact CB-CD1 4.22Å; G100-I105 VanDerWaalsContact N-CD1 3.31Å; I105-F107 HydrophobicContact CG2-CD1 4.45Å; I105-F107 HydrophobicContact CG2-CD2 4.37Å; I105-F107 HydrophobicContact CG2-CE1 3.9Å; I105-F107 HydrophobicContact CG2-CE2 3.79Å; I105-F107 HydrophobicContact CG2-CZ 3.53Å
106	I	96	Very high	94.7	Very high	64 Å²	64	67.7 Å²	67.7	33%	0.328	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	121.7	177	-57.2	170.6	0	0	0	107.7	Q81 I82 I84 M108	Q81-I106 HydrophobicContact CG-CD1 4.4Å; I82-I106 PolarHBondContact O-N 3.49Å; I84-I106 PolarHBondContact N-O 2.87Å; I106-M108 HydrophobicContact CG2-CG 4.12Å
107	F	96.4	Very high	94.7	Very high	59 Å²	59	68.3 Å²	68.3	26%	0.259	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	133	173.9	-60.3	-75.5	0	0	0	109.2	I84 L93 L96 R97 I105	I84-F107 HydrophobicContact CB-CD1 3.98Å; I84-F107 HydrophobicContact CB-CE1 4.29Å; I84-F107 HydrophobicContact CD1-CE1 4Å; I84-F107 HydrophobicContact CG2-CD1 4.01Å; I84-F107 HydrophobicContact CG2-CE1 4.24Å; L93-F107 HydrophobicContact CB-CD1 4.33Å; L93-F107 HydrophobicContact CB-CE1 3.99Å; L93-F107 HydrophobicContact CD1-CD1 4.08Å; L93-F107 HydrophobicContact CD2-CD1 4.32Å; L93-F107 HydrophobicContact CD2-CE1 4.28Å; L96-F107 HydrophobicContact CB-CE1 4.3Å; L96-F107 HydrophobicContact CB-CZ 4.34Å; R97-F107 HydrophobicContact CG-CE2 3.85Å; R97-F107 HydrophobicContact CG-CZ 3.87Å; I105-F107 HydrophobicContact CG2-CD1 4.45Å; I105-F107 HydrophobicContact CG2-CD2 4.37Å; I105-F107 HydrophobicContact CG2-CE1 3.9Å; I105-F107 HydrophobicContact CG2-CE2 3.79Å; I105-F107 HydrophobicContact CG2-CZ 3.53Å
108	M	95.1	Very high	94.7	Very high	45 Å²	45	63 Å²	63	22%	0.222	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	135.8	176	-66.9	179.7	69.8	0	0	109.2	V83 I84 P85 H86 I106 E120	V83-M108 HydrophobicContact CG1-CG 4.26Å; V83-M108 HydrophobicContact CG1-SD 3.62Å; I84-M108 PolarHBondContact O-N 3.2Å; I84-M108 VanDerWaalsContact O-N 3.08Å; P85-M108 CarbonylContact C-O 3.59Å; P85-M108 VanDerWaalsContact CA-O 3.24Å; P85-M108 WeakPolarHBondContact CA-O 3.33Å; H86-M108 PolarHBondContact CD2-O 3.33Å; H86-M108 PolarHBondContact N-O 3.24Å; I106-M108 HydrophobicContact CG2-CG 4.12Å; M108-E120 HydrophobicContact CE-CB 4.4Å; M108-E120 HydrophobicContact CE-CG 3.85Å
109	E	95.7	Very high	94.7	Very high	153 Å²	153	63.6 Å²	63.6	72%	0.715	32%	0.318	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.8	139.6	171.7	-73.7	-177.5	-177.7	0	0	110.1	H86	H86-E109 WeakPolarHBondContact CE1-CG 3.24Å; H86-E109 IonicContact CE1-OE1 2.7Å; H86-E109 WeakPolarHBondContact O-CA 3.44Å
110	W	95.6	Very high	94.6	Very high	28 Å²	28	68.2 Å²	68.2	11%	0.106	34%	0.34	C	S	.	.			trans	-145.5	156.4	174.8	76.1	-65.3	0	0	0	111	F61 P85 H86 A112 I118 V132 I150	F61-W110 HydrophobicContact CD1-CD2 4.21Å; F61-W110 AromaticContact CD1-CE2 3.84Å; F61-W110 HydrophobicContact CD1-CE3 4.37Å; F61-W110 AromaticContact CD1-CH2 3.86Å; F61-W110 HydrophobicContact CD1-CH2 3.86Å; F61-W110 AromaticContact CD1-CZ2 3.68Å; F61-W110 HydrophobicContact CD1-CZ2 3.68Å; F61-W110 HydrophobicContact CD1-CZ3 4.18Å; F61-W110 HydrophobicContact CE1-CD2 4.06Å; F61-W110 HydrophobicContact CE1-CE3 4.04Å; F61-W110 HydrophobicContact CE1-CH2 4.28Å; F61-W110 HydrophobicContact CE1-CZ2 4.31Å; F61-W110 HydrophobicContact CE1-CZ3 4.13Å; P85-W110 VanDerWaalsContact C-NE1 3.29Å; P85-W110 HydrophobicContact CB-CB 4.42Å; P85-W110 HydrophobicContact CB-CD2 4.39Å; P85-W110 HydrophobicContact CB-CG 3.83Å; P85-W110 PolarHBondContact O-NE1 3.1Å; P85-W110 VanDerWaalsContact O-NE1 3.11Å; H86-W110 VanDerWaalsContact C-CD1 3.5Å; H86-W110 VanDerWaalsContact N-CD1 3.33Å; H86-W110 VanDerWaalsContact O-CD1 3.25Å; H86-W110 PolarHBondContact O-N 3.22Å; H86-W110 VanDerWaalsContact O-N 3.09Å; W110-A112 HydrophobicContact CE3-CB 4.45Å; W110-A112 HydrophobicContact CH2-CB 3.9Å; W110-A112 VanDerWaalsContact CZ3-CA 3.42Å; W110-A112 HydrophobicContact CZ3-CB 3.74Å; W110-I118 HydrophobicContact CE3-CD1 4.47Å; W110-I118 HydrophobicContact CE3-CG1 3.81Å; W110-I118 HydrophobicContact CZ3-CD1 4.15Å; W110-I118 HydrophobicContact CZ3-CG1 3.95Å; W110-V132 HydrophobicContact CH2-CG2 4.41Å; W110-V132 HydrophobicContact CZ2-CG2 4.4Å; W110-I150 HydrophobicContact CH2-CG2 4.29Å
111	D	94.8	Very high	94.7	Very high	55 Å²	55	68.1 Å²	68.1	29%	0.294	34%	0.338	S	S	.	.			trans	-118.9	133.5	169.9	-168.4	8.9	0	0	0	110	R87 R113 N114 S117 Y141	R87-D111 IonicContact CZ-OD1 2.76Å; R87-D111 IonicContact NH1-OD1 2.86Å; R87-D111 PolarHBondContact NH1-OD1 2.94Å; R87-D111 IonicContact NH2-OD1 3.92Å; R87-D111 PolarHBondContact NH2-OD1 3.12Å; R87-D111 IonicContact NH2-OD2 3.57Å; D111-R113 PolarHBondContact O-N 3.43Å; D111-R113 VanDerWaalsContact O-N 3.15Å; D111-N114 HydrophobicContact CB-CB 4.21Å; D111-N114 PolarHBondContact O-N 3.07Å; D111-S117 PolarHBondContact N-OG 3.48Å; D111-S117 PolarHBondContact O-OG 2.91Å; D111-S117 VanDerWaalsContact O-OG 3.1Å; D111-Y141 PolarHBondContact OD1-OH 3.48Å
112	A	91.1	Very high	94.6	Very high	7 Å²	7	66 Å²	66	6%	0.058	33%	0.327	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.9	-19	-176.7	0	0	0	0	0	114	W110 Y141 I150	W110-A112 HydrophobicContact CE3-CB 4.45Å; W110-A112 HydrophobicContact CH2-CB 3.9Å; W110-A112 VanDerWaalsContact CZ3-CA 3.42Å; W110-A112 HydrophobicContact CZ3-CB 3.74Å; A112-Y141 HydrophobicContact CB-CE1 4.46Å; A112-I150 HydrophobicContact CB-CD1 3.5Å; A112-I150 HydrophobicContact CB-CG1 3.9Å
113	R	90.7	Very high	94.4	Very high	154 Å²	154	63 Å²	63	58%	0.581	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.2	-20.7	174.1	-65.3	-179.2	177.4	-174.4	-1	112.9	D111 N140 Y141	D111-R113 PolarHBondContact O-N 3.43Å; D111-R113 VanDerWaalsContact O-N 3.15Å; R113-N140 PolarHBondContact NH2-O 2.84Å; R113-Y141 HydrophobicContact CG-CE1 4.05Å; R113-Y141 PolarHBondContact NE-OH 2.92Å
114	N	93.9	Very high	94.2	Very high	77 Å²	77	67.8 Å²	67.8	41%	0.412	32%	0.321	S	S	.	.			trans	-95	105.8	-177.2	-173.1	-3.3	0	0	0	110.6	D111 D116 S117 I118	D111-N114 HydrophobicContact CB-CB 4.21Å; D111-N114 PolarHBondContact O-N 3.07Å; N114-D116 PolarHBondContact O-N 2.91Å; N114-D116 PolarHBondContact OD1-N 3.4Å; N114-D116 VanDerWaalsContact OD1-N 3.1Å; N114-S117 PolarHBondContact O-N 3.17Å; N114-S117 PolarHBondContact O-OG 2.85Å; N114-I118 PolarHBondContact O-N 3.44Å
115	K	93.6	Very high	94.2	Very high	114 Å²	114	66.3 Å²	66.3	50%	0.496	32%	0.315	S	S	.	.	H	α-helix	trans	-62.4	-31	-178.8	-63.6	176.6	-176.4	173.6	0	112.9	I118 R119	K115-I118 PolarHBondContact O-N 2.78Å; K115-R119 WeakPolarHBondContact O-CG 3.43Å; K115-R119 PolarHBondContact O-N 3.29Å; K115-R119 VanDerWaalsContact O-N 3.15Å
116	D	94.8	Very high	94.1	Very high	100 Å²	100	67.7 Å²	67.7	54%	0.535	32%	0.323	S	S	.	.	H	α-helix	trans	-72.8	-36.1	-177.3	-61.4	-34.3	0	0	0	111.2	N114 I118 R119 E120	N114-D116 PolarHBondContact O-N 2.91Å; N114-D116 PolarHBondContact OD1-N 3.4Å; N114-D116 VanDerWaalsContact OD1-N 3.1Å; D116-I118 VanDerWaalsContact C-N 3.28Å; D116-I118 PolarHBondContact O-N 3.36Å; D116-R119 WeakPolarHBondContact O-CB 3.4Å; D116-R119 PolarHBondContact O-N 3.48Å; D116-R119 VanDerWaalsContact O-N 3.13Å; D116-R119 IonicContact OD1-CZ 3.68Å; D116-R119 IonicContact OD1-NH1 3.56Å; D116-R119 PolarHBondContact OD1-NH1 3.43Å; D116-E120 PolarHBondContact O-N 3.01Å
117	S	95.1	Very high	94.1	Very high	14 Å²	14	65 Å²	65	10%	0.098	31%	0.309	C	S	.	.	H	α-helix	trans	-63.4	-34.2	173.9	72.7	0	0	0	0	112.7	D111 N114 A121	D111-S117 PolarHBondContact N-OG 3.48Å; D111-S117 PolarHBondContact O-OG 2.91Å; D111-S117 VanDerWaalsContact O-OG 3.1Å; N114-S117 PolarHBondContact O-N 3.17Å; N114-S117 PolarHBondContact O-OG 2.85Å; S117-A121 PolarHBondContact O-N 2.99Å
118	I	95.2	Very high	94.2	Very high	2 Å²	2	62.1 Å²	62.1	1%	0.01	30%	0.297	C	S	.	.	H	α-helix	trans	-66.7	-44.1	173.9	-61.3	173	0	0	0	109.9	F61 W110 N114 K115 D116 A121 L122 Q153 I154 A157	F61-I118 HydrophobicContact CZ-CG2 4.09Å; W110-I118 HydrophobicContact CE3-CD1 4.47Å; W110-I118 HydrophobicContact CE3-CG1 3.81Å; W110-I118 HydrophobicContact CZ3-CD1 4.15Å; W110-I118 HydrophobicContact CZ3-CG1 3.95Å; N114-I118 PolarHBondContact O-N 3.44Å; K115-I118 PolarHBondContact O-N 2.78Å; D116-I118 VanDerWaalsContact C-N 3.28Å; D116-I118 PolarHBondContact O-N 3.36Å; I118-A121 PolarHBondContact O-N 3.46Å; I118-L122 HydrophobicContact CG2-CD1 4Å; I118-L122 VanDerWaalsContact O-CG 3.22Å; I118-L122 WeakPolarHBondContact O-CG 3.4Å; I118-L122 PolarHBondContact O-N 3.1Å; I118-Q153 HydrophobicContact CD1-CB 4.28Å; I118-I154 HydrophobicContact CG2-CG1 4.21Å; I118-A157 HydrophobicContact CG2-CB 3.86Å
119	R	94.9	Very high	94.3	Very high	99 Å²	99	60 Å²	60	37%	0.374	29%	0.286	S	S	.	.	H	α-helix	trans	-62.5	-44.3	178.1	-69.9	178.9	-177.8	122.7	-3.7	111.7	K115 D116 A121 L122 V123 A157 E160	K115-R119 WeakPolarHBondContact O-CG 3.43Å; K115-R119 PolarHBondContact O-N 3.29Å; K115-R119 VanDerWaalsContact O-N 3.15Å; D116-R119 WeakPolarHBondContact O-CB 3.4Å; D116-R119 PolarHBondContact O-N 3.48Å; D116-R119 VanDerWaalsContact O-N 3.13Å; D116-R119 IonicContact OD1-CZ 3.68Å; D116-R119 IonicContact OD1-NH1 3.56Å; D116-R119 PolarHBondContact OD1-NH1 3.43Å; R119-A121 VanDerWaalsContact C-N 3.31Å; R119-A121 PolarHBondContact O-N 3.45Å; R119-L122 PolarHBondContact O-N 3.46Å; R119-V123 VanDerWaalsContact O-CG2 3.26Å; R119-V123 WeakPolarHBondContact O-CG2 3.36Å; R119-V123 PolarHBondContact O-N 2.97Å; R119-A157 HydrophobicContact CG-CB 4.34Å; R119-E160 IonicContact CZ-OE2 3.57Å; R119-E160 IonicContact NE-OE2 3.09Å; R119-E160 PolarHBondContact NE-OE2 2.87Å; R119-E160 IonicContact NH2-OE2 2.67Å; R119-E160 PolarHBondContact NH2-OE2 3.04Å; R119-E160 VanDerWaalsContact NH2-OE2 3.15Å
120	E	94.8	Very high	94.4	Very high	129 Å²	129	52.9 Å²	52.9	60%	0.603	25%	0.253	S	S	*	.	H	α-helix	trans	-58.7	-43.5	179.1	-162.1	-175.7	165.6	0	0	111.7	M108 D116 L122	M108-E120 HydrophobicContact CE-CB 4.4Å; M108-E120 HydrophobicContact CE-CG 3.85Å; D116-E120 PolarHBondContact O-N 3.01Å; E120-L122 PolarHBondContact O-N 3.33Å; E120-L122 VanDerWaalsContact O-N 3.15Å
121	A	94.6	Very high	94.5	Very high	3 Å²	3	52.9 Å²	52.9	3%	0.025	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67	-12.3	176.7	0	0	0	0	0	114.3	T59 F61 P85 S117 I118 R119	T59-A121 HydrophobicContact CG2-CB 4.28Å; T59-A121 WeakPolarHBondContact CG2-O 3.23Å; T59-A121 PolarHBondContact OG1-O 3.01Å; F61-A121 HydrophobicContact CZ-CB 4.43Å; P85-A121 HydrophobicContact CB-CB 4.25Å; S117-A121 PolarHBondContact O-N 2.99Å; I118-A121 PolarHBondContact O-N 3.46Å; R119-A121 VanDerWaalsContact C-N 3.31Å; R119-A121 PolarHBondContact O-N 3.45Å
122	L	94.6	Very high	94.6	Very high	1 Å²	1	51.6 Å²	51.6	1%	0.005	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	-106.4	-16.6	-175.3	-70.7	179.7	0	0	0	114.3	T59 F61 I118 R119 E120 H124 S125 V128 A157 I163	T59-L122 HydrophobicContact CG2-CD2 4.12Å; F61-L122 HydrophobicContact CE2-CD2 4.02Å; F61-L122 HydrophobicContact CZ-CD2 4.4Å; F61-L122 HydrophobicContact CZ-CG 4.48Å; I118-L122 HydrophobicContact CG2-CD1 4Å; I118-L122 VanDerWaalsContact O-CG 3.22Å; I118-L122 WeakPolarHBondContact O-CG 3.4Å; I118-L122 PolarHBondContact O-N 3.1Å; R119-L122 PolarHBondContact O-N 3.46Å; E120-L122 PolarHBondContact O-N 3.33Å; E120-L122 VanDerWaalsContact O-N 3.15Å; L122-H124 PolarHBondContact O-N 2.83Å; L122-S125 PolarHBondContact O-N 2.91Å; L122-S125 VanDerWaalsContact O-N 3.11Å; L122-V128 HydrophobicContact CD2-CB 4.28Å; L122-V128 HydrophobicContact CD2-CG1 3.99Å; L122-V128 HydrophobicContact CD2-CG2 3.27Å; L122-A157 HydrophobicContact CD1-CB 3.71Å; L122-I163 HydrophobicContact CB-CD1 4.08Å; L122-I163 HydrophobicContact CD2-CD1 4.03Å
123	V	90.6	Very high	94.7	Very high	94 Å²	94	53.3 Å²	53.3	57%	0.57	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.1	-37.1	-169.4	-179.1	0	0	0	0	114	R119	R119-V123 VanDerWaalsContact O-CG2 3.26Å; R119-V123 WeakPolarHBondContact O-CG2 3.36Å; R119-V123 PolarHBondContact O-N 2.97Å
124	H	90.1	Very high	94.9	Very high	159 Å²	159	49.9 Å²	49.9	74%	0.736	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.3	15.8	-174.1	-61.1	-50.7	0	0	0	114	A57 L122	A57-H124 WeakPolarHBondContact CB-O 3.46Å; L122-H124 PolarHBondContact O-N 2.83Å
125	S	94.4	Very high	94.7	Very high	9 Å²	9	47.5 Å²	47.5	6%	0.063	24%	0.241	C	C	.	.			trans	-102.3	137.9	-172.7	-69.2	0	0	0	0	112.8	T59 L122 I163	T59-S125 VanDerWaalsContact OG1-CB 3.27Å; T59-S125 WeakPolarHBondContact OG1-CB 3.32Å; T59-S125 PolarHBondContact OG1-OG 2.7Å; L122-S125 PolarHBondContact O-N 2.91Å; L122-S125 VanDerWaalsContact O-N 3.11Å; S125-I163 WeakPolarHBondContact O-CD1 3.37Å; S125-I163 WeakPolarHBondContact O-CG1 3.37Å
126	N	94.3	Very high	94.7	Very high	56 Å²	56	43.4 Å²	43.4	30%	0.299	22%	0.222	S	C	.	.	S	Bend	trans	-92.5	-22.6	175.5	-61.4	-13.7	0	0	0	111.7	V42 G55 A57 I163	V42-N126 WeakPolarHBondContact CG1-ND2 3.39Å; G55-N126 PolarHBondContact O-ND2 3.09Å; A57-N126 PolarHBondContact O-N 3.19Å; N126-I163 VanDerWaalsContact C-CG2 3.4Å; N126-I163 WeakPolarHBondContact O-CG2 3.41Å
127	V	96.1	Very high	94.4	Very high	6 Å²	6	42.3 Å²	42.3	4%	0.036	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	138.2	-175	-177.8	0	0	0	0	109.4	V56 A57 A58 T59 I129 K165 I256	V56-V127 HydrophobicContact CG1-CG2 4.17Å; A57-V127 PolarHBondContact O-N 3.43Å; A57-V127 VanDerWaalsContact O-N 3.12Å; A58-V127 CarbonylContact C-O 3.18Å; A58-V127 VanDerWaalsContact CA-O 3.3Å; A58-V127 WeakPolarHBondContact CA-O 3.41Å; A58-V127 HydrophobicContact CB-CB 4.39Å; T59-V127 PolarHBondContact N-O 3.15Å; V127-I129 HydrophobicContact CG1-CG1 4.21Å; V127-K165 WeakPolarHBondContact CA-O 3.35Å; V127-K165 HydrophobicContact CG1-CB 4.32Å; V127-K165 HydrophobicContact CG2-CB 4.28Å; V127-I256 HydrophobicContact CG1-CD1 3.96Å; V127-I256 HydrophobicContact CG1-CG1 3.85Å; V127-I256 HydrophobicContact CG1-CG2 4.31Å; V127-I256 HydrophobicContact CG2-CG2 3.8Å
128	V	97.5	Very high	94.2	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	130.1	173.5	-175.1	0	0	0	0	109.5	F61 L122 I154 T158 I163 K165 L166 I167	F61-V128 HydrophobicContact CD2-CG1 3.92Å; F61-V128 HydrophobicContact CE2-CG1 3.84Å; L122-V128 HydrophobicContact CD2-CB 4.28Å; L122-V128 HydrophobicContact CD2-CG1 3.99Å; L122-V128 HydrophobicContact CD2-CG2 3.27Å; V128-I154 HydrophobicContact CG1-CG2 3.93Å; V128-T158 HydrophobicContact CB-CG2 4.27Å; V128-T158 HydrophobicContact CG2-CG2 3.79Å; V128-I163 HydrophobicContact CG2-CD1 3.65Å; V128-I163 HydrophobicContact CG2-CG2 4.18Å; V128-K165 PolarHBondContact N-O 3.18Å; V128-L166 HydrophobicContact CB-CD1 3.72Å; V128-L166 HydrophobicContact CG1-CD1 3.74Å; V128-I167 PolarHBondContact O-N 3.42Å
129	I	98.1	Very high	94	Very high	0 Å²	0	54 Å²	54	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	118.5	177	-48.3	177.7	0	0	0	108	T59 V60 F61 V71 L75 V127 L131 I167 I252 I256	T59-I129 PolarHBondContact O-N 3.18Å; V60-I129 HydrophobicContact CG1-CB 4.43Å; V60-I129 HydrophobicContact CG2-CB 4.43Å; V60-I129 HydrophobicContact CG2-CD1 4.07Å; F61-I129 PolarHBondContact N-O 2.87Å; V71-I129 HydrophobicContact CG1-CD1 3.77Å; L75-I129 HydrophobicContact CD1-CD1 4.03Å; V127-I129 HydrophobicContact CG1-CG1 4.21Å; I129-L131 HydrophobicContact CG2-CD1 4.27Å; I129-L131 HydrophobicContact CG2-CD2 3.78Å; I129-L131 HydrophobicContact CG2-CG 3.87Å; I129-I167 HydrophobicContact CG2-CB 4.46Å; I129-I252 HydrophobicContact CD1-CG2 3.93Å; I129-I252 HydrophobicContact CG2-CG2 4.18Å; I129-I256 HydrophobicContact CD1-CD1 3.7Å; I129-I256 HydrophobicContact CG1-CD1 4.37Å
130	N	97.9	Very high	93.8	Very high	4 Å²	4	54.4 Å²	54.4	2%	0.021	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	107.7	177.3	-176.8	5.6	0	0	0	110.8	V132 I167 H168 V169	N130-V132 WeakPolarHBondContact OD1-CB 3.46Å; N130-V132 WeakPolarHBondContact OD1-CG2 3.48Å; N130-V132 PolarHBondContact OD1-N 2.97Å; N130-I167 PolarHBondContact N-O 3.27Å; N130-H168 PolarHBondContact ND2-ND1 3.15Å; N130-V169 PolarHBondContact O-N 3Å
131	L	97.3	Very high	93.8	Very high	27 Å²	27	50 Å²	50	14%	0.141	26%	0.255	C	S	.	.			trans	-116.1	17.5	175	-47	175.7	0	0	0	111.7	V60 F61 L67 V71 I129 G133 V169 I252	V60-L131 HydrophobicContact CG1-CD1 3.89Å; F61-L131 WeakPolarHBondContact O-CA 3.43Å; F61-L131 VanDerWaalsContact O-CB 3.26Å; F61-L131 WeakPolarHBondContact O-CB 3.47Å; F61-L131 PolarHBondContact O-N 2.64Å; L67-L131 HydrophobicContact CD2-CD2 3.87Å; L67-L131 HydrophobicContact CG-CD1 4.34Å; L67-L131 HydrophobicContact CG-CD2 4.36Å; V71-L131 HydrophobicContact CB-CD1 4.34Å; V71-L131 HydrophobicContact CG2-CD1 4.08Å; I129-L131 HydrophobicContact CG2-CD1 4.27Å; I129-L131 HydrophobicContact CG2-CD2 3.78Å; I129-L131 HydrophobicContact CG2-CG 3.87Å; L131-G133 PolarHBondContact O-N 3.23Å; L131-V169 HydrophobicContact CD2-CB 4.07Å; L131-V169 HydrophobicContact CD2-CG2 3.36Å; L131-I252 HydrophobicContact CD2-CD1 4.27Å
132	V	96.4	Very high	93.8	Very high	28 Å²	28	52 Å²	52	17%	0.17	27%	0.268	C	S	.	.			trans	-67.6	128.1	179.6	-178.3	0	0	0	0	109.3	F61 W110 N130 T146 I150	F61-V132 HydrophobicContact CB-CG2 3.64Å; W110-V132 HydrophobicContact CH2-CG2 4.41Å; W110-V132 HydrophobicContact CZ2-CG2 4.4Å; N130-V132 WeakPolarHBondContact OD1-CB 3.46Å; N130-V132 WeakPolarHBondContact OD1-CG2 3.48Å; N130-V132 PolarHBondContact OD1-N 2.97Å; V132-T146 HydrophobicContact CG1-CG2 4.35Å; V132-I150 HydrophobicContact CG1-CG2 4.48Å
133	G	94.1	Very high	93.8	Very high	43 Å²	43	52.2 Å²	52.2	44%	0.443	27%	0.269	S	S	.	.			trans	-178.8	155.8	179	0	0	0	0	0	112.6	L131 Y147	L131-G133 PolarHBondContact O-N 3.23Å; G133-Y147 WeakPolarHBondContact CA-OH 3.28Å
134	R	93.8	Very high	94.1	Very high	83 Å²	83	53.7 Å²	53.7	31%	0.313	27%	0.27	S	S	.	.			trans	-140.7	142.4	175.1	-158.2	65.4	165	170.4	-6.2	110.1	W136 F143 Y147 Y182 E314	R134-W136 VanDerWaalsContact C-N 3.31Å; R134-W136 HydrophobicContact CG-CD2 4.23Å; R134-W136 HydrophobicContact CG-CG 4.39Å; R134-W136 WeakPolarHBondContact CG-O 3.31Å; R134-W136 VanDerWaalsContact NE-CZ2 3.33Å; R134-F143 WeakPolarHBondContact O-CE1 3.4Å; R134-Y147 PolarHBondContact N-OH 3.31Å; R134-Y147 PolarHBondContact O-OH 3.08Å; R134-Y182 WeakPolarHBondContact O-CE2 3.07Å; R134-E314 IonicContact CZ-OE1 3.94Å; R134-E314 IonicContact NH1-OE1 2.92Å; R134-E314 PolarHBondContact NH1-OE1 3.49Å; R134-E314 IonicContact NH2-OE1 3.78Å; R134-E314 PolarHBondContact NH2-OE1 3.32Å
135	E	91.6	Very high	94.3	Very high	27 Å²	27	48.6 Å²	48.6	13%	0.126	25%	0.248	C	C	.	.	S	Bend	trans	-80.2	-13.5	179	-58.7	-164.6	144.9	0	0	113.6	R214 K321 R324	E135-R214 VanDerWaalsContact CD-CD 3.45Å; E135-R214 WeakPolarHBondContact OE1-CB 3.27Å; E135-R214 WeakPolarHBondContact OE2-CB 3.44Å; E135-R214 VanDerWaalsContact OE2-CD 3.26Å; E135-R214 WeakPolarHBondContact OE2-CD 3.42Å; E135-K321 IonicContact OE2-NZ 2.88Å; E135-K321 PolarHBondContact OE2-NZ 3.31Å; E135-R324 IonicContact OE1-CZ 2.79Å; E135-R324 IonicContact OE1-NH1 3.99Å; E135-R324 IonicContact OE1-NH2 2.75Å; E135-R324 PolarHBondContact OE1-NH2 2.69Å; E135-R324 IonicContact OE2-NH2 2.84Å
136	W	92.3	Very high	94.4	Very high	27 Å²	27	48.8 Å²	48.8	10%	0.102	25%	0.249	C	C	.	.	S	Bend	trans	-134.4	154.2	178.3	58.8	93.3	0	0	0	109.7	R134 E314 P315 T318	R134-W136 VanDerWaalsContact C-N 3.31Å; R134-W136 HydrophobicContact CG-CD2 4.23Å; R134-W136 HydrophobicContact CG-CG 4.39Å; R134-W136 WeakPolarHBondContact CG-O 3.31Å; R134-W136 VanDerWaalsContact NE-CZ2 3.33Å; W136-E314 HydrophobicContact CH2-CB 3.58Å; W136-E314 VanDerWaalsContact CH2-CD 3.48Å; W136-E314 HydrophobicContact CH2-CG 3.83Å; W136-E314 WeakPolarHBondContact CH2-OE2 3.34Å; W136-E314 HydrophobicContact CZ2-CB 3.5Å; W136-E314 VanDerWaalsContact CZ2-CB 3.5Å; W136-E314 HydrophobicContact CZ2-CG 3.5Å; W136-P315 HydrophobicContact CB-CG 3.9Å; W136-P315 HydrophobicContact CD2-CG 3.94Å; W136-P315 HydrophobicContact CE3-CG 4.28Å; W136-P315 HydrophobicContact CG-CG 3.75Å; W136-T318 HydrophobicContact CB-CG2 3.8Å
137	E	90	Very high	94.5	Very high	77 Å²	77	46.2 Å²	46.2	36%	0.36	24%	0.235	S	C	.	.			trans	-73.8	135.7	173.6	-60.7	-163	128.9	0	0	109.3	F143 K181	E137-F143 VanDerWaalsContact CD-CD2 3.49Å; E137-F143 HydrophobicContact CG-CB 4.24Å; E137-F143 HydrophobicContact CG-CD1 3.71Å; E137-F143 HydrophobicContact CG-CD2 3.28Å; E137-F143 HydrophobicContact CG-CE1 3.81Å; E137-F143 HydrophobicContact CG-CE2 3.4Å; E137-F143 HydrophobicContact CG-CG 3.44Å; E137-F143 VanDerWaalsContact CG-CG 3.44Å; E137-F143 HydrophobicContact CG-CZ 3.67Å; E137-F143 VanDerWaalsContact OE1-CB 3.24Å; E137-F143 WeakPolarHBondContact OE1-CB 3.22Å; E137-F143 WeakPolarHBondContact OE1-CD2 3.24Å; E137-F143 VanDerWaalsContact OE1-CG 3.3Å; E137-F143 WeakPolarHBondContact OE1-CG 2.86Å; E137-F143 PolarHBondContact OE1-N 3.27Å; E137-K181 VanDerWaalsContact CD-NZ 3.27Å; E137-K181 WeakPolarHBondContact OE1-CE 3.39Å; E137-K181 IonicContact OE1-NZ 3.59Å; E137-K181 PolarHBondContact OE1-NZ 2.89Å; E137-K181 IonicContact OE2-NZ 3.1Å; E137-K181 PolarHBondContact OE2-NZ 2.84Å
138	T	90.7	Very high	94.5	Very high	54 Å²	54	46.9 Å²	46.9	33%	0.331	24%	0.239	S	C	.	.			trans	-96.9	154.5	169	64.7	0	0	0	0	108.4	N140 Y141	T138-N140 PolarHBondContact O-N 3.42Å; T138-Y141 PolarHBondContact N-O 2.85Å; T138-Y141 VanDerWaalsContact N-O 3.16Å; T138-Y141 CarbonylContact O-C 3.55Å; T138-Y141 PolarHBondContact O-N 2.94Å; T138-Y141 WeakPolarHBondContact OG1-CA 3.42Å; T138-Y141 WeakPolarHBondContact OG1-CB 3.46Å; T138-Y141 PolarHBondContact OG1-N 3.39Å; T138-Y141 PolarHBondContact OG1-O 3.38Å
139	K	89.3	Confident	94.4	Very high	209 Å²	209	48.3 Å²	48.3	91%	0.909	25%	0.249	S	C	*	.	S	Bend	trans	-57.2	-33.7	176.8	-173	177.9	178	-178.5	0	112.6
140	N	92.1	Very high	94.3	Very high	107 Å²	107	48.7 Å²	48.7	57%	0.572	25%	0.251	S	S	*	.	S	Bend	trans	-90	-27.3	-174.6	-60.8	4.5	0	0	0	112.9	R113 T138	R113-N140 PolarHBondContact NH2-O 2.84Å; T138-N140 PolarHBondContact O-N 3.42Å
141	Y	93.6	Very high	94.3	Very high	35 Å²	35	48.5 Å²	48.5	14%	0.137	25%	0.25	C	S	.	.	S	Bend	trans	-131.4	103.6	179.7	-66	-81.2	0	0	0	110.1	R87 D111 A112 R113 T138 D145 I150	R87-Y141 VanDerWaalsContact CZ-OH 3.27Å; R87-Y141 VanDerWaalsContact NH1-CE2 3.32Å; R87-Y141 PolarHBondContact NH1-OH 2.91Å; R87-Y141 PolarHBondContact NH2-OH 2.82Å; D111-Y141 PolarHBondContact OD1-OH 3.48Å; A112-Y141 HydrophobicContact CB-CE1 4.46Å; R113-Y141 HydrophobicContact CG-CE1 4.05Å; R113-Y141 PolarHBondContact NE-OH 2.92Å; T138-Y141 PolarHBondContact N-O 2.85Å; T138-Y141 VanDerWaalsContact N-O 3.16Å; T138-Y141 CarbonylContact O-C 3.55Å; T138-Y141 PolarHBondContact O-N 2.94Å; T138-Y141 WeakPolarHBondContact OG1-CA 3.42Å; T138-Y141 WeakPolarHBondContact OG1-CB 3.46Å; T138-Y141 PolarHBondContact OG1-N 3.39Å; T138-Y141 PolarHBondContact OG1-O 3.38Å; Y141-D145 HydrophobicContact CD1-CB 4.49Å; Y141-I150 HydrophobicContact CD1-CD1 4.48Å
