A0A087Y3E8_POEFO Loading...

MKRN2 opposite strand

AlphaFold DB , UniProt , Accession A0A087Y3E8, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 258 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	42.6	Very low	43	Very low	241 Å²	241	152.4 Å²	152.4	100%	1.187	80%	0.804	S	S	*	*				0	108.6	0	-78.2	-175.6	147.1	0	0	109
2	S	37.5	Very low	43.8	Very low	126 Å²	126	157.8 Å²	157.8	88%	0.881	81%	0.806	S	S	*	*			trans	-179	115.3	143.4	-86.2	0	0	0	0	107.4
3	S	38.1	Very low	44.4	Very low	104 Å²	104	161 Å²	161	73%	0.727	80%	0.802	S	S	*	*			trans	-117.4	107.1	179.4	178.7	0	0	0	0	106.3	R5	S3-R5 PolarHBondContact O-N 2.74Å
4	D	43.2	Very low	44.9	Very low	160 Å²	160	163 Å²	163	86%	0.856	80%	0.795	S	S	*	*			trans	-80.1	103.6	174.1	-79.9	-32	0	0	0	109.6
5	R	42.7	Very low	45.7	Very low	216 Å²	216	165.1 Å²	165.1	82%	0.815	79%	0.791	S	S	*	*			trans	-85.5	110	167	-75.8	-178	-177.7	-179.7	0.5	109.1	S3 Y7	S3-R5 PolarHBondContact O-N 2.74Å; R5-Y7 PolarHBondContact O-N 3.47Å
6	L	46.8	Very low	46.1	Very low	172 Å²	172	157.1 Å²	157.1	90%	0.901	77%	0.765	S	S	*	*			trans	-60.4	119.7	166.9	-89.1	118.6	0	0	0	110.7
7	Y	38.4	Very low	46.5	Very low	211 Å²	211	156 Å²	156	83%	0.827	76%	0.758	S	S	*	*			trans	-71.6	131.4	176.7	-83.2	-98.4	0	0	0	111.7	R5 G9	R5-Y7 PolarHBondContact O-N 3.47Å; Y7-G9 PolarHBondContact O-N 3.22Å; Y7-G9 VanDerWaalsContact O-N 3.08Å
8	P	46.7	Very low	46.9	Very low	113 Å²	113	154 Å²	154	73%	0.734	75%	0.747	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.5	1.2	-178.8	-15	28.2	0	0	0	115.7
9	G	45.8	Very low	47.4	Very low	49 Å²	49	148.9 Å²	148.9	51%	0.505	73%	0.733	S	S	.	*	H	α-helix	trans	-76.9	-27.6	-168.7	0	0	0	0	0	115.6	Y7	Y7-G9 PolarHBondContact O-N 3.22Å; Y7-G9 VanDerWaalsContact O-N 3.08Å
10	N	44.2	Very low	47.8	Very low	129 Å²	129	149.2 Å²	149.2	69%	0.69	73%	0.73	S	S	*	*	H	α-helix	trans	-81.8	-22.6	-170.3	-93.4	-10.8	0	0	0	114.8
11	Q	47.4	Very low	47.9	Very low	155 Å²	155	146.8 Å²	146.8	72%	0.724	72%	0.717	S	S	*	*	H	α-helix	trans	-76.3	-30.4	177.3	-87	176	-15.3	0	0	113.2	R15	Q11-R15 PolarHBondContact O-N 3.28Å
12	R	52.4	Low	48.5	Very low	217 Å²	217	144 Å²	144	82%	0.819	69%	0.693	S	S	*	*	H	α-helix	trans	-70.9	-36.6	178.3	-81.1	-174.4	174.9	-169.8	-1.1	112.7	G16	R12-G16 PolarHBondContact O-N 2.94Å
13	R	51	Low	49.2	Very low	200 Å²	200	147.9 Å²	147.9	76%	0.755	69%	0.689	S	S	*	*	H	α-helix	trans	-65.7	-46.2	177.4	-95.2	-177.8	162	-178	-5.8	112.6	R15 G16 E17	R13-R15 PolarHBondContact O-N 3.39Å; R13-G16 PolarHBondContact O-N 3.19Å; R13-G16 VanDerWaalsContact O-N 3.16Å; R13-E17 PolarHBondContact O-N 2.86Å
14	R	52.5	Low	49.8	Very low	189 Å²	189	151.8 Å²	151.8	71%	0.713	69%	0.687	S	S	*	*	H	α-helix	trans	-62	-41.3	177.8	-76.1	-171.9	175.3	-175.2	-0.9	113.2	G16 E17 E18	R14-G16 VanDerWaalsContact C-N 3.28Å; R14-G16 PolarHBondContact O-N 3.46Å; R14-E17 PolarHBondContact O-N 2.91Å; R14-E18 PolarHBondContact O-N 2.62Å; R14-E18 VanDerWaalsContact O-N 3.11Å
15	R	55.9	Low	50.1	Low	195 Å²	195	151 Å²	151	74%	0.736	68%	0.677	S	S	*	*	H	α-helix	trans	-63.7	-32.8	175.5	-75.4	-173.2	-178.1	-143.3	1.7	113	Q11 R13 A19	Q11-R15 PolarHBondContact O-N 3.28Å; R13-R15 PolarHBondContact O-N 3.39Å; R15-A19 WeakPolarHBondContact O-CB 2.86Å; R15-A19 PolarHBondContact O-N 3.45Å
16	G	51.7	Low	50.4	Low	36 Å²	36	150 Å²	150	37%	0.371	67%	0.672	S	S	.	*	H	α-helix	trans	-70.5	-35	177.4	0	0	0	0	0	113.6	R12 R13 R14 K20	R12-G16 PolarHBondContact O-N 2.94Å; R13-G16 PolarHBondContact O-N 3.19Å; R13-G16 VanDerWaalsContact O-N 3.16Å; R14-G16 VanDerWaalsContact C-N 3.28Å; R14-G16 PolarHBondContact O-N 3.46Å; G16-K20 WeakPolarHBondContact O-CG 2.8Å; G16-K20 PolarHBondContact O-N 2.64Å
17	E	53.6	Low	50.4	Low	139 Å²	139	144.9 Å²	144.9	65%	0.65	65%	0.651	S	S	*	*	H	α-helix	trans	-76	-42.1	177.4	-74.4	178.1	159.5	0	0	112.1	R13 R14 A19 K20 E21	R13-E17 PolarHBondContact O-N 2.86Å; R14-E17 PolarHBondContact O-N 2.91Å; E17-A19 VanDerWaalsContact C-N 3.29Å; E17-A19 PolarHBondContact O-N 2.77Å; E17-K20 PolarHBondContact O-N 3.41Å; E17-K20 VanDerWaalsContact O-N 3.15Å; E17-E21 WeakPolarHBondContact O-CB 3.27Å; E17-E21 PolarHBondContact O-N 3.4Å
18	E	54.3	Low	50.3	Low	120 Å²	120	136.5 Å²	136.5	56%	0.561	63%	0.629	S	S	*	*	H	α-helix	trans	-62.5	-35.1	174.3	-73.2	178.4	173.7	0	0	112.5	R14 R22	R14-E18 PolarHBondContact O-N 2.62Å; R14-E18 VanDerWaalsContact O-N 3.11Å; E18-R22 WeakPolarHBondContact O-CB 3.47Å; E18-R22 VanDerWaalsContact O-CG 3.25Å; E18-R22 WeakPolarHBondContact O-CG 3.46Å; E18-R22 PolarHBondContact O-N 2.98Å
19	A	55.2	Low	50	Low	57 Å²	57	134.6 Å²	134.6	47%	0.471	62%	0.618	S	S	.	*	H	α-helix	trans	-69.6	-36	174.7	0	0	0	0	0	112.6	R15 E17 R23	R15-A19 WeakPolarHBondContact O-CB 2.86Å; R15-A19 PolarHBondContact O-N 3.45Å; E17-A19 VanDerWaalsContact C-N 3.29Å; E17-A19 PolarHBondContact O-N 2.77Å; A19-R23 WeakPolarHBondContact O-CB 3.37Å; A19-R23 PolarHBondContact O-N 3.37Å
20	K	55.4	Low	49.7	Very low	154 Å²	154	137.6 Å²	137.6	67%	0.67	62%	0.623	S	S	*	*	H	α-helix	trans	-70.5	-40	174.8	-80.4	-178.4	176.8	-176.8	0	112.2	G16 E17 R23 R24	G16-K20 WeakPolarHBondContact O-CG 2.8Å; G16-K20 PolarHBondContact O-N 2.64Å; E17-K20 PolarHBondContact O-N 3.41Å; E17-K20 VanDerWaalsContact O-N 3.15Å; K20-R23 PolarHBondContact O-N 2.87Å; K20-R24 PolarHBondContact O-N 2.79Å
21	E	50.6	Low	49.3	Very low	99 Å²	99	135 Å²	135	46%	0.463	61%	0.613	S	S	.	*	H	α-helix	trans	-64.9	-42.9	175.7	-168	70.9	-158.7	0	0	111.2	E17 R23 R24 K25	E17-E21 WeakPolarHBondContact O-CB 3.27Å; E17-E21 PolarHBondContact O-N 3.4Å; E21-R23 PolarHBondContact O-N 3.12Å; E21-R24 PolarHBondContact O-N 3.27Å; E21-K25 WeakPolarHBondContact O-CG 3.47Å; E21-K25 PolarHBondContact O-N 3.15Å
22	R	55	Low	48.7	Very low	184 Å²	184	134.2 Å²	134.2	69%	0.694	61%	0.61	S	S	*	*	H	α-helix	trans	-65.5	-35.7	174.2	-74.5	175.2	-179	-120.2	2	112.7	E18 R26	E18-R22 WeakPolarHBondContact O-CB 3.47Å; E18-R22 VanDerWaalsContact O-CG 3.25Å; E18-R22 WeakPolarHBondContact O-CG 3.46Å; E18-R22 PolarHBondContact O-N 2.98Å; R22-R26 WeakPolarHBondContact O-CB 3.47Å; R22-R26 PolarHBondContact O-N 3.04Å
23	R	52.2	Low	47.9	Very low	207 Å²	207	127.5 Å²	127.5	78%	0.781	60%	0.601	S	S	*	*	H	α-helix	trans	-66.9	-41.1	173.1	-111.8	-178.5	175.3	-174.8	-1.9	112	A19 K20 E21 R26 S27	A19-R23 WeakPolarHBondContact O-CB 3.37Å; A19-R23 PolarHBondContact O-N 3.37Å; K20-R23 PolarHBondContact O-N 2.87Å; E21-R23 PolarHBondContact O-N 3.12Å; R23-R26 PolarHBondContact O-N 2.96Å; R23-S27 WeakPolarHBondContact O-CB 3.2Å; R23-S27 PolarHBondContact O-N 2.82Å; R23-S27 PolarHBondContact O-OG 2.83Å
24	R	51.6	Low	47.1	Very low	186 Å²	186	122 Å²	122	70%	0.702	60%	0.598	S	S	*	*	H	α-helix	trans	-66.3	-37.9	175.3	-80	179.7	166.9	178.1	-5.9	112.8	K20 E21 S27 G28	K20-R24 PolarHBondContact O-N 2.79Å; E21-R24 PolarHBondContact O-N 3.27Å; R24-S27 WeakPolarHBondContact CA-OG 3.48Å; R24-S27 PolarHBondContact O-OG 2.93Å; R24-G28 PolarHBondContact O-N 3.05Å
25	K	48.9	Very low	46.3	Very low	144 Å²	144	120.5 Å²	120.5	63%	0.626	60%	0.599	S	S	*	*	H	α-helix	trans	-71.4	-36.2	175.1	-74.6	-177.9	179	-177.6	0	113	E21 S29	E21-K25 WeakPolarHBondContact O-CG 3.47Å; E21-K25 PolarHBondContact O-N 3.15Å; K25-S29 WeakPolarHBondContact O-CB 3.48Å; K25-S29 PolarHBondContact O-N 3.32Å
26	R	47.9	Very low	45.4	Very low	193 Å²	193	119 Å²	119	73%	0.728	60%	0.601	S	S	*	*	H	α-helix	trans	-67.8	-44.8	171.8	-83.2	-176.1	172.9	-172.1	-4.3	112.2	R22 R23 G28 S29 D30	R22-R26 WeakPolarHBondContact O-CB 3.47Å; R22-R26 PolarHBondContact O-N 3.04Å; R23-R26 PolarHBondContact O-N 2.96Å; R26-G28 VanDerWaalsContact C-N 3.31Å; R26-G28 PolarHBondContact O-N 3.33Å; R26-S29 PolarHBondContact O-N 2.8Å; R26-D30 WeakPolarHBondContact O-CB 3.22Å; R26-D30 PolarHBondContact O-N 3.4Å
27	S	47.7	Very low	44.9	Very low	66 Å²	66	125.4 Å²	125.4	46%	0.462	62%	0.621	S	S	.	*	H	α-helix	trans	-64.9	-34.6	176.4	64.6	0	0	0	0	112.5	R23 R24 C31	R23-S27 WeakPolarHBondContact O-CB 3.2Å; R23-S27 PolarHBondContact O-N 2.82Å; R23-S27 PolarHBondContact O-OG 2.83Å; R24-S27 WeakPolarHBondContact CA-OG 3.48Å; R24-S27 PolarHBondContact O-OG 2.93Å; S27-C31 VanDerWaalsContact O-CB 3.29Å; S27-C31 WeakPolarHBondContact O-CB 3.46Å; S27-C31 PolarHBondContact O-N 3.13Å; S27-C31 VanDerWaalsContact O-N 3.17Å; S27-C31 PolarHBondContact O-SG 2.97Å
28	G	36.9	Very low	44.3	Very low	34 Å²	34	126 Å²	126	35%	0.351	63%	0.626	S	S	.	*	H	α-helix	trans	-71	-35.8	175.3	0	0	0	0	0	113.8	R24 R26 Q32	R24-G28 PolarHBondContact O-N 3.05Å; R26-G28 VanDerWaalsContact C-N 3.31Å; R26-G28 PolarHBondContact O-N 3.33Å; G28-Q32 WeakPolarHBondContact O-CG 3.47Å; G28-Q32 PolarHBondContact O-N 2.67Å
29	S	40.3	Very low	44.5	Very low	73 Å²	73	127.4 Å²	127.4	51%	0.51	63%	0.632	S	S	.	*	H	α-helix	trans	-77.3	-36.9	178.8	-177	0	0	0	0	112.9	K25 R26 Q32 A33	K25-S29 WeakPolarHBondContact O-CB 3.48Å; K25-S29 PolarHBondContact O-N 3.32Å; R26-S29 PolarHBondContact O-N 2.8Å; S29-Q32 PolarHBondContact O-N 3.46Å; S29-A33 PolarHBondContact O-N 2.81Å
30	D	38.4	Very low	45.5	Very low	113 Å²	113	129.7 Å²	129.7	60%	0.604	63%	0.633	S	S	*	*	H	α-helix	trans	-74	-30.9	176.8	-73.3	-23.2	0	0	0	111.3	R26 A33 A34	R26-D30 WeakPolarHBondContact O-CB 3.22Å; R26-D30 PolarHBondContact O-N 3.4Å; D30-A33 PolarHBondContact O-N 2.9Å; D30-A34 PolarHBondContact O-N 2.79Å
31	C	37	Very low	47	Very low	73 Å²	73	125 Å²	125	49%	0.493	62%	0.62	S	S	.	*	H	α-helix	trans	-68.3	-33.7	171	-72.8	0	0	0	0	112.5	S27 E35	S27-C31 VanDerWaalsContact O-CB 3.29Å; S27-C31 WeakPolarHBondContact O-CB 3.46Å; S27-C31 PolarHBondContact O-N 3.13Å; S27-C31 VanDerWaalsContact O-N 3.17Å; S27-C31 PolarHBondContact O-SG 2.97Å; C31-E35 WeakPolarHBondContact O-CG 3.36Å; C31-E35 PolarHBondContact O-N 3.48Å
32	Q	33.7	Very low	49.1	Very low	139 Å²	139	120.3 Å²	120.3	65%	0.65	60%	0.598	S	S	*	*	H	α-helix	trans	-73.8	-28.3	176.5	-76.1	179.9	-36.7	0	0	113.2	G28 S29	G28-Q32 WeakPolarHBondContact O-CG 3.47Å; G28-Q32 PolarHBondContact O-N 2.67Å; S29-Q32 PolarHBondContact O-N 3.46Å
33	A	35.1	Very low	50.9	Low	76 Å²	76	113 Å²	113	63%	0.628	57%	0.572	S	S	*	*	H	α-helix	trans	-79.1	-22.9	175.7	0	0	0	0	0	113.4	S29 D30	S29-A33 PolarHBondContact O-N 2.81Å; D30-A33 PolarHBondContact O-N 2.9Å
34	A	36.2	Very low	52.9	Low	84 Å²	84	105.1 Å²	105.1	69%	0.694	54%	0.544	S	S	*	.	S	Bend	trans	-88.1	-6.4	175.9	0	0	0	0	0	113.7	D30	D30-A34 PolarHBondContact O-N 2.79Å
35	E	34.6	Very low	54.8	Low	158 Å²	158	96.5 Å²	96.5	74%	0.738	51%	0.512	S	S	*	.	S	Bend	trans	-102.4	4	-179.7	-77.2	177.3	167.6	0	0	113.4	C31	C31-E35 WeakPolarHBondContact O-CG 3.36Å; C31-E35 PolarHBondContact O-N 3.48Å
36	E	36.3	Very low	56.8	Low	165 Å²	165	90.3 Å²	90.3	77%	0.771	49%	0.487	S	S	*	.			trans	-118.5	22	-179.5	-81	-172.1	170.2	0	0	114.8	M38	E36-M38 PolarHBondContact O-N 3Å
37	E	42	Very low	58.8	Low	169 Å²	169	82.7 Å²	82.7	79%	0.79	46%	0.459	S	S	*	.			trans	-77.2	78.5	146.9	-78.8	-166.9	168.1	0	0	107.1	E39	E37-E39 VanDerWaalsContact C-N 3.34Å; E37-E39 PolarHBondContact O-N 2.96Å
38	M	41.9	Very low	60.8	Low	152 Å²	152	82.1 Å²	82.1	75%	0.749	46%	0.455	S	S	*	.			trans	-54.4	111	157.5	-69.7	-139.5	-50.1	0	0	105.4	E36 Q40	E36-M38 PolarHBondContact O-N 3Å; M38-Q40 PolarHBondContact O-N 2.6Å
39	E	58.5	Low	63.3	Low	149 Å²	149	87.7 Å²	87.7	70%	0.696	47%	0.472	S	S	*	.			trans	-54.9	90.2	167.1	-79.8	-175.2	156.6	0	0	106.6	E37 S41	E37-E39 VanDerWaalsContact C-N 3.34Å; E37-E39 PolarHBondContact O-N 2.96Å; E39-S41 PolarHBondContact O-N 3.32Å
40	Q	74.6	Confident	65.7	Low	105 Å²	105	86.8 Å²	86.8	49%	0.491	46%	0.459	S	S	.	.			trans	-64.8	113.8	-179.3	-75.8	-176.5	-17.9	0	0	105.8	M38 V42 F55	M38-Q40 PolarHBondContact O-N 2.6Å; Q40-V42 PolarHBondContact O-N 2.76Å; Q40-V42 VanDerWaalsContact O-N 3.14Å; Q40-F55 HydrophobicContact CB-CB 4.26Å; Q40-F55 HydrophobicContact CB-CD1 3.44Å; Q40-F55 VanDerWaalsContact CB-CD1 3.44Å; Q40-F55 HydrophobicContact CB-CE1 3.8Å; Q40-F55 HydrophobicContact CB-CG 3.86Å; Q40-F55 HydrophobicContact CB-CZ 4.49Å; Q40-F55 WeakPolarHBondContact O-CE1 3.44Å; Q40-F55 VanDerWaalsContact OE1-CG 3.23Å
41	S	88.7	Confident	68.3	Low	57 Å²	57	82.9 Å²	82.9	40%	0.399	44%	0.437	S	S	.	.	P	Polyproline II helix	trans	-60.5	124	-178.6	106	0	0	0	0	108	E39 I43 S79	E39-S41 PolarHBondContact O-N 3.32Å; S41-I43 PolarHBondContact O-N 2.75Å; S41-S79 WeakPolarHBondContact CB-OG 3.05Å; S41-S79 PolarHBondContact OG-OG 3.02Å
42	V	93.6	Very high	71	Confident	0 Å²	0	79.4 Å²	79.4	0%	0	41%	0.413	C	S	.	.	P	Polyproline II helix	trans	-68.3	125.2	174.3	177.4	0	0	0	0	107.8	Q40 F53 F55 L80 Y226 L229 I230 L233	Q40-V42 PolarHBondContact O-N 2.76Å; Q40-V42 VanDerWaalsContact O-N 3.14Å; V42-F53 HydrophobicContact CG1-CB 4.39Å; V42-F53 HydrophobicContact CG1-CD1 4.32Å; V42-F55 HydrophobicContact CG2-CD1 4.42Å; V42-F55 HydrophobicContact CG2-CE1 3.93Å; V42-L80 HydrophobicContact CB-CB 4.15Å; V42-L80 HydrophobicContact CB-CD2 4.41Å; V42-L80 HydrophobicContact CG1-CB 4.22Å; V42-L80 HydrophobicContact CG1-CD2 4.05Å; V42-L80 WeakPolarHBondContact O-CB 3.46Å; V42-L80 PolarHBondContact O-N 2.77Å; V42-Y226 HydrophobicContact CB-CE2 4.5Å; V42-Y226 HydrophobicContact CG2-CE2 4.26Å; V42-L229 HydrophobicContact CG1-CD2 3.86Å; V42-L229 HydrophobicContact CG1-CG 4.48Å; V42-I230 HydrophobicContact CG2-CD1 4.35Å; V42-I230 HydrophobicContact CG2-CG1 3.77Å; V42-L233 HydrophobicContact CG1-CD1 3.95Å; V42-L233 HydrophobicContact CG2-CD1 4.24Å
43	I	93.8	Very high	74	Confident	31 Å²	31	74.3 Å²	74.3	16%	0.159	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	135.4	176.1	-55.1	173.2	0	0	0	108.2	S41 F53 C54 V57 P77 V78	S41-I43 PolarHBondContact O-N 2.75Å; I43-F53 CarbonylContact O-C 3.49Å; I43-F53 VanDerWaalsContact O-CA 3.26Å; I43-F53 WeakPolarHBondContact O-CA 3.33Å; I43-C54 WeakPolarHBondContact CA-O 3.42Å; I43-C54 WeakPolarHBondContact CB-O 3.33Å; I43-C54 PolarHBondContact N-O 2.88Å; I43-C54 PolarHBondContact O-N 3.45Å; I43-V57 HydrophobicContact CD1-CG2 3.98Å; I43-V57 HydrophobicContact CG2-CG2 3.76Å; I43-P77 HydrophobicContact CG2-CB 3.62Å; I43-V78 CarbonylContact C-O 3.58Å; I43-V78 WeakPolarHBondContact CA-O 3.34Å
44	H	92.9	Very high	76.8	Confident	41 Å²	41	70.7 Å²	70.7	19%	0.19	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	135.1	176	165.6	-112.8	0	0	0	109.5	E51 I52 F53 P77 V78	H44-E51 IonicContact CD2-OE2 3.67Å; H44-E51 IonicContact CE1-OE2 3.78Å; H44-E51 PolarHBondContact CE1-OE2 3.14Å; H44-E51 IonicContact NE2-OE2 3.48Å; H44-E51 PolarHBondContact NE2-OE2 3.33Å; H44-I52 WeakPolarHBondContact CA-O 3.26Å; H44-F53 HydrophobicContact CB-CD1 3.97Å; H44-F53 HydrophobicContact CB-CE1 3.93Å; H44-F53 AromaticContact CD2-CE1 3.5Å; H44-F53 VanDerWaalsContact CD2-CE1 3.5Å; H44-F53 WeakPolarHBondContact CD2-CE1 3.24Å; H44-F53 AromaticContact CD2-CZ 3.58Å; H44-F53 AromaticContact CG-CE1 3.87Å; H44-P77 WeakPolarHBondContact O-CA 3.45Å; H44-V78 HydrophobicContact CB-CG2 4.05Å; H44-V78 PolarHBondContact N-O 3.15Å; H44-V78 WeakPolarHBondContact O-CG2 3.45Å; H44-V78 PolarHBondContact O-N 2.96Å
45	L	92.2	Very high	79.6	Confident	4 Å²	4	68.6 Å²	68.6	2%	0.021	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.1	153.6	172.1	66.6	159.4	0	0	0	110.5	I52 V57 L68 P77	L45-I52 HydrophobicContact CD2-CB 3.84Å; L45-I52 HydrophobicContact CD2-CG2 3.99Å; L45-I52 HydrophobicContact CG-CB 4.02Å; L45-I52 HydrophobicContact CG-CD1 4.4Å; L45-I52 PolarHBondContact N-O 2.98Å; L45-I52 PolarHBondContact O-N 2.83Å; L45-V57 HydrophobicContact CD1-CG1 4.12Å; L45-L68 HydrophobicContact CD1-CD1 3.89Å; L45-L68 HydrophobicContact CD1-CD2 3.96Å; L45-L68 HydrophobicContact CD1-CG 4.43Å; L45-P77 HydrophobicContact CB-CB 4.48Å
46	S	90.9	Very high	82.3	Confident	14 Å²	14	66.5 Å²	66.5	10%	0.098	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	132.7	177.1	-46.1	0	0	0	0	110.6	K50 E51 E75	S46-K50 WeakPolarHBondContact CA-O 3.49Å; S46-E51 WeakPolarHBondContact CB-OE2 3.45Å; S46-E51 PolarHBondContact OG-OE1 3.16Å; S46-E51 PolarHBondContact OG-OE2 2.92Å; S46-E75 WeakPolarHBondContact O-CB 3.05Å; S46-E75 WeakPolarHBondContact O-CG 3.31Å
47	H	90.6	Very high	84.8	Confident	33 Å²	33	61.1 Å²	61.1	15%	0.153	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.3	145.8	173.3	-171.1	83.9	0	0	0	110.2	Q49 K50 I52 C61 C64 L68	H47-Q49 PolarHBondContact O-N 2.89Å; H47-K50 PolarHBondContact N-O 3.49Å; H47-K50 WeakPolarHBondContact O-CA 3.45Å; H47-K50 WeakPolarHBondContact O-CB 3.32Å; H47-K50 PolarHBondContact O-N 3Å; H47-K50 VanDerWaalsContact O-O 3.12Å; H47-I52 HydrophobicContact CB-CD1 4.04Å; H47-C61 VanDerWaalsContact CD2-SG 3.56Å; H47-C64 VanDerWaalsContact CD2-SG 3.53Å; H47-C64 PolarHBondContact NE2-SG 3.24Å; H47-C64 VanDerWaalsContact NE2-SG 3.41Å; H47-L68 HydrophobicContact CB-CD2 3.7Å
48	C	89.2	Confident	87.1	Confident	55 Å²	55	54.9 Å²	54.9	37%	0.372	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	44.8	41.3	177	72.5	0	0	0	0	115.6	K50 C64	C48-K50 PolarHBondContact O-N 3.11Å; C48-C64 HydrophobicContact CB-CB 4.3Å
49	Q	88.8	Confident	89.4	Confident	151 Å²	151	55.7 Å²	55.7	71%	0.706	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	63	18.2	-176	-52.8	175.1	18.6	0	0	115	H47 R243	H47-Q49 PolarHBondContact O-N 2.89Å; Q49-R243 VanDerWaalsContact O-CB 3.24Å; Q49-R243 WeakPolarHBondContact O-CB 3.35Å; Q49-R243 PolarHBondContact O-N 3.2Å
