X2JKP3_DROME Loading...

Cell division cycle 50, isoform B

AlphaFold DB , UniProt , Accession X2JKP3, Species DROME (Drosophila melanogaster, Fruit fly), Gene Cdc50, Length 347 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	33.1	Very low	39	Very low	242 Å²	242	160.4 Å²	160.4	100%	1.192	86%	0.862	S	S	*	*				0	117.1	0	-164.3	172.9	178.3	0	0	107.2
2	S	38.3	Very low	40.1	Very low	107 Å²	107	155.1 Å²	155.1	75%	0.748	86%	0.857	S	S	*	*			trans	61.7	93.2	161.9	-155.1	0	0	0	0	119
3	T	29.7	Very low	41.7	Very low	138 Å²	138	149.7 Å²	149.7	85%	0.847	85%	0.845	S	S	*	*			trans	-128.9	106.7	148.1	2.5	0	0	0	0	107.2	Q5	T3-Q5 PolarHBondContact O-N 3.26Å
4	Q	41.8	Very low	43	Very low	188 Å²	188	145.7 Å²	145.7	88%	0.879	84%	0.84	S	S	*	*			trans	-73.5	110.8	169	-76.2	177	-14.8	0	0	108.2
5	Q	31.7	Very low	44.4	Very low	165 Å²	165	150.1 Å²	150.1	77%	0.771	85%	0.846	S	S	*	*			trans	-118.9	102.1	156.7	-90.8	175.1	-48.5	0	0	106.5	T3 E7	T3-Q5 PolarHBondContact O-N 3.26Å; Q5-E7 VanDerWaalsContact C-N 3.26Å; Q5-E7 PolarHBondContact O-N 3.13Å; Q5-E7 VanDerWaalsContact O-N 3.11Å
6	A	38.2	Very low	46.2	Very low	108 Å²	108	146.4 Å²	146.4	89%	0.893	83%	0.833	S	S	*	*			trans	-74.4	89.2	162.5	0	0	0	0	0	106.9	N8	A6-N8 PolarHBondContact O-N 3.24Å
7	E	43.4	Very low	48.3	Very low	168 Å²	168	150.4 Å²	150.4	79%	0.785	84%	0.838	S	S	*	*			trans	-75.8	109.6	160.4	-76	179.9	154	0	0	107.3	Q5	Q5-E7 VanDerWaalsContact C-N 3.26Å; Q5-E7 PolarHBondContact O-N 3.13Å; Q5-E7 VanDerWaalsContact O-N 3.11Å
8	N	38.2	Very low	50	Low	162 Å²	162	152.9 Å²	152.9	87%	0.866	83%	0.833	S	S	*	*			trans	-120.3	110.6	154.9	-110.6	-7.1	0	0	0	105.8	A6 E10	A6-N8 PolarHBondContact O-N 3.24Å; N8-E10 PolarHBondContact O-N 3.18Å; N8-E10 VanDerWaalsContact O-N 3.09Å
9	E	40.8	Very low	51.7	Low	194 Å²	194	149.7 Å²	149.7	91%	0.907	82%	0.821	S	S	*	*			trans	-45.3	112.7	179.1	-73.5	172.8	126.9	0	0	111	S11	E9-S11 PolarHBondContact O-N 2.99Å
10	E	47.1	Very low	53.3	Low	191 Å²	191	144.7 Å²	144.7	89%	0.893	80%	0.797	S	S	*	*			trans	-70.5	95.9	172.1	-161.1	173.2	-160.5	0	0	107.3	N8 A12	N8-E10 PolarHBondContact O-N 3.18Å; N8-E10 VanDerWaalsContact O-N 3.09Å; E10-A12 PolarHBondContact O-N 3.37Å
11	S	46.5	Very low	54.9	Low	101 Å²	101	143.3 Å²	143.3	71%	0.706	79%	0.788	S	S	*	*			trans	-54.4	120.3	172.2	78.2	0	0	0	0	107.6	E9 A13	E9-S11 PolarHBondContact O-N 2.99Å; S11-A13 VanDerWaalsContact C-N 3.28Å; S11-A13 PolarHBondContact O-N 3.44Å
12	A	52.7	Low	57.6	Low	97 Å²	97	134 Å²	134	80%	0.802	75%	0.748	S	S	*	*			trans	-58.9	94.8	174.7	0	0	0	0	0	108.6	E10 A14	E10-A12 PolarHBondContact O-N 3.37Å; A12-A14 PolarHBondContact O-N 2.82Å
13	A	59.9	Low	60	Low	85 Å²	85	131.4 Å²	131.4	70%	0.702	73%	0.732	S	S	*	*			trans	-55.4	119.1	179.7	0	0	0	0	0	107.7	S11 K15	S11-A13 VanDerWaalsContact C-N 3.28Å; S11-A13 PolarHBondContact O-N 3.44Å; A13-K15 PolarHBondContact O-N 2.87Å
14	A	60.8	Low	62.9	Low	94 Å²	94	132.2 Å²	132.2	78%	0.777	72%	0.724	S	S	*	*			trans	-47.5	119.7	-179.7	0	0	0	0	0	108.9	A12 S16	A12-A14 PolarHBondContact O-N 2.82Å; A14-S16 PolarHBondContact O-N 2.93Å
15	K	63.9	Low	65.1	Low	211 Å²	211	129.8 Å²	129.8	92%	0.917	71%	0.711	S	S	*	*			trans	-61.5	89.5	178.3	-79.3	-178	179.9	175.6	0	108.8	A13 K17	A13-K15 PolarHBondContact O-N 2.87Å; K15-K17 PolarHBondContact O-N 3.44Å
16	S	73.1	Confident	68	Low	92 Å²	92	124.7 Å²	124.7	64%	0.643	69%	0.687	S	S	*	*			trans	-66.6	125.2	177.7	-178.3	0	0	0	0	108.3	A14 R18	A14-S16 PolarHBondContact O-N 2.93Å; S16-R18 PolarHBondContact O-N 3.28Å; S16-R18 VanDerWaalsContact O-N 3.17Å; S16-R18 VanDerWaalsContact OG-CB 3.23Å; S16-R18 WeakPolarHBondContact OG-CB 3.41Å; S16-R18 PolarHBondContact OG-N 3.33Å
17	K	81.3	Confident	70.4	Confident	213 Å²	213	128.3 Å²	128.3	93%	0.926	69%	0.685	S	S	*	*			trans	-72.6	5	170.8	-65.5	-176.9	-179.9	179.4	0	112.1	K15 P19	K15-K17 PolarHBondContact O-N 3.44Å; K17-P19 WeakPolarHBondContact O-CD 3.31Å
18	R	80.1	Confident	72.7	Confident	196 Å²	196	128.9 Å²	128.9	74%	0.74	68%	0.68	S	S	*	*	P	Polyproline II helix	trans	-71.2	122	179.1	-169.1	172.8	-179.8	172.2	-1.9	109.1	S16	S16-R18 PolarHBondContact O-N 3.28Å; S16-R18 VanDerWaalsContact O-N 3.17Å; S16-R18 VanDerWaalsContact OG-CB 3.23Å; S16-R18 WeakPolarHBondContact OG-CB 3.41Å; S16-R18 PolarHBondContact OG-N 3.33Å
19	P	80.9	Confident	75.4	Confident	93 Å²	93	125.9 Å²	125.9	60%	0.604	66%	0.664	S	S	*	*	P	Polyproline II helix	trans	-62.3	147.4	176	24.3	-31.1	0	0	0	110.3	K17 D21	K17-P19 WeakPolarHBondContact O-CD 3.31Å; P19-D21 PolarHBondContact O-N 2.94Å
20	S	84.9	Confident	77.8	Confident	49 Å²	49	122.8 Å²	122.8	34%	0.343	66%	0.66	S	S	.	*	P	Polyproline II helix	trans	-63.6	136	-177.8	61.2	0	0	0	0	111.6	S22 K25 Q26	S20-S22 VanDerWaalsContact C-N 3.25Å; S20-S22 PolarHBondContact O-N 3.33Å; S20-S22 VanDerWaalsContact O-N 3.07Å; S20-K25 WeakPolarHBondContact OG-CD 3.45Å; S20-K25 WeakPolarHBondContact OG-CE 3.44Å; S20-K25 PolarHBondContact OG-NZ 3.48Å; S20-Q26 PolarHBondContact O-NE2 2.82Å
21	D	87.3	Confident	80	Confident	115 Å²	115	117.2 Å²	117.2	62%	0.615	65%	0.647	S	S	*	*			trans	-87.6	47	-173.1	-161.7	16.5	0	0	0	113	P19	P19-D21 PolarHBondContact O-N 2.94Å
22	S	89.4	Confident	82.2	Confident	48 Å²	48	123 Å²	123	34%	0.336	65%	0.654	S	S	.	*			trans	-92.5	144.9	173.5	72.4	0	0	0	0	110.7	S20 F24 K25 Q26	S20-S22 VanDerWaalsContact C-N 3.25Å; S20-S22 PolarHBondContact O-N 3.33Å; S20-S22 VanDerWaalsContact O-N 3.07Å; S22-F24 PolarHBondContact O-N 2.91Å; S22-F24 VanDerWaalsContact O-N 3.08Å; S22-K25 PolarHBondContact O-N 3.32Å; S22-K25 WeakPolarHBondContact OG-CG 3.39Å; S22-K25 PolarHBondContact OG-N 2.87Å; S22-Q26 WeakPolarHBondContact O-CB 3.31Å; S22-Q26 WeakPolarHBondContact O-CG 3.34Å; S22-Q26 PolarHBondContact O-N 3.17Å
23	A	87.4	Confident	83.9	Confident	51 Å²	51	126.1 Å²	126.1	42%	0.421	65%	0.652	S	S	.	*	T	Hydrogen-bonded Turn	trans	-54.2	-32.8	-179.5	0	0	0	0	0	113.1	Q27 R28 L29	A23-Q27 PolarHBondContact O-N 3.5Å; A23-R28 PolarHBondContact O-N 2.92Å; A23-L29 HydrophobicContact CB-CD2 4.29Å; A23-L29 PolarHBondContact O-N 2.87Å
24	F	90.5	Very high	85.2	Confident	156 Å²	156	125.2 Å²	125.2	68%	0.684	64%	0.638	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.6	-51	173.1	-178.7	-104.4	0	0	0	112.4	S22 Q26 Q27 L29	S22-F24 PolarHBondContact O-N 2.91Å; S22-F24 VanDerWaalsContact O-N 3.08Å; F24-Q26 VanDerWaalsContact C-N 3.3Å; F24-Q26 PolarHBondContact O-N 2.95Å; F24-Q27 PolarHBondContact O-N 3.32Å; F24-L29 HydrophobicContact CD2-CD1 3.93Å
25	K	88.3	Confident	86.6	Confident	137 Å²	137	126.1 Å²	126.1	60%	0.596	63%	0.634	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.8	-20.9	-177	-63.6	-154	-138.9	161.5	0	113.4	S20 S22	S20-K25 WeakPolarHBondContact OG-CD 3.45Å; S20-K25 WeakPolarHBondContact OG-CE 3.44Å; S20-K25 PolarHBondContact OG-NZ 3.48Å; S22-K25 PolarHBondContact O-N 3.32Å; S22-K25 WeakPolarHBondContact OG-CG 3.39Å; S22-K25 PolarHBondContact OG-N 2.87Å
26	Q	92.2	Very high	87.7	Confident	57 Å²	57	122.7 Å²	122.7	27%	0.266	63%	0.625	S	S	.	*	T	Hydrogen-bonded Turn	trans	-93.8	2.5	175.4	-59.1	-60.1	-32.6	0	0	113.3	S20 S22 F24 R28	S20-Q26 PolarHBondContact O-NE2 2.82Å; S22-Q26 WeakPolarHBondContact O-CB 3.31Å; S22-Q26 WeakPolarHBondContact O-CG 3.34Å; S22-Q26 PolarHBondContact O-N 3.17Å; F24-Q26 VanDerWaalsContact C-N 3.3Å; F24-Q26 PolarHBondContact O-N 2.95Å; Q26-R28 VanDerWaalsContact C-N 3.27Å; Q26-R28 HydrophobicContact CB-CG 4.24Å; Q26-R28 WeakPolarHBondContact O-CG 3.34Å; Q26-R28 PolarHBondContact O-N 3.43Å
27	Q	89.4	Confident	88.3	Confident	185 Å²	185	121.4 Å²	121.4	86%	0.864	61%	0.613	S	S	*	*	T	Hydrogen-bonded Turn	trans	56.6	36.1	-178.4	-56	-180	-2.1	0	0	113.9	A23 F24	A23-Q27 PolarHBondContact O-N 3.5Å; F24-Q27 PolarHBondContact O-N 3.32Å
28	R	92.4	Very high	88.4	Confident	180 Å²	180	113.4 Å²	113.4	68%	0.679	59%	0.587	S	S	*	*			trans	-112.6	27.3	179.3	-60.1	177.9	-171.4	172.2	1.2	112.3	A23 Q26	A23-R28 PolarHBondContact O-N 2.92Å; Q26-R28 VanDerWaalsContact C-N 3.27Å; Q26-R28 HydrophobicContact CB-CG 4.24Å; Q26-R28 WeakPolarHBondContact O-CG 3.34Å; Q26-R28 PolarHBondContact O-N 3.43Å
29	L	93.9	Very high	88.6	Confident	98 Å²	98	113.7 Å²	113.7	51%	0.513	59%	0.588	S	S	.	*			trans	-62.4	143.1	172.8	-76.4	178.5	0	0	0	109.9	A23 F24 A31	A23-L29 HydrophobicContact CB-CD2 4.29Å; A23-L29 PolarHBondContact O-N 2.87Å; F24-L29 HydrophobicContact CD2-CD1 3.93Å; L29-A31 PolarHBondContact O-N 3.46Å; L29-A31 VanDerWaalsContact O-N 3.11Å
30	P	92.1	Very high	88.9	Confident	129 Å²	129	112.9 Å²	112.9	84%	0.838	58%	0.581	S	S	*	*			trans	-59.5	120.2	171.7	26.4	-33	0	0	0	108.4
31	A	92.6	Very high	89.1	Confident	74 Å²	74	112.3 Å²	112.3	61%	0.612	58%	0.575	S	S	*	*			trans	-125	137.8	-179.4	0	0	0	0	0	109.4	L29	L29-A31 PolarHBondContact O-N 3.46Å; L29-A31 VanDerWaalsContact O-N 3.11Å
32	W	92	Very high	89.3	Confident	224 Å²	224	108.1 Å²	108.1	85%	0.848	55%	0.553	S	S	*	*			trans	-82.3	122.2	167.1	178.6	58	0	0	0	108.9	P34	W32-P34 HydrophobicContact CD2-CB 4.41Å; W32-P34 HydrophobicContact CD2-CG 4.25Å; W32-P34 HydrophobicContact CE3-CG 4.02Å; W32-P34 HydrophobicContact CH2-CB 3.8Å; W32-P34 HydrophobicContact CH2-CG 3.94Å; W32-P34 HydrophobicContact CZ2-CB 3.65Å; W32-P34 HydrophobicContact CZ2-CG 4.16Å; W32-P34 HydrophobicContact CZ3-CB 4.24Å; W32-P34 HydrophobicContact CZ3-CG 3.86Å; W32-P34 VanDerWaalsContact O-CD 3.29Å; W32-P34 WeakPolarHBondContact O-CD 2.87Å
33	Q	89.4	Confident	89.6	Confident	162 Å²	162	109.1 Å²	109.1	76%	0.757	56%	0.558	S	S	*	*			trans	-115.6	83.8	-177.9	-66.8	-179.1	-31	0	0	109.6	V35	Q33-V35 PolarHBondContact O-N 2.88Å; Q33-V35 VanDerWaalsContact O-N 3.14Å
34	P	88	Confident	89.9	Confident	66 Å²	66	110 Å²	110	43%	0.429	56%	0.559	S	S	.	*			trans	-68.2	113.4	-179.6	25.7	-31.8	0	0	0	110.7	W32 L36	W32-P34 HydrophobicContact CD2-CB 4.41Å; W32-P34 HydrophobicContact CD2-CG 4.25Å; W32-P34 HydrophobicContact CE3-CG 4.02Å; W32-P34 HydrophobicContact CH2-CB 3.8Å; W32-P34 HydrophobicContact CH2-CG 3.94Å; W32-P34 HydrophobicContact CZ2-CB 3.65Å; W32-P34 HydrophobicContact CZ2-CG 4.16Å; W32-P34 HydrophobicContact CZ3-CB 4.24Å; W32-P34 HydrophobicContact CZ3-CG 3.86Å; W32-P34 VanDerWaalsContact O-CD 3.29Å; W32-P34 WeakPolarHBondContact O-CD 2.87Å; P34-L36 PolarHBondContact O-N 3.22Å
35	V	88.4	Confident	90.1	Very high	112 Å²	112	105 Å²	105	68%	0.679	54%	0.536	S	S	*	.			trans	-84.1	107.2	169.7	-172.9	0	0	0	0	108.1	Q33 T37	Q33-V35 PolarHBondContact O-N 2.88Å; Q33-V35 VanDerWaalsContact O-N 3.14Å; V35-T37 HydrophobicContact CG1-CG2 3.92Å; V35-T37 PolarHBondContact O-N 2.92Å
36	L	88	Confident	90.5	Very high	140 Å²	140	101 Å²	101	73%	0.733	52%	0.519	S	S	*	.			trans	-74.9	91.4	179	-63.3	178.1	0	0	0	109.7	P34 V41	P34-L36 PolarHBondContact O-N 3.22Å; L36-V41 HydrophobicContact CB-CG2 3.87Å; L36-V41 HydrophobicContact CD2-CG2 4.03Å; L36-V41 HydrophobicContact CG-CG2 4.48Å
37	T	86.3	Confident	90.7	Very high	65 Å²	65	102.3 Å²	102.3	40%	0.399	53%	0.531	S	S	.	.			trans	-97.3	161	175.2	65.3	0	0	0	0	110.5	V35 R39 T40 V41	V35-T37 HydrophobicContact CG1-CG2 3.92Å; V35-T37 PolarHBondContact O-N 2.92Å; T37-R39 PolarHBondContact O-N 2.89Å; T37-R39 VanDerWaalsContact O-N 3.16Å; T37-T40 PolarHBondContact N-OG1 3.33Å; T37-T40 VanDerWaalsContact N-OG1 3.1Å; T37-T40 PolarHBondContact O-N 3.44Å; T37-T40 PolarHBondContact O-OG1 2.94Å; T37-T40 PolarHBondContact OG1-OG1 3.4Å; T37-V41 WeakPolarHBondContact O-CG2 3.4Å; T37-V41 PolarHBondContact O-N 3.26Å
38	A	83.6	Confident	91.1	Very high	44 Å²	44	96.5 Å²	96.5	36%	0.364	51%	0.505	S	S	.	.	H	α-helix	trans	-54.3	-36.4	175.7	0	0	0	0	0	112.2	T40 L42	A38-T40 VanDerWaalsContact C-N 3.31Å; A38-T40 PolarHBondContact O-N 3.32Å; A38-L42 WeakPolarHBondContact O-CB 3.3Å; A38-L42 PolarHBondContact O-N 3.36Å
39	R	83.5	Confident	91.3	Very high	203 Å²	203	88 Å²	88	77%	0.766	47%	0.473	S	S	*	.	H	α-helix	trans	-65.8	-30.6	178.1	-69	-176.5	-176.9	168.5	1.3	113.5	T37 P43	T37-R39 PolarHBondContact O-N 2.89Å; T37-R39 VanDerWaalsContact O-N 3.16Å; R39-P43 VanDerWaalsContact O-CD 3.26Å; R39-P43 WeakPolarHBondContact O-CD 3.34Å; R39-P43 WeakPolarHBondContact O-CG 3.46Å
40	T	86.3	Confident	91.4	Very high	75 Å²	75	87.9 Å²	87.9	46%	0.46	48%	0.476	S	S	.	.	H	α-helix	trans	-89.8	-34.3	-179.5	56.8	0	0	0	0	112.5	T37 A38	T37-T40 PolarHBondContact N-OG1 3.33Å; T37-T40 VanDerWaalsContact N-OG1 3.1Å; T37-T40 PolarHBondContact O-N 3.44Å; T37-T40 PolarHBondContact O-OG1 2.94Å; T37-T40 PolarHBondContact OG1-OG1 3.4Å; A38-T40 VanDerWaalsContact C-N 3.31Å; A38-T40 PolarHBondContact O-N 3.32Å
41	V	90.3	Very high	91.7	Very high	37 Å²	37	86.3 Å²	86.3	22%	0.224	46%	0.461	C	S	.	.	H	α-helix	trans	-85.8	-32.8	-176.3	178	0	0	0	0	112.7	L36 T37 T44 F45	L36-V41 HydrophobicContact CB-CG2 3.87Å; L36-V41 HydrophobicContact CD2-CG2 4.03Å; L36-V41 HydrophobicContact CG-CG2 4.48Å; T37-V41 WeakPolarHBondContact O-CG2 3.4Å; T37-V41 PolarHBondContact O-N 3.26Å; V41-T44 PolarHBondContact O-N 3.22Å; V41-T44 PolarHBondContact O-OG1 2.89Å; V41-F45 HydrophobicContact CG1-CD2 3.78Å; V41-F45 HydrophobicContact CG1-CE2 3.45Å; V41-F45 VanDerWaalsContact CG1-CE2 3.45Å; V41-F45 WeakPolarHBondContact O-CD2 3.24Å; V41-F45 PolarHBondContact O-N 3.48Å
42	L	92	Very high	91.9	Very high	28 Å²	28	85.9 Å²	85.9	15%	0.147	45%	0.445	C	S	.	.	H	α-helix	trans	-64.7	-42.6	-174.3	-161.1	120.5	0	0	0	113.6	A38 T44 F45 F46 L333 L334	A38-L42 WeakPolarHBondContact O-CB 3.3Å; A38-L42 PolarHBondContact O-N 3.36Å; L42-T44 VanDerWaalsContact C-N 3.28Å; L42-T44 PolarHBondContact O-N 2.87Å; L42-F45 PolarHBondContact O-N 3.06Å; L42-F46 HydrophobicContact CD2-CD2 4.28Å; L42-F46 HydrophobicContact CD2-CE2 3.7Å; L42-F46 HydrophobicContact CG-CE2 4.02Å; L42-F46 VanDerWaalsContact O-CD2 3.23Å; L42-F46 WeakPolarHBondContact O-CD2 3.25Å; L42-L333 HydrophobicContact CD1-CB 3.85Å; L42-L334 HydrophobicContact CD1-CB 3.89Å; L42-L334 HydrophobicContact CD2-CB 4.15Å; L42-L334 HydrophobicContact CD2-CD1 3.82Å; L42-L334 HydrophobicContact CD2-CG 4.42Å
43	P	94	Very high	92.2	Very high	68 Å²	68	77.8 Å²	77.8	44%	0.442	42%	0.418	S	S	.	.	H	α-helix	trans	-61.6	-34.8	174.7	-23.3	35.1	0	0	0	113.1	R39 F45 F46 V47	R39-P43 VanDerWaalsContact O-CD 3.26Å; R39-P43 WeakPolarHBondContact O-CD 3.34Å; R39-P43 WeakPolarHBondContact O-CG 3.46Å; P43-F45 VanDerWaalsContact C-N 3.35Å; P43-F45 PolarHBondContact O-N 3.21Å; P43-F46 PolarHBondContact O-N 2.89Å; P43-V47 VanDerWaalsContact O-CG2 3.31Å; P43-V47 WeakPolarHBondContact O-CG2 3.37Å; P43-V47 PolarHBondContact O-N 3.08Å
44	T	94.1	Very high	92.6	Very high	70 Å²	70	73.4 Å²	73.4	43%	0.429	40%	0.403	S	S	.	.	H	α-helix	trans	-66.9	-37.4	-177.3	65.8	0	0	0	0	111.7	V41 L42 F46 V47 I48	V41-T44 PolarHBondContact O-N 3.22Å; V41-T44 PolarHBondContact O-OG1 2.89Å; L42-T44 VanDerWaalsContact C-N 3.28Å; L42-T44 PolarHBondContact O-N 2.87Å; T44-F46 PolarHBondContact O-N 2.98Å; T44-V47 PolarHBondContact O-N 2.78Å; T44-I48 WeakPolarHBondContact O-CB 3.48Å; T44-I48 VanDerWaalsContact O-CG1 3.26Å; T44-I48 WeakPolarHBondContact O-CG1 3.41Å; T44-I48 PolarHBondContact O-N 2.85Å
45	F	95.4	Very high	93.1	Very high	50 Å²	50	73.9 Å²	73.9	22%	0.219	40%	0.402	C	S	.	.	H	α-helix	trans	-58.7	-45.3	173.3	-84.5	-72.3	0	0	0	112.6	V41 L42 P43 G49 C326 L329 L333	V41-F45 HydrophobicContact CG1-CD2 3.78Å; V41-F45 HydrophobicContact CG1-CE2 3.45Å; V41-F45 VanDerWaalsContact CG1-CE2 3.45Å; V41-F45 WeakPolarHBondContact O-CD2 3.24Å; V41-F45 PolarHBondContact O-N 3.48Å; L42-F45 PolarHBondContact O-N 3.06Å; P43-F45 VanDerWaalsContact C-N 3.35Å; P43-F45 PolarHBondContact O-N 3.21Å; F45-G49 PolarHBondContact O-N 3.37Å; F45-C326 HydrophobicContact CD1-CB 4.06Å; F45-L329 HydrophobicContact CE1-CB 4.36Å; F45-L329 HydrophobicContact CE1-CD1 4.34Å; F45-L333 HydrophobicContact CD2-CD1 4.29Å; F45-L333 HydrophobicContact CE2-CD1 3.93Å
46	F	96.5	Very high	93.5	Very high	54 Å²	54	68.6 Å²	68.6	24%	0.237	37%	0.369	C	S	.	.	H	α-helix	trans	-69.1	-41.4	178.2	-71	-70.8	0	0	0	112.2	L42 P43 T44 G49 V50 L331	L42-F46 HydrophobicContact CD2-CD2 4.28Å; L42-F46 HydrophobicContact CD2-CE2 3.7Å; L42-F46 HydrophobicContact CG-CE2 4.02Å; L42-F46 VanDerWaalsContact O-CD2 3.23Å; L42-F46 WeakPolarHBondContact O-CD2 3.25Å; P43-F46 PolarHBondContact O-N 2.89Å; T44-F46 PolarHBondContact O-N 2.98Å; F46-G49 PolarHBondContact O-N 3.46Å; F46-V50 WeakPolarHBondContact O-CB 3.45Å; F46-V50 VanDerWaalsContact O-CG2 3.27Å; F46-V50 WeakPolarHBondContact O-CG2 3.28Å; F46-V50 PolarHBondContact O-N 3.48Å; F46-L331 HydrophobicContact CE1-CD2 4.04Å; F46-L331 HydrophobicContact CE1-CG 4.14Å; F46-L331 HydrophobicContact CZ-CD2 4.05Å; F46-L331 HydrophobicContact CZ-CG 4.29Å
47	V	96.8	Very high	93.9	Very high	84 Å²	84	65.7 Å²	65.7	51%	0.509	36%	0.357	S	S	.	.	H	α-helix	trans	-60.6	-48.7	177	170.4	0	0	0	0	110.8	P43 T44 G49 V50 L51	P43-V47 VanDerWaalsContact O-CG2 3.31Å; P43-V47 WeakPolarHBondContact O-CG2 3.37Å; P43-V47 PolarHBondContact O-N 3.08Å; T44-V47 PolarHBondContact O-N 2.78Å; V47-G49 VanDerWaalsContact C-N 3.35Å; V47-G49 PolarHBondContact O-N 3.3Å; V47-V50 PolarHBondContact O-N 2.97Å; V47-L51 HydrophobicContact CG1-CD1 3.85Å; V47-L51 WeakPolarHBondContact O-CB 3.28Å; V47-L51 VanDerWaalsContact O-CG 3.26Å; V47-L51 WeakPolarHBondContact O-CG 3.32Å; V47-L51 PolarHBondContact O-N 3.16Å
48	I	96.5	Very high	94.4	Very high	64 Å²	64	66.6 Å²	66.6	33%	0.328	36%	0.363	S	S	.	.	H	α-helix	trans	-61.3	-46.1	177.7	-67.7	167.4	0	0	0	110.2	T44 L51 F52	T44-I48 WeakPolarHBondContact O-CB 3.48Å; T44-I48 VanDerWaalsContact O-CG1 3.26Å; T44-I48 WeakPolarHBondContact O-CG1 3.41Å; T44-I48 PolarHBondContact O-N 2.85Å; I48-L51 PolarHBondContact O-N 3.37Å; I48-F52 HydrophobicContact CG2-CD1 4.12Å; I48-F52 HydrophobicContact CG2-CD2 3.94Å; I48-F52 HydrophobicContact CG2-CE1 4.14Å; I48-F52 HydrophobicContact CG2-CE2 3.95Å; I48-F52 HydrophobicContact CG2-CG 4.03Å; I48-F52 HydrophobicContact CG2-CZ 4.06Å; I48-F52 VanDerWaalsContact O-CB 3.23Å; I48-F52 WeakPolarHBondContact O-CB 3.34Å; I48-F52 WeakPolarHBondContact O-CD1 3.45Å; I48-F52 WeakPolarHBondContact O-CG 3.45Å; I48-F52 PolarHBondContact O-N 2.9Å
49	G	96.8	Very high	95	Very high	0 Å²	0	65.9 Å²	65.9	0%	0	35%	0.353	C	S	.	.	H	α-helix	trans	-59.4	-50	179.1	0	0	0	0	0	113.7	F45 F46 V47 L51 F52 I53	F45-G49 PolarHBondContact O-N 3.37Å; F46-G49 PolarHBondContact O-N 3.46Å; V47-G49 VanDerWaalsContact C-N 3.35Å; V47-G49 PolarHBondContact O-N 3.3Å; G49-L51 VanDerWaalsContact C-N 3.29Å; G49-L51 PolarHBondContact O-N 3.34Å; G49-F52 PolarHBondContact O-N 2.89Å; G49-I53 WeakPolarHBondContact O-CG1 3.42Å; G49-I53 PolarHBondContact O-N 3.31Å
50	V	97	Very high	95.5	Very high	96 Å²	96	58.2 Å²	58.2	58%	0.582	33%	0.327	S	S	*	.	H	α-helix	trans	-66.4	-30.2	-179.3	170.9	0	0	0	0	112	F46 V47 P54	F46-V50 WeakPolarHBondContact O-CB 3.45Å; F46-V50 VanDerWaalsContact O-CG2 3.27Å; F46-V50 WeakPolarHBondContact O-CG2 3.28Å; F46-V50 PolarHBondContact O-N 3.48Å; V47-V50 PolarHBondContact O-N 2.97Å; V50-P54 WeakPolarHBondContact O-CD 3.1Å; V50-P54 WeakPolarHBondContact O-CG 3.4Å
51	L	97.6	Very high	95.9	Very high	97 Å²	97	60.7 Å²	60.7	51%	0.508	33%	0.333	S	S	.	.	H	α-helix	trans	-80.9	-42.6	175.3	-68.9	174.7	0	0	0	112.4	V47 I48 G49 P54 I55	V47-L51 HydrophobicContact CG1-CD1 3.85Å; V47-L51 WeakPolarHBondContact O-CB 3.28Å; V47-L51 VanDerWaalsContact O-CG 3.26Å; V47-L51 WeakPolarHBondContact O-CG 3.32Å; V47-L51 PolarHBondContact O-N 3.16Å; I48-L51 PolarHBondContact O-N 3.37Å; G49-L51 VanDerWaalsContact C-N 3.29Å; G49-L51 PolarHBondContact O-N 3.34Å; L51-P54 WeakPolarHBondContact O-CD 3.24Å; L51-P54 WeakPolarHBondContact O-CG 3.02Å; L51-I55 WeakPolarHBondContact O-CB 3.26Å; L51-I55 VanDerWaalsContact O-CD1 3.3Å; L51-I55 WeakPolarHBondContact O-CD1 3.23Å; L51-I55 WeakPolarHBondContact O-CG1 3.37Å; L51-I55 PolarHBondContact O-N 3.41Å
52	F	98.3	Very high	96	Very high	65 Å²	65	61.4 Å²	61.4	29%	0.285	34%	0.335	S	S	.	.	H	α-helix	trans	-72.9	-34.1	-171.7	-82.3	25.3	0	0	0	112.8	I48 G49 G56 Y319 V322	I48-F52 HydrophobicContact CG2-CD1 4.12Å; I48-F52 HydrophobicContact CG2-CD2 3.94Å; I48-F52 HydrophobicContact CG2-CE1 4.14Å; I48-F52 HydrophobicContact CG2-CE2 3.95Å; I48-F52 HydrophobicContact CG2-CG 4.03Å; I48-F52 HydrophobicContact CG2-CZ 4.06Å; I48-F52 VanDerWaalsContact O-CB 3.23Å; I48-F52 WeakPolarHBondContact O-CB 3.34Å; I48-F52 WeakPolarHBondContact O-CD1 3.45Å; I48-F52 WeakPolarHBondContact O-CG 3.45Å; I48-F52 PolarHBondContact O-N 2.9Å; G49-F52 PolarHBondContact O-N 2.89Å; F52-G56 PolarHBondContact O-N 3.04Å; F52-Y319 HydrophobicContact CB-CD1 4.09Å; F52-Y319 HydrophobicContact CD1-CD1 4.22Å; F52-Y319 HydrophobicContact CD1-CE1 4.23Å; F52-Y319 AromaticContact CD2-CD1 3.96Å; F52-Y319 HydrophobicContact CD2-CD1 3.96Å; F52-Y319 HydrophobicContact CD2-CE1 4.3Å; F52-Y319 HydrophobicContact CE1-CE1 4.27Å; F52-Y319 HydrophobicContact CE2-CD1 4.43Å; F52-Y319 HydrophobicContact CE2-CE1 4.34Å; F52-Y319 AromaticContact CG-CD1 3.84Å; F52-Y319 HydrophobicContact CG-CD1 3.84Å; F52-Y319 HydrophobicContact CG-CE1 4.24Å; F52-Y319 HydrophobicContact CZ-CE1 4.33Å; F52-V322 HydrophobicContact CD2-CB 4.44Å; F52-V322 HydrophobicContact CD2-CG1 3.99Å; F52-V322 HydrophobicContact CE2-CG1 4.18Å
53	I	97.9	Very high	96.1	Very high	54 Å²	54	60.2 Å²	60.2	28%	0.277	33%	0.329	S	S	.	.	H	α-helix	trans	-61.7	-56.4	178.5	-67.6	171.6	0	0	0	112.3	G49 I55 G56 V57 I327	G49-I53 WeakPolarHBondContact O-CG1 3.42Å; G49-I53 PolarHBondContact O-N 3.31Å; I53-I55 VanDerWaalsContact C-N 3.32Å; I53-I55 PolarHBondContact O-N 3.47Å; I53-G56 PolarHBondContact O-N 3.28Å; I53-G56 VanDerWaalsContact O-N 3.16Å; I53-V57 WeakPolarHBondContact O-CG2 3.42Å; I53-V57 PolarHBondContact O-N 3.22Å; I53-I327 HydrophobicContact CD1-CD1 3.53Å
54	P	97.9	Very high	96	Very high	70 Å²	70	61 Å²	61	46%	0.455	33%	0.329	S	S	.	.	H	α-helix	trans	-63.7	-37.7	179.7	24.4	-33.4	0	0	0	112	V50 L51 G56 V57 V58	V50-P54 WeakPolarHBondContact O-CD 3.1Å; V50-P54 WeakPolarHBondContact O-CG 3.4Å; L51-P54 WeakPolarHBondContact O-CD 3.24Å; L51-P54 WeakPolarHBondContact O-CG 3.02Å; P54-G56 VanDerWaalsContact C-N 3.34Å; P54-G56 PolarHBondContact O-N 3.28Å; P54-V57 PolarHBondContact O-N 3.32Å; P54-V58 WeakPolarHBondContact O-CG2 3.17Å; P54-V58 PolarHBondContact O-N 2.63Å
55	I	97.5	Very high	95.8	Very high	76 Å²	76	61.1 Å²	61.1	39%	0.39	33%	0.33	S	S	.	.	H	α-helix	trans	-58.9	-48.2	173.1	-68.3	170.3	0	0	0	110.1	L51 I53 V57 V58 L59 Y319	L51-I55 WeakPolarHBondContact O-CB 3.26Å; L51-I55 VanDerWaalsContact O-CD1 3.3Å; L51-I55 WeakPolarHBondContact O-CD1 3.23Å; L51-I55 WeakPolarHBondContact O-CG1 3.37Å; L51-I55 PolarHBondContact O-N 3.41Å; I53-I55 VanDerWaalsContact C-N 3.32Å; I53-I55 PolarHBondContact O-N 3.47Å; I55-V57 PolarHBondContact O-N 2.84Å; I55-V58 PolarHBondContact O-N 3.36Å; I55-L59 HydrophobicContact CG2-CD1 3.79Å; I55-L59 HydrophobicContact CG2-CG 4.21Å; I55-L59 WeakPolarHBondContact O-CB 3.31Å; I55-L59 VanDerWaalsContact O-CG 3.25Å; I55-L59 WeakPolarHBondContact O-CG 3.27Å; I55-L59 PolarHBondContact O-N 3.36Å; I55-Y319 HydrophobicContact CB-CD1 4.31Å; I55-Y319 HydrophobicContact CG2-CD1 3.82Å; I55-Y319 HydrophobicContact CG2-CE1 3.9Å; I55-Y319 HydrophobicContact CG2-CG 4.48Å
56	G	97.6	Very high	95.6	Very high	0 Å²	0	58.8 Å²	58.8	0%	0	32%	0.32	C	S	.	.	H	α-helix	trans	-61.9	-39.7	178.9	0	0	0	0	0	113.2	F52 I53 P54 L59 L60 G316	F52-G56 PolarHBondContact O-N 3.04Å; I53-G56 PolarHBondContact O-N 3.28Å; I53-G56 VanDerWaalsContact O-N 3.16Å; P54-G56 VanDerWaalsContact C-N 3.34Å; P54-G56 PolarHBondContact O-N 3.28Å; G56-L59 PolarHBondContact O-N 3.43Å; G56-L60 VanDerWaalsContact O-CB 3.26Å; G56-L60 WeakPolarHBondContact O-CB 3.22Å; G56-L60 PolarHBondContact O-N 3.43Å; G56-G316 WeakPolarHBondContact O-CA 3.04Å
57	V	97.2	Very high	95.4	Very high	79 Å²	79	58.4 Å²	58.4	48%	0.479	32%	0.32	S	S	.	.	H	α-helix	trans	-62.9	-46	174.4	172.2	0	0	0	0	111.2	I53 P54 I55 L60 H61 I320	I53-V57 WeakPolarHBondContact O-CG2 3.42Å; I53-V57 PolarHBondContact O-N 3.22Å; P54-V57 PolarHBondContact O-N 3.32Å; I55-V57 PolarHBondContact O-N 2.84Å; V57-L60 PolarHBondContact O-N 3.26Å; V57-H61 WeakPolarHBondContact O-CB 3.4Å; V57-H61 PolarHBondContact O-N 3.35Å; V57-I320 HydrophobicContact CG2-CD1 4.06Å; V57-I320 HydrophobicContact CG2-CG1 4.35Å
58	V	96.2	Very high	95.3	Very high	85 Å²	85	56.9 Å²	56.9	52%	0.515	31%	0.308	S	S	.	.	H	α-helix	trans	-62.3	-47	176.9	171.6	0	0	0	0	110.8	P54 I55 L60 H61 L62	P54-V58 WeakPolarHBondContact O-CG2 3.17Å; P54-V58 PolarHBondContact O-N 2.63Å; I55-V58 PolarHBondContact O-N 3.36Å; V58-L60 VanDerWaalsContact C-N 3.33Å; V58-L60 PolarHBondContact O-N 3.31Å; V58-H61 PolarHBondContact O-N 3.48Å; V58-L62 HydrophobicContact CG1-CD1 3.95Å; V58-L62 HydrophobicContact CG1-CG 4.33Å; V58-L62 WeakPolarHBondContact O-CB 3.43Å; V58-L62 VanDerWaalsContact O-CG 3.32Å; V58-L62 WeakPolarHBondContact O-CG 3.37Å; V58-L62 PolarHBondContact O-N 3.47Å