142	P	94.7	Very high	94.3	Very high	46 Å²	46	50.5 Å²	50.5	30%	0.299	26%	0.259	S	S	.	.			trans	-69.5	168.9	169.8	30.3	-35.1	0	0	0	111.4	E144 D145 T146	P142-E144 VanDerWaalsContact C-N 3.25Å; P142-E144 PolarHBondContact O-N 2.86Å; P142-D145 VanDerWaalsContact CD-OD2 3.31Å; P142-D145 WeakPolarHBondContact CD-OD2 3.41Å; P142-D145 HydrophobicContact CG-CB 4.14Å; P142-D145 PolarHBondContact O-N 3.21Å; P142-T146 PolarHBondContact O-N 3.45Å; P142-T146 VanDerWaalsContact O-N 3.13Å; P142-T146 PolarHBondContact O-OG1 3.4Å
143	F	95.5	Very high	94.3	Very high	5 Å²	5	51.5 Å²	51.5	2%	0.022	26%	0.261	C	S	.	.	H	α-helix	trans	-64.3	-30.3	177.8	-74.2	-34	0	0	0	113.4	R134 E137 T146 Y147 K181 Y182 N185 D320	R134-F143 WeakPolarHBondContact O-CE1 3.4Å; E137-F143 VanDerWaalsContact CD-CD2 3.49Å; E137-F143 HydrophobicContact CG-CB 4.24Å; E137-F143 HydrophobicContact CG-CD1 3.71Å; E137-F143 HydrophobicContact CG-CD2 3.28Å; E137-F143 HydrophobicContact CG-CE1 3.81Å; E137-F143 HydrophobicContact CG-CE2 3.4Å; E137-F143 HydrophobicContact CG-CG 3.44Å; E137-F143 VanDerWaalsContact CG-CG 3.44Å; E137-F143 HydrophobicContact CG-CZ 3.67Å; E137-F143 VanDerWaalsContact OE1-CB 3.24Å; E137-F143 WeakPolarHBondContact OE1-CB 3.22Å; E137-F143 WeakPolarHBondContact OE1-CD2 3.24Å; E137-F143 VanDerWaalsContact OE1-CG 3.3Å; E137-F143 WeakPolarHBondContact OE1-CG 2.86Å; E137-F143 PolarHBondContact OE1-N 3.27Å; F143-T146 PolarHBondContact O-N 3.15Å; F143-Y147 HydrophobicContact CB-CD2 4.1Å; F143-Y147 HydrophobicContact CB-CE2 4.41Å; F143-Y147 HydrophobicContact CD1-CD2 4.23Å; F143-Y147 AromaticContact CD1-CE2 3.69Å; F143-Y147 HydrophobicContact CD1-CE2 3.69Å; F143-Y147 HydrophobicContact CE1-CE2 4.26Å; F143-Y147 HydrophobicContact CG-CD2 4.42Å; F143-Y147 HydrophobicContact CG-CE2 4.25Å; F143-Y147 WeakPolarHBondContact O-CB 3.47Å; F143-Y147 WeakPolarHBondContact O-CD2 3.2Å; F143-Y147 PolarHBondContact O-N 3.28Å; F143-K181 HydrophobicContact CD2-CB 4.15Å; F143-K181 HydrophobicContact CD2-CD 4.1Å; F143-K181 HydrophobicContact CD2-CG 4.06Å; F143-Y182 HydrophobicContact CE1-CD2 4.25Å; F143-Y182 HydrophobicContact CZ-CD2 4.33Å; F143-N185 HydrophobicContact CB-CB 4.44Å; F143-N185 WeakPolarHBondContact CB-ND2 3.33Å; F143-D320 HydrophobicContact CE2-CB 4.42Å
144	E	95.6	Very high	94.4	Very high	126 Å²	126	49.4 Å²	49.4	59%	0.589	24%	0.24	S	C	*	.	H	α-helix	trans	-61.9	-46.3	176.8	-174.7	173.5	-179.1	0	0	110.6	P142 T146 V148 S149 N185	P142-E144 VanDerWaalsContact C-N 3.25Å; P142-E144 PolarHBondContact O-N 2.86Å; E144-T146 VanDerWaalsContact C-N 3.35Å; E144-T146 PolarHBondContact O-N 3Å; E144-V148 HydrophobicContact CG-CB 4.5Å; E144-V148 HydrophobicContact CG-CG2 4.45Å; E144-V148 WeakPolarHBondContact O-CA 3.29Å; E144-V148 WeakPolarHBondContact O-CB 3.39Å; E144-V148 PolarHBondContact O-N 3.18Å; E144-S149 PolarHBondContact O-N 3.4Å; E144-N185 PolarHBondContact N-ND2 2.61Å
145	D	95.4	Very high	94.5	Very high	52 Å²	52	45.5 Å²	45.5	28%	0.278	23%	0.225	S	C	.	.	I	π-helix	trans	-64.8	-42.4	176.3	-76.3	-25.3	0	0	0	112.3	Y141 P142 Y147 S149 I150	Y141-D145 HydrophobicContact CD1-CB 4.49Å; P142-D145 VanDerWaalsContact CD-OD2 3.31Å; P142-D145 WeakPolarHBondContact CD-OD2 3.41Å; P142-D145 HydrophobicContact CG-CB 4.14Å; P142-D145 PolarHBondContact O-N 3.21Å; D145-Y147 PolarHBondContact O-N 3.11Å; D145-S149 WeakPolarHBondContact CA-OG 3.41Å; D145-S149 PolarHBondContact O-OG 3.41Å; D145-S149 PolarHBondContact OD1-OG 2.9Å; D145-S149 VanDerWaalsContact OD1-OG 3.12Å; D145-I150 WeakPolarHBondContact O-CB 3.23Å; D145-I150 WeakPolarHBondContact O-CD1 3.48Å; D145-I150 VanDerWaalsContact O-CG1 3.25Å; D145-I150 WeakPolarHBondContact O-CG1 3.49Å; D145-I150 PolarHBondContact O-N 3.13Å
146	T	95.4	Very high	94.7	Very high	12 Å²	12	48.5 Å²	48.5	7%	0.074	24%	0.238	C	C	.	.	I	π-helix	trans	-66.4	-39.6	-176	-53.1	0	0	0	0	112.7	V132 P142 F143 E144 P151	V132-T146 HydrophobicContact CG1-CG2 4.35Å; P142-T146 PolarHBondContact O-N 3.45Å; P142-T146 VanDerWaalsContact O-N 3.13Å; P142-T146 PolarHBondContact O-OG1 3.4Å; F143-T146 PolarHBondContact O-N 3.15Å; E144-T146 VanDerWaalsContact C-N 3.35Å; E144-T146 PolarHBondContact O-N 3Å; T146-P151 WeakPolarHBondContact O-CD 3.27Å
147	Y	97	Very high	94.9	Very high	2 Å²	2	47.6 Å²	47.6	1%	0.008	24%	0.237	C	C	.	.	I	π-helix	trans	-107.5	-20.1	-172.5	-65.4	-58.8	0	0	0	114.7	G133 R134 F143 D145 P151 Y182 N185 K186 G189	G133-Y147 WeakPolarHBondContact CA-OH 3.28Å; R134-Y147 PolarHBondContact N-OH 3.31Å; R134-Y147 PolarHBondContact O-OH 3.08Å; F143-Y147 HydrophobicContact CB-CD2 4.1Å; F143-Y147 HydrophobicContact CB-CE2 4.41Å; F143-Y147 HydrophobicContact CD1-CD2 4.23Å; F143-Y147 AromaticContact CD1-CE2 3.69Å; F143-Y147 HydrophobicContact CD1-CE2 3.69Å; F143-Y147 HydrophobicContact CE1-CE2 4.26Å; F143-Y147 HydrophobicContact CG-CD2 4.42Å; F143-Y147 HydrophobicContact CG-CE2 4.25Å; F143-Y147 WeakPolarHBondContact O-CB 3.47Å; F143-Y147 WeakPolarHBondContact O-CD2 3.2Å; F143-Y147 PolarHBondContact O-N 3.28Å; D145-Y147 PolarHBondContact O-N 3.11Å; Y147-P151 VanDerWaalsContact O-CG 3.31Å; Y147-P151 WeakPolarHBondContact O-CG 3.07Å; Y147-Y182 HydrophobicContact CE1-CE2 4.45Å; Y147-Y182 AromaticContact CE2-CD2 3.65Å; Y147-Y182 HydrophobicContact CE2-CD2 3.65Å; Y147-Y182 AromaticContact CE2-CE2 3.89Å; Y147-Y182 HydrophobicContact CE2-CE2 3.89Å; Y147-Y182 HydrophobicContact CE2-CG 4.35Å; Y147-Y182 AromaticContact CZ-CD2 3.8Å; Y147-Y182 AromaticContact CZ-CE2 3.5Å; Y147-Y182 WeakPolarHBondContact OH-CD2 3.48Å; Y147-Y182 WeakPolarHBondContact OH-CE2 3.41Å; Y147-N185 HydrophobicContact CD2-CB 4.25Å; Y147-K186 HydrophobicContact CD1-CG 3.74Å; Y147-K186 HydrophobicContact CD2-CG 4.48Å; Y147-K186 HydrophobicContact CE1-CD 4.46Å; Y147-K186 HydrophobicContact CE1-CG 4.07Å; Y147-K186 HydrophobicContact CG-CG 3.99Å; Y147-G189 WeakPolarHBondContact O-CA 3.43Å
148	V	96.5	Very high	95.1	Very high	21 Å²	21	44 Å²	44	13%	0.127	22%	0.219	C	C	.	.	I	π-helix	trans	-108.7	-64.9	-179.3	-171.9	0	0	0	0	110.2	E144 P151 Q152 V188 A192	E144-V148 HydrophobicContact CG-CB 4.5Å; E144-V148 HydrophobicContact CG-CG2 4.45Å; E144-V148 WeakPolarHBondContact O-CA 3.29Å; E144-V148 WeakPolarHBondContact O-CB 3.39Å; E144-V148 PolarHBondContact O-N 3.18Å; V148-P151 WeakPolarHBondContact O-CD 3.4Å; V148-Q152 WeakPolarHBondContact O-CB 3.42Å; V148-Q152 PolarHBondContact O-N 3.12Å; V148-V188 HydrophobicContact CG1-CG1 3.95Å; V148-V188 HydrophobicContact CG2-CB 3.98Å; V148-V188 HydrophobicContact CG2-CG1 3.74Å; V148-A192 HydrophobicContact CG1-CB 4.4Å
149	S	95.9	Very high	95.3	Very high	29 Å²	29	47 Å²	47	20%	0.203	23%	0.225	C	C	.	.	I	π-helix	trans	-68.7	-43.8	-169.3	77.1	0	0	0	0	112.9	E144 D145 Q153	E144-S149 PolarHBondContact O-N 3.4Å; D145-S149 WeakPolarHBondContact CA-OG 3.41Å; D145-S149 PolarHBondContact O-OG 3.41Å; D145-S149 PolarHBondContact OD1-OG 2.9Å; D145-S149 VanDerWaalsContact OD1-OG 3.12Å; S149-Q153 VanDerWaalsContact O-CG 3.27Å; S149-Q153 WeakPolarHBondContact O-CG 3.35Å; S149-Q153 PolarHBondContact O-N 3.1Å
150	I	96.4	Very high	95.5	Very high	8 Å²	8	41.7 Å²	41.7	4%	0.041	20%	0.203	C	C	.	.	H	α-helix	trans	-66.1	-51.5	179	-67.4	165.4	0	0	0	111.5	W110 A112 V132 Y141 D145 Q152 Q153 I154	W110-I150 HydrophobicContact CH2-CG2 4.29Å; A112-I150 HydrophobicContact CB-CD1 3.5Å; A112-I150 HydrophobicContact CB-CG1 3.9Å; V132-I150 HydrophobicContact CG1-CG2 4.48Å; Y141-I150 HydrophobicContact CD1-CD1 4.48Å; D145-I150 WeakPolarHBondContact O-CB 3.23Å; D145-I150 WeakPolarHBondContact O-CD1 3.48Å; D145-I150 VanDerWaalsContact O-CG1 3.25Å; D145-I150 WeakPolarHBondContact O-CG1 3.49Å; D145-I150 PolarHBondContact O-N 3.13Å; I150-Q152 VanDerWaalsContact C-N 3.3Å; I150-Q152 PolarHBondContact O-N 3.19Å; I150-Q153 PolarHBondContact O-N 3.15Å; I150-I154 HydrophobicContact CG2-CD1 3.79Å; I150-I154 HydrophobicContact CG2-CG1 4.44Å; I150-I154 WeakPolarHBondContact O-CG1 3.45Å; I150-I154 PolarHBondContact O-N 3.2Å
151	P	96.9	Very high	95.6	Very high	1 Å²	1	39 Å²	39	1%	0.006	20%	0.196	C	C	.	.	H	α-helix	trans	-60.4	-37.3	176.9	-29.3	40.8	0	0	0	113.6	T146 Y147 V148 I154 A155 V193	T146-P151 WeakPolarHBondContact O-CD 3.27Å; Y147-P151 VanDerWaalsContact O-CG 3.31Å; Y147-P151 WeakPolarHBondContact O-CG 3.07Å; V148-P151 WeakPolarHBondContact O-CD 3.4Å; P151-I154 PolarHBondContact O-N 3.36Å; P151-A155 WeakPolarHBondContact O-CB 3.47Å; P151-A155 PolarHBondContact O-N 3Å; P151-V193 HydrophobicContact CB-CG2 3.53Å
152	Q	96.6	Very high	95.5	Very high	69 Å²	69	40.2 Å²	40.2	32%	0.322	22%	0.219	S	C	.	.	H	α-helix	trans	-61.8	-44.9	175	-171.5	-174.9	14.5	0	0	111.5	V148 I150 A155 K156 A192 E196	V148-Q152 WeakPolarHBondContact O-CB 3.42Å; V148-Q152 PolarHBondContact O-N 3.12Å; I150-Q152 VanDerWaalsContact C-N 3.3Å; I150-Q152 PolarHBondContact O-N 3.19Å; Q152-A155 PolarHBondContact O-N 3.44Å; Q152-K156 WeakPolarHBondContact O-CB 3.21Å; Q152-K156 PolarHBondContact O-N 2.82Å; Q152-A192 HydrophobicContact CB-CB 4.41Å; Q152-A192 HydrophobicContact CG-CB 4.49Å; Q152-E196 HydrophobicContact CG-CG 3.73Å; Q152-E196 PolarHBondContact NE2-OE1 3.32Å
153	Q	96.1	Very high	95.3	Very high	48 Å²	48	38.6 Å²	38.6	22%	0.224	21%	0.208	C	C	.	.	H	α-helix	trans	-64.3	-41.5	177.1	-72.3	177.6	25.1	0	0	112.3	I118 S149 I150 K156 A157	I118-Q153 HydrophobicContact CD1-CB 4.28Å; S149-Q153 VanDerWaalsContact O-CG 3.27Å; S149-Q153 WeakPolarHBondContact O-CG 3.35Å; S149-Q153 PolarHBondContact O-N 3.1Å; I150-Q153 PolarHBondContact O-N 3.15Å; Q153-K156 PolarHBondContact O-N 3.48Å; Q153-A157 WeakPolarHBondContact O-CB 3.28Å; Q153-A157 PolarHBondContact O-N 3.42Å
154	I	96.6	Very high	94.9	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-62.3	-45.8	175.1	-66.9	168.2	0	0	0	110.1	F61 I118 V128 I150 P151 K156 A157 T158 L166	F61-I154 HydrophobicContact CB-CD1 4.38Å; F61-I154 HydrophobicContact CD1-CD1 4.3Å; F61-I154 HydrophobicContact CD2-CD1 3.98Å; F61-I154 HydrophobicContact CD2-CG1 4.44Å; F61-I154 HydrophobicContact CD2-CG2 4.1Å; F61-I154 HydrophobicContact CE2-CD1 4.31Å; F61-I154 HydrophobicContact CE2-CG1 4.29Å; F61-I154 HydrophobicContact CE2-CG2 3.92Å; F61-I154 HydrophobicContact CG-CD1 3.97Å; F61-I154 HydrophobicContact CZ-CG1 4.47Å; I118-I154 HydrophobicContact CG2-CG1 4.21Å; V128-I154 HydrophobicContact CG1-CG2 3.93Å; I150-I154 HydrophobicContact CG2-CD1 3.79Å; I150-I154 HydrophobicContact CG2-CG1 4.44Å; I150-I154 WeakPolarHBondContact O-CG1 3.45Å; I150-I154 PolarHBondContact O-N 3.2Å; P151-I154 PolarHBondContact O-N 3.36Å; I154-K156 PolarHBondContact O-N 3.27Å; I154-A157 PolarHBondContact O-N 2.83Å; I154-T158 VanDerWaalsContact O-CB 3.28Å; I154-T158 WeakPolarHBondContact O-CB 3.32Å; I154-T158 PolarHBondContact O-N 2.71Å; I154-T158 PolarHBondContact O-OG1 2.73Å; I154-L166 HydrophobicContact CG2-CD1 4.39Å
155	A	96.7	Very high	94.8	Very high	0 Å²	0	38 Å²	38	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-61.4	-45.3	179.2	0	0	0	0	0	111.7	P151 Q152 T158 R159 L166 V193 E196 F197	P151-A155 WeakPolarHBondContact O-CB 3.47Å; P151-A155 PolarHBondContact O-N 3Å; Q152-A155 PolarHBondContact O-N 3.44Å; A155-T158 WeakPolarHBondContact O-CB 3.48Å; A155-T158 PolarHBondContact O-N 3.33Å; A155-R159 PolarHBondContact O-N 3.44Å; A155-L166 HydrophobicContact CB-CD2 3.79Å; A155-V193 HydrophobicContact CB-CG1 4.29Å; A155-E196 HydrophobicContact CB-CB 3.87Å; A155-F197 HydrophobicContact CB-CB 4.23Å
156	K	96	Very high	94.9	Very high	90 Å²	90	35.7 Å²	35.7	39%	0.391	20%	0.199	S	C	.	.	H	α-helix	trans	-61.3	-47.6	175.5	-177.7	173.8	177.8	170.4	0	112.3	Q152 Q153 I154 T158 R159 E160	Q152-K156 WeakPolarHBondContact O-CB 3.21Å; Q152-K156 PolarHBondContact O-N 2.82Å; Q153-K156 PolarHBondContact O-N 3.48Å; I154-K156 PolarHBondContact O-N 3.27Å; K156-T158 VanDerWaalsContact C-N 3.29Å; K156-T158 PolarHBondContact O-N 3.46Å; K156-R159 WeakPolarHBondContact O-CB 3.45Å; K156-R159 PolarHBondContact O-N 3.43Å; K156-E160 WeakPolarHBondContact CE-OE1 3.38Å; K156-E160 WeakPolarHBondContact O-CG 3.29Å; K156-E160 PolarHBondContact O-N 2.84Å
157	A	95.6	Very high	95	Very high	9 Å²	9	35.1 Å²	35.1	7%	0.074	20%	0.196	C	C	.	.	H	α-helix	trans	-64.1	-35.7	178.2	0	0	0	0	0	112.1	I118 R119 L122 Q153 I154 E160 A161	I118-A157 HydrophobicContact CG2-CB 3.86Å; R119-A157 HydrophobicContact CG-CB 4.34Å; L122-A157 HydrophobicContact CD1-CB 3.71Å; Q153-A157 WeakPolarHBondContact O-CB 3.28Å; Q153-A157 PolarHBondContact O-N 3.42Å; I154-A157 PolarHBondContact O-N 2.83Å; A157-E160 PolarHBondContact O-N 2.93Å; A157-A161 WeakPolarHBondContact O-CB 3.39Å; A157-A161 PolarHBondContact O-N 3.17Å
158	T	95.6	Very high	95	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-64.8	-41.5	175.4	-56.6	0	0	0	0	111.2	V128 I154 A155 K156 A161 G162 I163 L166 F197	V128-T158 HydrophobicContact CB-CG2 4.27Å; V128-T158 HydrophobicContact CG2-CG2 3.79Å; I154-T158 VanDerWaalsContact O-CB 3.28Å; I154-T158 WeakPolarHBondContact O-CB 3.32Å; I154-T158 PolarHBondContact O-N 2.71Å; I154-T158 PolarHBondContact O-OG1 2.73Å; A155-T158 WeakPolarHBondContact O-CB 3.48Å; A155-T158 PolarHBondContact O-N 3.33Å; K156-T158 VanDerWaalsContact C-N 3.29Å; K156-T158 PolarHBondContact O-N 3.46Å; T158-A161 PolarHBondContact O-N 3.46Å; T158-G162 PolarHBondContact O-N 3.22Å; T158-I163 HydrophobicContact CG2-CB 3.68Å; T158-I163 HydrophobicContact CG2-CD1 4.21Å; T158-I163 HydrophobicContact CG2-CG1 4.39Å; T158-I163 HydrophobicContact CG2-CG2 4.11Å; T158-I163 PolarHBondContact O-N 3.23Å; T158-I163 VanDerWaalsContact O-N 3.17Å; T158-L166 HydrophobicContact CG2-CB 4.18Å; T158-L166 HydrophobicContact CG2-CD1 4.36Å; T158-F197 HydrophobicContact CG2-CE2 4.28Å
159	R	94.6	Very high	95.1	Very high	118 Å²	118	34.8 Å²	34.8	45%	0.445	19%	0.193	S	C	.	.	H	α-helix	trans	-63.8	-47.4	173.2	-169.5	-179.6	72.8	-140.8	2.2	111.8	A155 K156 A161 G162 E196 F197	A155-R159 PolarHBondContact O-N 3.44Å; K156-R159 WeakPolarHBondContact O-CB 3.45Å; K156-R159 PolarHBondContact O-N 3.43Å; R159-A161 VanDerWaalsContact C-N 3.28Å; R159-A161 PolarHBondContact O-N 2.85Å; R159-G162 PolarHBondContact O-N 3.07Å; R159-E196 WeakPolarHBondContact CD-O 3.47Å; R159-E196 IonicContact CZ-OE2 3.57Å; R159-E196 PolarHBondContact NH1-O 3.21Å; R159-E196 IonicContact NH1-OE2 3.94Å; R159-E196 PolarHBondContact NH1-OE2 2.99Å; R159-E196 IonicContact NH2-OE2 3.79Å; R159-F197 HydrophobicContact CB-CD2 4.12Å
160	E	93.8	Very high	95.1	Very high	97 Å²	97	33.5 Å²	33.5	45%	0.453	19%	0.185	S	C	.	.	H	α-helix	trans	-59.5	-37.9	178.3	-74.1	173.7	-171.4	0	0	111.8	R119 K156 A157 G162	R119-E160 IonicContact CZ-OE2 3.57Å; R119-E160 IonicContact NE-OE2 3.09Å; R119-E160 PolarHBondContact NE-OE2 2.87Å; R119-E160 IonicContact NH2-OE2 2.67Å; R119-E160 PolarHBondContact NH2-OE2 3.04Å; R119-E160 VanDerWaalsContact NH2-OE2 3.15Å; K156-E160 WeakPolarHBondContact CE-OE1 3.38Å; K156-E160 WeakPolarHBondContact O-CG 3.29Å; K156-E160 PolarHBondContact O-N 2.84Å; A157-E160 PolarHBondContact O-N 2.93Å; E160-G162 PolarHBondContact O-N 3.24Å
161	A	92.6	Very high	95.1	Very high	51 Å²	51	33.5 Å²	33.5	42%	0.421	19%	0.185	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.7	-6.4	176.4	0	0	0	0	0	114	A157 T158 R159 I163	A157-A161 WeakPolarHBondContact O-CB 3.39Å; A157-A161 PolarHBondContact O-N 3.17Å; T158-A161 PolarHBondContact O-N 3.46Å; R159-A161 VanDerWaalsContact C-N 3.28Å; R159-A161 PolarHBondContact O-N 2.85Å; A161-I163 VanDerWaalsContact C-N 3.3Å; A161-I163 HydrophobicContact CB-CD1 3.92Å; A161-I163 HydrophobicContact CB-CG1 3.81Å; A161-I163 PolarHBondContact O-N 3.37Å
162	G	91.1	Very high	95	Very high	61 Å²	61	33.5 Å²	33.5	63%	0.629	18%	0.184	S	C	*	.	T	Hydrogen-bonded Turn	trans	69.7	25.6	179.6	0	0	0	0	0	114	T158 R159 E160	T158-G162 PolarHBondContact O-N 3.22Å; R159-G162 PolarHBondContact O-N 3.07Å; E160-G162 PolarHBondContact O-N 3.24Å
163	I	92.2	Very high	94.9	Very high	12 Å²	12	30.3 Å²	30.3	6%	0.062	17%	0.169	C	C	.	.			trans	-77.4	134.3	-177.4	-56.8	177.3	0	0	0	109.9	L122 S125 N126 V128 T158 A161 F197	L122-I163 HydrophobicContact CB-CD1 4.08Å; L122-I163 HydrophobicContact CD2-CD1 4.03Å; S125-I163 WeakPolarHBondContact O-CD1 3.37Å; S125-I163 WeakPolarHBondContact O-CG1 3.37Å; N126-I163 VanDerWaalsContact C-CG2 3.4Å; N126-I163 WeakPolarHBondContact O-CG2 3.41Å; V128-I163 HydrophobicContact CG2-CD1 3.65Å; V128-I163 HydrophobicContact CG2-CG2 4.18Å; T158-I163 HydrophobicContact CG2-CB 3.68Å; T158-I163 HydrophobicContact CG2-CD1 4.21Å; T158-I163 HydrophobicContact CG2-CG1 4.39Å; T158-I163 HydrophobicContact CG2-CG2 4.11Å; T158-I163 PolarHBondContact O-N 3.23Å; T158-I163 VanDerWaalsContact O-N 3.17Å; A161-I163 VanDerWaalsContact C-N 3.3Å; A161-I163 HydrophobicContact CB-CD1 3.92Å; A161-I163 HydrophobicContact CB-CG1 3.81Å; A161-I163 PolarHBondContact O-N 3.37Å; I163-F197 WeakPolarHBondContact O-CE2 3.15Å; I163-F197 WeakPolarHBondContact O-CZ 3.49Å
164	T	85.3	Confident	94.8	Very high	95 Å²	95	28.4 Å²	28.4	58%	0.583	16%	0.162	S	C	*	.	S	Bend	trans	-77.7	-29.9	-172.4	59.6	0	0	0	0	114.7
165	K	94.4	Very high	94.7	Very high	23 Å²	23	31 Å²	31	10%	0.1	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129	117.2	-172.7	-65.8	-165.2	175.4	-166.1	0	112.2	V127 V128 I256 D258	V127-K165 WeakPolarHBondContact CA-O 3.35Å; V127-K165 HydrophobicContact CG1-CB 4.32Å; V127-K165 HydrophobicContact CG2-CB 4.28Å; V128-K165 PolarHBondContact N-O 3.18Å; K165-I256 PolarHBondContact NZ-O 3.41Å; K165-D258 PolarHBondContact NZ-O 3.3Å
166	L	97.1	Very high	94.6	Very high	3 Å²	3	35.5 Å²	35.5	2%	0.016	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	124.3	169.4	179.6	61.7	0	0	0	109.4	V128 I154 A155 T158 V193 F197 A200 I201	V128-L166 HydrophobicContact CB-CD1 3.72Å; V128-L166 HydrophobicContact CG1-CD1 3.74Å; I154-L166 HydrophobicContact CG2-CD1 4.39Å; A155-L166 HydrophobicContact CB-CD2 3.79Å; T158-L166 HydrophobicContact CG2-CB 4.18Å; T158-L166 HydrophobicContact CG2-CD1 4.36Å; L166-V193 HydrophobicContact CD2-CG1 4.08Å; L166-F197 HydrophobicContact CB-CD1 3.83Å; L166-F197 HydrophobicContact CB-CE1 3.84Å; L166-F197 HydrophobicContact CB-CG 4.33Å; L166-F197 HydrophobicContact CB-CZ 4.33Å; L166-F197 HydrophobicContact CD2-CB 3.94Å; L166-F197 HydrophobicContact CD2-CD1 4.13Å; L166-F197 HydrophobicContact CD2-CG 4Å; L166-A200 HydrophobicContact CD2-CB 4.27Å; L166-I201 PolarHBondContact O-N 2.52Å
167	I	97.7	Very high	94.5	Very high	0 Å²	0	42 Å²	42	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	120.6	173.7	-57.4	179.8	0	0	0	108.5	V128 I129 N130 I201 M203 I252 I256	V128-I167 PolarHBondContact O-N 3.42Å; I129-I167 HydrophobicContact CG2-CB 4.46Å; N130-I167 PolarHBondContact N-O 3.27Å; I167-I201 WeakPolarHBondContact CA-O 3.38Å; I167-I201 HydrophobicContact CG1-CB 4.2Å; I167-I201 HydrophobicContact CG1-CD1 4.18Å; I167-M203 HydrophobicContact CG2-CG 3.93Å; I167-I252 HydrophobicContact CD1-CG2 4Å; I167-I252 HydrophobicContact CG2-CG2 4.47Å; I167-I256 HydrophobicContact CD1-CD1 4.1Å; I167-I256 HydrophobicContact CD1-CG1 3.39Å
168	H	98.1	Very high	94.3	Very high	4 Å²	4	42 Å²	42	2%	0.019	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	128.7	175.8	-178	65.6	0	0	0	110.6	N130 V193 I201 I202 M203	N130-H168 PolarHBondContact ND2-ND1 3.15Å; H168-V193 HydrophobicContact CB-CG1 4.08Å; H168-I201 PolarHBondContact N-O 2.92Å; H168-I202 WeakPolarHBondContact O-CA 3.43Å; H168-M203 PolarHBondContact O-N 2.91Å
169	V	97.6	Very high	94.1	Very high	12 Å²	12	46 Å²	46	7%	0.073	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	104.5	179.1	-176.6	0	0	0	0	110.5	L67 N130 L131 K186 M203 P205 I252	L67-V169 HydrophobicContact CD2-CG1 4.32Å; N130-V169 PolarHBondContact O-N 3Å; L131-V169 HydrophobicContact CD2-CB 4.07Å; L131-V169 HydrophobicContact CD2-CG2 3.36Å; V169-K186 PolarHBondContact O-NZ 2.87Å; V169-M203 CarbonylContact C-O 3.59Å; V169-M203 WeakPolarHBondContact CA-O 3.18Å; V169-M203 HydrophobicContact CG2-CB 4.21Å; V169-P205 HydrophobicContact CG1-CG 3.77Å; V169-I252 HydrophobicContact CG2-CD1 4.19Å
170	S	95.9	Very high	94.1	Very high	3 Å²	3	40.3 Å²	40.3	2%	0.021	23%	0.225	C	C	.	.			trans	-88.3	-135.5	174.2	-172.8	0	0	0	0	110	K186 M203	S170-K186 PolarHBondContact O-NZ 2.88Å; S170-K186 VanDerWaalsContact O-NZ 3.16Å; S170-M203 PolarHBondContact N-O 2.78Å
171	H	96.1	Very high	94.1	Very high	8 Å²	8	39.6 Å²	39.6	4%	0.037	22%	0.221	C	C	.	.			trans	-151.1	150.2	174.1	-164.3	-52.2	0	0	0	108.8	N173 A174 Y182 L183 K186 P205 E207	H171-N173 VanDerWaalsContact C-N 3.27Å; H171-N173 PolarHBondContact ND1-N 3.36Å; H171-N173 PolarHBondContact O-N 2.74Å; H171-A174 VanDerWaalsContact O-CB 3.27Å; H171-A174 WeakPolarHBondContact O-CB 3.45Å; H171-A174 PolarHBondContact O-N 2.82Å; H171-A174 VanDerWaalsContact O-N 3.17Å; H171-Y182 AromaticContact CD2-CE1 3.99Å; H171-L183 HydrophobicContact CB-CD2 4.02Å; H171-K186 HydrophobicContact CB-CD 3.78Å; H171-P205 PolarHBondContact ND1-O 2.96Å; H171-E207 IonicContact NE2-OE1 3.66Å
172	L	95.5	Very high	94.2	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	-52.4	-41.9	175.6	-168.8	72.2	0	0	0	113.7	A174 P205 A206 A267 V269 D329 Y332	L172-A174 VanDerWaalsContact C-N 3.31Å; L172-A174 PolarHBondContact O-N 3.1Å; L172-P205 PolarHBondContact N-O 2.76Å; L172-A206 HydrophobicContact CD2-CB 3.98Å; L172-A267 HydrophobicContact CD1-CB 4.02Å; L172-V269 HydrophobicContact CD1-CG1 3.89Å; L172-V269 HydrophobicContact CD2-CG1 3.85Å; L172-D329 HydrophobicContact CD2-CB 3.99Å; L172-Y332 HydrophobicContact CD1-CD2 3.75Å; L172-Y332 HydrophobicContact CD1-CE2 4.02Å; L172-Y332 HydrophobicContact CG-CD2 4.4Å; L172-Y332 HydrophobicContact CG-CE2 4.26Å; L172-Y332 WeakPolarHBondContact O-CE2 3.49Å
173	N	95.1	Very high	94.5	Very high	2 Å²	2	35.4 Å²	35.4	1%	0.011	18%	0.175	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95	20.3	-175.8	-57.7	-22.7	0	0	0	112.6	H171 D175 L183 T327 D329 M330	H171-N173 VanDerWaalsContact C-N 3.27Å; H171-N173 PolarHBondContact ND1-N 3.36Å; H171-N173 PolarHBondContact O-N 2.74Å; N173-D175 PolarHBondContact O-N 3.17Å; N173-D175 VanDerWaalsContact O-N 3.07Å; N173-L183 HydrophobicContact CB-CD1 3.78Å; N173-L183 HydrophobicContact CB-CD2 4.18Å; N173-L183 WeakPolarHBondContact O-CD1 3.17Å; N173-T327 HydrophobicContact CB-CG2 4.46Å; N173-D329 PolarHBondContact ND2-OD1 3.06Å; N173-D329 WeakPolarHBondContact OD1-CA 3.15Å; N173-M330 PolarHBondContact OD1-N 3.46Å
174	A	93.8	Very high	94.7	Very high	8 Å²	8	40 Å²	40	7%	0.066	19%	0.191	C	C	.	.			trans	-66.7	107.1	175	0	0	0	0	0	109.2	H171 L172 K186 A187	H171-A174 VanDerWaalsContact O-CB 3.27Å; H171-A174 WeakPolarHBondContact O-CB 3.45Å; H171-A174 PolarHBondContact O-N 2.82Å; H171-A174 VanDerWaalsContact O-N 3.17Å; L172-A174 VanDerWaalsContact C-N 3.31Å; L172-A174 PolarHBondContact O-N 3.1Å; A174-K186 HydrophobicContact CB-CB 4.09Å; A174-A187 HydrophobicContact CB-CB 4.34Å