50	K	91.2	Very high	91	Very high	54 Å²	54	52.3 Å²	52.3	24%	0.235	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	142.9	170.9	-59.6	-63.9	-170.9	173	0	110.2	S46 H47 C48 I52 A241 D242	S46-K50 WeakPolarHBondContact CA-O 3.49Å; H47-K50 PolarHBondContact N-O 3.49Å; H47-K50 WeakPolarHBondContact O-CA 3.45Å; H47-K50 WeakPolarHBondContact O-CB 3.32Å; H47-K50 PolarHBondContact O-N 3Å; H47-K50 VanDerWaalsContact O-O 3.12Å; C48-K50 PolarHBondContact O-N 3.11Å; K50-I52 HydrophobicContact CB-CG1 4.5Å; K50-A241 CarbonylContact C-O 3.54Å; K50-A241 WeakPolarHBondContact CA-O 3.44Å; K50-D242 WeakPolarHBondContact CE-OD1 3.46Å; K50-D242 IonicContact NZ-OD1 3.17Å; K50-D242 PolarHBondContact NZ-OD1 3.23Å; K50-D242 IonicContact NZ-OD2 2.98Å
51	E	93.3	Very high	91.8	Very high	31 Å²	31	47.4 Å²	47.4	15%	0.145	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	124.6	161.7	-54.9	-59.7	166.9	0	0	108	H44 S46 F53 L240 A241 R243	H44-E51 IonicContact CD2-OE2 3.67Å; H44-E51 IonicContact CE1-OE2 3.78Å; H44-E51 PolarHBondContact CE1-OE2 3.14Å; H44-E51 IonicContact NE2-OE2 3.48Å; H44-E51 PolarHBondContact NE2-OE2 3.33Å; S46-E51 WeakPolarHBondContact CB-OE2 3.45Å; S46-E51 PolarHBondContact OG-OE1 3.16Å; S46-E51 PolarHBondContact OG-OE2 2.92Å; E51-F53 HydrophobicContact CB-CE2 3.72Å; E51-F53 HydrophobicContact CB-CZ 4.23Å; E51-L240 WeakPolarHBondContact O-CA 3.42Å; E51-A241 HydrophobicContact CB-CB 4.33Å; E51-A241 PolarHBondContact N-O 3.37Å; E51-A241 PolarHBondContact O-N 3.35Å; E51-R243 HydrophobicContact CG-CB 4.32Å; E51-R243 WeakPolarHBondContact OE1-CD 3.44Å; E51-R243 VanDerWaalsContact OE1-CG 3.26Å; E51-R243 WeakPolarHBondContact OE1-CG 3.23Å; E51-R243 IonicContact OE1-NE 3.7Å
52	I	94.2	Very high	92.1	Very high	0 Å²	0	46.8 Å²	46.8	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	128.8	-177	-50.7	171.8	0	0	0	107.4	H44 L45 H47 K50 P62 L240	H44-I52 WeakPolarHBondContact CA-O 3.26Å; L45-I52 HydrophobicContact CD2-CB 3.84Å; L45-I52 HydrophobicContact CD2-CG2 3.99Å; L45-I52 HydrophobicContact CG-CB 4.02Å; L45-I52 HydrophobicContact CG-CD1 4.4Å; L45-I52 PolarHBondContact N-O 2.98Å; L45-I52 PolarHBondContact O-N 2.83Å; H47-I52 HydrophobicContact CB-CD1 4.04Å; K50-I52 HydrophobicContact CB-CG1 4.5Å; I52-P62 HydrophobicContact CG2-CG 4.42Å; I52-L240 HydrophobicContact CB-CD2 4.14Å; I52-L240 HydrophobicContact CG1-CD2 3.73Å; I52-L240 HydrophobicContact CG2-CD2 3.93Å
53	F	95.7	Very high	92	Very high	31 Å²	31	49.4 Å²	49.4	14%	0.136	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	136.1	175.5	-57.2	-98	0	0	0	109.4	V42 I43 H44 E51 L80 L229 L233 Y238 Y239	V42-F53 HydrophobicContact CG1-CB 4.39Å; V42-F53 HydrophobicContact CG1-CD1 4.32Å; I43-F53 CarbonylContact O-C 3.49Å; I43-F53 VanDerWaalsContact O-CA 3.26Å; I43-F53 WeakPolarHBondContact O-CA 3.33Å; H44-F53 HydrophobicContact CB-CD1 3.97Å; H44-F53 HydrophobicContact CB-CE1 3.93Å; H44-F53 AromaticContact CD2-CE1 3.5Å; H44-F53 VanDerWaalsContact CD2-CE1 3.5Å; H44-F53 WeakPolarHBondContact CD2-CE1 3.24Å; H44-F53 AromaticContact CD2-CZ 3.58Å; H44-F53 AromaticContact CG-CE1 3.87Å; E51-F53 HydrophobicContact CB-CE2 3.72Å; E51-F53 HydrophobicContact CB-CZ 4.23Å; F53-L80 HydrophobicContact CD1-CD2 4.43Å; F53-L80 HydrophobicContact CE1-CD2 4.38Å; F53-L229 HydrophobicContact CB-CD1 3.87Å; F53-L229 HydrophobicContact CB-CD2 4.2Å; F53-L229 HydrophobicContact CD1-CD2 3.7Å; F53-L229 HydrophobicContact CE1-CD2 4.29Å; F53-L229 HydrophobicContact CG-CD1 4.18Å; F53-L229 HydrophobicContact CG-CD2 4.04Å; F53-L233 HydrophobicContact CB-CD1 4.42Å; F53-L233 WeakPolarHBondContact O-CD2 3.4Å; F53-Y238 CarbonylContact O-C 3.59Å; F53-Y238 VanDerWaalsContact O-CA 3.31Å; F53-Y238 WeakPolarHBondContact O-CA 3.5Å; F53-Y239 AromaticContact CD2-CD1 3.67Å; F53-Y239 HydrophobicContact CD2-CD1 3.67Å; F53-Y239 HydrophobicContact CD2-CE1 4.38Å; F53-Y239 HydrophobicContact CE2-CD1 4.24Å; F53-Y239 HydrophobicContact CG-CD1 4.37Å; F53-Y239 PolarHBondContact N-O 3.12Å; F53-Y239 PolarHBondContact O-N 2.83Å
54	C	94.6	Very high	92	Very high	1 Å²	1	50.7 Å²	50.7	1%	0.007	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-162.1	163.2	-175.4	55.7	0	0	0	0	111.3	I43 T56	I43-C54 WeakPolarHBondContact CA-O 3.42Å; I43-C54 WeakPolarHBondContact CB-O 3.33Å; I43-C54 PolarHBondContact N-O 2.88Å; I43-C54 PolarHBondContact O-N 3.45Å; C54-T56 PolarHBondContact SG-O 2.7Å
55	F	94	Very high	91.9	Very high	39 Å²	39	51.1 Å²	51.1	17%	0.171	29%	0.294	C	S	.	.	S	Bend	trans	-85	-20.4	169.2	-63.7	-52.1	0	0	0	112.9	Q40 V42 I230 L233 Q234	Q40-F55 HydrophobicContact CB-CB 4.26Å; Q40-F55 HydrophobicContact CB-CD1 3.44Å; Q40-F55 VanDerWaalsContact CB-CD1 3.44Å; Q40-F55 HydrophobicContact CB-CE1 3.8Å; Q40-F55 HydrophobicContact CB-CG 3.86Å; Q40-F55 HydrophobicContact CB-CZ 4.49Å; Q40-F55 WeakPolarHBondContact O-CE1 3.44Å; Q40-F55 VanDerWaalsContact OE1-CG 3.23Å; V42-F55 HydrophobicContact CG2-CD1 4.42Å; V42-F55 HydrophobicContact CG2-CE1 3.93Å; F55-I230 HydrophobicContact CZ-CG2 4.4Å; F55-L233 HydrophobicContact CD2-CB 4.06Å; F55-L233 HydrophobicContact CE1-CB 4.34Å; F55-L233 HydrophobicContact CE1-CD1 4.34Å; F55-L233 HydrophobicContact CE2-CB 3.49Å; F55-L233 VanDerWaalsContact CE2-CB 3.49Å; F55-L233 WeakPolarHBondContact CE2-O 3.35Å; F55-L233 HydrophobicContact CZ-CB 3.65Å; F55-L233 HydrophobicContact CZ-CD1 4.43Å; F55-Q234 HydrophobicContact CE2-CG 4.36Å; F55-Q234 HydrophobicContact CZ-CG 4.46Å
56	T	90.9	Very high	91.8	Very high	115 Å²	115	57.1 Å²	57.1	71%	0.706	32%	0.321	S	S	*	.	S	Bend	trans	-142.8	130.7	178.2	-59.2	0	0	0	0	108.5	C54 P58	C54-T56 PolarHBondContact SG-O 2.7Å; T56-P58 WeakPolarHBondContact O-CD 3.37Å
57	V	89.8	Confident	91.7	Very high	51 Å²	51	61.5 Å²	61.5	31%	0.309	34%	0.341	S	S	.	.			trans	-66.4	123.9	-177.8	-176.9	0	0	0	0	109.4	I43 L45 L68 P77	I43-V57 HydrophobicContact CD1-CG2 3.98Å; I43-V57 HydrophobicContact CG2-CG2 3.76Å; L45-V57 HydrophobicContact CD1-CG1 4.12Å; V57-L68 HydrophobicContact CG1-CD1 4.5Å; V57-P77 HydrophobicContact CG1-CG 4.14Å; V57-P77 HydrophobicContact CG2-CB 3.7Å; V57-P77 HydrophobicContact CG2-CG 3.8Å
58	P	90.3	Very high	91.5	Very high	39 Å²	39	61.6 Å²	61.6	25%	0.253	34%	0.342	S	S	.	.			trans	-72.9	155.2	176.5	27.8	-29.7	0	0	0	111.3	T56 V60 L68	T56-P58 WeakPolarHBondContact O-CD 3.37Å; P58-V60 VanDerWaalsContact C-N 3.34Å; P58-V60 WeakPolarHBondContact CB-O 3.35Å; P58-L68 HydrophobicContact CG-CD1 3.73Å; P58-L68 WeakPolarHBondContact O-CD1 3.41Å
59	E	89.5	Confident	90.6	Very high	169 Å²	169	63.7 Å²	63.7	79%	0.79	35%	0.345	S	S	*	.	S	Bend	trans	-70.7	-33.3	176.2	-64.1	-175.6	166.2	0	0	112.1	L68	E59-L68 PolarHBondContact O-N 3.17Å
60	V	92.4	Very high	89.4	Confident	78 Å²	78	59.4 Å²	59.4	47%	0.473	34%	0.341	S	S	.	.	B	Isolated β-bridge	trans	-119.6	147	179.4	-62.8	0	0	0	0	110.8	P58 P62 E66	P58-V60 VanDerWaalsContact C-N 3.34Å; P58-V60 WeakPolarHBondContact CB-O 3.35Å; V60-P62 WeakPolarHBondContact O-CD 3.46Å; V60-E66 CarbonylContact C-O 3.58Å; V60-E66 WeakPolarHBondContact CA-O 3.32Å
61	C	92	Very high	88.1	Confident	1 Å²	1	66.3 Å²	66.3	1%	0.007	37%	0.365	C	S	.	.			trans	-68.2	123.2	177.3	177	0	0	0	0	110	H47 S63 C64 G65 E66 L68	H47-C61 VanDerWaalsContact CD2-SG 3.56Å; C61-S63 PolarHBondContact O-N 2.98Å; C61-S63 VanDerWaalsContact O-N 3.12Å; C61-S63 PolarHBondContact SG-N 3.48Å; C61-S63 VanDerWaalsContact SG-N 3.37Å; C61-C64 VanDerWaalsContact CB-SG 3.51Å; C61-C64 VanDerWaalsContact SG-SG 3.62Å; C61-G65 WeakPolarHBondContact O-CA 3.26Å; C61-G65 PolarHBondContact O-N 2.95Å; C61-E66 WeakPolarHBondContact CB-O 3.31Å; C61-E66 PolarHBondContact N-O 3.05Å; C61-L68 HydrophobicContact CB-CD2 4.06Å; C61-L68 HydrophobicContact CB-CG 4.25Å
62	P	93.3	Very high	86.9	Confident	44 Å²	44	72 Å²	72	29%	0.286	39%	0.386	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.5	-12.9	178.8	28.8	-37.9	0	0	0	113.7	I52 V60 Y238 L240	I52-P62 HydrophobicContact CG2-CG 4.42Å; V60-P62 WeakPolarHBondContact O-CD 3.46Å; P62-Y238 HydrophobicContact CB-CD1 4.1Å; P62-Y238 HydrophobicContact CB-CD2 4.03Å; P62-Y238 HydrophobicContact CB-CE1 3.93Å; P62-Y238 HydrophobicContact CB-CE2 3.83Å; P62-Y238 HydrophobicContact CB-CG 4.16Å; P62-Y238 HydrophobicContact CG-CD1 4.39Å; P62-Y238 HydrophobicContact CG-CD2 4.17Å; P62-Y238 HydrophobicContact CG-CE2 4.46Å; P62-Y238 HydrophobicContact CG-CG 4.13Å; P62-L240 HydrophobicContact CG-CD1 4.31Å; P62-L240 HydrophobicContact CG-CD2 3.74Å
63	S	93.1	Very high	85.8	Confident	55 Å²	55	80.2 Å²	80.2	39%	0.385	43%	0.428	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94	-39.6	179.2	-171.5	0	0	0	0	114.1	C61	C61-S63 PolarHBondContact O-N 2.98Å; C61-S63 VanDerWaalsContact O-N 3.12Å; C61-S63 PolarHBondContact SG-N 3.48Å; C61-S63 VanDerWaalsContact SG-N 3.37Å
64	C	92.9	Very high	84.6	Confident	58 Å²	58	83.6 Å²	83.6	39%	0.392	44%	0.444	S	S	.	.	T	Hydrogen-bonded Turn	trans	-119.7	-11.5	-174.8	65.1	0	0	0	0	114.4	H47 C48 C61 E66	H47-C64 VanDerWaalsContact CD2-SG 3.53Å; H47-C64 PolarHBondContact NE2-SG 3.24Å; H47-C64 VanDerWaalsContact NE2-SG 3.41Å; C48-C64 HydrophobicContact CB-CB 4.3Å; C61-C64 VanDerWaalsContact CB-SG 3.51Å; C61-C64 VanDerWaalsContact SG-SG 3.62Å; C64-E66 VanDerWaalsContact C-N 3.26Å; C64-E66 PolarHBondContact O-N 3.49Å
65	G	91.4	Very high	83.8	Confident	51 Å²	51	85.3 Å²	85.3	53%	0.526	45%	0.452	S	S	.	.			trans	80.3	-4.2	-178.8	0	0	0	0	0	115.4	C61	C61-G65 WeakPolarHBondContact O-CA 3.26Å; C61-G65 PolarHBondContact O-N 2.95Å
66	E	90.7	Very high	83.3	Confident	129 Å²	129	85.3 Å²	85.3	60%	0.603	46%	0.46	S	S	*	.			trans	-75.9	151	178.8	-67.6	-64	146.6	0	0	112.3	V60 C61 C64	V60-E66 CarbonylContact C-O 3.58Å; V60-E66 WeakPolarHBondContact CA-O 3.32Å; C61-E66 WeakPolarHBondContact CB-O 3.31Å; C61-E66 PolarHBondContact N-O 3.05Å; C64-E66 VanDerWaalsContact C-N 3.26Å; C64-E66 PolarHBondContact O-N 3.49Å
67	E	88.8	Confident	83.2	Confident	107 Å²	107	83 Å²	83	50%	0.5	45%	0.447	S	S	.	.	B	Isolated β-bridge	trans	-68.9	132.1	-178.1	-158.8	178.6	154.6	0	0	111.7	K69	E67-K69 HydrophobicContact CB-CG 4.39Å; E67-K69 HydrophobicContact CG-CG 4.11Å; E67-K69 PolarHBondContact O-N 3.17Å; E67-K69 WeakPolarHBondContact OE1-CE 3.21Å; E67-K69 IonicContact OE1-NZ 3.47Å; E67-K69 PolarHBondContact OE1-NZ 3.5Å; E67-K69 WeakPolarHBondContact OE2-CE 3.44Å; E67-K69 IonicContact OE2-NZ 2.74Å; E67-K69 PolarHBondContact OE2-NZ 2.82Å
68	L	85.5	Confident	83.3	Confident	34 Å²	34	84.1 Å²	84.1	18%	0.178	45%	0.453	C	S	.	.			trans	-79.6	57.4	178.6	-70.1	169.1	0	0	0	111	L45 H47 V57 P58 E59 C61 G70	L45-L68 HydrophobicContact CD1-CD1 3.89Å; L45-L68 HydrophobicContact CD1-CD2 3.96Å; L45-L68 HydrophobicContact CD1-CG 4.43Å; H47-L68 HydrophobicContact CB-CD2 3.7Å; V57-L68 HydrophobicContact CG1-CD1 4.5Å; P58-L68 HydrophobicContact CG-CD1 3.73Å; P58-L68 WeakPolarHBondContact O-CD1 3.41Å; E59-L68 PolarHBondContact O-N 3.17Å; C61-L68 HydrophobicContact CB-CD2 4.06Å; C61-L68 HydrophobicContact CB-CG 4.25Å; L68-G70 PolarHBondContact O-N 3.15Å
69	K	69.8	Low	83.4	Confident	100 Å²	100	85.7 Å²	85.7	44%	0.435	47%	0.465	S	S	.	.			trans	-72.6	109.3	166.3	-62.6	-174.5	-175.2	165.4	0	106.1	E67 R71	E67-K69 HydrophobicContact CB-CG 4.39Å; E67-K69 HydrophobicContact CG-CG 4.11Å; E67-K69 PolarHBondContact O-N 3.17Å; E67-K69 WeakPolarHBondContact OE1-CE 3.21Å; E67-K69 IonicContact OE1-NZ 3.47Å; E67-K69 PolarHBondContact OE1-NZ 3.5Å; E67-K69 WeakPolarHBondContact OE2-CE 3.44Å; E67-K69 IonicContact OE2-NZ 2.74Å; E67-K69 PolarHBondContact OE2-NZ 2.82Å; K69-R71 HydrophobicContact CB-CG 4.03Å; K69-R71 WeakPolarHBondContact O-CG 3.42Å; K69-R71 PolarHBondContact O-N 2.91Å
70	G	63.9	Low	83.5	Confident	60 Å²	60	80 Å²	80	62%	0.619	44%	0.44	S	S	*	.			trans	-60.4	73.9	175.5	0	0	0	0	0	112.4	L68 R72	L68-G70 PolarHBondContact O-N 3.15Å; G70-R72 VanDerWaalsContact C-N 3.32Å
71	R	63.4	Low	83.5	Confident	200 Å²	200	80 Å²	80	76%	0.755	44%	0.442	S	S	*	.			trans	-79.4	-19.9	-174.6	-70.8	-178.6	-165.9	-145.2	8.8	111.5	K69	K69-R71 HydrophobicContact CB-CG 4.03Å; K69-R71 WeakPolarHBondContact O-CG 3.42Å; K69-R71 PolarHBondContact O-N 2.91Å
72	R	69.9	Low	83.5	Confident	151 Å²	151	81.9 Å²	81.9	57%	0.57	46%	0.455	S	S	*	.	S	Bend	trans	-129.9	140.6	-179.2	-53.5	-175.5	179.3	173	-6.2	110.2	G70 H74 E75 A76	G70-R72 VanDerWaalsContact C-N 3.32Å; R72-H74 WeakPolarHBondContact CD-CE1 3.46Å; R72-H74 PolarHBondContact O-N 3.13Å; R72-E75 HydrophobicContact CB-CB 4.47Å; R72-E75 HydrophobicContact CB-CG 4.03Å; R72-E75 WeakPolarHBondContact O-CB 3.23Å; R72-E75 PolarHBondContact O-N 3.26Å; R72-A76 PolarHBondContact O-N 2.65Å
73	L	69.8	Low	83.5	Confident	172 Å²	172	80.6 Å²	80.6	90%	0.901	45%	0.446	S	S	*	.	G	3₁₀ helix	trans	-55.7	-34.2	178.6	-86.4	146.1	0	0	0	113.4	E75 A76	L73-E75 PolarHBondContact O-N 3.04Å; L73-A76 VanDerWaalsContact O-CB 3.22Å; L73-A76 WeakPolarHBondContact O-CB 3.48Å; L73-A76 PolarHBondContact O-N 3.28Å
74	H	71.6	Confident	83.5	Confident	102 Å²	102	79.3 Å²	79.3	47%	0.472	43%	0.434	S	S	.	.	G	3₁₀ helix	trans	-77.2	-8.2	178.2	68	-101.5	0	0	0	114.1	R72	R72-H74 WeakPolarHBondContact CD-CE1 3.46Å; R72-H74 PolarHBondContact O-N 3.13Å
75	E	77.4	Confident	83.5	Confident	37 Å²	37	79 Å²	79	17%	0.173	43%	0.43	C	S	.	.	G	3₁₀ helix	trans	-101.2	2	174.5	-58.5	172	173.1	0	0	110.5	S46 R72 L73	S46-E75 WeakPolarHBondContact O-CB 3.05Å; S46-E75 WeakPolarHBondContact O-CG 3.31Å; R72-E75 HydrophobicContact CB-CB 4.47Å; R72-E75 HydrophobicContact CB-CG 4.03Å; R72-E75 WeakPolarHBondContact O-CB 3.23Å; R72-E75 PolarHBondContact O-N 3.26Å; L73-E75 PolarHBondContact O-N 3.04Å
76	A	83.8	Confident	83.6	Confident	39 Å²	39	78.4 Å²	78.4	32%	0.322	42%	0.415	S	S	.	.	S	Bend	trans	-67.5	135.2	-179.5	0	0	0	0	0	110.3	R72 L73 V78	R72-A76 PolarHBondContact O-N 2.65Å; L73-A76 VanDerWaalsContact O-CB 3.22Å; L73-A76 WeakPolarHBondContact O-CB 3.48Å; L73-A76 PolarHBondContact O-N 3.28Å; A76-V78 PolarHBondContact O-N 3.43Å
77	P	88	Confident	83.8	Confident	67 Å²	67	72.2 Å²	72.2	44%	0.435	39%	0.386	S	S	.	.			trans	-61	128.1	172.2	-19.9	31.1	0	0	0	111.1	I43 H44 L45 V57	I43-P77 HydrophobicContact CG2-CB 3.62Å; H44-P77 WeakPolarHBondContact O-CA 3.45Å; L45-P77 HydrophobicContact CB-CB 4.48Å; V57-P77 HydrophobicContact CG1-CG 4.14Å; V57-P77 HydrophobicContact CG2-CB 3.7Å; V57-P77 HydrophobicContact CG2-CG 3.8Å
78	V	91.5	Very high	84.2	Confident	73 Å²	73	69 Å²	69	44%	0.442	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	140.6	176.2	-64.1	0	0	0	0	110.1	I43 H44 A76 L80	I43-V78 CarbonylContact C-O 3.58Å; I43-V78 WeakPolarHBondContact CA-O 3.34Å; H44-V78 HydrophobicContact CB-CG2 4.05Å; H44-V78 PolarHBondContact N-O 3.15Å; H44-V78 WeakPolarHBondContact O-CG2 3.45Å; H44-V78 PolarHBondContact O-N 2.96Å; A76-V78 PolarHBondContact O-N 3.43Å; V78-L80 PolarHBondContact O-N 3.37Å
79	S	92	Very high	84.6	Confident	73 Å²	73	75.6 Å²	75.6	51%	0.51	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	123.8	171	-171.3	0	0	0	0	108.8	S41 P81	S41-S79 WeakPolarHBondContact CB-OG 3.05Å; S41-S79 PolarHBondContact OG-OG 3.02Å; S79-P81 WeakPolarHBondContact O-CD 3.37Å
80	L	92.1	Very high	85.7	Confident	48 Å²	48	71.8 Å²	71.8	25%	0.251	38%	0.384	S	S	.	.	P	Polyproline II helix	trans	-74.3	117.7	176	-173.3	70.3	0	0	0	108.3	V42 F53 V78 S82 Y226 L229	V42-L80 HydrophobicContact CB-CB 4.15Å; V42-L80 HydrophobicContact CB-CD2 4.41Å; V42-L80 HydrophobicContact CG1-CB 4.22Å; V42-L80 HydrophobicContact CG1-CD2 4.05Å; V42-L80 WeakPolarHBondContact O-CB 3.46Å; V42-L80 PolarHBondContact O-N 2.77Å; F53-L80 HydrophobicContact CD1-CD2 4.43Å; F53-L80 HydrophobicContact CE1-CD2 4.38Å; V78-L80 PolarHBondContact O-N 3.37Å; L80-S82 PolarHBondContact O-N 3.17Å; L80-Y226 HydrophobicContact CD2-CD2 3.92Å; L80-Y226 HydrophobicContact CD2-CE2 3.99Å; L80-Y226 HydrophobicContact CG-CE2 4.31Å; L80-L229 HydrophobicContact CD2-CD2 3.98Å
81	P	92.1	Very high	87.2	Confident	80 Å²	80	72.1 Å²	72.1	52%	0.519	38%	0.376	S	S	.	.	P	Polyproline II helix	trans	-67.1	131	-175.5	17.8	-23.7	0	0	0	111.3	S79 R222	S79-P81 WeakPolarHBondContact O-CD 3.37Å; P81-R222 PolarHBondContact O-NH2 3.06Å
82	S	92.3	Very high	88.8	Confident	40 Å²	40	62.7 Å²	62.7	28%	0.28	34%	0.341	S	S	.	.	P	Polyproline II helix	trans	-54.1	136.5	172.6	-177.7	0	0	0	0	110.5	L80 F84	L80-S82 PolarHBondContact O-N 3.17Å; S82-F84 PolarHBondContact O-N 2.96Å; S82-F84 PolarHBondContact OG-N 3.09Å
83	P	93.3	Very high	90.1	Very high	16 Å²	16	55.9 Å²	55.9	10%	0.104	32%	0.317	C	S	.	.	S	Bend	trans	-74.5	-10.5	171.3	33.4	-35.3	0	0	0	112.3	R222 V223 Y226	P83-R222 HydrophobicContact CB-CG 4.08Å; P83-V223 HydrophobicContact CB-CG2 3.89Å; P83-V223 HydrophobicContact CG-CG2 4.04Å; P83-Y226 VanDerWaalsContact CD-CG 3.41Å; P83-Y226 HydrophobicContact CG-CD1 3.75Å; P83-Y226 HydrophobicContact CG-CE1 4.43Å; P83-Y226 HydrophobicContact CG-CG 3.79Å