59	L	95.6	Very high	95.3	Very high	29 Å²	29	55.3 Å²	55.3	15%	0.152	30%	0.3	C	S	.	.	H	α-helix	trans	-61.3	-41.5	177.9	-69.2	174.6	0	0	0	111.9	I55 G56 L62 S63 L308 L315 Y319	I55-L59 HydrophobicContact CG2-CD1 3.79Å; I55-L59 HydrophobicContact CG2-CG 4.21Å; I55-L59 WeakPolarHBondContact O-CB 3.31Å; I55-L59 VanDerWaalsContact O-CG 3.25Å; I55-L59 WeakPolarHBondContact O-CG 3.27Å; I55-L59 PolarHBondContact O-N 3.36Å; G56-L59 PolarHBondContact O-N 3.43Å; L59-L62 PolarHBondContact O-N 3.34Å; L59-S63 VanDerWaalsContact O-CB 3.31Å; L59-S63 WeakPolarHBondContact O-CB 3.27Å; L59-S63 PolarHBondContact O-N 3.41Å; L59-L308 HydrophobicContact CB-CD1 4.35Å; L59-L308 HydrophobicContact CD2-CD1 3.57Å; L59-L308 HydrophobicContact CD2-CD2 4.01Å; L59-L308 HydrophobicContact CD2-CG 4.44Å; L59-L315 HydrophobicContact CD1-CD2 3.96Å; L59-L315 HydrophobicContact CD1-CG 4.06Å; L59-Y319 HydrophobicContact CD1-CD2 4.08Å; L59-Y319 HydrophobicContact CD1-CE2 4.24Å; L59-Y319 HydrophobicContact CD1-CG 4.38Å
60	L	95.1	Very high	95.4	Very high	42 Å²	42	59.1 Å²	59.1	22%	0.22	32%	0.319	C	S	.	.	H	α-helix	trans	-65.1	-41.7	177.1	-175.3	60.4	0	0	0	111.3	G56 V57 V58 S63 N64 P313 I317 I320	G56-L60 VanDerWaalsContact O-CB 3.26Å; G56-L60 WeakPolarHBondContact O-CB 3.22Å; G56-L60 PolarHBondContact O-N 3.43Å; V57-L60 PolarHBondContact O-N 3.26Å; V58-L60 VanDerWaalsContact C-N 3.33Å; V58-L60 PolarHBondContact O-N 3.31Å; L60-S63 PolarHBondContact O-N 2.81Å; L60-N64 PolarHBondContact O-N 3.43Å; L60-N64 PolarHBondContact O-ND2 3.5Å; L60-P313 HydrophobicContact CD1-CB 3.58Å; L60-I317 HydrophobicContact CD1-CG1 4.27Å; L60-I320 HydrophobicContact CD2-CD1 4.1Å
61	H	94.1	Very high	95.4	Very high	127 Å²	127	55.3 Å²	55.3	59%	0.588	30%	0.296	S	S	*	.	H	α-helix	trans	-62.1	-49.9	175.3	-174.9	73.5	0	0	0	111.4	V57 V58 S63 N64 T65	V57-H61 WeakPolarHBondContact O-CB 3.4Å; V57-H61 PolarHBondContact O-N 3.35Å; V58-H61 PolarHBondContact O-N 3.48Å; H61-S63 PolarHBondContact O-N 3.24Å; H61-N64 PolarHBondContact O-N 3.41Å; H61-N64 VanDerWaalsContact O-N 3.08Å; H61-T65 PolarHBondContact O-N 2.86Å
62	L	92.9	Very high	95.4	Very high	51 Å²	51	55.2 Å²	55.2	27%	0.267	30%	0.295	S	S	.	.	H	α-helix	trans	-61.6	-27.5	176.8	-69.9	176.3	0	0	0	113.2	V58 L59 T65 S306 L308	V58-L62 HydrophobicContact CG1-CD1 3.95Å; V58-L62 HydrophobicContact CG1-CG 4.33Å; V58-L62 WeakPolarHBondContact O-CB 3.43Å; V58-L62 VanDerWaalsContact O-CG 3.32Å; V58-L62 WeakPolarHBondContact O-CG 3.37Å; V58-L62 PolarHBondContact O-N 3.47Å; L59-L62 PolarHBondContact O-N 3.34Å; L62-T65 PolarHBondContact O-OG1 3.43Å; L62-S306 WeakPolarHBondContact O-CB 3.34Å; L62-S306 PolarHBondContact O-OG 2.86Å; L62-L308 HydrophobicContact CB-CD1 3.85Å; L62-L308 HydrophobicContact CB-CG 4.39Å; L62-L308 HydrophobicContact CD1-CD1 4.35Å
63	S	93.1	Very high	95.3	Very high	3 Å²	3	52.2 Å²	52.2	2%	0.021	28%	0.282	C	S	.	.	H	α-helix	trans	-75	-37.4	174.8	-169.1	0	0	0	0	112.2	L59 L60 H61 T65 A66 N312	L59-S63 VanDerWaalsContact O-CB 3.31Å; L59-S63 WeakPolarHBondContact O-CB 3.27Å; L59-S63 PolarHBondContact O-N 3.41Å; L60-S63 PolarHBondContact O-N 2.81Å; H61-S63 PolarHBondContact O-N 3.24Å; S63-T65 VanDerWaalsContact C-N 3.31Å; S63-T65 PolarHBondContact O-N 3.11Å; S63-A66 PolarHBondContact O-N 2.9Å; S63-N312 WeakPolarHBondContact OG-CA 3.38Å; S63-N312 PolarHBondContact OG-N 3.35Å; S63-N312 PolarHBondContact OG-O 3.46Å
64	N	91	Very high	95.2	Very high	84 Å²	84	50.1 Å²	50.1	45%	0.449	27%	0.272	S	S	.	.	H	α-helix	trans	-76.9	-12.8	-178.8	-74.3	-24.3	0	0	0	114.2	L60 H61 A66	L60-N64 PolarHBondContact O-N 3.43Å; L60-N64 PolarHBondContact O-ND2 3.5Å; H61-N64 PolarHBondContact O-N 3.41Å; H61-N64 VanDerWaalsContact O-N 3.08Å; N64-A66 VanDerWaalsContact C-N 3.25Å; N64-A66 PolarHBondContact O-N 3.08Å
65	T	90.4	Very high	95	Very high	74 Å²	74	55 Å²	55	45%	0.454	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.8	-20.7	172	59.7	0	0	0	0	112.9	H61 L62 S63	H61-T65 PolarHBondContact O-N 2.86Å; L62-T65 PolarHBondContact O-OG1 3.43Å; S63-T65 VanDerWaalsContact C-N 3.31Å; S63-T65 PolarHBondContact O-N 3.11Å
66	A	91.2	Very high	94.9	Very high	0 Å²	0	51.7 Å²	51.7	0%	0	27%	0.27	C	S	.	.	S	Bend	trans	-78.2	127.3	173.1	0	0	0	0	0	110.4	S63 N64 K311	S63-A66 PolarHBondContact O-N 2.9Å; N64-A66 VanDerWaalsContact C-N 3.25Å; N64-A66 PolarHBondContact O-N 3.08Å; A66-K311 HydrophobicContact CB-CB 4.06Å; A66-K311 WeakPolarHBondContact O-CD 3.32Å
67	N	93.3	Very high	94.7	Very high	47 Å²	47	58.7 Å²	58.7	25%	0.251	30%	0.296	S	S	.	.			trans	-93.6	138.7	174.6	-70.9	-29.5	0	0	0	109.3	D108 F109 S303 T304	N67-D108 PolarHBondContact ND2-O 3.24Å; N67-F109 HydrophobicContact CB-CD1 3.81Å; N67-F109 HydrophobicContact CB-CD2 4.33Å; N67-F109 HydrophobicContact CB-CE1 3.59Å; N67-F109 HydrophobicContact CB-CE2 4.12Å; N67-F109 HydrophobicContact CB-CG 4.18Å; N67-F109 HydrophobicContact CB-CZ 3.75Å; N67-S303 WeakPolarHBondContact O-CA 3.38Å; N67-T304 PolarHBondContact N-OG1 3.5Å; N67-T304 PolarHBondContact O-N 3.17Å
68	E	95.3	Very high	94.6	Very high	51 Å²	51	59 Å²	59	24%	0.238	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	133.4	179.4	-172.6	176.9	96.2	0	0	109.5	I70 R259 I301 L302 K311	E68-I70 HydrophobicContact CG-CG1 4.24Å; E68-I70 WeakPolarHBondContact OE1-CD1 3.41Å; E68-R259 IonicContact OE1-NH2 3.36Å; E68-R259 IonicContact OE2-CZ 3.34Å; E68-R259 IonicContact OE2-NH1 3.14Å; E68-R259 PolarHBondContact OE2-NH1 2.95Å; E68-R259 IonicContact OE2-NH2 3.87Å; E68-R259 PolarHBondContact OE2-NH2 3Å; E68-R259 VanDerWaalsContact OE2-NH2 3.14Å; E68-I301 HydrophobicContact CG-CG2 3.72Å; E68-L302 CarbonylContact C-O 3.57Å; E68-L302 VanDerWaalsContact CA-O 3.32Å; E68-L302 WeakPolarHBondContact CA-O 3.36Å; E68-K311 HydrophobicContact CB-CB 4.41Å; E68-K311 HydrophobicContact CB-CD 4.22Å
69	L	96.4	Very high	94.2	Very high	31 Å²	31	58.1 Å²	58.1	16%	0.162	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	128.3	171.9	178.8	69.1	0	0	0	108.3	I71 F103 L105 F109 I301 L302	L69-I71 HydrophobicContact CD2-CD1 3.83Å; L69-I71 HydrophobicContact CD2-CG1 4.39Å; L69-I71 HydrophobicContact CG-CD1 4.21Å; L69-I71 HydrophobicContact CG-CG1 4.31Å; L69-F103 HydrophobicContact CD2-CD2 3.51Å; L69-F103 HydrophobicContact CD2-CE2 3.55Å; L69-L105 HydrophobicContact CB-CD1 4.38Å; L69-L105 HydrophobicContact CD2-CD1 3.78Å; L69-F109 HydrophobicContact CB-CE2 4.44Å; L69-F109 HydrophobicContact CB-CZ 3.88Å; L69-I301 CarbonylContact O-C 3.25Å; L69-I301 VanDerWaalsContact O-CA 3.31Å; L69-I301 WeakPolarHBondContact O-CA 3.07Å; L69-L302 PolarHBondContact N-O 3.4Å; L69-L302 PolarHBondContact O-N 3.3Å
70	I	97.3	Very high	93.5	Very high	80 Å²	80	60.4 Å²	60.4	41%	0.41	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	127.1	178.6	-52.6	-179.7	0	0	0	108.6	E68 R299 I301	E68-I70 HydrophobicContact CG-CG1 4.24Å; E68-I70 WeakPolarHBondContact OE1-CD1 3.41Å; I70-R299 HydrophobicContact CG2-CB 3.98Å; I70-R299 HydrophobicContact CG2-CG 4.34Å; I70-I301 HydrophobicContact CG1-CG1 4.23Å; I70-I301 HydrophobicContact CG1-CG2 4.28Å; I70-I301 HydrophobicContact CG2-CG1 4.19Å
71	I	97.7	Very high	92.9	Very high	17 Å²	17	59.7 Å²	59.7	9%	0.087	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	114.3	177.3	-67.1	151.3	0	0	0	108.1	L69 V101 F103 L283 R299 M300	L69-I71 HydrophobicContact CD2-CD1 3.83Å; L69-I71 HydrophobicContact CD2-CG1 4.39Å; L69-I71 HydrophobicContact CG-CD1 4.21Å; L69-I71 HydrophobicContact CG-CG1 4.31Å; I71-V101 HydrophobicContact CG2-CG1 3.96Å; I71-F103 HydrophobicContact CD1-CB 3.92Å; I71-F103 HydrophobicContact CD1-CD1 3.56Å; I71-F103 HydrophobicContact CD1-CD2 3.63Å; I71-F103 HydrophobicContact CD1-CE1 3.83Å; I71-F103 HydrophobicContact CD1-CE2 3.87Å; I71-F103 HydrophobicContact CD1-CG 3.43Å; I71-F103 VanDerWaalsContact CD1-CG 3.43Å; I71-F103 HydrophobicContact CD1-CZ 3.94Å; I71-F103 HydrophobicContact CG1-CB 4.41Å; I71-F103 HydrophobicContact CG1-CG 4.4Å; I71-L283 HydrophobicContact CG2-CD2 4.37Å; I71-R299 CarbonylContact O-C 3.52Å; I71-R299 WeakPolarHBondContact O-CA 3.28Å; I71-M300 HydrophobicContact CB-CE 4.45Å; I71-M300 HydrophobicContact CD1-CE 3.38Å; I71-M300 HydrophobicContact CG1-CE 4.47Å; I71-M300 PolarHBondContact N-O 3.42Å; I71-M300 PolarHBondContact O-N 2.91Å
72	D	97.4	Very high	92.6	Very high	94 Å²	94	60.1 Å²	60.1	50%	0.503	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	124.6	170.8	-166.9	-44.5	0	0	0	109.1	T74	D72-T74 WeakPolarHBondContact OD1-CB 3.43Å; D72-T74 PolarHBondContact OD1-N 3.33Å; D72-T74 PolarHBondContact OD1-OG1 3.27Å
73	Y	96.9	Very high	92.6	Very high	2 Å²	2	60.9 Å²	60.9	1%	0.008	33%	0.334	C	S	.	.			trans	-120.9	18	177.6	68.3	-89.7	0	0	0	112.1	K75 C76 F174 D176 L178 I285 Y287 K298 R299 M300	Y73-K75 VanDerWaalsContact C-N 3.32Å; Y73-K75 PolarHBondContact O-N 2.82Å; Y73-C76 VanDerWaalsContact O-CB 3.25Å; Y73-C76 WeakPolarHBondContact O-CB 3.48Å; Y73-C76 PolarHBondContact O-N 3.03Å; Y73-F174 WeakPolarHBondContact OH-CZ 3.35Å; Y73-D176 PolarHBondContact OH-OD2 3.47Å; Y73-L178 HydrophobicContact CE1-CD2 4.28Å; Y73-L178 HydrophobicContact CE2-CD2 4.24Å; Y73-I285 HydrophobicContact CD2-CG1 4.26Å; Y73-I285 HydrophobicContact CD2-CG2 4.09Å; Y73-I285 HydrophobicContact CE2-CG2 4.05Å; Y73-I285 HydrophobicContact CG-CG1 4.46Å; Y73-Y287 HydrophobicContact CD2-CD2 4.23Å; Y73-Y287 HydrophobicContact CD2-CE2 4.28Å; Y73-Y287 HydrophobicContact CE2-CD2 4.44Å; Y73-K298 HydrophobicContact CD2-CB 4.33Å; Y73-K298 HydrophobicContact CE1-CB 4Å; Y73-K298 HydrophobicContact CE2-CB 3.79Å; Y73-K298 HydrophobicContact CE2-CD 4.08Å; Y73-K298 PolarHBondContact N-O 3.19Å; Y73-R299 VanDerWaalsContact CE1-C 3.42Å; Y73-M300 HydrophobicContact CD1-CB 4.15Å; Y73-M300 HydrophobicContact CE1-CB 4.1Å
74	T	95.9	Very high	92.6	Very high	11 Å²	11	61.8 Å²	61.8	7%	0.067	34%	0.339	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57	-45.7	-179.7	-48.5	0	0	0	0	111.4	D72 Y287 V291 T297 K298	D72-T74 WeakPolarHBondContact OD1-CB 3.43Å; D72-T74 PolarHBondContact OD1-N 3.33Å; D72-T74 PolarHBondContact OD1-OG1 3.27Å; T74-Y287 PolarHBondContact O-OH 3.08Å; T74-V291 HydrophobicContact CG2-CG2 3.96Å; T74-T297 WeakPolarHBondContact OG1-CA 2.95Å; T74-T297 WeakPolarHBondContact OG1-CB 3.25Å; T74-K298 PolarHBondContact N-O 2.85Å; T74-K298 PolarHBondContact OG1-N 3.36Å; T74-K298 PolarHBondContact OG1-O 3.49Å
75	K	93.9	Very high	92.7	Very high	171 Å²	171	57.8 Å²	57.8	74%	0.743	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.7	36.2	-178.7	-61.1	-173.9	-179.9	-175.3	0	112.5	Y73 T84	Y73-K75 VanDerWaalsContact C-N 3.32Å; Y73-K75 PolarHBondContact O-N 2.82Å; K75-T84 HydrophobicContact CB-CG2 4.25Å
76	C	93.9	Very high	92.8	Very high	8 Å²	8	54.7 Å²	54.7	5%	0.054	30%	0.299	C	S	.	.	P	Polyproline II helix	trans	-62.9	134.8	178.3	-165.3	0	0	0	0	110.9	Y73 T84 C85 C99 V101	Y73-C76 VanDerWaalsContact O-CB 3.25Å; Y73-C76 WeakPolarHBondContact O-CB 3.48Å; Y73-C76 PolarHBondContact O-N 3.03Å; C76-T84 WeakPolarHBondContact O-CA 3.34Å; C76-C85 PolarHBondContact O-N 2.87Å; C76-C99 HydrophobicContact CB-CB 3.91Å; C76-C99 WeakPolarHBondContact CB-SG 3.35Å; C76-C99 WeakPolarHBondContact SG-CB 3.32Å; C76-C99 CovalentContact SG-SG 2.02Å; C76-C99 PolarHBondContact SG-SG 3.13Å; C76-V101 HydrophobicContact CB-CG2 4.46Å; C76-V101 WeakPolarHBondContact SG-CG2 3.37Å
77	R	94.5	Very high	92.7	Very high	147 Å²	147	59.8 Å²	59.8	56%	0.555	32%	0.323	S	S	*	.	B	Isolated β-bridge	trans	-84.1	136.9	-177.9	-65.3	179.1	84.2	116.2	-6.6	110.8	N82 C99	R77-N82 PolarHBondContact NH2-O 3.38Å; R77-N82 PolarHBondContact NH2-OD1 2.98Å; R77-C99 WeakPolarHBondContact O-CB 3.49Å
78	R	93.9	Very high	92.6	Very high	84 Å²	84	60.6 Å²	60.6	32%	0.317	32%	0.323	S	S	.	.	B	Isolated β-bridge	trans	-60.2	137.2	179.1	-171.8	177.8	83.4	101.3	7.8	111.1	G80 G81 T83 C97	R78-G80 PolarHBondContact NH2-O 3.34Å; R78-G80 PolarHBondContact O-N 3.24Å; R78-G81 PolarHBondContact O-N 2.9Å; R78-G81 VanDerWaalsContact O-N 3.11Å; R78-T83 PolarHBondContact N-O 3.46Å; R78-T83 VanDerWaalsContact N-O 3.08Å; R78-C97 VanDerWaalsContact CG-SG 3.53Å
79	S	87.9	Confident	92.4	Very high	67 Å²	67	58.9 Å²	58.9	47%	0.469	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62	121.5	171.1	-169.4	0	0	0	0	110.1	P98	S79-P98 PolarHBondContact N-O 3.43Å
80	G	81	Confident	91.9	Very high	78 Å²	78	63 Å²	63	80%	0.804	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.9	19.5	-175.7	0	0	0	0	0	115.5	R78	R78-G80 PolarHBondContact NH2-O 3.34Å; R78-G80 PolarHBondContact O-N 3.24Å
81	G	83.2	Confident	91.4	Very high	26 Å²	26	62.7 Å²	62.7	27%	0.268	34%	0.344	S	S	.	.	S	Bend	trans	-147.5	165.9	175.1	0	0	0	0	0	113.9	R78	R78-G81 PolarHBondContact O-N 2.9Å; R78-G81 VanDerWaalsContact O-N 3.11Å
82	N	87.9	Confident	91	Very high	136 Å²	136	65 Å²	65	73%	0.727	36%	0.356	S	S	*	.	S	Bend	trans	-96.5	-8	177.5	-87.7	-27.2	0	0	0	114.4	R77	R77-N82 PolarHBondContact NH2-O 3.38Å; R77-N82 PolarHBondContact NH2-OD1 2.98Å
83	T	92	Very high	90.3	Very high	68 Å²	68	65.8 Å²	65.8	42%	0.417	37%	0.366	S	S	.	.	S	Bend	trans	-86.4	154.7	178.6	54.9	0	0	0	0	111.7	R78	R78-T83 PolarHBondContact N-O 3.46Å; R78-T83 VanDerWaalsContact N-O 3.08Å
84	T	93.9	Very high	89.5	Confident	22 Å²	22	68.5 Å²	68.5	14%	0.135	40%	0.395	C	S	.	.	B	Isolated β-bridge	trans	-75.5	150.8	172.3	67.1	0	0	0	0	110.4	K75 C76 A86 E87 Y88	K75-T84 HydrophobicContact CB-CG2 4.25Å; C76-T84 WeakPolarHBondContact O-CA 3.34Å; T84-A86 PolarHBondContact O-N 3.41Å; T84-E87 PolarHBondContact N-OE2 3.23Å; T84-E87 VanDerWaalsContact N-OE2 3.08Å; T84-E87 PolarHBondContact O-N 3.16Å; T84-E87 VanDerWaalsContact OG1-CG 3.22Å; T84-E87 WeakPolarHBondContact OG1-CG 2.92Å; T84-E87 PolarHBondContact OG1-N 3.11Å; T84-E87 PolarHBondContact OG1-OE2 2.02Å; T84-Y88 WeakPolarHBondContact O-CB 3.38Å; T84-Y88 PolarHBondContact O-N 2.83Å
85	C	93.7	Very high	89.1	Confident	0 Å²	0	70.9 Å²	70.9	0%	0	41%	0.409	C	S	.	.	H	α-helix	trans	-62.1	-30.7	172.6	-76.9	0	0	0	0	111.8	C76 Y88 L89 C97 Y287	C76-C85 PolarHBondContact O-N 2.87Å; C85-Y88 PolarHBondContact O-N 2.89Å; C85-L89 HydrophobicContact CB-CD1 4.46Å; C85-L89 WeakPolarHBondContact O-CD1 3.34Å; C85-L89 PolarHBondContact O-N 3.36Å; C85-C97 WeakPolarHBondContact CA-SG 3.26Å; C85-C97 HydrophobicContact CB-CB 3.61Å; C85-C97 WeakPolarHBondContact CB-SG 2.88Å; C85-C97 WeakPolarHBondContact SG-CB 3.15Å; C85-C97 CovalentContact SG-SG 2.04Å; C85-C97 PolarHBondContact SG-SG 3.24Å; C85-Y287 HydrophobicContact CB-CD1 4.03Å; C85-Y287 HydrophobicContact CB-CD2 3.9Å; C85-Y287 HydrophobicContact CB-CE1 4.49Å; C85-Y287 HydrophobicContact CB-CE2 4.37Å; C85-Y287 HydrophobicContact CB-CG 3.71Å
86	A	91.2	Very high	89	Confident	8 Å²	8	66 Å²	66	7%	0.066	39%	0.394	C	S	.	.	H	α-helix	trans	-60.8	-51.2	177.9	0	0	0	0	0	111.9	T84 L89 E90 V292	T84-A86 PolarHBondContact O-N 3.41Å; A86-L89 PolarHBondContact O-N 3.08Å; A86-E90 PolarHBondContact O-N 3.05Å; A86-V292 HydrophobicContact CB-CG2 3.59Å
87	E	90.3	Very high	89	Confident	108 Å²	108	65.7 Å²	65.7	51%	0.505	39%	0.392	S	S	.	.	H	α-helix	trans	-66	-38.2	175.4	-66.6	155.2	164.7	0	0	111.8	T84 L89 E90 A91	T84-E87 PolarHBondContact N-OE2 3.23Å; T84-E87 VanDerWaalsContact N-OE2 3.08Å; T84-E87 PolarHBondContact O-N 3.16Å; T84-E87 VanDerWaalsContact OG1-CG 3.22Å; T84-E87 WeakPolarHBondContact OG1-CG 2.92Å; T84-E87 PolarHBondContact OG1-N 3.11Å; T84-E87 PolarHBondContact OG1-OE2 2.02Å; E87-L89 VanDerWaalsContact C-N 3.34Å; E87-L89 PolarHBondContact O-N 3.33Å; E87-E90 PolarHBondContact O-N 2.92Å; E87-A91 PolarHBondContact O-N 3.25Å
88	Y	91.1	Very high	89.1	Confident	64 Å²	64	61.6 Å²	61.6	25%	0.251	38%	0.384	S	S	.	.	H	α-helix	trans	-63.4	-39.5	-179.5	-176.2	-97.4	0	0	0	112.4	T84 C85 A91 N92 V95 C97	T84-Y88 WeakPolarHBondContact O-CB 3.38Å; T84-Y88 PolarHBondContact O-N 2.83Å; C85-Y88 PolarHBondContact O-N 2.89Å; Y88-A91 PolarHBondContact O-N 2.91Å; Y88-N92 HydrophobicContact CE1-CB 4.31Å; Y88-N92 WeakPolarHBondContact O-CB 3.38Å; Y88-N92 PolarHBondContact O-N 3.31Å; Y88-N92 PolarHBondContact O-ND2 3.37Å; Y88-V95 HydrophobicContact CE1-CB 4.26Å; Y88-V95 HydrophobicContact CE1-CG1 3.89Å; Y88-C97 HydrophobicContact CD1-CB 4.13Å
89	L	90.6	Very high	89.2	Confident	15 Å²	15	57.6 Å²	57.6	8%	0.079	37%	0.369	C	S	.	.	H	α-helix	trans	-71.2	-28.6	177.5	-93	78.8	0	0	0	113	C85 A86 E87 N92 C97 Y287 N288	C85-L89 HydrophobicContact CB-CD1 4.46Å; C85-L89 WeakPolarHBondContact O-CD1 3.34Å; C85-L89 PolarHBondContact O-N 3.36Å; A86-L89 PolarHBondContact O-N 3.08Å; E87-L89 VanDerWaalsContact C-N 3.34Å; E87-L89 PolarHBondContact O-N 3.33Å; L89-N92 CarbonylContact O-C 3.58Å; L89-C97 HydrophobicContact CD1-CB 3.48Å; L89-C97 VanDerWaalsContact CD1-CB 3.48Å; L89-Y287 HydrophobicContact CD1-CD1 3.91Å; L89-Y287 HydrophobicContact CD1-CE1 4.48Å; L89-Y287 HydrophobicContact CD2-CD1 3.8Å; L89-Y287 HydrophobicContact CD2-CE1 4.1Å; L89-Y287 HydrophobicContact CG-CD1 4.48Å; L89-N288 WeakPolarHBondContact CD2-O 3.1Å
90	E	86.4	Confident	89.5	Confident	116 Å²	116	59.7 Å²	59.7	54%	0.542	37%	0.372	S	S	.	.	H	α-helix	trans	-67.2	-38.8	172.9	-71.3	-173.3	154.4	0	0	111.5	A86 E87 V292	A86-E90 PolarHBondContact O-N 3.05Å; E87-E90 PolarHBondContact O-N 2.92Å; E90-V292 VanDerWaalsContact OE1-CB 3.24Å; E90-V292 WeakPolarHBondContact OE1-CB 3.32Å; E90-V292 WeakPolarHBondContact OE1-CG1 3.39Å
91	A	86.8	Confident	90.2	Very high	75 Å²	75	57.3 Å²	57.3	62%	0.62	34%	0.342	S	S	*	.	H	α-helix	trans	-77.3	-30.2	176.2	0	0	0	0	0	113.3	E87 Y88	E87-A91 PolarHBondContact O-N 3.25Å; Y88-A91 PolarHBondContact O-N 2.91Å
92	N	88.3	Confident	90.9	Very high	65 Å²	65	60.8 Å²	60.8	35%	0.348	36%	0.359	S	S	.	.	S	Bend	trans	-130.5	77.8	-175	-58.6	-88.5	0	0	0	110.7	Y88 L89 G94 V95	Y88-N92 HydrophobicContact CE1-CB 4.31Å; Y88-N92 WeakPolarHBondContact O-CB 3.38Å; Y88-N92 PolarHBondContact O-N 3.31Å; Y88-N92 PolarHBondContact O-ND2 3.37Å; L89-N92 CarbonylContact O-C 3.58Å; N92-G94 PolarHBondContact O-N 2.96Å; N92-V95 HydrophobicContact CB-CB 4.35Å; N92-V95 HydrophobicContact CB-CG2 3.96Å; N92-V95 PolarHBondContact O-N 2.91Å
93	P	82.9	Confident	91.3	Very high	110 Å²	110	55.3 Å²	55.3	71%	0.714	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.5	138.9	179.6	25.8	-33.7	0	0	0	110.8
94	G	80.6	Confident	91.5	Very high	60 Å²	60	56.4 Å²	56.4	62%	0.619	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	85.4	1.2	177.8	0	0	0	0	0	115.5	N92	N92-G94 PolarHBondContact O-N 2.96Å
95	V	88	Confident	91.6	Very high	60 Å²	60	55.4 Å²	55.4	36%	0.364	33%	0.329	S	S	.	.			trans	-96	139.2	176.4	-174.8	0	0	0	0	111.2	Y88 N92	Y88-V95 HydrophobicContact CE1-CB 4.26Å; Y88-V95 HydrophobicContact CE1-CG1 3.89Å; N92-V95 HydrophobicContact CB-CB 4.35Å; N92-V95 HydrophobicContact CB-CG2 3.96Å; N92-V95 PolarHBondContact O-N 2.91Å
96	T	91.4	Very high	91.7	Very high	70 Å²	70	60.2 Å²	60.2	43%	0.429	36%	0.36	S	S	.	.			trans	-80.8	125.7	172.1	-60.1	0	0	0	0	111.2	K286 N288	T96-K286 HydrophobicContact CG2-CB 3.77Å; T96-K286 HydrophobicContact CG2-CG 4.36Å; T96-N288 VanDerWaalsContact CA-OD1 3.25Å; T96-N288 WeakPolarHBondContact CA-OD1 3.37Å; T96-N288 WeakPolarHBondContact CB-OD1 3.48Å; T96-N288 VanDerWaalsContact CG2-OD1 3.25Å; T96-N288 WeakPolarHBondContact CG2-OD1 3.49Å; T96-N288 PolarHBondContact OG1-OD1 3.37Å
97	C	94.3	Very high	91.9	Very high	1 Å²	1	62 Å²	62	1%	0.007	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	110.6	175.5	-176.2	0	0	0	0	110.9	R78 C85 Y88 L89 Y287	R78-C97 VanDerWaalsContact CG-SG 3.53Å; C85-C97 WeakPolarHBondContact CA-SG 3.26Å; C85-C97 HydrophobicContact CB-CB 3.61Å; C85-C97 WeakPolarHBondContact CB-SG 2.88Å; C85-C97 WeakPolarHBondContact SG-CB 3.15Å; C85-C97 CovalentContact SG-SG 2.04Å; C85-C97 PolarHBondContact SG-SG 3.24Å; Y88-C97 HydrophobicContact CD1-CB 4.13Å; L89-C97 HydrophobicContact CD1-CB 3.48Å; L89-C97 VanDerWaalsContact CD1-CB 3.48Å; C97-Y287 PolarHBondContact N-O 2.86Å; C97-Y287 WeakPolarHBondContact O-CA 3.4Å; C97-Y287 WeakPolarHBondContact O-CB 3.31Å; C97-Y287 PolarHBondContact O-N 2.91Å
98	P	95.4	Very high	92.1	Very high	60 Å²	60	59 Å²	59	39%	0.39	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77	137.1	175.5	30.5	-33	0	0	0	110.8	S79 I285	S79-P98 PolarHBondContact N-O 3.43Å; P98-I285 WeakPolarHBondContact CA-O 3.4Å
99	C	95.6	Very high	92.3	Very high	0 Å²	0	56 Å²	56	0%	0	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148	153.5	174.4	82.4	0	0	0	0	112.4	C76 R77 N284 I285	C76-C99 HydrophobicContact CB-CB 3.91Å; C76-C99 WeakPolarHBondContact CB-SG 3.35Å; C76-C99 WeakPolarHBondContact SG-CB 3.32Å; C76-C99 CovalentContact SG-SG 2.02Å; C76-C99 PolarHBondContact SG-SG 3.13Å; R77-C99 WeakPolarHBondContact O-CB 3.49Å; C99-N284 PolarHBondContact O-OD1 3.5Å; C99-I285 PolarHBondContact N-O 2.81Å; C99-I285 PolarHBondContact O-N 2.79Å
100	E	95.3	Very high	92.3	Very high	111 Å²	111	60 Å²	60	52%	0.519	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	132	-176.2	-66.7	179.3	-176.4	0	0	110.2	T282 L283	E100-T282 HydrophobicContact CB-CG2 4.2Å; E100-L283 WeakPolarHBondContact CA-O 3.42Å
101	V	96.1	Very high	92.5	Very high	29 Å²	29	56 Å²	56	18%	0.176	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	103.1	178.3	-175.7	0	0	0	0	108.5	I71 C76 L283 I285	I71-V101 HydrophobicContact CG2-CG1 3.96Å; C76-V101 HydrophobicContact CB-CG2 4.46Å; C76-V101 WeakPolarHBondContact SG-CG2 3.37Å; V101-L283 HydrophobicContact CB-CB 4.41Å; V101-L283 PolarHBondContact N-O 2.92Å; V101-L283 PolarHBondContact O-N 2.88Å; V101-I285 HydrophobicContact CB-CD1 4.46Å; V101-I285 HydrophobicContact CG2-CD1 3.86Å
102	P	96.3	Very high	92.6	Very high	99 Å²	99	54.8 Å²	54.8	64%	0.643	34%	0.344	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70.2	139.5	171.1	29.8	-33.1	0	0	0	109.6
103	F	96.9	Very high	92.9	Very high	21 Å²	21	51.9 Å²	51.9	9%	0.092	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.4	159.6	177	70.7	-91.6	0	0	0	111.5	L69 I71 L180 Y281 L283 M300 L302	L69-F103 HydrophobicContact CD2-CD2 3.51Å; L69-F103 HydrophobicContact CD2-CE2 3.55Å; I71-F103 HydrophobicContact CD1-CB 3.92Å; I71-F103 HydrophobicContact CD1-CD1 3.56Å; I71-F103 HydrophobicContact CD1-CD2 3.63Å; I71-F103 HydrophobicContact CD1-CE1 3.83Å; I71-F103 HydrophobicContact CD1-CE2 3.87Å; I71-F103 HydrophobicContact CD1-CG 3.43Å; I71-F103 VanDerWaalsContact CD1-CG 3.43Å; I71-F103 HydrophobicContact CD1-CZ 3.94Å; I71-F103 HydrophobicContact CG1-CB 4.41Å; I71-F103 HydrophobicContact CG1-CG 4.4Å; F103-L180 HydrophobicContact CE1-CD1 3.6Å; F103-L180 HydrophobicContact CZ-CD1 3.48Å; F103-L180 VanDerWaalsContact CZ-CD1 3.48Å; F103-Y281 HydrophobicContact CE2-CD2 4.32Å; F103-Y281 HydrophobicContact CE2-CG 4.24Å; F103-Y281 VanDerWaalsContact CZ-CB 3.42Å; F103-Y281 HydrophobicContact CZ-CG 4.18Å; F103-Y281 PolarHBondContact N-O 2.84Å; F103-Y281 PolarHBondContact O-N 3.05Å; F103-Y281 VanDerWaalsContact O-O 3.05Å; F103-L283 HydrophobicContact CD1-CB 4.21Å; F103-L283 HydrophobicContact CE1-CB 3.96Å; F103-M300 HydrophobicContact CE1-CE 4.18Å; F103-M300 HydrophobicContact CZ-CE 4.17Å; F103-L302 HydrophobicContact CE2-CD1 4.21Å; F103-L302 HydrophobicContact CZ-CD1 4.04Å
104	V	96.9	Very high	93.5	Very high	91 Å²	91	49.2 Å²	49.2	55%	0.552	31%	0.305	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-110.5	127.8	177.8	-172.7	0	0	0	0	108.9	P106 G279 N280	V104-P106 WeakPolarHBondContact O-CD 3.36Å; V104-G279 WeakPolarHBondContact CA-O 3.43Å; V104-N280 WeakPolarHBondContact CG2-OD1 3.47Å
105	L	96.8	Very high	94.4	Very high	1 Å²	1	46.4 Å²	46.4	1%	0.005	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	112.9	170.4	-165.3	70.7	0	0	0	108.4	L69 S107 F109 L276 K277 S278 G279 Y281	L69-L105 HydrophobicContact CB-CD1 4.38Å; L69-L105 HydrophobicContact CD2-CD1 3.78Å; L105-S107 VanDerWaalsContact C-N 3.32Å; L105-S107 WeakPolarHBondContact CG-O 3.39Å; L105-S107 PolarHBondContact O-N 3.42Å; L105-F109 HydrophobicContact CD1-CD1 3.68Å; L105-F109 HydrophobicContact CD1-CD2 4.46Å; L105-F109 HydrophobicContact CD1-CE1 3.42Å; L105-F109 VanDerWaalsContact CD1-CE1 3.42Å; L105-F109 HydrophobicContact CD1-CE2 4.24Å; L105-F109 HydrophobicContact CD1-CG 4.21Å; L105-F109 HydrophobicContact CD1-CZ 3.73Å; L105-F109 HydrophobicContact CD2-CB 4.35Å; L105-F109 HydrophobicContact CD2-CD1 3.83Å; L105-F109 HydrophobicContact CD2-CE1 4.4Å; L105-F109 HydrophobicContact CD2-CG 4.16Å; L105-F109 HydrophobicContact CG-CD1 3.89Å; L105-F109 HydrophobicContact CG-CE1 3.97Å; L105-L276 HydrophobicContact CD2-CB 3.76Å; L105-K277 WeakPolarHBondContact CD2-O 3.41Å; L105-S278 WeakPolarHBondContact O-CA 3.39Å; L105-S278 WeakPolarHBondContact O-CB 3.23Å; L105-G279 PolarHBondContact N-O 3.06Å; L105-G279 PolarHBondContact O-N 3.05Å; L105-Y281 HydrophobicContact CB-CD2 3.9Å; L105-Y281 HydrophobicContact CB-CE2 3.82Å; L105-Y281 HydrophobicContact CD2-CE2 4.11Å
106	P	94.9	Very high	94.8	Very high	100 Å²	100	45.6 Å²	45.6	65%	0.649	27%	0.267	S	S	*	.			trans	-72.5	-24.2	-167.7	28	-35.8	0	0	0	113.8	V104	V104-P106 WeakPolarHBondContact O-CD 3.36Å
107	S	94.4	Very high	95.2	Very high	46 Å²	46	42.5 Å²	42.5	32%	0.322	25%	0.247	S	C	.	.	S	Bend	trans	-146	163.1	-178.2	62.8	0	0	0	0	109.7	L105 F109	L105-S107 VanDerWaalsContact C-N 3.32Å; L105-S107 WeakPolarHBondContact CG-O 3.39Å; L105-S107 PolarHBondContact O-N 3.42Å; S107-F109 WeakPolarHBondContact O-CD1 3.33Å; S107-F109 PolarHBondContact O-N 3.49Å