175	D	94.1	Very high	95.3	Very high	56 Å²	56	36.6 Å²	36.6	30%	0.299	17%	0.17	S	C	.	.			trans	-145.1	139.9	177.3	-176.5	4.2	0	0	0	109.1	N173 R177 S178 R184 M330	N173-D175 PolarHBondContact O-N 3.17Å; N173-D175 VanDerWaalsContact O-N 3.07Å; D175-R177 PolarHBondContact O-N 3.39Å; D175-R177 PolarHBondContact OD1-N 2.92Å; D175-R177 VanDerWaalsContact OD1-N 3.14Å; D175-S178 WeakPolarHBondContact O-CB 3.42Å; D175-S178 PolarHBondContact O-N 3.22Å; D175-S178 VanDerWaalsContact O-N 3.17Å; D175-R184 WeakPolarHBondContact O-CA 3.32Å; D175-M330 HydrophobicContact CB-CE 4.47Å
176	I	94.3	Very high	95.4	Very high	94 Å²	94	36 Å²	36	48%	0.482	17%	0.167	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-28.6	177.7	-60	169.4	0	0	0	110.8	S178 R184 A187 M191	I176-S178 VanDerWaalsContact C-N 3.33Å; I176-R184 WeakPolarHBondContact O-CD 3.46Å; I176-R184 VanDerWaalsContact O-CG 3.27Å; I176-R184 WeakPolarHBondContact O-CG 3.32Å; I176-A187 HydrophobicContact CG1-CB 3.89Å; I176-M191 HydrophobicContact CD1-CE 3.61Å; I176-M191 HydrophobicContact CD1-SD 4.11Å; I176-M191 HydrophobicContact CG1-CE 4.31Å
177	R	93.4	Very high	95.3	Very high	225 Å²	225	36.3 Å²	36.3	85%	0.849	17%	0.17	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87.7	1.3	179.4	-61.7	-179.1	-179.4	177	1.1	113.8	D175	D175-R177 PolarHBondContact O-N 3.39Å; D175-R177 PolarHBondContact OD1-N 2.92Å; D175-R177 VanDerWaalsContact OD1-N 3.14Å
178	S	92.5	Very high	95.3	Very high	10 Å²	10	38.8 Å²	38.8	7%	0.07	19%	0.185	C	C	.	.			trans	-65.5	143.6	-179	-177.4	0	0	0	0	112.1	D175 I176 S180 L183 R184	D175-S178 WeakPolarHBondContact O-CB 3.42Å; D175-S178 PolarHBondContact O-N 3.22Å; D175-S178 VanDerWaalsContact O-N 3.17Å; I176-S178 VanDerWaalsContact C-N 3.33Å; S178-S180 VanDerWaalsContact C-N 3.33Å; S178-S180 PolarHBondContact O-N 3.22Å; S178-S180 PolarHBondContact OG-OG 3.34Å; S178-L183 WeakPolarHBondContact OG-CD1 3.26Å; S178-R184 WeakPolarHBondContact O-CD 3.07Å; S178-R184 WeakPolarHBondContact O-CG 3.2Å; S178-R184 PolarHBondContact O-NE 3.18Å
179	P	91.1	Very high	95.3	Very high	83 Å²	83	38.6 Å²	38.6	54%	0.539	18%	0.184	S	C	.	.	S	Bend	trans	-64.3	-37	176	25	-33.9	0	0	0	112.5	D323	P179-D323 HydrophobicContact CG-CB 4.43Å
180	S	93.9	Very high	95.2	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	19%	0.187	C	C	.	.	S	Bend	trans	-71.4	135.9	-179.4	65.9	0	0	0	0	111.5	S178 Y182 L183 R184 D320	S178-S180 VanDerWaalsContact C-N 3.33Å; S178-S180 PolarHBondContact O-N 3.22Å; S178-S180 PolarHBondContact OG-OG 3.34Å; S180-Y182 VanDerWaalsContact C-N 3.31Å; S180-L183 WeakPolarHBondContact OG-CB 3.35Å; S180-L183 WeakPolarHBondContact OG-CD1 3.38Å; S180-L183 WeakPolarHBondContact OG-CG 3.44Å; S180-L183 PolarHBondContact OG-N 3.07Å; S180-R184 WeakPolarHBondContact O-CG 3.19Å; S180-R184 PolarHBondContact O-N 2.92Å; S180-D320 WeakPolarHBondContact CA-OD1 3.24Å; S180-D320 VanDerWaalsContact CB-OD1 3.3Å; S180-D320 WeakPolarHBondContact CB-OD1 3.46Å
181	K	94.8	Very high	95.2	Very high	82 Å²	82	43.3 Å²	43.3	36%	0.357	21%	0.206	S	C	.	.	H	α-helix	trans	-68.8	-34.5	177.3	-171.4	-179.7	178.3	-168.1	0	110.8	E137 F143 R184 N185 D320	E137-K181 VanDerWaalsContact CD-NZ 3.27Å; E137-K181 WeakPolarHBondContact OE1-CE 3.39Å; E137-K181 IonicContact OE1-NZ 3.59Å; E137-K181 PolarHBondContact OE1-NZ 2.89Å; E137-K181 IonicContact OE2-NZ 3.1Å; E137-K181 PolarHBondContact OE2-NZ 2.84Å; F143-K181 HydrophobicContact CD2-CB 4.15Å; F143-K181 HydrophobicContact CD2-CD 4.1Å; F143-K181 HydrophobicContact CD2-CG 4.06Å; K181-R184 PolarHBondContact O-N 3.46Å; K181-N185 WeakPolarHBondContact O-CB 3.28Å; K181-N185 PolarHBondContact O-N 3.26Å; K181-D320 PolarHBondContact N-OD1 3.01Å
182	Y	95.3	Very high	95.3	Very high	24 Å²	24	43.4 Å²	43.4	9%	0.094	21%	0.208	C	C	.	.	H	α-helix	trans	-56.9	-51.4	175.1	175.4	-81	0	0	0	112.4	R134 F143 Y147 H171 S180 N185 K186 D320	R134-Y182 WeakPolarHBondContact O-CE2 3.07Å; F143-Y182 HydrophobicContact CE1-CD2 4.25Å; F143-Y182 HydrophobicContact CZ-CD2 4.33Å; Y147-Y182 HydrophobicContact CE1-CE2 4.45Å; Y147-Y182 AromaticContact CE2-CD2 3.65Å; Y147-Y182 HydrophobicContact CE2-CD2 3.65Å; Y147-Y182 AromaticContact CE2-CE2 3.89Å; Y147-Y182 HydrophobicContact CE2-CE2 3.89Å; Y147-Y182 HydrophobicContact CE2-CG 4.35Å; Y147-Y182 AromaticContact CZ-CD2 3.8Å; Y147-Y182 AromaticContact CZ-CE2 3.5Å; Y147-Y182 WeakPolarHBondContact OH-CD2 3.48Å; Y147-Y182 WeakPolarHBondContact OH-CE2 3.41Å; H171-Y182 AromaticContact CD2-CE1 3.99Å; S180-Y182 VanDerWaalsContact C-N 3.31Å; Y182-N185 PolarHBondContact O-N 3.36Å; Y182-K186 HydrophobicContact CD1-CD 4.21Å; Y182-K186 HydrophobicContact CE1-CD 3.54Å; Y182-K186 VanDerWaalsContact CE1-CE 3.48Å; Y182-K186 HydrophobicContact CE1-CG 4.43Å; Y182-K186 PolarHBondContact O-N 2.9Å; Y182-K186 WeakPolarHBondContact OH-CE 3.35Å; Y182-D320 WeakPolarHBondContact CB-OD1 3.35Å; Y182-D320 WeakPolarHBondContact CB-OD2 3.39Å; Y182-D320 PolarHBondContact N-OD1 2.9Å
183	L	96.1	Very high	95.4	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-70.3	-35.3	-177	-64.4	174.4	0	0	0	111.7	H171 N173 S178 S180 K186 A187	H171-L183 HydrophobicContact CB-CD2 4.02Å; N173-L183 HydrophobicContact CB-CD1 3.78Å; N173-L183 HydrophobicContact CB-CD2 4.18Å; N173-L183 WeakPolarHBondContact O-CD1 3.17Å; S178-L183 WeakPolarHBondContact OG-CD1 3.26Å; S180-L183 WeakPolarHBondContact OG-CB 3.35Å; S180-L183 WeakPolarHBondContact OG-CD1 3.38Å; S180-L183 WeakPolarHBondContact OG-CG 3.44Å; S180-L183 PolarHBondContact OG-N 3.07Å; L183-K186 PolarHBondContact O-N 3.49Å; L183-A187 PolarHBondContact O-N 3.19Å; L183-A187 VanDerWaalsContact O-N 3.08Å
184	R	96.7	Very high	95.4	Very high	107 Å²	107	46.6 Å²	46.6	40%	0.404	22%	0.22	S	C	.	.	H	α-helix	trans	-61.7	-48.8	174.3	-72.1	-170.4	-76	167.5	-3.5	111.9	D175 I176 S178 S180 K181 K186 A187 V188	D175-R184 WeakPolarHBondContact O-CA 3.32Å; I176-R184 WeakPolarHBondContact O-CD 3.46Å; I176-R184 VanDerWaalsContact O-CG 3.27Å; I176-R184 WeakPolarHBondContact O-CG 3.32Å; S178-R184 WeakPolarHBondContact O-CD 3.07Å; S178-R184 WeakPolarHBondContact O-CG 3.2Å; S178-R184 PolarHBondContact O-NE 3.18Å; S180-R184 WeakPolarHBondContact O-CG 3.19Å; S180-R184 PolarHBondContact O-N 2.92Å; K181-R184 PolarHBondContact O-N 3.46Å; R184-K186 VanDerWaalsContact C-N 3.3Å; R184-K186 PolarHBondContact O-N 3.33Å; R184-A187 WeakPolarHBondContact O-CB 3.34Å; R184-A187 PolarHBondContact O-N 3.11Å; R184-A187 VanDerWaalsContact O-N 3.09Å; R184-V188 PolarHBondContact O-N 2.88Å
185	N	97.1	Very high	95.5	Very high	25 Å²	25	53.3 Å²	53.3	13%	0.134	25%	0.25	C	S	.	.	H	α-helix	trans	-68.4	-30.5	-179.6	-73.9	-13.8	0	0	0	112.5	F143 E144 Y147 K181 Y182 V188 G189	F143-N185 HydrophobicContact CB-CB 4.44Å; F143-N185 WeakPolarHBondContact CB-ND2 3.33Å; E144-N185 PolarHBondContact N-ND2 2.61Å; Y147-N185 HydrophobicContact CD2-CB 4.25Å; K181-N185 WeakPolarHBondContact O-CB 3.28Å; K181-N185 PolarHBondContact O-N 3.26Å; Y182-N185 PolarHBondContact O-N 3.36Å; N185-V188 PolarHBondContact O-N 2.96Å; N185-G189 PolarHBondContact O-N 3.15Å
186	K	96.4	Very high	95.6	Very high	11 Å²	11	52.4 Å²	52.4	5%	0.048	24%	0.244	C	C	.	.	H	α-helix	trans	-64.9	-36.9	169.2	-85.2	-171.8	169.6	-80	0	112.9	Y147 V169 S170 H171 A174 Y182 L183 R184 G189 E190	Y147-K186 HydrophobicContact CD1-CG 3.74Å; Y147-K186 HydrophobicContact CD2-CG 4.48Å; Y147-K186 HydrophobicContact CE1-CD 4.46Å; Y147-K186 HydrophobicContact CE1-CG 4.07Å; Y147-K186 HydrophobicContact CG-CG 3.99Å; V169-K186 PolarHBondContact O-NZ 2.87Å; S170-K186 PolarHBondContact O-NZ 2.88Å; S170-K186 VanDerWaalsContact O-NZ 3.16Å; H171-K186 HydrophobicContact CB-CD 3.78Å; A174-K186 HydrophobicContact CB-CB 4.09Å; Y182-K186 HydrophobicContact CD1-CD 4.21Å; Y182-K186 HydrophobicContact CE1-CD 3.54Å; Y182-K186 VanDerWaalsContact CE1-CE 3.48Å; Y182-K186 HydrophobicContact CE1-CG 4.43Å; Y182-K186 PolarHBondContact O-N 2.9Å; Y182-K186 WeakPolarHBondContact OH-CE 3.35Å; L183-K186 PolarHBondContact O-N 3.49Å; R184-K186 VanDerWaalsContact C-N 3.3Å; R184-K186 PolarHBondContact O-N 3.33Å; K186-G189 PolarHBondContact O-N 2.86Å; K186-E190 WeakPolarHBondContact O-CB 3.49Å; K186-E190 PolarHBondContact O-N 3.25Å
187	A	96.5	Very high	95.7	Very high	8 Å²	8	48.7 Å²	48.7	7%	0.066	22%	0.224	C	C	.	.	H	α-helix	trans	-66.1	-41.8	175	0	0	0	0	0	111.6	A174 I176 L183 R184 E190 M191	A174-A187 HydrophobicContact CB-CB 4.34Å; I176-A187 HydrophobicContact CG1-CB 3.89Å; L183-A187 PolarHBondContact O-N 3.19Å; L183-A187 VanDerWaalsContact O-N 3.08Å; R184-A187 WeakPolarHBondContact O-CB 3.34Å; R184-A187 PolarHBondContact O-N 3.11Å; R184-A187 VanDerWaalsContact O-N 3.09Å; A187-E190 WeakPolarHBondContact O-CB 3.28Å; A187-E190 PolarHBondContact O-N 3.19Å; A187-M191 WeakPolarHBondContact O-CG 3.42Å; A187-M191 PolarHBondContact O-N 2.97Å
188	V	97.5	Very high	95.7	Very high	52 Å²	52	41.8 Å²	41.8	32%	0.315	21%	0.209	S	C	.	.	H	α-helix	trans	-64.3	-44.1	174	179.7	0	0	0	0	111.4	V148 R184 N185 E190 M191 A192	V148-V188 HydrophobicContact CG1-CG1 3.95Å; V148-V188 HydrophobicContact CG2-CB 3.98Å; V148-V188 HydrophobicContact CG2-CG1 3.74Å; R184-V188 PolarHBondContact O-N 2.88Å; N185-V188 PolarHBondContact O-N 2.96Å; V188-E190 VanDerWaalsContact C-N 3.31Å; V188-E190 PolarHBondContact O-N 3.35Å; V188-M191 HydrophobicContact CB-CE 4.5Å; V188-M191 HydrophobicContact CG2-CE 4.33Å; V188-M191 PolarHBondContact O-N 3.35Å; V188-A192 PolarHBondContact O-N 3.29Å
189	G	96.7	Very high	95.8	Very high	0 Å²	0	45.8 Å²	45.8	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-60.1	-39.2	175.7	0	0	0	0	0	113.3	Y147 N185 K186 M191 A192 V193	Y147-G189 WeakPolarHBondContact O-CA 3.43Å; N185-G189 PolarHBondContact O-N 3.15Å; K186-G189 PolarHBondContact O-N 2.86Å; G189-M191 PolarHBondContact O-N 3.5Å; G189-A192 PolarHBondContact O-N 3.1Å; G189-V193 WeakPolarHBondContact O-CB 3.36Å; G189-V193 VanDerWaalsContact O-CG2 3.25Å; G189-V193 WeakPolarHBondContact O-CG2 3.4Å; G189-V193 PolarHBondContact O-N 3.31Å
190	E	96.4	Very high	96.1	Very high	30 Å²	30	41.8 Å²	41.8	14%	0.14	20%	0.204	C	C	.	.	H	α-helix	trans	-59.6	-45.6	175.1	-170.7	-178.7	151.7	0	0	112	K186 A187 V188 R194 I202 K204	K186-E190 WeakPolarHBondContact O-CB 3.49Å; K186-E190 PolarHBondContact O-N 3.25Å; A187-E190 WeakPolarHBondContact O-CB 3.28Å; A187-E190 PolarHBondContact O-N 3.19Å; V188-E190 VanDerWaalsContact C-N 3.31Å; V188-E190 PolarHBondContact O-N 3.35Å; E190-R194 VanDerWaalsContact O-CB 3.28Å; E190-R194 WeakPolarHBondContact O-CB 3.16Å; E190-R194 PolarHBondContact O-N 2.78Å; E190-I202 HydrophobicContact CG-CD1 3.43Å; E190-I202 VanDerWaalsContact CG-CD1 3.43Å; E190-I202 HydrophobicContact CG-CG2 3.84Å; E190-K204 WeakPolarHBondContact OE1-CE 3.44Å; E190-K204 IonicContact OE1-NZ 3.19Å; E190-K204 PolarHBondContact OE1-NZ 3.08Å; E190-K204 WeakPolarHBondContact OE2-CE 3.24Å; E190-K204 IonicContact OE2-NZ 3.15Å; E190-K204 PolarHBondContact OE2-NZ 2.73Å
191	M	96.7	Very high	96.3	Very high	85 Å²	85	41.8 Å²	41.8	42%	0.419	20%	0.204	S	C	.	.	H	α-helix	trans	-65.6	-46.7	176.3	-64.5	-175.7	-62.2	0	0	111.2	I176 A187 V188 G189 V193 R194 E195	I176-M191 HydrophobicContact CD1-CE 3.61Å; I176-M191 HydrophobicContact CD1-SD 4.11Å; I176-M191 HydrophobicContact CG1-CE 4.31Å; A187-M191 WeakPolarHBondContact O-CG 3.42Å; A187-M191 PolarHBondContact O-N 2.97Å; V188-M191 HydrophobicContact CB-CE 4.5Å; V188-M191 HydrophobicContact CG2-CE 4.33Å; V188-M191 PolarHBondContact O-N 3.35Å; G189-M191 PolarHBondContact O-N 3.5Å; M191-V193 PolarHBondContact O-N 2.75Å; M191-R194 WeakPolarHBondContact O-CB 3.23Å; M191-R194 PolarHBondContact O-N 3.09Å; M191-R194 VanDerWaalsContact O-N 3.1Å; M191-E195 WeakPolarHBondContact O-CG 3.26Å; M191-E195 PolarHBondContact O-N 3.1Å
192	A	97.1	Very high	96.4	Very high	9 Å²	9	37.9 Å²	37.9	7%	0.074	19%	0.187	C	C	.	.	H	α-helix	trans	-62.3	-41	-179.7	0	0	0	0	0	112.8	V148 Q152 V188 G189 R194 E195 E196	V148-A192 HydrophobicContact CG1-CB 4.4Å; Q152-A192 HydrophobicContact CB-CB 4.41Å; Q152-A192 HydrophobicContact CG-CB 4.49Å; V188-A192 PolarHBondContact O-N 3.29Å; G189-A192 PolarHBondContact O-N 3.1Å; A192-R194 VanDerWaalsContact C-N 3.33Å; A192-E195 PolarHBondContact O-N 3.21Å; A192-E196 PolarHBondContact O-N 3.15Å; A192-E196 VanDerWaalsContact O-N 3.14Å
193	V	97.2	Very high	96.5	Very high	2 Å²	2	36.8 Å²	36.8	1%	0.012	18%	0.182	C	C	.	.	H	α-helix	trans	-65.1	-40.5	174.4	170.1	0	0	0	0	110.6	P151 A155 L166 H168 G189 M191 E196 F197 A200	P151-V193 HydrophobicContact CB-CG2 3.53Å; A155-V193 HydrophobicContact CB-CG1 4.29Å; L166-V193 HydrophobicContact CD2-CG1 4.08Å; H168-V193 HydrophobicContact CB-CG1 4.08Å; G189-V193 WeakPolarHBondContact O-CB 3.36Å; G189-V193 VanDerWaalsContact O-CG2 3.25Å; G189-V193 WeakPolarHBondContact O-CG2 3.4Å; G189-V193 PolarHBondContact O-N 3.31Å; M191-V193 PolarHBondContact O-N 2.75Å; V193-E196 PolarHBondContact O-N 2.99Å; V193-F197 PolarHBondContact O-N 3.26Å; V193-A200 HydrophobicContact CG1-CB 3.89Å
194	R	96.4	Very high	96.5	Very high	68 Å²	68	37.7 Å²	37.7	26%	0.257	19%	0.186	S	C	.	.	H	α-helix	trans	-66.1	-38.4	178.8	-173.8	64.3	66	146	8.5	112.5	E190 M191 A192 F197 P198 I202 G263 T265	E190-R194 VanDerWaalsContact O-CB 3.28Å; E190-R194 WeakPolarHBondContact O-CB 3.16Å; E190-R194 PolarHBondContact O-N 2.78Å; M191-R194 WeakPolarHBondContact O-CB 3.23Å; M191-R194 PolarHBondContact O-N 3.09Å; M191-R194 VanDerWaalsContact O-N 3.1Å; A192-R194 VanDerWaalsContact C-N 3.33Å; R194-F197 CarbonylContact O-C 3.58Å; R194-P198 WeakPolarHBondContact CD-O 3.31Å; R194-P198 PolarHBondContact NH1-O 3.1Å; R194-P198 VanDerWaalsContact O-CA 3.29Å; R194-P198 WeakPolarHBondContact O-CA 3.4Å; R194-I202 VanDerWaalsContact NH2-CD1 3.28Å; R194-G263 PolarHBondContact NH1-O 3.18Å; R194-T265 PolarHBondContact NH2-OG1 3.44Å
195	E	96.3	Very high	96.5	Very high	148 Å²	148	32.7 Å²	32.7	69%	0.692	17%	0.168	S	C	*	.	H	α-helix	trans	-66.4	-43.7	176.9	-74.5	173.5	-172.9	0	0	111.7	M191 A192	M191-E195 WeakPolarHBondContact O-CG 3.26Å; M191-E195 PolarHBondContact O-N 3.1Å; A192-E195 PolarHBondContact O-N 3.21Å
196	E	96	Very high	96.4	Very high	37 Å²	37	31.6 Å²	31.6	17%	0.173	16%	0.162	C	C	.	.	H	α-helix	trans	-75.7	-35.4	180	-69	-67.1	178.7	0	0	113	Q152 A155 R159 A192 V193	Q152-E196 HydrophobicContact CG-CG 3.73Å; Q152-E196 PolarHBondContact NE2-OE1 3.32Å; A155-E196 HydrophobicContact CB-CB 3.87Å; R159-E196 WeakPolarHBondContact CD-O 3.47Å; R159-E196 IonicContact CZ-OE2 3.57Å; R159-E196 PolarHBondContact NH1-O 3.21Å; R159-E196 IonicContact NH1-OE2 3.94Å; R159-E196 PolarHBondContact NH1-OE2 2.99Å; R159-E196 IonicContact NH2-OE2 3.79Å; A192-E196 PolarHBondContact O-N 3.15Å; A192-E196 VanDerWaalsContact O-N 3.14Å; V193-E196 PolarHBondContact O-N 2.99Å
197	F	95.5	Very high	96.4	Very high	16 Å²	16	31.5 Å²	31.5	7%	0.07	16%	0.162	C	C	.	.			trans	-136.1	89.9	-179.4	-163.8	-84.5	0	0	0	110	A155 T158 R159 I163 L166 V193 R194 D199 A200	A155-F197 HydrophobicContact CB-CB 4.23Å; T158-F197 HydrophobicContact CG2-CE2 4.28Å; R159-F197 HydrophobicContact CB-CD2 4.12Å; I163-F197 WeakPolarHBondContact O-CE2 3.15Å; I163-F197 WeakPolarHBondContact O-CZ 3.49Å; L166-F197 HydrophobicContact CB-CD1 3.83Å; L166-F197 HydrophobicContact CB-CE1 3.84Å; L166-F197 HydrophobicContact CB-CG 4.33Å; L166-F197 HydrophobicContact CB-CZ 4.33Å; L166-F197 HydrophobicContact CD2-CB 3.94Å; L166-F197 HydrophobicContact CD2-CD1 4.13Å; L166-F197 HydrophobicContact CD2-CG 4Å; V193-F197 PolarHBondContact O-N 3.26Å; R194-F197 CarbonylContact O-C 3.58Å; F197-D199 VanDerWaalsContact C-N 3.26Å; F197-D199 HydrophobicContact CD1-CB 4.28Å; F197-D199 HydrophobicContact CE1-CB 3.74Å; F197-D199 HydrophobicContact CZ-CB 4.41Å; F197-D199 PolarHBondContact O-N 2.72Å; F197-A200 HydrophobicContact CB-CB 4.47Å; F197-A200 HydrophobicContact CD1-CB 3.81Å; F197-A200 VanDerWaalsContact CD1-N 3.29Å; F197-A200 WeakPolarHBondContact O-CB 3.39Å; F197-A200 PolarHBondContact O-N 3.37Å
198	P	94.3	Very high	96.4	Very high	80 Å²	80	33.1 Å²	33.1	52%	0.519	17%	0.169	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.7	-34	-175.2	-28.7	36.5	0	0	0	114.7	R194 A200	R194-P198 WeakPolarHBondContact CD-O 3.31Å; R194-P198 PolarHBondContact NH1-O 3.1Å; R194-P198 VanDerWaalsContact O-CA 3.29Å; R194-P198 WeakPolarHBondContact O-CA 3.4Å; P198-A200 PolarHBondContact O-N 3.15Å
199	D	94.8	Very high	96.3	Very high	94 Å²	94	30.7 Å²	30.7	50%	0.503	15%	0.154	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.8	9	-179.5	-63.5	-29.3	0	0	0	113.2	F197 I201 G263	F197-D199 VanDerWaalsContact C-N 3.26Å; F197-D199 HydrophobicContact CD1-CB 4.28Å; F197-D199 HydrophobicContact CE1-CB 3.74Å; F197-D199 HydrophobicContact CZ-CB 4.41Å; F197-D199 PolarHBondContact O-N 2.72Å; D199-I201 PolarHBondContact O-N 3.37Å; D199-G263 PolarHBondContact O-N 2.97Å
200	A	96.6	Very high	96.2	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	16%	0.155	C	C	.	.			trans	-65.6	134.3	-177.1	0	0	0	0	0	110.4	L166 V193 F197 P198	L166-A200 HydrophobicContact CD2-CB 4.27Å; V193-A200 HydrophobicContact CG1-CB 3.89Å; F197-A200 HydrophobicContact CB-CB 4.47Å; F197-A200 HydrophobicContact CD1-CB 3.81Å; F197-A200 VanDerWaalsContact CD1-N 3.29Å; F197-A200 WeakPolarHBondContact O-CB 3.39Å; F197-A200 PolarHBondContact O-N 3.37Å; P198-A200 PolarHBondContact O-N 3.15Å
201	I	97.4	Very high	96.2	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	116.3	174.3	-47.2	-178	0	0	0	107.7	L166 I167 H168 D199 M203 A255 A261 Y266	L166-I201 PolarHBondContact O-N 2.52Å; I167-I201 WeakPolarHBondContact CA-O 3.38Å; I167-I201 HydrophobicContact CG1-CB 4.2Å; I167-I201 HydrophobicContact CG1-CD1 4.18Å; H168-I201 PolarHBondContact N-O 2.92Å; D199-I201 PolarHBondContact O-N 3.37Å; I201-M203 HydrophobicContact CG2-CE 3.71Å; I201-A255 HydrophobicContact CD1-CB 4.5Å; I201-A261 HydrophobicContact CD1-CB 3.77Å; I201-A261 WeakPolarHBondContact CG1-O 3.38Å; I201-Y266 HydrophobicContact CG2-CD2 3.82Å; I201-Y266 HydrophobicContact CG2-CE2 3.74Å
202	I	97.4	Very high	96.1	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	112	-177.2	-57.1	-169.9	0	0	0	109	H168 E190 R194 K204 K264 T265 Y266	H168-I202 WeakPolarHBondContact O-CA 3.43Å; E190-I202 HydrophobicContact CG-CD1 3.43Å; E190-I202 VanDerWaalsContact CG-CD1 3.43Å; E190-I202 HydrophobicContact CG-CG2 3.84Å; R194-I202 VanDerWaalsContact NH2-CD1 3.28Å; I202-K204 HydrophobicContact CG2-CG 4.31Å; I202-K264 PolarHBondContact N-O 3.1Å; I202-T265 HydrophobicContact CB-CG2 4.23Å; I202-T265 HydrophobicContact CG2-CG2 4.22Å; I202-T265 CarbonylContact O-C 3.55Å; I202-T265 VanDerWaalsContact O-CA 3.28Å; I202-T265 WeakPolarHBondContact O-CA 3.19Å; I202-Y266 PolarHBondContact O-N 3.35Å
203	M	96.9	Very high	95.9	Very high	0 Å²	0	35 Å²	35	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	121.9	177.2	-64.2	-67.6	-178.9	0	0	109.3	I167 H168 V169 S170 I201 P205 A255 Y266 L268 L341	I167-M203 HydrophobicContact CG2-CG 3.93Å; H168-M203 PolarHBondContact O-N 2.91Å; V169-M203 CarbonylContact C-O 3.59Å; V169-M203 WeakPolarHBondContact CA-O 3.18Å; V169-M203 HydrophobicContact CG2-CB 4.21Å; S170-M203 PolarHBondContact N-O 2.78Å; I201-M203 HydrophobicContact CG2-CE 3.71Å; M203-P205 VanDerWaalsContact C-CD 3.47Å; M203-P205 WeakPolarHBondContact O-CD 3.29Å; M203-A255 HydrophobicContact CE-CB 3.23Å; M203-Y266 HydrophobicContact CE-CD2 3.69Å; M203-Y266 HydrophobicContact CE-CE2 4.16Å; M203-Y266 HydrophobicContact CE-CG 4.25Å; M203-Y266 VanDerWaalsContact SD-CB 3.58Å; M203-Y266 HydrophobicContact SD-CD2 3.73Å; M203-Y266 HydrophobicContact SD-CG 3.89Å; M203-L268 HydrophobicContact CB-CD1 4.18Å; M203-L268 HydrophobicContact SD-CD1 4Å; M203-L268 HydrophobicContact SD-CD2 4.28Å; M203-L268 HydrophobicContact SD-CG 4.39Å; M203-L341 HydrophobicContact CE-CD1 4.35Å
204	K	96.7	Very high	95.8	Very high	19 Å²	19	38.8 Å²	38.8	8%	0.083	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	82.6	177.5	-64.8	-168	179.5	-168.3	0	110.4	E190 I202 T265 Y266 L268	E190-K204 WeakPolarHBondContact OE1-CE 3.44Å; E190-K204 IonicContact OE1-NZ 3.19Å; E190-K204 PolarHBondContact OE1-NZ 3.08Å; E190-K204 WeakPolarHBondContact OE2-CE 3.24Å; E190-K204 IonicContact OE2-NZ 3.15Å; E190-K204 PolarHBondContact OE2-NZ 2.73Å; I202-K204 HydrophobicContact CG2-CG 4.31Å; K204-T265 HydrophobicContact CD-CG2 3.91Å; K204-T265 HydrophobicContact CG-CG2 4.1Å; K204-Y266 WeakPolarHBondContact CA-O 3.36Å; K204-Y266 WeakPolarHBondContact CB-O 3.39Å; K204-Y266 PolarHBondContact N-O 2.71Å; K204-L268 PolarHBondContact O-N 3.21Å
205	P	96.7	Very high	95.6	Very high	3 Å²	3	35.6 Å²	35.6	2%	0.019	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	144.9	173.4	31	-34.7	0	0	0	111.4	V169 H171 L172 M203 M208 V243 V248 L268	V169-P205 HydrophobicContact CG1-CG 3.77Å; H171-P205 PolarHBondContact ND1-O 2.96Å; L172-P205 PolarHBondContact N-O 2.76Å; M203-P205 VanDerWaalsContact C-CD 3.47Å; M203-P205 WeakPolarHBondContact O-CD 3.29Å; P205-M208 HydrophobicContact CB-CG 4.14Å; P205-M208 HydrophobicContact CB-SD 4.25Å; P205-M208 HydrophobicContact CG-CE 4.33Å; P205-M208 HydrophobicContact CG-SD 4.42Å; P205-V243 HydrophobicContact CB-CG1 4.25Å; P205-V248 HydrophobicContact CB-CG1 4.42Å; P205-V248 HydrophobicContact CB-CG2 4.25Å; P205-L268 WeakPolarHBondContact CA-O 3.16Å; P205-L268 HydrophobicContact CB-CB 4.41Å
206	A	95.4	Very high	95.5	Very high	2 Å²	2	28.6 Å²	28.6	2%	0.017	14%	0.135	C	C	.	.			trans	-67.3	-176.7	159.7	0	0	0	0	0	110.7	L172 M208 Q241 V243 L268	L172-A206 HydrophobicContact CD2-CB 3.98Å; A206-M208 PolarHBondContact O-N 2.91Å; A206-M208 VanDerWaalsContact O-N 3.07Å; A206-Q241 WeakPolarHBondContact CB-O 3.27Å; A206-V243 HydrophobicContact CB-CB 4.42Å; A206-V243 HydrophobicContact CB-CG1 4.2Å; A206-L268 PolarHBondContact N-O 3.04Å
207	E	95.3	Very high	95.5	Very high	9 Å²	9	27.1 Å²	27.1	4%	0.042	13%	0.129	C	C	.	.	S	Bend	trans	-57.6	118.6	175	-75.4	-68.6	179.5	0	0	110.5	H171 F215 P242 V243 R324	H171-E207 IonicContact NE2-OE1 3.66Å; E207-F215 HydrophobicContact CB-CD1 4.12Å; E207-F215 HydrophobicContact CB-CE1 4.21Å; E207-F215 HydrophobicContact CB-CG 4.33Å; E207-F215 HydrophobicContact CB-CZ 4.47Å; E207-F215 HydrophobicContact CG-CE2 4.46Å; E207-P242 CarbonylContact O-C 3.56Å; E207-P242 WeakPolarHBondContact O-CA 2.9Å; E207-P242 WeakPolarHBondContact O-CB 3.31Å; E207-V243 PolarHBondContact O-N 2.82Å; E207-R324 WeakPolarHBondContact OE1-CD 3.15Å; E207-R324 WeakPolarHBondContact OE1-CG 3.21Å; E207-R324 IonicContact OE1-CZ 2.82Å; E207-R324 IonicContact OE1-NE 2.71Å; E207-R324 IonicContact OE1-NH1 3.01Å; E207-R324 PolarHBondContact OE1-NH1 2.81Å; E207-R324 IonicContact OE2-NH1 3.73Å; E207-R324 PolarHBondContact OE2-NH1 2.95Å; E207-R324 VanDerWaalsContact OE2-NH1 3.1Å