84	F	93.1	Very high	91.4	Very high	28 Å²	28	47.8 Å²	47.8	12%	0.123	27%	0.274	C	S	.	.			trans	-92.7	146	179.1	-50	-63.8	0	0	0	110.7	S82 F107 H141 C142 V143 V223 Y226	S82-F84 PolarHBondContact O-N 2.96Å; S82-F84 PolarHBondContact OG-N 3.09Å; F84-F107 HydrophobicContact CD1-CD2 4.03Å; F84-F107 AromaticContact CD1-CE2 3.76Å; F84-F107 HydrophobicContact CD1-CE2 3.76Å; F84-F107 AromaticContact CE1-CD2 3.28Å; F84-F107 HydrophobicContact CE1-CD2 3.28Å; F84-F107 AromaticContact CE1-CE2 3.49Å; F84-F107 HydrophobicContact CE1-CE2 3.49Å; F84-F107 VanDerWaalsContact CE1-CE2 3.49Å; F84-F107 HydrophobicContact CE1-CG 4.12Å; F84-F107 HydrophobicContact CE1-CZ 4.47Å; F84-F107 HydrophobicContact CZ-CD2 4.04Å; F84-H141 AromaticContact CD1-CE1 3.88Å; F84-H141 AromaticContact CD1-NE2 3.44Å; F84-H141 WeakPolarHBondContact CD1-NE2 3.21Å; F84-H141 AromaticContact CD2-CE1 3.33Å; F84-H141 WeakPolarHBondContact CD2-CE1 3.28Å; F84-H141 AromaticContact CD2-NE2 3.6Å; F84-H141 AromaticContact CE1-NE2 3.64Å; F84-H141 AromaticContact CE2-CE1 3.84Å; F84-H141 AromaticContact CE2-NE2 3.77Å; F84-H141 AromaticContact CG-CE1 3.33Å; F84-H141 WeakPolarHBondContact CG-CE1 3.5Å; F84-H141 AromaticContact CG-NE2 3.41Å; F84-H141 WeakPolarHBondContact CG-NE2 3.5Å; F84-H141 AromaticContact CZ-NE2 3.77Å; F84-C142 CarbonylContact C-O 3.58Å; F84-C142 WeakPolarHBondContact CA-O 3.35Å; F84-V143 HydrophobicContact CD1-CG2 4.43Å; F84-V223 HydrophobicContact CD1-CG2 4.46Å; F84-V223 HydrophobicContact CE1-CB 4.36Å; F84-V223 HydrophobicContact CE1-CG1 3.68Å; F84-V223 HydrophobicContact CE1-CG2 3.81Å; F84-V223 HydrophobicContact CZ-CG1 3.72Å; F84-V223 HydrophobicContact CZ-CG2 4.36Å; F84-Y226 HydrophobicContact CE2-CD1 4.16Å; F84-Y226 HydrophobicContact CE2-CE1 4.43Å
85	T	93.3	Very high	92.6	Very high	51 Å²	51	43 Å²	43	31%	0.313	25%	0.252	S	S	.	.	B	Isolated β-bridge	trans	-141	156.1	-177.1	56.8	0	0	0	0	109.6	G87 C142 S144	T85-G87 PolarHBondContact O-N 3.03Å; T85-C142 PolarHBondContact N-O 2.82Å; T85-C142 PolarHBondContact O-N 3.42Å; T85-C142 PolarHBondContact O-SG 3.37Å; T85-C142 PolarHBondContact OG1-O 3.29Å; T85-S144 WeakPolarHBondContact OG1-CB 3.35Å
86	D	94.4	Very high	93.5	Very high	39 Å²	39	41.3 Å²	41.3	21%	0.209	24%	0.244	C	C	.	.			trans	-83.4	107.2	169.2	-176.4	-10.4	0	0	0	109.2	H88 K89 S140	D86-H88 PolarHBondContact O-N 2.79Å; D86-H88 VanDerWaalsContact O-N 3.17Å; D86-H88 WeakPolarHBondContact OD1-CB 3.34Å; D86-H88 IonicContact OD1-CD2 3.92Å; D86-H88 IonicContact OD1-CG 3.01Å; D86-H88 PolarHBondContact OD1-N 2.92Å; D86-K89 HydrophobicContact CB-CB 4.3Å; D86-K89 HydrophobicContact CB-CD 3.95Å; D86-K89 HydrophobicContact CB-CG 4.1Å; D86-K89 WeakPolarHBondContact O-CB 3.3Å; D86-K89 PolarHBondContact O-N 3.45Å; D86-K89 WeakPolarHBondContact OD2-CD 3.23Å; D86-K89 WeakPolarHBondContact OD2-CE 3.29Å; D86-K89 IonicContact OD2-NZ 3.87Å; D86-K89 PolarHBondContact OD2-NZ 3.39Å; D86-S140 WeakPolarHBondContact CA-O 3.26Å
87	G	94.3	Very high	93.9	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	23%	0.231	C	C	.	.	G	3₁₀ helix	trans	-58	-28.6	-178.8	0	0	0	0	0	113.1	T85 K89 T90 W139 C142	T85-G87 PolarHBondContact O-N 3.03Å; G87-K89 PolarHBondContact O-N 2.9Å; G87-T90 PolarHBondContact O-N 3.46Å; G87-T90 VanDerWaalsContact O-N 3.15Å; G87-T90 PolarHBondContact O-OG1 2.86Å; G87-W139 WeakPolarHBondContact CA-O 3.49Å; G87-W139 PolarHBondContact N-O 2.92Å; G87-C142 VanDerWaalsContact CA-SG 3.5Å; G87-C142 PolarHBondContact N-SG 3.16Å; G87-C142 VanDerWaalsContact N-SG 3.35Å
88	H	96.1	Very high	93.9	Very high	38 Å²	38	37.1 Å²	37.1	18%	0.176	21%	0.214	C	C	.	.	G	3₁₀ helix	trans	-76.3	-7.4	177.1	-57.4	-61.1	0	0	0	113.5	D86 G122 D135 S137 W139	D86-H88 PolarHBondContact O-N 2.79Å; D86-H88 VanDerWaalsContact O-N 3.17Å; D86-H88 WeakPolarHBondContact OD1-CB 3.34Å; D86-H88 IonicContact OD1-CD2 3.92Å; D86-H88 IonicContact OD1-CG 3.01Å; D86-H88 PolarHBondContact OD1-N 2.92Å; H88-G122 WeakPolarHBondContact CA-O 3.36Å; H88-G122 PolarHBondContact ND1-O 2.69Å; H88-D135 PolarHBondContact CE1-O 2.76Å; H88-S137 PolarHBondContact CE1-N 3.47Å; H88-S137 VanDerWaalsContact CE1-N 3.28Å; H88-S137 WeakPolarHBondContact NE2-CA 3.39Å; H88-S137 PolarHBondContact NE2-N 3.03Å; H88-W139 AromaticContact CE1-CD1 3.83Å; H88-W139 WeakPolarHBondContact NE2-CB 3.5Å; H88-W139 AromaticContact NE2-CD1 3.91Å; H88-W139 PolarHBondContact NE2-N 2.91Å; H88-W139 VanDerWaalsContact NE2-N 3.2Å
89	K	95.8	Very high	93.3	Very high	173 Å²	173	34.4 Å²	34.4	75%	0.752	20%	0.2	S	C	*	.	G	3₁₀ helix	trans	-105.2	3.9	170.9	-61.2	177.7	-173.5	150.9	0	112.5	D86 G87	D86-K89 HydrophobicContact CB-CB 4.3Å; D86-K89 HydrophobicContact CB-CD 3.95Å; D86-K89 HydrophobicContact CB-CG 4.1Å; D86-K89 WeakPolarHBondContact O-CB 3.3Å; D86-K89 PolarHBondContact O-N 3.45Å; D86-K89 WeakPolarHBondContact OD2-CD 3.23Å; D86-K89 WeakPolarHBondContact OD2-CE 3.29Å; D86-K89 IonicContact OD2-NZ 3.87Å; D86-K89 PolarHBondContact OD2-NZ 3.39Å; G87-K89 PolarHBondContact O-N 2.9Å
90	T	92.9	Very high	92	Very high	21 Å²	21	36 Å²	36	13%	0.129	20%	0.199	C	C	.	.			trans	-101.8	152.8	176.6	70.9	0	0	0	0	111.1	G87 S118 G122	G87-T90 PolarHBondContact O-N 3.46Å; G87-T90 VanDerWaalsContact O-N 3.15Å; G87-T90 PolarHBondContact O-OG1 2.86Å; T90-S118 PolarHBondContact OG1-OG 2.93Å; T90-G122 WeakPolarHBondContact O-CA 3.28Å
91	S	94.5	Very high	90.2	Very high	67 Å²	67	38.7 Å²	38.7	47%	0.469	21%	0.214	S	C	.	.	S	Bend	trans	-119.7	130.3	176.1	-57.2	0	0	0	0	109.7	C93 T120	S91-C93 VanDerWaalsContact C-N 3.35Å; S91-C93 PolarHBondContact O-N 3.34Å; S91-C93 PolarHBondContact O-SG 3.48Å; S91-T120 PolarHBondContact OG-O 3.04Å
92	C	96.2	Very high	88.4	Confident	2 Å²	2	36.9 Å²	36.9	1%	0.014	20%	0.199	C	C	.	.	S	Bend	trans	57	45.3	172.2	-47.3	0	0	0	0	113.6	S118 N119 L147 V148 L156 W159	C92-S118 VanDerWaalsContact CA-O 3.28Å; C92-S118 WeakPolarHBondContact CA-O 3.33Å; C92-S118 PolarHBondContact N-O 3.02Å; C92-S118 PolarHBondContact N-OG 3.34Å; C92-N119 PolarHBondContact N-O 2.89Å; C92-L147 WeakPolarHBondContact O-CB 3.48Å; C92-L147 PolarHBondContact O-N 3.31Å; C92-V148 HydrophobicContact CB-CB 4.31Å; C92-V148 HydrophobicContact CB-CG2 3.47Å; C92-V148 VanDerWaalsContact CB-CG2 3.47Å; C92-L156 HydrophobicContact CB-CD2 4.33Å; C92-L156 WeakPolarHBondContact SG-CD2 3.47Å; C92-W159 HydrophobicContact CB-CD2 3.85Å; C92-W159 HydrophobicContact CB-CE3 4.35Å; C92-W159 HydrophobicContact CB-CG 4.25Å; C92-W159 HydrophobicContact CB-CH2 4.24Å; C92-W159 HydrophobicContact CB-CZ2 3.75Å
93	C	97.2	Very high	86.4	Confident	8 Å²	8	44.2 Å²	44.2	5%	0.054	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	147.3	178.9	-66.5	0	0	0	0	110.9	S91 L95 I117 S118 S144 V145	S91-C93 VanDerWaalsContact C-N 3.35Å; S91-C93 PolarHBondContact O-N 3.34Å; S91-C93 PolarHBondContact O-SG 3.48Å; C93-L95 HydrophobicContact CB-CD2 3.89Å; C93-I117 CarbonylContact O-C 3.58Å; C93-I117 WeakPolarHBondContact O-CA 3.48Å; C93-S118 PolarHBondContact N-OG 3.05Å; C93-S118 PolarHBondContact O-N 3.46Å; C93-S118 PolarHBondContact O-OG 3.23Å; C93-S144 WeakPolarHBondContact CB-OG 3.41Å; C93-S144 PolarHBondContact SG-OG 3.2Å; C93-V145 CarbonylContact C-O 3.3Å; C93-V145 VanDerWaalsContact CA-O 3.29Å; C93-V145 WeakPolarHBondContact CA-O 3.41Å
94	L	97.9	Very high	84.5	Confident	2 Å²	2	49.6 Å²	49.6	1%	0.01	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	130	155.8	-179.5	151.7	0	0	0	107.6	V96 G116 V145 L147 C190 F211 I216	L94-V96 HydrophobicContact CD2-CG2 3.68Å; L94-G116 CarbonylContact C-O 3.57Å; L94-G116 WeakPolarHBondContact CA-O 3.38Å; L94-V145 HydrophobicContact CB-CB 4.2Å; L94-V145 HydrophobicContact CD2-CB 4.46Å; L94-V145 HydrophobicContact CD2-CG2 4.25Å; L94-V145 PolarHBondContact N-O 2.82Å; L94-V145 PolarHBondContact O-N 2.96Å; L94-L147 HydrophobicContact CB-CD1 4.01Å; L94-L147 HydrophobicContact CB-CD2 3.9Å; L94-L147 HydrophobicContact CB-CG 4.15Å; L94-C190 HydrophobicContact CD1-CB 3.65Å; L94-C190 HydrophobicContact CG-CB 4.46Å; L94-F211 HydrophobicContact CD1-CE1 3.62Å; L94-F211 HydrophobicContact CD1-CZ 3.72Å; L94-F211 HydrophobicContact CD2-CE1 4.43Å; L94-I216 HydrophobicContact CD2-CD1 3.82Å
95	L	97.6	Very high	83.1	Confident	0 Å²	0	53 Å²	53	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	137.1	-180	-56	178.8	0	0	0	108.7	C93 T115 G116 V124 W139 V143	C93-L95 HydrophobicContact CB-CD2 3.89Å; L95-T115 VanDerWaalsContact O-CA 3.24Å; L95-T115 WeakPolarHBondContact O-CA 3.39Å; L95-G116 PolarHBondContact N-O 3.37Å; L95-G116 PolarHBondContact O-N 3.42Å; L95-G116 VanDerWaalsContact O-N 3.08Å; L95-V124 HydrophobicContact CD1-CB 4.38Å; L95-V124 HydrophobicContact CD1-CG1 3.96Å; L95-V124 HydrophobicContact CD1-CG2 3.46Å; L95-V124 VanDerWaalsContact CD1-CG2 3.46Å; L95-W139 HydrophobicContact CB-CE3 3.62Å; L95-W139 HydrophobicContact CB-CZ3 3.7Å; L95-W139 HydrophobicContact CD1-CB 4.39Å; L95-W139 HydrophobicContact CD1-CD2 4.41Å; L95-W139 HydrophobicContact CD1-CE3 4.03Å; L95-V143 WeakPolarHBondContact CA-O 3.33Å
96	V	95.8	Very high	81.7	Confident	2 Å²	2	54.6 Å²	54.6	1%	0.012	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	122.8	170.1	-171.2	0	0	0	0	107	L94 F107 L113 H114 T115 C142 V143 I216 M220	L94-V96 HydrophobicContact CD2-CG2 3.68Å; V96-F107 HydrophobicContact CG1-CE1 4.35Å; V96-F107 WeakPolarHBondContact O-CZ 3.44Å; V96-L113 HydrophobicContact CG1-CB 4.1Å; V96-L113 HydrophobicContact CG1-CD1 4.06Å; V96-L113 HydrophobicContact CG1-CD2 4.15Å; V96-L113 HydrophobicContact CG1-CG 4.33Å; V96-H114 WeakPolarHBondContact CA-O 3.49Å; V96-T115 HydrophobicContact CG1-CG2 4.39Å; V96-T115 HydrophobicContact CG2-CG2 4.17Å; V96-C142 CarbonylContact O-C 3.47Å; V96-C142 WeakPolarHBondContact O-CA 3.49Å; V96-C142 WeakPolarHBondContact O-CB 3.35Å; V96-V143 HydrophobicContact CB-CB 4.25Å; V96-V143 PolarHBondContact N-O 3.35Å; V96-V143 PolarHBondContact O-N 3.25Å; V96-I216 HydrophobicContact CG2-CD1 3.88Å; V96-M220 HydrophobicContact CG1-SD 4.44Å
97	A	92.1	Very high	80.6	Confident	7 Å²	7	53.4 Å²	53.4	6%	0.058	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	157.1	175.1	0	0	0	0	0	109	H114 W139 C142	A97-H114 PolarHBondContact N-O 3.13Å; A97-H114 PolarHBondContact O-N 2.84Å; A97-W139 HydrophobicContact CB-CE3 3.78Å; A97-W139 HydrophobicContact CB-CH2 4.43Å; A97-W139 HydrophobicContact CB-CZ3 3.69Å; A97-C142 HydrophobicContact CB-CB 4.18Å
98	P	88.2	Confident	79.2	Confident	11 Å²	11	56.7 Å²	56.7	7%	0.071	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.7	142.6	166.4	-20.7	38.1	0	0	0	108.5	N102 R105 F107	P98-N102 HydrophobicContact CB-CB 4.45Å; P98-R105 WeakPolarHBondContact CG-O 3.46Å; P98-F107 VanDerWaalsContact CD-CZ 3.44Å; P98-F107 HydrophobicContact CG-CD1 4.02Å; P98-F107 HydrophobicContact CG-CD2 3.64Å; P98-F107 HydrophobicContact CG-CE1 4.03Å; P98-F107 HydrophobicContact CG-CE2 3.63Å; P98-F107 HydrophobicContact CG-CG 3.89Å; P98-F107 HydrophobicContact CG-CZ 3.86Å
99	A	78.9	Confident	77.6	Confident	17 Å²	17	59.3 Å²	59.3	14%	0.14	33%	0.326	C	S	.	.			trans	-58.5	146.3	179.3	0	0	0	0	0	110.7	N101 N102 D112	A99-N101 VanDerWaalsContact CB-OD1 3.31Å; A99-N101 WeakPolarHBondContact CB-OD1 3.34Å; A99-N101 PolarHBondContact O-N 3.34Å; A99-N101 PolarHBondContact O-OD1 3.05Å; A99-N102 PolarHBondContact O-N 3.4Å; A99-D112 HydrophobicContact CB-CB 3.72Å; A99-D112 WeakPolarHBondContact CB-O 3.47Å; A99-D112 PolarHBondContact N-O 2.95Å
100	H	63.7	Low	76	Confident	107 Å²	107	57.3 Å²	57.3	50%	0.495	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.9	-12.1	-173.4	-78.8	-79.6	0	0	0	115.1
101	N	55.2	Low	74.9	Confident	104 Å²	104	57 Å²	57	56%	0.556	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.6	-10.2	178.2	62.3	-8	0	0	0	114.1	A99 Q103	A99-N101 VanDerWaalsContact CB-OD1 3.31Å; A99-N101 WeakPolarHBondContact CB-OD1 3.34Å; A99-N101 PolarHBondContact O-N 3.34Å; A99-N101 PolarHBondContact O-OD1 3.05Å; N101-Q103 PolarHBondContact O-N 2.9Å; N101-Q103 VanDerWaalsContact O-N 3.13Å
102	N	54.8	Low	74.3	Confident	42 Å²	42	58.6 Å²	58.6	23%	0.225	33%	0.33	C	S	.	.			trans	-74.4	106.6	175.1	-79.5	-15.3	0	0	0	109.3	P98 A99 D104 R105 S111	P98-N102 HydrophobicContact CB-CB 4.45Å; A99-N102 PolarHBondContact O-N 3.4Å; N102-D104 PolarHBondContact O-N 3.46Å; N102-R105 PolarHBondContact O-N 3.35Å; N102-S111 WeakPolarHBondContact ND2-CB 3.28Å; N102-S111 PolarHBondContact ND2-OG 3.11Å; N102-S111 VanDerWaalsContact ND2-OG 3.09Å
103	Q	48.8	Very low	74.1	Confident	193 Å²	193	62.1 Å²	62.1	90%	0.902	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.2	-26.8	-179.5	-74.7	174.4	-4.6	0	0	112.7	N101	N101-Q103 PolarHBondContact O-N 2.9Å; N101-Q103 VanDerWaalsContact O-N 3.13Å
104	D	54.9	Low	73.9	Confident	129 Å²	129	62.6 Å²	62.6	69%	0.69	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.7	-6.3	179.7	-55.7	-37.1	0	0	0	113.4	N102 D106	N102-D104 PolarHBondContact O-N 3.46Å; D104-D106 HydrophobicContact CB-CB 4.38Å; D104-D106 PolarHBondContact O-N 2.93Å
105	R	62.2	Low	73.8	Confident	101 Å²	101	62.8 Å²	62.8	38%	0.381	35%	0.352	S	S	.	.			trans	42.3	33.7	-171.6	-65.4	-174.4	173.5	-139.6	-1	113.5	P98 N102 G138	P98-R105 WeakPolarHBondContact CG-O 3.46Å; N102-R105 PolarHBondContact O-N 3.35Å; R105-G138 PolarHBondContact NH1-O 2.78Å
106	D	65.1	Low	73.8	Confident	83 Å²	83	62.8 Å²	62.8	44%	0.444	35%	0.352	S	S	.	.			trans	-85.8	145.4	176.6	-85.8	-25.2	0	0	0	110.1	D104 T108 S111	D104-D106 HydrophobicContact CB-CB 4.38Å; D104-D106 PolarHBondContact O-N 2.93Å; D106-T108 HydrophobicContact CB-CG2 3.85Å; D106-T108 PolarHBondContact O-N 3.38Å; D106-S111 PolarHBondContact O-OG 2.91Å
107	F	70.9	Confident	74	Confident	14 Å²	14	62.7 Å²	62.7	6%	0.061	35%	0.351	C	S	.	.			trans	-82	69	165.6	-73.3	-91.4	0	0	0	109.5	F84 V96 P98 L113 V143 M220 V223	F84-F107 HydrophobicContact CD1-CD2 4.03Å; F84-F107 AromaticContact CD1-CE2 3.76Å; F84-F107 HydrophobicContact CD1-CE2 3.76Å; F84-F107 AromaticContact CE1-CD2 3.28Å; F84-F107 HydrophobicContact CE1-CD2 3.28Å; F84-F107 AromaticContact CE1-CE2 3.49Å; F84-F107 HydrophobicContact CE1-CE2 3.49Å; F84-F107 VanDerWaalsContact CE1-CE2 3.49Å; F84-F107 HydrophobicContact CE1-CG 4.12Å; F84-F107 HydrophobicContact CE1-CZ 4.47Å; F84-F107 HydrophobicContact CZ-CD2 4.04Å; V96-F107 HydrophobicContact CG1-CE1 4.35Å; V96-F107 WeakPolarHBondContact O-CZ 3.44Å; P98-F107 VanDerWaalsContact CD-CZ 3.44Å; P98-F107 HydrophobicContact CG-CD1 4.02Å; P98-F107 HydrophobicContact CG-CD2 3.64Å; P98-F107 HydrophobicContact CG-CE1 4.03Å; P98-F107 HydrophobicContact CG-CE2 3.63Å; P98-F107 HydrophobicContact CG-CG 3.89Å; P98-F107 HydrophobicContact CG-CZ 3.86Å; F107-L113 HydrophobicContact CD1-CD2 3.95Å; F107-L113 HydrophobicContact CE1-CD2 4.02Å; F107-V143 HydrophobicContact CE1-CG2 4.12Å; F107-V143 HydrophobicContact CE2-CG2 4.4Å; F107-V143 HydrophobicContact CZ-CG2 3.82Å; F107-M220 HydrophobicContact CD1-CE 3.46Å; F107-M220 VanDerWaalsContact CD1-CE 3.46Å; F107-M220 HydrophobicContact CE1-CE 3.9Å; F107-M220 HydrophobicContact CE1-SD 4.4Å; F107-M220 HydrophobicContact CG-CE 4.38Å; F107-V223 HydrophobicContact CB-CG1 3.47Å; F107-V223 VanDerWaalsContact CB-CG1 3.47Å; F107-V223 HydrophobicContact CD1-CG1 4.44Å; F107-V223 HydrophobicContact CD2-CG1 4.33Å; F107-V223 HydrophobicContact CG-CG1 3.87Å
108	T	64.1	Low	74.3	Confident	70 Å²	70	62.4 Å²	62.4	43%	0.429	35%	0.348	S	S	.	.			trans	-71.7	150.8	168.8	72.2	0	0	0	0	108.5	D106 T110 S111	D106-T108 HydrophobicContact CB-CG2 3.85Å; D106-T108 PolarHBondContact O-N 3.38Å; T108-T110 PolarHBondContact O-N 2.85Å; T108-T110 PolarHBondContact OG1-OG1 3.2Å; T108-S111 PolarHBondContact N-OG 2.96Å; T108-S111 VanDerWaalsContact N-OG 3.09Å; T108-S111 VanDerWaalsContact O-CB 3.31Å; T108-S111 WeakPolarHBondContact O-CB 3.34Å; T108-S111 PolarHBondContact O-N 2.92Å; T108-S111 PolarHBondContact O-OG 3.48Å; T108-S111 PolarHBondContact OG1-N 3.46Å; T108-S111 PolarHBondContact OG1-OG 2.74Å
109	G	62.2	Low	74.7	Confident	93 Å²	93	62.3 Å²	62.3	96%	0.959	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.1	-5.2	179.1	0	0	0	0	0	114.8
110	T	63.9	Low	75.5	Confident	130 Å²	130	63.5 Å²	63.5	80%	0.798	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-117.1	7.5	178.2	59.6	0	0	0	0	112.8	T108	T108-T110 PolarHBondContact O-N 2.85Å; T108-T110 PolarHBondContact OG1-OG1 3.2Å
111	S	69.1	Low	77.1	Confident	15 Å²	15	66.2 Å²	66.2	11%	0.105	36%	0.363	C	S	.	.			trans	-73.8	130.9	-178.9	-72.1	0	0	0	0	111.2	N102 D106 T108 L113	N102-S111 WeakPolarHBondContact ND2-CB 3.28Å; N102-S111 PolarHBondContact ND2-OG 3.11Å; N102-S111 VanDerWaalsContact ND2-OG 3.09Å; D106-S111 PolarHBondContact O-OG 2.91Å; T108-S111 PolarHBondContact N-OG 2.96Å; T108-S111 VanDerWaalsContact N-OG 3.09Å; T108-S111 VanDerWaalsContact O-CB 3.31Å; T108-S111 WeakPolarHBondContact O-CB 3.34Å; T108-S111 PolarHBondContact O-N 2.92Å; T108-S111 PolarHBondContact O-OG 3.48Å; T108-S111 PolarHBondContact OG1-N 3.46Å; T108-S111 PolarHBondContact OG1-OG 2.74Å; S111-L113 PolarHBondContact O-N 3.02Å
112	D	82.6	Confident	79	Confident	100 Å²	100	61.3 Å²	61.3	54%	0.535	34%	0.337	S	S	.	.			trans	-59.8	136.1	165.2	-68.1	-26.9	0	0	0	109	A99	A99-D112 HydrophobicContact CB-CB 3.72Å; A99-D112 WeakPolarHBondContact CB-O 3.47Å; A99-D112 PolarHBondContact N-O 2.95Å
113	L	90.1	Very high	81.1	Confident	76 Å²	76	60 Å²	60	40%	0.398	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	135.8	-178	-60.1	179.9	0	0	0	109.8	V96 F107 S111 M220	V96-L113 HydrophobicContact CG1-CB 4.1Å; V96-L113 HydrophobicContact CG1-CD1 4.06Å; V96-L113 HydrophobicContact CG1-CD2 4.15Å; V96-L113 HydrophobicContact CG1-CG 4.33Å; F107-L113 HydrophobicContact CD1-CD2 3.95Å; F107-L113 HydrophobicContact CE1-CD2 4.02Å; S111-L113 PolarHBondContact O-N 3.02Å; L113-M220 HydrophobicContact CD1-CE 4.46Å; L113-M220 HydrophobicContact CD2-CE 4.36Å