108	D	94.8	Very high	95.4	Very high	45 Å²	45	42.5 Å²	42.5	24%	0.241	25%	0.247	C	C	.	.			trans	-64.9	131.5	174.3	-70	6.8	0	0	0	110.7	N67 N110 K277 S278	N67-D108 PolarHBondContact ND2-O 3.24Å; D108-N110 PolarHBondContact O-N 3.49Å; D108-K277 HydrophobicContact CB-CD 4.47Å; D108-K277 WeakPolarHBondContact OD2-CD 3.35Å; D108-K277 IonicContact OD2-NZ 2.65Å; D108-K277 PolarHBondContact OD2-NZ 2.96Å; D108-S278 WeakPolarHBondContact OD1-CB 3.42Å; D108-S278 PolarHBondContact OD1-N 3.03Å; D108-S278 PolarHBondContact OD1-OG 3.39Å
109	F	95.1	Very high	95.5	Very high	2 Å²	2	39.7 Å²	39.7	1%	0.009	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	86.2	172.8	-83.4	42.8	0	0	0	107.4	N67 L69 L105 S107 V113 G275 L276 L302 T304	N67-F109 HydrophobicContact CB-CD1 3.81Å; N67-F109 HydrophobicContact CB-CD2 4.33Å; N67-F109 HydrophobicContact CB-CE1 3.59Å; N67-F109 HydrophobicContact CB-CE2 4.12Å; N67-F109 HydrophobicContact CB-CG 4.18Å; N67-F109 HydrophobicContact CB-CZ 3.75Å; L69-F109 HydrophobicContact CB-CE2 4.44Å; L69-F109 HydrophobicContact CB-CZ 3.88Å; L105-F109 HydrophobicContact CD1-CD1 3.68Å; L105-F109 HydrophobicContact CD1-CD2 4.46Å; L105-F109 HydrophobicContact CD1-CE1 3.42Å; L105-F109 VanDerWaalsContact CD1-CE1 3.42Å; L105-F109 HydrophobicContact CD1-CE2 4.24Å; L105-F109 HydrophobicContact CD1-CG 4.21Å; L105-F109 HydrophobicContact CD1-CZ 3.73Å; L105-F109 HydrophobicContact CD2-CB 4.35Å; L105-F109 HydrophobicContact CD2-CD1 3.83Å; L105-F109 HydrophobicContact CD2-CE1 4.4Å; L105-F109 HydrophobicContact CD2-CG 4.16Å; L105-F109 HydrophobicContact CG-CD1 3.89Å; L105-F109 HydrophobicContact CG-CE1 3.97Å; S107-F109 WeakPolarHBondContact O-CD1 3.33Å; S107-F109 PolarHBondContact O-N 3.49Å; F109-V113 HydrophobicContact CB-CG2 3.89Å; F109-V113 HydrophobicContact CD2-CG1 4.31Å; F109-G275 CarbonylContact O-C 3.52Å; F109-G275 VanDerWaalsContact O-CA 3.28Å; F109-G275 WeakPolarHBondContact O-CA 3.19Å; F109-L276 HydrophobicContact CB-CB 4.25Å; F109-L276 PolarHBondContact N-O 2.8Å; F109-L276 PolarHBondContact O-N 2.75Å; F109-L302 HydrophobicContact CD2-CB 4.45Å; F109-L302 HydrophobicContact CE2-CB 4Å; F109-T304 HydrophobicContact CB-CG2 3.76Å; F109-T304 HydrophobicContact CD2-CG2 3.92Å; F109-T304 HydrophobicContact CG-CG2 4.07Å
110	N	92	Very high	95.6	Very high	99 Å²	99	40.8 Å²	40.8	53%	0.529	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	144.3	-176.2	-64.1	-41.3	0	0	0	112.1	D108 N274 T304	D108-N110 PolarHBondContact O-N 3.49Å; N110-N274 WeakPolarHBondContact CA-O 3.49Å; N110-T304 WeakPolarHBondContact O-CG2 3.5Å
111	G	89.8	Confident	95.7	Very high	32 Å²	32	38.2 Å²	38.2	33%	0.33	23%	0.225	S	C	.	.	S	Bend	trans	83.4	-149.7	177.3	0	0	0	0	0	113.1	V113 Q267 N274 G275	G111-V113 PolarHBondContact O-N 3.1Å; G111-Q267 PolarHBondContact O-NE2 3.02Å; G111-N274 PolarHBondContact N-O 3.44Å; G111-G275 WeakPolarHBondContact O-CA 3.46Å
112	V	89.6	Confident	95.8	Very high	49 Å²	49	38 Å²	38	30%	0.297	22%	0.221	S	C	.	.			trans	-75	119.2	-177	-164.9	0	0	0	0	109.7	Y114	V112-Y114 HydrophobicContact CB-CE2 4Å; V112-Y114 HydrophobicContact CG1-CD2 4.35Å; V112-Y114 HydrophobicContact CG1-CE1 4.18Å; V112-Y114 HydrophobicContact CG1-CE2 3.65Å
113	V	94.4	Very high	95.8	Very high	3 Å²	3	39.4 Å²	39.4	2%	0.018	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	130.8	176.3	-174.1	0	0	0	0	109.9	F109 G111 L265 L276 L302 T304	F109-V113 HydrophobicContact CB-CG2 3.89Å; F109-V113 HydrophobicContact CD2-CG1 4.31Å; G111-V113 PolarHBondContact O-N 3.1Å; V113-L265 HydrophobicContact CB-CB 4.05Å; V113-L265 HydrophobicContact CB-CD2 4.02Å; V113-L265 HydrophobicContact CG2-CD2 4Å; V113-L265 WeakPolarHBondContact O-CB 3.26Å; V113-L265 PolarHBondContact O-N 3.47Å; V113-L276 HydrophobicContact CG1-CD1 4.03Å; V113-L276 HydrophobicContact CG2-CG 4.24Å; V113-L302 HydrophobicContact CG1-CD2 4.34Å; V113-T304 HydrophobicContact CG2-CG2 4.21Å
114	Y	96.3	Very high	95.8	Very high	54 Å²	54	38.4 Å²	38.4	21%	0.212	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	140.7	176.3	-63.4	-83.2	0	0	0	110.2	V112 Y116 L261 R264 L302 S303 T305	V112-Y114 HydrophobicContact CB-CE2 4Å; V112-Y114 HydrophobicContact CG1-CD2 4.35Å; V112-Y114 HydrophobicContact CG1-CE1 4.18Å; V112-Y114 HydrophobicContact CG1-CE2 3.65Å; Y114-Y116 VanDerWaalsContact CB-CE2 3.42Å; Y114-Y116 HydrophobicContact CG-CE2 4.48Å; Y114-L261 HydrophobicContact CD1-CD1 3.71Å; Y114-L261 HydrophobicContact CD1-CD2 4.17Å; Y114-L261 HydrophobicContact CG-CD1 4.15Å; Y114-R264 HydrophobicContact CD1-CB 3.95Å; Y114-R264 HydrophobicContact CE1-CB 4.09Å; Y114-L302 WeakPolarHBondContact O-CA 3.12Å; Y114-S303 PolarHBondContact N-O 3.37Å; Y114-S303 PolarHBondContact O-N 2.83Å; Y114-T305 HydrophobicContact CD2-CG2 3.69Å; Y114-T305 HydrophobicContact CE2-CG2 3.38Å
115	M	97.7	Very high	95.8	Very high	2 Å²	2	37.4 Å²	37.4	1%	0.01	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	124.2	173.7	-174.3	-175.7	-168.7	0	0	108.6	L178 L189 Y262 R263 L283 M300 I301 L302	M115-L178 HydrophobicContact CE-CB 3.35Å; M115-L178 HydrophobicContact CE-CD1 3.93Å; M115-L178 HydrophobicContact CE-CG 4.28Å; M115-L189 HydrophobicContact SD-CD1 3.57Å; M115-L189 VanDerWaalsContact SD-CD1 3.57Å; M115-Y262 HydrophobicContact CE-CD1 4.37Å; M115-Y262 HydrophobicContact CG-CD1 4.38Å; M115-Y262 WeakPolarHBondContact O-CA 3.5Å; M115-Y262 WeakPolarHBondContact O-CB 3.21Å; M115-Y262 PolarHBondContact O-N 3.07Å; M115-Y262 HydrophobicContact SD-CD1 3.85Å; M115-Y262 HydrophobicContact SD-CE1 4.38Å; M115-R263 HydrophobicContact CB-CB 4.27Å; M115-R263 PolarHBondContact N-O 2.93Å; M115-R263 PolarHBondContact O-N 2.72Å; M115-L283 HydrophobicContact CE-CD1 3.74Å; M115-M300 HydrophobicContact CE-CG 3.36Å; M115-M300 HydrophobicContact CE-SD 3.96Å; M115-M300 HydrophobicContact CG-CG 4.23Å; M115-M300 HydrophobicContact CG-SD 4.15Å; M115-I301 CarbonylContact C-O 3.39Å; M115-I301 WeakPolarHBondContact CA-O 3.47Å; M115-L302 HydrophobicContact CB-CD2 3.95Å; M115-L302 HydrophobicContact CG-CD2 4.06Å
116	Y	98.3	Very high	95.9	Very high	43 Å²	43	42.3 Å²	42.3	17%	0.169	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	149.7	174.9	-54.6	-102.6	0	0	0	109.5	Y114 R259 K260 L261 I301	Y114-Y116 VanDerWaalsContact CB-CE2 3.42Å; Y114-Y116 HydrophobicContact CG-CE2 4.48Å; Y116-R259 HydrophobicContact CD1-CG 4.21Å; Y116-K260 WeakPolarHBondContact CA-O 3.25Å; Y116-K260 VanDerWaalsContact CB-O 3.29Å; Y116-K260 WeakPolarHBondContact CB-O 3.48Å; Y116-L261 VanDerWaalsContact CD1-CA 3.45Å; Y116-L261 HydrophobicContact CD1-CB 3.97Å; Y116-L261 HydrophobicContact CD1-CD1 4.09Å; Y116-L261 HydrophobicContact CE1-CB 3.78Å; Y116-L261 HydrophobicContact CE1-CD1 3.72Å; Y116-L261 HydrophobicContact CE1-CG 4.3Å; Y116-L261 HydrophobicContact CE2-CD1 4.26Å; Y116-L261 HydrophobicContact CG-CD1 4.48Å; Y116-I301 PolarHBondContact N-O 2.91Å; Y116-I301 PolarHBondContact O-N 2.59Å
117	Y	98.4	Very high	96	Very high	5 Å²	5	47.8 Å²	47.8	2%	0.02	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	146.3	156.6	61.1	-96.9	0	0	0	108.8	F174 W249 R259 K260 Y262 R299	Y117-F174 AromaticContact CD1-CD1 3.8Å; Y117-F174 HydrophobicContact CD1-CD1 3.8Å; Y117-F174 AromaticContact CD1-CE1 3.73Å; Y117-F174 HydrophobicContact CD1-CE1 3.73Å; Y117-F174 HydrophobicContact CD1-CZ 4.45Å; Y117-F174 HydrophobicContact CD2-CD1 4.09Å; Y117-F174 HydrophobicContact CD2-CD2 4.24Å; Y117-F174 HydrophobicContact CD2-CE1 4.17Å; Y117-F174 HydrophobicContact CD2-CE2 4.32Å; Y117-F174 HydrophobicContact CD2-CG 4.1Å; Y117-F174 HydrophobicContact CD2-CZ 4.26Å; Y117-F174 AromaticContact CE1-CD1 3.79Å; Y117-F174 HydrophobicContact CE1-CD1 3.79Å; Y117-F174 HydrophobicContact CE1-CE1 4.2Å; Y117-F174 HydrophobicContact CE1-CG 4.42Å; Y117-F174 HydrophobicContact CE2-CB 4.07Å; Y117-F174 HydrophobicContact CE2-CD1 4.02Å; Y117-F174 HydrophobicContact CE2-CD2 4.32Å; Y117-F174 AromaticContact CE2-CG 3.86Å; Y117-F174 HydrophobicContact CE2-CG 3.86Å; Y117-F174 AromaticContact CG-CD1 3.99Å; Y117-F174 HydrophobicContact CG-CD1 3.99Å; Y117-F174 AromaticContact CG-CE1 3.75Å; Y117-F174 HydrophobicContact CG-CE1 3.75Å; Y117-F174 HydrophobicContact CG-CG 4.46Å; Y117-F174 HydrophobicContact CG-CZ 4.02Å; Y117-F174 AromaticContact CZ-CD1 3.89Å; Y117-W249 HydrophobicContact CE2-CE3 4.29Å; Y117-W249 HydrophobicContact CE2-CZ3 4.16Å; Y117-R259 CarbonylContact O-C 3.57Å; Y117-R259 VanDerWaalsContact O-CA 3.23Å; Y117-R259 WeakPolarHBondContact O-CA 3.48Å; Y117-K260 HydrophobicContact CD2-CB 4.26Å; Y117-K260 HydrophobicContact CE1-CB 3.99Å; Y117-K260 HydrophobicContact CE2-CB 3.58Å; Y117-K260 HydrophobicContact CE2-CD 3.81Å; Y117-K260 HydrophobicContact CE2-CG 4.2Å; Y117-K260 VanDerWaalsContact CZ-CB 3.4Å; Y117-K260 PolarHBondContact N-O 3.39Å; Y117-K260 VanDerWaalsContact N-O 3.08Å; Y117-K260 PolarHBondContact O-N 3.22Å; Y117-K260 WeakPolarHBondContact OH-CB 3.38Å; Y117-K260 WeakPolarHBondContact OH-CD 3.43Å; Y117-Y262 AromaticContact CD1-CD2 3.76Å; Y117-Y262 HydrophobicContact CD1-CD2 3.76Å; Y117-Y262 AromaticContact CD1-CG 3.91Å; Y117-Y262 HydrophobicContact CD1-CG 3.91Å; Y117-Y262 AromaticContact CE1-CD2 3.9Å; Y117-Y262 HydrophobicContact CE1-CD2 3.9Å; Y117-Y262 HydrophobicContact CE1-CG 4.4Å; Y117-R299 CarbonylContact C-O 3.59Å; Y117-R299 WeakPolarHBondContact CA-O 3.45Å
118	G	98.2	Very high	96.1	Very high	0 Å²	0	55.5 Å²	55.5	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	139.3	175.1	0	0	0	0	0	110.9	F258 K298 R299	G118-F258 WeakPolarHBondContact CA-O 3.26Å; G118-K298 WeakPolarHBondContact O-CA 3.49Å; G118-R299 PolarHBondContact N-O 2.96Å; G118-R299 PolarHBondContact O-N 2.9Å
119	L	98.2	Very high	96.2	Very high	2 Å²	2	54.8 Å²	54.8	1%	0.01	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	143.7	173.1	-62.9	178.6	0	0	0	108.5	Y122 F174 W249 S257 F258 Y289 V291 T297 K298	L119-Y122 HydrophobicContact CD1-CD2 4.38Å; L119-Y122 HydrophobicContact CD1-CG 4.39Å; L119-F174 HydrophobicContact CD1-CD2 4.42Å; L119-F174 HydrophobicContact CD2-CE2 4.34Å; L119-W249 HydrophobicContact CD1-CH2 3.95Å; L119-W249 HydrophobicContact CD1-CZ3 3.96Å; L119-S257 WeakPolarHBondContact O-CA 3.45Å; L119-F258 HydrophobicContact CB-CE1 4.24Å; L119-F258 HydrophobicContact CB-CE2 4.22Å; L119-F258 HydrophobicContact CB-CZ 3.91Å; L119-F258 HydrophobicContact CD1-CE2 4.23Å; L119-F258 HydrophobicContact CD1-CZ 3.86Å; L119-F258 HydrophobicContact CG-CE2 4.44Å; L119-F258 HydrophobicContact CG-CZ 4.32Å; L119-F258 PolarHBondContact N-O 3.12Å; L119-F258 VanDerWaalsContact N-O 3.08Å; L119-F258 PolarHBondContact O-N 3.4Å; L119-Y289 HydrophobicContact CD1-CE1 4.15Å; L119-V291 HydrophobicContact CD2-CG1 4.39Å; L119-T297 WeakPolarHBondContact CA-O 3.46Å; L119-K298 HydrophobicContact CD2-CB 4.48Å; L119-K298 HydrophobicContact CD2-CD 4.23Å; L119-K298 HydrophobicContact CD2-CG 3.72Å
120	T	97.8	Very high	96.3	Very high	23 Å²	23	57 Å²	57	14%	0.141	26%	0.262	C	S	.	.	S	Bend	trans	-119.1	160.5	170.8	69.6	0	0	0	0	109.8	Y122 P256 G296 T297	T120-Y122 PolarHBondContact O-N 3.4Å; T120-Y122 VanDerWaalsContact O-N 3.14Å; T120-P256 CarbonylContact C-O 3.51Å; T120-G296 WeakPolarHBondContact O-CA 3.45Å; T120-T297 VanDerWaalsContact CG2-OG1 3.31Å; T120-T297 WeakPolarHBondContact CG2-OG1 3.45Å; T120-T297 PolarHBondContact N-O 2.04Å; T120-T297 VanDerWaalsContact N-O 3.08Å; T120-T297 WeakPolarHBondContact OG1-CB 3.4Å; T120-T297 PolarHBondContact OG1-N 2.76Å; T120-T297 PolarHBondContact OG1-OG1 3.23Å
121	N	97.3	Very high	96.5	Very high	56 Å²	56	57.6 Å²	57.6	30%	0.299	26%	0.26	S	S	.	.	S	Bend	trans	52.8	31.3	-176	-148.9	23.6	0	0	0	114.3	Y123 P256 F294	N121-Y123 WeakPolarHBondContact OD1-CE2 3.26Å; N121-Y123 PolarHBondContact OD1-OH 3.02Å; N121-P256 PolarHBondContact N-O 2.98Å; N121-F294 PolarHBondContact ND2-O 3.22Å; N121-F294 WeakPolarHBondContact O-CD2 3.39Å
122	Y	97.6	Very high	96.9	Very high	24 Å²	24	56.2 Å²	56.2	9%	0.094	25%	0.245	C	C	.	.			trans	-117.5	104	-177.9	-167	-74.5	0	0	0	110.6	L119 T120 Q124 Y129 S172 W249 P256 F258 Y289 F294	L119-Y122 HydrophobicContact CD1-CD2 4.38Å; L119-Y122 HydrophobicContact CD1-CG 4.39Å; T120-Y122 PolarHBondContact O-N 3.4Å; T120-Y122 VanDerWaalsContact O-N 3.14Å; Y122-Q124 HydrophobicContact CD1-CG 3.54Å; Y122-Q124 HydrophobicContact CE1-CG 3.54Å; Y122-Q124 PolarHBondContact O-N 3.41Å; Y122-Y129 HydrophobicContact CE1-CE2 4.31Å; Y122-Y129 AromaticContact CE1-CZ 3.98Å; Y122-Y129 PolarHBondContact OH-OH 2.95Å; Y122-S172 WeakPolarHBondContact OH-CB 3.43Å; Y122-S172 PolarHBondContact OH-OG 2.96Å; Y122-W249 HydrophobicContact CE1-CH2 4.06Å; Y122-W249 HydrophobicContact CE1-CZ2 4.16Å; Y122-P256 PolarHBondContact N-O 3.01Å; Y122-P256 VanDerWaalsContact O-CA 3.3Å; Y122-P256 WeakPolarHBondContact O-CA 3.48Å; Y122-F258 AromaticContact CD1-CE1 3.78Å; Y122-F258 HydrophobicContact CD1-CE1 3.78Å; Y122-F258 AromaticContact CD1-CZ 3.93Å; Y122-F258 HydrophobicContact CD1-CZ 3.93Å; Y122-F258 HydrophobicContact CG-CE1 4.16Å; Y122-F258 HydrophobicContact CG-CZ 4.34Å; Y122-Y289 HydrophobicContact CE2-CE1 4.31Å; Y122-Y289 WeakPolarHBondContact CE2-OH 3.44Å; Y122-Y289 PolarHBondContact OH-OH 3.08Å; Y122-F294 AromaticContact CD2-CE2 3.95Å; Y122-F294 HydrophobicContact CD2-CE2 3.95Å; Y122-F294 AromaticContact CD2-CZ 3.75Å; Y122-F294 HydrophobicContact CD2-CZ 3.75Å; Y122-F294 HydrophobicContact CE2-CZ 4.27Å
123	Y	97.1	Very high	97.3	Very high	130 Å²	130	57.8 Å²	57.8	51%	0.51	25%	0.246	S	C	.	.			trans	-83.5	67.9	-169.8	-64.9	-90.6	0	0	0	113.8	N121 N125 H126 P256	N121-Y123 WeakPolarHBondContact OD1-CE2 3.26Å; N121-Y123 PolarHBondContact OD1-OH 3.02Å; Y123-N125 PolarHBondContact O-N 3.25Å; Y123-N125 VanDerWaalsContact O-N 3.16Å; Y123-H126 WeakPolarHBondContact O-CB 3.06Å; Y123-H126 PolarHBondContact O-N 3.46Å; Y123-H126 VanDerWaalsContact O-N 3.14Å; Y123-P256 HydrophobicContact CD1-CB 3.77Å; Y123-P256 HydrophobicContact CD1-CG 4.39Å; Y123-P256 HydrophobicContact CE1-CB 3.72Å; Y123-P256 HydrophobicContact CE1-CG 4.03Å; Y123-P256 HydrophobicContact CG-CB 4.21Å
124	Q	97.5	Very high	97.5	Very high	0 Å²	0	58.5 Å²	58.5	0%	0	25%	0.25	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.7	-23.8	172.7	-71.3	-159.1	-21	0	0	113.2	Y122 H126 Y129 V130 W249 A253 F258 K260	Y122-Q124 HydrophobicContact CD1-CG 3.54Å; Y122-Q124 HydrophobicContact CE1-CG 3.54Å; Y122-Q124 PolarHBondContact O-N 3.41Å; Q124-H126 VanDerWaalsContact C-N 3.3Å; Q124-Y129 HydrophobicContact CB-CD1 4.36Å; Q124-Y129 HydrophobicContact CB-CE1 4.05Å; Q124-Y129 HydrophobicContact CG-CE1 3.91Å; Q124-Y129 VanDerWaalsContact O-CD1 3.28Å; Q124-Y129 WeakPolarHBondContact O-CD1 3.31Å; Q124-V130 WeakPolarHBondContact O-CG2 3.49Å; Q124-W249 VanDerWaalsContact NE2-CH2 3.32Å; Q124-A253 HydrophobicContact CB-CB 4.4Å; Q124-F258 HydrophobicContact CG-CE1 3.73Å; Q124-F258 HydrophobicContact CG-CZ 3.85Å; Q124-K260 VanDerWaalsContact NE2-CE 3.34Å; Q124-K260 VanDerWaalsContact OE1-CE 3.28Å
125	N	96.9	Very high	97.5	Very high	69 Å²	69	59.6 Å²	59.6	37%	0.369	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.1	-1	-179.6	64.3	-12.8	0	0	0	113.8	Y123 R127 A254	Y123-N125 PolarHBondContact O-N 3.25Å; Y123-N125 VanDerWaalsContact O-N 3.16Å; N125-R127 PolarHBondContact O-N 3.14Å; N125-A254 PolarHBondContact ND2-O 2.81Å
126	H	97.6	Very high	97.4	Very high	105 Å²	105	64.5 Å²	64.5	49%	0.486	28%	0.282	S	S	.	.			trans	-63.1	130.2	176.9	-175.5	-96.2	0	0	0	110.5	Y123 Q124 R128 Y129 V130	Y123-H126 WeakPolarHBondContact O-CB 3.06Å; Y123-H126 PolarHBondContact O-N 3.46Å; Y123-H126 VanDerWaalsContact O-N 3.14Å; Q124-H126 VanDerWaalsContact C-N 3.3Å; H126-R128 VanDerWaalsContact C-N 3.3Å; H126-R128 PolarHBondContact ND1-N 2.67Å; H126-R128 PolarHBondContact O-N 3.29Å; H126-R128 VanDerWaalsContact O-N 3.14Å; H126-Y129 WeakPolarHBondContact O-CA 3.21Å; H126-Y129 WeakPolarHBondContact O-CB 3.41Å; H126-Y129 PolarHBondContact O-N 2.94Å; H126-V130 PolarHBondContact O-N 2.93Å
127	R	96.6	Very high	97.4	Very high	215 Å²	215	62.7 Å²	62.7	81%	0.811	28%	0.275	S	S	*	.	H	α-helix	trans	-50.4	-45.4	-172.4	-179.2	-177.8	173.2	-152.6	-0.8	113.6	N125 Y129 K131	N125-R127 PolarHBondContact O-N 3.14Å; R127-Y129 VanDerWaalsContact C-N 3.32Å; R127-K131 VanDerWaalsContact O-CB 3.31Å; R127-K131 WeakPolarHBondContact O-CB 3.38Å; R127-K131 PolarHBondContact O-N 3.35Å; R127-K131 VanDerWaalsContact O-N 3.13Å
128	R	96.3	Very high	97.3	Very high	208 Å²	208	62.8 Å²	62.8	79%	0.785	28%	0.276	S	S	*	.	H	α-helix	trans	-68.6	-31.4	179.1	-67.3	-173	177.9	179	-0.9	112.6	H126 S132	H126-R128 VanDerWaalsContact C-N 3.3Å; H126-R128 PolarHBondContact ND1-N 2.67Å; H126-R128 PolarHBondContact O-N 3.29Å; H126-R128 VanDerWaalsContact O-N 3.14Å; R128-S132 VanDerWaalsContact O-CB 3.27Å; R128-S132 WeakPolarHBondContact O-CB 3.45Å; R128-S132 PolarHBondContact O-N 3.45Å
129	Y	97.4	Very high	97.2	Very high	29 Å²	29	65.5 Å²	65.5	11%	0.114	29%	0.29	C	S	.	.	H	α-helix	trans	-72.4	-51.2	177.8	-174.1	-85.9	0	0	0	110.3	Y122 Q124 H126 R127 K131 S132 A168 I169 S172 W249 T252	Y122-Y129 HydrophobicContact CE1-CE2 4.31Å; Y122-Y129 AromaticContact CE1-CZ 3.98Å; Y122-Y129 PolarHBondContact OH-OH 2.95Å; Q124-Y129 HydrophobicContact CB-CD1 4.36Å; Q124-Y129 HydrophobicContact CB-CE1 4.05Å; Q124-Y129 HydrophobicContact CG-CE1 3.91Å; Q124-Y129 VanDerWaalsContact O-CD1 3.28Å; Q124-Y129 WeakPolarHBondContact O-CD1 3.31Å; H126-Y129 WeakPolarHBondContact O-CA 3.21Å; H126-Y129 WeakPolarHBondContact O-CB 3.41Å; H126-Y129 PolarHBondContact O-N 2.94Å; R127-Y129 VanDerWaalsContact C-N 3.32Å; Y129-K131 VanDerWaalsContact C-N 3.26Å; Y129-K131 PolarHBondContact O-N 3.38Å; Y129-S132 PolarHBondContact O-N 2.92Å; Y129-A168 HydrophobicContact CD2-CB 4.09Å; Y129-A168 HydrophobicContact CE2-CB 4.44Å; Y129-I169 HydrophobicContact CD1-CG1 3.91Å; Y129-I169 HydrophobicContact CE1-CB 4.19Å; Y129-I169 HydrophobicContact CE1-CG1 3.75Å; Y129-I169 HydrophobicContact CE1-CG2 4.12Å; Y129-I169 WeakPolarHBondContact O-CD1 3.28Å; Y129-I169 WeakPolarHBondContact O-CG1 3.22Å; Y129-S172 WeakPolarHBondContact CE2-OG 3.18Å; Y129-S172 PolarHBondContact OH-OG 3.44Å; Y129-W249 WeakPolarHBondContact OH-CZ2 3.44Å; Y129-T252 HydrophobicContact CD1-CG2 4.5Å; Y129-T252 HydrophobicContact CE1-CG2 4.41Å
130	V	97.4	Very high	97.1	Very high	50 Å²	50	65.8 Å²	65.8	30%	0.303	29%	0.294	S	S	.	.	H	α-helix	trans	-58.1	-38.7	179.3	178.8	0	0	0	0	112.3	Q124 H126 S132 T252	Q124-V130 WeakPolarHBondContact O-CG2 3.49Å; H126-V130 PolarHBondContact O-N 2.93Å; V130-S132 VanDerWaalsContact C-N 3.31Å; V130-T252 HydrophobicContact CG2-CG2 4.3Å
131	K	97	Very high	97	Very high	111 Å²	111	70.4 Å²	70.4	48%	0.483	31%	0.313	S	S	.	.	H	α-helix	trans	-71.7	-25	179.3	-169.8	176.5	-172.3	-136.2	0	112.6	R127 Y129 R133 D149	R127-K131 VanDerWaalsContact O-CB 3.31Å; R127-K131 WeakPolarHBondContact O-CB 3.38Å; R127-K131 PolarHBondContact O-N 3.35Å; R127-K131 VanDerWaalsContact O-N 3.13Å; Y129-K131 VanDerWaalsContact C-N 3.26Å; Y129-K131 PolarHBondContact O-N 3.38Å; K131-R133 PolarHBondContact O-N 2.93Å; K131-D149 WeakPolarHBondContact CE-OD1 3.4Å; K131-D149 WeakPolarHBondContact CE-OD2 3.23Å; K131-D149 HydrophobicContact CG-CB 4.11Å; K131-D149 IonicContact NZ-OD1 3.67Å; K131-D149 PolarHBondContact NZ-OD1 3.27Å; K131-D149 IonicContact NZ-OD2 2.81Å; K131-D149 WeakPolarHBondContact O-CB 3.49Å
132	S	97.9	Very high	96.8	Very high	3 Å²	3	69.9 Å²	69.9	2%	0.021	31%	0.31	C	S	.	.			trans	-82.8	79.5	-167.6	-167.2	0	0	0	0	113.4	R128 Y129 V130 D149 C150 G167 A168	R128-S132 VanDerWaalsContact O-CB 3.27Å; R128-S132 WeakPolarHBondContact O-CB 3.45Å; R128-S132 PolarHBondContact O-N 3.45Å; Y129-S132 PolarHBondContact O-N 2.92Å; V130-S132 VanDerWaalsContact C-N 3.31Å; S132-D149 VanDerWaalsContact CA-O 3.25Å; S132-D149 WeakPolarHBondContact CA-O 3.37Å; S132-D149 PolarHBondContact OG-O 3.5Å; S132-C150 PolarHBondContact OG-O 2.91Å; S132-G167 CarbonylContact O-C 3.58Å; S132-G167 VanDerWaalsContact O-CA 3.31Å; S132-G167 WeakPolarHBondContact O-CA 3.31Å; S132-G167 WeakPolarHBondContact OG-CA 3.44Å; S132-A168 PolarHBondContact O-N 2.91Å; S132-A168 PolarHBondContact OG-N 3.45Å
133	R	97.3	Very high	96.7	Very high	81 Å²	81	71.1 Å²	71.1	31%	0.306	32%	0.323	S	S	.	.	S	Bend	trans	-162.9	167.2	175.1	66.9	-173.5	-158.6	-155	-2.1	110.4	K131 D135 I169 M250	K131-R133 PolarHBondContact O-N 2.93Å; R133-D135 WeakPolarHBondContact CD-OD1 3.26Å; R133-D135 IonicContact CZ-OD1 3.7Å; R133-D135 IonicContact CZ-OD2 2.62Å; R133-D135 IonicContact NE-OD1 3.5Å; R133-D135 PolarHBondContact NE-OD1 3.38Å; R133-D135 IonicContact NE-OD2 3.37Å; R133-D135 IonicContact NH2-OD1 3Å; R133-D135 PolarHBondContact NH2-OD1 3.49Å; R133-D135 IonicContact NH2-OD2 2.72Å; R133-D135 PolarHBondContact NH2-OD2 2.99Å; R133-I169 HydrophobicContact CB-CD1 4.3Å; R133-I169 HydrophobicContact CG-CD1 4.44Å; R133-M250 HydrophobicContact CB-CE 4.03Å
134	D	97.9	Very high	96.5	Very high	19 Å²	19	70 Å²	70	10%	0.102	32%	0.322	C	S	.	.			trans	-122.5	108.8	173.3	-173.7	-26	0	0	0	109.7	E136 Q137 L138 P146 S147 C150 C166	D134-E136 VanDerWaalsContact C-N 3.34Å; D134-E136 PolarHBondContact O-N 3.43Å; D134-E136 PolarHBondContact OD1-N 3Å; D134-Q137 HydrophobicContact CB-CB 3.85Å; D134-Q137 PolarHBondContact O-N 3.08Å; D134-Q137 PolarHBondContact OD1-N 3.34Å; D134-L138 WeakPolarHBondContact O-CG 3.4Å; D134-L138 PolarHBondContact O-N 2.97Å; D134-L138 VanDerWaalsContact O-N 3.17Å; D134-P146 WeakPolarHBondContact OD2-CA 3.3Å; D134-S147 PolarHBondContact OD2-N 3.26Å; D134-C150 PolarHBondContact N-SG 2.79Å; D134-C166 WeakPolarHBondContact CB-SG 3.3Å
135	D	96.8	Very high	96.4	Very high	77 Å²	77	74.9 Å²	74.9	41%	0.412	35%	0.352	S	S	.	.	H	α-helix	trans	-71.9	-26.6	-175.1	-72.6	-19.7	0	0	0	112.3	R133 L138 L139	R133-D135 WeakPolarHBondContact CD-OD1 3.26Å; R133-D135 IonicContact CZ-OD1 3.7Å; R133-D135 IonicContact CZ-OD2 2.62Å; R133-D135 IonicContact NE-OD1 3.5Å; R133-D135 PolarHBondContact NE-OD1 3.38Å; R133-D135 IonicContact NE-OD2 3.37Å; R133-D135 IonicContact NH2-OD1 3Å; R133-D135 PolarHBondContact NH2-OD1 3.49Å; R133-D135 IonicContact NH2-OD2 2.72Å; R133-D135 PolarHBondContact NH2-OD2 2.99Å; D135-L138 PolarHBondContact O-N 3.3Å; D135-L139 WeakPolarHBondContact O-CG 3.03Å; D135-L139 PolarHBondContact O-N 3.37Å; D135-L139 VanDerWaalsContact O-N 3.16Å
136	E	97.1	Very high	96.2	Very high	105 Å²	105	72.3 Å²	72.3	49%	0.491	34%	0.339	S	S	.	.	H	α-helix	trans	-69.9	-40.3	173.8	-70.5	-60.5	137.9	0	0	110.7	D134 L138 L139 G140 H141	D134-E136 VanDerWaalsContact C-N 3.34Å; D134-E136 PolarHBondContact O-N 3.43Å; D134-E136 PolarHBondContact OD1-N 3Å; E136-L138 VanDerWaalsContact C-N 3.32Å; E136-L138 PolarHBondContact O-N 2.84Å; E136-L139 CarbonylContact O-C 3.6Å; E136-L139 WeakPolarHBondContact O-CB 3.07Å; E136-L139 PolarHBondContact O-N 3.05Å; E136-L139 VanDerWaalsContact O-N 3.11Å; E136-G140 PolarHBondContact O-N 2.04Å; E136-H141 HydrophobicContact CB-CB 4.33Å; E136-H141 WeakPolarHBondContact O-CB 3.13Å; E136-H141 PolarHBondContact O-N 2.68Å; E136-H141 IonicContact OE2-CE1 3.75Å; E136-H141 IonicContact OE2-CG 3.77Å; E136-H141 IonicContact OE2-ND1 3.4Å; E136-H141 PolarHBondContact OE2-ND1 2.7Å
137	Q	96.3	Very high	96.1	Very high	4 Å²	4	69 Å²	69	2%	0.019	33%	0.328	C	S	.	.	H	α-helix	trans	-61.7	-41.3	174.7	-166.8	-175.5	51.1	0	0	111.8	D134 L139 G140 L142 I163 A164 P165 F241	D134-Q137 HydrophobicContact CB-CB 3.85Å; D134-Q137 PolarHBondContact O-N 3.08Å; D134-Q137 PolarHBondContact OD1-N 3.34Å; Q137-L139 PolarHBondContact O-N 3.3Å; Q137-G140 PolarHBondContact O-N 3.14Å; Q137-L142 HydrophobicContact CG-CD2 3.65Å; Q137-I163 PolarHBondContact NE2-O 2.95Å; Q137-A164 VanDerWaalsContact NE2-CA 3.35Å; Q137-P165 VanDerWaalsContact OE1-CA 3.3Å; Q137-F241 HydrophobicContact CG-CE1 4.17Å; Q137-F241 HydrophobicContact CG-CZ 3.88Å
138	L	97	Very high	96.1	Very high	8 Å²	8	64.6 Å²	64.6	4%	0.042	33%	0.325	C	S	.	.	H	α-helix	trans	-66.1	-25.9	176.7	-63.9	177.1	0	0	0	112.7	D134 D135 E136 G140 P165 F204 R205 F241 M250	D134-L138 WeakPolarHBondContact O-CG 3.4Å; D134-L138 PolarHBondContact O-N 2.97Å; D134-L138 VanDerWaalsContact O-N 3.17Å; D135-L138 PolarHBondContact O-N 3.3Å; E136-L138 VanDerWaalsContact C-N 3.32Å; E136-L138 PolarHBondContact O-N 2.84Å; L138-G140 PolarHBondContact O-N 2.8Å; L138-P165 HydrophobicContact CD2-CB 4.43Å; L138-F204 HydrophobicContact CB-CD1 4.21Å; L138-F204 HydrophobicContact CB-CE1 4.25Å; L138-F204 HydrophobicContact CD1-CE1 3.87Å; L138-F204 HydrophobicContact CD1-CZ 4.21Å; L138-F204 HydrophobicContact CD2-CD1 4.18Å; L138-F204 HydrophobicContact CD2-CE1 3.84Å; L138-F204 HydrophobicContact CG-CE1 4.19Å; L138-F204 CarbonylContact O-C 3.58Å; L138-F204 VanDerWaalsContact O-CA 3.28Å; L138-F204 WeakPolarHBondContact O-CA 3.38Å; L138-R205 PolarHBondContact O-N 2.77Å; L138-F241 HydrophobicContact CD2-CD1 3.94Å; L138-F241 HydrophobicContact CD2-CE1 4.25Å; L138-M250 HydrophobicContact CD1-CE 3.8Å; L138-M250 HydrophobicContact CD2-CE 4.23Å