208	M	96.3	Very high	95.4	Very high	42 Å²	42	26.6 Å²	26.6	21%	0.207	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	133.8	-175	-68.9	178.5	-77.3	0	0	110.7	F66 L67 P205 A206 V243 V248	F66-M208 HydrophobicContact CE1-CB 4.08Å; L67-M208 HydrophobicContact CD1-SD 4.23Å; L67-M208 HydrophobicContact CD2-CE 4.23Å; L67-M208 HydrophobicContact CD2-SD 4.02Å; P205-M208 HydrophobicContact CB-CG 4.14Å; P205-M208 HydrophobicContact CB-SD 4.25Å; P205-M208 HydrophobicContact CG-CE 4.33Å; P205-M208 HydrophobicContact CG-SD 4.42Å; A206-M208 PolarHBondContact O-N 2.91Å; A206-M208 VanDerWaalsContact O-N 3.07Å; M208-V243 CarbonylContact C-O 3.53Å; M208-V243 VanDerWaalsContact CA-O 3.26Å; M208-V243 WeakPolarHBondContact CA-O 3.37Å; M208-V243 HydrophobicContact CG-CG1 3.78Å; M208-V248 HydrophobicContact CG-CG2 4.23Å; M208-V248 HydrophobicContact SD-CB 4.36Å; M208-V248 HydrophobicContact SD-CG1 4.1Å; M208-V248 HydrophobicContact SD-CG2 4.21Å
209	F	96.4	Very high	95.3	Very high	0 Å²	0	22.9 Å²	22.9	0%	0	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	148.9	171.6	77.2	-83.9	0	0	0	111.9	D213 F216 P242 V243 H244 V245 V348 K351	F209-D213 WeakPolarHBondContact CA-OD2 3.43Å; F209-F216 HydrophobicContact CB-CD1 4.02Å; F209-F216 HydrophobicContact CB-CD2 4.04Å; F209-F216 HydrophobicContact CB-CE1 3.91Å; F209-F216 HydrophobicContact CB-CE2 3.94Å; F209-F216 HydrophobicContact CB-CG 4.08Å; F209-F216 HydrophobicContact CB-CZ 3.86Å; F209-F216 HydrophobicContact CD1-CZ 4.3Å; F209-F216 HydrophobicContact CD2-CD2 4.21Å; F209-F216 AromaticContact CD2-CE2 3.72Å; F209-F216 HydrophobicContact CD2-CE2 3.72Å; F209-F216 HydrophobicContact CD2-CZ 4.14Å; F209-F216 HydrophobicContact CE2-CE2 4.39Å; F209-F216 HydrophobicContact CG-CD2 4.39Å; F209-F216 HydrophobicContact CG-CE1 4.36Å; F209-F216 AromaticContact CG-CE2 3.87Å; F209-F216 HydrophobicContact CG-CE2 3.87Å; F209-F216 AromaticContact CG-CZ 3.85Å; F209-F216 HydrophobicContact CG-CZ 3.85Å; F209-P242 HydrophobicContact CD1-CB 3.99Å; F209-V243 VanDerWaalsContact CD1-C 3.49Å; F209-V243 VanDerWaalsContact CD1-O 3.23Å; F209-V243 WeakPolarHBondContact CD1-O 3.46Å; F209-V243 PolarHBondContact N-O 3.07Å; F209-H244 HydrophobicContact CE1-CB 3.81Å; F209-H244 HydrophobicContact CE2-CB 4.39Å; F209-H244 AromaticContact CE2-CD2 3.75Å; F209-H244 HydrophobicContact CZ-CB 3.71Å; F209-H244 AromaticContact CZ-CD2 3.95Å; F209-V245 PolarHBondContact O-N 2.79Å; F209-V348 HydrophobicContact CD1-CG2 4.47Å; F209-V348 HydrophobicContact CE1-CG2 3.88Å; F209-V348 HydrophobicContact CZ-CB 4.46Å; F209-V348 HydrophobicContact CZ-CG2 4.08Å; F209-K351 HydrophobicContact CE2-CB 3.68Å; F209-K351 HydrophobicContact CZ-CB 4.2Å
210	G	95.3	Very high	95.3	Very high	2 Å²	2	18.6 Å²	18.6	2%	0.021	8%	0.08	C	C	.	.	S	Bend	trans	172.1	179.6	-174	0	0	0	0	0	110.8	E212 D213 V355	G210-E212 VanDerWaalsContact C-N 3.33Å; G210-E212 PolarHBondContact O-N 2.84Å; G210-D213 VanDerWaalsContact O-CB 3.29Å; G210-D213 WeakPolarHBondContact O-CB 3.42Å; G210-D213 VanDerWaalsContact O-CG 3.27Å; G210-D213 PolarHBondContact O-N 3.16Å; G210-D213 VanDerWaalsContact O-N 3.11Å; G210-V355 WeakPolarHBondContact O-CG1 3.34Å; G210-V355 WeakPolarHBondContact O-CG2 3.45Å
211	R	95.2	Very high	95.1	Very high	133 Å²	133	19.6 Å²	19.6	50%	0.502	9%	0.085	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60	-40	-167.5	-66	-171.6	-178.2	115	3.7	113.8	N217 E354	R211-N217 PolarHBondContact O-ND2 2.8Å; R211-E354 IonicContact CZ-OE2 2.93Å; R211-E354 IonicContact NE-OE2 3.15Å; R211-E354 IonicContact NH2-OE2 3.84Å; R211-E354 PolarHBondContact NH2-OE2 3.09Å
212	E	94.1	Very high	94.8	Very high	75 Å²	75	19.8 Å²	19.8	35%	0.35	9%	0.086	S	C	.	.	T	Hydrogen-bonded Turn	trans	-106.9	23.6	179.9	-43.1	91.6	146	0	0	112.4	F66 R69 Y70 G210	F66-E212 HydrophobicContact CD2-CB 3.97Å; F66-E212 HydrophobicContact CE2-CB 4.31Å; R69-E212 IonicContact CZ-OE1 3.34Å; R69-E212 VanDerWaalsContact NH1-CD 3.34Å; R69-E212 IonicContact NH1-OE1 3.23Å; R69-E212 PolarHBondContact NH1-OE1 3.31Å; Y70-E212 PolarHBondContact OH-OE2 3.05Å; G210-E212 VanDerWaalsContact C-N 3.33Å; G210-E212 PolarHBondContact O-N 2.84Å
213	D	94.8	Very high	94.2	Very high	4 Å²	4	22.3 Å²	22.3	2%	0.021	10%	0.096	C	C	.	.			trans	-62.7	163.9	179	81.2	-17.2	0	0	0	112	F66 F209 G210 F216 N217	F66-D213 HydrophobicContact CE1-CB 4.22Å; F66-D213 HydrophobicContact CE2-CB 4.3Å; F66-D213 HydrophobicContact CZ-CB 3.84Å; F209-D213 WeakPolarHBondContact CA-OD2 3.43Å; G210-D213 VanDerWaalsContact O-CB 3.29Å; G210-D213 WeakPolarHBondContact O-CB 3.42Å; G210-D213 VanDerWaalsContact O-CG 3.27Å; G210-D213 PolarHBondContact O-N 3.16Å; G210-D213 VanDerWaalsContact O-N 3.11Å; D213-F216 PolarHBondContact OD1-N 2.86Å; D213-F216 VanDerWaalsContact OD2-CB 3.24Å; D213-F216 WeakPolarHBondContact OD2-CB 3.42Å; D213-F216 PolarHBondContact OD2-N 2.89Å; D213-N217 PolarHBondContact N-ND2 3.11Å; D213-N217 VanDerWaalsContact O-CB 3.27Å; D213-N217 WeakPolarHBondContact O-CB 3.47Å; D213-N217 PolarHBondContact O-ND2 3.26Å; D213-N217 WeakPolarHBondContact OD1-CB 3.33Å; D213-N217 PolarHBondContact OD1-N 3.1Å; D213-N217 PolarHBondContact OD1-ND2 2.99Å
214	R	93.3	Very high	93.8	Very high	82 Å²	82	30.4 Å²	30.4	31%	0.309	13%	0.127	S	C	.	.	S	Bend	trans	-111.9	11.5	176.6	-66.2	-178.2	175.8	-169.8	-10.8	112.3	E135 H218 E314 K321	E135-R214 VanDerWaalsContact CD-CD 3.45Å; E135-R214 WeakPolarHBondContact OE1-CB 3.27Å; E135-R214 WeakPolarHBondContact OE2-CB 3.44Å; E135-R214 VanDerWaalsContact OE2-CD 3.26Å; E135-R214 WeakPolarHBondContact OE2-CD 3.42Å; R214-H218 WeakPolarHBondContact O-CB 3.44Å; R214-E314 IonicContact NH2-OE1 3.14Å; R214-E314 IonicContact NH2-OE2 2.78Å; R214-E314 PolarHBondContact NH2-OE2 3.48Å; R214-E314 VanDerWaalsContact NH2-OE2 3.15Å; R214-K321 PolarHBondContact O-NZ 3.41Å
215	F	93.8	Very high	93.2	Very high	2 Å²	2	34.9 Å²	34.9	1%	0.009	15%	0.146	C	C	.	.	S	Bend	trans	-104.2	-68.3	178.3	-174.2	-126.3	0	0	0	111.1	E207 H218 F219 K240 P242 L279 F325	E207-F215 HydrophobicContact CB-CD1 4.12Å; E207-F215 HydrophobicContact CB-CE1 4.21Å; E207-F215 HydrophobicContact CB-CG 4.33Å; E207-F215 HydrophobicContact CB-CZ 4.47Å; E207-F215 HydrophobicContact CG-CE2 4.46Å; F215-H218 WeakPolarHBondContact O-CB 3.41Å; F215-H218 PolarHBondContact O-N 3.14Å; F215-F219 AromaticContact CD2-CE2 3.92Å; F215-F219 HydrophobicContact CD2-CE2 3.92Å; F215-F219 HydrophobicContact CE2-CD2 4.44Å; F215-F219 AromaticContact CE2-CE2 3.54Å; F215-F219 HydrophobicContact CE2-CE2 3.54Å; F215-F219 HydrophobicContact CE2-CZ 4.35Å; F215-F219 HydrophobicContact CZ-CE2 4.03Å; F215-F219 WeakPolarHBondContact O-CD2 3.4Å; F215-F219 PolarHBondContact O-N 3.48Å; F215-K240 HydrophobicContact CZ-CG 4.41Å; F215-P242 HydrophobicContact CE1-CB 4.27Å; F215-L279 HydrophobicContact CE1-CD2 3.64Å; F215-L279 HydrophobicContact CZ-CD2 3.67Å; F215-F325 AromaticContact CD2-CD1 3.92Å; F215-F325 HydrophobicContact CD2-CD1 3.92Å; F215-F325 AromaticContact CD2-CE1 3.47Å; F215-F325 HydrophobicContact CD2-CE1 3.47Å; F215-F325 VanDerWaalsContact CD2-CE1 3.47Å; F215-F325 HydrophobicContact CD2-CE2 4.39Å; F215-F325 AromaticContact CD2-CZ 3.7Å; F215-F325 HydrophobicContact CD2-CZ 3.7Å; F215-F325 AromaticContact CE2-CD1 3.95Å; F215-F325 HydrophobicContact CE2-CD1 3.95Å; F215-F325 AromaticContact CE2-CE1 3.99Å; F215-F325 HydrophobicContact CE2-CE1 3.99Å; F215-F325 HydrophobicContact CE2-CG 4.36Å; F215-F325 HydrophobicContact CE2-CZ 4.41Å
216	F	94.4	Very high	92.4	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-68.2	-44.9	179.5	-74.2	15.3	0	0	0	111.4	F209 D213 H218 F219 A220 P242 L279 V283 V348 A352 V355 L356	F209-F216 HydrophobicContact CB-CD1 4.02Å; F209-F216 HydrophobicContact CB-CD2 4.04Å; F209-F216 HydrophobicContact CB-CE1 3.91Å; F209-F216 HydrophobicContact CB-CE2 3.94Å; F209-F216 HydrophobicContact CB-CG 4.08Å; F209-F216 HydrophobicContact CB-CZ 3.86Å; F209-F216 HydrophobicContact CD1-CZ 4.3Å; F209-F216 HydrophobicContact CD2-CD2 4.21Å; F209-F216 AromaticContact CD2-CE2 3.72Å; F209-F216 HydrophobicContact CD2-CE2 3.72Å; F209-F216 HydrophobicContact CD2-CZ 4.14Å; F209-F216 HydrophobicContact CE2-CE2 4.39Å; F209-F216 HydrophobicContact CG-CD2 4.39Å; F209-F216 HydrophobicContact CG-CE1 4.36Å; F209-F216 AromaticContact CG-CE2 3.87Å; F209-F216 HydrophobicContact CG-CE2 3.87Å; F209-F216 AromaticContact CG-CZ 3.85Å; F209-F216 HydrophobicContact CG-CZ 3.85Å; D213-F216 PolarHBondContact OD1-N 2.86Å; D213-F216 VanDerWaalsContact OD2-CB 3.24Å; D213-F216 WeakPolarHBondContact OD2-CB 3.42Å; D213-F216 PolarHBondContact OD2-N 2.89Å; F216-H218 PolarHBondContact O-N 3.05Å; F216-F219 PolarHBondContact O-N 3.21Å; F216-A220 WeakPolarHBondContact O-CB 3.27Å; F216-A220 PolarHBondContact O-N 2.73Å; F216-P242 HydrophobicContact CE1-CB 4.45Å; F216-L279 HydrophobicContact CE1-CD2 4.33Å; F216-V283 HydrophobicContact CG-CG2 4.38Å; F216-V348 HydrophobicContact CE2-CG1 3.74Å; F216-V348 HydrophobicContact CZ-CG1 3.6Å; F216-V348 HydrophobicContact CZ-CG2 4.3Å; F216-A352 HydrophobicContact CE2-CB 4.41Å; F216-V355 HydrophobicContact CB-CG1 4.38Å; F216-L356 HydrophobicContact CB-CD2 4.33Å
217	N	95.1	Very high	91.6	Very high	7 Å²	7	39 Å²	39	4%	0.037	18%	0.18	C	C	.	.	H	α-helix	trans	-60.3	-28.7	174.3	-74.4	-44.7	0	0	0	112.6	R211 D213 N221 R358 H359	R211-N217 PolarHBondContact O-ND2 2.8Å; D213-N217 PolarHBondContact N-ND2 3.11Å; D213-N217 VanDerWaalsContact O-CB 3.27Å; D213-N217 WeakPolarHBondContact O-CB 3.47Å; D213-N217 PolarHBondContact O-ND2 3.26Å; D213-N217 WeakPolarHBondContact OD1-CB 3.33Å; D213-N217 PolarHBondContact OD1-N 3.1Å; D213-N217 PolarHBondContact OD1-ND2 2.99Å; N217-N221 WeakPolarHBondContact O-CB 3.35Å; N217-N221 PolarHBondContact O-N 3.35Å; N217-N221 PolarHBondContact O-ND2 2.89Å; N217-N221 VanDerWaalsContact O-ND2 3.16Å; N217-R358 VanDerWaalsContact CG-NH2 3.3Å; N217-R358 VanDerWaalsContact OD1-CZ 3.23Å; N217-R358 PolarHBondContact OD1-NE 3.26Å; N217-R358 PolarHBondContact OD1-NH2 3.03Å; N217-R358 VanDerWaalsContact OD1-NH2 3.07Å; N217-H359 PolarHBondContact OD1-NE2 3.36Å
218	H	93.4	Very high	91.2	Very high	5 Å²	5	40.4 Å²	40.4	2%	0.023	19%	0.194	C	C	.	.	H	α-helix	trans	-66.5	-50.4	175.5	172.5	93.7	0	0	0	110.8	R214 F215 F216 A220 N221 M222 W316 T317 F325	R214-H218 WeakPolarHBondContact O-CB 3.44Å; F215-H218 WeakPolarHBondContact O-CB 3.41Å; F215-H218 PolarHBondContact O-N 3.14Å; F216-H218 PolarHBondContact O-N 3.05Å; H218-A220 VanDerWaalsContact C-N 3.34Å; H218-A220 PolarHBondContact O-N 3.13Å; H218-N221 PolarHBondContact O-N 2.91Å; H218-M222 PolarHBondContact O-N 3.07Å; H218-W316 AromaticContact CE1-CE2 3.61Å; H218-W316 AromaticContact CE1-CZ2 3.58Å; H218-W316 AromaticContact ND1-CD1 3.99Å; H218-W316 AromaticContact ND1-CE2 3.51Å; H218-W316 AromaticContact ND1-CZ2 3.8Å; H218-W316 AromaticContact ND1-NE1 3.42Å; H218-W316 PolarHBondContact ND1-NE1 3.38Å; H218-W316 PolarHBondContact ND1-O 3.38Å; H218-W316 AromaticContact NE2-CZ2 3.98Å; H218-T317 PolarHBondContact CE1-OG1 3.03Å; H218-F325 HydrophobicContact CB-CE2 4.43Å; H218-F325 AromaticContact CD2-CE2 3.44Å; H218-F325 VanDerWaalsContact CD2-CE2 3.44Å; H218-F325 WeakPolarHBondContact CD2-CE2 3.24Å; H218-F325 AromaticContact CG-CE2 3.89Å; H218-F325 AromaticContact NE2-CE2 3.74Å
219	F	93.1	Very high	90.9	Very high	2 Å²	2	38.4 Å²	38.4	1%	0.009	18%	0.184	C	C	.	.	H	α-helix	trans	-64.3	-38.1	175.8	-69.7	-62	0	0	0	112.8	F215 F216 M222 L231 L276 V280 V283 Y284 F325	F215-F219 AromaticContact CD2-CE2 3.92Å; F215-F219 HydrophobicContact CD2-CE2 3.92Å; F215-F219 HydrophobicContact CE2-CD2 4.44Å; F215-F219 AromaticContact CE2-CE2 3.54Å; F215-F219 HydrophobicContact CE2-CE2 3.54Å; F215-F219 HydrophobicContact CE2-CZ 4.35Å; F215-F219 HydrophobicContact CZ-CE2 4.03Å; F215-F219 WeakPolarHBondContact O-CD2 3.4Å; F215-F219 PolarHBondContact O-N 3.48Å; F216-F219 PolarHBondContact O-N 3.21Å; F219-M222 VanDerWaalsContact O-CB 3.28Å; F219-M222 WeakPolarHBondContact O-CB 3.32Å; F219-M222 PolarHBondContact O-N 3.14Å; F219-L231 HydrophobicContact CE1-CD2 4.21Å; F219-L276 HydrophobicContact CE2-CD1 4.26Å; F219-L276 HydrophobicContact CZ-CD1 3.96Å; F219-V280 HydrophobicContact CD1-CG1 4.19Å; F219-V280 HydrophobicContact CD1-CG2 3.72Å; F219-V280 HydrophobicContact CD2-CG2 4.03Å; F219-V280 HydrophobicContact CE1-CG2 3.73Å; F219-V280 HydrophobicContact CE2-CG2 4.02Å; F219-V280 HydrophobicContact CG-CG1 4.44Å; F219-V280 HydrophobicContact CG-CG2 3.88Å; F219-V280 HydrophobicContact CZ-CG2 3.89Å; F219-V283 HydrophobicContact CB-CG1 4.29Å; F219-Y284 PolarHBondContact O-OH 2.87Å; F219-F325 HydrophobicContact CZ-CD2 4.02Å; F219-F325 HydrophobicContact CZ-CE2 4.45Å
220	A	93.1	Very high	90.6	Very high	4 Å²	4	39 Å²	39	3%	0.033	19%	0.187	C	C	.	.	H	α-helix	trans	-68.8	-33.3	178.2	0	0	0	0	0	112.9	F216 H218 M222 R223 V283 L356 H359	F216-A220 WeakPolarHBondContact O-CB 3.27Å; F216-A220 PolarHBondContact O-N 2.73Å; H218-A220 VanDerWaalsContact C-N 3.34Å; H218-A220 PolarHBondContact O-N 3.13Å; A220-M222 VanDerWaalsContact C-N 3.31Å; A220-R223 WeakPolarHBondContact O-CD 3.5Å; A220-R223 WeakPolarHBondContact O-CG 3.3Å; A220-V283 HydrophobicContact CB-CG1 4.23Å; A220-L356 HydrophobicContact CB-CD2 3.79Å; A220-H359 HydrophobicContact CB-CB 4.3Å; A220-H359 WeakPolarHBondContact CB-CD2 3.29Å
221	N	92.8	Very high	90.4	Very high	21 Å²	21	38.9 Å²	38.9	11%	0.112	19%	0.186	C	C	.	.	H	α-helix	trans	-75.1	-19.8	175.6	-78.4	-22.6	0	0	0	113.3	N217 H218 R223 W224 H359	N217-N221 WeakPolarHBondContact O-CB 3.35Å; N217-N221 PolarHBondContact O-N 3.35Å; N217-N221 PolarHBondContact O-ND2 2.89Å; N217-N221 VanDerWaalsContact O-ND2 3.16Å; H218-N221 PolarHBondContact O-N 2.91Å; N221-R223 PolarHBondContact O-N 2.85Å; N221-W224 HydrophobicContact CB-CE3 3.77Å; N221-W224 HydrophobicContact CB-CH2 4.24Å; N221-W224 HydrophobicContact CB-CZ3 3.61Å; N221-W224 VanDerWaalsContact CG-CZ3 3.4Å; N221-W224 PolarHBondContact O-N 3.2Å; N221-W224 VanDerWaalsContact OD1-CH2 3.27Å; N221-W224 WeakPolarHBondContact OD1-CH2 3.35Å; N221-H359 PolarHBondContact OD1-CE1 3.42Å
222	M	90.3	Very high	90.1	Very high	4 Å²	4	33 Å²	33	2%	0.02	17%	0.165	C	C	.	.	G	3₁₀ helix	trans	-59.5	-20.3	178.2	-162.9	165.2	-130.4	0	0	112.9	H218 F219 A220 W224 F225 V229 P230 W316	H218-M222 PolarHBondContact O-N 3.07Å; F219-M222 VanDerWaalsContact O-CB 3.28Å; F219-M222 WeakPolarHBondContact O-CB 3.32Å; F219-M222 PolarHBondContact O-N 3.14Å; A220-M222 VanDerWaalsContact C-N 3.31Å; M222-W224 PolarHBondContact O-N 3.06Å; M222-F225 PolarHBondContact O-N 3.01Å; M222-V229 HydrophobicContact SD-CB 4.29Å; M222-V229 HydrophobicContact SD-CG1 3.61Å; M222-V229 HydrophobicContact SD-CG2 4.49Å; M222-P230 HydrophobicContact CE-CG 3.38Å; M222-P230 HydrophobicContact SD-CG 4.41Å; M222-W316 HydrophobicContact CB-CH2 4.11Å; M222-W316 HydrophobicContact CB-CZ2 3.96Å; M222-W316 HydrophobicContact CE-CH2 3.65Å; M222-W316 HydrophobicContact CE-CZ2 4.5Å; M222-W316 HydrophobicContact CE-CZ3 4.46Å; M222-W316 HydrophobicContact CG-CH2 3.84Å; M222-W316 HydrophobicContact CG-CZ2 4.2Å; M222-W316 HydrophobicContact SD-CH2 4.33Å
223	R	86.8	Confident	89.8	Confident	53 Å²	53	32.3 Å²	32.3	20%	0.2	17%	0.169	C	C	.	.	G	3₁₀ helix	trans	-50.6	-25.2	169	75.8	-174.9	178	-173.7	0.8	114.9	A220 N221 G226 Y284 H359	A220-R223 WeakPolarHBondContact O-CD 3.5Å; A220-R223 WeakPolarHBondContact O-CG 3.3Å; N221-R223 PolarHBondContact O-N 2.85Å; R223-G226 CarbonylContact C-O 3.28Å; R223-G226 WeakPolarHBondContact CA-O 3.38Å; R223-G226 PolarHBondContact O-N 3.06Å; R223-Y284 PolarHBondContact N-OH 3.39Å; R223-H359 VanDerWaalsContact CZ-ND1 3.27Å; R223-H359 VanDerWaalsContact NH1-C 3.26Å; R223-H359 PolarHBondContact NH1-ND1 3.41Å; R223-H359 PolarHBondContact NH1-O 3.33Å; R223-H359 PolarHBondContact NH2-ND1 2.69Å
224	W	87	Confident	89.5	Confident	170 Å²	170	34.7 Å²	34.7	64%	0.644	18%	0.18	S	C	*	.	G	3₁₀ helix	trans	-71.7	-24.2	-179.7	-68.4	-43.8	0	0	0	111.8	N221 M222 G226	N221-W224 HydrophobicContact CB-CE3 3.77Å; N221-W224 HydrophobicContact CB-CH2 4.24Å; N221-W224 HydrophobicContact CB-CZ3 3.61Å; N221-W224 VanDerWaalsContact CG-CZ3 3.4Å; N221-W224 PolarHBondContact O-N 3.2Å; N221-W224 VanDerWaalsContact OD1-CH2 3.27Å; N221-W224 WeakPolarHBondContact OD1-CH2 3.35Å; M222-W224 PolarHBondContact O-N 3.06Å; W224-G226 PolarHBondContact O-N 3.07Å
225	F	83.8	Confident	89.1	Confident	112 Å²	112	30.8 Å²	30.8	49%	0.491	17%	0.165	S	C	.	.	G	3₁₀ helix	trans	-86.9	11.6	173.4	-57.5	-73.7	0	0	0	112.6	M222 F308 W316	M222-F225 PolarHBondContact O-N 3.01Å; F225-F308 HydrophobicContact CE1-CE1 4.21Å; F225-F308 AromaticContact CE1-CZ 3.78Å; F225-F308 HydrophobicContact CE1-CZ 3.78Å; F225-F308 HydrophobicContact CZ-CE1 4.05Å; F225-F308 AromaticContact CZ-CZ 3.84Å; F225-F308 HydrophobicContact CZ-CZ 3.84Å; F225-W316 AromaticContact CD2-CH2 3.83Å; F225-W316 HydrophobicContact CD2-CH2 3.83Å; F225-W316 HydrophobicContact CD2-CZ2 4.45Å; F225-W316 AromaticContact CD2-CZ3 3.86Å; F225-W316 HydrophobicContact CD2-CZ3 3.86Å; F225-W316 HydrophobicContact CE2-CD2 4.03Å; F225-W316 AromaticContact CE2-CE3 3.53Å; F225-W316 HydrophobicContact CE2-CE3 3.53Å; F225-W316 AromaticContact CE2-CH2 3.59Å; F225-W316 HydrophobicContact CE2-CH2 3.59Å; F225-W316 HydrophobicContact CE2-CZ2 4.07Å; F225-W316 AromaticContact CE2-CZ3 3.29Å; F225-W316 HydrophobicContact CE2-CZ3 3.29Å; F225-W316 AromaticContact CZ-CE3 3.94Å; F225-W316 HydrophobicContact CZ-CE3 3.94Å; F225-W316 AromaticContact CZ-CZ3 4Å; F225-W316 HydrophobicContact CZ-CZ3 4Å
226	G	81.1	Confident	88.9	Confident	35 Å²	35	36.8 Å²	36.8	36%	0.361	19%	0.191	S	C	.	.			trans	104.5	-170	-177.5	0	0	0	0	0	112.8	R223 W224 A228	R223-G226 CarbonylContact C-O 3.28Å; R223-G226 WeakPolarHBondContact CA-O 3.38Å; R223-G226 PolarHBondContact O-N 3.06Å; W224-G226 PolarHBondContact O-N 3.07Å; G226-A228 PolarHBondContact O-N 3.2Å
227	S	78.1	Confident	88.8	Confident	56 Å²	56	44.7 Å²	44.7	39%	0.392	23%	0.226	S	C	.	.	S	Bend	trans	-79.9	-4.1	178	-48.7	0	0	0	0	113.1	P290 V292	S227-P290 VanDerWaalsContact OG-CG 3.29Å; S227-P290 WeakPolarHBondContact OG-CG 3.46Å; S227-V292 WeakPolarHBondContact O-CB 3.24Å; S227-V292 PolarHBondContact O-N 3.07Å
228	A	86.5	Confident	88.7	Confident	39 Å²	39	44.7 Å²	44.7	32%	0.322	23%	0.226	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91	120.9	-173.2	0	0	0	0	0	110.8	G226 V292 Y294	G226-A228 PolarHBondContact O-N 3.2Å; A228-V292 VanDerWaalsContact CA-O 3.29Å; A228-V292 WeakPolarHBondContact CA-O 3.4Å; A228-Y294 HydrophobicContact CB-CD1 3.8Å; A228-Y294 HydrophobicContact CB-CE1 3.6Å
229	V	90.1	Very high	88.8	Confident	0 Å²	0	44.6 Å²	44.6	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	109.8	-178	-179.2	0	0	0	0	109.5	M222 L231 V280 Y284 F291 V292 P293 Y294	M222-V229 HydrophobicContact SD-CB 4.29Å; M222-V229 HydrophobicContact SD-CG1 3.61Å; M222-V229 HydrophobicContact SD-CG2 4.49Å; V229-L231 HydrophobicContact CG1-CD2 4.33Å; V229-L231 HydrophobicContact CG1-CG 4.12Å; V229-L231 PolarHBondContact O-N 2.97Å; V229-V280 HydrophobicContact CG1-CG1 4.07Å; V229-Y284 HydrophobicContact CG2-CE1 4.2Å; V229-Y284 HydrophobicContact CG2-CE2 3.67Å; V229-Y284 VanDerWaalsContact CG2-CZ 3.47Å; V229-Y284 WeakPolarHBondContact CG2-OH 3.47Å; V229-F291 HydrophobicContact CB-CD2 4.37Å; V229-F291 HydrophobicContact CB-CE2 3.96Å; V229-F291 HydrophobicContact CG1-CE2 4.22Å; V229-F291 HydrophobicContact CG2-CD2 3.92Å; V229-F291 HydrophobicContact CG2-CE2 3.97Å; V229-V292 PolarHBondContact N-O 3.35Å; V229-P293 WeakPolarHBondContact O-CA 3.11Å; V229-Y294 PolarHBondContact O-N 3.33Å
230	P	90.9	Very high	88.9	Confident	12 Å²	12	44.5 Å²	44.5	8%	0.078	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	124	174.4	22.3	-27.5	0	0	0	110.6	M222 Y294 L296	M222-P230 HydrophobicContact CE-CG 3.38Å; M222-P230 HydrophobicContact SD-CG 4.41Å; P230-Y294 HydrophobicContact CB-CE1 3.97Å; P230-Y294 HydrophobicContact CB-CE2 3.78Å; P230-Y294 VanDerWaalsContact CB-CZ 3.45Å; P230-Y294 WeakPolarHBondContact CB-OH 3.39Å; P230-Y294 HydrophobicContact CG-CE1 4.24Å; P230-Y294 WeakPolarHBondContact CG-OH 3.42Å; P230-Y294 VanDerWaalsContact N-CE1 3.31Å; P230-L296 HydrophobicContact CB-CB 3.95Å; P230-L296 HydrophobicContact CB-CD2 3.73Å; P230-L296 HydrophobicContact CB-CG 4.48Å
231	L	90.8	Very high	89	Confident	0 Å²	0	45.3 Å²	45.3	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	138	171.3	-65.6	174.3	0	0	0	109.7	F219 V229 S233 M234 L276 V280 P293 Y294 P295 L296	F219-L231 HydrophobicContact CE1-CD2 4.21Å; V229-L231 HydrophobicContact CG1-CD2 4.33Å; V229-L231 HydrophobicContact CG1-CG 4.12Å; V229-L231 PolarHBondContact O-N 2.97Å; L231-S233 PolarHBondContact O-N 3.37Å; L231-M234 PolarHBondContact O-N 2.96Å; L231-L276 HydrophobicContact CD2-CD2 4.44Å; L231-V280 HydrophobicContact CD2-CG2 4.47Å; L231-P293 HydrophobicContact CD1-CB 4.48Å; L231-Y294 PolarHBondContact N-O 3.23Å; L231-Y294 VanDerWaalsContact N-O 3.09Å; L231-P295 WeakPolarHBondContact O-CA 3.47Å; L231-L296 PolarHBondContact O-N 2.93Å; L231-L296 VanDerWaalsContact O-N 3.11Å
232	I	89.3	Confident	89.2	Confident	9 Å²	9	44.4 Å²	44.4	5%	0.046	22%	0.224	C	C	.	.	G	3₁₀ helix	trans	-69.6	123.7	175.6	-61.5	164.1	0	0	0	108.2	M234 G235 R298 Y301 V322 H326	I232-M234 PolarHBondContact O-N 3.39Å; I232-M234 VanDerWaalsContact O-N 3.16Å; I232-G235 PolarHBondContact O-N 3.04Å; I232-R298 HydrophobicContact CB-CG 4.43Å; I232-R298 HydrophobicContact CD1-CB 4.45Å; I232-R298 HydrophobicContact CD1-CG 3.71Å; I232-R298 HydrophobicContact CG1-CG 4.11Å; I232-R298 HydrophobicContact CG2-CG 3.5Å; I232-R298 VanDerWaalsContact CG2-CG 3.5Å; I232-Y301 HydrophobicContact CD1-CD1 4.02Å; I232-Y301 HydrophobicContact CG1-CD1 3.88Å; I232-V322 HydrophobicContact CD1-CG1 3.62Å; I232-H326 WeakPolarHBondContact CB-CD2 3.14Å; I232-H326 HydrophobicContact CD1-CB 4.06Å; I232-H326 VanDerWaalsContact CD1-CG 3.47Å; I232-H326 PolarHBondContact N-NE2 3.17Å; I232-H326 VanDerWaalsContact N-NE2 3.12Å
233	S	87.6	Confident	89.5	Confident	62 Å²	62	44.3 Å²	44.3	43%	0.434	22%	0.223	S	C	.	.	G	3₁₀ helix	trans	50.1	39	-176.5	-55.7	0	0	0	0	112.6	L231 G235 K236	L231-S233 PolarHBondContact O-N 3.37Å; S233-G235 PolarHBondContact O-N 2.91Å; S233-K236 PolarHBondContact O-N 3.2Å
234	M	87.3	Confident	90	Very high	53 Å²	53	42.5 Å²	42.5	26%	0.261	22%	0.217	S	C	.	.	G	3₁₀ helix	trans	60.8	6.4	-175.6	-64.7	-65.3	-160.9	0	0	115.7	L231 I232 K236 H277 P293 P295	L231-M234 PolarHBondContact O-N 2.96Å; I232-M234 PolarHBondContact O-N 3.39Å; I232-M234 VanDerWaalsContact O-N 3.16Å; M234-K236 HydrophobicContact CB-CD 4.38Å; M234-K236 HydrophobicContact CB-CG 4.12Å; M234-K236 PolarHBondContact O-N 3.02Å; M234-H277 WeakPolarHBondContact O-CB 3.45Å; M234-H277 PolarHBondContact O-ND1 3.13Å; M234-P293 HydrophobicContact SD-CB 4.07Å; M234-P295 HydrophobicContact CE-CB 4.27Å; M234-P295 HydrophobicContact CE-CG 3.9Å; M234-P295 HydrophobicContact CG-CB 4.24Å; M234-P295 HydrophobicContact SD-CB 4.27Å