114	H	93.9	Very high	83.5	Confident	19 Å²	19	50.9 Å²	50.9	9%	0.088	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	145.3	169.9	-169.5	42.9	0	0	0	110.2	V96 A97 N126 W139 C186	V96-H114 WeakPolarHBondContact CA-O 3.49Å; A97-H114 PolarHBondContact N-O 3.13Å; A97-H114 PolarHBondContact O-N 2.84Å; H114-N126 PolarHBondContact NE2-OD1 3Å; H114-W139 AromaticContact CD2-CH2 3.51Å; H114-W139 AromaticContact CD2-CZ2 3.41Å; H114-W139 VanDerWaalsContact CD2-CZ2 3.41Å; H114-W139 WeakPolarHBondContact CD2-CZ2 3.42Å; H114-W139 AromaticContact NE2-CZ2 3.75Å; H114-C186 WeakPolarHBondContact ND1-CB 3.49Å; H114-C186 PolarHBondContact ND1-SG 3.33Å; H114-C186 VanDerWaalsContact ND1-SG 3.35Å
115	T	96.7	Very high	85.5	Confident	6 Å²	6	45.3 Å²	45.3	4%	0.037	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	149.3	-178	56.6	0	0	0	0	112.3	L95 V96 N126 W139 C186 F187	L95-T115 VanDerWaalsContact O-CA 3.24Å; L95-T115 WeakPolarHBondContact O-CA 3.39Å; V96-T115 HydrophobicContact CG1-CG2 4.39Å; V96-T115 HydrophobicContact CG2-CG2 4.17Å; T115-N126 WeakPolarHBondContact O-CB 3.27Å; T115-W139 VanDerWaalsContact C-CH2 3.46Å; T115-C186 PolarHBondContact OG1-O 3.4Å; T115-C186 PolarHBondContact OG1-SG 2.89Å; T115-F187 HydrophobicContact CG2-CD2 4.21Å; T115-F187 VanDerWaalsContact OG1-CA 3.23Å; T115-F187 WeakPolarHBondContact OG1-CA 3.24Å; T115-F187 PolarHBondContact OG1-N 3.4Å; T115-F187 VanDerWaalsContact OG1-N 3.14Å
116	G	97.7	Very high	87.2	Confident	0 Å²	0	40.6 Å²	40.6	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.7	169.3	178.7	0	0	0	0	0	111.3	L94 L95 Y125	L94-G116 CarbonylContact C-O 3.57Å; L94-G116 WeakPolarHBondContact CA-O 3.38Å; L95-G116 PolarHBondContact N-O 3.37Å; L95-G116 PolarHBondContact O-N 3.42Å; L95-G116 VanDerWaalsContact O-N 3.08Å; G116-Y125 CarbonylContact C-O 3.59Å; G116-Y125 WeakPolarHBondContact CA-O 3.36Å
117	I	98.3	Very high	88.7	Confident	0 Å²	0	36.6 Å²	36.6	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	126.4	177.2	-65.7	158.7	0	0	0	109	C93 V124 Y125 L147 W159 L163 F189 C190 F193	C93-I117 CarbonylContact O-C 3.58Å; C93-I117 WeakPolarHBondContact O-CA 3.48Å; I117-V124 WeakPolarHBondContact O-CA 3.42Å; I117-Y125 PolarHBondContact N-O 2.8Å; I117-Y125 PolarHBondContact O-N 2.97Å; I117-L147 HydrophobicContact CG1-CD1 4.41Å; I117-L147 HydrophobicContact CG2-CD1 4.31Å; I117-W159 HydrophobicContact CG2-CZ2 3.56Å; I117-L163 HydrophobicContact CB-CD1 4.24Å; I117-L163 HydrophobicContact CB-CD2 4.34Å; I117-L163 HydrophobicContact CD1-CD1 4.28Å; I117-L163 HydrophobicContact CG2-CD1 4.13Å; I117-L163 HydrophobicContact CG2-CD2 3.82Å; I117-F189 HydrophobicContact CD1-CE1 4.47Å; I117-C190 HydrophobicContact CD1-CB 3.95Å; I117-C190 HydrophobicContact CG1-CB 4.07Å; I117-F193 HydrophobicContact CD1-CB 3.74Å; I117-F193 HydrophobicContact CD1-CD1 3.31Å; I117-F193 HydrophobicContact CD1-CE1 4.13Å; I117-F193 HydrophobicContact CD1-CG 3.74Å; I117-F193 HydrophobicContact CG1-CD1 4.44Å; I117-F193 HydrophobicContact CG2-CD1 4.45Å; I117-F193 HydrophobicContact CG2-CE1 4.2Å
118	S	98.1	Very high	89.8	Confident	0 Å²	0	37.4 Å²	37.4	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	136.4	171.5	57.7	0	0	0	0	111.3	T90 C92 C93 V123 W159	T90-S118 PolarHBondContact OG1-OG 2.93Å; C92-S118 VanDerWaalsContact CA-O 3.28Å; C92-S118 WeakPolarHBondContact CA-O 3.33Å; C92-S118 PolarHBondContact N-O 3.02Å; C92-S118 PolarHBondContact N-OG 3.34Å; C93-S118 PolarHBondContact N-OG 3.05Å; C93-S118 PolarHBondContact O-N 3.46Å; C93-S118 PolarHBondContact O-OG 3.23Å; S118-V123 CarbonylContact C-O 3.57Å; S118-V123 WeakPolarHBondContact CA-O 3.46Å; S118-W159 PolarHBondContact O-NE1 2.87Å
119	N	97.4	Very high	91.2	Very high	10 Å²	10	40.9 Å²	40.9	5%	0.053	24%	0.236	C	C	.	.			trans	-75.2	-177.7	165.5	81.2	-3.5	0	0	0	110.5	C92 K121 G122 V123 Y125 D160 L163	C92-N119 PolarHBondContact N-O 2.89Å; N119-K121 PolarHBondContact O-N 3.49Å; N119-K121 VanDerWaalsContact O-N 3.16Å; N119-K121 WeakPolarHBondContact OD1-CA 3.43Å; N119-K121 PolarHBondContact OD1-N 3.03Å; N119-G122 PolarHBondContact O-N 3.43Å; N119-G122 PolarHBondContact OD1-N 2.91Å; N119-V123 PolarHBondContact N-O 3.31Å; N119-V123 WeakPolarHBondContact ND2-CB 3.23Å; N119-V123 WeakPolarHBondContact ND2-CG2 3.5Å; N119-V123 PolarHBondContact OD1-N 3.42Å; N119-Y125 HydrophobicContact CB-CD2 4.5Å; N119-Y125 HydrophobicContact CB-CE2 4.01Å; N119-D160 WeakPolarHBondContact CB-OD1 3.35Å; N119-L163 HydrophobicContact CB-CD2 4.12Å
120	T	96.5	Very high	92.6	Very high	42 Å²	42	42.6 Å²	42.6	26%	0.258	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-20.8	-178.5	60.7	0	0	0	0	113.7	S91 W159 D160	S91-T120 PolarHBondContact OG-O 3.04Å; T120-W159 HydrophobicContact CG2-CB 4.22Å; T120-D160 WeakPolarHBondContact CB-OD1 3.44Å; T120-D160 VanDerWaalsContact CG2-OD1 3.27Å; T120-D160 WeakPolarHBondContact CG2-OD1 3.37Å; T120-D160 PolarHBondContact N-OD1 2.78Å; T120-D160 PolarHBondContact OG1-OD1 2.93Å; T120-D160 PolarHBondContact OG1-OD2 3.44Å
121	K	96.4	Very high	94.1	Very high	164 Å²	164	36.5 Å²	36.5	71%	0.713	19%	0.187	S	C	*	.	T	Hydrogen-bonded Turn	trans	-103.1	3.8	-176.8	-58.7	177.8	-173.8	170.5	0	113.7	N119	N119-K121 PolarHBondContact O-N 3.49Å; N119-K121 VanDerWaalsContact O-N 3.16Å; N119-K121 WeakPolarHBondContact OD1-CA 3.43Å; N119-K121 PolarHBondContact OD1-N 3.03Å
122	G	96.2	Very high	95.4	Very high	1 Å²	1	37 Å²	37	1%	0.01	19%	0.189	C	C	.	.	S	Bend	trans	83.7	12.3	-179.1	0	0	0	0	0	115.5	H88 T90 N119	H88-G122 WeakPolarHBondContact CA-O 3.36Å; H88-G122 PolarHBondContact ND1-O 2.69Å; T90-G122 WeakPolarHBondContact O-CA 3.28Å; N119-G122 PolarHBondContact O-N 3.43Å; N119-G122 PolarHBondContact OD1-N 2.91Å
123	V	98.1	Very high	96.1	Very high	15 Å²	15	38 Å²	38	9%	0.091	19%	0.185	C	C	.	.	P	Polyproline II helix	trans	-75.2	129.3	168	-169.7	0	0	0	0	108.6	S118 N119 Y125 R134	S118-V123 CarbonylContact C-O 3.57Å; S118-V123 WeakPolarHBondContact CA-O 3.46Å; N119-V123 PolarHBondContact N-O 3.31Å; N119-V123 WeakPolarHBondContact ND2-CB 3.23Å; N119-V123 WeakPolarHBondContact ND2-CG2 3.5Å; N119-V123 PolarHBondContact OD1-N 3.42Å; V123-Y125 HydrophobicContact CB-CE2 4.24Å; V123-Y125 HydrophobicContact CG1-CE2 4.12Å; V123-R134 HydrophobicContact CG1-CB 4.14Å
124	V	98.3	Very high	96.4	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	116	-174.8	-173.3	0	0	0	0	111	L95 I117 D135 W139	L95-V124 HydrophobicContact CD1-CB 4.38Å; L95-V124 HydrophobicContact CD1-CG1 3.96Å; L95-V124 HydrophobicContact CD1-CG2 3.46Å; L95-V124 VanDerWaalsContact CD1-CG2 3.46Å; I117-V124 WeakPolarHBondContact O-CA 3.42Å; V124-D135 PolarHBondContact N-O 3.37Å; V124-D135 PolarHBondContact O-N 3.04Å; V124-W139 HydrophobicContact CB-CD2 4.18Å; V124-W139 HydrophobicContact CB-CG 4.01Å; V124-W139 HydrophobicContact CG1-CD2 3.67Å; V124-W139 VanDerWaalsContact CG1-CE2 3.48Å; V124-W139 HydrophobicContact CG1-CE3 4.16Å; V124-W139 HydrophobicContact CG1-CG 4.05Å; V124-W139 HydrophobicContact CG1-CH2 4.33Å; V124-W139 HydrophobicContact CG1-CZ2 3.84Å; V124-W139 HydrophobicContact CG1-CZ3 4.47Å; V124-W139 HydrophobicContact CG2-CB 4.01Å; V124-W139 HydrophobicContact CG2-CD2 4.23Å; V124-W139 HydrophobicContact CG2-CG 3.76Å
125	Y	98.4	Very high	96.6	Very high	13 Å²	13	38.9 Å²	38.9	5%	0.051	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	122.2	174.7	-69.1	-112.2	0	0	0	108.8	G116 I117 N119 V123 V132 R133 R134 L163 E164 S167	G116-Y125 CarbonylContact C-O 3.59Å; G116-Y125 WeakPolarHBondContact CA-O 3.36Å; I117-Y125 PolarHBondContact N-O 2.8Å; I117-Y125 PolarHBondContact O-N 2.97Å; N119-Y125 HydrophobicContact CB-CD2 4.5Å; N119-Y125 HydrophobicContact CB-CE2 4.01Å; V123-Y125 HydrophobicContact CB-CE2 4.24Å; V123-Y125 HydrophobicContact CG1-CE2 4.12Å; Y125-V132 HydrophobicContact CD1-CG1 4.4Å; Y125-R133 VanDerWaalsContact CA-O 3.31Å; Y125-R133 WeakPolarHBondContact CA-O 3.38Å; Y125-R134 HydrophobicContact CD1-CG 3.8Å; Y125-R134 HydrophobicContact CE1-CG 3.55Å; Y125-R134 HydrophobicContact CE2-CG 4.44Å; Y125-R134 HydrophobicContact CG-CG 4.41Å; Y125-L163 HydrophobicContact CD1-CD2 4.46Å; Y125-L163 HydrophobicContact CD1-CG 4.04Å; Y125-L163 HydrophobicContact CD2-CD2 3.37Å; Y125-L163 HydrophobicContact CD2-CG 3.86Å; Y125-L163 HydrophobicContact CE1-CG 4.37Å; Y125-L163 HydrophobicContact CE2-CD2 3.87Å; Y125-L163 HydrophobicContact CE2-CG 4.27Å; Y125-L163 HydrophobicContact CG-CD1 4.28Å; Y125-L163 HydrophobicContact CG-CD2 3.72Å; Y125-L163 HydrophobicContact CG-CG 3.74Å; Y125-E164 VanDerWaalsContact CE1-OE2 3.3Å; Y125-E164 WeakPolarHBondContact CE1-OE2 3.17Å; Y125-E164 VanDerWaalsContact CZ-OE2 3.3Å; Y125-E164 PolarHBondContact OH-OE2 3.28Å; Y125-S167 WeakPolarHBondContact CD1-OG 3.33Å
126	N	97.4	Very high	96.5	Very high	1 Å²	1	45 Å²	45	1%	0.005	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	146.1	-179.7	68.2	96.6	0	0	0	110.7	H114 T115 T128 V132 R133 D135 W139	H114-N126 PolarHBondContact NE2-OD1 3Å; T115-N126 WeakPolarHBondContact O-CB 3.27Å; N126-T128 WeakPolarHBondContact OD1-CG2 3.42Å; N126-V132 WeakPolarHBondContact O-CA 3.42Å; N126-R133 PolarHBondContact N-O 2.91Å; N126-R133 VanDerWaalsContact N-O 3.15Å; N126-R133 PolarHBondContact O-N 3.45Å; N126-D135 PolarHBondContact ND2-OD2 2.78Å; N126-W139 HydrophobicContact CB-CH2 4.46Å; N126-W139 HydrophobicContact CB-CZ2 3.85Å
127	Y	96.9	Very high	96.3	Very high	0 Å²	0	49.1 Å²	49.1	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	127.8	-178.4	-179.9	-111.2	0	0	0	110.5	V132 W172 Q177 F179 H184 C186 F189	Y127-V132 HydrophobicContact CD2-CG2 3.96Å; Y127-W172 HydrophobicContact CD1-CE3 4.16Å; Y127-W172 HydrophobicContact CD1-CZ3 4.29Å; Y127-W172 HydrophobicContact CD2-CB 4.27Å; Y127-W172 AromaticContact CD2-CE3 4Å; Y127-W172 HydrophobicContact CD2-CE3 4Å; Y127-W172 HydrophobicContact CE1-CE3 4.3Å; Y127-W172 HydrophobicContact CE2-CB 4.24Å; Y127-W172 HydrophobicContact CE2-CE3 4.13Å; Y127-W172 WeakPolarHBondContact CE2-O 3.47Å; Y127-W172 HydrophobicContact CG-CE3 4.02Å; Y127-W172 HydrophobicContact CG-CZ3 4.48Å; Y127-Q177 PolarHBondContact OH-O 2.91Å; Y127-Q177 VanDerWaalsContact OH-O 3.11Å; Y127-F179 AromaticContact CD1-CD2 3.74Å; Y127-F179 HydrophobicContact CD1-CD2 3.74Å; Y127-F179 HydrophobicContact CD1-CE2 4.19Å; Y127-F179 HydrophobicContact CE1-CB 4.13Å; Y127-F179 AromaticContact CE1-CD2 3.54Å; Y127-F179 HydrophobicContact CE1-CD2 3.54Å; Y127-F179 HydrophobicContact CE1-CE2 4.4Å; Y127-F179 HydrophobicContact CE1-CG 4.22Å; Y127-F179 PolarHBondContact OH-N 2.94Å; Y127-H184 AromaticContact CE1-CD2 3.57Å; Y127-H184 AromaticContact CE1-NE2 3.64Å; Y127-H184 AromaticContact CZ-CD2 3.71Å; Y127-H184 AromaticContact CZ-NE2 3.45Å; Y127-H184 PolarHBondContact OH-CD2 2.94Å; Y127-H184 VanDerWaalsContact OH-CD2 3.27Å; Y127-H184 PolarHBondContact OH-NE2 2.86Å; Y127-H184 VanDerWaalsContact OH-NE2 3.15Å; Y127-C186 VanDerWaalsContact O-CB 3.32Å; Y127-C186 WeakPolarHBondContact O-CB 3.34Å; Y127-F189 HydrophobicContact CG-CB 4.41Å
128	T	93.9	Very high	95.9	Very high	31 Å²	31	50 Å²	50	19%	0.19	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	-178.2	178.9	75.2	0	0	0	0	110.3	N126 D130 G131 R133	N126-T128 WeakPolarHBondContact OD1-CG2 3.42Å; T128-D130 PolarHBondContact O-N 2.78Å; T128-D130 VanDerWaalsContact O-N 3.15Å; T128-D130 PolarHBondContact OG1-N 3.29Å; T128-G131 PolarHBondContact N-O 3.16Å; T128-G131 PolarHBondContact O-N 3.05Å; T128-G131 PolarHBondContact OG1-O 2.93Å; T128-R133 HydrophobicContact CG2-CG 3.77Å
129	Q	92.2	Very high	95.7	Very high	142 Å²	142	50.1 Å²	50.1	66%	0.664	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.5	-22.9	173.3	-66.7	-179.4	-21.6	0	0	113.2	F179	Q129-F179 HydrophobicContact CB-CB 4.49Å; Q129-F179 HydrophobicContact CG-CB 4.07Å; Q129-F179 HydrophobicContact CG-CD1 4.14Å; Q129-F179 HydrophobicContact CG-CG 4.02Å
130	D	92.3	Very high	95.4	Very high	129 Å²	129	53 Å²	53	69%	0.69	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.1	7	178.9	-58.5	-44.6	0	0	0	113	T128	T128-D130 PolarHBondContact O-N 2.78Å; T128-D130 VanDerWaalsContact O-N 3.15Å; T128-D130 PolarHBondContact OG1-N 3.29Å
131	G	95.3	Very high	95.1	Very high	3 Å²	3	53.6 Å²	53.6	3%	0.031	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	98	-161.1	-175.9	0	0	0	0	0	113.8	T128 R133	T128-G131 PolarHBondContact N-O 3.16Å; T128-G131 PolarHBondContact O-N 3.05Å; T128-G131 PolarHBondContact OG1-O 2.93Å; G131-R133 PolarHBondContact O-N 3.33Å
132	V	97.3	Very high	95	Very high	24 Å²	24	45.8 Å²	45.8	15%	0.145	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	123	-177.8	-170.5	0	0	0	0	111.7	Y125 N126 Y127 R134 W172 F189	Y125-V132 HydrophobicContact CD1-CG1 4.4Å; N126-V132 WeakPolarHBondContact O-CA 3.42Å; Y127-V132 HydrophobicContact CD2-CG2 3.96Å; V132-R134 PolarHBondContact O-NH1 3.17Å; V132-W172 HydrophobicContact CG2-CB 3.46Å; V132-W172 VanDerWaalsContact CG2-CB 3.46Å; V132-W172 HydrophobicContact CG2-CG 4.14Å; V132-F189 HydrophobicContact CG1-CE2 4.06Å; V132-F189 HydrophobicContact CG1-CZ 3.88Å; V132-F189 HydrophobicContact CG2-CD2 4.28Å; V132-F189 HydrophobicContact CG2-CE2 3.72Å; V132-F189 HydrophobicContact CG2-CZ 4.39Å
133	R	96.4	Very high	94.9	Very high	121 Å²	121	45.9 Å²	45.9	46%	0.457	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	152.4	176.5	-58.9	-69.4	-63.3	-160.2	-3.5	110.7	Y125 N126 T128 G131 D135	Y125-R133 VanDerWaalsContact CA-O 3.31Å; Y125-R133 WeakPolarHBondContact CA-O 3.38Å; N126-R133 PolarHBondContact N-O 2.91Å; N126-R133 VanDerWaalsContact N-O 3.15Å; N126-R133 PolarHBondContact O-N 3.45Å; T128-R133 HydrophobicContact CG2-CG 3.77Å; G131-R133 PolarHBondContact O-N 3.33Å; R133-D135 IonicContact NE-OD1 3.83Å
134	R	97.6	Very high	94.8	Very high	93 Å²	93	46.2 Å²	46.2	35%	0.351	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	83.1	176	-70.3	161.2	-174.3	74.6	-5.6	108.1	V123 Y125 V132 E164	V123-R134 HydrophobicContact CG1-CB 4.14Å; Y125-R134 HydrophobicContact CD1-CG 3.8Å; Y125-R134 HydrophobicContact CE1-CG 3.55Å; Y125-R134 HydrophobicContact CE2-CG 4.44Å; Y125-R134 HydrophobicContact CG-CG 4.41Å; V132-R134 PolarHBondContact O-NH1 3.17Å; R134-E164 IonicContact CZ-OE1 3.22Å; R134-E164 VanDerWaalsContact CZ-OE1 3.22Å; R134-E164 IonicContact NE-OE1 2.95Å; R134-E164 PolarHBondContact NE-OE1 3.01Å; R134-E164 IonicContact NE-OE2 3.48Å; R134-E164 PolarHBondContact NE-OE2 3.27Å; R134-E164 IonicContact NH2-OE1 2.68Å; R134-E164 PolarHBondContact NH2-OE1 3.43Å
135	D	96.5	Very high	94.7	Very high	22 Å²	22	46.2 Å²	46.2	12%	0.118	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	129.6	-169.5	-67.1	-23.9	0	0	0	111.3	H88 V124 N126 R133	H88-D135 PolarHBondContact CE1-O 2.76Å; V124-D135 PolarHBondContact N-O 3.37Å; V124-D135 PolarHBondContact O-N 3.04Å; N126-D135 PolarHBondContact ND2-OD2 2.78Å; R133-D135 IonicContact NE-OD1 3.83Å
136	Q	95.6	Very high	94.5	Very high	133 Å²	133	49.4 Å²	49.4	62%	0.621	26%	0.263	S	S	*	.	S	Bend	trans	-99.9	-0.6	174.2	-63.1	-75.3	4.7	0	0	112.2
137	S	92.6	Very high	94.3	Very high	88 Å²	88	50 Å²	50	62%	0.615	27%	0.267	S	S	*	.	S	Bend	trans	-150.7	164.6	-178.6	67.8	0	0	0	0	109.8	H88	H88-S137 PolarHBondContact CE1-N 3.47Å; H88-S137 VanDerWaalsContact CE1-N 3.28Å; H88-S137 WeakPolarHBondContact NE2-CA 3.39Å; H88-S137 PolarHBondContact NE2-N 3.03Å
138	G	90.2	Very high	94	Very high	19 Å²	19	51 Å²	51	20%	0.196	27%	0.272	C	S	.	.	S	Bend	trans	94.1	-4.5	174.3	0	0	0	0	0	114.7	R105	R105-G138 PolarHBondContact NH1-O 2.78Å
139	W	93.6	Very high	93.5	Very high	1 Å²	1	56.6 Å²	56.6	0%	0.004	29%	0.29	C	S	.	.			trans	-111.1	21	176.6	-62	81.7	0	0	0	113.2	G87 H88 L95 A97 H114 T115 V124 N126 H141 C142	G87-W139 WeakPolarHBondContact CA-O 3.49Å; G87-W139 PolarHBondContact N-O 2.92Å; H88-W139 AromaticContact CE1-CD1 3.83Å; H88-W139 WeakPolarHBondContact NE2-CB 3.5Å; H88-W139 AromaticContact NE2-CD1 3.91Å; H88-W139 PolarHBondContact NE2-N 2.91Å; H88-W139 VanDerWaalsContact NE2-N 3.2Å; L95-W139 HydrophobicContact CB-CE3 3.62Å; L95-W139 HydrophobicContact CB-CZ3 3.7Å; L95-W139 HydrophobicContact CD1-CB 4.39Å; L95-W139 HydrophobicContact CD1-CD2 4.41Å; L95-W139 HydrophobicContact CD1-CE3 4.03Å; A97-W139 HydrophobicContact CB-CE3 3.78Å; A97-W139 HydrophobicContact CB-CH2 4.43Å; A97-W139 HydrophobicContact CB-CZ3 3.69Å; H114-W139 AromaticContact CD2-CH2 3.51Å; H114-W139 AromaticContact CD2-CZ2 3.41Å; H114-W139 VanDerWaalsContact CD2-CZ2 3.41Å; H114-W139 WeakPolarHBondContact CD2-CZ2 3.42Å; H114-W139 AromaticContact NE2-CZ2 3.75Å; T115-W139 VanDerWaalsContact C-CH2 3.46Å; V124-W139 HydrophobicContact CB-CD2 4.18Å; V124-W139 HydrophobicContact CB-CG 4.01Å; V124-W139 HydrophobicContact CG1-CD2 3.67Å; V124-W139 VanDerWaalsContact CG1-CE2 3.48Å; V124-W139 HydrophobicContact CG1-CE3 4.16Å; V124-W139 HydrophobicContact CG1-CG 4.05Å; V124-W139 HydrophobicContact CG1-CH2 4.33Å; V124-W139 HydrophobicContact CG1-CZ2 3.84Å; V124-W139 HydrophobicContact CG1-CZ3 4.47Å; V124-W139 HydrophobicContact CG2-CB 4.01Å; V124-W139 HydrophobicContact CG2-CD2 4.23Å; V124-W139 HydrophobicContact CG2-CG 3.76Å; N126-W139 HydrophobicContact CB-CH2 4.46Å; N126-W139 HydrophobicContact CB-CZ2 3.85Å; W139-H141 PolarHBondContact O-N 2.99Å; W139-C142 HydrophobicContact CE3-CB 4.35Å; W139-C142 PolarHBondContact O-SG 3.28Å
140	S	91.8	Very high	93.2	Very high	72 Å²	72	54.6 Å²	54.6	50%	0.503	29%	0.289	S	S	.	.	S	Bend	trans	-69.9	-17.5	-178.8	55.1	0	0	0	0	114.4	D86	D86-S140 WeakPolarHBondContact CA-O 3.26Å