139	L	96.8	Very high	96.1	Very high	57 Å²	57	57.1 Å²	57.1	30%	0.298	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.2	3	171.3	-69.5	170.1	0	0	0	113.4	D135 E136 Q137 H141 V202 R205	D135-L139 WeakPolarHBondContact O-CG 3.03Å; D135-L139 PolarHBondContact O-N 3.37Å; D135-L139 VanDerWaalsContact O-N 3.16Å; E136-L139 CarbonylContact O-C 3.6Å; E136-L139 WeakPolarHBondContact O-CB 3.07Å; E136-L139 PolarHBondContact O-N 3.05Å; E136-L139 VanDerWaalsContact O-N 3.11Å; Q137-L139 PolarHBondContact O-N 3.3Å; L139-H141 VanDerWaalsContact C-N 3.34Å; L139-V202 WeakPolarHBondContact CD2-O 3.38Å; L139-R205 WeakPolarHBondContact O-CB 3.43Å
140	G	95	Very high	96	Very high	8 Å²	8	55.7 Å²	55.7	8%	0.082	30%	0.295	C	S	.	.	T	Hydrogen-bonded Turn	trans	85.2	4.8	179.3	0	0	0	0	0	113.9	E136 Q137 L138 L142 R205 P207	E136-G140 PolarHBondContact O-N 2.04Å; Q137-G140 PolarHBondContact O-N 3.14Å; L138-G140 PolarHBondContact O-N 2.8Å; G140-L142 PolarHBondContact O-N 3.12Å; G140-R205 VanDerWaalsContact CA-O 3.31Å; G140-R205 WeakPolarHBondContact CA-O 3.2Å; G140-R205 PolarHBondContact N-O 2.65Å; G140-P207 WeakPolarHBondContact O-CB 3.45Å
141	H	95.6	Very high	95.9	Very high	119 Å²	119	56.3 Å²	56.3	55%	0.551	31%	0.305	S	S	*	.			trans	-85.7	89.4	174.1	-57.3	157.6	0	0	0	109.6	E136 L139	E136-H141 HydrophobicContact CB-CB 4.33Å; E136-H141 WeakPolarHBondContact O-CB 3.13Å; E136-H141 PolarHBondContact O-N 2.68Å; E136-H141 IonicContact OE2-CE1 3.75Å; E136-H141 IonicContact OE2-CG 3.77Å; E136-H141 IonicContact OE2-ND1 3.4Å; E136-H141 PolarHBondContact OE2-ND1 2.7Å; L139-H141 VanDerWaalsContact C-N 3.34Å
142	L	94.5	Very high	95.9	Very high	46 Å²	46	56 Å²	56	24%	0.241	31%	0.314	C	S	.	.			trans	-80.2	125.2	-177.8	-61.9	-175.1	0	0	0	111.4	Q137 G140 P207 S214 L215 F218 F241	Q137-L142 HydrophobicContact CG-CD2 3.65Å; G140-L142 PolarHBondContact O-N 3.12Å; L142-P207 HydrophobicContact CD1-CB 4.31Å; L142-P207 HydrophobicContact CD1-CG 4.07Å; L142-S214 VanDerWaalsContact CD1-O 3.32Å; L142-S214 WeakPolarHBondContact CD1-O 3.25Å; L142-L215 HydrophobicContact CD1-CD2 4.1Å; L142-F218 HydrophobicContact CB-CE1 4.43Å; L142-F218 HydrophobicContact CB-CE2 3.86Å; L142-F218 HydrophobicContact CB-CZ 3.62Å; L142-F218 HydrophobicContact CD1-CD2 4.27Å; L142-F218 HydrophobicContact CD1-CE2 3.94Å; L142-F218 HydrophobicContact CD1-CZ 4.4Å; L142-F218 HydrophobicContact CG-CE2 4.43Å; L142-F218 HydrophobicContact CG-CZ 4.42Å; L142-F241 HydrophobicContact CD2-CE2 3.89Å; L142-F241 HydrophobicContact CD2-CZ 3.86Å
143	S	93.8	Very high	95.8	Very high	50 Å²	50	58 Å²	58	35%	0.35	32%	0.323	S	S	.	.			trans	-120.4	144.9	175.1	175.1	0	0	0	0	110.7	T145 F218	S143-T145 PolarHBondContact O-N 2.9Å; S143-T145 PolarHBondContact OG-N 3.48Å; S143-T145 PolarHBondContact OG-O 2.81Å; S143-T145 VanDerWaalsContact OG-O 3.08Å; S143-T145 PolarHBondContact OG-OG1 2.88Å; S143-F218 WeakPolarHBondContact O-CE1 3.28Å
144	Q	93.8	Very high	95.8	Very high	105 Å²	105	54.7 Å²	54.7	49%	0.491	31%	0.312	S	S	.	.	S	Bend	trans	-70.1	-14	170.8	-63.7	-60.1	-47.3	0	0	112.8	P146 Y155	Q144-P146 WeakPolarHBondContact O-CD 3.47Å; Q144-Y155 PolarHBondContact O-OH 3.24Å
145	T	94.6	Very high	95.8	Very high	104 Å²	104	58.5 Å²	58.5	64%	0.638	33%	0.326	S	S	*	.	S	Bend	trans	-118	83.8	175	49.9	0	0	0	0	108.5	S143	S143-T145 PolarHBondContact O-N 2.9Å; S143-T145 PolarHBondContact OG-N 3.48Å; S143-T145 PolarHBondContact OG-O 2.81Å; S143-T145 VanDerWaalsContact OG-O 3.08Å; S143-T145 PolarHBondContact OG-OG1 2.88Å
146	P	93.4	Very high	95.8	Very high	14 Å²	14	56.2 Å²	56.2	9%	0.091	31%	0.314	C	S	.	.			trans	-64.8	162.9	175.8	27.2	-35.1	0	0	0	111.2	D134 Q144 A154 Y155 P162	D134-P146 WeakPolarHBondContact OD2-CA 3.3Å; Q144-P146 WeakPolarHBondContact O-CD 3.47Å; P146-A154 HydrophobicContact CG-CB 4.09Å; P146-Y155 HydrophobicContact CG-CE2 4.38Å; P146-P162 HydrophobicContact CG-CB 4.23Å
147	S	95.4	Very high	95.7	Very high	36 Å²	36	55.8 Å²	55.8	25%	0.252	32%	0.32	S	S	.	.			trans	-51	139.6	177.9	177.7	0	0	0	0	112.6	D134 D149 C150	D134-S147 PolarHBondContact OD2-N 3.26Å; S147-D149 PolarHBondContact O-N 2.92Å; S147-D149 WeakPolarHBondContact OG-CB 3.38Å; S147-D149 PolarHBondContact OG-N 2.85Å; S147-C150 WeakPolarHBondContact O-CB 3.19Å; S147-C150 PolarHBondContact O-N 3.36Å
148	T	95.9	Very high	95.5	Very high	122 Å²	122	63 Å²	63	75%	0.748	36%	0.359	S	S	*	.	G	3₁₀ helix	trans	-59.2	-20.2	174.2	55.1	0	0	0	0	112.8	C150 A151	T148-C150 PolarHBondContact O-N 2.84Å; T148-A151 WeakPolarHBondContact O-CB 3.46Å; T148-A151 PolarHBondContact O-N 2.83Å
149	D	96.8	Very high	95.4	Very high	51 Å²	51	65.4 Å²	65.4	27%	0.273	38%	0.376	S	S	.	.	G	3₁₀ helix	trans	-69	-24.8	179	-68.5	-11.7	0	0	0	112.5	K131 S132 S147 A151	K131-D149 WeakPolarHBondContact CE-OD1 3.4Å; K131-D149 WeakPolarHBondContact CE-OD2 3.23Å; K131-D149 HydrophobicContact CG-CB 4.11Å; K131-D149 IonicContact NZ-OD1 3.67Å; K131-D149 PolarHBondContact NZ-OD1 3.27Å; K131-D149 IonicContact NZ-OD2 2.81Å; K131-D149 WeakPolarHBondContact O-CB 3.49Å; S132-D149 VanDerWaalsContact CA-O 3.25Å; S132-D149 WeakPolarHBondContact CA-O 3.37Å; S132-D149 PolarHBondContact OG-O 3.5Å; S147-D149 PolarHBondContact O-N 2.92Å; S147-D149 WeakPolarHBondContact OG-CB 3.38Å; S147-D149 PolarHBondContact OG-N 2.85Å; D149-A151 PolarHBondContact O-N 3.39Å
150	C	96.7	Very high	95.3	Very high	0 Å²	0	65.1 Å²	65.1	0%	0	39%	0.388	C	S	.	.	G	3₁₀ helix	trans	-68.3	-10.1	175.5	-83.3	0	0	0	0	114.2	S132 D134 S147 T148 F153 A154 C166	S132-C150 PolarHBondContact OG-O 2.91Å; D134-C150 PolarHBondContact N-SG 2.79Å; S147-C150 WeakPolarHBondContact O-CB 3.19Å; S147-C150 PolarHBondContact O-N 3.36Å; T148-C150 PolarHBondContact O-N 2.84Å; C150-F153 CarbonylContact O-C 3.58Å; C150-F153 VanDerWaalsContact O-C 3.25Å; C150-F153 WeakPolarHBondContact O-CA 3.31Å; C150-F153 PolarHBondContact O-N 2.97Å; C150-A154 HydrophobicContact CB-CB 3.95Å; C150-A154 PolarHBondContact O-N 2.9Å; C150-C166 HydrophobicContact CB-CB 3.6Å; C150-C166 WeakPolarHBondContact CB-SG 3.49Å; C150-C166 WeakPolarHBondContact SG-CB 3.45Å; C150-C166 CovalentContact SG-SG 2.04Å; C150-C166 PolarHBondContact SG-SG 2.99Å
151	A	94.8	Very high	95.3	Very high	62 Å²	62	69 Å²	69	51%	0.512	40%	0.402	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.6	139.4	179.8	0	0	0	0	0	112.5	T148 D149	T148-A151 WeakPolarHBondContact O-CB 3.46Å; T148-A151 PolarHBondContact O-N 2.83Å; D149-A151 PolarHBondContact O-N 3.39Å
152	P	95.8	Very high	95.4	Very high	105 Å²	105	63.6 Å²	63.6	68%	0.682	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	cis	-84.6	-1.4	1.1	35.3	-36.4	0	0	0	114.5	A154	P152-A154 VanDerWaalsContact C-N 3.26Å; P152-A154 PolarHBondContact O-N 3.44Å
153	F	97.4	Very high	95.6	Very high	46 Å²	46	61.5 Å²	61.5	20%	0.202	37%	0.366	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.3	35.3	-174.3	-51.7	-72.3	0	0	0	113.2	C150 C166 G167 A168 N171 I222	C150-F153 CarbonylContact O-C 3.58Å; C150-F153 VanDerWaalsContact O-C 3.25Å; C150-F153 WeakPolarHBondContact O-CA 3.31Å; C150-F153 PolarHBondContact O-N 2.97Å; F153-C166 WeakPolarHBondContact O-CB 3.31Å; F153-G167 PolarHBondContact O-N 2.79Å; F153-A168 VanDerWaalsContact CD2-CA 3.46Å; F153-A168 HydrophobicContact CD2-CB 3.67Å; F153-A168 HydrophobicContact CE2-CB 3.64Å; F153-N171 HydrophobicContact CD1-CB 4.32Å; F153-N171 VanDerWaalsContact CD1-ND2 3.34Å; F153-N171 WeakPolarHBondContact CD1-ND2 3.06Å; F153-N171 WeakPolarHBondContact CE1-ND2 3.48Å; F153-N171 HydrophobicContact CG-CB 4.3Å; F153-I222 HydrophobicContact CD1-CD1 3.96Å; F153-I222 HydrophobicContact CE1-CD1 4.36Å
154	A	97.3	Very high	95.8	Very high	10 Å²	10	59.2 Å²	59.2	8%	0.083	35%	0.351	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.6	-36.9	177.1	0	0	0	0	0	111.6	P146 C150 P152 I163	P146-A154 HydrophobicContact CG-CB 4.09Å; C150-A154 HydrophobicContact CB-CB 3.95Å; C150-A154 PolarHBondContact O-N 2.9Å; P152-A154 VanDerWaalsContact C-N 3.26Å; P152-A154 PolarHBondContact O-N 3.44Å; A154-I163 PolarHBondContact O-N 2.94Å
155	Y	97.5	Very high	95.9	Very high	99 Å²	99	54.2 Å²	54.2	39%	0.388	33%	0.328	S	S	.	.	B	Isolated β-bridge	trans	-129.4	148	-176.9	-62.4	-87	0	0	0	110.1	Q144 P146 K161 P162 I163	Q144-Y155 PolarHBondContact O-OH 3.24Å; P146-Y155 HydrophobicContact CG-CE2 4.38Å; Y155-K161 WeakPolarHBondContact CA-O 3.45Å; Y155-P162 HydrophobicContact CD1-CB 4.27Å; Y155-P162 HydrophobicContact CE1-CB 4.15Å; Y155-I163 WeakPolarHBondContact O-CD1 3.34Å
156	D	96.5	Very high	96.1	Very high	29 Å²	29	49.3 Å²	49.3	16%	0.155	30%	0.297	C	S	.	.			trans	-75.7	121.6	172	173.2	13.6	0	0	0	109.1	D158 S159 G160 K161 I163 S219	D156-D158 PolarHBondContact O-N 3.46Å; D156-D158 PolarHBondContact OD1-N 2.89Å; D156-S159 WeakPolarHBondContact CB-OG 3.32Å; D156-S159 VanDerWaalsContact CG-OG 3.26Å; D156-S159 WeakPolarHBondContact OD2-CB 3.46Å; D156-S159 PolarHBondContact OD2-OG 3.49Å; D156-G160 VanDerWaalsContact O-CA 3.28Å; D156-G160 WeakPolarHBondContact O-CA 3.32Å; D156-G160 PolarHBondContact O-N 2.88Å; D156-K161 PolarHBondContact N-O 2.99Å; D156-I163 HydrophobicContact CB-CD1 4.44Å; D156-I163 HydrophobicContact CB-CG1 4.13Å; D156-S219 PolarHBondContact OD2-OG 3.33Å
157	P	94.4	Very high	96.3	Very high	97 Å²	97	48.7 Å²	48.7	63%	0.63	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.2	-27.3	-175.8	25.4	-35.1	0	0	0	113.5	I222	P157-I222 HydrophobicContact CG-CD1 4.46Å
158	D	93.2	Very high	96.4	Very high	154 Å²	154	47.7 Å²	47.7	82%	0.824	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.1	-42.1	-174.6	-64.3	-35.2	0	0	0	112	D156	D156-D158 PolarHBondContact O-N 3.46Å; D156-D158 PolarHBondContact OD1-N 2.89Å
159	S	94	Very high	96.5	Very high	59 Å²	59	41.9 Å²	41.9	41%	0.413	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.5	-17.9	-177.2	69.2	0	0	0	0	114.3	D156 K161 S219	D156-S159 WeakPolarHBondContact CB-OG 3.32Å; D156-S159 VanDerWaalsContact CG-OG 3.26Å; D156-S159 WeakPolarHBondContact OD2-CB 3.46Å; D156-S159 PolarHBondContact OD2-OG 3.49Å; S159-K161 PolarHBondContact O-N 3.43Å; S159-K161 WeakPolarHBondContact OG-CB 3.43Å; S159-K161 PolarHBondContact OG-N 2.88Å; S159-S219 PolarHBondContact OG-OG 2.67Å; S159-S219 VanDerWaalsContact OG-OG 3.08Å
160	G	94.4	Very high	96.6	Very high	52 Å²	52	39.5 Å²	39.5	54%	0.536	24%	0.239	S	C	.	.			trans	69.8	1.5	-171.4	0	0	0	0	0	114.4	D156	D156-G160 VanDerWaalsContact O-CA 3.28Å; D156-G160 WeakPolarHBondContact O-CA 3.32Å; D156-G160 PolarHBondContact O-N 2.88Å
161	K	96.3	Very high	96.6	Very high	90 Å²	90	39.7 Å²	39.7	39%	0.391	24%	0.24	S	C	.	.	P	Polyproline II helix	trans	-74.1	147.2	179.2	-68.6	-175.1	175.6	-170.9	0	111.4	Y155 D156 S159 E216	Y155-K161 WeakPolarHBondContact CA-O 3.45Å; D156-K161 PolarHBondContact N-O 2.99Å; S159-K161 PolarHBondContact O-N 3.43Å; S159-K161 WeakPolarHBondContact OG-CB 3.43Å; S159-K161 PolarHBondContact OG-N 2.88Å; K161-E216 PolarHBondContact NZ-O 2.95Å; K161-E216 VanDerWaalsContact NZ-O 3.1Å
162	P	97.5	Very high	96.7	Very high	4 Å²	4	37.7 Å²	37.7	3%	0.026	22%	0.222	C	C	.	.	B	Isolated β-bridge	trans	-61.4	141.9	170.3	28.8	-37.1	0	0	0	110.8	P146 Y155 F218 S219	P146-P162 HydrophobicContact CG-CB 4.23Å; Y155-P162 HydrophobicContact CD1-CB 4.27Å; Y155-P162 HydrophobicContact CE1-CB 4.15Å; P162-F218 HydrophobicContact CB-CD1 3.9Å; P162-F218 HydrophobicContact CB-CE1 3.9Å; P162-F218 HydrophobicContact CG-CD1 3.56Å; P162-F218 HydrophobicContact CG-CE1 3.56Å; P162-F218 HydrophobicContact CG-CG 4.33Å; P162-F218 HydrophobicContact CG-CZ 4.33Å; P162-F218 VanDerWaalsContact O-CA 3.32Å; P162-F218 WeakPolarHBondContact O-CA 3.33Å; P162-S219 PolarHBondContact O-N 3.49Å
163	I	98	Very high	96.8	Very high	2 Å²	2	33.8 Å²	33.8	1%	0.01	20%	0.196	C	C	.	.	B	Isolated β-bridge	trans	-86.4	137.7	179.1	-67.2	173.1	0	0	0	110	Q137 A154 Y155 D156 P165 C166 S219 P221 I222	Q137-I163 PolarHBondContact NE2-O 2.95Å; A154-I163 PolarHBondContact O-N 2.94Å; Y155-I163 WeakPolarHBondContact O-CD1 3.34Å; D156-I163 HydrophobicContact CB-CD1 4.44Å; D156-I163 HydrophobicContact CB-CG1 4.13Å; I163-P165 WeakPolarHBondContact CG2-O 3.28Å; I163-C166 HydrophobicContact CB-CB 4.37Å; I163-C166 WeakPolarHBondContact O-CB 3.14Å; I163-C166 PolarHBondContact O-N 2.84Å; I163-S219 CarbonylContact C-O 3.58Å; I163-S219 WeakPolarHBondContact CA-O 3.34Å; I163-P221 HydrophobicContact CG2-CB 4.06Å; I163-P221 HydrophobicContact CG2-CG 3.86Å; I163-I222 HydrophobicContact CD1-CD1 4.46Å; I163-I222 HydrophobicContact CD1-CG1 4.02Å
164	A	97.1	Very high	96.8	Very high	3 Å²	3	32.5 Å²	32.5	3%	0.025	19%	0.19	C	C	.	.	T	Hydrogen-bonded Turn	trans	-130.6	117.4	171.4	0	0	0	0	0	111.6	Q137 L215 F218 S219 F241	Q137-A164 VanDerWaalsContact NE2-CA 3.35Å; A164-L215 HydrophobicContact CB-CD2 3.95Å; A164-F218 HydrophobicContact CB-CB 3.86Å; A164-F218 HydrophobicContact CB-CD1 3.78Å; A164-F218 HydrophobicContact CB-CG 3.96Å; A164-S219 PolarHBondContact N-O 3.31Å; A164-F241 HydrophobicContact CB-CZ 4.35Å
165	P	97.8	Very high	96.7	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	cis	-72.4	135.6	-8.9	27.8	-35.4	0	0	0	114	Q137 L138 I163 A170 P221 W224 F241	Q137-P165 VanDerWaalsContact OE1-CA 3.3Å; L138-P165 HydrophobicContact CD2-CB 4.43Å; I163-P165 WeakPolarHBondContact CG2-O 3.28Å; P165-A170 HydrophobicContact CB-CB 3.68Å; P165-A170 HydrophobicContact CG-CB 3.52Å; P165-P221 HydrophobicContact CG-CG 4.16Å; P165-P221 WeakPolarHBondContact O-CG 3.4Å; P165-W224 HydrophobicContact CG-CH2 3.54Å; P165-W224 HydrophobicContact CG-CZ2 3.75Å; P165-W224 HydrophobicContact CG-CZ3 4.37Å; P165-F241 HydrophobicContact CB-CE1 3.93Å
166	C	97.8	Very high	96.7	Very high	1 Å²	1	29.9 Å²	29.9	1%	0.007	18%	0.181	C	C	.	.			trans	-79.1	161.8	176.8	71.9	0	0	0	0	113.4	D134 C150 F153 I163	D134-C166 WeakPolarHBondContact CB-SG 3.3Å; C150-C166 HydrophobicContact CB-CB 3.6Å; C150-C166 WeakPolarHBondContact CB-SG 3.49Å; C150-C166 WeakPolarHBondContact SG-CB 3.45Å; C150-C166 CovalentContact SG-SG 2.04Å; C150-C166 PolarHBondContact SG-SG 2.99Å; F153-C166 WeakPolarHBondContact O-CB 3.31Å; I163-C166 HydrophobicContact CB-CB 4.37Å; I163-C166 WeakPolarHBondContact O-CB 3.14Å; I163-C166 PolarHBondContact O-N 2.84Å
167	G	97.9	Very high	96.7	Very high	1 Å²	1	31 Å²	31	1%	0.01	19%	0.189	C	C	.	.	S	Bend	trans	99.8	161	170.9	0	0	0	0	0	115.3	S132 F153 I169 A170 N171	S132-G167 CarbonylContact O-C 3.58Å; S132-G167 VanDerWaalsContact O-CA 3.31Å; S132-G167 WeakPolarHBondContact O-CA 3.31Å; S132-G167 WeakPolarHBondContact OG-CA 3.44Å; F153-G167 PolarHBondContact O-N 2.79Å; G167-I169 VanDerWaalsContact C-N 3.28Å; G167-I169 PolarHBondContact O-N 2.99Å; G167-A170 PolarHBondContact O-N 3.27Å; G167-N171 VanDerWaalsContact O-CB 3.32Å; G167-N171 WeakPolarHBondContact O-CB 3.38Å; G167-N171 PolarHBondContact O-N 3.33Å
168	A	97.9	Very high	96.8	Very high	15 Å²	15	26.6 Å²	26.6	12%	0.124	16%	0.16	C	C	.	.	H	α-helix	trans	-64.1	-33.3	-173.4	0	0	0	0	0	112.8	Y129 S132 F153 S172	Y129-A168 HydrophobicContact CD2-CB 4.09Å; Y129-A168 HydrophobicContact CE2-CB 4.44Å; S132-A168 PolarHBondContact O-N 2.91Å; S132-A168 PolarHBondContact OG-N 3.45Å; F153-A168 VanDerWaalsContact CD2-CA 3.46Å; F153-A168 HydrophobicContact CD2-CB 3.67Å; F153-A168 HydrophobicContact CE2-CB 3.64Å; A168-S172 PolarHBondContact O-N 3.14Å; A168-S172 PolarHBondContact O-OG 3.49Å
169	I	98.1	Very high	97	Very high	0 Å²	0	20.7 Å²	20.7	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-62.6	-54.8	179.5	-51.1	176.7	0	0	0	109.1	Y129 R133 G167 S172 W249 M250 T252	Y129-I169 HydrophobicContact CD1-CG1 3.91Å; Y129-I169 HydrophobicContact CE1-CB 4.19Å; Y129-I169 HydrophobicContact CE1-CG1 3.75Å; Y129-I169 HydrophobicContact CE1-CG2 4.12Å; Y129-I169 WeakPolarHBondContact O-CD1 3.28Å; Y129-I169 WeakPolarHBondContact O-CG1 3.22Å; R133-I169 HydrophobicContact CB-CD1 4.3Å; R133-I169 HydrophobicContact CG-CD1 4.44Å; G167-I169 VanDerWaalsContact C-N 3.28Å; G167-I169 PolarHBondContact O-N 2.99Å; I169-S172 PolarHBondContact O-N 2.89Å; I169-S172 PolarHBondContact O-OG 2.8Å; I169-W249 PolarHBondContact O-NE1 3.15Å; I169-M250 HydrophobicContact CB-CE 4.17Å; I169-M250 HydrophobicContact CB-SD 3.95Å; I169-M250 HydrophobicContact CG2-CE 4.16Å; I169-M250 HydrophobicContact CG2-SD 3.53Å; I169-M250 VanDerWaalsContact CG2-SD 3.53Å; I169-T252 HydrophobicContact CD1-CG2 3.79Å; I169-T252 HydrophobicContact CG1-CG2 4.45Å
170	A	97.6	Very high	97.1	Very high	0 Å²	0	18 Å²	18	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-69.3	-40.1	-176.6	0	0	0	0	0	111.6	P165 G167 S172 L173 W224 M250	P165-A170 HydrophobicContact CB-CB 3.68Å; P165-A170 HydrophobicContact CG-CB 3.52Å; G167-A170 PolarHBondContact O-N 3.27Å; A170-S172 PolarHBondContact O-N 2.97Å; A170-L173 WeakPolarHBondContact O-CB 3.25Å; A170-L173 PolarHBondContact O-N 3.28Å; A170-L173 VanDerWaalsContact O-N 3.1Å; A170-W224 PolarHBondContact O-NE1 2.91Å; A170-M250 HydrophobicContact CB-CE 4.36Å; A170-M250 HydrophobicContact CB-SD 3.77Å
171	N	97.6	Very high	97.1	Very high	5 Å²	5	17 Å²	17	3%	0.027	9%	0.093	C	C	.	.	H	α-helix	trans	-58.4	-32.8	179.5	-171.8	46.2	0	0	0	113.2	F153 G167 L173 P221 I222 F223	F153-N171 HydrophobicContact CD1-CB 4.32Å; F153-N171 VanDerWaalsContact CD1-ND2 3.34Å; F153-N171 WeakPolarHBondContact CD1-ND2 3.06Å; F153-N171 WeakPolarHBondContact CE1-ND2 3.48Å; F153-N171 HydrophobicContact CG-CB 4.3Å; G167-N171 VanDerWaalsContact O-CB 3.32Å; G167-N171 WeakPolarHBondContact O-CB 3.38Å; G167-N171 PolarHBondContact O-N 3.33Å; N171-L173 VanDerWaalsContact C-N 3.33Å; N171-L173 PolarHBondContact O-N 3.44Å; N171-P221 HydrophobicContact CB-CB 4.24Å; N171-I222 PolarHBondContact OD1-N 3.38Å; N171-F223 WeakPolarHBondContact ND2-CD2 3.13Å; N171-F223 VanDerWaalsContact ND2-CE2 3.34Å; N171-F223 WeakPolarHBondContact ND2-CE2 3.41Å; N171-F223 PolarHBondContact OD1-N 2.85Å
172	S	96.8	Very high	97	Very high	20 Å²	20	15.5 Å²	15.5	14%	0.14	9%	0.087	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.7	26.1	179.2	57.8	0	0	0	0	114.1	Y122 Y129 A168 I169 A170 F174 W249 Y289	Y122-S172 WeakPolarHBondContact OH-CB 3.43Å; Y122-S172 PolarHBondContact OH-OG 2.96Å; Y129-S172 WeakPolarHBondContact CE2-OG 3.18Å; Y129-S172 PolarHBondContact OH-OG 3.44Å; A168-S172 PolarHBondContact O-N 3.14Å; A168-S172 PolarHBondContact O-OG 3.49Å; I169-S172 PolarHBondContact O-N 2.89Å; I169-S172 PolarHBondContact O-OG 2.8Å; A170-S172 PolarHBondContact O-N 2.97Å; S172-F174 PolarHBondContact O-N 3.08Å; S172-W249 VanDerWaalsContact O-CE2 3.3Å; S172-W249 WeakPolarHBondContact O-CZ2 3.17Å; S172-Y289 WeakPolarHBondContact O-CE2 3.34Å; S172-Y289 PolarHBondContact O-OH 3.04Å; S172-Y289 VanDerWaalsContact O-OH 3.14Å
173	L	97.6	Very high	96.6	Very high	23 Å²	23	19.2 Å²	19.2	12%	0.12	13%	0.127	C	C	.	.			trans	-51.3	128.7	178.2	-178.6	63	0	0	0	112.2	A170 N171 N175 W224 L246 W249	A170-L173 WeakPolarHBondContact O-CB 3.25Å; A170-L173 PolarHBondContact O-N 3.28Å; A170-L173 VanDerWaalsContact O-N 3.1Å; N171-L173 VanDerWaalsContact C-N 3.33Å; N171-L173 PolarHBondContact O-N 3.44Å; L173-N175 PolarHBondContact O-N 2.78Å; L173-W224 HydrophobicContact CB-CZ2 4.12Å; L173-W224 HydrophobicContact CD2-CH2 4.1Å; L173-W224 HydrophobicContact CD2-CZ2 3.59Å; L173-W224 HydrophobicContact CG-CZ2 4.47Å; L173-L246 HydrophobicContact CD1-CD1 4.41Å; L173-L246 HydrophobicContact CD2-CD1 4.43Å; L173-W249 HydrophobicContact CD1-CB 3.38Å; L173-W249 HydrophobicContact CD1-CD2 4.26Å; L173-W249 HydrophobicContact CD1-CG 3.45Å; L173-W249 VanDerWaalsContact CD1-CG 3.45Å
174	F	97.2	Very high	96	Very high	18 Å²	18	22.4 Å²	22.4	8%	0.079	16%	0.16	C	C	.	.			trans	-59.5	126.4	174.1	-179.1	-99.1	0	0	0	111.1	Y73 Y117 L119 S172 D176 W249 Y289 K298	Y73-F174 WeakPolarHBondContact OH-CZ 3.35Å; Y117-F174 AromaticContact CD1-CD1 3.8Å; Y117-F174 HydrophobicContact CD1-CD1 3.8Å; Y117-F174 AromaticContact CD1-CE1 3.73Å; Y117-F174 HydrophobicContact CD1-CE1 3.73Å; Y117-F174 HydrophobicContact CD1-CZ 4.45Å; Y117-F174 HydrophobicContact CD2-CD1 4.09Å; Y117-F174 HydrophobicContact CD2-CD2 4.24Å; Y117-F174 HydrophobicContact CD2-CE1 4.17Å; Y117-F174 HydrophobicContact CD2-CE2 4.32Å; Y117-F174 HydrophobicContact CD2-CG 4.1Å; Y117-F174 HydrophobicContact CD2-CZ 4.26Å; Y117-F174 AromaticContact CE1-CD1 3.79Å; Y117-F174 HydrophobicContact CE1-CD1 3.79Å; Y117-F174 HydrophobicContact CE1-CE1 4.2Å; Y117-F174 HydrophobicContact CE1-CG 4.42Å; Y117-F174 HydrophobicContact CE2-CB 4.07Å; Y117-F174 HydrophobicContact CE2-CD1 4.02Å; Y117-F174 HydrophobicContact CE2-CD2 4.32Å; Y117-F174 AromaticContact CE2-CG 3.86Å; Y117-F174 HydrophobicContact CE2-CG 3.86Å; Y117-F174 AromaticContact CG-CD1 3.99Å; Y117-F174 HydrophobicContact CG-CD1 3.99Å; Y117-F174 AromaticContact CG-CE1 3.75Å; Y117-F174 HydrophobicContact CG-CE1 3.75Å; Y117-F174 HydrophobicContact CG-CG 4.46Å; Y117-F174 HydrophobicContact CG-CZ 4.02Å; Y117-F174 AromaticContact CZ-CD1 3.89Å; L119-F174 HydrophobicContact CD1-CD2 4.42Å; L119-F174 HydrophobicContact CD2-CE2 4.34Å; S172-F174 PolarHBondContact O-N 3.08Å; F174-D176 HydrophobicContact CE1-CB 3.86Å; F174-D176 HydrophobicContact CE2-CB 4.12Å; F174-D176 HydrophobicContact CZ-CB 3.47Å; F174-D176 VanDerWaalsContact CZ-CB 3.47Å; F174-D176 WeakPolarHBondContact CZ-OD2 3.27Å; F174-W249 HydrophobicContact CB-CE3 3.84Å; F174-W249 HydrophobicContact CB-CH2 4.41Å; F174-W249 HydrophobicContact CB-CZ3 3.78Å; F174-Y289 HydrophobicContact CD2-CD1 4.08Å; F174-Y289 HydrophobicContact CD2-CD2 4.28Å; F174-Y289 AromaticContact CD2-CG 3.93Å; F174-Y289 HydrophobicContact CD2-CG 3.93Å; F174-Y289 HydrophobicContact CE2-CD1 4.46Å; F174-Y289 HydrophobicContact CE2-CG 4.35Å; F174-K298 HydrophobicContact CE2-CD 4.37Å
175	N	95.5	Very high	95.8	Very high	50 Å²	50	26.2 Å²	26.2	27%	0.267	19%	0.186	S	C	.	.			trans	-130.7	12.4	-168.3	69	-3.4	0	0	0	114.7	L173 N288 Y289	L173-N175 PolarHBondContact O-N 2.78Å; N175-N288 PolarHBondContact O-ND2 2.94Å; N175-N288 VanDerWaalsContact OD1-CB 3.27Å; N175-N288 WeakPolarHBondContact OD1-CB 3.37Å; N175-Y289 WeakPolarHBondContact OD1-CA 3.44Å; N175-Y289 WeakPolarHBondContact OD1-CB 3.35Å; N175-Y289 WeakPolarHBondContact OD1-CD2 3.31Å; N175-Y289 PolarHBondContact OD1-N 2.98Å
176	D	96.6	Very high	95.6	Very high	4 Å²	4	32.4 Å²	32.4	2%	0.021	22%	0.216	C	C	.	.			trans	-69.8	146.3	167.4	-63.7	-28.6	0	0	0	110	Y73 F174 L178 K286 N288 Y289 K298	Y73-D176 PolarHBondContact OH-OD2 3.47Å; F174-D176 HydrophobicContact CE1-CB 3.86Å; F174-D176 HydrophobicContact CE2-CB 4.12Å; F174-D176 HydrophobicContact CZ-CB 3.47Å; F174-D176 VanDerWaalsContact CZ-CB 3.47Å; F174-D176 WeakPolarHBondContact CZ-OD2 3.27Å; D176-L178 HydrophobicContact CB-CD2 4.34Å; D176-K286 WeakPolarHBondContact CA-O 3.25Å; D176-N288 PolarHBondContact OD1-N 3.16Å; D176-Y289 WeakPolarHBondContact OD1-CB 3.37Å; D176-Y289 PolarHBondContact OD1-N 2.89Å; D176-K298 IonicContact OD1-NZ 2.68Å; D176-K298 PolarHBondContact OD1-NZ 3.48Å; D176-K298 WeakPolarHBondContact OD2-CD 3.44Å; D176-K298 WeakPolarHBondContact OD2-CE 3.41Å; D176-K298 IonicContact OD2-NZ 2.75Å; D176-K298 PolarHBondContact OD2-NZ 3.08Å
177	T	96.7	Very high	95.4	Very high	53 Å²	53	32.4 Å²	32.4	33%	0.325	22%	0.216	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	118.2	170.5	-49	0	0	0	0	109.6	T179 I285 K286	T177-T179 HydrophobicContact CG2-CG2 4.38Å; T177-I285 CarbonylContact O-C 3.48Å; T177-I285 WeakPolarHBondContact O-CA 3.48Å; T177-K286 PolarHBondContact N-O 2.95Å; T177-K286 VanDerWaalsContact N-O 3.08Å; T177-K286 PolarHBondContact O-N 3.09Å
178	L	97.7	Very high	95.1	Very high	4 Å²	4	39 Å²	39	2%	0.021	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	125.2	177	-45	175.3	0	0	0	109.8	Y73 M115 D176 Y262 L283 I285 M300	Y73-L178 HydrophobicContact CE1-CD2 4.28Å; Y73-L178 HydrophobicContact CE2-CD2 4.24Å; M115-L178 HydrophobicContact CE-CB 3.35Å; M115-L178 HydrophobicContact CE-CD1 3.93Å; M115-L178 HydrophobicContact CE-CG 4.28Å; D176-L178 HydrophobicContact CB-CD2 4.34Å; L178-Y262 HydrophobicContact CB-CD1 4.18Å; L178-Y262 HydrophobicContact CB-CE1 3.66Å; L178-Y262 HydrophobicContact CD1-CD1 4.15Å; L178-Y262 HydrophobicContact CD1-CE1 4.31Å; L178-Y262 HydrophobicContact CG-CD1 4.44Å; L178-Y262 HydrophobicContact CG-CE1 4.09Å; L178-Y262 PolarHBondContact N-OH 2.65Å; L178-Y262 WeakPolarHBondContact O-CE1 3.36Å; L178-L283 HydrophobicContact CB-CD1 4.2Å; L178-I285 HydrophobicContact CD2-CB 4.26Å; L178-I285 HydrophobicContact CD2-CG1 3.78Å; L178-I285 HydrophobicContact CD2-CG2 3.81Å; L178-M300 HydrophobicContact CD1-CB 4.46Å; L178-M300 HydrophobicContact CD1-CG 4.2Å
179	T	97	Very high	95	Very high	31 Å²	31	39.9 Å²	39.9	19%	0.19	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	147	174.3	58	0	0	0	0	110.6	T177 N284	T177-T179 HydrophobicContact CG2-CG2 4.38Å; T179-N284 PolarHBondContact N-O 3.32Å; T179-N284 PolarHBondContact O-N 3.05Å; T179-N284 WeakPolarHBondContact OG1-CB 3.02Å; T179-N284 PolarHBondContact OG1-O 2.89Å
180	L	95.9	Very high	94.8	Very high	1 Å²	1	41.8 Å²	41.8	1%	0.005	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	132.5	-175.6	-173.9	62.9	0	0	0	109.6	F103 I187 L189 L276 Y281 L302	F103-L180 HydrophobicContact CE1-CD1 3.6Å; F103-L180 HydrophobicContact CZ-CD1 3.48Å; F103-L180 VanDerWaalsContact CZ-CD1 3.48Å; L180-I187 HydrophobicContact CB-CB 4.37Å; L180-I187 HydrophobicContact CD2-CD1 3.76Å; L180-I187 HydrophobicContact CG-CD1 3.78Å; L180-I187 HydrophobicContact CG-CG1 4.31Å; L180-I187 PolarHBondContact O-N 2.86Å; L180-L189 HydrophobicContact CB-CD1 4.27Å; L180-L276 HydrophobicContact CD2-CD1 4.15Å; L180-Y281 HydrophobicContact CD1-CD1 4.3Å; L180-Y281 HydrophobicContact CD2-CD1 4.48Å; L180-Y281 HydrophobicContact CG-CD1 4.34Å; L180-L302 HydrophobicContact CD2-CD1 4.48Å