235	G	86.1	Confident	90.5	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	19%	0.187	C	C	.	.	G	3₁₀ helix	trans	72.4	10.9	-175	0	0	0	0	0	114.1	I232 S233 K237 L276 H277	I232-G235 PolarHBondContact O-N 3.04Å; S233-G235 PolarHBondContact O-N 2.91Å; G235-K237 VanDerWaalsContact C-N 3.34Å; G235-L276 WeakPolarHBondContact O-CB 3.17Å; G235-L276 PolarHBondContact O-N 2.94Å; G235-H277 PolarHBondContact O-N 3.37Å
236	K	89.6	Confident	91.1	Very high	128 Å²	128	30.4 Å²	30.4	56%	0.557	17%	0.171	S	C	*	.	S	Bend	trans	-79.9	-13.8	-178.2	-66.9	-174.7	176.9	-175.3	0	114.2	S233 M234 L275 H277	S233-K236 PolarHBondContact O-N 3.2Å; M234-K236 HydrophobicContact CB-CD 4.38Å; M234-K236 HydrophobicContact CB-CG 4.12Å; M234-K236 PolarHBondContact O-N 3.02Å; K236-L275 WeakPolarHBondContact O-CD2 3.27Å; K236-H277 HydrophobicContact CG-CB 4.12Å
237	K	91.1	Very high	91.8	Very high	166 Å²	166	29 Å²	29	72%	0.722	16%	0.155	S	C	*	.	S	Bend	trans	-97.2	-11.6	179.3	-65.5	-173.1	177.5	-175.5	0	113.5	G235	G235-K237 VanDerWaalsContact C-N 3.34Å
238	T	93.8	Very high	92.7	Very high	8 Å²	8	26.3 Å²	26.3	5%	0.049	14%	0.137	C	C	.	.			trans	-107.8	128.6	-173.9	-54.7	0	0	0	0	109.4	L276 H326	T238-L276 HydrophobicContact CG2-CB 4.43Å; T238-L276 HydrophobicContact CG2-CD2 4.4Å; T238-L276 PolarHBondContact O-N 3.48Å; T238-H326 WeakPolarHBondContact CG2-O 3.46Å; T238-H326 PolarHBondContact OG1-O 2.96Å
239	V	95.8	Very high	93.3	Very high	2 Å²	2	24.4 Å²	24.4	1%	0.012	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	137.5	174.4	178.2	0	0	0	0	109.3	R273 Y274 L275 T328 D329 Y380	V239-R273 HydrophobicContact CG1-CB 3.79Å; V239-Y274 CarbonylContact C-O 3.5Å; V239-Y274 WeakPolarHBondContact CA-O 3.46Å; V239-L275 HydrophobicContact CG2-CD2 3.86Å; V239-T328 HydrophobicContact CB-CG2 3.92Å; V239-T328 PolarHBondContact N-OG1 2.92Å; V239-T328 WeakPolarHBondContact O-CA 3.31Å; V239-D329 PolarHBondContact O-N 3Å; V239-Y380 HydrophobicContact CG2-CD2 4.04Å; V239-Y380 HydrophobicContact CG2-CE2 3.45Å; V239-Y380 VanDerWaalsContact CG2-CE2 3.45Å
240	K	95.9	Very high	93.6	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	142.2	177.7	-68	-61.4	-165.9	179.4	0	110.8	F215 P242 R273 Y274 L276 R324 F325 T327 D329	F215-K240 HydrophobicContact CZ-CG 4.41Å; K240-P242 WeakPolarHBondContact O-CD 3.5Å; K240-R273 WeakPolarHBondContact O-CA 3.2Å; K240-Y274 PolarHBondContact N-O 2.67Å; K240-Y274 PolarHBondContact O-N 2.93Å; K240-L276 HydrophobicContact CG-CD1 4.33Å; K240-R324 PolarHBondContact NZ-O 2.96Å; K240-F325 WeakPolarHBondContact CE-O 3.03Å; K240-T327 WeakPolarHBondContact CE-O 3.31Å; K240-T327 PolarHBondContact NZ-O 2.73Å; K240-D329 VanDerWaalsContact CA-OD2 3.31Å; K240-D329 WeakPolarHBondContact CA-OD2 3.38Å; K240-D329 VanDerWaalsContact CD-OD1 3.27Å; K240-D329 WeakPolarHBondContact CD-OD1 3.47Å; K240-D329 WeakPolarHBondContact CD-OD2 3.33Å; K240-D329 IonicContact NZ-OD1 3.68Å; K240-D329 PolarHBondContact NZ-OD1 3.43Å; K240-D329 VanDerWaalsContact NZ-OD1 3.09Å
241	Q	95.4	Very high	93.8	Very high	22 Å²	22	27.1 Å²	27.1	10%	0.103	13%	0.132	C	C	.	.			trans	-124.6	70.8	178.6	-171.5	171.4	3	0	0	109.4	A206 V269 G270 R273 D329	A206-Q241 WeakPolarHBondContact CB-O 3.27Å; Q241-V269 HydrophobicContact CG-CB 4.1Å; Q241-G270 WeakPolarHBondContact CG-O 3.46Å; Q241-G270 PolarHBondContact NE2-O 2.91Å; Q241-R273 HydrophobicContact CB-CB 4.34Å; Q241-R273 HydrophobicContact CB-CG 3.96Å; Q241-R273 HydrophobicContact CG-CG 3.81Å; Q241-D329 PolarHBondContact N-OD2 3.2Å
242	P	95.9	Very high	94.1	Very high	1 Å²	1	27.1 Å²	27.1	1%	0.006	13%	0.132	C	C	.	.			trans	-66.4	143.6	-170.8	30.8	-37.4	0	0	0	111.6	E207 F209 F215 F216 K240 G270 Y274 L279 V348	E207-P242 CarbonylContact O-C 3.56Å; E207-P242 WeakPolarHBondContact O-CA 2.9Å; E207-P242 WeakPolarHBondContact O-CB 3.31Å; F209-P242 HydrophobicContact CD1-CB 3.99Å; F215-P242 HydrophobicContact CE1-CB 4.27Å; F216-P242 HydrophobicContact CE1-CB 4.45Å; K240-P242 WeakPolarHBondContact O-CD 3.5Å; P242-G270 WeakPolarHBondContact O-CA 2.98Å; P242-Y274 HydrophobicContact CG-CD2 4.31Å; P242-Y274 HydrophobicContact CG-CE2 4.42Å; P242-L279 HydrophobicContact CG-CD1 4.08Å; P242-V348 HydrophobicContact CG-CG2 3.54Å
243	V	96.7	Very high	94.4	Very high	2 Å²	2	27.1 Å²	27.1	1%	0.012	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	141.5	-176.8	67.3	0	0	0	0	110.9	P205 A206 E207 M208 F209 V248 L338	P205-V243 HydrophobicContact CB-CG1 4.25Å; A206-V243 HydrophobicContact CB-CB 4.42Å; A206-V243 HydrophobicContact CB-CG1 4.2Å; E207-V243 PolarHBondContact O-N 2.82Å; M208-V243 CarbonylContact C-O 3.53Å; M208-V243 VanDerWaalsContact CA-O 3.26Å; M208-V243 WeakPolarHBondContact CA-O 3.37Å; M208-V243 HydrophobicContact CG-CG1 3.78Å; F209-V243 VanDerWaalsContact CD1-C 3.49Å; F209-V243 VanDerWaalsContact CD1-O 3.23Å; F209-V243 WeakPolarHBondContact CD1-O 3.46Å; F209-V243 PolarHBondContact N-O 3.07Å; V243-V248 HydrophobicContact CB-CG2 4.42Å; V243-V248 HydrophobicContact CG1-CG2 3.71Å; V243-V248 HydrophobicContact CG2-CG2 3.8Å; V243-L338 HydrophobicContact CG2-CD1 3.94Å
244	H	97.3	Very high	94.8	Very high	16 Å²	16	26.6 Å²	26.6	7%	0.074	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	130.2	-179.4	-177.3	-120.5	0	0	0	111.3	F209 V246 D247 V248 A346	F209-H244 HydrophobicContact CE1-CB 3.81Å; F209-H244 HydrophobicContact CE2-CB 4.39Å; F209-H244 AromaticContact CE2-CD2 3.75Å; F209-H244 HydrophobicContact CZ-CB 3.71Å; F209-H244 AromaticContact CZ-CD2 3.95Å; H244-V246 VanDerWaalsContact CE1-CB 3.41Å; H244-V246 WeakPolarHBondContact CE1-CB 3.47Å; H244-V246 WeakPolarHBondContact CE1-CG2 3.4Å; H244-V246 PolarHBondContact O-N 3.33Å; H244-V246 VanDerWaalsContact O-N 3.15Å; H244-D247 IonicContact ND1-OD2 3.77Å; H244-D247 PolarHBondContact O-N 2.84Å; H244-V248 PolarHBondContact O-N 2.86Å; H244-A346 HydrophobicContact CB-CB 4.23Å
245	V	96.9	Very high	95.2	Very high	0 Å²	0	24 Å²	24	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-57.9	-33.8	-173.5	68.2	0	0	0	0	113.7	F66 L67 Y70 F209 D247 V248 A249	F66-V245 HydrophobicContact CD1-CG2 4.22Å; F66-V245 HydrophobicContact CE1-CB 3.87Å; F66-V245 HydrophobicContact CE1-CG2 3.56Å; F66-V245 HydrophobicContact CE2-CG1 4.31Å; F66-V245 HydrophobicContact CE2-CG2 4.3Å; F66-V245 HydrophobicContact CZ-CB 3.62Å; F66-V245 HydrophobicContact CZ-CG1 3.78Å; F66-V245 HydrophobicContact CZ-CG2 3.62Å; L67-V245 HydrophobicContact CD1-CG2 3.76Å; Y70-V245 HydrophobicContact CD1-CG1 4.44Å; Y70-V245 HydrophobicContact CD2-CG1 4.02Å; Y70-V245 HydrophobicContact CD2-CG2 3.63Å; Y70-V245 HydrophobicContact CE1-CG1 4.19Å; Y70-V245 HydrophobicContact CE2-CG1 3.8Å; Y70-V245 HydrophobicContact CE2-CG2 4.02Å; Y70-V245 HydrophobicContact CG-CG1 4.37Å; Y70-V245 HydrophobicContact CG-CG2 4.24Å; F209-V245 PolarHBondContact O-N 2.79Å; V245-D247 VanDerWaalsContact C-N 3.29Å; V245-D247 PolarHBondContact O-N 2.79Å; V245-V248 PolarHBondContact O-N 3.44Å; V245-A249 PolarHBondContact O-N 3.17Å
246	V	96.7	Very high	95.6	Very high	28 Å²	28	24.6 Å²	24.6	17%	0.17	11%	0.114	C	C	.	.	H	α-helix	trans	-69.3	-31.6	-179.3	-178.5	0	0	0	0	111.2	Y70 H244 A249 K250	Y70-V246 HydrophobicContact CD1-CG2 4.16Å; Y70-V246 HydrophobicContact CE1-CG2 4.27Å; H244-V246 VanDerWaalsContact CE1-CB 3.41Å; H244-V246 WeakPolarHBondContact CE1-CB 3.47Å; H244-V246 WeakPolarHBondContact CE1-CG2 3.4Å; H244-V246 PolarHBondContact O-N 3.33Å; H244-V246 VanDerWaalsContact O-N 3.15Å; V246-A249 PolarHBondContact O-N 3.45Å; V246-K250 WeakPolarHBondContact O-CG 3.43Å; V246-K250 PolarHBondContact O-N 2.84Å
247	D	96.9	Very high	95.7	Very high	4 Å²	4	24.2 Å²	24.2	2%	0.021	11%	0.113	C	C	.	.	H	α-helix	trans	-76.8	-36.5	179.5	-61.7	-28.4	0	0	0	110.6	H244 V245 A249 K250 A251 I343 A346	H244-D247 IonicContact ND1-OD2 3.77Å; H244-D247 PolarHBondContact O-N 2.84Å; V245-D247 VanDerWaalsContact C-N 3.29Å; V245-D247 PolarHBondContact O-N 2.79Å; D247-A249 PolarHBondContact O-N 3.34Å; D247-K250 PolarHBondContact O-N 3.28Å; D247-K250 IonicContact OD1-NZ 2.84Å; D247-K250 PolarHBondContact OD1-NZ 3.12Å; D247-A251 WeakPolarHBondContact O-CB 3.25Å; D247-A251 PolarHBondContact O-N 2.98Å; D247-I343 HydrophobicContact CB-CG2 3.95Å; D247-A346 VanDerWaalsContact OD2-CB 3.28Å; D247-A346 WeakPolarHBondContact OD2-CB 3.36Å; D247-A346 PolarHBondContact OD2-N 3.43Å
248	V	97.3	Very high	95.8	Very high	0 Å²	0	18.2 Å²	18.2	0%	0	9%	0.089	C	C	.	.	H	α-helix	trans	-59.9	-44.4	168	179.3	0	0	0	0	111.4	L67 P205 M208 V243 H244 V245 K250 A251 I252 L268	L67-V248 HydrophobicContact CD1-CB 4.38Å; L67-V248 HydrophobicContact CD1-CG1 4.01Å; L67-V248 HydrophobicContact CD2-CG1 4.13Å; P205-V248 HydrophobicContact CB-CG1 4.42Å; P205-V248 HydrophobicContact CB-CG2 4.25Å; M208-V248 HydrophobicContact CG-CG2 4.23Å; M208-V248 HydrophobicContact SD-CB 4.36Å; M208-V248 HydrophobicContact SD-CG1 4.1Å; M208-V248 HydrophobicContact SD-CG2 4.21Å; V243-V248 HydrophobicContact CB-CG2 4.42Å; V243-V248 HydrophobicContact CG1-CG2 3.71Å; V243-V248 HydrophobicContact CG2-CG2 3.8Å; H244-V248 PolarHBondContact O-N 2.86Å; V245-V248 PolarHBondContact O-N 3.44Å; V248-K250 PolarHBondContact O-N 2.75Å; V248-A251 WeakPolarHBondContact O-CB 3.29Å; V248-A251 PolarHBondContact O-N 3.37Å; V248-I252 HydrophobicContact CG1-CD1 4.31Å; V248-I252 WeakPolarHBondContact O-CG1 3.36Å; V248-I252 PolarHBondContact O-N 2.88Å; V248-L268 HydrophobicContact CB-CD1 4.42Å; V248-L268 HydrophobicContact CG1-CD1 3.87Å; V248-L268 HydrophobicContact CG2-CD1 4.33Å
249	A	97.1	Very high	95.6	Very high	0 Å²	0	22.2 Å²	22.2	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-64.8	-37.5	177.7	0	0	0	0	0	112.8	L67 V71 V245 V246 D247 I253	L67-A249 HydrophobicContact CD1-CB 4.45Å; V71-A249 HydrophobicContact CG2-CB 4.08Å; V245-A249 PolarHBondContact O-N 3.17Å; V246-A249 PolarHBondContact O-N 3.45Å; D247-A249 PolarHBondContact O-N 3.34Å; A249-I253 PolarHBondContact O-N 2.84Å
250	K	96.5	Very high	95.5	Very high	68 Å²	68	27.4 Å²	27.4	30%	0.296	14%	0.142	S	C	.	.	H	α-helix	trans	-64.8	-41.2	171.5	-71.4	170.4	-168.5	157.1	0	111.2	V246 D247 V248 I252 I253 N254 I343	V246-K250 WeakPolarHBondContact O-CG 3.43Å; V246-K250 PolarHBondContact O-N 2.84Å; D247-K250 PolarHBondContact O-N 3.28Å; D247-K250 IonicContact OD1-NZ 2.84Å; D247-K250 PolarHBondContact OD1-NZ 3.12Å; V248-K250 PolarHBondContact O-N 2.75Å; K250-I252 VanDerWaalsContact C-N 3.33Å; K250-I252 PolarHBondContact O-N 3.39Å; K250-I253 PolarHBondContact O-N 3.49Å; K250-I253 VanDerWaalsContact O-N 3.1Å; K250-N254 PolarHBondContact O-N 2.89Å; K250-I343 VanDerWaalsContact C-CD1 3.49Å; K250-I343 HydrophobicContact CB-CD1 3.59Å; K250-I343 HydrophobicContact CB-CG1 4.12Å; K250-I343 HydrophobicContact CD-CG2 4.4Å
251	A	96.9	Very high	95.3	Very high	0 Å²	0	27.4 Å²	27.4	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-60.9	-44.6	-179.1	0	0	0	0	0	111.1	D247 V248 I253 N254 A255 L268 L338 L341 I343	D247-A251 WeakPolarHBondContact O-CB 3.25Å; D247-A251 PolarHBondContact O-N 2.98Å; V248-A251 WeakPolarHBondContact O-CB 3.29Å; V248-A251 PolarHBondContact O-N 3.37Å; A251-I253 VanDerWaalsContact C-N 3.3Å; A251-I253 PolarHBondContact O-N 3.25Å; A251-N254 PolarHBondContact O-N 3.45Å; A251-A255 VanDerWaalsContact O-CB 3.32Å; A251-A255 WeakPolarHBondContact O-CB 3.34Å; A251-A255 PolarHBondContact O-N 3.38Å; A251-L268 HydrophobicContact CB-CD1 4.1Å; A251-L268 HydrophobicContact CB-CD2 4.04Å; A251-L338 HydrophobicContact CB-CD2 3.72Å; A251-L341 HydrophobicContact CB-CD1 3.72Å; A251-I343 HydrophobicContact CB-CD1 3.73Å
252	I	96.9	Very high	95.2	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-56.2	-46	173.7	-68.4	167.6	0	0	0	110.6	L67 V71 I129 L131 I167 V169 V248 K250 A255 I256	L67-I252 HydrophobicContact CD2-CD1 4.18Å; V71-I252 HydrophobicContact CG1-CG2 4.33Å; V71-I252 HydrophobicContact CG2-CD1 3.81Å; I129-I252 HydrophobicContact CD1-CG2 3.93Å; I129-I252 HydrophobicContact CG2-CG2 4.18Å; L131-I252 HydrophobicContact CD2-CD1 4.27Å; I167-I252 HydrophobicContact CD1-CG2 4Å; I167-I252 HydrophobicContact CG2-CG2 4.47Å; V169-I252 HydrophobicContact CG2-CD1 4.19Å; V248-I252 HydrophobicContact CG1-CD1 4.31Å; V248-I252 WeakPolarHBondContact O-CG1 3.36Å; V248-I252 PolarHBondContact O-N 2.88Å; K250-I252 VanDerWaalsContact C-N 3.33Å; K250-I252 PolarHBondContact O-N 3.39Å; I252-A255 PolarHBondContact O-N 2.93Å; I252-I256 HydrophobicContact CG2-CD1 4.33Å; I252-I256 VanDerWaalsContact O-CG1 3.29Å; I252-I256 WeakPolarHBondContact O-CG1 3.4Å; I252-I256 PolarHBondContact O-N 3.5Å
253	I	95.8	Very high	95.1	Very high	9 Å²	9	30.3 Å²	30.3	5%	0.046	16%	0.164	C	C	.	.	H	α-helix	trans	-72.4	-37.3	-176.8	-70.2	168.5	0	0	0	112.9	R74 L75 M78 A249 K250 A251 A255 I256 K257	R74-I253 HydrophobicContact CB-CD1 3.03Å; R74-I253 HydrophobicContact CG-CD1 4.12Å; L75-I253 HydrophobicContact CD2-CD1 4.35Å; L75-I253 HydrophobicContact CD2-CG1 4.08Å; L75-I253 HydrophobicContact CG-CD1 4.23Å; L75-I253 HydrophobicContact CG-CG1 4.33Å; M78-I253 HydrophobicContact SD-CG2 3.69Å; A249-I253 PolarHBondContact O-N 2.84Å; K250-I253 PolarHBondContact O-N 3.49Å; K250-I253 VanDerWaalsContact O-N 3.1Å; A251-I253 VanDerWaalsContact C-N 3.3Å; A251-I253 PolarHBondContact O-N 3.25Å; I253-A255 VanDerWaalsContact C-N 3.32Å; I253-I256 WeakPolarHBondContact O-CB 3.35Å; I253-I256 PolarHBondContact O-N 3.22Å; I253-K257 PolarHBondContact O-N 3.4Å
254	N	95.6	Very high	95	Very high	51 Å²	51	34.1 Å²	34.1	27%	0.273	18%	0.181	S	C	.	.	H	α-helix	trans	-67.1	-38.3	175.4	-71.4	-3.2	0	0	0	110.4	K250 A251 I256 K257 D258 L341	K250-N254 PolarHBondContact O-N 2.89Å; A251-N254 PolarHBondContact O-N 3.45Å; N254-I256 VanDerWaalsContact C-N 3.29Å; N254-I256 PolarHBondContact O-N 3.24Å; N254-K257 PolarHBondContact O-N 2.83Å; N254-D258 WeakPolarHBondContact O-CB 3Å; N254-D258 PolarHBondContact O-N 3.43Å; N254-L341 HydrophobicContact CB-CB 4.36Å; N254-L341 PolarHBondContact ND2-O 3.07Å
255	A	95.6	Very high	95	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-64.4	-30.5	172.5	0	0	0	0	0	113.3	I201 M203 A251 I252 I253 K257 A261 L341	I201-A255 HydrophobicContact CD1-CB 4.5Å; M203-A255 HydrophobicContact CE-CB 3.23Å; A251-A255 VanDerWaalsContact O-CB 3.32Å; A251-A255 WeakPolarHBondContact O-CB 3.34Å; A251-A255 PolarHBondContact O-N 3.38Å; I252-A255 PolarHBondContact O-N 2.93Å; I253-A255 VanDerWaalsContact C-N 3.32Å; A255-K257 VanDerWaalsContact C-N 3.3Å; A255-K257 PolarHBondContact O-N 3.1Å; A255-A261 HydrophobicContact CB-CB 4.19Å; A255-L341 HydrophobicContact CB-CD2 4.28Å
256	I	94.3	Very high	94.9	Very high	12 Å²	12	34.8 Å²	34.8	6%	0.062	19%	0.186	C	C	.	.	H	α-helix	trans	-64.6	-37.1	171.6	-67.3	168.5	0	0	0	111.1	V56 L75 V127 I129 K165 I167 I252 I253 N254	V56-I256 HydrophobicContact CG1-CG2 4.14Å; V56-I256 HydrophobicContact CG2-CG2 4.18Å; L75-I256 HydrophobicContact CD2-CD1 4.21Å; V127-I256 HydrophobicContact CG1-CD1 3.96Å; V127-I256 HydrophobicContact CG1-CG1 3.85Å; V127-I256 HydrophobicContact CG1-CG2 4.31Å; V127-I256 HydrophobicContact CG2-CG2 3.8Å; I129-I256 HydrophobicContact CD1-CD1 3.7Å; I129-I256 HydrophobicContact CG1-CD1 4.37Å; K165-I256 PolarHBondContact NZ-O 3.41Å; I167-I256 HydrophobicContact CD1-CD1 4.1Å; I167-I256 HydrophobicContact CD1-CG1 3.39Å; I252-I256 HydrophobicContact CG2-CD1 4.33Å; I252-I256 VanDerWaalsContact O-CG1 3.29Å; I252-I256 WeakPolarHBondContact O-CG1 3.4Å; I252-I256 PolarHBondContact O-N 3.5Å; I253-I256 WeakPolarHBondContact O-CB 3.35Å; I253-I256 PolarHBondContact O-N 3.22Å; N254-I256 VanDerWaalsContact C-N 3.29Å; N254-I256 PolarHBondContact O-N 3.24Å
257	K	92.1	Very high	94.9	Very high	119 Å²	119	33.8 Å²	33.8	52%	0.517	18%	0.18	S	C	.	.	H	α-helix	trans	-80.2	-34.6	-179.1	-67.1	176.4	-178.3	177.8	0	112.5	M78 I253 N254 A255 P259	M78-K257 PolarHBondContact SD-NZ 3.01Å; M78-K257 VanDerWaalsContact SD-NZ 3.43Å; I253-K257 PolarHBondContact O-N 3.4Å; N254-K257 PolarHBondContact O-N 2.83Å; A255-K257 VanDerWaalsContact C-N 3.3Å; A255-K257 PolarHBondContact O-N 3.1Å; K257-P259 WeakPolarHBondContact O-CD 2.86Å
258	D	93.6	Very high	94.9	Very high	41 Å²	41	33.6 Å²	33.6	22%	0.219	18%	0.179	C	C	.	.			trans	-71.4	118.1	-177.2	-177.5	10.7	0	0	0	111	K165 N254 D260 A261	K165-D258 PolarHBondContact NZ-O 3.3Å; N254-D258 WeakPolarHBondContact O-CB 3Å; N254-D258 PolarHBondContact O-N 3.43Å; D258-D260 VanDerWaalsContact C-N 3.25Å; D258-D260 PolarHBondContact O-N 3.05Å; D258-D260 WeakPolarHBondContact OD1-CB 3.36Å; D258-D260 PolarHBondContact OD1-N 2.85Å; D258-A261 HydrophobicContact CB-CB 4.07Å
259	P	89.8	Confident	94.8	Very high	91 Å²	91	35.5 Å²	35.5	59%	0.591	19%	0.19	S	C	*	.	G	3₁₀ helix	trans	-67	-27.5	174.1	29.2	-35.1	0	0	0	112.5	K257 A261	K257-P259 WeakPolarHBondContact O-CD 2.86Å; P259-A261 PolarHBondContact O-N 2.99Å
260	D	92.4	Very high	94.6	Very high	111 Å²	111	35.6 Å²	35.6	59%	0.594	19%	0.192	S	C	*	.	G	3₁₀ helix	trans	-82.4	-4.9	-174.2	-62.1	-21.9	0	0	0	112.4	D258 N262 K264	D258-D260 VanDerWaalsContact C-N 3.25Å; D258-D260 PolarHBondContact O-N 3.05Å; D258-D260 WeakPolarHBondContact OD1-CB 3.36Å; D258-D260 PolarHBondContact OD1-N 2.85Å; D260-N262 VanDerWaalsContact C-N 3.28Å; D260-N262 PolarHBondContact O-N 3.23Å; D260-K264 VanDerWaalsContact O-CD 3.23Å; D260-K264 WeakPolarHBondContact O-CD 3.12Å; D260-K264 WeakPolarHBondContact O-CE 3.49Å; D260-K264 PolarHBondContact O-NZ 2.82Å
261	A	92.2	Very high	94.5	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	19%	0.194	C	C	.	.	G	3₁₀ helix	trans	-76.2	-14.6	-176.3	0	0	0	0	0	114	I201 A255 D258 P259 G263 K264 Y266	I201-A261 HydrophobicContact CD1-CB 3.77Å; I201-A261 WeakPolarHBondContact CG1-O 3.38Å; A255-A261 HydrophobicContact CB-CB 4.19Å; D258-A261 HydrophobicContact CB-CB 4.07Å; P259-A261 PolarHBondContact O-N 2.99Å; A261-G263 PolarHBondContact O-N 3.21Å; A261-K264 WeakPolarHBondContact O-CB 3.46Å; A261-K264 PolarHBondContact O-N 3.26Å; A261-K264 VanDerWaalsContact O-N 3.17Å; A261-Y266 WeakPolarHBondContact CA-OH 3.15Å; A261-Y266 HydrophobicContact CB-CE2 4.11Å; A261-Y266 WeakPolarHBondContact CB-OH 3.26Å
262	N	92.8	Very high	94.4	Very high	59 Å²	59	37.3 Å²	37.3	32%	0.316	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.7	134.8	-177.4	-69.2	-5.8	0	0	0	111.5	D260 K264	D260-N262 VanDerWaalsContact C-N 3.28Å; D260-N262 PolarHBondContact O-N 3.23Å; N262-K264 PolarHBondContact O-N 3.48Å
263	G	93.3	Very high	94.3	Very high	25 Å²	25	38.3 Å²	38.3	26%	0.258	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	67.6	-0.7	-178.6	0	0	0	0	0	115.4	R194 D199 A261	R194-G263 PolarHBondContact NH1-O 3.18Å; D199-G263 PolarHBondContact O-N 2.97Å; A261-G263 PolarHBondContact O-N 3.21Å
264	K	95.4	Very high	94.3	Very high	83 Å²	83	37.9 Å²	37.9	36%	0.361	21%	0.209	S	C	.	.			trans	-82.5	149.7	178.5	-67.5	-178.8	-180	158.4	0	111.9	I202 D260 A261 N262 Y266	I202-K264 PolarHBondContact N-O 3.1Å; D260-K264 VanDerWaalsContact O-CD 3.23Å; D260-K264 WeakPolarHBondContact O-CD 3.12Å; D260-K264 WeakPolarHBondContact O-CE 3.49Å; D260-K264 PolarHBondContact O-NZ 2.82Å; A261-K264 WeakPolarHBondContact O-CB 3.46Å; A261-K264 PolarHBondContact O-N 3.26Å; A261-K264 VanDerWaalsContact O-N 3.17Å; N262-K264 PolarHBondContact O-N 3.48Å; K264-Y266 HydrophobicContact CB-CD2 4.34Å; K264-Y266 HydrophobicContact CB-CE2 3.73Å
265	T	96.6	Very high	94.3	Very high	26 Å²	26	36.7 Å²	36.7	16%	0.16	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	118.8	170.8	-57.9	0	0	0	0	108.5	R194 I202 K204 L335 P336	R194-T265 PolarHBondContact NH2-OG1 3.44Å; I202-T265 HydrophobicContact CB-CG2 4.23Å; I202-T265 HydrophobicContact CG2-CG2 4.22Å; I202-T265 CarbonylContact O-C 3.55Å; I202-T265 VanDerWaalsContact O-CA 3.28Å; I202-T265 WeakPolarHBondContact O-CA 3.19Å; K204-T265 HydrophobicContact CD-CG2 3.91Å; K204-T265 HydrophobicContact CG-CG2 4.1Å; T265-L335 HydrophobicContact CG2-CD1 4.29Å; T265-P336 VanDerWaalsContact O-CD 3.27Å; T265-P336 WeakPolarHBondContact O-CD 3.09Å; T265-P336 WeakPolarHBondContact O-CG 3.44Å
266	Y	96.3	Very high	94.3	Very high	4 Å²	4	36.7 Å²	36.7	2%	0.016	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	131.9	-178.7	-68.5	-87.4	0	0	0	111.1	I201 I202 M203 K204 A261 K264 P336 L341	I201-Y266 HydrophobicContact CG2-CD2 3.82Å; I201-Y266 HydrophobicContact CG2-CE2 3.74Å; I202-Y266 PolarHBondContact O-N 3.35Å; M203-Y266 HydrophobicContact CE-CD2 3.69Å; M203-Y266 HydrophobicContact CE-CE2 4.16Å; M203-Y266 HydrophobicContact CE-CG 4.25Å; M203-Y266 VanDerWaalsContact SD-CB 3.58Å; M203-Y266 HydrophobicContact SD-CD2 3.73Å; M203-Y266 HydrophobicContact SD-CG 3.89Å; K204-Y266 WeakPolarHBondContact CA-O 3.36Å; K204-Y266 WeakPolarHBondContact CB-O 3.39Å; K204-Y266 PolarHBondContact N-O 2.71Å; A261-Y266 WeakPolarHBondContact CA-OH 3.15Å; A261-Y266 HydrophobicContact CB-CE2 4.11Å; A261-Y266 WeakPolarHBondContact CB-OH 3.26Å; K264-Y266 HydrophobicContact CB-CD2 4.34Å; K264-Y266 HydrophobicContact CB-CE2 3.73Å; Y266-P336 CarbonylContact C-O 3.55Å; Y266-P336 WeakPolarHBondContact CA-O 3.49Å; Y266-P336 HydrophobicContact CD1-CB 3.65Å; Y266-P336 HydrophobicContact CD1-CG 3.58Å; Y266-P336 HydrophobicContact CE1-CB 3.65Å; Y266-P336 HydrophobicContact CE1-CG 3.7Å; Y266-P336 HydrophobicContact CG-CG 4.19Å; Y266-L341 HydrophobicContact CD1-CD1 3.94Å; Y266-L341 HydrophobicContact CD1-CG 4.18Å; Y266-L341 HydrophobicContact CE1-CD1 4.09Å; Y266-L341 HydrophobicContact CE1-CD2 3.84Å; Y266-L341 HydrophobicContact CE1-CG 3.9Å; Y266-L341 HydrophobicContact CG-CD1 4.36Å
267	A	96.3	Very high	94.3	Very high	6 Å²	6	37.4 Å²	37.4	5%	0.05	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	103.1	171.6	0	0	0	0	0	109.4	L172 V269 L335 P336	L172-A267 HydrophobicContact CD1-CB 4.02Å; A267-V269 PolarHBondContact O-N 3.23Å; A267-L335 HydrophobicContact CB-CB 3.93Å; A267-L335 HydrophobicContact CB-CD1 4.12Å; A267-P336 PolarHBondContact N-O 2.86Å
268	L	96.1	Very high	94.4	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	98.1	-177.2	-46.5	176.6	0	0	0	109.4	M203 K204 P205 A206 V248 A251 L338 L341	M203-L268 HydrophobicContact CB-CD1 4.18Å; M203-L268 HydrophobicContact SD-CD1 4Å; M203-L268 HydrophobicContact SD-CD2 4.28Å; M203-L268 HydrophobicContact SD-CG 4.39Å; K204-L268 PolarHBondContact O-N 3.21Å; P205-L268 WeakPolarHBondContact CA-O 3.16Å; P205-L268 HydrophobicContact CB-CB 4.41Å; A206-L268 PolarHBondContact N-O 3.04Å; V248-L268 HydrophobicContact CB-CD1 4.42Å; V248-L268 HydrophobicContact CG1-CD1 3.87Å; V248-L268 HydrophobicContact CG2-CD1 4.33Å; A251-L268 HydrophobicContact CB-CD1 4.1Å; A251-L268 HydrophobicContact CB-CD2 4.04Å; L268-L338 HydrophobicContact CB-CD2 4.33Å; L268-L338 HydrophobicContact CB-CG 4.4Å; L268-L338 HydrophobicContact CD2-CD2 3.76Å; L268-L338 HydrophobicContact CD2-CG 4.15Å; L268-L341 HydrophobicContact CD2-CD1 4.38Å