141	H	90.4	Very high	92.8	Very high	53 Å²	53	52 Å²	52	25%	0.245	28%	0.276	C	S	.	.	S	Bend	trans	-128.1	82.7	178	-167.8	88.1	0	0	0	109.1	F84 W139	F84-H141 AromaticContact CD1-CE1 3.88Å; F84-H141 AromaticContact CD1-NE2 3.44Å; F84-H141 WeakPolarHBondContact CD1-NE2 3.21Å; F84-H141 AromaticContact CD2-CE1 3.33Å; F84-H141 WeakPolarHBondContact CD2-CE1 3.28Å; F84-H141 AromaticContact CD2-NE2 3.6Å; F84-H141 AromaticContact CE1-NE2 3.64Å; F84-H141 AromaticContact CE2-CE1 3.84Å; F84-H141 AromaticContact CE2-NE2 3.77Å; F84-H141 AromaticContact CG-CE1 3.33Å; F84-H141 WeakPolarHBondContact CG-CE1 3.5Å; F84-H141 AromaticContact CG-NE2 3.41Å; F84-H141 WeakPolarHBondContact CG-NE2 3.5Å; F84-H141 AromaticContact CZ-NE2 3.77Å; W139-H141 PolarHBondContact O-N 2.99Å
142	C	93.3	Very high	92.4	Very high	0 Å²	0	52.5 Å²	52.5	0%	0	28%	0.277	C	S	.	.	B	Isolated β-bridge	trans	-139.2	161.1	-176.2	68.9	0	0	0	0	112.2	F84 T85 G87 V96 A97 W139	F84-C142 CarbonylContact C-O 3.58Å; F84-C142 WeakPolarHBondContact CA-O 3.35Å; T85-C142 PolarHBondContact N-O 2.82Å; T85-C142 PolarHBondContact O-N 3.42Å; T85-C142 PolarHBondContact O-SG 3.37Å; T85-C142 PolarHBondContact OG1-O 3.29Å; G87-C142 VanDerWaalsContact CA-SG 3.5Å; G87-C142 PolarHBondContact N-SG 3.16Å; G87-C142 VanDerWaalsContact N-SG 3.35Å; V96-C142 CarbonylContact O-C 3.47Å; V96-C142 WeakPolarHBondContact O-CA 3.49Å; V96-C142 WeakPolarHBondContact O-CB 3.35Å; A97-C142 HydrophobicContact CB-CB 4.18Å; W139-C142 HydrophobicContact CE3-CB 4.35Å; W139-C142 PolarHBondContact O-SG 3.28Å
143	V	95.4	Very high	92	Very high	4 Å²	4	57 Å²	57	2%	0.024	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	128.4	170.4	175.4	0	0	0	0	108.6	F84 L95 V96 F107 R219 M220 V223	F84-V143 HydrophobicContact CD1-CG2 4.43Å; L95-V143 WeakPolarHBondContact CA-O 3.33Å; V96-V143 HydrophobicContact CB-CB 4.25Å; V96-V143 PolarHBondContact N-O 3.35Å; V96-V143 PolarHBondContact O-N 3.25Å; F107-V143 HydrophobicContact CE1-CG2 4.12Å; F107-V143 HydrophobicContact CE2-CG2 4.4Å; F107-V143 HydrophobicContact CZ-CG2 3.82Å; V143-R219 HydrophobicContact CG1-CB 3.6Å; V143-R219 HydrophobicContact CG1-CG 4.21Å; V143-M220 HydrophobicContact CG2-SD 4.31Å; V143-V223 HydrophobicContact CG2-CG2 3.45Å; V143-V223 VanDerWaalsContact CG2-CG2 3.45Å
144	S	96.4	Very high	91.6	Very high	21 Å²	21	56 Å²	56	15%	0.147	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	133.3	-178.5	-170.3	0	0	0	0	113.1	T85 C93 R219	T85-S144 WeakPolarHBondContact OG1-CB 3.35Å; C93-S144 WeakPolarHBondContact CB-OG 3.41Å; C93-S144 PolarHBondContact SG-OG 3.2Å; S144-R219 WeakPolarHBondContact O-CD 3.33Å; S144-R219 PolarHBondContact O-NE 3.2Å
145	V	96.5	Very high	91.2	Very high	0 Å²	0	51.7 Å²	51.7	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	102.9	171.7	-179.7	0	0	0	0	107.8	C93 L94 L147 F211 F215 I216 R219	C93-V145 CarbonylContact C-O 3.3Å; C93-V145 VanDerWaalsContact CA-O 3.29Å; C93-V145 WeakPolarHBondContact CA-O 3.41Å; L94-V145 HydrophobicContact CB-CB 4.2Å; L94-V145 HydrophobicContact CD2-CB 4.46Å; L94-V145 HydrophobicContact CD2-CG2 4.25Å; L94-V145 PolarHBondContact N-O 2.82Å; L94-V145 PolarHBondContact O-N 2.96Å; V145-L147 HydrophobicContact CG1-CD2 4.43Å; V145-L147 PolarHBondContact O-N 3.42Å; V145-F211 HydrophobicContact CG1-CZ 4.38Å; V145-F215 HydrophobicContact CG1-CB 4Å; V145-F215 HydrophobicContact CG1-CD1 4.3Å; V145-F215 HydrophobicContact CG1-CG 4.49Å; V145-I216 HydrophobicContact CG2-CD1 3.99Å; V145-R219 VanDerWaalsContact CG2-CD 3.46Å
146	P	94.3	Very high	90.9	Very high	80 Å²	80	54 Å²	54	52%	0.519	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.4	125.8	175.1	-22.8	34	0	0	0	110.9
147	L	92.7	Very high	90.6	Very high	15 Å²	15	52.2 Å²	52.2	8%	0.079	30%	0.299	C	S	.	.			trans	-95.8	-29.5	-178.5	-60.2	174.7	0	0	0	112.1	C92 L94 I117 V145 M152 W159 L194 F211	C92-L147 WeakPolarHBondContact O-CB 3.48Å; C92-L147 PolarHBondContact O-N 3.31Å; L94-L147 HydrophobicContact CB-CD1 4.01Å; L94-L147 HydrophobicContact CB-CD2 3.9Å; L94-L147 HydrophobicContact CB-CG 4.15Å; I117-L147 HydrophobicContact CG1-CD1 4.41Å; I117-L147 HydrophobicContact CG2-CD1 4.31Å; V145-L147 HydrophobicContact CG1-CD2 4.43Å; V145-L147 PolarHBondContact O-N 3.42Å; L147-M152 VanDerWaalsContact O-CE 3.23Å; L147-M152 WeakPolarHBondContact O-CE 3.34Å; L147-W159 HydrophobicContact CB-CH2 3.74Å; L147-W159 HydrophobicContact CB-CZ2 4.49Å; L147-W159 HydrophobicContact CD1-CH2 3.61Å; L147-W159 HydrophobicContact CD1-CZ2 3.9Å; L147-W159 HydrophobicContact CG-CH2 4.32Å; L147-L194 HydrophobicContact CD2-CD1 4.22Å; L147-L194 HydrophobicContact CD2-CD2 4.16Å; L147-F211 HydrophobicContact CD2-CE2 4.45Å; L147-F211 HydrophobicContact CD2-CZ 4.34Å
148	V	89.1	Confident	90.6	Very high	19 Å²	19	51.9 Å²	51.9	12%	0.115	29%	0.288	C	S	.	.			trans	-93.8	112.7	179.9	-172.9	0	0	0	0	109.5	C92 M152 F153 L156 W159	C92-V148 HydrophobicContact CB-CB 4.31Å; C92-V148 HydrophobicContact CB-CG2 3.47Å; C92-V148 VanDerWaalsContact CB-CG2 3.47Å; V148-M152 HydrophobicContact CG1-CB 4.1Å; V148-M152 VanDerWaalsContact CG1-O 3.3Å; V148-M152 WeakPolarHBondContact CG1-O 3.4Å; V148-F153 HydrophobicContact CG1-CD1 3.88Å; V148-F153 HydrophobicContact CG1-CE1 4.49Å; V148-L156 HydrophobicContact CB-CD2 4.26Å; V148-L156 HydrophobicContact CG1-CD2 4.08Å; V148-L156 HydrophobicContact CG1-CG 4.27Å; V148-L156 HydrophobicContact CG2-CD2 4.17Å; V148-W159 HydrophobicContact CG2-CE3 3.88Å; V148-W159 HydrophobicContact CG2-CH2 4.29Å; V148-W159 HydrophobicContact CG2-CZ3 3.76Å
149	R	83.6	Confident	90.9	Very high	149 Å²	149	51.1 Å²	51.1	56%	0.562	28%	0.279	S	S	*	.			trans	-83.3	162.8	174.7	-66.7	173.9	48.9	103.7	3.8	111	D151 M152 F153	R149-D151 WeakPolarHBondContact CB-OD1 3.4Å; R149-D151 IonicContact CZ-OD1 2.96Å; R149-D151 IonicContact NE-OD1 2.82Å; R149-D151 PolarHBondContact NE-OD1 2.78Å; R149-D151 IonicContact NH2-OD1 3.09Å; R149-D151 PolarHBondContact O-N 2.89Å; R149-D151 VanDerWaalsContact O-N 3.12Å; R149-M152 HydrophobicContact CB-CE 3.98Å; R149-M152 HydrophobicContact CG-CE 4.01Å; R149-M152 WeakPolarHBondContact O-CA 3.36Å; R149-M152 PolarHBondContact O-N 2.8Å; R149-F153 WeakPolarHBondContact O-CD1 3.44Å; R149-F153 PolarHBondContact O-N 3.08Å
150	P	85.8	Confident	91.1	Very high	101 Å²	101	53 Å²	53	66%	0.656	29%	0.289	S	S	*	.	G	3₁₀ helix	trans	-51.7	-35.2	176.4	-28.9	36.7	0	0	0	114.6	M152 F153	P150-M152 PolarHBondContact O-N 3.33Å; P150-F153 HydrophobicContact CB-CE2 4.33Å; P150-F153 HydrophobicContact CB-CZ 4.16Å; P150-F153 HydrophobicContact CG-CZ 4.24Å
151	D	84.6	Confident	91.3	Very high	75 Å²	75	55.8 Å²	55.8	40%	0.401	29%	0.294	S	S	.	.	G	3₁₀ helix	trans	-74.1	-6.4	176.9	58.2	-61	0	0	0	114.4	R149 R203	R149-D151 WeakPolarHBondContact CB-OD1 3.4Å; R149-D151 IonicContact CZ-OD1 2.96Å; R149-D151 IonicContact NE-OD1 2.82Å; R149-D151 PolarHBondContact NE-OD1 2.78Å; R149-D151 IonicContact NH2-OD1 3.09Å; R149-D151 PolarHBondContact O-N 2.89Å; R149-D151 VanDerWaalsContact O-N 3.12Å; D151-R203 IonicContact OD2-CZ 2.67Å; D151-R203 IonicContact OD2-NH1 3.73Å; D151-R203 PolarHBondContact OD2-NH1 2.87Å; D151-R203 IonicContact OD2-NH2 3.46Å; D151-R203 PolarHBondContact OD2-NH2 2.99Å
152	M	86.3	Confident	91.5	Very high	12 Å²	12	56.4 Å²	56.4	6%	0.059	30%	0.295	C	S	.	.	G	3₁₀ helix	trans	-120.3	15.5	-178	-59.3	-168.8	-61.7	0	0	113.1	L147 V148 R149 P150 H154 L155	L147-M152 VanDerWaalsContact O-CE 3.23Å; L147-M152 WeakPolarHBondContact O-CE 3.34Å; V148-M152 HydrophobicContact CG1-CB 4.1Å; V148-M152 VanDerWaalsContact CG1-O 3.3Å; V148-M152 WeakPolarHBondContact CG1-O 3.4Å; R149-M152 HydrophobicContact CB-CE 3.98Å; R149-M152 HydrophobicContact CG-CE 4.01Å; R149-M152 WeakPolarHBondContact O-CA 3.36Å; R149-M152 PolarHBondContact O-N 2.8Å; P150-M152 PolarHBondContact O-N 3.33Å; M152-H154 PolarHBondContact O-N 3.22Å; M152-H154 VanDerWaalsContact O-N 3.11Å; M152-L155 HydrophobicContact CB-CD1 3.95Å; M152-L155 HydrophobicContact CB-CG 4.42Å; M152-L155 VanDerWaalsContact O-CB 3.26Å; M152-L155 WeakPolarHBondContact O-CB 3.48Å; M152-L155 WeakPolarHBondContact O-CG 3.34Å; M152-L155 PolarHBondContact O-N 3.18Å; M152-L155 HydrophobicContact SD-CD1 4.35Å
153	F	89.4	Confident	91.7	Very high	120 Å²	120	56.4 Å²	56.4	53%	0.526	30%	0.295	S	S	.	.	G	3₁₀ helix	trans	-61.5	-20.2	-176.7	-76	-7.5	0	0	0	114.4	V148 R149 P150 L155 L156	V148-F153 HydrophobicContact CG1-CD1 3.88Å; V148-F153 HydrophobicContact CG1-CE1 4.49Å; R149-F153 WeakPolarHBondContact O-CD1 3.44Å; R149-F153 PolarHBondContact O-N 3.08Å; P150-F153 HydrophobicContact CB-CE2 4.33Å; P150-F153 HydrophobicContact CB-CZ 4.16Å; P150-F153 HydrophobicContact CG-CZ 4.24Å; F153-L155 PolarHBondContact O-N 3.11Å; F153-L156 HydrophobicContact CB-CD1 4.34Å; F153-L156 HydrophobicContact CD1-CD1 4.29Å; F153-L156 HydrophobicContact CG-CD1 4.39Å; F153-L156 WeakPolarHBondContact O-CB 3.48Å; F153-L156 WeakPolarHBondContact O-CG 3.36Å; F153-L156 PolarHBondContact O-N 3.49Å; F153-L156 VanDerWaalsContact O-N 3.13Å
154	H	88.5	Confident	91.8	Very high	100 Å²	100	58.7 Å²	58.7	46%	0.463	31%	0.305	S	S	.	.	G	3₁₀ helix	trans	-60.4	-27.7	171.6	62.2	-78.3	0	0	0	112.6	M152 L156 A157 E201	M152-H154 PolarHBondContact O-N 3.22Å; M152-H154 VanDerWaalsContact O-N 3.11Å; H154-L156 PolarHBondContact O-N 3.43Å; H154-A157 PolarHBondContact O-N 3.24Å; H154-E201 IonicContact CD2-OE1 3.72Å; H154-E201 IonicContact CE1-OE1 2.69Å; H154-E201 IonicContact CE1-OE2 3.77Å; H154-E201 PolarHBondContact CE1-OE2 2.84Å; H154-E201 IonicContact NE2-OE1 3.29Å; H154-E201 PolarHBondContact NE2-OE1 3.15Å; H154-E201 IonicContact NE2-OE2 3.76Å; H154-E201 PolarHBondContact NE2-OE2 2.75Å
155	L	88.1	Confident	91.8	Very high	2 Å²	2	62 Å²	62	1%	0.01	32%	0.324	C	S	.	.	G	3₁₀ helix	trans	-64.7	-24.1	176.7	-67.1	179.1	0	0	0	112.9	M152 F153 A157 Q158 W159 V197 E201	M152-L155 HydrophobicContact CB-CD1 3.95Å; M152-L155 HydrophobicContact CB-CG 4.42Å; M152-L155 VanDerWaalsContact O-CB 3.26Å; M152-L155 WeakPolarHBondContact O-CB 3.48Å; M152-L155 WeakPolarHBondContact O-CG 3.34Å; M152-L155 PolarHBondContact O-N 3.18Å; M152-L155 HydrophobicContact SD-CD1 4.35Å; F153-L155 PolarHBondContact O-N 3.11Å; L155-A157 PolarHBondContact O-N 3.14Å; L155-Q158 CarbonylContact O-C 3.58Å; L155-Q158 PolarHBondContact O-N 3.4Å; L155-W159 WeakPolarHBondContact O-CA 3.37Å; L155-W159 WeakPolarHBondContact O-CB 3.11Å; L155-W159 PolarHBondContact O-N 2.86Å; L155-V197 HydrophobicContact CD1-CG1 3.51Å; L155-V197 HydrophobicContact CD2-CG1 4.43Å; L155-E201 HydrophobicContact CD1-CG 4.15Å; L155-E201 HydrophobicContact CD2-CG 4.33Å; L155-E201 WeakPolarHBondContact CD2-OE1 3.44Å
156	L	91.1	Very high	91.9	Very high	70 Å²	70	64.3 Å²	64.3	37%	0.366	34%	0.335	S	S	.	.	G	3₁₀ helix	trans	-58	-34.3	-177.7	-65.4	176	0	0	0	112.2	C92 V148 F153 H154 Q158	C92-L156 HydrophobicContact CB-CD2 4.33Å; C92-L156 WeakPolarHBondContact SG-CD2 3.47Å; V148-L156 HydrophobicContact CB-CD2 4.26Å; V148-L156 HydrophobicContact CG1-CD2 4.08Å; V148-L156 HydrophobicContact CG1-CG 4.27Å; V148-L156 HydrophobicContact CG2-CD2 4.17Å; F153-L156 HydrophobicContact CB-CD1 4.34Å; F153-L156 HydrophobicContact CD1-CD1 4.29Å; F153-L156 HydrophobicContact CG-CD1 4.39Å; F153-L156 WeakPolarHBondContact O-CB 3.48Å; F153-L156 WeakPolarHBondContact O-CG 3.36Å; F153-L156 PolarHBondContact O-N 3.49Å; F153-L156 VanDerWaalsContact O-N 3.13Å; H154-L156 PolarHBondContact O-N 3.43Å; L156-Q158 PolarHBondContact O-N 3.4Å
157	A	89.8	Confident	92	Very high	95 Å²	95	60.9 Å²	60.9	79%	0.785	31%	0.312	S	S	*	.	G	3₁₀ helix	trans	-69.8	-22.1	179.2	0	0	0	0	0	113.4	H154 L155	H154-A157 PolarHBondContact O-N 3.24Å; L155-A157 PolarHBondContact O-N 3.14Å
158	Q	92.3	Very high	92.2	Very high	82 Å²	82	66.7 Å²	66.7	38%	0.383	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	-114.9	-11.6	-175.3	-65.5	177.8	-15.1	0	0	113	L155 L156 D160 Q161 Y162	L155-Q158 CarbonylContact O-C 3.58Å; L155-Q158 PolarHBondContact O-N 3.4Å; L156-Q158 PolarHBondContact O-N 3.4Å; Q158-D160 PolarHBondContact O-N 3.49Å; Q158-Q161 PolarHBondContact O-N 3.49Å; Q158-Q161 VanDerWaalsContact O-N 3.1Å; Q158-Y162 HydrophobicContact CB-CD2 4.13Å; Q158-Y162 HydrophobicContact CB-CE1 4.41Å; Q158-Y162 HydrophobicContact CB-CE2 3.81Å; Q158-Y162 PolarHBondContact O-N 2.94Å; Q158-Y162 PolarHBondContact OE1-OH 3.43Å
159	W	96.2	Very high	92.4	Very high	3 Å²	3	66.7 Å²	66.7	1%	0.011	34%	0.343	C	S	.	.	H	α-helix	trans	-52	-51.4	-173.6	-177.9	-93.6	0	0	0	112.8	C92 I117 S118 T120 L147 V148 L155 Q161 Y162 L163 F193	C92-W159 HydrophobicContact CB-CD2 3.85Å; C92-W159 HydrophobicContact CB-CE3 4.35Å; C92-W159 HydrophobicContact CB-CG 4.25Å; C92-W159 HydrophobicContact CB-CH2 4.24Å; C92-W159 HydrophobicContact CB-CZ2 3.75Å; I117-W159 HydrophobicContact CG2-CZ2 3.56Å; S118-W159 PolarHBondContact O-NE1 2.87Å; T120-W159 HydrophobicContact CG2-CB 4.22Å; L147-W159 HydrophobicContact CB-CH2 3.74Å; L147-W159 HydrophobicContact CB-CZ2 4.49Å; L147-W159 HydrophobicContact CD1-CH2 3.61Å; L147-W159 HydrophobicContact CD1-CZ2 3.9Å; L147-W159 HydrophobicContact CG-CH2 4.32Å; V148-W159 HydrophobicContact CG2-CE3 3.88Å; V148-W159 HydrophobicContact CG2-CH2 4.29Å; V148-W159 HydrophobicContact CG2-CZ3 3.76Å; L155-W159 WeakPolarHBondContact O-CA 3.37Å; L155-W159 WeakPolarHBondContact O-CB 3.11Å; L155-W159 PolarHBondContact O-N 2.86Å; W159-Q161 VanDerWaalsContact C-N 3.32Å; W159-Q161 PolarHBondContact O-N 3.49Å; W159-Y162 PolarHBondContact O-N 2.94Å; W159-L163 WeakPolarHBondContact O-CB 3.22Å; W159-L163 PolarHBondContact O-N 3.01Å; W159-F193 HydrophobicContact CD2-CZ 4.35Å; W159-F193 HydrophobicContact CE3-CE1 4.39Å; W159-F193 HydrophobicContact CE3-CZ 4.32Å; W159-F193 AromaticContact CH2-CE1 3.51Å; W159-F193 HydrophobicContact CH2-CE1 3.51Å; W159-F193 HydrophobicContact CH2-CZ 4.22Å; W159-F193 AromaticContact CZ2-CE1 3.65Å; W159-F193 HydrophobicContact CZ2-CE1 3.65Å; W159-F193 HydrophobicContact CZ2-CZ 4.23Å; W159-F193 AromaticContact CZ3-CE1 3.9Å; W159-F193 HydrophobicContact CZ3-CE1 3.9Å; W159-F193 HydrophobicContact CZ3-CZ 4.25Å
160	D	97.1	Very high	92.8	Very high	40 Å²	40	64.4 Å²	64.4	21%	0.214	35%	0.348	C	S	.	.	H	α-helix	trans	-62.5	-41.3	-178.5	-70.9	11.4	0	0	0	111.4	N119 T120 Q158 L163 E164	N119-D160 WeakPolarHBondContact CB-OD1 3.35Å; T120-D160 WeakPolarHBondContact CB-OD1 3.44Å; T120-D160 VanDerWaalsContact CG2-OD1 3.27Å; T120-D160 WeakPolarHBondContact CG2-OD1 3.37Å; T120-D160 PolarHBondContact N-OD1 2.78Å; T120-D160 PolarHBondContact OG1-OD1 2.93Å; T120-D160 PolarHBondContact OG1-OD2 3.44Å; Q158-D160 PolarHBondContact O-N 3.49Å; D160-L163 PolarHBondContact O-N 3.19Å; D160-E164 WeakPolarHBondContact O-CB 3.29Å; D160-E164 PolarHBondContact O-N 3.43Å
161	Q	96.1	Very high	93.2	Very high	130 Å²	130	61.2 Å²	61.2	61%	0.607	33%	0.33	S	S	*	.	H	α-helix	trans	-66.9	-44.5	179.1	-177.1	179.3	-0.5	0	0	111.3	Q158 W159 E164 T165	Q158-Q161 PolarHBondContact O-N 3.49Å; Q158-Q161 VanDerWaalsContact O-N 3.1Å; W159-Q161 VanDerWaalsContact C-N 3.32Å; W159-Q161 PolarHBondContact O-N 3.49Å; Q161-E164 PolarHBondContact O-N 3.15Å; Q161-T165 WeakPolarHBondContact O-CB 3.44Å; Q161-T165 PolarHBondContact O-N 2.86Å; Q161-T165 PolarHBondContact O-OG1 2.65Å; Q161-T165 VanDerWaalsContact O-OG1 3.1Å
162	Y	95.4	Very high	93.7	Very high	67 Å²	67	58 Å²	58	26%	0.263	31%	0.312	S	S	.	.	H	α-helix	trans	-63	-43.8	176.8	-70.4	-16.8	0	0	0	111.9	Q158 W159 E164 F166 M200	Q158-Y162 HydrophobicContact CB-CD2 4.13Å; Q158-Y162 HydrophobicContact CB-CE1 4.41Å; Q158-Y162 HydrophobicContact CB-CE2 3.81Å; Q158-Y162 PolarHBondContact O-N 2.94Å; Q158-Y162 PolarHBondContact OE1-OH 3.43Å; W159-Y162 PolarHBondContact O-N 2.94Å; Y162-E164 VanDerWaalsContact C-N 3.34Å; Y162-F166 WeakPolarHBondContact O-CB 3.36Å; Y162-F166 PolarHBondContact O-N 3.41Å; Y162-M200 HydrophobicContact CD2-CE 3.53Å; Y162-M200 HydrophobicContact CE1-CE 4.5Å; Y162-M200 HydrophobicContact CE1-SD 4.38Å; Y162-M200 HydrophobicContact CE2-CE 3.45Å; Y162-M200 VanDerWaalsContact CE2-CE 3.45Å; Y162-M200 HydrophobicContact CE2-SD 4.01Å; Y162-M200 HydrophobicContact CG-CE 4.11Å
163	L	97.4	Very high	94	Very high	0 Å²	0	60.3 Å²	60.3	0%	0	33%	0.325	C	S	.	.	H	α-helix	trans	-64.5	-41.1	178.7	-172.1	57.9	0	0	0	111.4	I117 N119 Y125 W159 D160 S167 F193	I117-L163 HydrophobicContact CB-CD1 4.24Å; I117-L163 HydrophobicContact CB-CD2 4.34Å; I117-L163 HydrophobicContact CD1-CD1 4.28Å; I117-L163 HydrophobicContact CG2-CD1 4.13Å; I117-L163 HydrophobicContact CG2-CD2 3.82Å; N119-L163 HydrophobicContact CB-CD2 4.12Å; Y125-L163 HydrophobicContact CD1-CD2 4.46Å; Y125-L163 HydrophobicContact CD1-CG 4.04Å; Y125-L163 HydrophobicContact CD2-CD2 3.37Å; Y125-L163 HydrophobicContact CD2-CG 3.86Å; Y125-L163 HydrophobicContact CE1-CG 4.37Å; Y125-L163 HydrophobicContact CE2-CD2 3.87Å; Y125-L163 HydrophobicContact CE2-CG 4.27Å; Y125-L163 HydrophobicContact CG-CD1 4.28Å; Y125-L163 HydrophobicContact CG-CD2 3.72Å; Y125-L163 HydrophobicContact CG-CG 3.74Å; W159-L163 WeakPolarHBondContact O-CB 3.22Å; W159-L163 PolarHBondContact O-N 3.01Å; D160-L163 PolarHBondContact O-N 3.19Å; L163-S167 WeakPolarHBondContact O-CB 3.47Å; L163-S167 PolarHBondContact O-N 3.42Å; L163-S167 PolarHBondContact O-OG 2.95Å; L163-F193 HydrophobicContact CB-CE2 3.92Å; L163-F193 HydrophobicContact CB-CZ 3.99Å; L163-F193 HydrophobicContact CD1-CD1 4.28Å; L163-F193 HydrophobicContact CD1-CD2 3.84Å; L163-F193 HydrophobicContact CD1-CE1 4.17Å; L163-F193 HydrophobicContact CD1-CE2 3.78Å; L163-F193 HydrophobicContact CD1-CG 4.08Å; L163-F193 HydrophobicContact CD1-CZ 3.93Å; L163-F193 HydrophobicContact CG-CE2 4.47Å; L163-F193 HydrophobicContact CG-CZ 4.49Å