181	L	95.4	Very high	94.7	Very high	32 Å²	32	45.3 Å²	45.3	17%	0.168	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	144.2	-178	-63.4	153.1	0	0	0	110	S185 E186 Y281 T282 N284	L181-S185 CarbonylContact C-O 3.46Å; L181-S185 WeakPolarHBondContact CA-O 3.48Å; L181-E186 HydrophobicContact CD2-CB 4.08Å; L181-Y281 WeakPolarHBondContact O-CA 3.4Å; L181-T282 HydrophobicContact CD1-CG2 4.44Å; L181-T282 PolarHBondContact N-O 2.82Å; L181-T282 PolarHBondContact O-N 3.36Å; L181-N284 HydrophobicContact CD1-CB 3.76Å
182	Q	93.8	Very high	94.6	Very high	58 Å²	58	46.9 Å²	46.9	27%	0.271	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	123.1	169.4	-173	171.8	16.8	0	0	109.2	G184 S185 I187 Y272 Y281	Q182-G184 PolarHBondContact O-N 3.48Å; Q182-G184 VanDerWaalsContact O-N 3.15Å; Q182-S185 PolarHBondContact N-O 3.08Å; Q182-S185 PolarHBondContact O-N 2.86Å; Q182-I187 HydrophobicContact CB-CD1 4.01Å; Q182-I187 HydrophobicContact CB-CG1 4.31Å; Q182-Y272 PolarHBondContact OE1-OH 3.39Å; Q182-Y281 HydrophobicContact CB-CD1 3.86Å; Q182-Y281 HydrophobicContact CB-CE1 3.76Å; Q182-Y281 VanDerWaalsContact CD-CE1 3.43Å; Q182-Y281 HydrophobicContact CG-CD1 4.16Å; Q182-Y281 HydrophobicContact CG-CE1 3.81Å; Q182-Y281 PolarHBondContact NE2-OH 2.96Å; Q182-Y281 PolarHBondContact OE1-OH 2.72Å
183	G	88.1	Confident	94.5	Very high	83 Å²	83	47.8 Å²	47.8	86%	0.856	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.9	30.6	-177.7	0	0	0	0	0	113.9	S185	G183-S185 VanDerWaalsContact C-N 3.31Å; G183-S185 PolarHBondContact O-N 3.08Å
184	G	86.9	Confident	94.4	Very high	69 Å²	69	47.2 Å²	47.2	71%	0.711	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	83.2	-5.6	-177.1	0	0	0	0	0	115.5	Q182	Q182-G184 PolarHBondContact O-N 3.48Å; Q182-G184 VanDerWaalsContact O-N 3.15Å
185	S	91.6	Very high	94.4	Very high	82 Å²	82	47 Å²	47	57%	0.573	29%	0.293	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98.5	137.7	177.4	-65.2	0	0	0	0	111.7	L181 Q182 G183	L181-S185 CarbonylContact C-O 3.46Å; L181-S185 WeakPolarHBondContact CA-O 3.48Å; Q182-S185 PolarHBondContact N-O 3.08Å; Q182-S185 PolarHBondContact O-N 2.86Å; G183-S185 VanDerWaalsContact C-N 3.31Å; G183-S185 PolarHBondContact O-N 3.08Å
186	E	93.6	Very high	94.5	Very high	131 Å²	131	52.1 Å²	52.1	61%	0.612	31%	0.308	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.6	131.4	179.9	-172.9	175	177.5	0	0	111.8	L181	L181-E186 HydrophobicContact CD2-CB 4.08Å
187	I	93.4	Very high	94.4	Very high	1 Å²	1	55.3 Å²	55.3	1%	0.005	33%	0.329	C	S	.	.	P	Polyproline II helix	trans	-83.2	118.8	173.1	-52.1	-170.3	0	0	0	108	L180 Q182 L189 L265 Y272 L276 Y281	L180-I187 HydrophobicContact CB-CB 4.37Å; L180-I187 HydrophobicContact CD2-CD1 3.76Å; L180-I187 HydrophobicContact CG-CD1 3.78Å; L180-I187 HydrophobicContact CG-CG1 4.31Å; L180-I187 PolarHBondContact O-N 2.86Å; Q182-I187 HydrophobicContact CB-CD1 4.01Å; Q182-I187 HydrophobicContact CB-CG1 4.31Å; I187-L189 HydrophobicContact CG2-CD2 4.41Å; I187-L189 PolarHBondContact O-N 3.37Å; I187-L189 VanDerWaalsContact O-N 3.12Å; I187-L265 HydrophobicContact CG2-CD1 3.65Å; I187-Y272 HydrophobicContact CD1-CE1 4.03Å; I187-Y272 HydrophobicContact CG1-CE1 4.42Å; I187-Y272 HydrophobicContact CG1-CE2 4.45Å; I187-Y272 HydrophobicContact CG2-CD2 4.16Å; I187-Y272 HydrophobicContact CG2-CE1 4.31Å; I187-Y272 HydrophobicContact CG2-CE2 3.94Å; I187-Y272 HydrophobicContact CG2-CG 4.45Å; I187-L276 HydrophobicContact CD1-CD2 4.14Å; I187-Y281 HydrophobicContact CD1-CD1 3.77Å; I187-Y281 HydrophobicContact CD1-CE1 3.51Å
188	K	92.8	Very high	94.4	Very high	138 Å²	138	55.7 Å²	55.7	60%	0.6	33%	0.334	S	S	*	.			trans	-66.6	113.2	178.3	-171.9	167.8	-177.8	172.5	0	110.7	N266	K188-N266 HydrophobicContact CG-CB 4.36Å; K188-N266 VanDerWaalsContact O-CB 3.26Å; K188-N266 WeakPolarHBondContact O-CB 3.48Å; K188-N266 PolarHBondContact O-N 3.02Å
189	L	94.3	Very high	94.3	Very high	35 Å²	35	55.8 Å²	55.8	18%	0.183	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	140.3	174.2	-60.1	176.8	0	0	0	109.9	M115 L180 I187 R263 L265	M115-L189 HydrophobicContact SD-CD1 3.57Å; M115-L189 VanDerWaalsContact SD-CD1 3.57Å; L180-L189 HydrophobicContact CB-CD1 4.27Å; I187-L189 HydrophobicContact CG2-CD2 4.41Å; I187-L189 PolarHBondContact O-N 3.37Å; I187-L189 VanDerWaalsContact O-N 3.12Å; L189-R263 HydrophobicContact CB-CB 3.74Å; L189-R263 HydrophobicContact CB-CG 4.04Å; L189-R263 HydrophobicContact CD1-CB 4.17Å; L189-R263 HydrophobicContact CD1-CG 4.31Å; L189-R263 HydrophobicContact CG-CB 4.46Å; L189-L265 HydrophobicContact CD2-CD1 4Å
190	L	95	Very high	94.2	Very high	40 Å²	40	56.4 Å²	56.4	21%	0.209	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	136.8	-179.5	-55.4	175.9	0	0	0	111	R263 R264 N266	L190-R263 WeakPolarHBondContact O-CA 3.31Å; L190-R263 WeakPolarHBondContact O-CD 3.45Å; L190-R264 HydrophobicContact CB-CG 3.76Å; L190-R264 HydrophobicContact CD1-CG 4.2Å; L190-R264 HydrophobicContact CG-CG 4.39Å; L190-R264 PolarHBondContact N-O 2.81Å; L190-R264 PolarHBondContact O-N 3.19Å; L190-N266 HydrophobicContact CD1-CB 4.25Å; L190-N266 HydrophobicContact CD2-CB 3.91Å; L190-N266 HydrophobicContact CG-CB 3.82Å
191	K	95.1	Very high	94	Very high	74 Å²	74	63.7 Å²	63.7	32%	0.322	36%	0.362	S	S	.	.	S	Bend	trans	-86	-18.8	172.2	-53.6	-176	-168.7	167.4	0	113.5	I194 D232	K191-I194 VanDerWaalsContact O-CD1 3.31Å; K191-I194 WeakPolarHBondContact O-CD1 3.41Å; K191-I194 WeakPolarHBondContact O-CG1 3.33Å; K191-D232 IonicContact NZ-OD1 3.23Å; K191-D232 PolarHBondContact NZ-OD1 2.77Å
192	T	95.3	Very high	94	Very high	38 Å²	38	67 Å²	67	23%	0.233	38%	0.383	C	S	.	.	S	Bend	trans	-95.7	158.9	-177.7	59.9	0	0	0	0	111.6	I194 N238 R264	T192-I194 VanDerWaalsContact C-N 3.33Å; T192-N238 HydrophobicContact CG2-CB 4.17Å; T192-R264 PolarHBondContact O-NE 3.34Å; T192-R264 PolarHBondContact O-NH2 2.99Å; T192-R264 VanDerWaalsContact O-NH2 3.12Å
193	G	94.9	Very high	94.1	Very high	39 Å²	39	70 Å²	70	40%	0.402	40%	0.395	S	S	.	.	S	Bend	trans	70.2	28.8	-178.8	0	0	0	0	0	113.7	E244	G193-E244 WeakPolarHBondContact CA-OE2 3.31Å; G193-E244 VanDerWaalsContact N-CD 3.29Å; G193-E244 PolarHBondContact N-OE1 2.75Å; G193-E244 VanDerWaalsContact N-OE1 3.09Å; G193-E244 PolarHBondContact N-OE2 2.75Å
194	I	96.7	Very high	94.5	Very high	11 Å²	11	66.6 Å²	66.6	6%	0.056	36%	0.357	C	S	.	.			trans	-105.4	-26.5	174.7	65	175.7	0	0	0	112	K191 T192 E244 D245 V248 L261 Y262	K191-I194 VanDerWaalsContact O-CD1 3.31Å; K191-I194 WeakPolarHBondContact O-CD1 3.41Å; K191-I194 WeakPolarHBondContact O-CG1 3.33Å; T192-I194 VanDerWaalsContact C-N 3.33Å; I194-E244 HydrophobicContact CD1-CB 3.97Å; I194-E244 HydrophobicContact CG1-CB 3.55Å; I194-E244 WeakPolarHBondContact CG1-OE2 3.23Å; I194-E244 PolarHBondContact N-OE2 3.37Å; I194-D245 WeakPolarHBondContact CD1-OD1 3.34Å; I194-V248 HydrophobicContact CB-CG2 4.49Å; I194-V248 HydrophobicContact CD1-CG2 4.3Å; I194-V248 HydrophobicContact CG1-CG2 4.06Å; I194-L261 HydrophobicContact CB-CD2 3.74Å; I194-L261 HydrophobicContact CB-CG 3.87Å; I194-L261 HydrophobicContact CG2-CD2 3.97Å; I194-L261 HydrophobicContact CG2-CG 3.96Å; I194-Y262 WeakPolarHBondContact CD1-O 3.49Å
195	A	96.9	Very high	95	Very high	14 Å²	14	69 Å²	69	12%	0.116	35%	0.345	C	S	.	.	S	Bend	trans	-87.2	158	175.1	0	0	0	0	0	111.7	E244 I247 V248	A195-E244 HydrophobicContact CB-CB 3.92Å; A195-E244 HydrophobicContact CB-CG 3.78Å; A195-E244 PolarHBondContact N-OE2 3.13Å; A195-I247 HydrophobicContact CB-CB 4.05Å; A195-I247 HydrophobicContact CB-CD1 4.41Å; A195-I247 HydrophobicContact CB-CG2 3.75Å; A195-V248 HydrophobicContact CB-CG2 4.35Å
196	W	95.9	Very high	95.2	Very high	157 Å²	157	67 Å²	67	60%	0.595	33%	0.327	S	S	*	.			trans	-68.4	135.4	174.9	-73	76.4	0	0	0	110.2	S198 D199 K200	W196-S198 PolarHBondContact O-N 2.82Å; W196-S198 VanDerWaalsContact O-N 3.15Å; W196-D199 HydrophobicContact CB-CB 4.37Å; W196-D199 PolarHBondContact O-N 2.91Å; W196-K200 PolarHBondContact O-N 2.9Å
197	P	95.6	Very high	95.3	Very high	70 Å²	70	61.5 Å²	61.5	46%	0.455	30%	0.303	S	S	.	.	H	α-helix	trans	-60.8	-29.5	-178.3	-23.5	32	0	0	0	113.5	R201	P197-R201 VanDerWaalsContact CB-NH1 3.28Å; P197-R201 VanDerWaalsContact O-CB 3.3Å; P197-R201 WeakPolarHBondContact O-CB 3.41Å; P197-R201 VanDerWaalsContact O-CG 3.27Å; P197-R201 WeakPolarHBondContact O-CG 3.39Å; P197-R201 PolarHBondContact O-N 3.19Å; P197-R201 VanDerWaalsContact O-N 3.12Å; P197-R201 PolarHBondContact O-NE 2.82Å
198	S	95.8	Very high	95.1	Very high	61 Å²	61	70.6 Å²	70.6	43%	0.427	35%	0.346	S	S	.	.	H	α-helix	trans	-68.5	-43.1	174.1	49.2	0	0	0	0	112.5	W196 R201 V202	W196-S198 PolarHBondContact O-N 2.82Å; W196-S198 VanDerWaalsContact O-N 3.15Å; S198-R201 PolarHBondContact O-N 3.04Å; S198-V202 VanDerWaalsContact O-CB 3.28Å; S198-V202 WeakPolarHBondContact O-CB 3.32Å; S198-V202 PolarHBondContact O-N 2.95Å
199	D	96.1	Very high	94.9	Very high	7 Å²	7	67.7 Å²	67.7	4%	0.037	35%	0.354	C	S	.	.	I	π-helix	trans	-63.1	-49.6	177.1	-73.9	0.1	0	0	0	109.9	W196 R201 K203 F204 I247 R251	W196-D199 HydrophobicContact CB-CB 4.37Å; W196-D199 PolarHBondContact O-N 2.91Å; D199-R201 VanDerWaalsContact C-N 3.31Å; D199-R201 PolarHBondContact O-N 3.08Å; D199-K203 PolarHBondContact O-N 3.07Å; D199-K203 WeakPolarHBondContact OD1-CD 3.34Å; D199-K203 IonicContact OD1-NZ 3.39Å; D199-K203 PolarHBondContact OD1-NZ 3.39Å; D199-F204 HydrophobicContact CB-CD2 4.22Å; D199-F204 HydrophobicContact CB-CE2 4.33Å; D199-F204 PolarHBondContact O-N 3.23Å; D199-F204 VanDerWaalsContact O-N 3.1Å; D199-I247 HydrophobicContact CB-CG2 3.72Å; D199-R251 VanDerWaalsContact CG-NH2 3.28Å; D199-R251 IonicContact OD1-NH2 2.81Å; D199-R251 PolarHBondContact OD1-NH2 3.12Å; D199-R251 IonicContact OD2-CZ 2.69Å; D199-R251 IonicContact OD2-NE 3.32Å; D199-R251 PolarHBondContact OD2-NE 3.39Å; D199-R251 IonicContact OD2-NH2 3.44Å; D199-R251 PolarHBondContact OD2-NH2 3.2Å
200	K	94.2	Very high	94.8	Very high	43 Å²	43	70.8 Å²	70.8	19%	0.187	37%	0.371	C	S	.	.	I	π-helix	trans	-63.7	-31.6	-178.2	-168.1	175.2	-171.9	178.2	0	113.9	W196 D237 E244 I247	W196-K200 PolarHBondContact O-N 2.9Å; K200-D237 VanDerWaalsContact CE-O 3.28Å; K200-D237 WeakPolarHBondContact CE-O 3.44Å; K200-D237 PolarHBondContact NZ-O 3.35Å; K200-E244 HydrophobicContact CD-CG 3.93Å; K200-E244 IonicContact NZ-OE1 2.8Å; K200-E244 PolarHBondContact NZ-OE1 3Å; K200-I247 HydrophobicContact CB-CD1 4.1Å; K200-I247 HydrophobicContact CG-CD1 4.1Å
201	R	93.1	Very high	94.6	Very high	155 Å²	155	69.9 Å²	69.9	59%	0.585	37%	0.367	S	S	*	.	I	π-helix	trans	-93.5	-28.9	-177.9	-68.9	-170.1	-58.2	-107.6	0.1	114.3	P197 S198 D199 R205	P197-R201 VanDerWaalsContact CB-NH1 3.28Å; P197-R201 VanDerWaalsContact O-CB 3.3Å; P197-R201 WeakPolarHBondContact O-CB 3.41Å; P197-R201 VanDerWaalsContact O-CG 3.27Å; P197-R201 WeakPolarHBondContact O-CG 3.39Å; P197-R201 PolarHBondContact O-N 3.19Å; P197-R201 VanDerWaalsContact O-N 3.12Å; P197-R201 PolarHBondContact O-NE 2.82Å; S198-R201 PolarHBondContact O-N 3.04Å; D199-R201 VanDerWaalsContact C-N 3.31Å; D199-R201 PolarHBondContact O-N 3.08Å; R201-R205 VanDerWaalsContact O-CZ 3.27Å; R201-R205 PolarHBondContact O-NE 3.13Å; R201-R205 PolarHBondContact O-NH2 3.24Å
202	V	94.7	Very high	94.4	Very high	101 Å²	101	71 Å²	71	61%	0.612	38%	0.376	S	S	*	.	I	π-helix	trans	-116	-38.7	-168.7	-174.9	0	0	0	0	112.4	L139 S198	L139-V202 WeakPolarHBondContact CD2-O 3.38Å; S198-V202 VanDerWaalsContact O-CB 3.28Å; S198-V202 WeakPolarHBondContact O-CB 3.32Å; S198-V202 PolarHBondContact O-N 2.95Å
203	K	95.8	Very high	94.3	Very high	120 Å²	120	73.3 Å²	73.3	52%	0.522	39%	0.39	S	S	.	.	I	π-helix	trans	-99.6	-21.4	-170.6	-63.8	-173.2	-177.8	168.6	0	114.5	D199	D199-K203 PolarHBondContact O-N 3.07Å; D199-K203 WeakPolarHBondContact OD1-CD 3.34Å; D199-K203 IonicContact OD1-NZ 3.39Å; D199-K203 PolarHBondContact OD1-NZ 3.39Å
204	F	97.4	Very high	94.2	Very high	12 Å²	12	73 Å²	73	5%	0.053	38%	0.382	C	S	.	.			trans	-125.2	123.8	-178.4	-68	-95.8	0	0	0	109.6	L138 D199 F241 I247 M250	L138-F204 HydrophobicContact CB-CD1 4.21Å; L138-F204 HydrophobicContact CB-CE1 4.25Å; L138-F204 HydrophobicContact CD1-CE1 3.87Å; L138-F204 HydrophobicContact CD1-CZ 4.21Å; L138-F204 HydrophobicContact CD2-CD1 4.18Å; L138-F204 HydrophobicContact CD2-CE1 3.84Å; L138-F204 HydrophobicContact CG-CE1 4.19Å; L138-F204 CarbonylContact O-C 3.58Å; L138-F204 VanDerWaalsContact O-CA 3.28Å; L138-F204 WeakPolarHBondContact O-CA 3.38Å; D199-F204 HydrophobicContact CB-CD2 4.22Å; D199-F204 HydrophobicContact CB-CE2 4.33Å; D199-F204 PolarHBondContact O-N 3.23Å; D199-F204 VanDerWaalsContact O-N 3.1Å; F204-F241 WeakPolarHBondContact CD1-O 3.29Å; F204-I247 HydrophobicContact CB-CD1 3.96Å; F204-I247 HydrophobicContact CB-CG1 4.03Å; F204-I247 HydrophobicContact CD1-CG1 3.88Å; F204-I247 HydrophobicContact CD2-CB 4.46Å; F204-I247 HydrophobicContact CD2-CD1 4.31Å; F204-I247 HydrophobicContact CD2-CG1 3.83Å; F204-I247 HydrophobicContact CD2-CG2 4Å; F204-I247 HydrophobicContact CE1-CG1 4.27Å; F204-I247 HydrophobicContact CE2-CB 4.47Å; F204-I247 HydrophobicContact CE2-CG1 4.25Å; F204-I247 HydrophobicContact CE2-CG2 3.91Å; F204-I247 HydrophobicContact CG-CD1 4.11Å; F204-I247 HydrophobicContact CG-CG1 3.64Å; F204-I247 HydrophobicContact CZ-CG1 4.46Å; F204-I247 HydrophobicContact CZ-CG2 4.47Å; F204-M250 HydrophobicContact CE1-CB 4.07Å; F204-M250 HydrophobicContact CE1-CG 4.08Å; F204-M250 HydrophobicContact CZ-CB 3.75Å; F204-M250 HydrophobicContact CZ-CG 4.29Å
205	R	96.8	Very high	94.1	Very high	121 Å²	121	73.7 Å²	73.7	46%	0.457	39%	0.386	S	S	.	.			trans	-144.1	140.8	-178.9	-73.2	-66.6	-178.2	150.6	0.5	109.9	L138 L139 G140 R201 F241	L138-R205 PolarHBondContact O-N 2.77Å; L139-R205 WeakPolarHBondContact O-CB 3.43Å; G140-R205 VanDerWaalsContact CA-O 3.31Å; G140-R205 WeakPolarHBondContact CA-O 3.2Å; G140-R205 PolarHBondContact N-O 2.65Å; R201-R205 VanDerWaalsContact O-CZ 3.27Å; R201-R205 PolarHBondContact O-NE 3.13Å; R201-R205 PolarHBondContact O-NH2 3.24Å; R205-F241 WeakPolarHBondContact O-CB 3.41Å
206	N	96.2	Very high	93.8	Very high	38 Å²	38	79.6 Å²	79.6	20%	0.203	41%	0.411	C	S	.	.	P	Polyproline II helix	trans	-74.5	148.8	166.4	-72.1	-31	0	0	0	109.3	N239 G240 F241	N206-N239 PolarHBondContact ND2-O 2.98Å; N206-G240 WeakPolarHBondContact OD1-CA 3.19Å; N206-F241 PolarHBondContact OD1-N 3.44Å
207	P	94.5	Very high	93.7	Very high	17 Å²	17	73.5 Å²	73.5	11%	0.11	40%	0.396	C	S	.	.	P	Polyproline II helix	trans	-55.7	152.7	170.2	25.4	-35.6	0	0	0	110.8	G140 L142 L211 S214	G140-P207 WeakPolarHBondContact O-CB 3.45Å; L142-P207 HydrophobicContact CD1-CB 4.31Å; L142-P207 HydrophobicContact CD1-CG 4.07Å; P207-L211 HydrophobicContact CG-CD1 3.88Å; P207-S214 VanDerWaalsContact CG-CB 3.44Å
208	E	90.6	Very high	93.7	Very high	192 Å²	192	71.3 Å²	71.3	90%	0.897	38%	0.38	S	S	*	.	S	Bend	trans	-63.5	141.1	176.2	-63	-171.3	168.1	0	0	111.1
209	G	89.1	Confident	93.7	Very high	76 Å²	76	69.3 Å²	69.3	78%	0.784	37%	0.366	S	S	*	.	S	Bend	trans	88.9	-148.2	-179.5	0	0	0	0	0	113.8
210	N	91.1	Very high	93.8	Very high	100 Å²	100	73.4 Å²	73.4	54%	0.535	38%	0.383	S	S	.	.			trans	-86	117.5	-176.7	-171.6	-44.9	0	0	0	110.4	N212 V213 S214	N210-N212 PolarHBondContact O-N 2.94Å; N210-N212 WeakPolarHBondContact OD1-CB 3.35Å; N210-N212 PolarHBondContact OD1-N 2.86Å; N210-V213 HydrophobicContact CB-CB 4.35Å; N210-V213 HydrophobicContact CB-CG2 3.99Å; N210-V213 PolarHBondContact O-N 3.14Å; N210-V213 VanDerWaalsContact O-N 3.08Å; N210-S214 PolarHBondContact O-N 3.16Å; N210-S214 VanDerWaalsContact O-N 3.07Å; N210-S214 PolarHBondContact O-OG 3.2Å
211	L	91.6	Very high	93.9	Very high	22 Å²	22	71.4 Å²	71.4	12%	0.115	38%	0.375	C	S	.	.	H	α-helix	trans	-53.2	-38.6	-178.2	-178.4	63.7	0	0	0	113.3	P207 V213 S214 L215 A229	P207-L211 HydrophobicContact CG-CD1 3.88Å; L211-V213 PolarHBondContact O-N 3.43Å; L211-S214 PolarHBondContact O-N 3.37Å; L211-L215 HydrophobicContact CD1-CD1 3.81Å; L211-L215 HydrophobicContact CD1-CG 4.15Å; L211-L215 HydrophobicContact CG-CD1 3.84Å; L211-L215 HydrophobicContact CG-CG 4.49Å; L211-L215 WeakPolarHBondContact O-CB 3.42Å; L211-L215 VanDerWaalsContact O-CG 3.23Å; L211-L215 WeakPolarHBondContact O-CG 3.04Å; L211-L215 PolarHBondContact O-N 3.14Å; L211-L215 VanDerWaalsContact O-N 3.17Å; L211-A229 HydrophobicContact CD2-CB 3.98Å; L211-A229 HydrophobicContact CG-CB 4.28Å
212	N	91.1	Very high	94	Very high	96 Å²	96	67.6 Å²	67.6	51%	0.513	37%	0.365	S	S	.	.	H	α-helix	trans	-65.2	-42.8	-178.9	-68.3	-11.6	0	0	0	111.2	N210 L215 E216 A229	N210-N212 PolarHBondContact O-N 2.94Å; N210-N212 WeakPolarHBondContact OD1-CB 3.35Å; N210-N212 PolarHBondContact OD1-N 2.86Å; N212-L215 PolarHBondContact O-N 3.24Å; N212-E216 PolarHBondContact O-N 3.24Å; N212-A229 WeakPolarHBondContact OD1-CB 2.93Å
213	V	92.9	Very high	93.9	Very high	88 Å²	88	69 Å²	69	53%	0.533	36%	0.363	S	S	.	.	H	α-helix	trans	-65.7	-43.6	178.6	-179.9	0	0	0	0	110.3	N210 L211 L215 E216	N210-V213 HydrophobicContact CB-CB 4.35Å; N210-V213 HydrophobicContact CB-CG2 3.99Å; N210-V213 PolarHBondContact O-N 3.14Å; N210-V213 VanDerWaalsContact O-N 3.08Å; L211-V213 PolarHBondContact O-N 3.43Å; V213-L215 PolarHBondContact O-N 2.73Å; V213-L215 VanDerWaalsContact O-N 3.16Å; V213-E216 PolarHBondContact O-N 2.87Å
214	S	92.5	Very high	93.9	Very high	33 Å²	33	64 Å²	64	23%	0.231	34%	0.341	C	S	.	.	H	α-helix	trans	-61.3	-23.8	177	-51.5	0	0	0	0	113.2	L142 P207 N210 L211	L142-S214 VanDerWaalsContact CD1-O 3.32Å; L142-S214 WeakPolarHBondContact CD1-O 3.25Å; P207-S214 VanDerWaalsContact CG-CB 3.44Å; N210-S214 PolarHBondContact O-N 3.16Å; N210-S214 VanDerWaalsContact O-N 3.07Å; N210-S214 PolarHBondContact O-OG 3.2Å; L211-S214 PolarHBondContact O-N 3.37Å
215	L	93.8	Very high	93.6	Very high	25 Å²	25	69.6 Å²	69.6	13%	0.131	37%	0.367	C	S	.	.	H	α-helix	trans	-98.7	-4.2	-176.6	-68.1	175.1	0	0	0	114.9	L142 A164 L211 N212 V213 G217 F218 L228 A229	L142-L215 HydrophobicContact CD1-CD2 4.1Å; A164-L215 HydrophobicContact CB-CD2 3.95Å; L211-L215 HydrophobicContact CD1-CD1 3.81Å; L211-L215 HydrophobicContact CD1-CG 4.15Å; L211-L215 HydrophobicContact CG-CD1 3.84Å; L211-L215 HydrophobicContact CG-CG 4.49Å; L211-L215 WeakPolarHBondContact O-CB 3.42Å; L211-L215 VanDerWaalsContact O-CG 3.23Å; L211-L215 WeakPolarHBondContact O-CG 3.04Å; L211-L215 PolarHBondContact O-N 3.14Å; L211-L215 VanDerWaalsContact O-N 3.17Å; N212-L215 PolarHBondContact O-N 3.24Å; V213-L215 PolarHBondContact O-N 2.73Å; V213-L215 VanDerWaalsContact O-N 3.16Å; L215-G217 PolarHBondContact O-N 3Å; L215-G217 VanDerWaalsContact O-N 3.13Å; L215-F218 HydrophobicContact CD2-CB 4.43Å; L215-F218 PolarHBondContact O-N 3.19Å; L215-L228 HydrophobicContact CD1-CB 4.03Å; L215-L228 HydrophobicContact CD1-CD2 4.22Å; L215-L228 HydrophobicContact CD1-CG 4.39Å; L215-L228 HydrophobicContact CD2-CD2 4.17Å; L215-A229 HydrophobicContact CD1-CB 4.26Å
216	E	91.6	Very high	93.4	Very high	138 Å²	138	70.2 Å²	70.2	65%	0.645	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.1	-32.4	-176.8	-71.1	179	-178.5	0	0	113.9	K161 N212 V213 F218	K161-E216 PolarHBondContact NZ-O 2.95Å; K161-E216 VanDerWaalsContact NZ-O 3.1Å; N212-E216 PolarHBondContact O-N 3.24Å; V213-E216 PolarHBondContact O-N 2.87Å; E216-F218 VanDerWaalsContact C-N 3.32Å
217	G	92.6	Very high	93.2	Very high	28 Å²	28	69.2 Å²	69.2	29%	0.289	37%	0.372	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.1	-0.4	176.6	0	0	0	0	0	115.1	L215	L215-G217 PolarHBondContact O-N 3Å; L215-G217 VanDerWaalsContact O-N 3.13Å
218	F	96.3	Very high	93.2	Very high	24 Å²	24	68.6 Å²	68.6	11%	0.105	37%	0.368	C	S	.	.			trans	-118.2	150.8	-172.6	-65.7	-93.5	0	0	0	111.8	L142 S143 P162 A164 L215 E216	L142-F218 HydrophobicContact CB-CE1 4.43Å; L142-F218 HydrophobicContact CB-CE2 3.86Å; L142-F218 HydrophobicContact CB-CZ 3.62Å; L142-F218 HydrophobicContact CD1-CD2 4.27Å; L142-F218 HydrophobicContact CD1-CE2 3.94Å; L142-F218 HydrophobicContact CD1-CZ 4.4Å; L142-F218 HydrophobicContact CG-CE2 4.43Å; L142-F218 HydrophobicContact CG-CZ 4.42Å; S143-F218 WeakPolarHBondContact O-CE1 3.28Å; P162-F218 HydrophobicContact CB-CD1 3.9Å; P162-F218 HydrophobicContact CB-CE1 3.9Å; P162-F218 HydrophobicContact CG-CD1 3.56Å; P162-F218 HydrophobicContact CG-CE1 3.56Å; P162-F218 HydrophobicContact CG-CG 4.33Å; P162-F218 HydrophobicContact CG-CZ 4.33Å; P162-F218 VanDerWaalsContact O-CA 3.32Å; P162-F218 WeakPolarHBondContact O-CA 3.33Å; A164-F218 HydrophobicContact CB-CB 3.86Å; A164-F218 HydrophobicContact CB-CD1 3.78Å; A164-F218 HydrophobicContact CB-CG 3.96Å; L215-F218 HydrophobicContact CD2-CB 4.43Å; L215-F218 PolarHBondContact O-N 3.19Å; E216-F218 VanDerWaalsContact C-N 3.32Å
219	S	96.9	Very high	93.4	Very high	19 Å²	19	60.1 Å²	60.1	13%	0.133	33%	0.33	C	S	.	.	B	Isolated β-bridge	trans	-96.7	151.3	169.2	-77.9	0	0	0	0	110.8	D156 S159 P162 I163 A164	D156-S219 PolarHBondContact OD2-OG 3.33Å; S159-S219 PolarHBondContact OG-OG 2.67Å; S159-S219 VanDerWaalsContact OG-OG 3.08Å; P162-S219 PolarHBondContact O-N 3.49Å; I163-S219 CarbonylContact C-O 3.58Å; I163-S219 WeakPolarHBondContact CA-O 3.34Å; A164-S219 PolarHBondContact N-O 3.31Å
220	K	96.3	Very high	93.7	Very high	94 Å²	94	60.7 Å²	60.7	41%	0.409	32%	0.315	S	S	.	.	P	Polyproline II helix	trans	-68.3	159.7	166.9	64	171.7	178	163.9	0	110.2	W224 Q225	K220-W224 HydrophobicContact CD-CB 4.39Å; K220-W224 WeakPolarHBondContact CD-O 3.46Å; K220-W224 WeakPolarHBondContact CE-O 3.48Å; K220-W224 PolarHBondContact NZ-O 2.8Å; K220-Q225 PolarHBondContact NZ-O 3Å
221	P	97.1	Very high	93.8	Very high	1 Å²	1	57.6 Å²	57.6	1%	0.006	30%	0.299	C	S	.	.	P	Polyproline II helix	trans	-60.5	148.1	172.5	-22	34.3	0	0	0	111.9	I163 P165 N171 F223 W224	I163-P221 HydrophobicContact CG2-CB 4.06Å; I163-P221 HydrophobicContact CG2-CG 3.86Å; P165-P221 HydrophobicContact CG-CG 4.16Å; P165-P221 WeakPolarHBondContact O-CG 3.4Å; N171-P221 HydrophobicContact CB-CB 4.24Å; P221-F223 VanDerWaalsContact C-N 3.29Å; P221-F223 PolarHBondContact O-N 2.92Å; P221-W224 HydrophobicContact CB-CB 4.39Å; P221-W224 HydrophobicContact CB-CD2 4.06Å; P221-W224 HydrophobicContact CB-CG 3.77Å; P221-W224 HydrophobicContact CG-CD2 3.59Å; P221-W224 HydrophobicContact CG-CE3 4.05Å; P221-W224 HydrophobicContact CG-CG 3.86Å; P221-W224 HydrophobicContact CG-CH2 4.46Å; P221-W224 HydrophobicContact CG-CZ2 4.03Å; P221-W224 HydrophobicContact CG-CZ3 4.46Å; P221-W224 WeakPolarHBondContact O-CB 3.2Å; P221-W224 PolarHBondContact O-N 3.33Å
222	I	95.3	Very high	94	Very high	75 Å²	75	56.8 Å²	56.8	39%	0.385	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.5	-42.2	-169.2	-55.7	177	0	0	0	112	F153 P157 I163 N171	F153-I222 HydrophobicContact CD1-CD1 3.96Å; F153-I222 HydrophobicContact CE1-CD1 4.36Å; P157-I222 HydrophobicContact CG-CD1 4.46Å; I163-I222 HydrophobicContact CD1-CD1 4.46Å; I163-I222 HydrophobicContact CD1-CG1 4.02Å; N171-I222 PolarHBondContact OD1-N 3.38Å
223	F	93.5	Very high	93.9	Very high	130 Å²	130	56.7 Å²	56.7	57%	0.57	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.4	5.6	-177.6	-57.1	-42.7	0	0	0	114.3	N171 P221	N171-F223 WeakPolarHBondContact ND2-CD2 3.13Å; N171-F223 VanDerWaalsContact ND2-CE2 3.34Å; N171-F223 WeakPolarHBondContact ND2-CE2 3.41Å; N171-F223 PolarHBondContact OD1-N 2.85Å; P221-F223 VanDerWaalsContact C-N 3.29Å; P221-F223 PolarHBondContact O-N 2.92Å
224	W	95.1	Very high	93.9	Very high	15 Å²	15	60.7 Å²	60.7	6%	0.057	31%	0.312	C	S	.	.			trans	-82.1	131.9	178.2	-75.6	26.3	0	0	0	111	P165 A170 L173 K220 P221 K226 L228 L231 L246	P165-W224 HydrophobicContact CG-CH2 3.54Å; P165-W224 HydrophobicContact CG-CZ2 3.75Å; P165-W224 HydrophobicContact CG-CZ3 4.37Å; A170-W224 PolarHBondContact O-NE1 2.91Å; L173-W224 HydrophobicContact CB-CZ2 4.12Å; L173-W224 HydrophobicContact CD2-CH2 4.1Å; L173-W224 HydrophobicContact CD2-CZ2 3.59Å; L173-W224 HydrophobicContact CG-CZ2 4.47Å; K220-W224 HydrophobicContact CD-CB 4.39Å; K220-W224 WeakPolarHBondContact CD-O 3.46Å; K220-W224 WeakPolarHBondContact CE-O 3.48Å; K220-W224 PolarHBondContact NZ-O 2.8Å; P221-W224 HydrophobicContact CB-CB 4.39Å; P221-W224 HydrophobicContact CB-CD2 4.06Å; P221-W224 HydrophobicContact CB-CG 3.77Å; P221-W224 HydrophobicContact CG-CD2 3.59Å; P221-W224 HydrophobicContact CG-CE3 4.05Å; P221-W224 HydrophobicContact CG-CG 3.86Å; P221-W224 HydrophobicContact CG-CH2 4.46Å; P221-W224 HydrophobicContact CG-CZ2 4.03Å; P221-W224 HydrophobicContact CG-CZ3 4.46Å; P221-W224 WeakPolarHBondContact O-CB 3.2Å; P221-W224 PolarHBondContact O-N 3.33Å; W224-K226 WeakPolarHBondContact CB-O 3.42Å; W224-L228 HydrophobicContact CH2-CD1 4.15Å; W224-L228 HydrophobicContact CZ3-CB 4.27Å; W224-L228 HydrophobicContact CZ3-CD1 4.06Å; W224-L231 HydrophobicContact CE3-CD2 4.37Å; W224-L231 HydrophobicContact CH2-CD1 4.18Å; W224-L231 HydrophobicContact CZ3-CD1 4.09Å; W224-L231 HydrophobicContact CZ3-CD2 3.98Å; W224-L231 HydrophobicContact CZ3-CG 4.32Å; W224-L246 HydrophobicContact CH2-CD1 4.04Å; W224-L246 HydrophobicContact CH2-CD2 4.43Å; W224-L246 HydrophobicContact CZ2-CD1 4Å