269	V	95.4	Very high	94.5	Very high	40 Å²	40	30.9 Å²	30.9	24%	0.242	18%	0.176	C	C	.	.			trans	-116.6	149.9	-176.2	-63.5	0	0	0	0	111.4	L172 Q241 A267 L338	L172-V269 HydrophobicContact CD1-CG1 3.89Å; L172-V269 HydrophobicContact CD2-CG1 3.85Å; Q241-V269 HydrophobicContact CG-CB 4.1Å; A267-V269 PolarHBondContact O-N 3.23Å; V269-L338 VanDerWaalsContact O-CD1 3.32Å; V269-L338 WeakPolarHBondContact O-CD1 3.2Å
270	G	93.7	Very high	94.7	Very high	3 Å²	3	26.5 Å²	26.5	3%	0.031	15%	0.148	C	C	.	.			trans	-69.5	171.5	171.7	0	0	0	0	0	112.9	Q241 P242	Q241-G270 WeakPolarHBondContact CG-O 3.46Å; Q241-G270 PolarHBondContact NE2-O 2.91Å; P242-G270 WeakPolarHBondContact O-CA 2.98Å
271	P	93.9	Very high	94.8	Very high	53 Å²	53	25.7 Å²	25.7	34%	0.344	14%	0.14	S	C	.	.	S	Bend	trans	-71.8	-35.3	-177.8	27	-28.9	0	0	0	112.6	P345 A346	P271-P345 HydrophobicContact CB-CB 4.43Å; P271-P345 HydrophobicContact CB-CG 4.09Å; P271-P345 HydrophobicContact CG-CB 4.46Å; P271-A346 WeakPolarHBondContact CD-O 3.48Å
272	N	94.4	Very high	94.9	Very high	51 Å²	51	26 Å²	26	27%	0.273	14%	0.142	S	C	.	.			trans	-115.9	140.6	-170.9	-65.8	-22.4	0	0	0	110.7	Y274 T377	N272-Y274 HydrophobicContact CB-CD2 4.49Å; N272-Y274 HydrophobicContact CB-CE1 4.11Å; N272-Y274 HydrophobicContact CB-CE2 3.58Å; N272-Y274 WeakPolarHBondContact CB-OH 3.36Å; N272-Y274 PolarHBondContact ND2-OH 3.16Å; N272-Y274 VanDerWaalsContact ND2-OH 3.1Å; N272-Y274 WeakPolarHBondContact O-CE2 3.36Å; N272-T377 HydrophobicContact CB-CG2 3.92Å
273	R	95	Very high	95	Very high	20 Å²	20	23.2 Å²	23.2	8%	0.075	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	142.6	169	-39.6	-179.6	68	-176	-6.7	109.4	V239 K240 Q241 D329 T377 V378 Y380	V239-R273 HydrophobicContact CG1-CB 3.79Å; K240-R273 WeakPolarHBondContact O-CA 3.2Å; Q241-R273 HydrophobicContact CB-CB 4.34Å; Q241-R273 HydrophobicContact CB-CG 3.96Å; Q241-R273 HydrophobicContact CG-CG 3.81Å; R273-D329 PolarHBondContact NH2-O 3.46Å; R273-T377 CarbonylContact O-C 3.57Å; R273-T377 VanDerWaalsContact O-CA 3.3Å; R273-T377 WeakPolarHBondContact O-CA 3.48Å; R273-V378 WeakPolarHBondContact CB-O 3.45Å; R273-V378 PolarHBondContact O-N 3.06Å; R273-Y380 PolarHBondContact NH1-O 2.97Å; R273-Y380 PolarHBondContact NH1-OXT 3.13Å; R273-Y380 PolarHBondContact NH2-O 3.36Å
274	Y	95.4	Very high	95	Very high	1 Å²	1	22.3 Å²	22.3	0%	0.004	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	148	-176.9	-54.2	-85.1	0	0	0	109.8	V239 K240 P242 N272 L279 V348 E349 A375 T377	V239-Y274 CarbonylContact C-O 3.5Å; V239-Y274 WeakPolarHBondContact CA-O 3.46Å; K240-Y274 PolarHBondContact N-O 2.67Å; K240-Y274 PolarHBondContact O-N 2.93Å; P242-Y274 HydrophobicContact CG-CD2 4.31Å; P242-Y274 HydrophobicContact CG-CE2 4.42Å; N272-Y274 HydrophobicContact CB-CD2 4.49Å; N272-Y274 HydrophobicContact CB-CE1 4.11Å; N272-Y274 HydrophobicContact CB-CE2 3.58Å; N272-Y274 WeakPolarHBondContact CB-OH 3.36Å; N272-Y274 PolarHBondContact ND2-OH 3.16Å; N272-Y274 VanDerWaalsContact ND2-OH 3.1Å; N272-Y274 WeakPolarHBondContact O-CE2 3.36Å; Y274-L279 HydrophobicContact CD2-CD1 3.61Å; Y274-L279 HydrophobicContact CE2-CD1 4.33Å; Y274-L279 HydrophobicContact CG-CD1 3.76Å; Y274-V348 HydrophobicContact CE2-CB 4.16Å; Y274-V348 HydrophobicContact CE2-CG2 3.7Å; Y274-E349 WeakPolarHBondContact CE1-OE1 3.49Å; Y274-E349 VanDerWaalsContact CZ-OE1 3.32Å; Y274-E349 PolarHBondContact OH-OE1 3.43Å; Y274-E349 PolarHBondContact OH-OE2 3.41Å; Y274-A375 HydrophobicContact CD1-CB 3.59Å; Y274-A375 HydrophobicContact CE1-CB 3.68Å; Y274-T377 HydrophobicContact CD1-CG2 4.13Å; Y274-T377 HydrophobicContact CE1-CG2 3.65Å
275	L	95.9	Very high	94.9	Very high	26 Å²	26	20.3 Å²	20.3	14%	0.136	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.5	141.1	161.4	-75.2	166.5	0	0	0	109.1	K236 V239 H277 D278 L279 V378	K236-L275 WeakPolarHBondContact O-CD2 3.27Å; V239-L275 HydrophobicContact CG2-CD2 3.86Å; L275-H277 PolarHBondContact O-N 2.88Å; L275-D278 HydrophobicContact CB-CB 4.36Å; L275-D278 PolarHBondContact O-N 3.45Å; L275-D278 VanDerWaalsContact O-N 3.17Å; L275-L279 WeakPolarHBondContact O-CB 3.25Å; L275-L279 PolarHBondContact O-N 3.15Å; L275-V378 HydrophobicContact CD1-CG2 4.03Å; L275-V378 HydrophobicContact CG-CG2 3.84Å
276	L	95.1	Very high	94.8	Very high	0 Å²	0	19.1 Å²	19.1	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-58	-36.6	179.2	-179.3	65.6	0	0	0	111.2	F219 L231 G235 T238 K240 V280	F219-L276 HydrophobicContact CE2-CD1 4.26Å; F219-L276 HydrophobicContact CZ-CD1 3.96Å; L231-L276 HydrophobicContact CD2-CD2 4.44Å; G235-L276 WeakPolarHBondContact O-CB 3.17Å; G235-L276 PolarHBondContact O-N 2.94Å; T238-L276 HydrophobicContact CG2-CB 4.43Å; T238-L276 HydrophobicContact CG2-CD2 4.4Å; T238-L276 PolarHBondContact O-N 3.48Å; K240-L276 HydrophobicContact CG-CD1 4.33Å; L276-V280 HydrophobicContact CD1-CG2 4.2Å; L276-V280 VanDerWaalsContact O-CG2 3.24Å; L276-V280 WeakPolarHBondContact O-CG2 3.36Å; L276-V280 PolarHBondContact O-N 3.25Å
277	H	94.6	Very high	94.6	Very high	26 Å²	26	19 Å²	19	12%	0.12	11%	0.107	C	C	.	.	H	α-helix	trans	-56.3	-57.9	173.6	-170.4	79.5	0	0	0	112.3	M234 G235 K236 L275 L279 V280 E281	M234-H277 WeakPolarHBondContact O-CB 3.45Å; M234-H277 PolarHBondContact O-ND1 3.13Å; G235-H277 PolarHBondContact O-N 3.37Å; K236-H277 HydrophobicContact CG-CB 4.12Å; L275-H277 PolarHBondContact O-N 2.88Å; H277-L279 VanDerWaalsContact C-N 3.28Å; H277-L279 PolarHBondContact O-N 3.12Å; H277-V280 PolarHBondContact O-N 3.15Å; H277-E281 WeakPolarHBondContact O-CB 3.27Å; H277-E281 PolarHBondContact O-N 2.94Å
278	D	94.5	Very high	94.4	Very high	23 Å²	23	21.1 Å²	21.1	12%	0.123	12%	0.116	C	C	.	.	H	α-helix	trans	-67.6	-32.2	-175.3	-58	-15.1	0	0	0	111.2	L275 Y282	L275-D278 HydrophobicContact CB-CB 4.36Å; L275-D278 PolarHBondContact O-N 3.45Å; L275-D278 VanDerWaalsContact O-N 3.17Å; D278-Y282 VanDerWaalsContact O-CB 3.31Å; D278-Y282 WeakPolarHBondContact O-CB 3.2Å; D278-Y282 PolarHBondContact O-N 2.98Å
279	L	94.9	Very high	94.1	Very high	0 Å²	0	24 Å²	24	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-64	-46.8	173.9	-170.8	93	0	0	0	111.2	F215 F216 P242 Y274 L275 H277 Y282 V283	F215-L279 HydrophobicContact CE1-CD2 3.64Å; F215-L279 HydrophobicContact CZ-CD2 3.67Å; F216-L279 HydrophobicContact CE1-CD2 4.33Å; P242-L279 HydrophobicContact CG-CD1 4.08Å; Y274-L279 HydrophobicContact CD2-CD1 3.61Å; Y274-L279 HydrophobicContact CE2-CD1 4.33Å; Y274-L279 HydrophobicContact CG-CD1 3.76Å; L275-L279 WeakPolarHBondContact O-CB 3.25Å; L275-L279 PolarHBondContact O-N 3.15Å; H277-L279 VanDerWaalsContact C-N 3.28Å; H277-L279 PolarHBondContact O-N 3.12Å; L279-Y282 WeakPolarHBondContact O-CB 3.33Å; L279-Y282 PolarHBondContact O-N 2.91Å; L279-V283 WeakPolarHBondContact O-CG2 3.37Å; L279-V283 PolarHBondContact O-N 3.46Å
280	V	94.6	Very high	93.9	Very high	0 Å²	0	25.6 Å²	25.6	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-69.9	-40.2	179.1	177.8	0	0	0	0	110.4	F219 V229 L231 L276 H277 Y282 V283 Y284 F291	F219-V280 HydrophobicContact CD1-CG1 4.19Å; F219-V280 HydrophobicContact CD1-CG2 3.72Å; F219-V280 HydrophobicContact CD2-CG2 4.03Å; F219-V280 HydrophobicContact CE1-CG2 3.73Å; F219-V280 HydrophobicContact CE2-CG2 4.02Å; F219-V280 HydrophobicContact CG-CG1 4.44Å; F219-V280 HydrophobicContact CG-CG2 3.88Å; F219-V280 HydrophobicContact CZ-CG2 3.89Å; V229-V280 HydrophobicContact CG1-CG1 4.07Å; L231-V280 HydrophobicContact CD2-CG2 4.47Å; L276-V280 HydrophobicContact CD1-CG2 4.2Å; L276-V280 VanDerWaalsContact O-CG2 3.24Å; L276-V280 WeakPolarHBondContact O-CG2 3.36Å; L276-V280 PolarHBondContact O-N 3.25Å; H277-V280 PolarHBondContact O-N 3.15Å; V280-Y282 VanDerWaalsContact C-N 3.26Å; V280-Y282 PolarHBondContact O-N 2.73Å; V280-V283 WeakPolarHBondContact O-CB 3.31Å; V280-V283 PolarHBondContact O-N 3.19Å; V280-V283 VanDerWaalsContact O-N 3.12Å; V280-Y284 HydrophobicContact CG1-CD2 3.91Å; V280-Y284 HydrophobicContact CG1-CE2 3.93Å; V280-Y284 WeakPolarHBondContact O-CD2 3.33Å; V280-Y284 PolarHBondContact O-N 3.23Å; V280-F291 HydrophobicContact CB-CE2 4.42Å; V280-F291 HydrophobicContact CB-CZ 4.46Å; V280-F291 HydrophobicContact CG1-CD2 4.41Å; V280-F291 HydrophobicContact CG1-CE2 3.63Å; V280-F291 HydrophobicContact CG1-CZ 4.14Å
281	E	94.2	Very high	93.8	Very high	94 Å²	94	27.5 Å²	27.5	44%	0.439	15%	0.146	S	C	.	.	H	α-helix	trans	-54.4	-45.4	171.7	-174.5	178.1	-174.2	0	0	110.9	H277 V283 Y284 A285 F291	H277-E281 WeakPolarHBondContact O-CB 3.27Å; H277-E281 PolarHBondContact O-N 2.94Å; E281-V283 PolarHBondContact O-N 3.25Å; E281-Y284 PolarHBondContact O-N 2.67Å; E281-A285 WeakPolarHBondContact O-CB 3.5Å; E281-A285 PolarHBondContact O-N 3.46Å; E281-F291 HydrophobicContact CB-CD1 3.95Å; E281-F291 HydrophobicContact CB-CE1 3.67Å; E281-F291 HydrophobicContact CB-CZ 4.38Å; E281-F291 HydrophobicContact CG-CD1 3.9Å; E281-F291 HydrophobicContact CG-CE1 4.06Å
282	Y	94.9	Very high	93.8	Very high	7 Å²	7	29 Å²	29	3%	0.027	15%	0.153	C	C	.	.	H	α-helix	trans	-62.6	-41.4	176	-178.5	-104.2	0	0	0	113	D278 L279 V280 Y284 A285 V286 V348 E349 A352 K373 A375	D278-Y282 VanDerWaalsContact O-CB 3.31Å; D278-Y282 WeakPolarHBondContact O-CB 3.2Å; D278-Y282 PolarHBondContact O-N 2.98Å; L279-Y282 WeakPolarHBondContact O-CB 3.33Å; L279-Y282 PolarHBondContact O-N 2.91Å; V280-Y282 VanDerWaalsContact C-N 3.26Å; V280-Y282 PolarHBondContact O-N 2.73Å; Y282-Y284 VanDerWaalsContact C-N 3.3Å; Y282-Y284 PolarHBondContact O-N 3.45Å; Y282-A285 PolarHBondContact O-N 2.88Å; Y282-V286 HydrophobicContact CD1-CG2 4.21Å; Y282-V286 HydrophobicContact CD2-CG2 4.25Å; Y282-V286 HydrophobicContact CE1-CG2 3.7Å; Y282-V286 HydrophobicContact CE2-CG2 3.74Å; Y282-V286 HydrophobicContact CG-CG2 4.44Å; Y282-V286 VanDerWaalsContact CZ-CG2 3.42Å; Y282-V286 WeakPolarHBondContact O-CG2 3.49Å; Y282-V286 PolarHBondContact O-N 2.77Å; Y282-V348 HydrophobicContact CD1-CG1 4.3Å; Y282-V348 HydrophobicContact CE1-CG1 4.02Å; Y282-E349 WeakPolarHBondContact OH-CA 3.3Å; Y282-A352 HydrophobicContact CE1-CB 3.78Å; Y282-K373 WeakPolarHBondContact CD2-O 3.46Å; Y282-K373 WeakPolarHBondContact CE2-O 3.48Å; Y282-A375 HydrophobicContact CD2-CB 4.11Å; Y282-A375 HydrophobicContact CG-CB 3.86Å
283	V	94.6	Very high	93.7	Very high	0 Å²	0	28.1 Å²	28.1	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-57.9	-43.4	174.5	168.9	0	0	0	0	111.2	F216 F219 A220 L279 V280 E281 A287 L356	F216-V283 HydrophobicContact CG-CG2 4.38Å; F219-V283 HydrophobicContact CB-CG1 4.29Å; A220-V283 HydrophobicContact CB-CG1 4.23Å; L279-V283 WeakPolarHBondContact O-CG2 3.37Å; L279-V283 PolarHBondContact O-N 3.46Å; V280-V283 WeakPolarHBondContact O-CB 3.31Å; V280-V283 PolarHBondContact O-N 3.19Å; V280-V283 VanDerWaalsContact O-N 3.12Å; E281-V283 PolarHBondContact O-N 3.25Å; V283-A287 VanDerWaalsContact O-CB 3.29Å; V283-A287 WeakPolarHBondContact O-CB 3.35Å; V283-A287 PolarHBondContact O-N 3.22Å; V283-L356 HydrophobicContact CB-CD1 4.26Å; V283-L356 HydrophobicContact CG1-CD1 4Å; V283-L356 HydrophobicContact CG1-CD2 3.9Å; V283-L356 HydrophobicContact CG2-CD1 4.3Å
284	Y	93.7	Very high	93.6	Very high	5 Å²	5	31.5 Å²	31.5	2%	0.02	16%	0.164	C	C	.	.	H	α-helix	trans	-72.3	-35.9	177.9	-84.7	-97.6	0	0	0	112.9	F219 R223 V229 V280 E281 Y282 A287 H288 R289 P290 F291	F219-Y284 PolarHBondContact O-OH 2.87Å; R223-Y284 PolarHBondContact N-OH 3.39Å; V229-Y284 HydrophobicContact CG2-CE1 4.2Å; V229-Y284 HydrophobicContact CG2-CE2 3.67Å; V229-Y284 VanDerWaalsContact CG2-CZ 3.47Å; V229-Y284 WeakPolarHBondContact CG2-OH 3.47Å; V280-Y284 HydrophobicContact CG1-CD2 3.91Å; V280-Y284 HydrophobicContact CG1-CE2 3.93Å; V280-Y284 WeakPolarHBondContact O-CD2 3.33Å; V280-Y284 PolarHBondContact O-N 3.23Å; E281-Y284 PolarHBondContact O-N 2.67Å; Y282-Y284 VanDerWaalsContact C-N 3.3Å; Y282-Y284 PolarHBondContact O-N 3.45Å; Y284-A287 CarbonylContact O-C 3.33Å; Y284-A287 PolarHBondContact O-N 2.89Å; Y284-H288 PolarHBondContact O-N 2.84Å; Y284-R289 HydrophobicContact CD1-CB 3.76Å; Y284-R289 HydrophobicContact CE1-CB 4.26Å; Y284-R289 PolarHBondContact O-N 2.92Å; Y284-P290 WeakPolarHBondContact CD1-O 3.43Å; Y284-F291 HydrophobicContact CD1-CB 4.23Å; Y284-F291 HydrophobicContact CD1-CD2 4.43Å; Y284-F291 AromaticContact CD2-CD2 3.78Å; Y284-F291 HydrophobicContact CD2-CD2 3.78Å; Y284-F291 HydrophobicContact CD2-CE2 4.35Å; Y284-F291 HydrophobicContact CE2-CD2 4.24Å; Y284-F291 HydrophobicContact CG-CB 3.99Å; Y284-F291 AromaticContact CG-CD2 3.92Å; Y284-F291 HydrophobicContact CG-CD2 3.92Å; Y284-F291 HydrophobicContact CG-CG 4.28Å
285	A	93.4	Very high	93.5	Very high	42 Å²	42	35.2 Å²	35.2	35%	0.347	19%	0.189	S	C	.	.	H	α-helix	trans	-60.7	-49	173.7	0	0	0	0	0	110.9	E281 Y282 A287 H288	E281-A285 WeakPolarHBondContact O-CB 3.5Å; E281-A285 PolarHBondContact O-N 3.46Å; Y282-A285 PolarHBondContact O-N 2.88Å; A285-A287 VanDerWaalsContact C-N 3.32Å; A285-A287 PolarHBondContact O-N 3.48Å; A285-H288 PolarHBondContact O-N 3.09Å; A285-H288 VanDerWaalsContact O-N 3.1Å
286	V	93.6	Very high	93.3	Very high	0 Å²	0	35 Å²	35	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-64.9	-36.3	176.2	177.3	0	0	0	0	111.6	Y282 H288 I353 L356 R360	Y282-V286 HydrophobicContact CD1-CG2 4.21Å; Y282-V286 HydrophobicContact CD2-CG2 4.25Å; Y282-V286 HydrophobicContact CE1-CG2 3.7Å; Y282-V286 HydrophobicContact CE2-CG2 3.74Å; Y282-V286 HydrophobicContact CG-CG2 4.44Å; Y282-V286 VanDerWaalsContact CZ-CG2 3.42Å; Y282-V286 WeakPolarHBondContact O-CG2 3.49Å; Y282-V286 PolarHBondContact O-N 2.77Å; V286-H288 PolarHBondContact O-N 3.17Å; V286-I353 HydrophobicContact CG1-CD1 4.34Å; V286-L356 HydrophobicContact CB-CD1 3.83Å; V286-L356 HydrophobicContact CG1-CB 3.91Å; V286-L356 HydrophobicContact CG1-CD1 3.83Å; V286-R360 VanDerWaalsContact O-CZ 3.3Å; V286-R360 PolarHBondContact O-NE 2.86Å; V286-R360 PolarHBondContact O-NH2 3.17Å
287	A	92.3	Very high	93.2	Very high	3 Å²	3	38.6 Å²	38.6	3%	0.025	21%	0.211	C	C	.	.	H	α-helix	trans	-74.5	-7.6	176.3	0	0	0	0	0	114	V283 Y284 A285 R289 H359	V283-A287 VanDerWaalsContact O-CB 3.29Å; V283-A287 WeakPolarHBondContact O-CB 3.35Å; V283-A287 PolarHBondContact O-N 3.22Å; Y284-A287 CarbonylContact O-C 3.33Å; Y284-A287 PolarHBondContact O-N 2.89Å; A285-A287 VanDerWaalsContact C-N 3.32Å; A285-A287 PolarHBondContact O-N 3.48Å; A287-R289 VanDerWaalsContact C-N 3.3Å; A287-R289 HydrophobicContact CB-CG 4.09Å; A287-R289 PolarHBondContact O-N 2.75Å; A287-H359 HydrophobicContact CB-CB 4.41Å
288	H	92	Very high	93	Very high	50 Å²	50	44.4 Å²	44.4	23%	0.231	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	47.9	50.3	-169.8	-64.6	-83.9	0	0	0	112.5	Y284 A285 V286 F364	Y284-H288 PolarHBondContact O-N 2.84Å; A285-H288 PolarHBondContact O-N 3.09Å; A285-H288 VanDerWaalsContact O-N 3.1Å; V286-H288 PolarHBondContact O-N 3.17Å; H288-F364 HydrophobicContact CB-CB 3.8Å; H288-F364 HydrophobicContact CB-CD1 4.13Å; H288-F364 HydrophobicContact CB-CD2 3.68Å; H288-F364 HydrophobicContact CB-CE2 4.27Å; H288-F364 HydrophobicContact CB-CG 3.6Å; H288-F364 AromaticContact CG-CD1 3.85Å; H288-F364 AromaticContact CG-CG 3.71Å; H288-F364 AromaticContact ND1-CD1 3.89Å
289	R	90.9	Very high	92.9	Very high	59 Å²	59	48.1 Å²	48.1	22%	0.223	26%	0.257	C	S	.	.			trans	-119.1	147.2	176.9	-65.5	-60.4	-176.9	145.6	-0.7	110.4	Y284 A287 F291 H359 R361	Y284-R289 HydrophobicContact CD1-CB 3.76Å; Y284-R289 HydrophobicContact CE1-CB 4.26Å; Y284-R289 PolarHBondContact O-N 2.92Å; A287-R289 VanDerWaalsContact C-N 3.3Å; A287-R289 HydrophobicContact CB-CG 4.09Å; A287-R289 PolarHBondContact O-N 2.75Å; R289-F291 PolarHBondContact O-N 2.93Å; R289-H359 PolarHBondContact NE-O 3.37Å; R289-H359 PolarHBondContact NH2-O 2.82Å; R289-R361 VanDerWaalsContact NH2-CG 3.29Å
290	P	91	Very high	92.8	Very high	75 Å²	75	52.1 Å²	52.1	49%	0.487	28%	0.278	S	S	.	.			trans	-62.2	136.7	174.5	27.9	-35.3	0	0	0	110	S227 Y284	S227-P290 VanDerWaalsContact OG-CG 3.29Å; S227-P290 WeakPolarHBondContact OG-CG 3.46Å; Y284-P290 WeakPolarHBondContact CD1-O 3.43Å
291	F	91.8	Very high	92.7	Very high	43 Å²	43	52.6 Å²	52.6	19%	0.189	28%	0.28	C	S	.	.			trans	-116.4	112	179.2	177	-123.8	0	0	0	109.3	V229 V280 E281 Y284 R289 P293	V229-F291 HydrophobicContact CB-CD2 4.37Å; V229-F291 HydrophobicContact CB-CE2 3.96Å; V229-F291 HydrophobicContact CG1-CE2 4.22Å; V229-F291 HydrophobicContact CG2-CD2 3.92Å; V229-F291 HydrophobicContact CG2-CE2 3.97Å; V280-F291 HydrophobicContact CB-CE2 4.42Å; V280-F291 HydrophobicContact CB-CZ 4.46Å; V280-F291 HydrophobicContact CG1-CD2 4.41Å; V280-F291 HydrophobicContact CG1-CE2 3.63Å; V280-F291 HydrophobicContact CG1-CZ 4.14Å; E281-F291 HydrophobicContact CB-CD1 3.95Å; E281-F291 HydrophobicContact CB-CE1 3.67Å; E281-F291 HydrophobicContact CB-CZ 4.38Å; E281-F291 HydrophobicContact CG-CD1 3.9Å; E281-F291 HydrophobicContact CG-CE1 4.06Å; Y284-F291 HydrophobicContact CD1-CB 4.23Å; Y284-F291 HydrophobicContact CD1-CD2 4.43Å; Y284-F291 AromaticContact CD2-CD2 3.78Å; Y284-F291 HydrophobicContact CD2-CD2 3.78Å; Y284-F291 HydrophobicContact CD2-CE2 4.35Å; Y284-F291 HydrophobicContact CE2-CD2 4.24Å; Y284-F291 HydrophobicContact CG-CB 3.99Å; Y284-F291 AromaticContact CG-CD2 3.92Å; Y284-F291 HydrophobicContact CG-CD2 3.92Å; Y284-F291 HydrophobicContact CG-CG 4.28Å; R289-F291 PolarHBondContact O-N 2.93Å; F291-P293 HydrophobicContact CD1-CG 4.18Å; F291-P293 HydrophobicContact CE1-CB 4.04Å; F291-P293 HydrophobicContact CE1-CG 3.59Å; F291-P293 HydrophobicContact CE2-CB 3.98Å; F291-P293 HydrophobicContact CE2-CG 4.33Å; F291-P293 HydrophobicContact CZ-CB 3.56Å; F291-P293 HydrophobicContact CZ-CG 3.69Å
292	V	92.6	Very high	92.6	Very high	83 Å²	83	50.6 Å²	50.6	50%	0.503	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	87.8	174.8	-173.9	0	0	0	0	108.1	S227 A228 V229	S227-V292 WeakPolarHBondContact O-CB 3.24Å; S227-V292 PolarHBondContact O-N 3.07Å; A228-V292 VanDerWaalsContact CA-O 3.29Å; A228-V292 WeakPolarHBondContact CA-O 3.4Å; V229-V292 PolarHBondContact N-O 3.35Å
293	P	92.8	Very high	92.6	Very high	34 Å²	34	55.9 Å²	55.9	22%	0.221	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	139.8	177.7	28.3	-32.1	0	0	0	110.6	V229 L231 M234 F291	V229-P293 WeakPolarHBondContact O-CA 3.11Å; L231-P293 HydrophobicContact CD1-CB 4.48Å; M234-P293 HydrophobicContact SD-CB 4.07Å; F291-P293 HydrophobicContact CD1-CG 4.18Å; F291-P293 HydrophobicContact CE1-CB 4.04Å; F291-P293 HydrophobicContact CE1-CG 3.59Å; F291-P293 HydrophobicContact CE2-CB 3.98Å; F291-P293 HydrophobicContact CE2-CG 4.33Å; F291-P293 HydrophobicContact CZ-CB 3.56Å; F291-P293 HydrophobicContact CZ-CG 3.69Å
294	Y	93.2	Very high	92.4	Very high	91 Å²	91	58.9 Å²	58.9	36%	0.357	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	148.1	171.6	68.8	-86.5	0	0	0	111.4	A228 V229 P230 L231 L296	A228-Y294 HydrophobicContact CB-CD1 3.8Å; A228-Y294 HydrophobicContact CB-CE1 3.6Å; V229-Y294 PolarHBondContact O-N 3.33Å; P230-Y294 HydrophobicContact CB-CE1 3.97Å; P230-Y294 HydrophobicContact CB-CE2 3.78Å; P230-Y294 VanDerWaalsContact CB-CZ 3.45Å; P230-Y294 WeakPolarHBondContact CB-OH 3.39Å; P230-Y294 HydrophobicContact CG-CE1 4.24Å; P230-Y294 WeakPolarHBondContact CG-OH 3.42Å; P230-Y294 VanDerWaalsContact N-CE1 3.31Å; L231-Y294 PolarHBondContact N-O 3.23Å; L231-Y294 VanDerWaalsContact N-O 3.09Å; Y294-L296 HydrophobicContact CE2-CB 4.26Å; Y294-L296 HydrophobicContact CE2-CD1 4.22Å; Y294-L296 PolarHBondContact O-N 2.83Å
295	P	93.4	Very high	92.3	Very high	79 Å²	79	58.7 Å²	58.7	51%	0.513	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	121.6	-177.9	30.8	-22.6	0	0	0	108.8	L231 M234	L231-P295 WeakPolarHBondContact O-CA 3.47Å; M234-P295 HydrophobicContact CE-CB 4.27Å; M234-P295 HydrophobicContact CE-CG 3.9Å; M234-P295 HydrophobicContact CG-CB 4.24Å; M234-P295 HydrophobicContact SD-CB 4.27Å
296	L	91.4	Very high	92.3	Very high	20 Å²	20	58.9 Å²	58.9	11%	0.105	32%	0.315	C	S	.	.			trans	-111.7	123.4	173.6	-167.2	63.7	0	0	0	109.7	P230 L231 Y294 L300 Y301	P230-L296 HydrophobicContact CB-CB 3.95Å; P230-L296 HydrophobicContact CB-CD2 3.73Å; P230-L296 HydrophobicContact CB-CG 4.48Å; L231-L296 PolarHBondContact O-N 2.93Å; L231-L296 VanDerWaalsContact O-N 3.11Å; Y294-L296 HydrophobicContact CE2-CB 4.26Å; Y294-L296 HydrophobicContact CE2-CD1 4.22Å; Y294-L296 PolarHBondContact O-N 2.83Å; L296-L300 HydrophobicContact CD1-CB 4.21Å; L296-L300 HydrophobicContact CD1-CD2 3.54Å; L296-L300 HydrophobicContact CD1-CG 3.83Å; L296-L300 HydrophobicContact CG-CB 4.5Å; L296-Y301 HydrophobicContact CD2-CD1 4.48Å; L296-Y301 HydrophobicContact CD2-CD2 3.93Å; L296-Y301 HydrophobicContact CD2-CG 3.78Å
297	P	92.3	Very high	92.2	Very high	77 Å²	77	66.3 Å²	66.3	50%	0.5	35%	0.347	S	S	.	.			trans	-58.7	142.3	174.1	-25.2	35.2	0	0	0	111.6	P299 L300 Y301	P297-P299 VanDerWaalsContact C-CD 3.49Å; P297-P299 HydrophobicContact CB-CG 4.43Å; P297-L300 PolarHBondContact O-N 2.89Å; P297-L300 VanDerWaalsContact O-N 3.16Å; P297-Y301 PolarHBondContact O-N 3.04Å
298	R	90.3	Very high	92.1	Very high	148 Å²	148	69.2 Å²	69.2	56%	0.558	36%	0.36	S	S	*	.	H	α-helix	trans	-45.9	-51.4	178.8	-67.7	-172	173	-178	-3.5	114.5	I232 L300 Y301 H302	I232-R298 HydrophobicContact CB-CG 4.43Å; I232-R298 HydrophobicContact CD1-CB 4.45Å; I232-R298 HydrophobicContact CD1-CG 3.71Å; I232-R298 HydrophobicContact CG1-CG 4.11Å; I232-R298 HydrophobicContact CG2-CG 3.5Å; I232-R298 VanDerWaalsContact CG2-CG 3.5Å; R298-L300 VanDerWaalsContact C-N 3.34Å; R298-L300 PolarHBondContact O-N 3.03Å; R298-Y301 PolarHBondContact O-N 3.21Å; R298-H302 PolarHBondContact O-CD2 3.31Å; R298-H302 PolarHBondContact O-N 2.9Å
299	P	92.9	Very high	92	Very high	101 Å²	101	68.8 Å²	68.8	66%	0.656	37%	0.365	S	S	*	.	H	α-helix	trans	-65.3	-37.4	-176.5	24.8	-34.9	0	0	0	112.5	P297 H302 L303	P297-P299 VanDerWaalsContact C-CD 3.49Å; P297-P299 HydrophobicContact CB-CG 4.43Å; P299-H302 PolarHBondContact O-N 3.08Å; P299-L303 PolarHBondContact O-N 3.43Å
300	L	92.9	Very high	91.8	Very high	84 Å²	84	73.1 Å²	73.1	44%	0.44	39%	0.389	S	S	.	.	H	α-helix	trans	-69.1	-37.7	178	-174.5	56.1	0	0	0	111.1	L296 P297 R298 L303 V304	L296-L300 HydrophobicContact CD1-CB 4.21Å; L296-L300 HydrophobicContact CD1-CD2 3.54Å; L296-L300 HydrophobicContact CD1-CG 3.83Å; L296-L300 HydrophobicContact CG-CB 4.5Å; P297-L300 PolarHBondContact O-N 2.89Å; P297-L300 VanDerWaalsContact O-N 3.16Å; R298-L300 VanDerWaalsContact C-N 3.34Å; R298-L300 PolarHBondContact O-N 3.03Å; L300-L303 HydrophobicContact CD1-CD2 4.32Å; L300-L303 PolarHBondContact O-N 3.43Å; L300-V304 WeakPolarHBondContact O-CG2 3.32Å; L300-V304 PolarHBondContact O-N 3.42Å; L300-V304 VanDerWaalsContact O-N 3.13Å