164	E	97.6	Very high	94.1	Very high	52 Å²	52	56.6 Å²	56.6	24%	0.243	31%	0.313	C	S	.	.	H	α-helix	trans	-63.4	-53.4	175.8	-167.2	64.4	-136.4	0	0	111.6	Y125 R134 D160 Q161 Y162 F166 S167 E168	Y125-E164 VanDerWaalsContact CE1-OE2 3.3Å; Y125-E164 WeakPolarHBondContact CE1-OE2 3.17Å; Y125-E164 VanDerWaalsContact CZ-OE2 3.3Å; Y125-E164 PolarHBondContact OH-OE2 3.28Å; R134-E164 IonicContact CZ-OE1 3.22Å; R134-E164 VanDerWaalsContact CZ-OE1 3.22Å; R134-E164 IonicContact NE-OE1 2.95Å; R134-E164 PolarHBondContact NE-OE1 3.01Å; R134-E164 IonicContact NE-OE2 3.48Å; R134-E164 PolarHBondContact NE-OE2 3.27Å; R134-E164 IonicContact NH2-OE1 2.68Å; R134-E164 PolarHBondContact NH2-OE1 3.43Å; D160-E164 WeakPolarHBondContact O-CB 3.29Å; D160-E164 PolarHBondContact O-N 3.43Å; Q161-E164 PolarHBondContact O-N 3.15Å; Y162-E164 VanDerWaalsContact C-N 3.34Å; E164-F166 VanDerWaalsContact C-N 3.31Å; E164-F166 PolarHBondContact O-N 3.22Å; E164-S167 WeakPolarHBondContact O-CB 3.15Å; E164-S167 PolarHBondContact O-N 3.1Å; E164-E168 WeakPolarHBondContact O-CG 3.48Å; E164-E168 PolarHBondContact O-N 2.86Å; E164-E168 VanDerWaalsContact O-N 3.09Å
165	T	96.8	Very high	94.2	Very high	89 Å²	89	57.4 Å²	57.4	55%	0.546	33%	0.325	S	S	.	.	H	α-helix	trans	-60.5	-40.7	-179.3	-61.2	0	0	0	0	111.8	Q161 S167 E168	Q161-T165 WeakPolarHBondContact O-CB 3.44Å; Q161-T165 PolarHBondContact O-N 2.86Å; Q161-T165 PolarHBondContact O-OG1 2.65Å; Q161-T165 VanDerWaalsContact O-OG1 3.1Å; T165-S167 VanDerWaalsContact C-N 3.34Å; T165-E168 PolarHBondContact O-N 3.49Å
166	F	97.4	Very high	94.3	Very high	50 Å²	50	66.8 Å²	66.8	22%	0.219	36%	0.36	C	S	.	.	H	α-helix	trans	-62.6	-42.1	175	176.5	-96.5	0	0	0	111.8	Y162 E164 E168 G169 W172 F189 Q192 F193	Y162-F166 WeakPolarHBondContact O-CB 3.36Å; Y162-F166 PolarHBondContact O-N 3.41Å; E164-F166 VanDerWaalsContact C-N 3.31Å; E164-F166 PolarHBondContact O-N 3.22Å; F166-E168 VanDerWaalsContact C-N 3.29Å; F166-E168 PolarHBondContact O-N 3.5Å; F166-G169 PolarHBondContact O-N 2.92Å; F166-G169 VanDerWaalsContact O-N 3.13Å; F166-W172 AromaticContact CD1-NE1 3.93Å; F166-W172 AromaticContact CE1-CE2 3.79Å; F166-W172 HydrophobicContact CE1-CZ2 4.01Å; F166-W172 AromaticContact CE1-NE1 3.35Å; F166-W172 VanDerWaalsContact CE1-NE1 3.35Å; F166-W172 HydrophobicContact CE2-CZ2 4.33Å; F166-W172 AromaticContact CE2-NE1 3.7Å; F166-W172 AromaticContact CZ-CE2 3.56Å; F166-W172 AromaticContact CZ-CZ2 3.47Å; F166-W172 HydrophobicContact CZ-CZ2 3.47Å; F166-W172 VanDerWaalsContact CZ-CZ2 3.47Å; F166-W172 AromaticContact CZ-NE1 3.24Å; F166-W172 VanDerWaalsContact O-CD1 3.24Å; F166-F189 HydrophobicContact CD1-CD2 4.43Å; F166-F189 AromaticContact CD1-CE2 3.79Å; F166-F189 HydrophobicContact CD1-CE2 3.79Å; F166-F189 HydrophobicContact CD1-CZ 4.06Å; F166-F189 AromaticContact CE1-CD2 3.66Å; F166-F189 HydrophobicContact CE1-CD2 3.66Å; F166-F189 AromaticContact CE1-CE2 3.46Å; F166-F189 HydrophobicContact CE1-CE2 3.46Å; F166-F189 VanDerWaalsContact CE1-CE2 3.46Å; F166-F189 HydrophobicContact CE1-CG 4.3Å; F166-F189 AromaticContact CE1-CZ 3.96Å; F166-F189 HydrophobicContact CE1-CZ 3.96Å; F166-Q192 HydrophobicContact CE2-CB 4.29Å; F166-Q192 HydrophobicContact CZ-CB 3.88Å; F166-F193 HydrophobicContact CB-CD2 3.96Å; F166-F193 HydrophobicContact CB-CE2 4.48Å; F166-F193 HydrophobicContact CD1-CB 3.86Å; F166-F193 AromaticContact CD1-CD2 3.86Å; F166-F193 HydrophobicContact CD1-CD2 3.86Å; F166-F193 HydrophobicContact CD1-CG 4.29Å; F166-F193 HydrophobicContact CD2-CD2 4.42Å; F166-F193 HydrophobicContact CE1-CB 3.57Å; F166-F193 HydrophobicContact CE1-CD2 4.45Å; F166-F193 HydrophobicContact CE1-CG 4.47Å; F166-F193 HydrophobicContact CE2-CB 4.33Å; F166-F193 HydrophobicContact CG-CB 4.35Å; F166-F193 AromaticContact CG-CD2 3.82Å; F166-F193 HydrophobicContact CG-CD2 3.82Å; F166-F193 HydrophobicContact CZ-CB 3.81Å; F166-F193 VanDerWaalsContact CZ-N 3.29Å
167	S	97.6	Very high	94.2	Very high	7 Å²	7	67.5 Å²	67.5	5%	0.049	36%	0.361	C	S	.	.	H	α-helix	trans	-70	-21.9	-177.7	-63.4	0	0	0	0	114.2	Y125 L163 E164 T165 G169	Y125-S167 WeakPolarHBondContact CD1-OG 3.33Å; L163-S167 WeakPolarHBondContact O-CB 3.47Å; L163-S167 PolarHBondContact O-N 3.42Å; L163-S167 PolarHBondContact O-OG 2.95Å; E164-S167 WeakPolarHBondContact O-CB 3.15Å; E164-S167 PolarHBondContact O-N 3.1Å; T165-S167 VanDerWaalsContact C-N 3.34Å; S167-G169 VanDerWaalsContact C-N 3.35Å
168	E	95.8	Very high	94.3	Very high	137 Å²	137	71 Å²	71	64%	0.64	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.5	-3.2	174	-66.2	179.6	156.4	0	0	112.9	E164 T165 F166	E164-E168 WeakPolarHBondContact O-CG 3.48Å; E164-E168 PolarHBondContact O-N 2.86Å; E164-E168 VanDerWaalsContact O-N 3.09Å; T165-E168 PolarHBondContact O-N 3.49Å; F166-E168 VanDerWaalsContact C-N 3.29Å; F166-E168 PolarHBondContact O-N 3.5Å
169	G	94.1	Very high	94.4	Very high	20 Å²	20	69.8 Å²	69.8	21%	0.206	35%	0.353	C	S	.	.	S	Bend	trans	-63	144.2	-179.4	0	0	0	0	0	112.7	F166 S167 A171 W172	F166-G169 PolarHBondContact O-N 2.92Å; F166-G169 VanDerWaalsContact O-N 3.13Å; S167-G169 VanDerWaalsContact C-N 3.35Å; G169-A171 PolarHBondContact O-N 2.87Å; G169-W172 PolarHBondContact O-N 2.87Å
170	P	92.4	Very high	94.3	Very high	100 Å²	100	73.9 Å²	73.9	65%	0.649	37%	0.371	S	S	*	.	G	3₁₀ helix	trans	-63.2	-19.7	-176.7	26.4	-35.5	0	0	0	113.7	W172 D173	P170-W172 PolarHBondContact O-N 2.86Å; P170-D173 PolarHBondContact O-N 3.37Å
171	A	93.3	Very high	94	Very high	35 Å²	35	79.3 Å²	79.3	29%	0.289	40%	0.395	S	S	.	.	G	3₁₀ helix	trans	-63	-19.7	174	0	0	0	0	0	113.1	G169 Q177 H184	G169-A171 PolarHBondContact O-N 2.87Å; A171-Q177 PolarHBondContact O-OE1 3.35Å; A171-H184 PolarHBondContact O-CE1 2.89Å; A171-H184 PolarHBondContact O-NE2 3.05Å; A171-H184 VanDerWaalsContact O-NE2 3.13Å
172	W	95.2	Very high	93.6	Very high	8 Å²	8	80 Å²	80	3%	0.03	40%	0.399	C	S	.	.	G	3₁₀ helix	trans	-113.2	9.2	-177.7	-50.5	112.5	0	0	0	113.4	Y127 V132 F166 G169 P170 H184 F189 Q192	Y127-W172 HydrophobicContact CD1-CE3 4.16Å; Y127-W172 HydrophobicContact CD1-CZ3 4.29Å; Y127-W172 HydrophobicContact CD2-CB 4.27Å; Y127-W172 AromaticContact CD2-CE3 4Å; Y127-W172 HydrophobicContact CD2-CE3 4Å; Y127-W172 HydrophobicContact CE1-CE3 4.3Å; Y127-W172 HydrophobicContact CE2-CB 4.24Å; Y127-W172 HydrophobicContact CE2-CE3 4.13Å; Y127-W172 WeakPolarHBondContact CE2-O 3.47Å; Y127-W172 HydrophobicContact CG-CE3 4.02Å; Y127-W172 HydrophobicContact CG-CZ3 4.48Å; V132-W172 HydrophobicContact CG2-CB 3.46Å; V132-W172 VanDerWaalsContact CG2-CB 3.46Å; V132-W172 HydrophobicContact CG2-CG 4.14Å; F166-W172 AromaticContact CD1-NE1 3.93Å; F166-W172 AromaticContact CE1-CE2 3.79Å; F166-W172 HydrophobicContact CE1-CZ2 4.01Å; F166-W172 AromaticContact CE1-NE1 3.35Å; F166-W172 VanDerWaalsContact CE1-NE1 3.35Å; F166-W172 HydrophobicContact CE2-CZ2 4.33Å; F166-W172 AromaticContact CE2-NE1 3.7Å; F166-W172 AromaticContact CZ-CE2 3.56Å; F166-W172 AromaticContact CZ-CZ2 3.47Å; F166-W172 HydrophobicContact CZ-CZ2 3.47Å; F166-W172 VanDerWaalsContact CZ-CZ2 3.47Å; F166-W172 AromaticContact CZ-NE1 3.24Å; F166-W172 VanDerWaalsContact O-CD1 3.24Å; G169-W172 PolarHBondContact O-N 2.87Å; P170-W172 PolarHBondContact O-N 2.86Å; W172-H184 AromaticContact CE3-CE1 3.4Å; W172-H184 AromaticContact CE3-NE2 3.7Å; W172-H184 AromaticContact CH2-CE1 3.96Å; W172-H184 AromaticContact CZ3-CE1 3.21Å; W172-H184 WeakPolarHBondContact CZ3-CE1 3.33Å; W172-H184 AromaticContact CZ3-ND1 3.72Å; W172-H184 AromaticContact CZ3-NE2 3.82Å; W172-F189 AromaticContact CD2-CD2 3.52Å; W172-F189 HydrophobicContact CD2-CD2 3.52Å; W172-F189 HydrophobicContact CD2-CE2 4.18Å; W172-F189 AromaticContact CE2-CD2 3.64Å; W172-F189 HydrophobicContact CE3-CB 4.13Å; W172-F189 AromaticContact CE3-CD2 3.73Å; W172-F189 HydrophobicContact CE3-CD2 3.73Å; W172-F189 HydrophobicContact CE3-CG 4.44Å; W172-F189 AromaticContact CG-CD2 3.97Å; W172-F189 HydrophobicContact CG-CD2 3.97Å; W172-F189 HydrophobicContact CG-CE2 4.16Å; W172-F189 HydrophobicContact CH2-CB 3.83Å; W172-F189 HydrophobicContact CH2-CD2 4.26Å; W172-F189 HydrophobicContact CZ2-CB 4.34Å; W172-F189 HydrophobicContact CZ2-CD2 4.05Å; W172-F189 HydrophobicContact CZ3-CB 3.68Å; W172-F189 HydrophobicContact CZ3-CD2 4.08Å; W172-F189 HydrophobicContact CZ3-CG 4.41Å; W172-Q192 HydrophobicContact CH2-CB 4.43Å; W172-Q192 HydrophobicContact CH2-CG 4.49Å; W172-Q192 HydrophobicContact CZ2-CB 4.03Å; W172-Q192 HydrophobicContact CZ2-CG 4.44Å
173	D	92.3	Very high	93.5	Very high	59 Å²	59	81.6 Å²	81.6	32%	0.316	41%	0.412	S	S	.	.			trans	-86.1	119.4	174	-178.4	-23.6	0	0	0	109	P170 V175 W176 Q177	P170-D173 PolarHBondContact O-N 3.37Å; D173-V175 PolarHBondContact O-N 3.28Å; D173-V175 VanDerWaalsContact OD1-CB 3.23Å; D173-V175 WeakPolarHBondContact OD1-CB 3.45Å; D173-V175 WeakPolarHBondContact OD1-CG2 3.24Å; D173-V175 PolarHBondContact OD1-N 2.89Å; D173-W176 PolarHBondContact O-N 3.2Å; D173-Q177 PolarHBondContact O-N 3.28Å
174	P	91.2	Very high	93.4	Very high	43 Å²	43	81.9 Å²	81.9	28%	0.279	41%	0.413	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.8	-16.4	-177.1	28.2	-36.8	0	0	0	113.7	Q177	P174-Q177 WeakPolarHBondContact CA-O 3.47Å
175	V	91.3	Very high	93.3	Very high	117 Å²	117	80.3 Å²	80.3	71%	0.709	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70	-39.6	173.3	179.4	0	0	0	0	111	D173	D173-V175 PolarHBondContact O-N 3.28Å; D173-V175 VanDerWaalsContact OD1-CB 3.23Å; D173-V175 WeakPolarHBondContact OD1-CB 3.45Å; D173-V175 WeakPolarHBondContact OD1-CG2 3.24Å; D173-V175 PolarHBondContact OD1-N 2.89Å
176	W	89.2	Confident	93.3	Very high	199 Å²	199	76.7 Å²	76.7	75%	0.754	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.4	-40.9	-176.2	-61.5	108.1	0	0	0	112.3	D173	D173-W176 PolarHBondContact O-N 3.2Å
177	Q	90.7	Very high	93.2	Very high	84 Å²	84	75.7 Å²	75.7	39%	0.393	38%	0.38	S	S	.	.	S	Bend	trans	-138.1	113.3	-177.3	-165.8	166	-7	0	0	110.2	Y127 A171 D173 P174 H184	Y127-Q177 PolarHBondContact OH-O 2.91Å; Y127-Q177 VanDerWaalsContact OH-O 3.11Å; A171-Q177 PolarHBondContact O-OE1 3.35Å; D173-Q177 PolarHBondContact O-N 3.28Å; P174-Q177 WeakPolarHBondContact CA-O 3.47Å; Q177-H184 VanDerWaalsContact CD-CE1 3.41Å; Q177-H184 PolarHBondContact NE2-CE1 2.78Å; Q177-H184 PolarHBondContact NE2-ND1 3.08Å; Q177-H184 VanDerWaalsContact NE2-ND1 3.16Å
178	K	91.9	Very high	93.2	Very high	170 Å²	170	75.7 Å²	75.7	74%	0.739	38%	0.38	S	S	*	.			trans	-81	149.7	-177.8	-67.1	-175.6	179	-178.4	0	111.1	H180 H184	K178-H180 PolarHBondContact O-N 3.41Å; K178-H184 PolarHBondContact O-CD2 3.2Å; K178-H184 VanDerWaalsContact O-CD2 3.29Å
179	F	94.1	Very high	93.3	Very high	56 Å²	56	69.1 Å²	69.1	25%	0.246	35%	0.349	C	S	.	.			trans	-54.6	130.7	170.6	-172.2	-79.1	0	0	0	111.1	Y127 Q129 E181 H184 N185	Y127-F179 AromaticContact CD1-CD2 3.74Å; Y127-F179 HydrophobicContact CD1-CD2 3.74Å; Y127-F179 HydrophobicContact CD1-CE2 4.19Å; Y127-F179 HydrophobicContact CE1-CB 4.13Å; Y127-F179 AromaticContact CE1-CD2 3.54Å; Y127-F179 HydrophobicContact CE1-CD2 3.54Å; Y127-F179 HydrophobicContact CE1-CE2 4.4Å; Y127-F179 HydrophobicContact CE1-CG 4.22Å; Y127-F179 PolarHBondContact OH-N 2.94Å; Q129-F179 HydrophobicContact CB-CB 4.49Å; Q129-F179 HydrophobicContact CG-CB 4.07Å; Q129-F179 HydrophobicContact CG-CD1 4.14Å; Q129-F179 HydrophobicContact CG-CG 4.02Å; F179-E181 HydrophobicContact CE1-CG 4.02Å; F179-H184 CarbonylContact C-O 3.55Å; F179-H184 WeakPolarHBondContact CA-O 3.39Å; F179-N185 HydrophobicContact CE1-CB 4.18Å; F179-N185 HydrophobicContact CE2-CB 3.91Å; F179-N185 HydrophobicContact CZ-CB 3.61Å
180	H	93.8	Very high	93.5	Very high	88 Å²	88	68.2 Å²	68.2	41%	0.407	34%	0.34	S	S	.	.	B	Isolated β-bridge	trans	-134.3	125.9	174.8	-173.4	-102	0	0	0	109.8	K178 E182 D183 H184 N185	K178-H180 PolarHBondContact O-N 3.41Å; H180-E182 PolarHBondContact O-N 3.1Å; H180-E182 VanDerWaalsContact O-N 3.11Å; H180-D183 WeakPolarHBondContact CB-OD1 3.45Å; H180-D183 IonicContact CE1-OD1 3.71Å; H180-D183 IonicContact CG-OD1 3.29Å; H180-D183 VanDerWaalsContact CG-OD1 3.29Å; H180-D183 IonicContact ND1-OD1 2.68Å; H180-D183 PolarHBondContact ND1-OD1 2.82Å; H180-H184 HydrophobicContact CB-CB 4.05Å; H180-H184 PolarHBondContact N-O 2.89Å; H180-H184 CarbonylContact O-C 3.05Å; H180-H184 PolarHBondContact O-N 2.87Å; H180-H184 VanDerWaalsContact O-O 3.1Å; H180-N185 WeakPolarHBondContact O-CB 3.36Å; H180-N185 PolarHBondContact O-N 3Å
181	E	89.7	Confident	93.8	Very high	154 Å²	154	64.3 Å²	64.3	72%	0.72	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60	-26.6	-169.2	-71	175.7	-169.4	0	0	113.8	F179 N185	F179-E181 HydrophobicContact CE1-CG 4.02Å; E181-N185 PolarHBondContact O-ND2 3.39Å
182	E	88.9	Confident	94	Very high	145 Å²	145	66.9 Å²	66.9	68%	0.678	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.8	-36.5	-174.5	-59.9	-168.8	151.1	0	0	114.1	H180 R208	H180-E182 PolarHBondContact O-N 3.1Å; H180-E182 VanDerWaalsContact O-N 3.11Å; E182-R208 PolarHBondContact O-NH1 3.13Å; E182-R208 PolarHBondContact O-NH2 3.23Å
183	D	92.4	Very high	94.1	Very high	101 Å²	101	66.7 Å²	66.7	54%	0.54	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	-133.6	-12.6	-167.8	65.7	-2.2	0	0	0	114.8	H180	H180-D183 WeakPolarHBondContact CB-OD1 3.45Å; H180-D183 IonicContact CE1-OD1 3.71Å; H180-D183 IonicContact CG-OD1 3.29Å; H180-D183 VanDerWaalsContact CG-OD1 3.29Å; H180-D183 IonicContact ND1-OD1 2.68Å; H180-D183 PolarHBondContact ND1-OD1 2.82Å
184	H	95.8	Very high	94.2	Very high	6 Å²	6	64.5 Å²	64.5	3%	0.028	31%	0.307	C	S	.	.	B	Isolated β-bridge	trans	-138.2	67	178.2	-163	70.5	0	0	0	111.7	Y127 A171 W172 Q177 K178 F179 H180 S188	Y127-H184 AromaticContact CE1-CD2 3.57Å; Y127-H184 AromaticContact CE1-NE2 3.64Å; Y127-H184 AromaticContact CZ-CD2 3.71Å; Y127-H184 AromaticContact CZ-NE2 3.45Å; Y127-H184 PolarHBondContact OH-CD2 2.94Å; Y127-H184 VanDerWaalsContact OH-CD2 3.27Å; Y127-H184 PolarHBondContact OH-NE2 2.86Å; Y127-H184 VanDerWaalsContact OH-NE2 3.15Å; A171-H184 PolarHBondContact O-CE1 2.89Å; A171-H184 PolarHBondContact O-NE2 3.05Å; A171-H184 VanDerWaalsContact O-NE2 3.13Å; W172-H184 AromaticContact CE3-CE1 3.4Å; W172-H184 AromaticContact CE3-NE2 3.7Å; W172-H184 AromaticContact CH2-CE1 3.96Å; W172-H184 AromaticContact CZ3-CE1 3.21Å; W172-H184 WeakPolarHBondContact CZ3-CE1 3.33Å; W172-H184 AromaticContact CZ3-ND1 3.72Å; W172-H184 AromaticContact CZ3-NE2 3.82Å; Q177-H184 VanDerWaalsContact CD-CE1 3.41Å; Q177-H184 PolarHBondContact NE2-CE1 2.78Å; Q177-H184 PolarHBondContact NE2-ND1 3.08Å; Q177-H184 VanDerWaalsContact NE2-ND1 3.16Å; K178-H184 PolarHBondContact O-CD2 3.2Å; K178-H184 VanDerWaalsContact O-CD2 3.29Å; F179-H184 CarbonylContact C-O 3.55Å; F179-H184 WeakPolarHBondContact CA-O 3.39Å; H180-H184 HydrophobicContact CB-CB 4.05Å; H180-H184 PolarHBondContact N-O 2.89Å; H180-H184 CarbonylContact O-C 3.05Å; H180-H184 PolarHBondContact O-N 2.87Å; H180-H184 VanDerWaalsContact O-O 3.1Å; H184-S188 WeakPolarHBondContact CA-OG 3.43Å
185	N	95.6	Very high	94.5	Very high	19 Å²	19	63.9 Å²	63.9	10%	0.102	30%	0.301	C	S	.	.	S	Bend	trans	-126.6	-177.7	-175	61.9	31.2	0	0	0	112.1	F179 H180 E181 F187 S188 F189	F179-N185 HydrophobicContact CE1-CB 4.18Å; F179-N185 HydrophobicContact CE2-CB 3.91Å; F179-N185 HydrophobicContact CZ-CB 3.61Å; H180-N185 WeakPolarHBondContact O-CB 3.36Å; H180-N185 PolarHBondContact O-N 3Å; E181-N185 PolarHBondContact O-ND2 3.39Å; N185-F187 PolarHBondContact O-N 3.11Å; N185-F187 WeakPolarHBondContact OD1-CA 3.31Å; N185-F187 WeakPolarHBondContact OD1-CB 3.48Å; N185-F187 PolarHBondContact OD1-N 3.07Å; N185-S188 PolarHBondContact N-OG 2.87Å; N185-S188 PolarHBondContact O-N 3.06Å; N185-S188 VanDerWaalsContact O-N 3.14Å; N185-S188 PolarHBondContact O-OG 2.92Å; N185-S188 PolarHBondContact OD1-N 3.45Å; N185-F189 PolarHBondContact O-N 3.47Å
186	C	96	Very high	94.6	Very high	12 Å²	12	60 Å²	60	8%	0.081	29%	0.285	C	S	.	.	H	α-helix	trans	-54.6	-36.7	177.4	60.9	0	0	0	0	113.7	H114 T115 Y127 F189 C190	H114-C186 WeakPolarHBondContact ND1-CB 3.49Å; H114-C186 PolarHBondContact ND1-SG 3.33Å; H114-C186 VanDerWaalsContact ND1-SG 3.35Å; T115-C186 PolarHBondContact OG1-O 3.4Å; T115-C186 PolarHBondContact OG1-SG 2.89Å; Y127-C186 VanDerWaalsContact O-CB 3.32Å; Y127-C186 WeakPolarHBondContact O-CB 3.34Å; C186-F189 WeakPolarHBondContact O-CB 3.3Å; C186-F189 PolarHBondContact O-N 2.91Å; C186-C190 PolarHBondContact O-N 3.43Å; C186-C190 VanDerWaalsContact O-N 3.14Å; C186-C190 PolarHBondContact O-SG 3.33Å
187	F	96.9	Very high	94.8	Very high	30 Å²	30	50.8 Å²	50.8	13%	0.132	25%	0.25	C	S	.	.	H	α-helix	trans	-70.9	-42.7	178.7	-176.5	-93.2	0	0	0	111.6	T115 N185 F189 C190 L191 R208 F211 I216	T115-F187 HydrophobicContact CG2-CD2 4.21Å; T115-F187 VanDerWaalsContact OG1-CA 3.23Å; T115-F187 WeakPolarHBondContact OG1-CA 3.24Å; T115-F187 PolarHBondContact OG1-N 3.4Å; T115-F187 VanDerWaalsContact OG1-N 3.14Å; N185-F187 PolarHBondContact O-N 3.11Å; N185-F187 WeakPolarHBondContact OD1-CA 3.31Å; N185-F187 WeakPolarHBondContact OD1-CB 3.48Å; N185-F187 PolarHBondContact OD1-N 3.07Å; F187-F189 VanDerWaalsContact C-N 3.3Å; F187-F189 PolarHBondContact O-N 3.45Å; F187-C190 PolarHBondContact O-N 2.72Å; F187-L191 HydrophobicContact CE1-CB 4.46Å; F187-L191 HydrophobicContact CE1-CD2 4.1Å; F187-L191 WeakPolarHBondContact O-CB 3.36Å; F187-L191 PolarHBondContact O-N 3.09Å; F187-R208 HydrophobicContact CD1-CG 4.34Å; F187-R208 HydrophobicContact CE1-CB 4.08Å; F187-R208 HydrophobicContact CE1-CG 3.66Å; F187-R208 HydrophobicContact CZ-CG 4.44Å; F187-F211 AromaticContact CE2-CD1 3.98Å; F187-F211 HydrophobicContact CE2-CD1 3.98Å; F187-F211 HydrophobicContact CE2-CE1 4.38Å; F187-F211 AromaticContact CZ-CD1 3.83Å; F187-F211 HydrophobicContact CZ-CD1 3.83Å; F187-I216 HydrophobicContact CE2-CG1 4.38Å