225	Q	90.4	Very high	93.9	Very high	130 Å²	130	61.4 Å²	61.4	61%	0.607	31%	0.313	S	S	*	.	S	Bend	trans	-77	-40.1	171.9	-62.9	-59.1	-24.8	0	0	111	K220	K220-Q225 PolarHBondContact NZ-O 3Å
226	K	92.4	Very high	93.8	Very high	133 Å²	133	65 Å²	65	58%	0.578	34%	0.338	S	S	*	.	S	Bend	trans	-108.4	149.5	-179.2	-61.8	-174.2	-179.6	-174.2	0	111.3	W224 D230	W224-K226 WeakPolarHBondContact CB-O 3.42Å; K226-D230 HydrophobicContact CB-CB 4.09Å
227	G	93.6	Very high	93.8	Very high	17 Å²	17	64.4 Å²	64.4	18%	0.175	34%	0.339	C	S	.	.			trans	-72.4	169.2	173.5	0	0	0	0	0	112.4	A229 D230	G227-A229 PolarHBondContact O-N 2.69Å; G227-D230 PolarHBondContact O-N 3.25Å
228	L	94.4	Very high	93.9	Very high	4 Å²	4	63 Å²	63	2%	0.021	33%	0.325	C	S	.	.	G	3₁₀ helix	trans	-59.6	-34.7	177.8	-177	61.6	0	0	0	112.9	L215 W224 D230 L231 G240 F241 L246	L215-L228 HydrophobicContact CD1-CB 4.03Å; L215-L228 HydrophobicContact CD1-CD2 4.22Å; L215-L228 HydrophobicContact CD1-CG 4.39Å; L215-L228 HydrophobicContact CD2-CD2 4.17Å; W224-L228 HydrophobicContact CH2-CD1 4.15Å; W224-L228 HydrophobicContact CZ3-CB 4.27Å; W224-L228 HydrophobicContact CZ3-CD1 4.06Å; L228-D230 VanDerWaalsContact C-N 3.28Å; L228-D230 PolarHBondContact O-N 2.82Å; L228-L231 HydrophobicContact CD1-CD1 3.8Å; L228-G240 VanDerWaalsContact CD1-C 3.42Å; L228-G240 WeakPolarHBondContact O-CA 3.45Å; L228-G240 PolarHBondContact O-N 3.3Å; L228-F241 HydrophobicContact CD2-CD1 3.95Å; L228-F241 HydrophobicContact CD2-CD2 3.82Å; L228-F241 HydrophobicContact CD2-CE1 3.65Å; L228-F241 HydrophobicContact CD2-CE2 3.49Å; L228-F241 VanDerWaalsContact CD2-CE2 3.49Å; L228-F241 HydrophobicContact CD2-CG 4.04Å; L228-F241 HydrophobicContact CD2-CZ 3.39Å; L228-L246 HydrophobicContact CD1-CD2 3.98Å
229	A	93.6	Very high	93.9	Very high	14 Å²	14	62.9 Å²	62.9	12%	0.116	33%	0.326	C	S	.	.	G	3₁₀ helix	trans	-77.4	-9.1	176.1	0	0	0	0	0	114.5	L211 N212 L215 G227 N239	L211-A229 HydrophobicContact CD2-CB 3.98Å; L211-A229 HydrophobicContact CG-CB 4.28Å; N212-A229 WeakPolarHBondContact OD1-CB 2.93Å; L215-A229 HydrophobicContact CD1-CB 4.26Å; G227-A229 PolarHBondContact O-N 2.69Å; A229-N239 PolarHBondContact O-ND2 3.45Å; A229-N239 PolarHBondContact O-OD1 3.24Å
230	D	94.5	Very high	93.9	Very high	88 Å²	88	62 Å²	62	47%	0.471	32%	0.319	S	S	.	.	G	3₁₀ helix	trans	-109.5	12.1	-176.5	-58.5	-50.1	0	0	0	112.5	K226 G227 L228	K226-D230 HydrophobicContact CB-CB 4.09Å; G227-D230 PolarHBondContact O-N 3.25Å; L228-D230 VanDerWaalsContact C-N 3.28Å; L228-D230 PolarHBondContact O-N 2.82Å
231	L	94.5	Very high	93.9	Very high	35 Å²	35	57.5 Å²	57.5	18%	0.183	30%	0.3	C	S	.	.	S	Bend	trans	-67.7	-43.2	-178.9	-69.3	-177.6	0	0	0	111.8	W224 L228 N239 N243 L246	W224-L231 HydrophobicContact CE3-CD2 4.37Å; W224-L231 HydrophobicContact CH2-CD1 4.18Å; W224-L231 HydrophobicContact CZ3-CD1 4.09Å; W224-L231 HydrophobicContact CZ3-CD2 3.98Å; W224-L231 HydrophobicContact CZ3-CG 4.32Å; L228-L231 HydrophobicContact CD1-CD1 3.8Å; L231-N239 PolarHBondContact N-OD1 3.18Å; L231-N243 HydrophobicContact CB-CB 4.24Å; L231-N243 HydrophobicContact CD1-CB 3.81Å; L231-L246 HydrophobicContact CD1-CB 4.46Å; L231-L246 HydrophobicContact CD1-CD2 4.43Å
232	D	94.4	Very high	93.9	Very high	6 Å²	6	59.4 Å²	59.4	3%	0.032	31%	0.309	C	S	.	.			trans	-148	76.3	175.2	-153.7	17.4	0	0	0	111.5	K191 E234 N235 N238 N239	K191-D232 IonicContact NZ-OD1 3.23Å; K191-D232 PolarHBondContact NZ-OD1 2.77Å; D232-E234 PolarHBondContact O-N 3.14Å; D232-N235 CarbonylContact O-C 3.59Å; D232-N235 PolarHBondContact O-N 3.13Å; D232-N235 VanDerWaalsContact O-N 3.16Å; D232-N238 WeakPolarHBondContact CB-O 3.17Å; D232-N238 PolarHBondContact OD2-ND2 3.36Å; D232-N239 PolarHBondContact N-OD1 3.46Å
233	P	90.8	Very high	94	Very high	93 Å²	93	56.1 Å²	56.1	60%	0.604	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.8	-19.9	-175.5	26.8	-35.2	0	0	0	113.5	N235	P233-N235 VanDerWaalsContact C-N 3.32Å
234	E	91.6	Very high	94.2	Very high	173 Å²	173	50.2 Å²	50.2	81%	0.808	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.2	-21.5	178	-63.2	178	177.5	0	0	112.9	D232	D232-E234 PolarHBondContact O-N 3.14Å
235	N	93.4	Very high	94.4	Very high	48 Å²	48	51 Å²	51	26%	0.257	27%	0.271	S	S	.	.			trans	-135.8	98.5	-175.4	-173.7	-5.3	0	0	0	111.5	D232 P233 D237 N238 N239	D232-N235 CarbonylContact O-C 3.59Å; D232-N235 PolarHBondContact O-N 3.13Å; D232-N235 VanDerWaalsContact O-N 3.16Å; P233-N235 VanDerWaalsContact C-N 3.32Å; N235-D237 PolarHBondContact O-N 2.92Å; N235-D237 PolarHBondContact OD1-N 3.03Å; N235-D237 VanDerWaalsContact OD1-N 3.13Å; N235-N238 HydrophobicContact CB-CB 4.14Å; N235-N238 CarbonylContact O-C 3.57Å; N235-N238 PolarHBondContact O-N 3.28Å; N235-N239 PolarHBondContact O-N 3.04Å
236	P	91	Very high	94.7	Very high	99 Å²	99	44.8 Å²	44.8	64%	0.643	24%	0.242	S	C	*	.	G	3₁₀ helix	trans	-55.6	-35.4	178.8	-26.2	35.1	0	0	0	113.9	N238 N239	P236-N238 PolarHBondContact O-N 3.28Å; P236-N239 PolarHBondContact O-N 3.21Å
237	D	91.9	Very high	95	Very high	126 Å²	126	38.5 Å²	38.5	67%	0.674	22%	0.215	S	C	*	.	G	3₁₀ helix	trans	-74.3	-3.9	179.6	-63.6	-31.5	0	0	0	113.5	K200 N235	K200-D237 VanDerWaalsContact CE-O 3.28Å; K200-D237 WeakPolarHBondContact CE-O 3.44Å; K200-D237 PolarHBondContact NZ-O 3.35Å; N235-D237 PolarHBondContact O-N 2.92Å; N235-D237 PolarHBondContact OD1-N 3.03Å; N235-D237 VanDerWaalsContact OD1-N 3.13Å
238	N	95.7	Very high	95.3	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	21%	0.213	C	C	.	.	G	3₁₀ helix	trans	-127.9	26.3	177.4	-166.3	47.4	0	0	0	111.9	T192 D232 N235 P236 N243 E244	T192-N238 HydrophobicContact CG2-CB 4.17Å; D232-N238 WeakPolarHBondContact CB-O 3.17Å; D232-N238 PolarHBondContact OD2-ND2 3.36Å; N235-N238 HydrophobicContact CB-CB 4.14Å; N235-N238 CarbonylContact O-C 3.57Å; N235-N238 PolarHBondContact O-N 3.28Å; P236-N238 PolarHBondContact O-N 3.28Å; N238-N243 VanDerWaalsContact O-CA 3.31Å; N238-N243 WeakPolarHBondContact O-CA 3.42Å; N238-N243 WeakPolarHBondContact O-CB 3.26Å; N238-N243 PolarHBondContact O-ND2 3.39Å; N238-E244 WeakPolarHBondContact OD1-CB 3.44Å; N238-E244 WeakPolarHBondContact OD1-CG 3.29Å; N238-E244 PolarHBondContact OD1-N 2.72Å
239	N	95.6	Very high	95.4	Very high	21 Å²	21	38.5 Å²	38.5	11%	0.112	21%	0.212	C	C	.	.	S	Bend	trans	-118.1	162.7	-178.2	-157.9	20.6	0	0	0	112.4	N206 A229 L231 D232 N235 P236 Q242	N206-N239 PolarHBondContact ND2-O 2.98Å; A229-N239 PolarHBondContact O-ND2 3.45Å; A229-N239 PolarHBondContact O-OD1 3.24Å; L231-N239 PolarHBondContact N-OD1 3.18Å; D232-N239 PolarHBondContact N-OD1 3.46Å; N235-N239 PolarHBondContact O-N 3.04Å; P236-N239 PolarHBondContact O-N 3.21Å; N239-Q242 PolarHBondContact O-N 3.45Å
240	G	96.2	Very high	95.6	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	21%	0.207	C	C	.	.	G	3₁₀ helix	trans	69.3	-145.2	-178.2	0	0	0	0	0	113.7	N206 L228 Q242 N243	N206-G240 WeakPolarHBondContact OD1-CA 3.19Å; L228-G240 VanDerWaalsContact CD1-C 3.42Å; L228-G240 WeakPolarHBondContact O-CA 3.45Å; L228-G240 PolarHBondContact O-N 3.3Å; G240-Q242 PolarHBondContact O-N 3.22Å; G240-N243 VanDerWaalsContact O-CB 3.23Å; G240-N243 WeakPolarHBondContact O-CB 3.36Å; G240-N243 PolarHBondContact O-N 3.18Å; G240-N243 VanDerWaalsContact O-N 3.14Å
241	F	97.1	Very high	95.8	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	20%	0.204	C	C	.	.	G	3₁₀ helix	trans	-61.9	-22.6	175	-66.6	-72.4	0	0	0	112.8	Q137 L138 L142 A164 P165 F204 R205 N206 L228 N243	Q137-F241 HydrophobicContact CG-CE1 4.17Å; Q137-F241 HydrophobicContact CG-CZ 3.88Å; L138-F241 HydrophobicContact CD2-CD1 3.94Å; L138-F241 HydrophobicContact CD2-CE1 4.25Å; L142-F241 HydrophobicContact CD2-CE2 3.89Å; L142-F241 HydrophobicContact CD2-CZ 3.86Å; A164-F241 HydrophobicContact CB-CZ 4.35Å; P165-F241 HydrophobicContact CB-CE1 3.93Å; F204-F241 WeakPolarHBondContact CD1-O 3.29Å; R205-F241 WeakPolarHBondContact O-CB 3.41Å; N206-F241 PolarHBondContact OD1-N 3.44Å; L228-F241 HydrophobicContact CD2-CD1 3.95Å; L228-F241 HydrophobicContact CD2-CD2 3.82Å; L228-F241 HydrophobicContact CD2-CE1 3.65Å; L228-F241 HydrophobicContact CD2-CE2 3.49Å; L228-F241 VanDerWaalsContact CD2-CE2 3.49Å; L228-F241 HydrophobicContact CD2-CG 4.04Å; L228-F241 HydrophobicContact CD2-CZ 3.39Å; F241-N243 VanDerWaalsContact C-N 3.3Å
242	Q	96.8	Very high	95.9	Very high	41 Å²	41	39.1 Å²	39.1	19%	0.192	21%	0.207	C	C	.	.	G	3₁₀ helix	trans	-87.1	2.8	179.3	-62.4	-172.1	-87.2	0	0	113.9	N239 G240 E244	N239-Q242 PolarHBondContact O-N 3.45Å; G240-Q242 PolarHBondContact O-N 3.22Å; Q242-E244 PolarHBondContact O-N 3.33Å
243	N	97.9	Very high	96.1	Very high	5 Å²	5	39.7 Å²	39.7	3%	0.027	21%	0.212	C	C	.	.			trans	-60.9	124.4	172.4	177.9	-93.2	0	0	0	111	L231 N238 G240 F241 D245 L246 I247	L231-N243 HydrophobicContact CB-CB 4.24Å; L231-N243 HydrophobicContact CD1-CB 3.81Å; N238-N243 VanDerWaalsContact O-CA 3.31Å; N238-N243 WeakPolarHBondContact O-CA 3.42Å; N238-N243 WeakPolarHBondContact O-CB 3.26Å; N238-N243 PolarHBondContact O-ND2 3.39Å; G240-N243 VanDerWaalsContact O-CB 3.23Å; G240-N243 WeakPolarHBondContact O-CB 3.36Å; G240-N243 PolarHBondContact O-N 3.18Å; G240-N243 VanDerWaalsContact O-N 3.14Å; F241-N243 VanDerWaalsContact C-N 3.3Å; N243-D245 VanDerWaalsContact C-N 3.34Å; N243-D245 PolarHBondContact O-N 3Å; N243-D245 WeakPolarHBondContact OD1-CB 3.2Å; N243-D245 PolarHBondContact OD1-N 3.1Å; N243-L246 HydrophobicContact CB-CB 4.24Å; N243-L246 WeakPolarHBondContact O-CB 3.12Å; N243-L246 PolarHBondContact O-N 3.4Å; N243-L246 PolarHBondContact OD1-N 2.86Å; N243-I247 WeakPolarHBondContact O-CG1 3.27Å; N243-I247 PolarHBondContact O-N 3.41Å
244	E	98.1	Very high	96.3	Very high	7 Å²	7	39.2 Å²	39.2	3%	0.033	22%	0.217	C	C	.	.	H	α-helix	trans	-70.8	-27.2	-172.4	-68.5	-171.8	-143	0	0	113.6	G193 I194 A195 K200 N238 Q242 I247 V248	G193-E244 WeakPolarHBondContact CA-OE2 3.31Å; G193-E244 VanDerWaalsContact N-CD 3.29Å; G193-E244 PolarHBondContact N-OE1 2.75Å; G193-E244 VanDerWaalsContact N-OE1 3.09Å; G193-E244 PolarHBondContact N-OE2 2.75Å; I194-E244 HydrophobicContact CD1-CB 3.97Å; I194-E244 HydrophobicContact CG1-CB 3.55Å; I194-E244 WeakPolarHBondContact CG1-OE2 3.23Å; I194-E244 PolarHBondContact N-OE2 3.37Å; A195-E244 HydrophobicContact CB-CB 3.92Å; A195-E244 HydrophobicContact CB-CG 3.78Å; A195-E244 PolarHBondContact N-OE2 3.13Å; K200-E244 HydrophobicContact CD-CG 3.93Å; K200-E244 IonicContact NZ-OE1 2.8Å; K200-E244 PolarHBondContact NZ-OE1 3Å; N238-E244 WeakPolarHBondContact OD1-CB 3.44Å; N238-E244 WeakPolarHBondContact OD1-CG 3.29Å; N238-E244 PolarHBondContact OD1-N 2.72Å; Q242-E244 PolarHBondContact O-N 3.33Å; E244-I247 PolarHBondContact O-N 3.07Å; E244-V248 WeakPolarHBondContact O-CB 3.35Å; E244-V248 VanDerWaalsContact O-CG2 3.25Å; E244-V248 WeakPolarHBondContact O-CG2 3.39Å; E244-V248 PolarHBondContact O-N 3.24Å
245	D	97.9	Very high	96.6	Very high	31 Å²	31	36.5 Å²	36.5	17%	0.166	21%	0.207	C	C	.	.	H	α-helix	trans	-64.9	-43.1	172.8	-78.5	-40.6	0	0	0	110.8	I194 N243 W249 R263	I194-D245 WeakPolarHBondContact CD1-OD1 3.34Å; N243-D245 VanDerWaalsContact C-N 3.34Å; N243-D245 PolarHBondContact O-N 3Å; N243-D245 WeakPolarHBondContact OD1-CB 3.2Å; N243-D245 PolarHBondContact OD1-N 3.1Å; D245-W249 WeakPolarHBondContact O-CB 3.46Å; D245-W249 PolarHBondContact O-N 3.11Å; D245-R263 IonicContact OD1-CZ 3.33Å; D245-R263 IonicContact OD1-NH1 2.91Å; D245-R263 PolarHBondContact OD1-NH1 3.11Å; D245-R263 IonicContact OD1-NH2 2.8Å; D245-R263 IonicContact OD2-CZ 2.65Å; D245-R263 IonicContact OD2-NH1 3.77Å; D245-R263 PolarHBondContact OD2-NH1 3.23Å; D245-R263 IonicContact OD2-NH2 3.68Å; D245-R263 PolarHBondContact OD2-NH2 3.31Å
246	L	98	Very high	96.8	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-60.6	-49.1	173.1	177.9	63.8	0	0	0	111	L173 W224 L228 L231 N243 V248 W249 M250	L173-L246 HydrophobicContact CD1-CD1 4.41Å; L173-L246 HydrophobicContact CD2-CD1 4.43Å; W224-L246 HydrophobicContact CH2-CD1 4.04Å; W224-L246 HydrophobicContact CH2-CD2 4.43Å; W224-L246 HydrophobicContact CZ2-CD1 4Å; L228-L246 HydrophobicContact CD1-CD2 3.98Å; L231-L246 HydrophobicContact CD1-CB 4.46Å; L231-L246 HydrophobicContact CD1-CD2 4.43Å; N243-L246 HydrophobicContact CB-CB 4.24Å; N243-L246 WeakPolarHBondContact O-CB 3.12Å; N243-L246 PolarHBondContact O-N 3.4Å; N243-L246 PolarHBondContact OD1-N 2.86Å; L246-V248 VanDerWaalsContact C-N 3.35Å; L246-V248 PolarHBondContact O-N 3.12Å; L246-W249 WeakPolarHBondContact O-CB 3.37Å; L246-W249 PolarHBondContact O-N 3.29Å; L246-W249 VanDerWaalsContact O-N 3.11Å; L246-M250 HydrophobicContact CD1-CG 3.86Å; L246-M250 HydrophobicContact CD1-SD 4.29Å; L246-M250 HydrophobicContact CG-CG 4.15Å; L246-M250 WeakPolarHBondContact O-CB 3.43Å; L246-M250 VanDerWaalsContact O-CG 3.26Å; L246-M250 WeakPolarHBondContact O-CG 3.32Å; L246-M250 PolarHBondContact O-N 3.4Å
247	I	98.3	Very high	97.1	Very high	1 Å²	1	34 Å²	34	1%	0.005	20%	0.195	C	C	.	.	H	α-helix	trans	-59.4	-45.6	-179.3	-65.1	168.5	0	0	0	111.2	A195 D199 K200 F204 N243 E244 W249 M250 R251	A195-I247 HydrophobicContact CB-CB 4.05Å; A195-I247 HydrophobicContact CB-CD1 4.41Å; A195-I247 HydrophobicContact CB-CG2 3.75Å; D199-I247 HydrophobicContact CB-CG2 3.72Å; K200-I247 HydrophobicContact CB-CD1 4.1Å; K200-I247 HydrophobicContact CG-CD1 4.1Å; F204-I247 HydrophobicContact CB-CD1 3.96Å; F204-I247 HydrophobicContact CB-CG1 4.03Å; F204-I247 HydrophobicContact CD1-CG1 3.88Å; F204-I247 HydrophobicContact CD2-CB 4.46Å; F204-I247 HydrophobicContact CD2-CD1 4.31Å; F204-I247 HydrophobicContact CD2-CG1 3.83Å; F204-I247 HydrophobicContact CD2-CG2 4Å; F204-I247 HydrophobicContact CE1-CG1 4.27Å; F204-I247 HydrophobicContact CE2-CB 4.47Å; F204-I247 HydrophobicContact CE2-CG1 4.25Å; F204-I247 HydrophobicContact CE2-CG2 3.91Å; F204-I247 HydrophobicContact CG-CD1 4.11Å; F204-I247 HydrophobicContact CG-CG1 3.64Å; F204-I247 HydrophobicContact CZ-CG1 4.46Å; F204-I247 HydrophobicContact CZ-CG2 4.47Å; N243-I247 WeakPolarHBondContact O-CG1 3.27Å; N243-I247 PolarHBondContact O-N 3.41Å; E244-I247 PolarHBondContact O-N 3.07Å; I247-W249 VanDerWaalsContact C-N 3.28Å; I247-W249 PolarHBondContact O-N 3.23Å; I247-M250 PolarHBondContact O-N 3.06Å; I247-R251 PolarHBondContact O-N 3.02Å
248	V	98.4	Very high	97.3	Very high	20 Å²	20	28.8 Å²	28.8	12%	0.121	17%	0.166	C	C	.	.	H	α-helix	trans	-62	-38.6	177.4	169.5	0	0	0	0	111.1	I194 A195 E244 L246 K260 L261	I194-V248 HydrophobicContact CB-CG2 4.49Å; I194-V248 HydrophobicContact CD1-CG2 4.3Å; I194-V248 HydrophobicContact CG1-CG2 4.06Å; A195-V248 HydrophobicContact CB-CG2 4.35Å; E244-V248 WeakPolarHBondContact O-CB 3.35Å; E244-V248 VanDerWaalsContact O-CG2 3.25Å; E244-V248 WeakPolarHBondContact O-CG2 3.39Å; E244-V248 PolarHBondContact O-N 3.24Å; L246-V248 VanDerWaalsContact C-N 3.35Å; L246-V248 PolarHBondContact O-N 3.12Å; V248-K260 HydrophobicContact CG1-CB 3.77Å; V248-K260 HydrophobicContact CG1-CD 4.32Å; V248-K260 HydrophobicContact CG1-CG 4.12Å; V248-K260 PolarHBondContact O-NZ 3.31Å; V248-L261 WeakPolarHBondContact CG1-O 3.48Å
249	W	98.3	Very high	97.4	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-67.3	-47.9	176.8	-177.4	-106	0	0	0	112.7	Y117 L119 Y122 Q124 Y129 I169 S172 L173 F174 D245 L246 I247 R251 F258 K260	Y117-W249 HydrophobicContact CE2-CE3 4.29Å; Y117-W249 HydrophobicContact CE2-CZ3 4.16Å; L119-W249 HydrophobicContact CD1-CH2 3.95Å; L119-W249 HydrophobicContact CD1-CZ3 3.96Å; Y122-W249 HydrophobicContact CE1-CH2 4.06Å; Y122-W249 HydrophobicContact CE1-CZ2 4.16Å; Q124-W249 VanDerWaalsContact NE2-CH2 3.32Å; Y129-W249 WeakPolarHBondContact OH-CZ2 3.44Å; I169-W249 PolarHBondContact O-NE1 3.15Å; S172-W249 VanDerWaalsContact O-CE2 3.3Å; S172-W249 WeakPolarHBondContact O-CZ2 3.17Å; L173-W249 HydrophobicContact CD1-CB 3.38Å; L173-W249 HydrophobicContact CD1-CD2 4.26Å; L173-W249 HydrophobicContact CD1-CG 3.45Å; L173-W249 VanDerWaalsContact CD1-CG 3.45Å; F174-W249 HydrophobicContact CB-CE3 3.84Å; F174-W249 HydrophobicContact CB-CH2 4.41Å; F174-W249 HydrophobicContact CB-CZ3 3.78Å; D245-W249 WeakPolarHBondContact O-CB 3.46Å; D245-W249 PolarHBondContact O-N 3.11Å; L246-W249 WeakPolarHBondContact O-CB 3.37Å; L246-W249 PolarHBondContact O-N 3.29Å; L246-W249 VanDerWaalsContact O-N 3.11Å; I247-W249 VanDerWaalsContact C-N 3.28Å; I247-W249 PolarHBondContact O-N 3.23Å; W249-R251 PolarHBondContact O-N 2.93Å; W249-R251 VanDerWaalsContact O-N 3.12Å; W249-F258 HydrophobicContact CH2-CZ 4.46Å; W249-F258 HydrophobicContact CZ3-CE2 4.31Å; W249-F258 HydrophobicContact CZ3-CZ 4.31Å; W249-K260 HydrophobicContact CE3-CD 3.63Å; W249-K260 HydrophobicContact CZ3-CD 4.1Å; W249-K260 PolarHBondContact O-NZ 3.46Å
250	M	98.1	Very high	97.5	Very high	6 Å²	6	33.3 Å²	33.3	3%	0.03	18%	0.182	C	C	.	.	H	α-helix	trans	-60.8	-23.2	-177.7	-70.5	-58.4	-71.5	0	0	113.5	R133 L138 I169 A170 F204 L246 I247 T252	R133-M250 HydrophobicContact CB-CE 4.03Å; L138-M250 HydrophobicContact CD1-CE 3.8Å; L138-M250 HydrophobicContact CD2-CE 4.23Å; I169-M250 HydrophobicContact CB-CE 4.17Å; I169-M250 HydrophobicContact CB-SD 3.95Å; I169-M250 HydrophobicContact CG2-CE 4.16Å; I169-M250 HydrophobicContact CG2-SD 3.53Å; I169-M250 VanDerWaalsContact CG2-SD 3.53Å; A170-M250 HydrophobicContact CB-CE 4.36Å; A170-M250 HydrophobicContact CB-SD 3.77Å; F204-M250 HydrophobicContact CE1-CB 4.07Å; F204-M250 HydrophobicContact CE1-CG 4.08Å; F204-M250 HydrophobicContact CZ-CB 3.75Å; F204-M250 HydrophobicContact CZ-CG 4.29Å; L246-M250 HydrophobicContact CD1-CG 3.86Å; L246-M250 HydrophobicContact CD1-SD 4.29Å; L246-M250 HydrophobicContact CG-CG 4.15Å; L246-M250 WeakPolarHBondContact O-CB 3.43Å; L246-M250 VanDerWaalsContact O-CG 3.26Å; L246-M250 WeakPolarHBondContact O-CG 3.32Å; L246-M250 PolarHBondContact O-N 3.4Å; I247-M250 PolarHBondContact O-N 3.06Å; M250-T252 PolarHBondContact O-N 2.92Å; M250-T252 VanDerWaalsContact O-N 3.07Å
251	R	97.6	Very high	97.6	Very high	104 Å²	104	34.6 Å²	34.6	39%	0.392	19%	0.189	S	C	.	.	S	Bend	trans	-73.3	94.9	168.9	-174	179.9	-74.4	-155	-0.5	110.9	D199 I247 W249 A253 K260	D199-R251 VanDerWaalsContact CG-NH2 3.28Å; D199-R251 IonicContact OD1-NH2 2.81Å; D199-R251 PolarHBondContact OD1-NH2 3.12Å; D199-R251 IonicContact OD2-CZ 2.69Å; D199-R251 IonicContact OD2-NE 3.32Å; D199-R251 PolarHBondContact OD2-NE 3.39Å; D199-R251 IonicContact OD2-NH2 3.44Å; D199-R251 PolarHBondContact OD2-NH2 3.2Å; I247-R251 PolarHBondContact O-N 3.02Å; W249-R251 PolarHBondContact O-N 2.93Å; W249-R251 VanDerWaalsContact O-N 3.12Å; R251-A253 PolarHBondContact O-N 2.73Å; R251-K260 PolarHBondContact O-NZ 2.82Å
252	T	97	Very high	97.7	Very high	40 Å²	40	35.2 Å²	35.2	25%	0.245	19%	0.191	C	C	.	.			trans	-58.4	133.7	-178.9	54.6	0	0	0	0	113	Y129 V130 I169 M250	Y129-T252 HydrophobicContact CD1-CG2 4.5Å; Y129-T252 HydrophobicContact CE1-CG2 4.41Å; V130-T252 HydrophobicContact CG2-CG2 4.3Å; I169-T252 HydrophobicContact CD1-CG2 3.79Å; I169-T252 HydrophobicContact CG1-CG2 4.45Å; M250-T252 PolarHBondContact O-N 2.92Å; M250-T252 VanDerWaalsContact O-N 3.07Å
253	A	97.7	Very high	97.7	Very high	18 Å²	18	34.2 Å²	34.2	15%	0.149	19%	0.186	C	C	.	.			trans	-75.5	147.6	172.5	0	0	0	0	0	112	Q124 R251 F258	Q124-A253 HydrophobicContact CB-CB 4.4Å; R251-A253 PolarHBondContact O-N 2.73Å; A253-F258 HydrophobicContact CB-CB 3.46Å; A253-F258 VanDerWaalsContact CB-CB 3.46Å; A253-F258 HydrophobicContact CB-CD1 3.66Å; A253-F258 HydrophobicContact CB-CD2 4.1Å; A253-F258 HydrophobicContact CB-CE1 4.39Å; A253-F258 HydrophobicContact CB-CG 3.47Å; A253-F258 VanDerWaalsContact CB-CG 3.47Å
254	A	96.7	Very high	97.5	Very high	84 Å²	84	37.9 Å²	37.9	69%	0.694	20%	0.199	S	C	*	.	S	Bend	trans	-78.5	-21.2	179.7	0	0	0	0	0	113.9	N125	N125-A254 PolarHBondContact ND2-O 2.81Å
255	L	97	Very high	97.3	Very high	115 Å²	115	37.8 Å²	37.8	60%	0.602	20%	0.199	S	C	*	.	S	Bend	trans	-121.8	152.8	-175.4	-64.8	174.7	0	0	0	110.6	S257	L255-S257 PolarHBondContact O-N 2.7Å
256	P	96.9	Very high	97	Very high	35 Å²	35	37 Å²	37	23%	0.227	19%	0.194	C	C	.	.	S	Bend	trans	-71	-18.6	179.4	28.4	-35.7	0	0	0	113.9	T120 N121 Y122 Y123	T120-P256 CarbonylContact C-O 3.51Å; N121-P256 PolarHBondContact N-O 2.98Å; Y122-P256 PolarHBondContact N-O 3.01Å; Y122-P256 VanDerWaalsContact O-CA 3.3Å; Y122-P256 WeakPolarHBondContact O-CA 3.48Å; Y123-P256 HydrophobicContact CD1-CB 3.77Å; Y123-P256 HydrophobicContact CD1-CG 4.39Å; Y123-P256 HydrophobicContact CE1-CB 3.72Å; Y123-P256 HydrophobicContact CE1-CG 4.03Å; Y123-P256 HydrophobicContact CG-CB 4.21Å
257	S	97.4	Very high	96.3	Very high	61 Å²	61	40.1 Å²	40.1	43%	0.427	21%	0.209	S	C	.	.	S	Bend	trans	-107.8	113.7	168.9	-69	0	0	0	0	108.6	L119 L255	L119-S257 WeakPolarHBondContact O-CA 3.45Å; L255-S257 PolarHBondContact O-N 2.7Å
258	F	97.6	Very high	95.6	Very high	15 Å²	15	46.1 Å²	46.1	7%	0.066	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	171	-176.4	62.1	-93.6	0	0	0	111.5	G118 L119 Y122 Q124 W249 A253 K260	G118-F258 WeakPolarHBondContact CA-O 3.26Å; L119-F258 HydrophobicContact CB-CE1 4.24Å; L119-F258 HydrophobicContact CB-CE2 4.22Å; L119-F258 HydrophobicContact CB-CZ 3.91Å; L119-F258 HydrophobicContact CD1-CE2 4.23Å; L119-F258 HydrophobicContact CD1-CZ 3.86Å; L119-F258 HydrophobicContact CG-CE2 4.44Å; L119-F258 HydrophobicContact CG-CZ 4.32Å; L119-F258 PolarHBondContact N-O 3.12Å; L119-F258 VanDerWaalsContact N-O 3.08Å; L119-F258 PolarHBondContact O-N 3.4Å; Y122-F258 AromaticContact CD1-CE1 3.78Å; Y122-F258 HydrophobicContact CD1-CE1 3.78Å; Y122-F258 AromaticContact CD1-CZ 3.93Å; Y122-F258 HydrophobicContact CD1-CZ 3.93Å; Y122-F258 HydrophobicContact CG-CE1 4.16Å; Y122-F258 HydrophobicContact CG-CZ 4.34Å; Q124-F258 HydrophobicContact CG-CE1 3.73Å; Q124-F258 HydrophobicContact CG-CZ 3.85Å; W249-F258 HydrophobicContact CH2-CZ 4.46Å; W249-F258 HydrophobicContact CZ3-CE2 4.31Å; W249-F258 HydrophobicContact CZ3-CZ 4.31Å; A253-F258 HydrophobicContact CB-CB 3.46Å; A253-F258 VanDerWaalsContact CB-CB 3.46Å; A253-F258 HydrophobicContact CB-CD1 3.66Å; A253-F258 HydrophobicContact CB-CD2 4.1Å; A253-F258 HydrophobicContact CB-CE1 4.39Å; A253-F258 HydrophobicContact CB-CG 3.47Å; A253-F258 VanDerWaalsContact CB-CG 3.47Å; F258-K260 HydrophobicContact CD2-CD 4.27Å; F258-K260 HydrophobicContact CD2-CG 3.99Å; F258-K260 HydrophobicContact CE2-CD 3.85Å; F258-K260 HydrophobicContact CE2-CG 4.08Å
259	R	97.1	Very high	94.3	Very high	103 Å²	103	48.1 Å²	48.1	39%	0.389	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	148.8	169	68.8	177.9	93.4	-175.8	1.5	108.7	E68 Y116 Y117 I301	E68-R259 IonicContact OE1-NH2 3.36Å; E68-R259 IonicContact OE2-CZ 3.34Å; E68-R259 IonicContact OE2-NH1 3.14Å; E68-R259 PolarHBondContact OE2-NH1 2.95Å; E68-R259 IonicContact OE2-NH2 3.87Å; E68-R259 PolarHBondContact OE2-NH2 3Å; E68-R259 VanDerWaalsContact OE2-NH2 3.14Å; Y116-R259 HydrophobicContact CD1-CG 4.21Å; Y117-R259 CarbonylContact O-C 3.57Å; Y117-R259 VanDerWaalsContact O-CA 3.23Å; Y117-R259 WeakPolarHBondContact O-CA 3.48Å; R259-I301 HydrophobicContact CB-CD1 3.79Å
260	K	98	Very high	93.2	Very high	13 Å²	13	54 Å²	54	6%	0.057	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	139.9	176.5	-78.8	177.9	-176	-71.4	0	108.9	Y116 Y117 Q124 V248 W249 R251 F258 Y262	Y116-K260 WeakPolarHBondContact CA-O 3.25Å; Y116-K260 VanDerWaalsContact CB-O 3.29Å; Y116-K260 WeakPolarHBondContact CB-O 3.48Å; Y117-K260 HydrophobicContact CD2-CB 4.26Å; Y117-K260 HydrophobicContact CE1-CB 3.99Å; Y117-K260 HydrophobicContact CE2-CB 3.58Å; Y117-K260 HydrophobicContact CE2-CD 3.81Å; Y117-K260 HydrophobicContact CE2-CG 4.2Å; Y117-K260 VanDerWaalsContact CZ-CB 3.4Å; Y117-K260 PolarHBondContact N-O 3.39Å; Y117-K260 VanDerWaalsContact N-O 3.08Å; Y117-K260 PolarHBondContact O-N 3.22Å; Y117-K260 WeakPolarHBondContact OH-CB 3.38Å; Y117-K260 WeakPolarHBondContact OH-CD 3.43Å; Q124-K260 VanDerWaalsContact NE2-CE 3.34Å; Q124-K260 VanDerWaalsContact OE1-CE 3.28Å; V248-K260 HydrophobicContact CG1-CB 3.77Å; V248-K260 HydrophobicContact CG1-CD 4.32Å; V248-K260 HydrophobicContact CG1-CG 4.12Å; V248-K260 PolarHBondContact O-NZ 3.31Å; W249-K260 HydrophobicContact CE3-CD 3.63Å; W249-K260 HydrophobicContact CZ3-CD 4.1Å; W249-K260 PolarHBondContact O-NZ 3.46Å; R251-K260 PolarHBondContact O-NZ 2.82Å; F258-K260 HydrophobicContact CD2-CD 4.27Å; F258-K260 HydrophobicContact CD2-CG 3.99Å; F258-K260 HydrophobicContact CE2-CD 3.85Å; F258-K260 HydrophobicContact CE2-CG 4.08Å; K260-Y262 PolarHBondContact O-N 3.28Å
261	L	97.9	Very high	92.4	Very high	28 Å²	28	59.8 Å²	59.8	15%	0.147	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.1	124.7	-178.8	-179.1	59.2	0	0	0	108.6	Y114 Y116 I194 V248	Y114-L261 HydrophobicContact CD1-CD1 3.71Å; Y114-L261 HydrophobicContact CD1-CD2 4.17Å; Y114-L261 HydrophobicContact CG-CD1 4.15Å; Y116-L261 VanDerWaalsContact CD1-CA 3.45Å; Y116-L261 HydrophobicContact CD1-CB 3.97Å; Y116-L261 HydrophobicContact CD1-CD1 4.09Å; Y116-L261 HydrophobicContact CE1-CB 3.78Å; Y116-L261 HydrophobicContact CE1-CD1 3.72Å; Y116-L261 HydrophobicContact CE1-CG 4.3Å; Y116-L261 HydrophobicContact CE2-CD1 4.26Å; Y116-L261 HydrophobicContact CG-CD1 4.48Å; I194-L261 HydrophobicContact CB-CD2 3.74Å; I194-L261 HydrophobicContact CB-CG 3.87Å; I194-L261 HydrophobicContact CG2-CD2 3.97Å; I194-L261 HydrophobicContact CG2-CG 3.96Å; V248-L261 WeakPolarHBondContact CG1-O 3.48Å