301	Y	92.1	Very high	91.7	Very high	9 Å²	9	73 Å²	73	4%	0.035	39%	0.385	C	S	.	.	H	α-helix	trans	-66.4	-40.5	174.7	-161.4	-178.7	0	0	0	112	I232 L296 P297 R298 L303 V304 A305 T317 V322 H326	I232-Y301 HydrophobicContact CD1-CD1 4.02Å; I232-Y301 HydrophobicContact CG1-CD1 3.88Å; L296-Y301 HydrophobicContact CD2-CD1 4.48Å; L296-Y301 HydrophobicContact CD2-CD2 3.93Å; L296-Y301 HydrophobicContact CD2-CG 3.78Å; P297-Y301 PolarHBondContact O-N 3.04Å; R298-Y301 PolarHBondContact O-N 3.21Å; Y301-L303 VanDerWaalsContact C-N 3.3Å; Y301-L303 PolarHBondContact O-N 3.45Å; Y301-V304 PolarHBondContact O-N 2.88Å; Y301-A305 VanDerWaalsContact O-CB 3.28Å; Y301-A305 WeakPolarHBondContact O-CB 3.08Å; Y301-A305 PolarHBondContact O-N 3.09Å; Y301-T317 HydrophobicContact CE2-CG2 4.36Å; Y301-V322 HydrophobicContact CD1-CB 4.36Å; Y301-V322 HydrophobicContact CD1-CG1 3.37Å; Y301-V322 HydrophobicContact CD1-CG2 4.02Å; Y301-V322 HydrophobicContact CD2-CG2 3.95Å; Y301-V322 HydrophobicContact CE1-CB 4.39Å; Y301-V322 HydrophobicContact CE1-CG1 3.71Å; Y301-V322 HydrophobicContact CE1-CG2 3.87Å; Y301-V322 HydrophobicContact CE2-CG2 3.75Å; Y301-V322 HydrophobicContact CG-CG1 3.86Å; Y301-V322 HydrophobicContact CG-CG2 4.06Å; Y301-H326 AromaticContact CE1-CE1 3.73Å
302	H	92.8	Very high	91.4	Very high	52 Å²	52	76.8 Å²	76.8	24%	0.241	41%	0.414	C	S	.	.	H	α-helix	trans	-61.1	-37.9	174	-86.5	-136.7	0	0	0	112.6	R298 P299 A305 S306 D323	R298-H302 PolarHBondContact O-CD2 3.31Å; R298-H302 PolarHBondContact O-N 2.9Å; P299-H302 PolarHBondContact O-N 3.08Å; H302-A305 PolarHBondContact O-N 3.41Å; H302-S306 WeakPolarHBondContact O-CB 3.2Å; H302-S306 PolarHBondContact O-N 3.05Å; H302-S306 PolarHBondContact O-OG 3.46Å; H302-D323 IonicContact CD2-OD1 4Å; H302-D323 IonicContact CE1-OD1 3.33Å; H302-D323 PolarHBondContact CE1-OD1 2.98Å; H302-D323 IonicContact CE1-OD2 3.2Å; H302-D323 PolarHBondContact CE1-OD2 3.32Å; H302-D323 IonicContact NE2-OD1 2.76Å; H302-D323 PolarHBondContact NE2-OD1 3.14Å; H302-D323 IonicContact NE2-OD2 3.47Å; H302-D323 PolarHBondContact NE2-OD2 2.81Å
303	L	93.8	Very high	91.3	Very high	119 Å²	119	80.3 Å²	80.3	62%	0.623	42%	0.422	S	S	*	.	H	α-helix	trans	-63	-49.2	176.1	-176.2	67.2	0	0	0	111.2	P299 L300 Y301 A305 S306 F307	P299-L303 PolarHBondContact O-N 3.43Å; L300-L303 HydrophobicContact CD1-CD2 4.32Å; L300-L303 PolarHBondContact O-N 3.43Å; Y301-L303 VanDerWaalsContact C-N 3.3Å; Y301-L303 PolarHBondContact O-N 3.45Å; L303-A305 VanDerWaalsContact C-N 3.33Å; L303-A305 PolarHBondContact O-N 3.47Å; L303-S306 WeakPolarHBondContact O-CB 3.14Å; L303-S306 PolarHBondContact O-N 3.43Å; L303-F307 PolarHBondContact O-N 3.46Å; L303-F307 VanDerWaalsContact O-N 3.11Å
304	V	92.1	Very high	91	Very high	63 Å²	63	83.9 Å²	83.9	38%	0.382	44%	0.436	S	S	.	.	H	α-helix	trans	-61.1	-44.4	176.4	174.5	0	0	0	0	110.7	L300 Y301 S306 F307 F308	L300-V304 WeakPolarHBondContact O-CG2 3.32Å; L300-V304 PolarHBondContact O-N 3.42Å; L300-V304 VanDerWaalsContact O-N 3.13Å; Y301-V304 PolarHBondContact O-N 2.88Å; V304-S306 VanDerWaalsContact C-N 3.31Å; V304-S306 PolarHBondContact O-N 2.82Å; V304-F307 WeakPolarHBondContact O-CB 3.42Å; V304-F307 PolarHBondContact O-N 2.9Å; V304-F308 HydrophobicContact CG1-CD2 3.94Å; V304-F308 HydrophobicContact CG1-CE2 3.7Å; V304-F308 VanDerWaalsContact O-CD2 3.27Å; V304-F308 WeakPolarHBondContact O-CD2 3.48Å; V304-F308 PolarHBondContact O-N 2.99Å; V304-F308 VanDerWaalsContact O-N 3.17Å
305	A	91.8	Very high	90.9	Very high	0 Å²	0	80.2 Å²	80.2	0%	0	42%	0.423	C	S	.	.	H	α-helix	trans	-64.9	-34.7	178.7	0	0	0	0	0	112.6	Y301 H302 L303 F307 F308 A309 T317 P319 V322	Y301-A305 VanDerWaalsContact O-CB 3.28Å; Y301-A305 WeakPolarHBondContact O-CB 3.08Å; Y301-A305 PolarHBondContact O-N 3.09Å; H302-A305 PolarHBondContact O-N 3.41Å; L303-A305 VanDerWaalsContact C-N 3.33Å; L303-A305 PolarHBondContact O-N 3.47Å; A305-F307 VanDerWaalsContact C-N 3.35Å; A305-F308 PolarHBondContact O-N 3.38Å; A305-A309 WeakPolarHBondContact O-CB 3.38Å; A305-A309 PolarHBondContact O-N 3.3Å; A305-T317 HydrophobicContact CB-CG2 3.87Å; A305-P319 HydrophobicContact CB-CG 4.17Å; A305-V322 HydrophobicContact CB-CG2 3.89Å
306	S	91.6	Very high	90.6	Very high	46 Å²	46	79.3 Å²	79.3	32%	0.322	41%	0.41	S	S	.	.	H	α-helix	trans	-64.9	-40	174.9	-60.1	0	0	0	0	111.5	H302 L303 V304 A309 M310 P319	H302-S306 WeakPolarHBondContact O-CB 3.2Å; H302-S306 PolarHBondContact O-N 3.05Å; H302-S306 PolarHBondContact O-OG 3.46Å; L303-S306 WeakPolarHBondContact O-CB 3.14Å; L303-S306 PolarHBondContact O-N 3.43Å; V304-S306 VanDerWaalsContact C-N 3.31Å; V304-S306 PolarHBondContact O-N 2.82Å; S306-A309 PolarHBondContact O-N 3.21Å; S306-M310 WeakPolarHBondContact O-CG 3.39Å; S306-M310 PolarHBondContact O-N 3.04Å; S306-P319 WeakPolarHBondContact OG-CG 3.39Å
307	F	92.3	Very high	90.5	Very high	156 Å²	156	78.5 Å²	78.5	68%	0.684	41%	0.405	S	S	*	.	H	α-helix	trans	-62.3	-43.5	175.3	-172.9	-97.9	0	0	0	111.9	L303 V304 A305 A309 M310	L303-F307 PolarHBondContact O-N 3.46Å; L303-F307 VanDerWaalsContact O-N 3.11Å; V304-F307 WeakPolarHBondContact O-CB 3.42Å; V304-F307 PolarHBondContact O-N 2.9Å; A305-F307 VanDerWaalsContact C-N 3.35Å; F307-A309 VanDerWaalsContact C-N 3.31Å; F307-A309 PolarHBondContact O-N 3.34Å; F307-M310 PolarHBondContact O-N 3.35Å
308	F	89.3	Confident	90.5	Very high	65 Å²	65	75.3 Å²	75.3	29%	0.285	39%	0.385	S	S	.	.	H	α-helix	trans	-65.6	-33.1	173.6	-78.1	-69.6	0	0	0	113.2	F225 V304 A305 M310 N311	F225-F308 HydrophobicContact CE1-CE1 4.21Å; F225-F308 AromaticContact CE1-CZ 3.78Å; F225-F308 HydrophobicContact CE1-CZ 3.78Å; F225-F308 HydrophobicContact CZ-CE1 4.05Å; F225-F308 AromaticContact CZ-CZ 3.84Å; F225-F308 HydrophobicContact CZ-CZ 3.84Å; V304-F308 HydrophobicContact CG1-CD2 3.94Å; V304-F308 HydrophobicContact CG1-CE2 3.7Å; V304-F308 VanDerWaalsContact O-CD2 3.27Å; V304-F308 WeakPolarHBondContact O-CD2 3.48Å; V304-F308 PolarHBondContact O-N 2.99Å; V304-F308 VanDerWaalsContact O-N 3.17Å; A305-F308 PolarHBondContact O-N 3.38Å; F308-M310 VanDerWaalsContact C-N 3.28Å; F308-M310 PolarHBondContact O-N 2.99Å; F308-N311 WeakPolarHBondContact O-CB 3.44Å; F308-N311 PolarHBondContact O-N 3.03Å
309	A	89.9	Confident	90.7	Very high	41 Å²	41	69.9 Å²	69.9	34%	0.339	37%	0.368	S	S	.	.	H	α-helix	trans	-73	-15.9	179.4	0	0	0	0	0	113.9	A305 S306 F307 N311 T318	A305-A309 WeakPolarHBondContact O-CB 3.38Å; A305-A309 PolarHBondContact O-N 3.3Å; S306-A309 PolarHBondContact O-N 3.21Å; F307-A309 VanDerWaalsContact C-N 3.31Å; F307-A309 PolarHBondContact O-N 3.34Å; A309-N311 PolarHBondContact O-N 3.46Å; A309-T318 HydrophobicContact CB-CG2 4.19Å
310	M	88.5	Confident	90.7	Very high	150 Å²	150	65.9 Å²	65.9	74%	0.739	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.5	-16.2	174.6	-72.3	177.7	173.8	0	0	113.1	S306 F307 F308	S306-M310 WeakPolarHBondContact O-CG 3.39Å; S306-M310 PolarHBondContact O-N 3.04Å; F307-M310 PolarHBondContact O-N 3.35Å; F308-M310 VanDerWaalsContact C-N 3.28Å; F308-M310 PolarHBondContact O-N 2.99Å
311	N	88.6	Confident	90.7	Very high	73 Å²	73	62.4 Å²	62.4	39%	0.39	32%	0.323	S	S	.	.			trans	-65.9	127.5	178.3	-171.4	-6.1	0	0	0	110.7	F308 A309 F313	F308-N311 WeakPolarHBondContact O-CB 3.44Å; F308-N311 PolarHBondContact O-N 3.03Å; A309-N311 PolarHBondContact O-N 3.46Å; N311-F313 PolarHBondContact O-N 3.36Å; N311-F313 VanDerWaalsContact O-O 3.1Å; N311-F313 WeakPolarHBondContact OD1-CB 3.34Å; N311-F313 WeakPolarHBondContact OD1-CD2 3.38Å; N311-F313 PolarHBondContact OD1-N 3.42Å
312	P	84.9	Confident	90.8	Very high	122 Å²	122	62 Å²	62	79%	0.792	32%	0.321	S	S	*	.	S	Bend	trans	-67.2	-21.2	174.8	27.3	-36.6	0	0	0	113.6
313	F	90.5	Very high	90.8	Very high	156 Å²	156	60.8 Å²	60.8	68%	0.684	32%	0.317	S	S	*	.	S	Bend	trans	-76.8	175	171.8	-56.1	-61.9	0	0	0	111.4	N311 P315	N311-F313 PolarHBondContact O-N 3.36Å; N311-F313 VanDerWaalsContact O-O 3.1Å; N311-F313 WeakPolarHBondContact OD1-CB 3.34Å; N311-F313 WeakPolarHBondContact OD1-CD2 3.38Å; N311-F313 PolarHBondContact OD1-N 3.42Å; F313-P315 WeakPolarHBondContact O-CD 3.03Å
314	E	87.4	Confident	90.7	Very high	110 Å²	110	55.3 Å²	55.3	51%	0.514	29%	0.288	S	S	.	.			trans	-56.2	111.3	178.2	-55.6	-148.1	144.1	0	0	111.1	R134 W136 R214	R134-E314 IonicContact CZ-OE1 3.94Å; R134-E314 IonicContact NH1-OE1 2.92Å; R134-E314 PolarHBondContact NH1-OE1 3.49Å; R134-E314 IonicContact NH2-OE1 3.78Å; R134-E314 PolarHBondContact NH2-OE1 3.32Å; W136-E314 HydrophobicContact CH2-CB 3.58Å; W136-E314 VanDerWaalsContact CH2-CD 3.48Å; W136-E314 HydrophobicContact CH2-CG 3.83Å; W136-E314 WeakPolarHBondContact CH2-OE2 3.34Å; W136-E314 HydrophobicContact CZ2-CB 3.5Å; W136-E314 VanDerWaalsContact CZ2-CB 3.5Å; W136-E314 HydrophobicContact CZ2-CG 3.5Å; R214-E314 IonicContact NH2-OE1 3.14Å; R214-E314 IonicContact NH2-OE2 2.78Å; R214-E314 PolarHBondContact NH2-OE2 3.48Å; R214-E314 VanDerWaalsContact NH2-OE2 3.15Å
315	P	89.5	Confident	90.8	Very high	13 Å²	13	52.4 Å²	52.4	8%	0.084	27%	0.27	C	S	.	.			trans	-73.6	135.2	-177.7	30.2	-33.8	0	0	0	109.7	W136 F313 T318	W136-P315 HydrophobicContact CB-CG 3.9Å; W136-P315 HydrophobicContact CD2-CG 3.94Å; W136-P315 HydrophobicContact CE3-CG 4.28Å; W136-P315 HydrophobicContact CG-CG 3.75Å; F313-P315 WeakPolarHBondContact O-CD 3.03Å; P315-T318 HydrophobicContact CB-CG2 4.06Å; P315-T318 HydrophobicContact CG-CG2 3.64Å
316	W	87.7	Confident	90.8	Very high	60 Å²	60	53 Å²	53	23%	0.227	27%	0.273	C	S	.	.	S	Bend	trans	-68.4	-37.5	177.6	175.5	68.7	0	0	0	112.4	H218 M222 F225	H218-W316 AromaticContact CE1-CE2 3.61Å; H218-W316 AromaticContact CE1-CZ2 3.58Å; H218-W316 AromaticContact ND1-CD1 3.99Å; H218-W316 AromaticContact ND1-CE2 3.51Å; H218-W316 AromaticContact ND1-CZ2 3.8Å; H218-W316 AromaticContact ND1-NE1 3.42Å; H218-W316 PolarHBondContact ND1-NE1 3.38Å; H218-W316 PolarHBondContact ND1-O 3.38Å; H218-W316 AromaticContact NE2-CZ2 3.98Å; M222-W316 HydrophobicContact CB-CH2 4.11Å; M222-W316 HydrophobicContact CB-CZ2 3.96Å; M222-W316 HydrophobicContact CE-CH2 3.65Å; M222-W316 HydrophobicContact CE-CZ2 4.5Å; M222-W316 HydrophobicContact CE-CZ3 4.46Å; M222-W316 HydrophobicContact CG-CH2 3.84Å; M222-W316 HydrophobicContact CG-CZ2 4.2Å; M222-W316 HydrophobicContact SD-CH2 4.33Å; F225-W316 AromaticContact CD2-CH2 3.83Å; F225-W316 HydrophobicContact CD2-CH2 3.83Å; F225-W316 HydrophobicContact CD2-CZ2 4.45Å; F225-W316 AromaticContact CD2-CZ3 3.86Å; F225-W316 HydrophobicContact CD2-CZ3 3.86Å; F225-W316 HydrophobicContact CE2-CD2 4.03Å; F225-W316 AromaticContact CE2-CE3 3.53Å; F225-W316 HydrophobicContact CE2-CE3 3.53Å; F225-W316 AromaticContact CE2-CH2 3.59Å; F225-W316 HydrophobicContact CE2-CH2 3.59Å; F225-W316 HydrophobicContact CE2-CZ2 4.07Å; F225-W316 AromaticContact CE2-CZ3 3.29Å; F225-W316 HydrophobicContact CE2-CZ3 3.29Å; F225-W316 AromaticContact CZ-CE3 3.94Å; F225-W316 HydrophobicContact CZ-CE3 3.94Å; F225-W316 AromaticContact CZ-CZ3 4Å; F225-W316 HydrophobicContact CZ-CZ3 4Å
317	T	89.8	Confident	90.9	Very high	3 Å²	3	52.1 Å²	52.1	2%	0.018	27%	0.265	C	S	.	.			trans	-134.2	141.6	178.9	-52.6	0	0	0	0	110.1	H218 Y301 A305 V322	H218-T317 PolarHBondContact CE1-OG1 3.03Å; Y301-T317 HydrophobicContact CE2-CG2 4.36Å; A305-T317 HydrophobicContact CB-CG2 3.87Å; T317-V322 HydrophobicContact CG2-CG2 3.84Å
318	T	92.9	Very high	91	Very high	10 Å²	10	47.4 Å²	47.4	6%	0.061	25%	0.249	C	C	.	.			trans	-131.8	156.3	173.1	58.7	0	0	0	0	109.8	W136 A309 P315 D320 K321 V322	W136-T318 HydrophobicContact CB-CG2 3.8Å; A309-T318 HydrophobicContact CB-CG2 4.19Å; P315-T318 HydrophobicContact CB-CG2 4.06Å; P315-T318 HydrophobicContact CG-CG2 3.64Å; T318-D320 PolarHBondContact O-N 3.35Å; T318-K321 WeakPolarHBondContact O-CB 3.18Å; T318-K321 PolarHBondContact O-N 2.96Å; T318-K321 VanDerWaalsContact O-N 3.07Å; T318-K321 VanDerWaalsContact OG1-CB 3.25Å; T318-K321 WeakPolarHBondContact OG1-CB 3.21Å; T318-K321 PolarHBondContact OG1-N 3.16Å; T318-V322 PolarHBondContact O-N 2.99Å
319	P	92.7	Very high	91.2	Very high	34 Å²	34	44.3 Å²	44.3	22%	0.221	24%	0.236	C	C	.	.	H	α-helix	trans	-55.9	-40.1	176.9	-26.4	35.2	0	0	0	112.3	A305 S306 K321 V322 D323	A305-P319 HydrophobicContact CB-CG 4.17Å; S306-P319 WeakPolarHBondContact OG-CG 3.39Å; P319-K321 PolarHBondContact O-N 3.32Å; P319-V322 WeakPolarHBondContact O-CB 3.46Å; P319-V322 PolarHBondContact O-N 3.34Å; P319-D323 PolarHBondContact O-N 3.18Å; P319-D323 VanDerWaalsContact O-N 3.1Å
320	D	93	Very high	91.3	Very high	17 Å²	17	45.9 Å²	45.9	9%	0.091	24%	0.237	C	C	.	.	H	α-helix	trans	-61.9	-41.5	175.9	-175.6	90.6	0	0	0	112.5	F143 S180 K181 Y182 T318 V322 D323 R324	F143-D320 HydrophobicContact CE2-CB 4.42Å; S180-D320 WeakPolarHBondContact CA-OD1 3.24Å; S180-D320 VanDerWaalsContact CB-OD1 3.3Å; S180-D320 WeakPolarHBondContact CB-OD1 3.46Å; K181-D320 PolarHBondContact N-OD1 3.01Å; Y182-D320 WeakPolarHBondContact CB-OD1 3.35Å; Y182-D320 WeakPolarHBondContact CB-OD2 3.39Å; Y182-D320 PolarHBondContact N-OD1 2.9Å; T318-D320 PolarHBondContact O-N 3.35Å; D320-V322 VanDerWaalsContact C-N 3.32Å; D320-V322 PolarHBondContact O-N 3.19Å; D320-D323 PolarHBondContact O-N 3.5Å; D320-R324 WeakPolarHBondContact O-CB 3.28Å; D320-R324 PolarHBondContact O-N 3.12Å
321	K	93.6	Very high	91.2	Very high	12 Å²	12	45.3 Å²	45.3	5%	0.052	23%	0.231	C	C	.	.	H	α-helix	trans	-63.5	-37.8	175.8	-172.4	166.9	-171.4	157.2	0	112.1	E135 R214 T318 P319 R324 F325	E135-K321 IonicContact OE2-NZ 2.88Å; E135-K321 PolarHBondContact OE2-NZ 3.31Å; R214-K321 PolarHBondContact O-NZ 3.41Å; T318-K321 WeakPolarHBondContact O-CB 3.18Å; T318-K321 PolarHBondContact O-N 2.96Å; T318-K321 VanDerWaalsContact O-N 3.07Å; T318-K321 VanDerWaalsContact OG1-CB 3.25Å; T318-K321 WeakPolarHBondContact OG1-CB 3.21Å; T318-K321 PolarHBondContact OG1-N 3.16Å; P319-K321 PolarHBondContact O-N 3.32Å; K321-R324 PolarHBondContact O-N 2.95Å; K321-F325 HydrophobicContact CD-CE2 4.15Å; K321-F325 HydrophobicContact CD-CZ 4.11Å; K321-F325 VanDerWaalsContact CE-CE2 3.43Å; K321-F325 HydrophobicContact CG-CD2 4.15Å; K321-F325 HydrophobicContact CG-CE1 4.16Å; K321-F325 HydrophobicContact CG-CE2 3.73Å; K321-F325 HydrophobicContact CG-CZ 3.77Å; K321-F325 WeakPolarHBondContact O-CB 3.2Å; K321-F325 WeakPolarHBondContact O-CG 3.3Å; K321-F325 PolarHBondContact O-N 3.46Å
322	V	93.3	Very high	91.1	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-60.6	-49.6	173.9	174.4	0	0	0	0	110.1	I232 Y301 A305 T317 T318 P319 D320 R324 F325 H326	I232-V322 HydrophobicContact CD1-CG1 3.62Å; Y301-V322 HydrophobicContact CD1-CB 4.36Å; Y301-V322 HydrophobicContact CD1-CG1 3.37Å; Y301-V322 HydrophobicContact CD1-CG2 4.02Å; Y301-V322 HydrophobicContact CD2-CG2 3.95Å; Y301-V322 HydrophobicContact CE1-CB 4.39Å; Y301-V322 HydrophobicContact CE1-CG1 3.71Å; Y301-V322 HydrophobicContact CE1-CG2 3.87Å; Y301-V322 HydrophobicContact CE2-CG2 3.75Å; Y301-V322 HydrophobicContact CG-CG1 3.86Å; Y301-V322 HydrophobicContact CG-CG2 4.06Å; A305-V322 HydrophobicContact CB-CG2 3.89Å; T317-V322 HydrophobicContact CG2-CG2 3.84Å; T318-V322 PolarHBondContact O-N 2.99Å; P319-V322 WeakPolarHBondContact O-CB 3.46Å; P319-V322 PolarHBondContact O-N 3.34Å; D320-V322 VanDerWaalsContact C-N 3.32Å; D320-V322 PolarHBondContact O-N 3.19Å; V322-R324 PolarHBondContact O-N 3.01Å; V322-F325 PolarHBondContact O-N 3.19Å; V322-H326 PolarHBondContact O-N 3.4Å; V322-H326 VanDerWaalsContact O-N 3.14Å; V322-H326 PolarHBondContact O-ND1 3.27Å
323	D	92.9	Very high	90.9	Very high	27 Å²	27	45.2 Å²	45.2	14%	0.144	23%	0.225	C	C	.	.	H	α-helix	trans	-64.2	-41.5	179.7	-71.9	-22.2	0	0	0	112.2	P179 H302 P319 D320 F325 H326 T327	P179-D323 HydrophobicContact CG-CB 4.43Å; H302-D323 IonicContact CD2-OD1 4Å; H302-D323 IonicContact CE1-OD1 3.33Å; H302-D323 PolarHBondContact CE1-OD1 2.98Å; H302-D323 IonicContact CE1-OD2 3.2Å; H302-D323 PolarHBondContact CE1-OD2 3.32Å; H302-D323 IonicContact NE2-OD1 2.76Å; H302-D323 PolarHBondContact NE2-OD1 3.14Å; H302-D323 IonicContact NE2-OD2 3.47Å; H302-D323 PolarHBondContact NE2-OD2 2.81Å; P319-D323 PolarHBondContact O-N 3.18Å; P319-D323 VanDerWaalsContact O-N 3.1Å; D320-D323 PolarHBondContact O-N 3.5Å; D323-F325 PolarHBondContact O-N 2.67Å; D323-H326 CarbonylContact O-C 3.52Å; D323-H326 PolarHBondContact O-N 3.46Å; D323-T327 WeakPolarHBondContact O-CB 3.44Å; D323-T327 PolarHBondContact O-N 2.96Å; D323-T327 PolarHBondContact O-OG1 3.39Å
324	R	93	Very high	90.7	Very high	4 Å²	4	41.4 Å²	41.4	2%	0.015	23%	0.229	C	C	.	.	H	α-helix	trans	-60.3	-44.1	177.3	-178.1	167.7	61.5	116.9	-9.1	112.6	E135 E207 K240 D320 K321 V322 H326 T327	E135-R324 IonicContact OE1-CZ 2.79Å; E135-R324 IonicContact OE1-NH1 3.99Å; E135-R324 IonicContact OE1-NH2 2.75Å; E135-R324 PolarHBondContact OE1-NH2 2.69Å; E135-R324 IonicContact OE2-NH2 2.84Å; E207-R324 WeakPolarHBondContact OE1-CD 3.15Å; E207-R324 WeakPolarHBondContact OE1-CG 3.21Å; E207-R324 IonicContact OE1-CZ 2.82Å; E207-R324 IonicContact OE1-NE 2.71Å; E207-R324 IonicContact OE1-NH1 3.01Å; E207-R324 PolarHBondContact OE1-NH1 2.81Å; E207-R324 IonicContact OE2-NH1 3.73Å; E207-R324 PolarHBondContact OE2-NH1 2.95Å; E207-R324 VanDerWaalsContact OE2-NH1 3.1Å; K240-R324 PolarHBondContact NZ-O 2.96Å; D320-R324 WeakPolarHBondContact O-CB 3.28Å; D320-R324 PolarHBondContact O-N 3.12Å; K321-R324 PolarHBondContact O-N 2.95Å; V322-R324 PolarHBondContact O-N 3.01Å; R324-H326 VanDerWaalsContact C-N 3.31Å; R324-H326 PolarHBondContact O-N 3.14Å; R324-T327 PolarHBondContact O-N 3.24Å
325	F	92.8	Very high	90.9	Very high	2 Å²	2	38.9 Å²	38.9	1%	0.009	22%	0.219	C	C	.	.	H	α-helix	trans	-69.3	-29.1	178.4	-71	-6.1	0	0	0	113.1	F215 H218 F219 K240 K321 V322 D323	F215-F325 AromaticContact CD2-CD1 3.92Å; F215-F325 HydrophobicContact CD2-CD1 3.92Å; F215-F325 AromaticContact CD2-CE1 3.47Å; F215-F325 HydrophobicContact CD2-CE1 3.47Å; F215-F325 VanDerWaalsContact CD2-CE1 3.47Å; F215-F325 HydrophobicContact CD2-CE2 4.39Å; F215-F325 AromaticContact CD2-CZ 3.7Å; F215-F325 HydrophobicContact CD2-CZ 3.7Å; F215-F325 AromaticContact CE2-CD1 3.95Å; F215-F325 HydrophobicContact CE2-CD1 3.95Å; F215-F325 AromaticContact CE2-CE1 3.99Å; F215-F325 HydrophobicContact CE2-CE1 3.99Å; F215-F325 HydrophobicContact CE2-CG 4.36Å; F215-F325 HydrophobicContact CE2-CZ 4.41Å; H218-F325 HydrophobicContact CB-CE2 4.43Å; H218-F325 AromaticContact CD2-CE2 3.44Å; H218-F325 VanDerWaalsContact CD2-CE2 3.44Å; H218-F325 WeakPolarHBondContact CD2-CE2 3.24Å; H218-F325 AromaticContact CG-CE2 3.89Å; H218-F325 AromaticContact NE2-CE2 3.74Å; F219-F325 HydrophobicContact CZ-CD2 4.02Å; F219-F325 HydrophobicContact CZ-CE2 4.45Å; K240-F325 WeakPolarHBondContact CE-O 3.03Å; K321-F325 HydrophobicContact CD-CE2 4.15Å; K321-F325 HydrophobicContact CD-CZ 4.11Å; K321-F325 VanDerWaalsContact CE-CE2 3.43Å; K321-F325 HydrophobicContact CG-CD2 4.15Å; K321-F325 HydrophobicContact CG-CE1 4.16Å; K321-F325 HydrophobicContact CG-CE2 3.73Å; K321-F325 HydrophobicContact CG-CZ 3.77Å; K321-F325 WeakPolarHBondContact O-CB 3.2Å; K321-F325 WeakPolarHBondContact O-CG 3.3Å; K321-F325 PolarHBondContact O-N 3.46Å; V322-F325 PolarHBondContact O-N 3.19Å; D323-F325 PolarHBondContact O-N 2.67Å
326	H	92.3	Very high	91.1	Very high	12 Å²	12	39.8 Å²	39.8	6%	0.056	23%	0.225	C	C	.	.	H	α-helix	trans	-95.3	1.8	179.9	-63.4	84.3	0	0	0	113.8	I232 T238 Y301 V322 D323 R324	I232-H326 WeakPolarHBondContact CB-CD2 3.14Å; I232-H326 HydrophobicContact CD1-CB 4.06Å; I232-H326 VanDerWaalsContact CD1-CG 3.47Å; I232-H326 PolarHBondContact N-NE2 3.17Å; I232-H326 VanDerWaalsContact N-NE2 3.12Å; T238-H326 WeakPolarHBondContact CG2-O 3.46Å; T238-H326 PolarHBondContact OG1-O 2.96Å; Y301-H326 AromaticContact CE1-CE1 3.73Å; V322-H326 PolarHBondContact O-N 3.4Å; V322-H326 VanDerWaalsContact O-N 3.14Å; V322-H326 PolarHBondContact O-ND1 3.27Å; D323-H326 CarbonylContact O-C 3.52Å; D323-H326 PolarHBondContact O-N 3.46Å; R324-H326 VanDerWaalsContact C-N 3.31Å; R324-H326 PolarHBondContact O-N 3.14Å
327	T	93.3	Very high	91.3	Very high	27 Å²	27	37.8 Å²	37.8	17%	0.166	22%	0.223	C	C	.	.	S	Bend	trans	-84.3	130	171.6	-62.5	0	0	0	0	109.6	N173 K240 D323 R324	N173-T327 HydrophobicContact CB-CG2 4.46Å; K240-T327 WeakPolarHBondContact CE-O 3.31Å; K240-T327 PolarHBondContact NZ-O 2.73Å; D323-T327 WeakPolarHBondContact O-CB 3.44Å; D323-T327 PolarHBondContact O-N 2.96Å; D323-T327 PolarHBondContact O-OG1 3.39Å; R324-T327 PolarHBondContact O-N 3.24Å
328	T	94.5	Very high	91.4	Very high	57 Å²	57	38 Å²	38	35%	0.35	22%	0.224	S	C	.	.	P	Polyproline II helix	trans	-72.2	139	178.8	-63.9	0	0	0	0	110.8	V239 M330	V239-T328 HydrophobicContact CB-CG2 3.92Å; V239-T328 PolarHBondContact N-OG1 2.92Å; V239-T328 WeakPolarHBondContact O-CA 3.31Å; T328-M330 PolarHBondContact O-N 2.88Å
329	D	94.7	Very high	91.4	Very high	1 Å²	1	44.7 Å²	44.7	1%	0.005	26%	0.255	C	S	.	.	P	Polyproline II helix	trans	-70.4	126.6	176	-70.1	-7.7	0	0	0	110.5	L172 N173 V239 K240 Q241 R273	L172-D329 HydrophobicContact CD2-CB 3.99Å; N173-D329 PolarHBondContact ND2-OD1 3.06Å; N173-D329 WeakPolarHBondContact OD1-CA 3.15Å; V239-D329 PolarHBondContact O-N 3Å; K240-D329 VanDerWaalsContact CA-OD2 3.31Å; K240-D329 WeakPolarHBondContact CA-OD2 3.38Å; K240-D329 VanDerWaalsContact CD-OD1 3.27Å; K240-D329 WeakPolarHBondContact CD-OD1 3.47Å; K240-D329 WeakPolarHBondContact CD-OD2 3.33Å; K240-D329 IonicContact NZ-OD1 3.68Å; K240-D329 PolarHBondContact NZ-OD1 3.43Å; K240-D329 VanDerWaalsContact NZ-OD1 3.09Å; Q241-D329 PolarHBondContact N-OD2 3.2Å; R273-D329 PolarHBondContact NH2-O 3.46Å
330	M	90.8	Very high	91.4	Very high	74 Å²	74	48.5 Å²	48.5	37%	0.365	27%	0.273	S	S	.	.	P	Polyproline II helix	trans	-77.5	148.5	-178.2	-65.8	-174.9	-177.5	0	0	112.1	N173 D175 T328 Y332	N173-M330 PolarHBondContact OD1-N 3.46Å; D175-M330 HydrophobicContact CB-CE 4.47Å; T328-M330 PolarHBondContact O-N 2.88Å; M330-Y332 HydrophobicContact CB-CD2 4.32Å; M330-Y332 HydrophobicContact CB-CE2 3.63Å; M330-Y332 PolarHBondContact SD-OH 3.45Å
331	K	87	Confident	91.4	Very high	137 Å²	137	48.2 Å²	48.2	60%	0.596	27%	0.272	S	S	*	.	P	Polyproline II helix	trans	-97.9	121.7	175	-168	178.2	-177.8	175.9	0	109.9	P333	K331-P333 VanDerWaalsContact O-CD 3.32Å; K331-P333 WeakPolarHBondContact O-CD 3.13Å
332	Y	86.6	Confident	91.4	Very high	75 Å²	75	50.9 Å²	50.9	29%	0.294	30%	0.302	S	S	.	.			trans	-116.4	81	176.2	-64.1	-78.4	0	0	0	110.4	L172 M330 G334 L335	L172-Y332 HydrophobicContact CD1-CD2 3.75Å; L172-Y332 HydrophobicContact CD1-CE2 4.02Å; L172-Y332 HydrophobicContact CG-CD2 4.4Å; L172-Y332 HydrophobicContact CG-CE2 4.26Å; L172-Y332 WeakPolarHBondContact O-CE2 3.49Å; M330-Y332 HydrophobicContact CB-CD2 4.32Å; M330-Y332 HydrophobicContact CB-CE2 3.63Å; M330-Y332 PolarHBondContact SD-OH 3.45Å; Y332-G334 PolarHBondContact O-N 3.24Å; Y332-L335 HydrophobicContact CD1-CD1 4.13Å; Y332-L335 HydrophobicContact CD2-CD1 4.41Å; Y332-L335 HydrophobicContact CG-CD1 3.83Å; Y332-L335 HydrophobicContact CG-CG 4.49Å; Y332-L335 PolarHBondContact O-N 3.1Å
333	P	81.1	Confident	91.4	Very high	118 Å²	118	51.3 Å²	51.3	77%	0.766	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.4	-19.4	-176.6	29	-34.7	0	0	0	113.4	K331	K331-P333 VanDerWaalsContact O-CD 3.32Å; K331-P333 WeakPolarHBondContact O-CD 3.13Å