188	S	97	Very high	94.8	Very high	6 Å²	6	47.7 Å²	47.7	4%	0.042	24%	0.237	C	C	.	.	H	α-helix	trans	-63	-37.2	175.8	74.7	0	0	0	0	111.8	H184 N185 L191 Q192	H184-S188 WeakPolarHBondContact CA-OG 3.43Å; N185-S188 PolarHBondContact N-OG 2.87Å; N185-S188 PolarHBondContact O-N 3.06Å; N185-S188 VanDerWaalsContact O-N 3.14Å; N185-S188 PolarHBondContact O-OG 2.92Å; N185-S188 PolarHBondContact OD1-N 3.45Å; S188-L191 PolarHBondContact O-N 3.09Å; S188-Q192 VanDerWaalsContact O-CB 3.27Å; S188-Q192 WeakPolarHBondContact O-CB 3.46Å; S188-Q192 VanDerWaalsContact O-CG 3.24Å; S188-Q192 WeakPolarHBondContact O-CG 3.2Å; S188-Q192 PolarHBondContact O-N 2.92Å
189	F	98.2	Very high	94.9	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-56.5	-52.3	171.5	172	-92.9	0	0	0	111.2	I117 Y127 V132 F166 W172 N185 C186 F187 L191 Q192 F193	I117-F189 HydrophobicContact CD1-CE1 4.47Å; Y127-F189 HydrophobicContact CG-CB 4.41Å; V132-F189 HydrophobicContact CG1-CE2 4.06Å; V132-F189 HydrophobicContact CG1-CZ 3.88Å; V132-F189 HydrophobicContact CG2-CD2 4.28Å; V132-F189 HydrophobicContact CG2-CE2 3.72Å; V132-F189 HydrophobicContact CG2-CZ 4.39Å; F166-F189 HydrophobicContact CD1-CD2 4.43Å; F166-F189 AromaticContact CD1-CE2 3.79Å; F166-F189 HydrophobicContact CD1-CE2 3.79Å; F166-F189 HydrophobicContact CD1-CZ 4.06Å; F166-F189 AromaticContact CE1-CD2 3.66Å; F166-F189 HydrophobicContact CE1-CD2 3.66Å; F166-F189 AromaticContact CE1-CE2 3.46Å; F166-F189 HydrophobicContact CE1-CE2 3.46Å; F166-F189 VanDerWaalsContact CE1-CE2 3.46Å; F166-F189 HydrophobicContact CE1-CG 4.3Å; F166-F189 AromaticContact CE1-CZ 3.96Å; F166-F189 HydrophobicContact CE1-CZ 3.96Å; W172-F189 AromaticContact CD2-CD2 3.52Å; W172-F189 HydrophobicContact CD2-CD2 3.52Å; W172-F189 HydrophobicContact CD2-CE2 4.18Å; W172-F189 AromaticContact CE2-CD2 3.64Å; W172-F189 HydrophobicContact CE3-CB 4.13Å; W172-F189 AromaticContact CE3-CD2 3.73Å; W172-F189 HydrophobicContact CE3-CD2 3.73Å; W172-F189 HydrophobicContact CE3-CG 4.44Å; W172-F189 AromaticContact CG-CD2 3.97Å; W172-F189 HydrophobicContact CG-CD2 3.97Å; W172-F189 HydrophobicContact CG-CE2 4.16Å; W172-F189 HydrophobicContact CH2-CB 3.83Å; W172-F189 HydrophobicContact CH2-CD2 4.26Å; W172-F189 HydrophobicContact CZ2-CB 4.34Å; W172-F189 HydrophobicContact CZ2-CD2 4.05Å; W172-F189 HydrophobicContact CZ3-CB 3.68Å; W172-F189 HydrophobicContact CZ3-CD2 4.08Å; W172-F189 HydrophobicContact CZ3-CG 4.41Å; N185-F189 PolarHBondContact O-N 3.47Å; C186-F189 WeakPolarHBondContact O-CB 3.3Å; C186-F189 PolarHBondContact O-N 2.91Å; F187-F189 VanDerWaalsContact C-N 3.3Å; F187-F189 PolarHBondContact O-N 3.45Å; F189-L191 PolarHBondContact O-N 3.38Å; F189-Q192 PolarHBondContact O-N 2.86Å; F189-F193 PolarHBondContact O-N 2.88Å
190	C	97.9	Very high	94.6	Very high	1 Å²	1	44.7 Å²	44.7	1%	0.007	24%	0.238	C	C	.	.	H	α-helix	trans	-63.7	-43.1	-179.1	-60.8	0	0	0	0	112.4	L94 I117 C186 F187 L194	L94-C190 HydrophobicContact CD1-CB 3.65Å; L94-C190 HydrophobicContact CG-CB 4.46Å; I117-C190 HydrophobicContact CD1-CB 3.95Å; I117-C190 HydrophobicContact CG1-CB 4.07Å; C186-C190 PolarHBondContact O-N 3.43Å; C186-C190 VanDerWaalsContact O-N 3.14Å; C186-C190 PolarHBondContact O-SG 3.33Å; F187-C190 PolarHBondContact O-N 2.72Å; C190-L194 WeakPolarHBondContact O-CB 3.2Å; C190-L194 PolarHBondContact O-N 2.71Å
191	L	97.6	Very high	94.3	Very high	18 Å²	18	43.3 Å²	43.3	9%	0.094	23%	0.231	C	C	.	.	H	α-helix	trans	-68.4	-39.8	-178.9	-174.3	63.4	0	0	0	112.2	F187 S188 F189 L194 N195 L206 R208 F211	F187-L191 HydrophobicContact CE1-CB 4.46Å; F187-L191 HydrophobicContact CE1-CD2 4.1Å; F187-L191 WeakPolarHBondContact O-CB 3.36Å; F187-L191 PolarHBondContact O-N 3.09Å; S188-L191 PolarHBondContact O-N 3.09Å; F189-L191 PolarHBondContact O-N 3.38Å; L191-L194 PolarHBondContact O-N 3.49Å; L191-N195 WeakPolarHBondContact O-CB 3.5Å; L191-N195 PolarHBondContact O-N 3.02Å; L191-N195 PolarHBondContact O-ND2 3.27Å; L191-L206 HydrophobicContact CD1-CB 4.24Å; L191-R208 HydrophobicContact CD2-CB 4.04Å; L191-F211 HydrophobicContact CD1-CB 3.89Å; L191-F211 HydrophobicContact CD1-CD2 4.3Å; L191-F211 HydrophobicContact CD1-CG 4.04Å
192	Q	97.5	Very high	94.3	Very high	88 Å²	88	39.4 Å²	39.4	41%	0.411	23%	0.233	S	C	.	.	H	α-helix	trans	-67.4	-40.5	177.4	-75.8	-175.1	40.6	0	0	111.8	F166 W172 S188 F189 N195 G196	F166-Q192 HydrophobicContact CE2-CB 4.29Å; F166-Q192 HydrophobicContact CZ-CB 3.88Å; W172-Q192 HydrophobicContact CH2-CB 4.43Å; W172-Q192 HydrophobicContact CH2-CG 4.49Å; W172-Q192 HydrophobicContact CZ2-CB 4.03Å; W172-Q192 HydrophobicContact CZ2-CG 4.44Å; S188-Q192 VanDerWaalsContact O-CB 3.27Å; S188-Q192 WeakPolarHBondContact O-CB 3.46Å; S188-Q192 VanDerWaalsContact O-CG 3.24Å; S188-Q192 WeakPolarHBondContact O-CG 3.2Å; S188-Q192 PolarHBondContact O-N 2.92Å; F189-Q192 PolarHBondContact O-N 2.86Å; Q192-N195 PolarHBondContact O-N 3.08Å; Q192-G196 PolarHBondContact O-N 2.92Å
193	F	97.6	Very high	94.3	Very high	5 Å²	5	37.5 Å²	37.5	2%	0.022	22%	0.219	C	C	.	.	H	α-helix	trans	-57.8	-51	172.1	172.9	-102.1	0	0	0	111	I117 W159 L163 F166 F189 N195 G196 V197	I117-F193 HydrophobicContact CD1-CB 3.74Å; I117-F193 HydrophobicContact CD1-CD1 3.31Å; I117-F193 HydrophobicContact CD1-CE1 4.13Å; I117-F193 HydrophobicContact CD1-CG 3.74Å; I117-F193 HydrophobicContact CG1-CD1 4.44Å; I117-F193 HydrophobicContact CG2-CD1 4.45Å; I117-F193 HydrophobicContact CG2-CE1 4.2Å; W159-F193 HydrophobicContact CD2-CZ 4.35Å; W159-F193 HydrophobicContact CE3-CE1 4.39Å; W159-F193 HydrophobicContact CE3-CZ 4.32Å; W159-F193 AromaticContact CH2-CE1 3.51Å; W159-F193 HydrophobicContact CH2-CE1 3.51Å; W159-F193 HydrophobicContact CH2-CZ 4.22Å; W159-F193 AromaticContact CZ2-CE1 3.65Å; W159-F193 HydrophobicContact CZ2-CE1 3.65Å; W159-F193 HydrophobicContact CZ2-CZ 4.23Å; W159-F193 AromaticContact CZ3-CE1 3.9Å; W159-F193 HydrophobicContact CZ3-CE1 3.9Å; W159-F193 HydrophobicContact CZ3-CZ 4.25Å; L163-F193 HydrophobicContact CB-CE2 3.92Å; L163-F193 HydrophobicContact CB-CZ 3.99Å; L163-F193 HydrophobicContact CD1-CD1 4.28Å; L163-F193 HydrophobicContact CD1-CD2 3.84Å; L163-F193 HydrophobicContact CD1-CE1 4.17Å; L163-F193 HydrophobicContact CD1-CE2 3.78Å; L163-F193 HydrophobicContact CD1-CG 4.08Å; L163-F193 HydrophobicContact CD1-CZ 3.93Å; L163-F193 HydrophobicContact CG-CE2 4.47Å; L163-F193 HydrophobicContact CG-CZ 4.49Å; F166-F193 HydrophobicContact CB-CD2 3.96Å; F166-F193 HydrophobicContact CB-CE2 4.48Å; F166-F193 HydrophobicContact CD1-CB 3.86Å; F166-F193 AromaticContact CD1-CD2 3.86Å; F166-F193 HydrophobicContact CD1-CD2 3.86Å; F166-F193 HydrophobicContact CD1-CG 4.29Å; F166-F193 HydrophobicContact CD2-CD2 4.42Å; F166-F193 HydrophobicContact CE1-CB 3.57Å; F166-F193 HydrophobicContact CE1-CD2 4.45Å; F166-F193 HydrophobicContact CE1-CG 4.47Å; F166-F193 HydrophobicContact CE2-CB 4.33Å; F166-F193 HydrophobicContact CG-CB 4.35Å; F166-F193 AromaticContact CG-CD2 3.82Å; F166-F193 HydrophobicContact CG-CD2 3.82Å; F166-F193 HydrophobicContact CZ-CB 3.81Å; F166-F193 VanDerWaalsContact CZ-N 3.29Å; F189-F193 PolarHBondContact O-N 2.88Å; F193-N195 VanDerWaalsContact C-N 3.33Å; F193-N195 PolarHBondContact O-N 3.17Å; F193-G196 PolarHBondContact O-N 3.3Å; F193-G196 VanDerWaalsContact O-N 3.11Å; F193-V197 HydrophobicContact CD1-CG2 4.45Å; F193-V197 HydrophobicContact CE1-CG2 3.99Å; F193-V197 HydrophobicContact CE2-CG2 4.1Å; F193-V197 HydrophobicContact CZ-CG2 3.8Å; F193-V197 PolarHBondContact O-N 3.06Å
194	L	95.7	Very high	94.2	Very high	13 Å²	13	35.6 Å²	35.6	7%	0.068	22%	0.223	C	C	.	.	H	α-helix	trans	-59.5	-44.1	-179.9	-180	61.5	0	0	0	111.8	L147 C190 L191 G196 V197 L198 L206 F211	L147-L194 HydrophobicContact CD2-CD1 4.22Å; L147-L194 HydrophobicContact CD2-CD2 4.16Å; C190-L194 WeakPolarHBondContact O-CB 3.2Å; C190-L194 PolarHBondContact O-N 2.71Å; L191-L194 PolarHBondContact O-N 3.49Å; L194-G196 VanDerWaalsContact C-N 3.3Å; L194-G196 PolarHBondContact O-N 3.37Å; L194-V197 PolarHBondContact O-N 2.98Å; L194-L198 HydrophobicContact CD1-CG 4.43Å; L194-L198 HydrophobicContact CG-CD1 4.14Å; L194-L198 HydrophobicContact CG-CG 4.46Å; L194-L198 WeakPolarHBondContact O-CG 3.15Å; L194-L198 PolarHBondContact O-N 3.41Å; L194-L206 HydrophobicContact CD2-CD1 3.95Å; L194-F211 HydrophobicContact CD2-CD2 3.72Å; L194-F211 HydrophobicContact CD2-CE2 3.32Å; L194-F211 HydrophobicContact CD2-CZ 4.21Å
195	N	96.2	Very high	94.1	Very high	29 Å²	29	40.2 Å²	40.2	16%	0.155	25%	0.252	C	S	.	.	H	α-helix	trans	-65.7	-32.7	177.3	-77.6	-21.3	0	0	0	112.6	L191 Q192 F193 L198 A199 T205 L206	L191-N195 WeakPolarHBondContact O-CB 3.5Å; L191-N195 PolarHBondContact O-N 3.02Å; L191-N195 PolarHBondContact O-ND2 3.27Å; Q192-N195 PolarHBondContact O-N 3.08Å; F193-N195 VanDerWaalsContact C-N 3.33Å; F193-N195 PolarHBondContact O-N 3.17Å; N195-L198 PolarHBondContact O-N 2.92Å; N195-A199 WeakPolarHBondContact O-CB 3.41Å; N195-A199 PolarHBondContact O-N 2.52Å; N195-T205 HydrophobicContact CB-CG2 4.22Å; N195-L206 PolarHBondContact ND2-O 2.94Å; N195-L206 PolarHBondContact OD1-N 2.81Å
196	G	94.6	Very high	94.1	Very high	35 Å²	35	41.6 Å²	41.6	36%	0.361	26%	0.259	S	S	.	.	H	α-helix	trans	-62.5	-44.9	170.5	0	0	0	0	0	112	Q192 F193 L194 A199 M200	Q192-G196 PolarHBondContact O-N 2.92Å; F193-G196 PolarHBondContact O-N 3.3Å; F193-G196 VanDerWaalsContact O-N 3.11Å; L194-G196 VanDerWaalsContact C-N 3.3Å; L194-G196 PolarHBondContact O-N 3.37Å; G196-A199 PolarHBondContact O-N 2.95Å; G196-M200 WeakPolarHBondContact O-CG 3.33Å; G196-M200 PolarHBondContact O-N 2.85Å; G196-M200 VanDerWaalsContact O-N 3.14Å
197	V	92.4	Very high	94.1	Very high	6 Å²	6	43.4 Å²	43.4	4%	0.036	27%	0.272	C	S	.	.	H	α-helix	trans	-62.4	-46.7	175.1	174.9	0	0	0	0	111.4	L155 F193 L194 A199 M200 E201	L155-V197 HydrophobicContact CD1-CG1 3.51Å; L155-V197 HydrophobicContact CD2-CG1 4.43Å; F193-V197 HydrophobicContact CD1-CG2 4.45Å; F193-V197 HydrophobicContact CE1-CG2 3.99Å; F193-V197 HydrophobicContact CE2-CG2 4.1Å; F193-V197 HydrophobicContact CZ-CG2 3.8Å; F193-V197 PolarHBondContact O-N 3.06Å; L194-V197 PolarHBondContact O-N 2.98Å; V197-A199 VanDerWaalsContact C-N 3.32Å; V197-A199 PolarHBondContact O-N 2.68Å; V197-M200 HydrophobicContact CG2-CE 4.26Å; V197-M200 PolarHBondContact O-N 3.06Å; V197-E201 WeakPolarHBondContact O-CG 3.45Å; V197-E201 PolarHBondContact O-N 3.34Å; V197-E201 VanDerWaalsContact O-N 3.11Å
198	L	91.9	Very high	94	Very high	19 Å²	19	46.6 Å²	46.6	10%	0.099	28%	0.283	C	S	.	.	H	α-helix	trans	-60.8	-40.5	177.9	-70.5	172.5	0	0	0	112.2	L194 N195 M200 E201 G202 R203 L206	L194-L198 HydrophobicContact CD1-CG 4.43Å; L194-L198 HydrophobicContact CG-CD1 4.14Å; L194-L198 HydrophobicContact CG-CG 4.46Å; L194-L198 WeakPolarHBondContact O-CG 3.15Å; L194-L198 PolarHBondContact O-N 3.41Å; N195-L198 PolarHBondContact O-N 2.92Å; L198-M200 PolarHBondContact O-N 2.99Å; L198-E201 CarbonylContact O-C 3.56Å; L198-E201 PolarHBondContact O-N 3.47Å; L198-G202 PolarHBondContact O-N 2.83Å; L198-R203 HydrophobicContact CB-CB 4.2Å; L198-R203 HydrophobicContact CD2-CB 4.11Å; L198-R203 WeakPolarHBondContact O-CB 3.31Å; L198-R203 PolarHBondContact O-N 3.48Å; L198-L206 HydrophobicContact CD1-CD1 3.76Å; L198-L206 HydrophobicContact CD1-CG 3.78Å
199	A	92.8	Very high	94	Very high	62 Å²	62	51.7 Å²	51.7	51%	0.512	31%	0.31	S	S	.	.	H	α-helix	trans	-63.7	-40	177.4	0	0	0	0	0	112.2	N195 G196 V197 E201 G202	N195-A199 WeakPolarHBondContact O-CB 3.41Å; N195-A199 PolarHBondContact O-N 2.52Å; G196-A199 PolarHBondContact O-N 2.95Å; V197-A199 VanDerWaalsContact C-N 3.32Å; V197-A199 PolarHBondContact O-N 2.68Å; A199-E201 VanDerWaalsContact C-N 3.27Å; A199-E201 PolarHBondContact O-N 3.09Å; A199-G202 PolarHBondContact O-N 3.35Å; A199-G202 VanDerWaalsContact O-N 3.08Å
200	M	88.1	Confident	93.9	Very high	101 Å²	101	54.4 Å²	54.4	50%	0.498	32%	0.324	S	S	.	.	H	α-helix	trans	-64	-34.1	174.4	-69.6	-173.1	-65.8	0	0	112.3	Y162 G196 V197 L198 G202	Y162-M200 HydrophobicContact CD2-CE 3.53Å; Y162-M200 HydrophobicContact CE1-CE 4.5Å; Y162-M200 HydrophobicContact CE1-SD 4.38Å; Y162-M200 HydrophobicContact CE2-CE 3.45Å; Y162-M200 VanDerWaalsContact CE2-CE 3.45Å; Y162-M200 HydrophobicContact CE2-SD 4.01Å; Y162-M200 HydrophobicContact CG-CE 4.11Å; G196-M200 WeakPolarHBondContact O-CG 3.33Å; G196-M200 PolarHBondContact O-N 2.85Å; G196-M200 VanDerWaalsContact O-N 3.14Å; V197-M200 HydrophobicContact CG2-CE 4.26Å; V197-M200 PolarHBondContact O-N 3.06Å; L198-M200 PolarHBondContact O-N 2.99Å; M200-G202 PolarHBondContact O-N 3.38Å
201	E	88.4	Confident	93.8	Very high	59 Å²	59	54.5 Å²	54.5	28%	0.276	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79	4.2	174.9	-66.8	-65.6	121.6	0	0	113.4	H154 L155 V197 L198 A199 R203	H154-E201 IonicContact CD2-OE1 3.72Å; H154-E201 IonicContact CE1-OE1 2.69Å; H154-E201 IonicContact CE1-OE2 3.77Å; H154-E201 PolarHBondContact CE1-OE2 2.84Å; H154-E201 IonicContact NE2-OE1 3.29Å; H154-E201 PolarHBondContact NE2-OE1 3.15Å; H154-E201 IonicContact NE2-OE2 3.76Å; H154-E201 PolarHBondContact NE2-OE2 2.75Å; L155-E201 HydrophobicContact CD1-CG 4.15Å; L155-E201 HydrophobicContact CD2-CG 4.33Å; L155-E201 WeakPolarHBondContact CD2-OE1 3.44Å; V197-E201 WeakPolarHBondContact O-CG 3.45Å; V197-E201 PolarHBondContact O-N 3.34Å; V197-E201 VanDerWaalsContact O-N 3.11Å; L198-E201 CarbonylContact O-C 3.56Å; L198-E201 PolarHBondContact O-N 3.47Å; A199-E201 VanDerWaalsContact C-N 3.27Å; A199-E201 PolarHBondContact O-N 3.09Å; E201-R203 VanDerWaalsContact C-N 3.26Å; E201-R203 HydrophobicContact CB-CG 4.15Å; E201-R203 PolarHBondContact O-N 2.63Å
202	G	89.1	Confident	93.6	Very high	72 Å²	72	55.5 Å²	55.5	74%	0.742	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	68.1	22.9	-178.7	0	0	0	0	0	114	L198 A199 M200	L198-G202 PolarHBondContact O-N 2.83Å; A199-G202 PolarHBondContact O-N 3.35Å; A199-G202 VanDerWaalsContact O-N 3.08Å; M200-G202 PolarHBondContact O-N 3.38Å
203	R	89.2	Confident	93.6	Very high	105 Å²	105	57.8 Å²	57.8	40%	0.396	34%	0.337	S	S	.	.	P	Polyproline II helix	trans	-99.9	159.1	-179.5	-59.9	-174.5	-176.2	-135.8	3.7	111.6	D151 L198 E201	D151-R203 IonicContact OD2-CZ 2.67Å; D151-R203 IonicContact OD2-NH1 3.73Å; D151-R203 PolarHBondContact OD2-NH1 2.87Å; D151-R203 IonicContact OD2-NH2 3.46Å; D151-R203 PolarHBondContact OD2-NH2 2.99Å; L198-R203 HydrophobicContact CB-CB 4.2Å; L198-R203 HydrophobicContact CD2-CB 4.11Å; L198-R203 WeakPolarHBondContact O-CB 3.31Å; L198-R203 PolarHBondContact O-N 3.48Å; E201-R203 VanDerWaalsContact C-N 3.26Å; E201-R203 HydrophobicContact CB-CG 4.15Å; E201-R203 PolarHBondContact O-N 2.63Å
204	G	89.3	Confident	93.5	Very high	61 Å²	61	60.9 Å²	60.9	63%	0.629	36%	0.358	S	S	*	.	P	Polyproline II helix	trans	-63.3	154.9	172.9	0	0	0	0	0	112.7
205	T	93.9	Very high	93.4	Very high	103 Å²	103	63.9 Å²	63.9	63%	0.632	37%	0.371	S	S	*	.	P	Polyproline II helix	trans	-79.5	150.5	174.7	55.4	0	0	0	0	111.1	N195	N195-T205 HydrophobicContact CB-CG2 4.22Å
206	L	94.9	Very high	93.3	Very high	48 Å²	48	63.2 Å²	63.2	25%	0.251	37%	0.367	S	S	.	.	P	Polyproline II helix	trans	-97.3	129.7	173.9	-64.4	173.5	0	0	0	109.8	L191 L194 N195 L198 F211 F215	L191-L206 HydrophobicContact CD1-CB 4.24Å; L194-L206 HydrophobicContact CD2-CD1 3.95Å; N195-L206 PolarHBondContact ND2-O 2.94Å; N195-L206 PolarHBondContact OD1-N 2.81Å; L198-L206 HydrophobicContact CD1-CD1 3.76Å; L198-L206 HydrophobicContact CD1-CG 3.78Å; L206-F211 HydrophobicContact CD1-CD2 3.88Å; L206-F215 HydrophobicContact CD1-CE2 4.32Å
207	S	96.4	Very high	93.3	Very high	50 Å²	50	64.9 Å²	64.9	35%	0.35	37%	0.367	S	S	.	.	P	Polyproline II helix	trans	-73.3	161.8	169.1	76.7	0	0	0	0	110.7	D209 D210 F211	S207-D209 PolarHBondContact O-N 3.14Å; S207-D209 PolarHBondContact OG-N 3.05Å; S207-D210 PolarHBondContact O-N 3.48Å; S207-D210 WeakPolarHBondContact OG-CB 3.42Å; S207-D210 PolarHBondContact OG-N 2.98Å; S207-D210 PolarHBondContact OG-OD2 2.82Å; S207-F211 WeakPolarHBondContact O-CB 3.24Å; S207-F211 PolarHBondContact O-N 3.21Å
208	R	95.8	Very high	93.4	Very high	98 Å²	98	67.7 Å²	67.7	37%	0.37	39%	0.385	S	S	.	.	H	α-helix	trans	-55.3	-43.9	172.2	166.5	176.8	-64.3	155.5	-7.2	111.2	E182 F187 L191 T212	E182-R208 PolarHBondContact O-NH1 3.13Å; E182-R208 PolarHBondContact O-NH2 3.23Å; F187-R208 HydrophobicContact CD1-CG 4.34Å; F187-R208 HydrophobicContact CE1-CB 4.08Å; F187-R208 HydrophobicContact CE1-CG 3.66Å; F187-R208 HydrophobicContact CZ-CG 4.44Å; L191-R208 HydrophobicContact CD2-CB 4.04Å; R208-T212 VanDerWaalsContact O-CB 3.22Å; R208-T212 WeakPolarHBondContact O-CB 3.27Å; R208-T212 PolarHBondContact O-N 3.22Å; R208-T212 PolarHBondContact O-OG1 3.46Å