262	Y	98.1	Very high	91.9	Very high	12 Å²	12	56.3 Å²	56.3	5%	0.047	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	-57.7	-177.8	-173.4	-124.3	0	0	0	109.7	M115 Y117 L178 I194 K260	M115-Y262 HydrophobicContact CE-CD1 4.37Å; M115-Y262 HydrophobicContact CG-CD1 4.38Å; M115-Y262 WeakPolarHBondContact O-CA 3.5Å; M115-Y262 WeakPolarHBondContact O-CB 3.21Å; M115-Y262 PolarHBondContact O-N 3.07Å; M115-Y262 HydrophobicContact SD-CD1 3.85Å; M115-Y262 HydrophobicContact SD-CE1 4.38Å; Y117-Y262 AromaticContact CD1-CD2 3.76Å; Y117-Y262 HydrophobicContact CD1-CD2 3.76Å; Y117-Y262 AromaticContact CD1-CG 3.91Å; Y117-Y262 HydrophobicContact CD1-CG 3.91Å; Y117-Y262 AromaticContact CE1-CD2 3.9Å; Y117-Y262 HydrophobicContact CE1-CD2 3.9Å; Y117-Y262 HydrophobicContact CE1-CG 4.4Å; L178-Y262 HydrophobicContact CB-CD1 4.18Å; L178-Y262 HydrophobicContact CB-CE1 3.66Å; L178-Y262 HydrophobicContact CD1-CD1 4.15Å; L178-Y262 HydrophobicContact CD1-CE1 4.31Å; L178-Y262 HydrophobicContact CG-CD1 4.44Å; L178-Y262 HydrophobicContact CG-CE1 4.09Å; L178-Y262 PolarHBondContact N-OH 2.65Å; L178-Y262 WeakPolarHBondContact O-CE1 3.36Å; I194-Y262 WeakPolarHBondContact CD1-O 3.49Å; K260-Y262 PolarHBondContact O-N 3.28Å
263	R	97.2	Very high	91.3	Very high	21 Å²	21	56.1 Å²	56.1	8%	0.079	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	162	-178.5	-52.8	-72	169.7	-112.6	7.7	111.2	M115 L189 L190 D245	M115-R263 HydrophobicContact CB-CB 4.27Å; M115-R263 PolarHBondContact N-O 2.93Å; M115-R263 PolarHBondContact O-N 2.72Å; L189-R263 HydrophobicContact CB-CB 3.74Å; L189-R263 HydrophobicContact CB-CG 4.04Å; L189-R263 HydrophobicContact CD1-CB 4.17Å; L189-R263 HydrophobicContact CD1-CG 4.31Å; L189-R263 HydrophobicContact CG-CB 4.46Å; L190-R263 WeakPolarHBondContact O-CA 3.31Å; L190-R263 WeakPolarHBondContact O-CD 3.45Å; D245-R263 IonicContact OD1-CZ 3.33Å; D245-R263 IonicContact OD1-NH1 2.91Å; D245-R263 PolarHBondContact OD1-NH1 3.11Å; D245-R263 IonicContact OD1-NH2 2.8Å; D245-R263 IonicContact OD2-CZ 2.65Å; D245-R263 IonicContact OD2-NH1 3.77Å; D245-R263 PolarHBondContact OD2-NH1 3.23Å; D245-R263 IonicContact OD2-NH2 3.68Å; D245-R263 PolarHBondContact OD2-NH2 3.31Å
264	R	95.1	Very high	90.9	Very high	81 Å²	81	61.4 Å²	61.4	31%	0.306	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	145.4	166.8	62.4	-179.1	177.5	164.2	0.1	109.9	Y114 L190 T192 N266	Y114-R264 HydrophobicContact CD1-CB 3.95Å; Y114-R264 HydrophobicContact CE1-CB 4.09Å; L190-R264 HydrophobicContact CB-CG 3.76Å; L190-R264 HydrophobicContact CD1-CG 4.2Å; L190-R264 HydrophobicContact CG-CG 4.39Å; L190-R264 PolarHBondContact N-O 2.81Å; L190-R264 PolarHBondContact O-N 3.19Å; T192-R264 PolarHBondContact O-NE 3.34Å; T192-R264 PolarHBondContact O-NH2 2.99Å; T192-R264 VanDerWaalsContact O-NH2 3.12Å; R264-N266 PolarHBondContact O-N 3.27Å
265	L	93.8	Very high	90.7	Very high	6 Å²	6	57.7 Å²	57.7	3%	0.031	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62	133.7	175.5	-176.7	64.5	0	0	0	110.1	V113 I187 L189 Q267 Y272 L276	V113-L265 HydrophobicContact CB-CB 4.05Å; V113-L265 HydrophobicContact CB-CD2 4.02Å; V113-L265 HydrophobicContact CG2-CD2 4Å; V113-L265 WeakPolarHBondContact O-CB 3.26Å; V113-L265 PolarHBondContact O-N 3.47Å; I187-L265 HydrophobicContact CG2-CD1 3.65Å; L189-L265 HydrophobicContact CD2-CD1 4Å; L265-Q267 PolarHBondContact O-N 2.62Å; L265-Y272 HydrophobicContact CD1-CG 4.37Å; L265-L276 HydrophobicContact CD1-CD2 4.04Å; L265-L276 HydrophobicContact CD2-CD2 4.08Å; L265-L276 HydrophobicContact CD2-CG 4.11Å
266	N	90.6	Very high	90.6	Very high	13 Å²	13	52.3 Å²	52.3	7%	0.07	28%	0.28	C	S	.	.			trans	-78.7	106.2	173.8	-173	17	0	0	0	110.7	K188 L190 R264 T268	K188-N266 HydrophobicContact CG-CB 4.36Å; K188-N266 VanDerWaalsContact O-CB 3.26Å; K188-N266 WeakPolarHBondContact O-CB 3.48Å; K188-N266 PolarHBondContact O-N 3.02Å; L190-N266 HydrophobicContact CD1-CB 4.25Å; L190-N266 HydrophobicContact CD2-CB 3.91Å; L190-N266 HydrophobicContact CG-CB 3.82Å; R264-N266 PolarHBondContact O-N 3.27Å; N266-T268 VanDerWaalsContact C-N 3.34Å; N266-T268 PolarHBondContact ND2-OG1 3.35Å; N266-T268 PolarHBondContact OD1-N 3.05Å; N266-T268 PolarHBondContact OD1-OG1 2.81Å
267	Q	84.4	Confident	90.4	Very high	67 Å²	67	55.9 Å²	55.9	31%	0.313	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.9	4.2	179.6	-65	180	-69.6	0	0	113.9	G111 L265 N269 A273	G111-Q267 PolarHBondContact O-NE2 3.02Å; L265-Q267 PolarHBondContact O-N 2.62Å; Q267-N269 PolarHBondContact O-N 3.24Å; Q267-A273 PolarHBondContact NE2-O 3.44Å
268	T	82.5	Confident	90.4	Very high	126 Å²	126	56 Å²	56	77%	0.773	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.5	-17.4	172.6	66.3	0	0	0	0	112.8	N266	N266-T268 VanDerWaalsContact C-N 3.34Å; N266-T268 PolarHBondContact ND2-OG1 3.35Å; N266-T268 PolarHBondContact OD1-N 3.05Å; N266-T268 PolarHBondContact OD1-OG1 2.81Å
269	N	71.5	Confident	90.2	Very high	63 Å²	63	56.4 Å²	56.4	34%	0.337	30%	0.301	S	S	.	.	S	Bend	trans	-85.2	134	176.7	-170.5	-29.7	0	0	0	110.3	Q267 N271 Y272 A273	Q267-N269 PolarHBondContact O-N 3.24Å; N269-N271 PolarHBondContact O-N 3.47Å; N269-N271 PolarHBondContact OD1-N 2.94Å; N269-N271 VanDerWaalsContact OD1-N 3.13Å; N269-Y272 PolarHBondContact O-N 2.72Å; N269-A273 PolarHBondContact O-N 3Å; N269-A273 VanDerWaalsContact O-N 3.07Å
270	T	74.6	Confident	90.2	Very high	124 Å²	124	57.2 Å²	57.2	76%	0.761	31%	0.313	S	S	*	.	G	3₁₀ helix	trans	-56.3	-33.6	179.7	49	0	0	0	0	113.1	Y272	T270-Y272 VanDerWaalsContact C-N 3.32Å; T270-Y272 PolarHBondContact O-N 3Å
271	N	81.5	Confident	90.2	Very high	126 Å²	126	56.8 Å²	56.8	67%	0.674	31%	0.312	S	S	*	.	G	3₁₀ helix	trans	-70.3	-26.5	-176.2	-66.6	-13.9	0	0	0	113.7	N269	N269-N271 PolarHBondContact O-N 3.47Å; N269-N271 PolarHBondContact OD1-N 2.94Å; N269-N271 VanDerWaalsContact OD1-N 3.13Å
272	Y	87.1	Confident	90.2	Very high	32 Å²	32	57.4 Å²	57.4	13%	0.125	32%	0.317	C	S	.	.	G	3₁₀ helix	trans	-124.8	12.8	-174.3	-57.6	-67	0	0	0	113.1	Q182 I187 L265 N269 T270 N274 G275 L276	Q182-Y272 PolarHBondContact OE1-OH 3.39Å; I187-Y272 HydrophobicContact CD1-CE1 4.03Å; I187-Y272 HydrophobicContact CG1-CE1 4.42Å; I187-Y272 HydrophobicContact CG1-CE2 4.45Å; I187-Y272 HydrophobicContact CG2-CD2 4.16Å; I187-Y272 HydrophobicContact CG2-CE1 4.31Å; I187-Y272 HydrophobicContact CG2-CE2 3.94Å; I187-Y272 HydrophobicContact CG2-CG 4.45Å; L265-Y272 HydrophobicContact CD1-CG 4.37Å; N269-Y272 PolarHBondContact O-N 2.72Å; T270-Y272 VanDerWaalsContact C-N 3.32Å; T270-Y272 PolarHBondContact O-N 3Å; Y272-N274 PolarHBondContact O-N 3.4Å; Y272-G275 PolarHBondContact O-N 3.32Å; Y272-G275 VanDerWaalsContact O-N 3.08Å; Y272-L276 HydrophobicContact CD1-CD2 3.88Å; Y272-L276 HydrophobicContact CE1-CD2 4.16Å
273	A	85.6	Confident	90.1	Very high	36 Å²	36	56.9 Å²	56.9	30%	0.298	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.4	-40.3	-178.6	0	0	0	0	0	112	Q267 N269	Q267-A273 PolarHBondContact NE2-O 3.44Å; N269-A273 PolarHBondContact O-N 3Å; N269-A273 VanDerWaalsContact O-N 3.07Å
274	N	88.5	Confident	90.1	Very high	128 Å²	128	57.7 Å²	57.7	68%	0.684	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.4	7.9	-178.1	-64.5	-39.4	0	0	0	114.1	N110 G111 Y272	N110-N274 WeakPolarHBondContact CA-O 3.49Å; G111-N274 PolarHBondContact N-O 3.44Å; Y272-N274 PolarHBondContact O-N 3.4Å
275	G	92.2	Very high	90.2	Very high	6 Å²	6	53.9 Å²	53.9	6%	0.062	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	106.8	-154	-179.2	0	0	0	0	0	113.6	F109 G111 Y272	F109-G275 CarbonylContact O-C 3.52Å; F109-G275 VanDerWaalsContact O-CA 3.28Å; F109-G275 WeakPolarHBondContact O-CA 3.19Å; G111-G275 WeakPolarHBondContact O-CA 3.46Å; Y272-G275 PolarHBondContact O-N 3.32Å; Y272-G275 VanDerWaalsContact O-N 3.08Å
276	L	94.2	Very high	90.4	Very high	3 Å²	3	59 Å²	59	2%	0.016	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	135	179	-61.3	176.4	0	0	0	110.5	L105 F109 V113 L180 I187 L265 Y272 Y281 L302	L105-L276 HydrophobicContact CD2-CB 3.76Å; F109-L276 HydrophobicContact CB-CB 4.25Å; F109-L276 PolarHBondContact N-O 2.8Å; F109-L276 PolarHBondContact O-N 2.75Å; V113-L276 HydrophobicContact CG1-CD1 4.03Å; V113-L276 HydrophobicContact CG2-CG 4.24Å; L180-L276 HydrophobicContact CD2-CD1 4.15Å; I187-L276 HydrophobicContact CD1-CD2 4.14Å; L265-L276 HydrophobicContact CD1-CD2 4.04Å; L265-L276 HydrophobicContact CD2-CD2 4.08Å; L265-L276 HydrophobicContact CD2-CG 4.11Å; Y272-L276 HydrophobicContact CD1-CD2 3.88Å; Y272-L276 HydrophobicContact CE1-CD2 4.16Å; L276-Y281 HydrophobicContact CD2-CE1 4.37Å; L276-L302 HydrophobicContact CD1-CD1 4.2Å
277	K	94.1	Very high	90.6	Very high	110 Å²	110	58.3 Å²	58.3	48%	0.478	32%	0.324	S	S	.	.	P	Polyproline II helix	trans	-85.2	150.3	176.4	-68.5	-55.7	-165.9	-178.9	0	111.1	L105 D108 G279 Y281	L105-K277 WeakPolarHBondContact CD2-O 3.41Å; D108-K277 HydrophobicContact CB-CD 4.47Å; D108-K277 WeakPolarHBondContact OD2-CD 3.35Å; D108-K277 IonicContact OD2-NZ 2.65Å; D108-K277 PolarHBondContact OD2-NZ 2.96Å; K277-G279 PolarHBondContact O-N 2.65Å; K277-Y281 PolarHBondContact N-OH 3.15Å; K277-Y281 VanDerWaalsContact O-CE2 3.23Å; K277-Y281 WeakPolarHBondContact O-CE2 3.16Å; K277-Y281 PolarHBondContact O-OH 3.02Å
278	S	95.7	Very high	91.1	Very high	64 Å²	64	56.8 Å²	56.8	45%	0.448	32%	0.318	S	S	.	.	S	Bend	trans	-53.8	139.1	168.3	48.9	0	0	0	0	110.6	L105 D108	L105-S278 WeakPolarHBondContact O-CA 3.39Å; L105-S278 WeakPolarHBondContact O-CB 3.23Å; D108-S278 WeakPolarHBondContact OD1-CB 3.42Å; D108-S278 PolarHBondContact OD1-N 3.03Å; D108-S278 PolarHBondContact OD1-OG 3.39Å
279	G	95.3	Very high	91.7	Very high	23 Å²	23	51.7 Å²	51.7	24%	0.237	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	151.5	-172	-176.5	0	0	0	0	0	114.3	V104 L105 K277 Y281	V104-G279 WeakPolarHBondContact CA-O 3.43Å; L105-G279 PolarHBondContact N-O 3.06Å; L105-G279 PolarHBondContact O-N 3.05Å; K277-G279 PolarHBondContact O-N 2.65Å; G279-Y281 WeakPolarHBondContact O-CD2 3.25Å
280	N	97.1	Very high	92.7	Very high	120 Å²	120	52.1 Å²	52.1	64%	0.642	29%	0.291	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88	128.4	-176.7	-63.5	-23	0	0	0	110.9	V104	V104-N280 WeakPolarHBondContact CG2-OD1 3.47Å
281	Y	97.1	Very high	93.6	Very high	4 Å²	4	46.2 Å²	46.2	2%	0.016	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	163.3	176.3	-69	-88.4	0	0	0	109.8	F103 L105 L180 L181 Q182 I187 L276 K277 G279	F103-Y281 HydrophobicContact CE2-CD2 4.32Å; F103-Y281 HydrophobicContact CE2-CG 4.24Å; F103-Y281 VanDerWaalsContact CZ-CB 3.42Å; F103-Y281 HydrophobicContact CZ-CG 4.18Å; F103-Y281 PolarHBondContact N-O 2.84Å; F103-Y281 PolarHBondContact O-N 3.05Å; F103-Y281 VanDerWaalsContact O-O 3.05Å; L105-Y281 HydrophobicContact CB-CD2 3.9Å; L105-Y281 HydrophobicContact CB-CE2 3.82Å; L105-Y281 HydrophobicContact CD2-CE2 4.11Å; L180-Y281 HydrophobicContact CD1-CD1 4.3Å; L180-Y281 HydrophobicContact CD2-CD1 4.48Å; L180-Y281 HydrophobicContact CG-CD1 4.34Å; L181-Y281 WeakPolarHBondContact O-CA 3.4Å; Q182-Y281 HydrophobicContact CB-CD1 3.86Å; Q182-Y281 HydrophobicContact CB-CE1 3.76Å; Q182-Y281 VanDerWaalsContact CD-CE1 3.43Å; Q182-Y281 HydrophobicContact CG-CD1 4.16Å; Q182-Y281 HydrophobicContact CG-CE1 3.81Å; Q182-Y281 PolarHBondContact NE2-OH 2.96Å; Q182-Y281 PolarHBondContact OE1-OH 2.72Å; I187-Y281 HydrophobicContact CD1-CD1 3.77Å; I187-Y281 HydrophobicContact CD1-CE1 3.51Å; L276-Y281 HydrophobicContact CD2-CE1 4.37Å; K277-Y281 PolarHBondContact N-OH 3.15Å; K277-Y281 VanDerWaalsContact O-CE2 3.23Å; K277-Y281 WeakPolarHBondContact O-CE2 3.16Å; K277-Y281 PolarHBondContact O-OH 3.02Å; G279-Y281 WeakPolarHBondContact O-CD2 3.25Å
282	T	97.2	Very high	93.9	Very high	41 Å²	41	42.7 Å²	42.7	25%	0.252	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131	125.6	173.8	-55	0	0	0	0	108.8	E100 L181	E100-T282 HydrophobicContact CB-CG2 4.2Å; L181-T282 HydrophobicContact CD1-CG2 4.44Å; L181-T282 PolarHBondContact N-O 2.82Å; L181-T282 PolarHBondContact O-N 3.36Å
283	L	97.4	Very high	94	Very high	0 Å²	0	46 Å²	46	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	116.3	170.2	179.2	65.3	0	0	0	107.6	I71 E100 V101 F103 M115 L178 I285 M300	I71-L283 HydrophobicContact CG2-CD2 4.37Å; E100-L283 WeakPolarHBondContact CA-O 3.42Å; V101-L283 HydrophobicContact CB-CB 4.41Å; V101-L283 PolarHBondContact N-O 2.92Å; V101-L283 PolarHBondContact O-N 2.88Å; F103-L283 HydrophobicContact CD1-CB 4.21Å; F103-L283 HydrophobicContact CE1-CB 3.96Å; M115-L283 HydrophobicContact CE-CD1 3.74Å; L178-L283 HydrophobicContact CB-CD1 4.2Å; L283-I285 HydrophobicContact CB-CD1 4.29Å; L283-I285 HydrophobicContact CD2-CD1 3.76Å; L283-I285 HydrophobicContact CD2-CG1 3.98Å; L283-I285 HydrophobicContact CG-CD1 3.6Å; L283-I285 HydrophobicContact CG-CG1 3.81Å; L283-I285 WeakPolarHBondContact O-CD1 3.34Å; L283-M300 HydrophobicContact CB-CE 4.5Å; L283-M300 HydrophobicContact CD1-CE 4.01Å; L283-M300 HydrophobicContact CD1-CG 4.14Å; L283-M300 HydrophobicContact CD2-CB 3.74Å; L283-M300 HydrophobicContact CD2-CE 3.88Å; L283-M300 HydrophobicContact CD2-CG 4.01Å; L283-M300 HydrophobicContact CG-CE 4.35Å
284	N	97	Very high	94.3	Very high	39 Å²	39	47.2 Å²	47.2	21%	0.209	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	129.3	171.5	-178.5	13.5	0	0	0	108.8	C99 T179 L181	C99-N284 PolarHBondContact O-OD1 3.5Å; T179-N284 PolarHBondContact N-O 3.32Å; T179-N284 PolarHBondContact O-N 3.05Å; T179-N284 WeakPolarHBondContact OG1-CB 3.02Å; T179-N284 PolarHBondContact OG1-O 2.89Å; L181-N284 HydrophobicContact CD1-CB 3.76Å
285	I	97.5	Very high	94.6	Very high	0 Å²	0	47.7 Å²	47.7	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	126.4	-174.1	-55.5	101.1	0	0	0	109.3	Y73 P98 C99 V101 T177 L178 L283 Y287	Y73-I285 HydrophobicContact CD2-CG1 4.26Å; Y73-I285 HydrophobicContact CD2-CG2 4.09Å; Y73-I285 HydrophobicContact CE2-CG2 4.05Å; Y73-I285 HydrophobicContact CG-CG1 4.46Å; P98-I285 WeakPolarHBondContact CA-O 3.4Å; C99-I285 PolarHBondContact N-O 2.81Å; C99-I285 PolarHBondContact O-N 2.79Å; V101-I285 HydrophobicContact CB-CD1 4.46Å; V101-I285 HydrophobicContact CG2-CD1 3.86Å; T177-I285 CarbonylContact O-C 3.48Å; T177-I285 WeakPolarHBondContact O-CA 3.48Å; L178-I285 HydrophobicContact CD2-CB 4.26Å; L178-I285 HydrophobicContact CD2-CG1 3.78Å; L178-I285 HydrophobicContact CD2-CG2 3.81Å; L283-I285 HydrophobicContact CB-CD1 4.29Å; L283-I285 HydrophobicContact CD2-CD1 3.76Å; L283-I285 HydrophobicContact CD2-CG1 3.98Å; L283-I285 HydrophobicContact CG-CD1 3.6Å; L283-I285 HydrophobicContact CG-CG1 3.81Å; L283-I285 WeakPolarHBondContact O-CD1 3.34Å; I285-Y287 HydrophobicContact CG2-CD2 4.48Å
286	K	96.7	Very high	94.8	Very high	113 Å²	113	47.6 Å²	47.6	49%	0.491	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	99.1	158.2	-60.3	-175.6	179	-180	0	107.7	T96 D176 T177 N288	T96-K286 HydrophobicContact CG2-CB 3.77Å; T96-K286 HydrophobicContact CG2-CG 4.36Å; D176-K286 WeakPolarHBondContact CA-O 3.25Å; T177-K286 PolarHBondContact N-O 2.95Å; T177-K286 VanDerWaalsContact N-O 3.08Å; T177-K286 PolarHBondContact O-N 3.09Å; K286-N288 PolarHBondContact O-N 2.78Å
287	Y	95.9	Very high	94.9	Very high	0 Å²	0	49.7 Å²	49.7	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	112.8	-174.7	-162.5	-66.8	0	0	0	109.6	Y73 T74 C85 L89 C97 I285 K298	Y73-Y287 HydrophobicContact CD2-CD2 4.23Å; Y73-Y287 HydrophobicContact CD2-CE2 4.28Å; Y73-Y287 HydrophobicContact CE2-CD2 4.44Å; T74-Y287 PolarHBondContact O-OH 3.08Å; C85-Y287 HydrophobicContact CB-CD1 4.03Å; C85-Y287 HydrophobicContact CB-CD2 3.9Å; C85-Y287 HydrophobicContact CB-CE1 4.49Å; C85-Y287 HydrophobicContact CB-CE2 4.37Å; C85-Y287 HydrophobicContact CB-CG 3.71Å; L89-Y287 HydrophobicContact CD1-CD1 3.91Å; L89-Y287 HydrophobicContact CD1-CE1 4.48Å; L89-Y287 HydrophobicContact CD2-CD1 3.8Å; L89-Y287 HydrophobicContact CD2-CE1 4.1Å; L89-Y287 HydrophobicContact CG-CD1 4.48Å; C97-Y287 PolarHBondContact N-O 2.86Å; C97-Y287 WeakPolarHBondContact O-CA 3.4Å; C97-Y287 WeakPolarHBondContact O-CB 3.31Å; C97-Y287 PolarHBondContact O-N 2.91Å; I285-Y287 HydrophobicContact CG2-CD2 4.48Å; Y287-K298 WeakPolarHBondContact OH-CE 3.36Å; Y287-K298 PolarHBondContact OH-NZ 3.18Å
288	N	94.8	Very high	95.1	Very high	35 Å²	35	44.5 Å²	44.5	19%	0.187	26%	0.256	C	S	.	.			trans	-127.8	-25.8	-176.9	-66	-38.5	0	0	0	112.7	L89 T96 N175 D176 K286 P290	L89-N288 WeakPolarHBondContact CD2-O 3.1Å; T96-N288 VanDerWaalsContact CA-OD1 3.25Å; T96-N288 WeakPolarHBondContact CA-OD1 3.37Å; T96-N288 WeakPolarHBondContact CB-OD1 3.48Å; T96-N288 VanDerWaalsContact CG2-OD1 3.25Å; T96-N288 WeakPolarHBondContact CG2-OD1 3.49Å; T96-N288 PolarHBondContact OG1-OD1 3.37Å; N175-N288 PolarHBondContact O-ND2 2.94Å; N175-N288 VanDerWaalsContact OD1-CB 3.27Å; N175-N288 WeakPolarHBondContact OD1-CB 3.37Å; D176-N288 PolarHBondContact OD1-N 3.16Å; K286-N288 PolarHBondContact O-N 2.78Å; N288-P290 VanDerWaalsContact O-CD 3.31Å; N288-P290 WeakPolarHBondContact O-CD 3.45Å
289	Y	94.7	Very high	95.2	Very high	19 Å²	19	44.4 Å²	44.4	8%	0.075	25%	0.246	C	C	.	.			trans	-94.1	109.6	-170.9	-159.4	-98.4	0	0	0	111.1	L119 Y122 S172 F174 N175 D176 V291 K298	L119-Y289 HydrophobicContact CD1-CE1 4.15Å; Y122-Y289 HydrophobicContact CE2-CE1 4.31Å; Y122-Y289 WeakPolarHBondContact CE2-OH 3.44Å; Y122-Y289 PolarHBondContact OH-OH 3.08Å; S172-Y289 WeakPolarHBondContact O-CE2 3.34Å; S172-Y289 PolarHBondContact O-OH 3.04Å; S172-Y289 VanDerWaalsContact O-OH 3.14Å; F174-Y289 HydrophobicContact CD2-CD1 4.08Å; F174-Y289 HydrophobicContact CD2-CD2 4.28Å; F174-Y289 AromaticContact CD2-CG 3.93Å; F174-Y289 HydrophobicContact CD2-CG 3.93Å; F174-Y289 HydrophobicContact CE2-CD1 4.46Å; F174-Y289 HydrophobicContact CE2-CG 4.35Å; N175-Y289 WeakPolarHBondContact OD1-CA 3.44Å; N175-Y289 WeakPolarHBondContact OD1-CB 3.35Å; N175-Y289 WeakPolarHBondContact OD1-CD2 3.31Å; N175-Y289 PolarHBondContact OD1-N 2.98Å; D176-Y289 WeakPolarHBondContact OD1-CB 3.37Å; D176-Y289 PolarHBondContact OD1-N 2.89Å; Y289-V291 HydrophobicContact CD1-CG1 3.89Å; Y289-V291 HydrophobicContact CE1-CG1 4.26Å; Y289-K298 PolarHBondContact O-NZ 3.42Å
290	P	92.7	Very high	95.3	Very high	71 Å²	71	43.3 Å²	43.3	46%	0.461	24%	0.235	S	C	.	.			trans	-76.5	138	-179.6	31.6	-34.3	0	0	0	111.1	N288	N288-P290 VanDerWaalsContact O-CD 3.31Å; N288-P290 WeakPolarHBondContact O-CD 3.45Å
291	V	92.6	Very high	95.4	Very high	1 Å²	1	37.7 Å²	37.7	1%	0.006	21%	0.205	C	C	.	.			trans	-131.5	-12.2	178.1	-61.6	0	0	0	0	114.3	T74 L119 Y289 S293 F294 D295 G296 K298	T74-V291 HydrophobicContact CG2-CG2 3.96Å; L119-V291 HydrophobicContact CD2-CG1 4.39Å; Y289-V291 HydrophobicContact CD1-CG1 3.89Å; Y289-V291 HydrophobicContact CE1-CG1 4.26Å; V291-S293 PolarHBondContact O-N 3.23Å; V291-F294 HydrophobicContact CB-CE1 4.43Å; V291-F294 HydrophobicContact CB-CE2 4.12Å; V291-F294 HydrophobicContact CB-CZ 3.81Å; V291-F294 HydrophobicContact CG1-CE2 4.35Å; V291-F294 HydrophobicContact CG1-CZ 3.8Å; V291-F294 PolarHBondContact O-N 3.41Å; V291-D295 PolarHBondContact O-N 3.27Å; V291-G296 WeakPolarHBondContact CG2-O 3.37Å; V291-G296 PolarHBondContact O-N 2.93Å; V291-K298 HydrophobicContact CB-CG 4.37Å; V291-K298 HydrophobicContact CG1-CD 3.74Å; V291-K298 HydrophobicContact CG1-CG 3.59Å; V291-K298 HydrophobicContact CG2-CD 4.33Å; V291-K298 HydrophobicContact CG2-CG 3.9Å
292	V	89.3	Confident	95.4	Very high	52 Å²	52	37.7 Å²	37.7	32%	0.315	21%	0.205	S	C	.	.	G	3₁₀ helix	trans	-66.8	-39.1	-173.7	-177	0	0	0	0	111.7	A86 E90 F294 D295	A86-V292 HydrophobicContact CB-CG2 3.59Å; E90-V292 VanDerWaalsContact OE1-CB 3.24Å; E90-V292 WeakPolarHBondContact OE1-CB 3.32Å; E90-V292 WeakPolarHBondContact OE1-CG1 3.39Å; V292-F294 PolarHBondContact O-N 3.05Å; V292-D295 PolarHBondContact O-N 2.87Å
293	S	89.4	Confident	95.3	Very high	101 Å²	101	35.8 Å²	35.8	71%	0.706	19%	0.194	S	C	*	.	G	3₁₀ helix	trans	-54.7	-18.3	179.4	60.9	0	0	0	0	115.6	V291	V291-S293 PolarHBondContact O-N 3.23Å
294	F	91.9	Very high	95.1	Very high	62 Å²	62	36.1 Å²	36.1	27%	0.272	20%	0.195	S	C	.	.	G	3₁₀ helix	trans	-128.6	24.4	177.7	57.2	-97.3	0	0	0	112.1	N121 Y122 V291 V292 G296	N121-F294 PolarHBondContact ND2-O 3.22Å; N121-F294 WeakPolarHBondContact O-CD2 3.39Å; Y122-F294 AromaticContact CD2-CE2 3.95Å; Y122-F294 HydrophobicContact CD2-CE2 3.95Å; Y122-F294 AromaticContact CD2-CZ 3.75Å; Y122-F294 HydrophobicContact CD2-CZ 3.75Å; Y122-F294 HydrophobicContact CE2-CZ 4.27Å; V291-F294 HydrophobicContact CB-CE1 4.43Å; V291-F294 HydrophobicContact CB-CE2 4.12Å; V291-F294 HydrophobicContact CB-CZ 3.81Å; V291-F294 HydrophobicContact CG1-CE2 4.35Å; V291-F294 HydrophobicContact CG1-CZ 3.8Å; V291-F294 PolarHBondContact O-N 3.41Å; V292-F294 PolarHBondContact O-N 3.05Å; F294-G296 PolarHBondContact O-N 2.89Å
295	D	94.5	Very high	94.8	Very high	138 Å²	138	37.3 Å²	37.3	74%	0.738	20%	0.204	S	C	*	.	T	Hydrogen-bonded Turn	trans	52.2	32.5	-179.9	-63.1	-49.4	0	0	0	113.8	V291 V292	V291-D295 PolarHBondContact O-N 3.27Å; V292-D295 PolarHBondContact O-N 2.87Å
296	G	95.6	Very high	94.2	Very high	4 Å²	4	38.1 Å²	38.1	4%	0.041	21%	0.21	C	C	.	.			trans	-83.7	155.7	177.5	0	0	0	0	0	112.4	T120 V291 F294	T120-G296 WeakPolarHBondContact O-CA 3.45Å; V291-G296 WeakPolarHBondContact CG2-O 3.37Å; V291-G296 PolarHBondContact O-N 2.93Å; F294-G296 PolarHBondContact O-N 2.89Å
297	T	97.2	Very high	93.6	Very high	47 Å²	47	39 Å²	39	29%	0.288	22%	0.224	S	C	.	.			trans	-119.6	152.2	171.9	73.3	0	0	0	0	112	T74 L119 T120	T74-T297 WeakPolarHBondContact OG1-CA 2.95Å; T74-T297 WeakPolarHBondContact OG1-CB 3.25Å; L119-T297 WeakPolarHBondContact CA-O 3.46Å; T120-T297 VanDerWaalsContact CG2-OG1 3.31Å; T120-T297 WeakPolarHBondContact CG2-OG1 3.45Å; T120-T297 PolarHBondContact N-O 2.04Å; T120-T297 VanDerWaalsContact N-O 3.08Å; T120-T297 WeakPolarHBondContact OG1-CB 3.4Å; T120-T297 PolarHBondContact OG1-N 2.76Å; T120-T297 PolarHBondContact OG1-OG1 3.23Å
298	K	97.4	Very high	93.1	Very high	0 Å²	0	43 Å²	43	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	131.6	177.2	-59.4	-166.1	-67.5	-174.6	0	110.6	Y73 T74 G118 L119 F174 D176 Y287 Y289 V291	Y73-K298 HydrophobicContact CD2-CB 4.33Å; Y73-K298 HydrophobicContact CE1-CB 4Å; Y73-K298 HydrophobicContact CE2-CB 3.79Å; Y73-K298 HydrophobicContact CE2-CD 4.08Å; Y73-K298 PolarHBondContact N-O 3.19Å; T74-K298 PolarHBondContact N-O 2.85Å; T74-K298 PolarHBondContact OG1-N 3.36Å; T74-K298 PolarHBondContact OG1-O 3.49Å; G118-K298 WeakPolarHBondContact O-CA 3.49Å; L119-K298 HydrophobicContact CD2-CB 4.48Å; L119-K298 HydrophobicContact CD2-CD 4.23Å; L119-K298 HydrophobicContact CD2-CG 3.72Å; F174-K298 HydrophobicContact CE2-CD 4.37Å; D176-K298 IonicContact OD1-NZ 2.68Å; D176-K298 PolarHBondContact OD1-NZ 3.48Å; D176-K298 WeakPolarHBondContact OD2-CD 3.44Å; D176-K298 WeakPolarHBondContact OD2-CE 3.41Å; D176-K298 IonicContact OD2-NZ 2.75Å; D176-K298 PolarHBondContact OD2-NZ 3.08Å; Y287-K298 WeakPolarHBondContact OH-CE 3.36Å; Y287-K298 PolarHBondContact OH-NZ 3.18Å; Y289-K298 PolarHBondContact O-NZ 3.42Å; V291-K298 HydrophobicContact CB-CG 4.37Å; V291-K298 HydrophobicContact CG1-CD 3.74Å; V291-K298 HydrophobicContact CG1-CG 3.59Å; V291-K298 HydrophobicContact CG2-CD 4.33Å; V291-K298 HydrophobicContact CG2-CG 3.9Å
299	R	97.9	Very high	92.7	Very high	63 Å²	63	42.8 Å²	42.8	24%	0.238	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	146.6	177.7	57.7	-174.7	169.7	-172	-2.7	111.5	I70 I71 Y73 Y117 G118 I301	I70-R299 HydrophobicContact CG2-CB 3.98Å; I70-R299 HydrophobicContact CG2-CG 4.34Å; I71-R299 CarbonylContact O-C 3.52Å; I71-R299 WeakPolarHBondContact O-CA 3.28Å; Y73-R299 VanDerWaalsContact CE1-C 3.42Å; Y117-R299 CarbonylContact C-O 3.59Å; Y117-R299 WeakPolarHBondContact CA-O 3.45Å; G118-R299 PolarHBondContact N-O 2.96Å; G118-R299 PolarHBondContact O-N 2.9Å; R299-I301 HydrophobicContact CG-CD1 4.16Å; R299-I301 HydrophobicContact CG-CG1 4.2Å
300	M	98	Very high	92.3	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	133.9	167.3	-174.4	-78.3	-75.9	0	0	107.3	I71 Y73 F103 M115 L178 L283 L302	I71-M300 HydrophobicContact CB-CE 4.45Å; I71-M300 HydrophobicContact CD1-CE 3.38Å; I71-M300 HydrophobicContact CG1-CE 4.47Å; I71-M300 PolarHBondContact N-O 3.42Å; I71-M300 PolarHBondContact O-N 2.91Å; Y73-M300 HydrophobicContact CD1-CB 4.15Å; Y73-M300 HydrophobicContact CE1-CB 4.1Å; F103-M300 HydrophobicContact CE1-CE 4.18Å; F103-M300 HydrophobicContact CZ-CE 4.17Å; M115-M300 HydrophobicContact CE-CG 3.36Å; M115-M300 HydrophobicContact CE-SD 3.96Å; M115-M300 HydrophobicContact CG-CG 4.23Å; M115-M300 HydrophobicContact CG-SD 4.15Å; L178-M300 HydrophobicContact CD1-CB 4.46Å; L178-M300 HydrophobicContact CD1-CG 4.2Å; L283-M300 HydrophobicContact CB-CE 4.5Å; L283-M300 HydrophobicContact CD1-CE 4.01Å; L283-M300 HydrophobicContact CD1-CG 4.14Å; L283-M300 HydrophobicContact CD2-CB 3.74Å; L283-M300 HydrophobicContact CD2-CE 3.88Å; L283-M300 HydrophobicContact CD2-CG 4.01Å; L283-M300 HydrophobicContact CG-CE 4.35Å; M300-L302 HydrophobicContact CE-CD1 4.28Å; M300-L302 HydrophobicContact CE-CG 4.12Å; M300-L302 HydrophobicContact SD-CD1 4.48Å; M300-L302 HydrophobicContact SD-CD2 4.03Å; M300-L302 HydrophobicContact SD-CG 3.7Å