334	G	85.1	Confident	91.6	Very high	76 Å²	76	56 Å²	56	78%	0.784	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.7	-0.4	179.1	0	0	0	0	0	114.9	Y332	Y332-G334 PolarHBondContact O-N 3.24Å
335	L	91.7	Very high	91.6	Very high	57 Å²	57	57.1 Å²	57.1	30%	0.298	34%	0.342	S	S	.	.	S	Bend	trans	-99	141.9	177.4	-66.8	-178.8	0	0	0	110.4	T265 A267 Y332	T265-L335 HydrophobicContact CG2-CD1 4.29Å; A267-L335 HydrophobicContact CB-CB 3.93Å; A267-L335 HydrophobicContact CB-CD1 4.12Å; Y332-L335 HydrophobicContact CD1-CD1 4.13Å; Y332-L335 HydrophobicContact CD2-CD1 4.41Å; Y332-L335 HydrophobicContact CG-CD1 3.83Å; Y332-L335 HydrophobicContact CG-CG 4.49Å; Y332-L335 PolarHBondContact O-N 3.1Å
336	P	93.6	Very high	91.7	Very high	32 Å²	32	57.7 Å²	57.7	21%	0.208	35%	0.347	C	S	.	.			trans	-62.3	143	174.8	26.3	-35.2	0	0	0	111.6	T265 Y266 A267 D340	T265-P336 VanDerWaalsContact O-CD 3.27Å; T265-P336 WeakPolarHBondContact O-CD 3.09Å; T265-P336 WeakPolarHBondContact O-CG 3.44Å; Y266-P336 CarbonylContact C-O 3.55Å; Y266-P336 WeakPolarHBondContact CA-O 3.49Å; Y266-P336 HydrophobicContact CD1-CB 3.65Å; Y266-P336 HydrophobicContact CD1-CG 3.58Å; Y266-P336 HydrophobicContact CE1-CB 3.65Å; Y266-P336 HydrophobicContact CE1-CG 3.7Å; Y266-P336 HydrophobicContact CG-CG 4.19Å; A267-P336 PolarHBondContact N-O 2.86Å; P336-D340 WeakPolarHBondContact CA-OD2 3.2Å; P336-D340 HydrophobicContact CB-CB 4.33Å; P336-D340 VanDerWaalsContact CB-OD2 3.23Å; P336-D340 WeakPolarHBondContact CB-OD2 3.18Å
337	G	92.3	Very high	91.7	Very high	18 Å²	18	58 Å²	58	19%	0.186	35%	0.35	C	S	.	.			trans	-107.5	-163.7	-172.2	0	0	0	0	0	114.2	E339 D340	G337-E339 VanDerWaalsContact C-N 3.32Å; G337-D340 PolarHBondContact N-OD2 3.43Å
338	L	92.6	Very high	91.7	Very high	7 Å²	7	56.8 Å²	56.8	4%	0.037	34%	0.343	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.1	-31.3	172.8	-76.4	170.3	0	0	0	112.6	V243 A251 L268 V269 L341 I343 P345	V243-L338 HydrophobicContact CG2-CD1 3.94Å; A251-L338 HydrophobicContact CB-CD2 3.72Å; L268-L338 HydrophobicContact CB-CD2 4.33Å; L268-L338 HydrophobicContact CB-CG 4.4Å; L268-L338 HydrophobicContact CD2-CD2 3.76Å; L268-L338 HydrophobicContact CD2-CG 4.15Å; V269-L338 VanDerWaalsContact O-CD1 3.32Å; V269-L338 WeakPolarHBondContact O-CD1 3.2Å; L338-L341 PolarHBondContact O-N 2.99Å; L338-I343 CarbonylContact C-O 3.11Å; L338-I343 HydrophobicContact CB-CB 4.45Å; L338-I343 HydrophobicContact CD2-CD1 4.39Å; L338-I343 HydrophobicContact CD2-CG2 4.47Å; L338-I343 PolarHBondContact O-N 2.71Å; L338-P345 HydrophobicContact CD1-CB 3.94Å
339	E	92.9	Very high	91.6	Very high	151 Å²	151	55.4 Å²	55.4	71%	0.706	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.6	-38.3	-177	-64.1	177	-178.6	0	0	111.7	G337 L341 G342	G337-E339 VanDerWaalsContact C-N 3.32Å; E339-L341 PolarHBondContact O-N 3.03Å; E339-G342 WeakPolarHBondContact O-CA 3.27Å; E339-G342 PolarHBondContact O-N 3.29Å
340	D	92.8	Very high	91.4	Very high	114 Å²	114	61.3 Å²	61.3	61%	0.61	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.3	-26.9	175.9	-58.7	-44.9	0	0	0	112.3	P336 G337 G342	P336-D340 WeakPolarHBondContact CA-OD2 3.2Å; P336-D340 HydrophobicContact CB-CB 4.33Å; P336-D340 VanDerWaalsContact CB-OD2 3.23Å; P336-D340 WeakPolarHBondContact CB-OD2 3.18Å; G337-D340 PolarHBondContact N-OD2 3.43Å; D340-G342 VanDerWaalsContact C-N 3.25Å; D340-G342 PolarHBondContact O-N 3.21Å
341	L	92.8	Very high	91.6	Very high	11 Å²	11	60.7 Å²	60.7	6%	0.058	36%	0.356	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88	9.1	174.5	-64.1	172.5	0	0	0	112.5	M203 A251 N254 A255 Y266 L268 L338 E339 I343	M203-L341 HydrophobicContact CE-CD1 4.35Å; A251-L341 HydrophobicContact CB-CD1 3.72Å; N254-L341 HydrophobicContact CB-CB 4.36Å; N254-L341 PolarHBondContact ND2-O 3.07Å; A255-L341 HydrophobicContact CB-CD2 4.28Å; Y266-L341 HydrophobicContact CD1-CD1 3.94Å; Y266-L341 HydrophobicContact CD1-CG 4.18Å; Y266-L341 HydrophobicContact CE1-CD1 4.09Å; Y266-L341 HydrophobicContact CE1-CD2 3.84Å; Y266-L341 HydrophobicContact CE1-CG 3.9Å; Y266-L341 HydrophobicContact CG-CD1 4.36Å; L268-L341 HydrophobicContact CD2-CD1 4.38Å; L338-L341 PolarHBondContact O-N 2.99Å; E339-L341 PolarHBondContact O-N 3.03Å; L341-I343 HydrophobicContact CB-CD1 4.18Å
342	G	92.8	Very high	91.8	Very high	68 Å²	68	54.2 Å²	54.2	70%	0.701	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.9	27.5	178.5	0	0	0	0	0	114	E339 D340	E339-G342 WeakPolarHBondContact O-CA 3.27Å; E339-G342 PolarHBondContact O-N 3.29Å; D340-G342 VanDerWaalsContact C-N 3.25Å; D340-G342 PolarHBondContact O-N 3.21Å
343	I	94.9	Very high	92.1	Very high	9 Å²	9	51.4 Å²	51.4	5%	0.046	32%	0.317	C	S	.	.			trans	-115.3	121.5	-176.3	-61.3	159.5	0	0	0	109.9	D247 K250 A251 L338 L341 P345	D247-I343 HydrophobicContact CB-CG2 3.95Å; K250-I343 VanDerWaalsContact C-CD1 3.49Å; K250-I343 HydrophobicContact CB-CD1 3.59Å; K250-I343 HydrophobicContact CB-CG1 4.12Å; K250-I343 HydrophobicContact CD-CG2 4.4Å; A251-I343 HydrophobicContact CB-CD1 3.73Å; L338-I343 CarbonylContact C-O 3.11Å; L338-I343 HydrophobicContact CB-CB 4.45Å; L338-I343 HydrophobicContact CD2-CD1 4.39Å; L338-I343 HydrophobicContact CD2-CG2 4.47Å; L338-I343 PolarHBondContact O-N 2.71Å; L341-I343 HydrophobicContact CB-CD1 4.18Å; I343-P345 WeakPolarHBondContact O-CD 3.4Å
344	V	95.2	Very high	92.7	Very high	127 Å²	127	49.5 Å²	49.5	77%	0.77	30%	0.298	S	S	*	.	P	Polyproline II helix	trans	-76.7	119.7	168.6	-177.8	0	0	0	0	108.5	A346	V344-A346 PolarHBondContact O-N 3.01Å
345	P	94.1	Very high	93.1	Very high	26 Å²	26	46.1 Å²	46.1	17%	0.169	26%	0.262	C	S	.	.	P	Polyproline II helix	trans	-70.9	128.6	-177.3	29.1	-35.2	0	0	0	111.3	P271 L338 I343	P271-P345 HydrophobicContact CB-CB 4.43Å; P271-P345 HydrophobicContact CB-CG 4.09Å; P271-P345 HydrophobicContact CG-CB 4.46Å; L338-P345 HydrophobicContact CD1-CB 3.94Å; I343-P345 WeakPolarHBondContact O-CD 3.4Å
346	A	94.1	Very high	93.3	Very high	15 Å²	15	43.4 Å²	43.4	12%	0.124	25%	0.248	C	C	.	.	P	Polyproline II helix	trans	-73.9	138.1	175.2	0	0	0	0	0	111.4	H244 D247 P271 V344 K351	H244-A346 HydrophobicContact CB-CB 4.23Å; D247-A346 VanDerWaalsContact OD2-CB 3.28Å; D247-A346 WeakPolarHBondContact OD2-CB 3.36Å; D247-A346 PolarHBondContact OD2-N 3.43Å; P271-A346 WeakPolarHBondContact CD-O 3.48Å; V344-A346 PolarHBondContact O-N 3.01Å; A346-K351 HydrophobicContact CB-CG 4.19Å
347	S	93.4	Very high	93.3	Very high	17 Å²	17	48 Å²	48	12%	0.119	26%	0.261	C	S	.	.	P	Polyproline II helix	trans	-77.6	156.6	176.8	94.7	0	0	0	0	111.8	E349 Q350	S347-E349 VanDerWaalsContact C-N 3.27Å; S347-E349 WeakPolarHBondContact CB-OE2 3.41Å; S347-E349 PolarHBondContact O-N 3.24Å; S347-E349 PolarHBondContact OG-N 2.95Å; S347-E349 PolarHBondContact OG-OE2 3.45Å; S347-Q350 PolarHBondContact O-N 3.36Å; S347-Q350 WeakPolarHBondContact OG-CG 3.29Å; S347-Q350 PolarHBondContact OG-N 3.34Å
348	V	92.4	Very high	93.4	Very high	3 Å²	3	53.9 Å²	53.9	2%	0.018	28%	0.278	C	S	.	.	H	α-helix	trans	-61.7	-40.7	177.2	173.5	0	0	0	0	110.4	F209 F216 P242 Y274 Y282 Q350 K351 A352	F209-V348 HydrophobicContact CD1-CG2 4.47Å; F209-V348 HydrophobicContact CE1-CG2 3.88Å; F209-V348 HydrophobicContact CZ-CB 4.46Å; F209-V348 HydrophobicContact CZ-CG2 4.08Å; F216-V348 HydrophobicContact CE2-CG1 3.74Å; F216-V348 HydrophobicContact CZ-CG1 3.6Å; F216-V348 HydrophobicContact CZ-CG2 4.3Å; P242-V348 HydrophobicContact CG-CG2 3.54Å; Y274-V348 HydrophobicContact CE2-CB 4.16Å; Y274-V348 HydrophobicContact CE2-CG2 3.7Å; Y282-V348 HydrophobicContact CD1-CG1 4.3Å; Y282-V348 HydrophobicContact CE1-CG1 4.02Å; V348-Q350 VanDerWaalsContact C-N 3.3Å; V348-Q350 PolarHBondContact O-N 3.37Å; V348-K351 PolarHBondContact O-N 3.35Å; V348-A352 HydrophobicContact CG1-CB 4.28Å; V348-A352 WeakPolarHBondContact O-CB 3.25Å; V348-A352 PolarHBondContact O-N 3.16Å
349	E	92.2	Very high	93.4	Very high	28 Å²	28	53.7 Å²	53.7	13%	0.131	28%	0.277	C	S	.	.	H	α-helix	trans	-60.9	-41.4	-175.8	-58	79.1	-171.9	0	0	111.7	Y274 Y282 S347 K351 L369 P374	Y274-E349 WeakPolarHBondContact CE1-OE1 3.49Å; Y274-E349 VanDerWaalsContact CZ-OE1 3.32Å; Y274-E349 PolarHBondContact OH-OE1 3.43Å; Y274-E349 PolarHBondContact OH-OE2 3.41Å; Y282-E349 WeakPolarHBondContact OH-CA 3.3Å; S347-E349 VanDerWaalsContact C-N 3.27Å; S347-E349 WeakPolarHBondContact CB-OE2 3.41Å; S347-E349 PolarHBondContact O-N 3.24Å; S347-E349 PolarHBondContact OG-N 2.95Å; S347-E349 PolarHBondContact OG-OE2 3.45Å; E349-K351 VanDerWaalsContact C-N 3.31Å; E349-K351 PolarHBondContact O-N 3.18Å; E349-L369 WeakPolarHBondContact O-CD2 3.27Å; E349-P374 HydrophobicContact CG-CB 4Å
350	Q	92.1	Very high	93.5	Very high	124 Å²	124	47.1 Å²	47.1	58%	0.579	25%	0.246	S	C	*	.	H	α-helix	trans	-65.8	-31.4	-179.8	-67.6	173.7	-2.3	0	0	113.3	S347 V348	S347-Q350 PolarHBondContact O-N 3.36Å; S347-Q350 WeakPolarHBondContact OG-CG 3.29Å; S347-Q350 PolarHBondContact OG-N 3.34Å; V348-Q350 VanDerWaalsContact C-N 3.3Å; V348-Q350 PolarHBondContact O-N 3.37Å
351	K	93.7	Very high	93.4	Very high	62 Å²	62	49 Å²	49	27%	0.27	24%	0.244	S	C	.	.	H	α-helix	trans	-114.1	-16.1	-168.1	-68.5	-53.8	-174	-168	0	114.9	F209 A346 V348 E349 I353 E354	F209-K351 HydrophobicContact CE2-CB 3.68Å; F209-K351 HydrophobicContact CZ-CB 4.2Å; A346-K351 HydrophobicContact CB-CG 4.19Å; V348-K351 PolarHBondContact O-N 3.35Å; E349-K351 VanDerWaalsContact C-N 3.31Å; E349-K351 PolarHBondContact O-N 3.18Å; K351-I353 VanDerWaalsContact C-N 3.26Å; K351-I353 PolarHBondContact O-N 3.06Å; K351-E354 WeakPolarHBondContact CD-OE1 3.44Å; K351-E354 IonicContact NZ-OE1 2.78Å; K351-E354 PolarHBondContact NZ-OE1 2.93Å; K351-E354 PolarHBondContact O-N 3.06Å
352	A	91.3	Very high	93.5	Very high	0 Å²	0	57.6 Å²	57.6	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-57.2	-37.3	-178.1	0	0	0	0	0	113.1	F216 Y282 V348 E354 V355 L356	F216-A352 HydrophobicContact CE2-CB 4.41Å; Y282-A352 HydrophobicContact CE1-CB 3.78Å; V348-A352 HydrophobicContact CG1-CB 4.28Å; V348-A352 WeakPolarHBondContact O-CB 3.25Å; V348-A352 PolarHBondContact O-N 3.16Å; A352-E354 VanDerWaalsContact C-N 3.32Å; A352-E354 PolarHBondContact O-N 2.96Å; A352-V355 PolarHBondContact O-N 3.44Å; A352-L356 HydrophobicContact CB-CD1 4.28Å; A352-L356 WeakPolarHBondContact O-CB 3.38Å; A352-L356 WeakPolarHBondContact O-CG 3.47Å; A352-L356 PolarHBondContact O-N 3.39Å
353	I	93.6	Very high	93.5	Very high	17 Å²	17	64.5 Å²	64.5	9%	0.087	29%	0.286	C	S	.	.	H	α-helix	trans	-61.2	-38.5	-179.9	-176.6	57.7	0	0	0	113	V286 K351 V355 L356 R357 R360 L369	V286-I353 HydrophobicContact CG1-CD1 4.34Å; K351-I353 VanDerWaalsContact C-N 3.26Å; K351-I353 PolarHBondContact O-N 3.06Å; I353-V355 PolarHBondContact O-N 3.33Å; I353-L356 PolarHBondContact O-N 3.26Å; I353-R357 HydrophobicContact CD1-CB 4.15Å; I353-R357 WeakPolarHBondContact O-CB 3.18Å; I353-R357 PolarHBondContact O-N 3.11Å; I353-R360 VanDerWaalsContact CD1-NH2 3.33Å; I353-L369 HydrophobicContact CB-CD1 3.66Å; I353-L369 HydrophobicContact CG2-CD1 3.94Å
354	E	93.6	Very high	93.4	Very high	77 Å²	77	67.5 Å²	67.5	36%	0.36	30%	0.299	S	S	.	.	H	α-helix	trans	-63.8	-27.9	-178.8	-60.6	-175.2	-155.9	0	0	111.9	R211 K351 A352	R211-E354 IonicContact CZ-OE2 2.93Å; R211-E354 IonicContact NE-OE2 3.15Å; R211-E354 IonicContact NH2-OE2 3.84Å; R211-E354 PolarHBondContact NH2-OE2 3.09Å; K351-E354 WeakPolarHBondContact CD-OE1 3.44Å; K351-E354 IonicContact NZ-OE1 2.78Å; K351-E354 PolarHBondContact NZ-OE1 2.93Å; K351-E354 PolarHBondContact O-N 3.06Å; A352-E354 VanDerWaalsContact C-N 3.32Å; A352-E354 PolarHBondContact O-N 2.96Å
355	V	94.2	Very high	93.2	Very high	5 Å²	5	64.6 Å²	64.6	3%	0.03	28%	0.279	C	S	.	.	H	α-helix	trans	-87.2	-47.8	178.2	-175.5	0	0	0	0	110.6	G210 F216 A352 I353	G210-V355 WeakPolarHBondContact O-CG1 3.34Å; G210-V355 WeakPolarHBondContact O-CG2 3.45Å; F216-V355 HydrophobicContact CB-CG1 4.38Å; A352-V355 PolarHBondContact O-N 3.44Å; I353-V355 PolarHBondContact O-N 3.33Å
356	L	94.8	Very high	93.1	Very high	0 Å²	0	72 Å²	72	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-87.3	-13	-167.9	-63.3	176.5	0	0	0	114.1	F216 A220 V283 V286 A352 I353 R358 H359	F216-L356 HydrophobicContact CB-CD2 4.33Å; A220-L356 HydrophobicContact CB-CD2 3.79Å; V283-L356 HydrophobicContact CB-CD1 4.26Å; V283-L356 HydrophobicContact CG1-CD1 4Å; V283-L356 HydrophobicContact CG1-CD2 3.9Å; V283-L356 HydrophobicContact CG2-CD1 4.3Å; V286-L356 HydrophobicContact CB-CD1 3.83Å; V286-L356 HydrophobicContact CG1-CB 3.91Å; V286-L356 HydrophobicContact CG1-CD1 3.83Å; A352-L356 HydrophobicContact CB-CD1 4.28Å; A352-L356 WeakPolarHBondContact O-CB 3.38Å; A352-L356 WeakPolarHBondContact O-CG 3.47Å; A352-L356 PolarHBondContact O-N 3.39Å; I353-L356 PolarHBondContact O-N 3.26Å; L356-R358 PolarHBondContact O-N 3.47Å; L356-H359 WeakPolarHBondContact O-CA 3.43Å; L356-H359 WeakPolarHBondContact O-CB 3.42Å; L356-H359 PolarHBondContact O-N 3.2Å
357	R	94	Very high	92.9	Very high	129 Å²	129	72.4 Å²	72.4	49%	0.487	31%	0.314	S	S	.	.	G	3₁₀ helix	trans	-54.8	-38.8	178.5	-176.5	176.1	-67.8	174.2	-2.5	112.3	I353 H359 R360 L365	I353-R357 HydrophobicContact CD1-CB 4.15Å; I353-R357 WeakPolarHBondContact O-CB 3.18Å; I353-R357 PolarHBondContact O-N 3.11Å; R357-H359 PolarHBondContact O-N 2.76Å; R357-R360 WeakPolarHBondContact O-CB 3.39Å; R357-R360 PolarHBondContact O-N 3.34Å; R357-L365 HydrophobicContact CG-CD1 3.87Å; R357-L365 WeakPolarHBondContact O-CD1 3.34Å
358	R	94.1	Very high	92.6	Very high	142 Å²	142	78 Å²	78	54%	0.536	34%	0.339	S	S	.	.	G	3₁₀ helix	trans	-58.7	-19.8	176.2	79.8	-178.8	-159.5	164.9	7.5	113.4	N217 L356	N217-R358 VanDerWaalsContact CG-NH2 3.3Å; N217-R358 VanDerWaalsContact OD1-CZ 3.23Å; N217-R358 PolarHBondContact OD1-NE 3.26Å; N217-R358 PolarHBondContact OD1-NH2 3.03Å; N217-R358 VanDerWaalsContact OD1-NH2 3.07Å; L356-R358 PolarHBondContact O-N 3.47Å
359	H	93.2	Very high	92.1	Very high	2 Å²	2	80.8 Å²	80.8	1%	0.009	35%	0.353	C	S	.	.	G	3₁₀ helix	trans	-94.1	-11.1	-178.1	-66.5	-63.2	0	0	0	114.1	N217 A220 N221 R223 A287 R289 L356 R357	N217-H359 PolarHBondContact OD1-NE2 3.36Å; A220-H359 HydrophobicContact CB-CB 4.3Å; A220-H359 WeakPolarHBondContact CB-CD2 3.29Å; N221-H359 PolarHBondContact OD1-CE1 3.42Å; R223-H359 VanDerWaalsContact CZ-ND1 3.27Å; R223-H359 VanDerWaalsContact NH1-C 3.26Å; R223-H359 PolarHBondContact NH1-ND1 3.41Å; R223-H359 PolarHBondContact NH1-O 3.33Å; R223-H359 PolarHBondContact NH2-ND1 2.69Å; A287-H359 HydrophobicContact CB-CB 4.41Å; R289-H359 PolarHBondContact NE-O 3.37Å; R289-H359 PolarHBondContact NH2-O 2.82Å; L356-H359 WeakPolarHBondContact O-CA 3.43Å; L356-H359 WeakPolarHBondContact O-CB 3.42Å; L356-H359 PolarHBondContact O-N 3.2Å; R357-H359 PolarHBondContact O-N 2.76Å
360	R	93.6	Very high	91.4	Very high	14 Å²	14	83.7 Å²	83.7	5%	0.053	38%	0.382	C	S	.	.	S	Bend	trans	-69.4	152.8	178.8	-63.8	-173.1	170.9	-170.2	-13.4	111.5	V286 I353 R357 F364 L365 A367	V286-R360 VanDerWaalsContact O-CZ 3.3Å; V286-R360 PolarHBondContact O-NE 2.86Å; V286-R360 PolarHBondContact O-NH2 3.17Å; I353-R360 VanDerWaalsContact CD1-NH2 3.33Å; R357-R360 WeakPolarHBondContact O-CB 3.39Å; R357-R360 PolarHBondContact O-N 3.34Å; R360-F364 WeakPolarHBondContact CD-O 3.43Å; R360-F364 PolarHBondContact NH1-O 3.39Å; R360-L365 HydrophobicContact CB-CD1 4.41Å; R360-A367 PolarHBondContact NH1-O 3.02Å
361	R	91.9	Very high	90.8	Very high	153 Å²	153	83.4 Å²	83.4	58%	0.577	39%	0.385	S	S	*	.			trans	-74.6	157.7	165.6	-69.1	-171.9	174.4	-176.4	-2.4	108.8	R289 R363 F364 L365	R289-R361 VanDerWaalsContact NH2-CG 3.29Å; R361-R363 PolarHBondContact O-N 3.23Å; R361-R363 VanDerWaalsContact O-N 3.14Å; R361-F364 CarbonylContact O-C 3.57Å; R361-F364 PolarHBondContact O-N 3.11Å; R361-L365 PolarHBondContact O-N 3.25Å
362	F	94.6	Very high	90.4	Very high	191 Å²	191	81.2 Å²	81.2	84%	0.838	38%	0.376	S	S	*	.	H	α-helix	trans	-46	-46.3	177	-178.6	-105.4	0	0	0	112.9	F364 L365	F362-F364 PolarHBondContact O-N 3.42Å; F362-L365 WeakPolarHBondContact O-CB 3.28Å; F362-L365 PolarHBondContact O-N 3.46Å; F362-L365 VanDerWaalsContact O-N 3.13Å
363	R	93.3	Very high	90.2	Very high	214 Å²	214	90 Å²	90	81%	0.808	41%	0.414	S	S	*	.	H	α-helix	trans	-52.9	-31.4	177.6	-178.9	170.1	-177.6	147	1.6	115.1	R361	R361-R363 PolarHBondContact O-N 3.23Å; R361-R363 VanDerWaalsContact O-N 3.14Å
364	F	91.4	Very high	90.1	Very high	72 Å²	72	93.7 Å²	93.7	32%	0.316	44%	0.44	S	S	.	.	H	α-helix	trans	-113.8	2.7	-175.7	-59.6	-73.5	0	0	0	112.6	H288 R360 R361 F362 E366 A367	H288-F364 HydrophobicContact CB-CB 3.8Å; H288-F364 HydrophobicContact CB-CD1 4.13Å; H288-F364 HydrophobicContact CB-CD2 3.68Å; H288-F364 HydrophobicContact CB-CE2 4.27Å; H288-F364 HydrophobicContact CB-CG 3.6Å; H288-F364 AromaticContact CG-CD1 3.85Å; H288-F364 AromaticContact CG-CG 3.71Å; H288-F364 AromaticContact ND1-CD1 3.89Å; R360-F364 WeakPolarHBondContact CD-O 3.43Å; R360-F364 PolarHBondContact NH1-O 3.39Å; R361-F364 CarbonylContact O-C 3.57Å; R361-F364 PolarHBondContact O-N 3.11Å; F362-F364 PolarHBondContact O-N 3.42Å; F364-E366 PolarHBondContact O-N 3.18Å; F364-A367 HydrophobicContact CB-CB 4.43Å; F364-A367 VanDerWaalsContact O-CB 3.31Å; F364-A367 WeakPolarHBondContact O-CB 3.39Å; F364-A367 PolarHBondContact O-N 3.36Å; F364-A367 VanDerWaalsContact O-N 3.1Å
365	L	91.9	Very high	90	Very high	65 Å²	65	90.7 Å²	90.7	34%	0.34	43%	0.428	S	S	.	.	H	α-helix	trans	-58.9	-40.1	-173	-173.1	70.3	0	0	0	111.6	R357 R360 R361 F362	R357-L365 HydrophobicContact CG-CD1 3.87Å; R357-L365 WeakPolarHBondContact O-CD1 3.34Å; R360-L365 HydrophobicContact CB-CD1 4.41Å; R361-L365 PolarHBondContact O-N 3.25Å; F362-L365 WeakPolarHBondContact O-CB 3.28Å; F362-L365 PolarHBondContact O-N 3.46Å; F362-L365 VanDerWaalsContact O-N 3.13Å
366	E	91.4	Very high	89.9	Confident	181 Å²	181	97.8 Å²	97.8	85%	0.846	46%	0.459	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.8	1.9	-179.6	-61.6	-175.5	165.2	0	0	113.7	F364	F364-E366 PolarHBondContact O-N 3.18Å
367	A	89.8	Confident	89.8	Confident	24 Å²	24	101.3 Å²	101.3	20%	0.198	48%	0.48	C	S	.	.			trans	-61	141.6	178.8	0	0	0	0	0	111.3	R360 F364	R360-A367 PolarHBondContact NH1-O 3.02Å; F364-A367 HydrophobicContact CB-CB 4.43Å; F364-A367 VanDerWaalsContact O-CB 3.31Å; F364-A367 WeakPolarHBondContact O-CB 3.39Å; F364-A367 PolarHBondContact O-N 3.36Å; F364-A367 VanDerWaalsContact O-N 3.1Å
368	E	87.4	Confident	89.7	Confident	136 Å²	136	96.1 Å²	96.1	64%	0.636	46%	0.462	S	S	*	.			trans	-69.8	159.1	-179.5	-63.5	-170.2	174.3	0	0	111.6
369	L	81.5	Confident	89.3	Confident	60 Å²	60	96.2 Å²	96.2	31%	0.314	47%	0.474	S	S	.	.	S	Bend	trans	-73.1	-32.2	175.6	-175	89.6	0	0	0	111.1	E349 I353 D371 T372	E349-L369 WeakPolarHBondContact O-CD2 3.27Å; I353-L369 HydrophobicContact CB-CD1 3.66Å; I353-L369 HydrophobicContact CG2-CD1 3.94Å; L369-D371 PolarHBondContact O-N 2.93Å; L369-D371 VanDerWaalsContact O-N 3.08Å; L369-T372 PolarHBondContact O-N 3.24Å; L369-T372 PolarHBondContact O-OG1 3.4Å
370	A	79	Confident	88.6	Confident	89 Å²	89	104.2 Å²	104.2	74%	0.736	51%	0.505	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.8	-25.7	-174.1	0	0	0	0	0	113.4	T372	A370-T372 PolarHBondContact O-N 3.16Å
371	D	78.4	Confident	88.4	Confident	119 Å²	119	108.8 Å²	108.8	64%	0.636	53%	0.528	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.2	-19.6	178.2	-60.7	-25.4	0	0	0	113.1	L369	L369-D371 PolarHBondContact O-N 2.93Å; L369-D371 VanDerWaalsContact O-N 3.08Å
372	T	84.8	Confident	88.2	Confident	16 Å²	16	106.4 Å²	106.4	10%	0.098	53%	0.525	C	S	.	.	S	Bend	trans	-92.1	122	-177.7	59.6	0	0	0	0	110.9	L369 A370	L369-T372 PolarHBondContact O-N 3.24Å; L369-T372 PolarHBondContact O-OG1 3.4Å; A370-T372 PolarHBondContact O-N 3.16Å
373	K	88.6	Confident	87.8	Confident	183 Å²	183	101.7 Å²	101.7	80%	0.796	51%	0.508	S	S	*	.	P	Polyproline II helix	trans	-64.8	134.7	177.4	-65.7	-179.1	-178.4	178.3	0	109.9	Y282	Y282-K373 WeakPolarHBondContact CD2-O 3.46Å; Y282-K373 WeakPolarHBondContact CE2-O 3.48Å
374	P	91.3	Very high	87.5	Confident	95 Å²	95	95.1 Å²	95.1	62%	0.617	49%	0.49	S	S	*	.	P	Polyproline II helix	trans	-64.5	151.8	177.4	27.9	-34.7	0	0	0	111	E349	E349-P374 HydrophobicContact CG-CB 4Å
375	A	90.2	Very high	87.3	Confident	14 Å²	14	96.6 Å²	96.6	12%	0.116	50%	0.501	C	S	.	.	P	Polyproline II helix	trans	-65	149.3	175.5	0	0	0	0	0	110.9	Y274 Y282 T377	Y274-A375 HydrophobicContact CD1-CB 3.59Å; Y274-A375 HydrophobicContact CE1-CB 3.68Å; Y282-A375 HydrophobicContact CD2-CB 4.11Å; Y282-A375 HydrophobicContact CG-CB 3.86Å; A375-T377 PolarHBondContact O-N 3.34Å
376	K	91.9	Very high	87	Confident	155 Å²	155	98.7 Å²	98.7	67%	0.674	51%	0.512	S	S	*	.	P	Polyproline II helix	trans	-71.5	129.2	173.7	-66.5	175.6	-176.3	169.9	0	109.8
377	T	93.3	Very high	86.7	Confident	74 Å²	74	92.8 Å²	92.8	45%	0.454	49%	0.488	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	153.1	178.4	55.8	0	0	0	0	111.4	N272 R273 Y274 A375	N272-T377 HydrophobicContact CB-CG2 3.92Å; R273-T377 CarbonylContact O-C 3.57Å; R273-T377 VanDerWaalsContact O-CA 3.3Å; R273-T377 WeakPolarHBondContact O-CA 3.48Å; Y274-T377 HydrophobicContact CD1-CG2 4.13Å; Y274-T377 HydrophobicContact CE1-CG2 3.65Å; A375-T377 PolarHBondContact O-N 3.34Å
378	V	91.8	Very high	86.4	Confident	19 Å²	19	98.1 Å²	98.1	12%	0.115	51%	0.51	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	144.6	-179.6	172.9	0	0	0	0	109.7	R273 L275 Y380	R273-V378 WeakPolarHBondContact CB-O 3.45Å; R273-V378 PolarHBondContact O-N 3.06Å; L275-V378 HydrophobicContact CD1-CG2 4.03Å; L275-V378 HydrophobicContact CG-CG2 3.84Å; V378-Y380 HydrophobicContact CB-CE1 4.41Å; V378-Y380 HydrophobicContact CG1-CD1 3.19Å; V378-Y380 HydrophobicContact CG1-CD2 3.9Å; V378-Y380 HydrophobicContact CG1-CE1 3.08Å; V378-Y380 HydrophobicContact CG1-CE2 3.81Å; V378-Y380 HydrophobicContact CG1-CG 3.61Å; V378-Y380 VanDerWaalsContact CG1-CZ 3.4Å
379	N	86.3	Confident	86.3	Confident	144 Å²	144	94.9 Å²	94.9	77%	0.77	50%	0.5	S	S	*	.			trans	-102.8	-10.3	-175.5	-68	-15.1	0	0	0	114.5
380	Y	78.9	Confident	86.8	Confident	171 Å²	171	98.1 Å²	98.1	67%	0.671	52%	0.517	S	S	*	.			trans	-88.9	0	-177.7	60.3	-104.3	0	0	0	113.6	V239 R273 V378	V239-Y380 HydrophobicContact CG2-CD2 4.04Å; V239-Y380 HydrophobicContact CG2-CE2 3.45Å; V239-Y380 VanDerWaalsContact CG2-CE2 3.45Å; R273-Y380 PolarHBondContact NH1-O 2.97Å; R273-Y380 PolarHBondContact NH1-OXT 3.13Å; R273-Y380 PolarHBondContact NH2-O 3.36Å; V378-Y380 HydrophobicContact CB-CE1 4.41Å; V378-Y380 HydrophobicContact CG1-CD1 3.19Å; V378-Y380 HydrophobicContact CG1-CD2 3.9Å; V378-Y380 HydrophobicContact CG1-CE1 3.08Å; V378-Y380 HydrophobicContact CG1-CE2 3.81Å; V378-Y380 HydrophobicContact CG1-CG 3.61Å; V378-Y380 VanDerWaalsContact CG1-CZ 3.4Å

Retrieved 380 of 380 residues in 2662.1 ms (Link to these results)

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