301	I	97.9	Very high	92.1	Very high	1 Å²	1	44.2 Å²	44.2	1%	0.005	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	120.1	-177.4	-54	152.9	0	0	0	108	E68 L69 I70 M115 Y116 R259 R299	E68-I301 HydrophobicContact CG-CG2 3.72Å; L69-I301 CarbonylContact O-C 3.25Å; L69-I301 VanDerWaalsContact O-CA 3.31Å; L69-I301 WeakPolarHBondContact O-CA 3.07Å; I70-I301 HydrophobicContact CG1-CG1 4.23Å; I70-I301 HydrophobicContact CG1-CG2 4.28Å; I70-I301 HydrophobicContact CG2-CG1 4.19Å; M115-I301 CarbonylContact C-O 3.39Å; M115-I301 WeakPolarHBondContact CA-O 3.47Å; Y116-I301 PolarHBondContact N-O 2.91Å; Y116-I301 PolarHBondContact O-N 2.59Å; R259-I301 HydrophobicContact CB-CD1 3.79Å; R299-I301 HydrophobicContact CG-CD1 4.16Å; R299-I301 HydrophobicContact CG-CG1 4.2Å
302	L	97.2	Very high	92	Very high	4 Å²	4	48.7 Å²	48.7	2%	0.021	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	132	165.2	-66.3	174.4	0	0	0	108	E68 L69 F103 F109 V113 Y114 M115 L180 L276 M300	E68-L302 CarbonylContact C-O 3.57Å; E68-L302 VanDerWaalsContact CA-O 3.32Å; E68-L302 WeakPolarHBondContact CA-O 3.36Å; L69-L302 PolarHBondContact N-O 3.4Å; L69-L302 PolarHBondContact O-N 3.3Å; F103-L302 HydrophobicContact CE2-CD1 4.21Å; F103-L302 HydrophobicContact CZ-CD1 4.04Å; F109-L302 HydrophobicContact CD2-CB 4.45Å; F109-L302 HydrophobicContact CE2-CB 4Å; V113-L302 HydrophobicContact CG1-CD2 4.34Å; Y114-L302 WeakPolarHBondContact O-CA 3.12Å; M115-L302 HydrophobicContact CB-CD2 3.95Å; M115-L302 HydrophobicContact CG-CD2 4.06Å; L180-L302 HydrophobicContact CD2-CD1 4.48Å; L276-L302 HydrophobicContact CD1-CD1 4.2Å; M300-L302 HydrophobicContact CE-CD1 4.28Å; M300-L302 HydrophobicContact CE-CG 4.12Å; M300-L302 HydrophobicContact SD-CD1 4.48Å; M300-L302 HydrophobicContact SD-CD2 4.03Å; M300-L302 HydrophobicContact SD-CG 3.7Å
303	S	95.6	Very high	92.2	Very high	2 Å²	2	48.6 Å²	48.6	1%	0.014	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143	140.2	177.3	-171.6	0	0	0	0	110.9	N67 Y114	N67-S303 WeakPolarHBondContact O-CA 3.38Å; Y114-S303 PolarHBondContact N-O 3.37Å; Y114-S303 PolarHBondContact O-N 2.83Å
304	T	94.5	Very high	92.5	Very high	6 Å²	6	50.8 Å²	50.8	4%	0.037	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	164.3	159.6	61.2	0	0	0	0	110	N67 F109 N110 V113	N67-T304 PolarHBondContact N-OG1 3.5Å; N67-T304 PolarHBondContact O-N 3.17Å; F109-T304 HydrophobicContact CB-CG2 3.76Å; F109-T304 HydrophobicContact CD2-CG2 3.92Å; F109-T304 HydrophobicContact CG-CG2 4.07Å; N110-T304 WeakPolarHBondContact O-CG2 3.5Å; V113-T304 HydrophobicContact CG2-CG2 4.21Å
305	T	89.4	Confident	92.6	Very high	64 Å²	64	51.8 Å²	51.8	39%	0.393	29%	0.29	S	S	.	.			trans	-104.2	136.6	174.2	49.7	0	0	0	0	111.1	Y114 G309	Y114-T305 HydrophobicContact CD2-CG2 3.69Å; Y114-T305 HydrophobicContact CE2-CG2 3.38Å; T305-G309 CarbonylContact C-O 3.48Å; T305-G309 WeakPolarHBondContact CA-O 3.34Å
306	S	86	Confident	92.7	Very high	18 Å²	18	45.3 Å²	45.3	13%	0.126	26%	0.256	C	S	.	.	B	Isolated β-bridge	trans	-97.2	179.6	161.4	76.9	0	0	0	0	110.8	L62 L308 G309	L62-S306 WeakPolarHBondContact O-CB 3.34Å; L62-S306 PolarHBondContact O-OG 2.86Å; S306-L308 PolarHBondContact O-N 3.44Å; S306-L308 VanDerWaalsContact O-N 3.13Å; S306-L308 PolarHBondContact OG-N 2.91Å; S306-G309 PolarHBondContact N-O 3.2Å; S306-G309 PolarHBondContact O-N 3.14Å
307	V	84.3	Confident	92.7	Very high	130 Å²	130	49 Å²	49	79%	0.788	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.8	-28.7	176	-179.1	0	0	0	0	112.2
308	L	84.6	Confident	92.8	Very high	85 Å²	85	48.2 Å²	48.2	45%	0.445	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.6	5.7	-179	-60.5	173	0	0	0	113.1	L59 L62 S306	L59-L308 HydrophobicContact CB-CD1 4.35Å; L59-L308 HydrophobicContact CD2-CD1 3.57Å; L59-L308 HydrophobicContact CD2-CD2 4.01Å; L59-L308 HydrophobicContact CD2-CG 4.44Å; L62-L308 HydrophobicContact CB-CD1 3.85Å; L62-L308 HydrophobicContact CB-CG 4.39Å; L62-L308 HydrophobicContact CD1-CD1 4.35Å; S306-L308 PolarHBondContact O-N 3.44Å; S306-L308 VanDerWaalsContact O-N 3.13Å; S306-L308 PolarHBondContact OG-N 2.91Å
309	G	86.1	Confident	92.8	Very high	30 Å²	30	51.9 Å²	51.9	31%	0.309	29%	0.286	S	S	.	.	B	Isolated β-bridge	trans	99.6	-127.1	-175.5	0	0	0	0	0	112.3	T305 S306	T305-G309 CarbonylContact C-O 3.48Å; T305-G309 WeakPolarHBondContact CA-O 3.34Å; S306-G309 PolarHBondContact N-O 3.2Å; S306-G309 PolarHBondContact O-N 3.14Å
310	G	85.6	Confident	92.8	Very high	36 Å²	36	51.2 Å²	51.2	37%	0.371	29%	0.287	S	S	.	.	S	Bend	trans	-83.9	174.8	179.7	0	0	0	0	0	113.3	N312	G310-N312 PolarHBondContact O-N 3.46Å; G310-N312 VanDerWaalsContact O-N 3.12Å
311	K	88.4	Confident	92.8	Very high	84 Å²	84	54.7 Å²	54.7	37%	0.365	31%	0.308	S	S	.	.			trans	-64.3	110.4	173.7	-171.4	175.9	-171.4	164.7	0	110.6	A66 E68	A66-K311 HydrophobicContact CB-CB 4.06Å; A66-K311 WeakPolarHBondContact O-CD 3.32Å; E68-K311 HydrophobicContact CB-CB 4.41Å; E68-K311 HydrophobicContact CB-CD 4.22Å
312	N	91.8	Very high	92.8	Very high	96 Å²	96	57.8 Å²	57.8	51%	0.513	33%	0.327	S	S	.	.			trans	-149.9	98.8	176.5	-174.9	-4.5	0	0	0	111.1	S63 G310 F314	S63-N312 WeakPolarHBondContact OG-CA 3.38Å; S63-N312 PolarHBondContact OG-N 3.35Å; S63-N312 PolarHBondContact OG-O 3.46Å; G310-N312 PolarHBondContact O-N 3.46Å; G310-N312 VanDerWaalsContact O-N 3.12Å; N312-F314 VanDerWaalsContact C-N 3.25Å; N312-F314 PolarHBondContact O-N 3.1Å; N312-F314 VanDerWaalsContact OD1-CB 3.22Å; N312-F314 WeakPolarHBondContact OD1-CB 3.34Å; N312-F314 PolarHBondContact OD1-N 3Å; N312-F314 VanDerWaalsContact OD1-N 3.13Å
313	P	93.5	Very high	92.8	Very high	49 Å²	49	57.6 Å²	57.6	32%	0.318	33%	0.326	S	S	.	.			trans	-77.5	-10.1	-175.7	31.6	-35.9	0	0	0	113.2	L60 L315 G316 I317	L60-P313 HydrophobicContact CD1-CB 3.58Å; P313-L315 PolarHBondContact O-N 3.5Å; P313-G316 PolarHBondContact O-N 2.78Å; P313-I317 HydrophobicContact CB-CD1 3.94Å; P313-I317 HydrophobicContact CG-CD1 4.38Å; P313-I317 WeakPolarHBondContact O-CG1 3.23Å; P313-I317 PolarHBondContact O-N 3.12Å
314	F	94.8	Very high	93	Very high	147 Å²	147	59.6 Å²	59.6	65%	0.645	34%	0.342	S	S	*	.	H	α-helix	trans	-55.1	-47.5	-172.1	175.1	-99.4	0	0	0	112.8	N312 G316 I317 A318	N312-F314 VanDerWaalsContact C-N 3.25Å; N312-F314 PolarHBondContact O-N 3.1Å; N312-F314 VanDerWaalsContact OD1-CB 3.22Å; N312-F314 WeakPolarHBondContact OD1-CB 3.34Å; N312-F314 PolarHBondContact OD1-N 3Å; N312-F314 VanDerWaalsContact OD1-N 3.13Å; F314-G316 PolarHBondContact O-N 2.93Å; F314-I317 PolarHBondContact O-N 3.31Å; F314-A318 VanDerWaalsContact O-CB 3.27Å; F314-A318 WeakPolarHBondContact O-CB 3.28Å; F314-A318 PolarHBondContact O-N 3.35Å
315	L	94.1	Very high	93.1	Very high	83 Å²	83	63.3 Å²	63.3	44%	0.435	36%	0.361	S	S	.	.	H	α-helix	trans	-62.9	-45.8	-177.2	-167.6	70.2	0	0	0	111	L59 P313 A318 Y319	L59-L315 HydrophobicContact CD1-CD2 3.96Å; L59-L315 HydrophobicContact CD1-CG 4.06Å; P313-L315 PolarHBondContact O-N 3.5Å; L315-A318 PolarHBondContact O-N 2.76Å; L315-Y319 HydrophobicContact CD1-CD2 4.23Å; L315-Y319 HydrophobicContact CD1-CE2 3.86Å; L315-Y319 HydrophobicContact CG-CD2 4.19Å; L315-Y319 HydrophobicContact CG-CE2 4.08Å; L315-Y319 VanDerWaalsContact O-CD2 3.28Å; L315-Y319 WeakPolarHBondContact O-CD2 3.48Å; L315-Y319 PolarHBondContact O-N 3.34Å; L315-Y319 VanDerWaalsContact O-N 3.08Å
316	G	95.9	Very high	93.5	Very high	2 Å²	2	61 Å²	61	2%	0.021	35%	0.348	C	S	.	.	H	α-helix	trans	-61	-46.5	176.7	0	0	0	0	0	112.4	G56 P313 F314 A318 Y319 I320	G56-G316 WeakPolarHBondContact O-CA 3.04Å; P313-G316 PolarHBondContact O-N 2.78Å; F314-G316 PolarHBondContact O-N 2.93Å; G316-A318 PolarHBondContact O-N 2.95Å; G316-Y319 PolarHBondContact O-N 3.41Å; G316-I320 WeakPolarHBondContact O-CG1 3.33Å; G316-I320 PolarHBondContact O-N 3.2Å; G316-I320 VanDerWaalsContact O-N 3.11Å
317	I	97.1	Very high	94	Very high	83 Å²	83	62.3 Å²	62.3	43%	0.426	35%	0.353	S	S	.	.	H	α-helix	trans	-61.3	-45	177	-65.7	168.3	0	0	0	110.9	L60 P313 F314 Y319 I320 V321	L60-I317 HydrophobicContact CD1-CG1 4.27Å; P313-I317 HydrophobicContact CB-CD1 3.94Å; P313-I317 HydrophobicContact CG-CD1 4.38Å; P313-I317 WeakPolarHBondContact O-CG1 3.23Å; P313-I317 PolarHBondContact O-N 3.12Å; F314-I317 PolarHBondContact O-N 3.31Å; I317-Y319 PolarHBondContact O-N 3.43Å; I317-I320 PolarHBondContact O-N 3.21Å; I317-V321 HydrophobicContact CG2-CG2 4.03Å; I317-V321 WeakPolarHBondContact O-CB 3.39Å; I317-V321 VanDerWaalsContact O-CG2 3.28Å; I317-V321 WeakPolarHBondContact O-CG2 3.47Å; I317-V321 PolarHBondContact O-N 3.17Å
318	A	97.7	Very high	94.6	Very high	30 Å²	30	60.1 Å²	60.1	25%	0.248	34%	0.34	C	S	.	.	H	α-helix	trans	-60.3	-44.3	-179.6	0	0	0	0	0	111.9	F314 L315 G316 V321 V322	F314-A318 VanDerWaalsContact O-CB 3.27Å; F314-A318 WeakPolarHBondContact O-CB 3.28Å; F314-A318 PolarHBondContact O-N 3.35Å; L315-A318 PolarHBondContact O-N 2.76Å; G316-A318 PolarHBondContact O-N 2.95Å; A318-V321 PolarHBondContact O-N 3.25Å; A318-V322 WeakPolarHBondContact O-CB 3.28Å; A318-V322 VanDerWaalsContact O-CG2 3.26Å; A318-V322 WeakPolarHBondContact O-CG2 3.28Å; A318-V322 PolarHBondContact O-N 3.07Å
319	Y	98	Very high	95.1	Very high	76 Å²	76	60 Å²	60	30%	0.298	34%	0.339	S	S	.	.	H	α-helix	trans	-62.5	-43.4	175.9	-90.7	-101.4	0	0	0	112.3	F52 I55 L59 L315 G316 I317 G323	F52-Y319 HydrophobicContact CB-CD1 4.09Å; F52-Y319 HydrophobicContact CD1-CD1 4.22Å; F52-Y319 HydrophobicContact CD1-CE1 4.23Å; F52-Y319 AromaticContact CD2-CD1 3.96Å; F52-Y319 HydrophobicContact CD2-CD1 3.96Å; F52-Y319 HydrophobicContact CD2-CE1 4.3Å; F52-Y319 HydrophobicContact CE1-CE1 4.27Å; F52-Y319 HydrophobicContact CE2-CD1 4.43Å; F52-Y319 HydrophobicContact CE2-CE1 4.34Å; F52-Y319 AromaticContact CG-CD1 3.84Å; F52-Y319 HydrophobicContact CG-CD1 3.84Å; F52-Y319 HydrophobicContact CG-CE1 4.24Å; F52-Y319 HydrophobicContact CZ-CE1 4.33Å; I55-Y319 HydrophobicContact CB-CD1 4.31Å; I55-Y319 HydrophobicContact CG2-CD1 3.82Å; I55-Y319 HydrophobicContact CG2-CE1 3.9Å; I55-Y319 HydrophobicContact CG2-CG 4.48Å; L59-Y319 HydrophobicContact CD1-CD2 4.08Å; L59-Y319 HydrophobicContact CD1-CE2 4.24Å; L59-Y319 HydrophobicContact CD1-CG 4.38Å; L315-Y319 HydrophobicContact CD1-CD2 4.23Å; L315-Y319 HydrophobicContact CD1-CE2 3.86Å; L315-Y319 HydrophobicContact CG-CD2 4.19Å; L315-Y319 HydrophobicContact CG-CE2 4.08Å; L315-Y319 VanDerWaalsContact O-CD2 3.28Å; L315-Y319 WeakPolarHBondContact O-CD2 3.48Å; L315-Y319 PolarHBondContact O-N 3.34Å; L315-Y319 VanDerWaalsContact O-N 3.08Å; G316-Y319 PolarHBondContact O-N 3.41Å; I317-Y319 PolarHBondContact O-N 3.43Å; Y319-G323 PolarHBondContact O-N 2.96Å
320	I	98.1	Very high	95.6	Very high	50 Å²	50	58.6 Å²	58.6	26%	0.256	32%	0.324	S	S	.	.	H	α-helix	trans	-63.6	-46.8	177.3	-65.9	167.1	0	0	0	110.7	V57 L60 G316 I317 G323 A324	V57-I320 HydrophobicContact CG2-CD1 4.06Å; V57-I320 HydrophobicContact CG2-CG1 4.35Å; L60-I320 HydrophobicContact CD2-CD1 4.1Å; G316-I320 WeakPolarHBondContact O-CG1 3.33Å; G316-I320 PolarHBondContact O-N 3.2Å; G316-I320 VanDerWaalsContact O-N 3.11Å; I317-I320 PolarHBondContact O-N 3.21Å; I320-G323 PolarHBondContact O-N 3.13Å; I320-A324 VanDerWaalsContact O-CB 3.32Å; I320-A324 WeakPolarHBondContact O-CB 3.27Å; I320-A324 PolarHBondContact O-N 3.08Å
321	V	98.1	Very high	96	Very high	73 Å²	73	61.3 Å²	61.3	44%	0.442	33%	0.33	S	S	.	.	H	α-helix	trans	-64.4	-49	-178.7	170	0	0	0	0	111	I317 A318 G323 A324 I325	I317-V321 HydrophobicContact CG2-CG2 4.03Å; I317-V321 WeakPolarHBondContact O-CB 3.39Å; I317-V321 VanDerWaalsContact O-CG2 3.28Å; I317-V321 WeakPolarHBondContact O-CG2 3.47Å; I317-V321 PolarHBondContact O-N 3.17Å; A318-V321 PolarHBondContact O-N 3.25Å; V321-G323 VanDerWaalsContact C-N 3.33Å; V321-G323 PolarHBondContact O-N 3.48Å; V321-A324 PolarHBondContact O-N 2.87Å; V321-I325 HydrophobicContact CG1-CD1 3.79Å; V321-I325 HydrophobicContact CG1-CG1 4.48Å; V321-I325 VanDerWaalsContact O-CG1 3.28Å; V321-I325 WeakPolarHBondContact O-CG1 3.3Å; V321-I325 PolarHBondContact O-N 3.1Å
322	V	98	Very high	96.3	Very high	66 Å²	66	59.7 Å²	59.7	40%	0.4	33%	0.332	S	S	.	.	H	α-helix	trans	-62.2	-43.2	177.6	172.6	0	0	0	0	110.5	F52 A318 A324 I325 C326	F52-V322 HydrophobicContact CD2-CB 4.44Å; F52-V322 HydrophobicContact CD2-CG1 3.99Å; F52-V322 HydrophobicContact CE2-CG1 4.18Å; A318-V322 WeakPolarHBondContact O-CB 3.28Å; A318-V322 VanDerWaalsContact O-CG2 3.26Å; A318-V322 WeakPolarHBondContact O-CG2 3.28Å; A318-V322 PolarHBondContact O-N 3.07Å; V322-A324 PolarHBondContact O-N 3.38Å; V322-I325 PolarHBondContact O-N 3.19Å; V322-C326 PolarHBondContact O-N 3.11Å; V322-C326 PolarHBondContact O-SG 3.16Å; V322-C326 VanDerWaalsContact O-SG 3.34Å
323	G	98.1	Very high	96.3	Very high	0 Å²	0	58.7 Å²	58.7	0%	0	33%	0.327	C	S	.	.	H	α-helix	trans	-60.8	-43.9	176.3	0	0	0	0	0	112.8	Y319 I320 V321 C326 I327	Y319-G323 PolarHBondContact O-N 2.96Å; I320-G323 PolarHBondContact O-N 3.13Å; V321-G323 VanDerWaalsContact C-N 3.33Å; V321-G323 PolarHBondContact O-N 3.48Å; G323-C326 PolarHBondContact O-N 3.03Å; G323-I327 WeakPolarHBondContact O-CG1 3.23Å; G323-I327 PolarHBondContact O-N 3.44Å
324	A	97.9	Very high	96.3	Very high	43 Å²	43	59.1 Å²	59.1	36%	0.355	33%	0.326	S	S	.	.	H	α-helix	trans	-63.8	-44.1	175.9	0	0	0	0	0	111.9	I320 V321 V322 C326 I327 T328	I320-A324 VanDerWaalsContact O-CB 3.32Å; I320-A324 WeakPolarHBondContact O-CB 3.27Å; I320-A324 PolarHBondContact O-N 3.08Å; V321-A324 PolarHBondContact O-N 2.87Å; V322-A324 PolarHBondContact O-N 3.38Å; A324-C326 VanDerWaalsContact C-N 3.32Å; A324-C326 PolarHBondContact O-N 3.02Å; A324-I327 PolarHBondContact O-N 3.32Å; A324-T328 WeakPolarHBondContact O-CG2 3.08Å; A324-T328 PolarHBondContact O-N 2.82Å; A324-T328 PolarHBondContact O-OG1 3.33Å
325	I	97.9	Very high	96.2	Very high	85 Å²	85	57.5 Å²	57.5	44%	0.436	32%	0.319	S	S	.	.	H	α-helix	trans	-58.7	-45.4	174.4	-69.4	167.7	0	0	0	110.2	V321 V322 I327 T328 L329	V321-I325 HydrophobicContact CG1-CD1 3.79Å; V321-I325 HydrophobicContact CG1-CG1 4.48Å; V321-I325 VanDerWaalsContact O-CG1 3.28Å; V321-I325 WeakPolarHBondContact O-CG1 3.3Å; V321-I325 PolarHBondContact O-N 3.1Å; V322-I325 PolarHBondContact O-N 3.19Å; I325-I327 PolarHBondContact O-N 2.99Å; I325-T328 WeakPolarHBondContact CA-OG1 3.07Å; I325-T328 PolarHBondContact O-N 3.36Å; I325-T328 PolarHBondContact O-OG1 2.9Å; I325-L329 HydrophobicContact CG2-CD1 3.67Å; I325-L329 HydrophobicContact CG2-CG 4.18Å; I325-L329 WeakPolarHBondContact O-CB 3.46Å; I325-L329 WeakPolarHBondContact O-CG 3.41Å; I325-L329 PolarHBondContact O-N 3.43Å
326	C	97.4	Very high	96	Very high	16 Å²	16	58 Å²	58	11%	0.108	32%	0.321	C	S	.	.	H	α-helix	trans	-59.5	-42.4	177.6	-74.2	0	0	0	0	112.9	F45 V322 G323 A324 G330	F45-C326 HydrophobicContact CD1-CB 4.06Å; V322-C326 PolarHBondContact O-N 3.11Å; V322-C326 PolarHBondContact O-SG 3.16Å; V322-C326 VanDerWaalsContact O-SG 3.34Å; G323-C326 PolarHBondContact O-N 3.03Å; A324-C326 VanDerWaalsContact C-N 3.32Å; A324-C326 PolarHBondContact O-N 3.02Å; C326-G330 PolarHBondContact O-N 3.17Å
327	I	97.1	Very high	95.7	Very high	45 Å²	45	61 Å²	61	23%	0.231	33%	0.334	C	S	.	.	H	α-helix	trans	-67.4	-46.4	177.4	-65.9	179.9	0	0	0	111.1	I53 G323 A324 I325 L329 G330 L331	I53-I327 HydrophobicContact CD1-CD1 3.53Å; G323-I327 WeakPolarHBondContact O-CG1 3.23Å; G323-I327 PolarHBondContact O-N 3.44Å; A324-I327 PolarHBondContact O-N 3.32Å; I325-I327 PolarHBondContact O-N 2.99Å; I327-L329 PolarHBondContact O-N 3.16Å; I327-G330 PolarHBondContact O-N 2.98Å; I327-L331 HydrophobicContact CG2-CD1 3.99Å; I327-L331 HydrophobicContact CG2-CG 4.34Å; I327-L331 WeakPolarHBondContact O-CG 3.33Å; I327-L331 PolarHBondContact O-N 3.13Å
328	T	96.9	Very high	95.3	Very high	84 Å²	84	62.4 Å²	62.4	52%	0.515	34%	0.34	S	S	.	.	H	α-helix	trans	-61.8	-44.7	180	58	0	0	0	0	112	A324 I325 L331 A332	A324-T328 WeakPolarHBondContact O-CG2 3.08Å; A324-T328 PolarHBondContact O-N 2.82Å; A324-T328 PolarHBondContact O-OG1 3.33Å; I325-T328 WeakPolarHBondContact CA-OG1 3.07Å; I325-T328 PolarHBondContact O-N 3.36Å; I325-T328 PolarHBondContact O-OG1 2.9Å; T328-L331 PolarHBondContact O-N 3.35Å; T328-A332 WeakPolarHBondContact O-CB 3.42Å; T328-A332 PolarHBondContact O-N 3.17Å
329	L	95.6	Very high	94.8	Very high	82 Å²	82	69.3 Å²	69.3	43%	0.429	36%	0.36	S	S	.	.	H	α-helix	trans	-64	-41.4	173.9	-69.3	176	0	0	0	111.7	F45 I325 I327 L331 A332 L333	F45-L329 HydrophobicContact CE1-CB 4.36Å; F45-L329 HydrophobicContact CE1-CD1 4.34Å; I325-L329 HydrophobicContact CG2-CD1 3.67Å; I325-L329 HydrophobicContact CG2-CG 4.18Å; I325-L329 WeakPolarHBondContact O-CB 3.46Å; I325-L329 WeakPolarHBondContact O-CG 3.41Å; I325-L329 PolarHBondContact O-N 3.43Å; I327-L329 PolarHBondContact O-N 3.16Å; L329-L331 PolarHBondContact O-N 3.2Å; L329-A332 PolarHBondContact O-N 2.98Å; L329-L333 WeakPolarHBondContact O-CB 3.45Å; L329-L333 VanDerWaalsContact O-CG 3.3Å; L329-L333 WeakPolarHBondContact O-CG 3.33Å; L329-L333 PolarHBondContact O-N 2.76Å
330	G	95.3	Very high	94	Very high	0 Å²	0	69.5 Å²	69.5	0%	0	37%	0.372	C	S	.	.	H	α-helix	trans	-58.5	-44.2	174.6	0	0	0	0	0	112.6	C326 I327 L334	C326-G330 PolarHBondContact O-N 3.17Å; I327-G330 PolarHBondContact O-N 2.98Å; G330-L334 VanDerWaalsContact O-CB 3.25Å; G330-L334 WeakPolarHBondContact O-CB 3.48Å; G330-L334 PolarHBondContact O-N 3.37Å
331	L	95.1	Very high	92.3	Very high	94 Å²	94	69.6 Å²	69.6	49%	0.492	38%	0.376	S	S	.	.	H	α-helix	trans	-66.4	-43	176	-70.9	172.6	0	0	0	112.4	F46 I327 T328 L329 L334 F335	F46-L331 HydrophobicContact CE1-CD2 4.04Å; F46-L331 HydrophobicContact CE1-CG 4.14Å; F46-L331 HydrophobicContact CZ-CD2 4.05Å; F46-L331 HydrophobicContact CZ-CG 4.29Å; I327-L331 HydrophobicContact CG2-CD1 3.99Å; I327-L331 HydrophobicContact CG2-CG 4.34Å; I327-L331 WeakPolarHBondContact O-CG 3.33Å; I327-L331 PolarHBondContact O-N 3.13Å; T328-L331 PolarHBondContact O-N 3.35Å; L329-L331 PolarHBondContact O-N 3.2Å; L331-L334 PolarHBondContact O-N 3.23Å; L331-F335 WeakPolarHBondContact O-CB 3.32Å; L331-F335 PolarHBondContact O-N 3.36Å
332	A	93.6	Very high	90.3	Very high	49 Å²	49	76.4 Å²	76.4	41%	0.405	39%	0.394	S	S	.	.	H	α-helix	trans	-63.2	-46.8	177.3	0	0	0	0	0	111.7	T328 L329 L334 F335 I336	T328-A332 WeakPolarHBondContact O-CB 3.42Å; T328-A332 PolarHBondContact O-N 3.17Å; L329-A332 PolarHBondContact O-N 2.98Å; A332-L334 VanDerWaalsContact C-N 3.31Å; A332-L334 PolarHBondContact O-N 3.41Å; A332-F335 PolarHBondContact O-N 3.5Å; A332-I336 VanDerWaalsContact O-CG1 3.31Å; A332-I336 WeakPolarHBondContact O-CG1 3.31Å; A332-I336 PolarHBondContact O-N 3Å
333	L	92.3	Very high	87.9	Confident	76 Å²	76	77.9 Å²	77.9	40%	0.398	41%	0.407	S	S	.	.	H	α-helix	trans	-64.1	-36.3	175.9	-70.9	174.3	0	0	0	111.8	L42 F45 L329 I336 H337	L42-L333 HydrophobicContact CD1-CB 3.85Å; F45-L333 HydrophobicContact CD2-CD1 4.29Å; F45-L333 HydrophobicContact CE2-CD1 3.93Å; L329-L333 WeakPolarHBondContact O-CB 3.45Å; L329-L333 VanDerWaalsContact O-CG 3.3Å; L329-L333 WeakPolarHBondContact O-CG 3.33Å; L329-L333 PolarHBondContact O-N 2.76Å; L333-I336 PolarHBondContact O-N 2.69Å; L333-H337 VanDerWaalsContact O-CB 3.24Å; L333-H337 WeakPolarHBondContact O-CB 3.15Å; L333-H337 PolarHBondContact O-N 2.8Å
334	L	93.4	Very high	85.6	Confident	58 Å²	58	84.7 Å²	84.7	30%	0.304	44%	0.442	S	S	.	.	H	α-helix	trans	-64.8	-45.2	175.9	179	61	0	0	0	110.3	L42 G330 L331 A332 H337 M338	L42-L334 HydrophobicContact CD1-CB 3.89Å; L42-L334 HydrophobicContact CD2-CB 4.15Å; L42-L334 HydrophobicContact CD2-CD1 3.82Å; L42-L334 HydrophobicContact CD2-CG 4.42Å; G330-L334 VanDerWaalsContact O-CB 3.25Å; G330-L334 WeakPolarHBondContact O-CB 3.48Å; G330-L334 PolarHBondContact O-N 3.37Å; L331-L334 PolarHBondContact O-N 3.23Å; A332-L334 VanDerWaalsContact C-N 3.31Å; A332-L334 PolarHBondContact O-N 3.41Å; L334-H337 PolarHBondContact O-N 3.07Å; L334-M338 HydrophobicContact CD1-CG 4.36Å; L334-M338 HydrophobicContact CG-CE 4.28Å; L334-M338 VanDerWaalsContact O-CG 3.31Å; L334-M338 WeakPolarHBondContact O-CG 3.46Å; L334-M338 PolarHBondContact O-N 3.19Å
335	F	92.6	Very high	82.8	Confident	113 Å²	113	90.2 Å²	90.2	50%	0.496	46%	0.464	S	S	.	.	H	α-helix	trans	-60.7	-47.5	176.6	179.4	-97	0	0	0	112	L331 A332 H337 M338 R339	L331-F335 WeakPolarHBondContact O-CB 3.32Å; L331-F335 PolarHBondContact O-N 3.36Å; A332-F335 PolarHBondContact O-N 3.5Å; F335-H337 VanDerWaalsContact C-N 3.35Å; F335-H337 PolarHBondContact O-N 3.08Å; F335-M338 PolarHBondContact O-N 3.05Å; F335-R339 HydrophobicContact CD1-CG 4.4Å; F335-R339 HydrophobicContact CE1-CG 4Å; F335-R339 HydrophobicContact CE2-CG 4.37Å; F335-R339 HydrophobicContact CZ-CG 3.99Å; F335-R339 WeakPolarHBondContact O-CG 3.33Å; F335-R339 PolarHBondContact O-N 3.06Å
336	I	90.9	Very high	80	Confident	92 Å²	92	92 Å²	92	47%	0.472	48%	0.479	S	S	.	.	H	α-helix	trans	-61.4	-45.3	176.3	-67.1	165.4	0	0	0	110.2	A332 L333 M338 R339 C340	A332-I336 VanDerWaalsContact O-CG1 3.31Å; A332-I336 WeakPolarHBondContact O-CG1 3.31Å; A332-I336 PolarHBondContact O-N 3Å; L333-I336 PolarHBondContact O-N 2.69Å; I336-M338 PolarHBondContact O-N 3.15Å; I336-R339 PolarHBondContact O-N 3.07Å; I336-C340 WeakPolarHBondContact O-CB 3.23Å; I336-C340 PolarHBondContact O-N 3.21Å
337	H	88.6	Confident	77	Confident	65 Å²	65	103.7 Å²	103.7	30%	0.301	53%	0.531	S	S	.	.	H	α-helix	trans	-60.8	-44.5	178.1	-171.8	61.7	0	0	0	111.1	L333 L334 F335 R339 S341	L333-H337 VanDerWaalsContact O-CB 3.24Å; L333-H337 WeakPolarHBondContact O-CB 3.15Å; L333-H337 PolarHBondContact O-N 2.8Å; L334-H337 PolarHBondContact O-N 3.07Å; F335-H337 VanDerWaalsContact C-N 3.35Å; F335-H337 PolarHBondContact O-N 3.08Å; H337-R339 VanDerWaalsContact C-N 3.31Å; H337-R339 PolarHBondContact O-N 2.73Å; H337-S341 WeakPolarHBondContact O-CA 3.46Å; H337-S341 WeakPolarHBondContact O-CB 3.49Å; H337-S341 PolarHBondContact O-N 3.45Å
338	M	88.1	Confident	76	Confident	113 Å²	113	106.7 Å²	106.7	56%	0.557	55%	0.547	S	S	*	.	H	α-helix	trans	-62.9	-35.4	176.3	-71.4	-168.8	-59.7	0	0	113	L334 F335 I336	L334-M338 HydrophobicContact CD1-CG 4.36Å; L334-M338 HydrophobicContact CG-CE 4.28Å; L334-M338 VanDerWaalsContact O-CG 3.31Å; L334-M338 WeakPolarHBondContact O-CG 3.46Å; L334-M338 PolarHBondContact O-N 3.19Å; F335-M338 PolarHBondContact O-N 3.05Å; I336-M338 PolarHBondContact O-N 3.15Å
339	R	88.6	Confident	74.9	Confident	176 Å²	176	107.8 Å²	107.8	66%	0.664	55%	0.548	S	S	*	.	H	α-helix	trans	-76.4	-46	179.1	-74.4	-71.4	-173.4	168.2	0.3	113	F335 I336 H337	F335-R339 HydrophobicContact CD1-CG 4.4Å; F335-R339 HydrophobicContact CE1-CG 4Å; F335-R339 HydrophobicContact CE2-CG 4.37Å; F335-R339 HydrophobicContact CZ-CG 3.99Å; F335-R339 WeakPolarHBondContact O-CG 3.33Å; F335-R339 PolarHBondContact O-N 3.06Å; I336-R339 PolarHBondContact O-N 3.07Å; H337-R339 VanDerWaalsContact C-N 3.31Å; H337-R339 PolarHBondContact O-N 2.73Å
340	C	80.2	Confident	73.7	Confident	80 Å²	80	109.3 Å²	109.3	54%	0.541	56%	0.555	S	S	.	*	H	α-helix	trans	-89.7	-22.9	-173.4	-64.2	0	0	0	0	113.8	I336 R342 S343	I336-C340 WeakPolarHBondContact O-CB 3.23Å; I336-C340 PolarHBondContact O-N 3.21Å; C340-R342 PolarHBondContact O-N 2.99Å; C340-S343 PolarHBondContact O-N 3.09Å; C340-S343 VanDerWaalsContact O-N 3.13Å
341	S	63.5	Low	72.5	Confident	51 Å²	51	115.7 Å²	115.7	36%	0.357	59%	0.587	S	S	.	*	G	3₁₀ helix	trans	-68.3	-18.1	177.5	-164.7	0	0	0	0	112.4	H337 S343 I344	H337-S341 WeakPolarHBondContact O-CA 3.46Å; H337-S341 WeakPolarHBondContact O-CB 3.49Å; H337-S341 PolarHBondContact O-N 3.45Å; S341-S343 PolarHBondContact O-N 3.11Å; S341-I344 PolarHBondContact O-N 3.39Å
342	R	54.9	Low	71	Confident	217 Å²	217	117.1 Å²	117.1	82%	0.819	59%	0.593	S	S	*	*	G	3₁₀ helix	trans	-68.3	-8.6	170.8	-79.9	-172.5	176.2	-172	-0.9	114.5	C340	C340-R342 PolarHBondContact O-N 2.99Å
343	S	47.8	Very low	69.5	Low	97 Å²	97	121.6 Å²	121.6	68%	0.678	61%	0.606	S	S	*	*	G	3₁₀ helix	trans	-95.9	2.5	177.4	-67.6	0	0	0	0	114.6	C340 S341	C340-S343 PolarHBondContact O-N 3.09Å; C340-S343 VanDerWaalsContact O-N 3.13Å; S341-S343 PolarHBondContact O-N 3.11Å
344	I	49.4	Very low	67.9	Low	142 Å²	142	124.9 Å²	124.9	73%	0.728	62%	0.621	S	S	*	*			trans	-103.2	58.5	171.1	-46.4	177.6	0	0	0	108.9	S341	S341-I344 PolarHBondContact O-N 3.39Å
345	I	39.9	Very low	66	Low	159 Å²	159	130 Å²	130	82%	0.815	65%	0.645	S	S	*	*			trans	-116.7	89.5	151.7	-61.4	173.6	0	0	0	103.1
346	V	38.4	Very low	63.7	Low	124 Å²	124	131.4 Å²	131.4	75%	0.752	66%	0.658	S	S	*	*			trans	-115	128.1	169.6	-179.6	0	0	0	0	106
347	H	34.7	Very low	61.3	Low	261 Å²	261	135 Å²	135	100%	1.208	68%	0.675	S	S	*	*			trans	-26.1	0	178.3	-80	-76.4	0	0	0	118.3

Retrieved 347 of 347 residues in 79.1 ms (Link to these results)

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