209	D	96.3	Very high	93.5	Very high	112 Å²	112	70.3 Å²	70.3	60%	0.599	39%	0.394	S	S	*	.	H	α-helix	trans	-70.5	-42.2	-176	-68.8	-8	0	0	0	111.5	S207 T212 R213	S207-D209 PolarHBondContact O-N 3.14Å; S207-D209 PolarHBondContact OG-N 3.05Å; D209-T212 PolarHBondContact O-N 3.14Å; D209-R213 WeakPolarHBondContact O-CB 3.31Å; D209-R213 PolarHBondContact O-N 3.45Å
210	D	96.1	Very high	93.5	Very high	57 Å²	57	69 Å²	69	31%	0.305	38%	0.378	S	S	.	.	H	α-helix	trans	-65.7	-45.7	177.1	-62.8	-38.8	0	0	0	110.9	S207 T212 R213 C214	S207-D210 PolarHBondContact O-N 3.48Å; S207-D210 WeakPolarHBondContact OG-CB 3.42Å; S207-D210 PolarHBondContact OG-N 2.98Å; S207-D210 PolarHBondContact OG-OD2 2.82Å; D210-T212 VanDerWaalsContact C-N 3.34Å; D210-T212 PolarHBondContact O-N 2.98Å; D210-R213 PolarHBondContact O-N 3.14Å; D210-R213 IonicContact OD1-CZ 2.6Å; D210-R213 VanDerWaalsContact OD1-CZ 3.29Å; D210-R213 IonicContact OD1-NH1 2.7Å; D210-R213 PolarHBondContact OD1-NH1 2.75Å; D210-R213 IonicContact OD1-NH2 3.52Å; D210-R213 PolarHBondContact OD1-NH2 2.82Å; D210-C214 VanDerWaalsContact O-CB 3.23Å; D210-C214 WeakPolarHBondContact O-CB 3.43Å; D210-C214 PolarHBondContact O-N 2.91Å; D210-C214 PolarHBondContact O-SG 3.32Å
211	F	95.4	Very high	93.8	Very high	3 Å²	3	72.2 Å²	72.2	1%	0.013	38%	0.384	C	S	.	.	H	α-helix	trans	-61.7	-45.9	178.5	-169.3	-92.1	0	0	0	111.4	L94 V145 L147 F187 L191 L194 L206 S207 F215 I216	L94-F211 HydrophobicContact CD1-CE1 3.62Å; L94-F211 HydrophobicContact CD1-CZ 3.72Å; L94-F211 HydrophobicContact CD2-CE1 4.43Å; V145-F211 HydrophobicContact CG1-CZ 4.38Å; L147-F211 HydrophobicContact CD2-CE2 4.45Å; L147-F211 HydrophobicContact CD2-CZ 4.34Å; F187-F211 AromaticContact CE2-CD1 3.98Å; F187-F211 HydrophobicContact CE2-CD1 3.98Å; F187-F211 HydrophobicContact CE2-CE1 4.38Å; F187-F211 AromaticContact CZ-CD1 3.83Å; F187-F211 HydrophobicContact CZ-CD1 3.83Å; L191-F211 HydrophobicContact CD1-CB 3.89Å; L191-F211 HydrophobicContact CD1-CD2 4.3Å; L191-F211 HydrophobicContact CD1-CG 4.04Å; L194-F211 HydrophobicContact CD2-CD2 3.72Å; L194-F211 HydrophobicContact CD2-CE2 3.32Å; L194-F211 HydrophobicContact CD2-CZ 4.21Å; L206-F211 HydrophobicContact CD1-CD2 3.88Å; S207-F211 WeakPolarHBondContact O-CB 3.24Å; S207-F211 PolarHBondContact O-N 3.21Å; F211-F215 AromaticContact CD2-CD2 3.7Å; F211-F215 HydrophobicContact CD2-CD2 3.7Å; F211-F215 HydrophobicContact CD2-CE2 4.22Å; F211-F215 HydrophobicContact CD2-CG 4.36Å; F211-F215 HydrophobicContact CE1-CB 4.35Å; F211-F215 HydrophobicContact CE2-CB 4.27Å; F211-F215 AromaticContact CE2-CD2 3.88Å; F211-F215 HydrophobicContact CE2-CD2 3.88Å; F211-F215 HydrophobicContact CE2-CE2 4.48Å; F211-F215 HydrophobicContact CE2-CG 4.11Å; F211-F215 HydrophobicContact CG-CD2 4.22Å; F211-F215 HydrophobicContact CZ-CB 4.14Å; F211-F215 HydrophobicContact CZ-CG 4.46Å; F211-F215 WeakPolarHBondContact O-CB 3.41Å; F211-F215 WeakPolarHBondContact O-CD2 3.43Å; F211-F215 PolarHBondContact O-N 2.93Å; F211-I216 HydrophobicContact CD1-CD1 4.33Å; F211-I216 HydrophobicContact CD1-CG1 4.01Å; F211-I216 HydrophobicContact CE1-CD1 3.7Å; F211-I216 HydrophobicContact CE1-CG1 3.9Å; F211-I216 PolarHBondContact O-N 2.72Å
212	T	95.3	Very high	94	Very high	39 Å²	39	75.1 Å²	75.1	24%	0.239	39%	0.393	C	S	.	.	I	π-helix	trans	-62.6	-48.6	179.1	-59.7	0	0	0	0	111.2	R208 D209 D210 I216 L217	R208-T212 VanDerWaalsContact O-CB 3.22Å; R208-T212 WeakPolarHBondContact O-CB 3.27Å; R208-T212 PolarHBondContact O-N 3.22Å; R208-T212 PolarHBondContact O-OG1 3.46Å; D209-T212 PolarHBondContact O-N 3.14Å; D210-T212 VanDerWaalsContact C-N 3.34Å; D210-T212 PolarHBondContact O-N 2.98Å; T212-I216 HydrophobicContact CG2-CB 4.39Å; T212-I216 PolarHBondContact O-N 3.5Å; T212-I216 VanDerWaalsContact O-N 3.15Å; T212-L217 HydrophobicContact CG2-CD2 4.45Å; T212-L217 HydrophobicContact CG2-CG 4.07Å; T212-L217 PolarHBondContact O-N 3.46Å
213	R	96.7	Very high	94.1	Very high	137 Å²	137	71.8 Å²	71.8	52%	0.517	36%	0.358	S	S	.	.	I	π-helix	trans	-64.7	-44.3	-177.8	-174.3	177.4	69.2	-110.8	-0.5	112.4	D209 D210 P218	D209-R213 WeakPolarHBondContact O-CB 3.31Å; D209-R213 PolarHBondContact O-N 3.45Å; D210-R213 PolarHBondContact O-N 3.14Å; D210-R213 IonicContact OD1-CZ 2.6Å; D210-R213 VanDerWaalsContact OD1-CZ 3.29Å; D210-R213 IonicContact OD1-NH1 2.7Å; D210-R213 PolarHBondContact OD1-NH1 2.75Å; D210-R213 IonicContact OD1-NH2 3.52Å; D210-R213 PolarHBondContact OD1-NH2 2.82Å; R213-P218 WeakPolarHBondContact O-CD 3.46Å
214	C	94.8	Very high	94.2	Very high	69 Å²	69	70 Å²	70	47%	0.466	36%	0.362	S	S	.	.	I	π-helix	trans	-84.5	-32.5	-173.1	-66.7	0	0	0	0	113.3	D210	D210-C214 VanDerWaalsContact O-CB 3.23Å; D210-C214 WeakPolarHBondContact O-CB 3.43Å; D210-C214 PolarHBondContact O-N 2.91Å; D210-C214 PolarHBondContact O-SG 3.32Å
215	F	94.3	Very high	94.4	Very high	77 Å²	77	74.8 Å²	74.8	34%	0.338	37%	0.365	S	S	.	.	I	π-helix	trans	-117.1	-39.5	-170.1	-58.4	-84	0	0	0	114.2	V145 L206 F211 R219	V145-F215 HydrophobicContact CG1-CB 4Å; V145-F215 HydrophobicContact CG1-CD1 4.3Å; V145-F215 HydrophobicContact CG1-CG 4.49Å; L206-F215 HydrophobicContact CD1-CE2 4.32Å; F211-F215 AromaticContact CD2-CD2 3.7Å; F211-F215 HydrophobicContact CD2-CD2 3.7Å; F211-F215 HydrophobicContact CD2-CE2 4.22Å; F211-F215 HydrophobicContact CD2-CG 4.36Å; F211-F215 HydrophobicContact CE1-CB 4.35Å; F211-F215 HydrophobicContact CE2-CB 4.27Å; F211-F215 AromaticContact CE2-CD2 3.88Å; F211-F215 HydrophobicContact CE2-CD2 3.88Å; F211-F215 HydrophobicContact CE2-CE2 4.48Å; F211-F215 HydrophobicContact CE2-CG 4.11Å; F211-F215 HydrophobicContact CG-CD2 4.22Å; F211-F215 HydrophobicContact CZ-CB 4.14Å; F211-F215 HydrophobicContact CZ-CG 4.46Å; F211-F215 WeakPolarHBondContact O-CB 3.41Å; F211-F215 WeakPolarHBondContact O-CD2 3.43Å; F211-F215 PolarHBondContact O-N 2.93Å; F215-R219 WeakPolarHBondContact O-CD 3.37Å; F215-R219 PolarHBondContact O-NH1 3.13Å
216	I	94.3	Very high	94.3	Very high	14 Å²	14	70.9 Å²	70.9	7%	0.072	34%	0.339	C	S	.	.	I	π-helix	trans	-84.1	-57.1	-175.8	-56.3	-52.9	0	0	0	111.3	L94 V96 V145 F187 F211 T212 P218 R219 M220	L94-I216 HydrophobicContact CD2-CD1 3.82Å; V96-I216 HydrophobicContact CG2-CD1 3.88Å; V145-I216 HydrophobicContact CG2-CD1 3.99Å; F187-I216 HydrophobicContact CE2-CG1 4.38Å; F211-I216 HydrophobicContact CD1-CD1 4.33Å; F211-I216 HydrophobicContact CD1-CG1 4.01Å; F211-I216 HydrophobicContact CE1-CD1 3.7Å; F211-I216 HydrophobicContact CE1-CG1 3.9Å; F211-I216 PolarHBondContact O-N 2.72Å; T212-I216 HydrophobicContact CG2-CB 4.39Å; T212-I216 PolarHBondContact O-N 3.5Å; T212-I216 VanDerWaalsContact O-N 3.15Å; I216-P218 VanDerWaalsContact C-CD 3.49Å; I216-R219 PolarHBondContact O-N 3Å; I216-M220 HydrophobicContact CG2-CG 3.76Å; I216-M220 WeakPolarHBondContact O-CG 3.48Å; I216-M220 PolarHBondContact O-N 3.39Å
217	L	93.9	Very high	94.1	Very high	71 Å²	71	71 Å²	71	37%	0.372	34%	0.342	S	S	.	.	H	α-helix	trans	-55.6	-41.9	-174	-71.4	-177.1	0	0	0	114.1	T212 R219 M220 R221	T212-L217 HydrophobicContact CG2-CD2 4.45Å; T212-L217 HydrophobicContact CG2-CG 4.07Å; T212-L217 PolarHBondContact O-N 3.46Å; L217-R219 VanDerWaalsContact C-N 3.28Å; L217-R219 PolarHBondContact O-N 3.2Å; L217-M220 PolarHBondContact O-N 3.5Å; L217-R221 WeakPolarHBondContact O-CB 3.23Å; L217-R221 VanDerWaalsContact O-CG 3.28Å; L217-R221 WeakPolarHBondContact O-CG 3.37Å; L217-R221 PolarHBondContact O-N 3.34Å
218	P	95	Very high	93.8	Very high	64 Å²	64	73 Å²	73	42%	0.416	35%	0.352	S	S	.	.	H	α-helix	trans	-60.5	-37.8	178	-25.7	36.7	0	0	0	112.9	R213 I216 R222	R213-P218 WeakPolarHBondContact O-CD 3.46Å; I216-P218 VanDerWaalsContact C-CD 3.49Å; P218-R222 PolarHBondContact O-N 3.03Å
219	R	94.4	Very high	93.7	Very high	74 Å²	74	69.3 Å²	69.3	28%	0.279	34%	0.339	S	S	.	.	H	α-helix	trans	-74.9	-41.4	178.1	-67.4	171.9	172.2	70.6	4.6	111.6	V143 S144 V145 F215 I216 L217 R221 R222 V223	V143-R219 HydrophobicContact CG1-CB 3.6Å; V143-R219 HydrophobicContact CG1-CG 4.21Å; S144-R219 WeakPolarHBondContact O-CD 3.33Å; S144-R219 PolarHBondContact O-NE 3.2Å; V145-R219 VanDerWaalsContact CG2-CD 3.46Å; F215-R219 WeakPolarHBondContact O-CD 3.37Å; F215-R219 PolarHBondContact O-NH1 3.13Å; I216-R219 PolarHBondContact O-N 3Å; L217-R219 VanDerWaalsContact C-N 3.28Å; L217-R219 PolarHBondContact O-N 3.2Å; R219-R221 VanDerWaalsContact C-N 3.31Å; R219-R221 PolarHBondContact O-N 3.46Å; R219-R222 WeakPolarHBondContact O-CA 3.46Å; R219-R222 WeakPolarHBondContact O-CB 3.25Å; R219-R222 PolarHBondContact O-N 2.98Å; R219-V223 PolarHBondContact O-N 3.44Å
220	M	92.6	Very high	93.5	Very high	35 Å²	35	66 Å²	66	17%	0.172	32%	0.321	C	S	.	.	H	α-helix	trans	-63.4	-36.3	175.8	-65.2	-43.6	-59.2	0	0	112.5	V96 F107 L113 V143 I216 L217 R222 V223 S224	V96-M220 HydrophobicContact CG1-SD 4.44Å; F107-M220 HydrophobicContact CD1-CE 3.46Å; F107-M220 VanDerWaalsContact CD1-CE 3.46Å; F107-M220 HydrophobicContact CE1-CE 3.9Å; F107-M220 HydrophobicContact CE1-SD 4.4Å; F107-M220 HydrophobicContact CG-CE 4.38Å; L113-M220 HydrophobicContact CD1-CE 4.46Å; L113-M220 HydrophobicContact CD2-CE 4.36Å; V143-M220 HydrophobicContact CG2-SD 4.31Å; I216-M220 HydrophobicContact CG2-CG 3.76Å; I216-M220 WeakPolarHBondContact O-CG 3.48Å; I216-M220 PolarHBondContact O-N 3.39Å; L217-M220 PolarHBondContact O-N 3.5Å; M220-R222 VanDerWaalsContact C-N 3.33Å; M220-R222 PolarHBondContact O-N 2.94Å; M220-V223 HydrophobicContact CE-CG1 4.48Å; M220-V223 PolarHBondContact O-N 2.99Å; M220-S224 WeakPolarHBondContact O-CB 3.48Å; M220-S224 PolarHBondContact O-N 3.47Å
221	R	93	Very high	93.2	Very high	169 Å²	169	71.2 Å²	71.2	64%	0.638	34%	0.337	S	S	*	.	H	α-helix	trans	-61.9	-41.1	170.6	-73.5	173.5	-173.3	174.5	3	111.8	L217 R219 S224 K225	L217-R221 WeakPolarHBondContact O-CB 3.23Å; L217-R221 VanDerWaalsContact O-CG 3.28Å; L217-R221 WeakPolarHBondContact O-CG 3.37Å; L217-R221 PolarHBondContact O-N 3.34Å; R219-R221 VanDerWaalsContact C-N 3.31Å; R219-R221 PolarHBondContact O-N 3.46Å; R221-S224 PolarHBondContact O-N 3.16Å; R221-K225 WeakPolarHBondContact O-CG 3.32Å; R221-K225 PolarHBondContact O-N 2.77Å
222	R	93.4	Very high	93.2	Very high	119 Å²	119	73.8 Å²	73.8	45%	0.449	35%	0.349	S	S	.	.	H	α-helix	trans	-63.5	-45.2	176.2	-176.3	-177.4	172.4	161.5	-6	111.1	P81 P83 P218 R219 M220 K225 Y226	P81-R222 PolarHBondContact O-NH2 3.06Å; P83-R222 HydrophobicContact CB-CG 4.08Å; P218-R222 PolarHBondContact O-N 3.03Å; R219-R222 WeakPolarHBondContact O-CA 3.46Å; R219-R222 WeakPolarHBondContact O-CB 3.25Å; R219-R222 PolarHBondContact O-N 2.98Å; M220-R222 VanDerWaalsContact C-N 3.33Å; M220-R222 PolarHBondContact O-N 2.94Å; R222-K225 PolarHBondContact O-N 3.42Å; R222-Y226 VanDerWaalsContact O-CB 3.28Å; R222-Y226 WeakPolarHBondContact O-CB 3.49Å; R222-Y226 PolarHBondContact O-N 3.21Å
223	V	92.3	Very high	93.1	Very high	2 Å²	2	72.3 Å²	72.3	1%	0.012	34%	0.339	C	S	.	.	H	α-helix	trans	-54.9	-53.9	173.9	167.9	0	0	0	0	110.7	P83 F84 F107 V143 R219 M220 K225 Y226 T227	P83-V223 HydrophobicContact CB-CG2 3.89Å; P83-V223 HydrophobicContact CG-CG2 4.04Å; F84-V223 HydrophobicContact CD1-CG2 4.46Å; F84-V223 HydrophobicContact CE1-CB 4.36Å; F84-V223 HydrophobicContact CE1-CG1 3.68Å; F84-V223 HydrophobicContact CE1-CG2 3.81Å; F84-V223 HydrophobicContact CZ-CG1 3.72Å; F84-V223 HydrophobicContact CZ-CG2 4.36Å; F107-V223 HydrophobicContact CB-CG1 3.47Å; F107-V223 VanDerWaalsContact CB-CG1 3.47Å; F107-V223 HydrophobicContact CD1-CG1 4.44Å; F107-V223 HydrophobicContact CD2-CG1 4.33Å; F107-V223 HydrophobicContact CG-CG1 3.87Å; V143-V223 HydrophobicContact CG2-CG2 3.45Å; V143-V223 VanDerWaalsContact CG2-CG2 3.45Å; R219-V223 PolarHBondContact O-N 3.44Å; M220-V223 HydrophobicContact CE-CG1 4.48Å; M220-V223 PolarHBondContact O-N 2.99Å; V223-K225 VanDerWaalsContact C-N 3.35Å; V223-K225 PolarHBondContact O-N 3.25Å; V223-Y226 PolarHBondContact O-N 2.68Å; V223-Y226 VanDerWaalsContact O-N 3.11Å; V223-T227 PolarHBondContact O-N 3.15Å; V223-T227 PolarHBondContact O-OG1 3Å; V223-T227 VanDerWaalsContact O-OG1 3.13Å
224	S	91.2	Very high	92.9	Very high	69 Å²	69	71.7 Å²	71.7	48%	0.483	34%	0.342	S	S	.	.	H	α-helix	trans	-56.6	-46.1	-179.6	174.4	0	0	0	0	112.6	M220 R221 T228	M220-S224 WeakPolarHBondContact O-CB 3.48Å; M220-S224 PolarHBondContact O-N 3.47Å; R221-S224 PolarHBondContact O-N 3.16Å; S224-T228 WeakPolarHBondContact O-CB 3.37Å; S224-T228 PolarHBondContact O-N 2.88Å; S224-T228 PolarHBondContact O-OG1 3.4Å
225	K	91.9	Very high	92.8	Very high	160 Å²	160	74.6 Å²	74.6	70%	0.696	35%	0.349	S	S	*	.	H	α-helix	trans	-61.7	-44.7	176	-72.2	-178.5	-178.4	-171.4	0	112	R221 R222 V223 T228 L229	R221-K225 WeakPolarHBondContact O-CG 3.32Å; R221-K225 PolarHBondContact O-N 2.77Å; R222-K225 PolarHBondContact O-N 3.42Å; V223-K225 VanDerWaalsContact C-N 3.35Å; V223-K225 PolarHBondContact O-N 3.25Å; K225-T228 PolarHBondContact O-N 2.81Å; K225-L229 WeakPolarHBondContact O-CB 3.21Å; K225-L229 PolarHBondContact O-N 3.05Å
226	Y	92.7	Very high	92.8	Very high	22 Å²	22	75.3 Å²	75.3	9%	0.086	35%	0.353	C	S	.	.	H	α-helix	trans	-66.9	-46.3	-177.9	-172.8	-95.8	0	0	0	112.1	V42 L80 P83 F84 R222 V223 T228 L229 I230	V42-Y226 HydrophobicContact CB-CE2 4.5Å; V42-Y226 HydrophobicContact CG2-CE2 4.26Å; L80-Y226 HydrophobicContact CD2-CD2 3.92Å; L80-Y226 HydrophobicContact CD2-CE2 3.99Å; L80-Y226 HydrophobicContact CG-CE2 4.31Å; P83-Y226 VanDerWaalsContact CD-CG 3.41Å; P83-Y226 HydrophobicContact CG-CD1 3.75Å; P83-Y226 HydrophobicContact CG-CE1 4.43Å; P83-Y226 HydrophobicContact CG-CG 3.79Å; F84-Y226 HydrophobicContact CE2-CD1 4.16Å; F84-Y226 HydrophobicContact CE2-CE1 4.43Å; R222-Y226 VanDerWaalsContact O-CB 3.28Å; R222-Y226 WeakPolarHBondContact O-CB 3.49Å; R222-Y226 PolarHBondContact O-N 3.21Å; V223-Y226 PolarHBondContact O-N 2.68Å; V223-Y226 VanDerWaalsContact O-N 3.11Å; Y226-T228 VanDerWaalsContact C-N 3.33Å; Y226-T228 PolarHBondContact O-N 2.71Å; Y226-L229 WeakPolarHBondContact O-CB 3.42Å; Y226-L229 PolarHBondContact O-N 3.11Å; Y226-I230 HydrophobicContact CD1-CD1 3.75Å; Y226-I230 HydrophobicContact CD1-CG1 4.39Å; Y226-I230 HydrophobicContact CE1-CD1 3.16Å; Y226-I230 HydrophobicContact CE1-CG1 4.09Å; Y226-I230 PolarHBondContact O-N 2.9Å
227	T	89.8	Confident	92.6	Very high	50 Å²	50	82.7 Å²	82.7	31%	0.307	39%	0.387	S	S	.	.	H	α-helix	trans	-62.5	-41.5	176.2	-57.6	0	0	0	0	111.4	V223 L229 I230 R231	V223-T227 PolarHBondContact O-N 3.15Å; V223-T227 PolarHBondContact O-OG1 3Å; V223-T227 VanDerWaalsContact O-OG1 3.13Å; T227-L229 VanDerWaalsContact C-N 3.32Å; T227-L229 PolarHBondContact O-N 3.11Å; T227-I230 PolarHBondContact O-N 2.99Å; T227-R231 WeakPolarHBondContact O-CB 3.48Å; T227-R231 PolarHBondContact O-N 3.04Å
228	T	91.1	Very high	92.6	Very high	92 Å²	92	84.2 Å²	84.2	56%	0.564	39%	0.389	S	S	*	.	H	α-helix	trans	-61.6	-42.8	175.3	-57.8	0	0	0	0	111.3	S224 K225 Y226 R231 H232	S224-T228 WeakPolarHBondContact O-CB 3.37Å; S224-T228 PolarHBondContact O-N 2.88Å; S224-T228 PolarHBondContact O-OG1 3.4Å; K225-T228 PolarHBondContact O-N 2.81Å; Y226-T228 VanDerWaalsContact C-N 3.33Å; Y226-T228 PolarHBondContact O-N 2.71Å; T228-R231 PolarHBondContact O-N 3.15Å; T228-H232 PolarHBondContact O-N 3.36Å
229	L	93.3	Very high	92.6	Very high	20 Å²	20	85.9 Å²	85.9	11%	0.105	39%	0.387	C	S	.	.	H	α-helix	trans	-63.6	-47.6	178.3	177.9	61.4	0	0	0	111.8	V42 F53 L80 K225 Y226 T227 R231 H232 L233 Y239	V42-L229 HydrophobicContact CG1-CD2 3.86Å; V42-L229 HydrophobicContact CG1-CG 4.48Å; F53-L229 HydrophobicContact CB-CD1 3.87Å; F53-L229 HydrophobicContact CB-CD2 4.2Å; F53-L229 HydrophobicContact CD1-CD2 3.7Å; F53-L229 HydrophobicContact CE1-CD2 4.29Å; F53-L229 HydrophobicContact CG-CD1 4.18Å; F53-L229 HydrophobicContact CG-CD2 4.04Å; L80-L229 HydrophobicContact CD2-CD2 3.98Å; K225-L229 WeakPolarHBondContact O-CB 3.21Å; K225-L229 PolarHBondContact O-N 3.05Å; Y226-L229 WeakPolarHBondContact O-CB 3.42Å; Y226-L229 PolarHBondContact O-N 3.11Å; T227-L229 VanDerWaalsContact C-N 3.32Å; T227-L229 PolarHBondContact O-N 3.11Å; L229-R231 VanDerWaalsContact C-N 3.34Å; L229-R231 PolarHBondContact O-N 3.13Å; L229-H232 WeakPolarHBondContact O-CB 3.39Å; L229-H232 PolarHBondContact O-N 3.19Å; L229-L233 HydrophobicContact CD1-CD1 4.11Å; L229-L233 HydrophobicContact CD1-CG 4.18Å; L229-L233 HydrophobicContact CG-CD1 4.08Å; L229-L233 VanDerWaalsContact O-CG 3.31Å; L229-L233 WeakPolarHBondContact O-CG 3.47Å; L229-L233 PolarHBondContact O-N 3.37Å; L229-Y239 HydrophobicContact CD1-CD1 3.67Å; L229-Y239 HydrophobicContact CD1-CG 3.77Å
230	I	91.8	Very high	92.7	Very high	42 Å²	42	85.1 Å²	85.1	22%	0.215	39%	0.389	C	S	.	.	H	α-helix	trans	-58.2	-48.2	177.2	-75.4	-178.6	0	0	0	110.7	V42 F55 Y226 T227 H232 L233 Q234	V42-I230 HydrophobicContact CG2-CD1 4.35Å; V42-I230 HydrophobicContact CG2-CG1 3.77Å; F55-I230 HydrophobicContact CZ-CG2 4.4Å; Y226-I230 HydrophobicContact CD1-CD1 3.75Å; Y226-I230 HydrophobicContact CD1-CG1 4.39Å; Y226-I230 HydrophobicContact CE1-CD1 3.16Å; Y226-I230 HydrophobicContact CE1-CG1 4.09Å; Y226-I230 PolarHBondContact O-N 2.9Å; T227-I230 PolarHBondContact O-N 2.99Å; I230-H232 VanDerWaalsContact C-N 3.28Å; I230-H232 PolarHBondContact O-N 3.06Å; I230-L233 CarbonylContact O-C 3.54Å; I230-L233 PolarHBondContact O-N 2.89Å; I230-Q234 HydrophobicContact CG2-CG 4.34Å; I230-Q234 WeakPolarHBondContact O-CG 3.46Å; I230-Q234 PolarHBondContact O-N 3.11Å
231	R	91.1	Very high	92.7	Very high	167 Å²	167	84.8 Å²	84.8	63%	0.63	39%	0.392	S	S	*	.	H	α-helix	trans	-59	-41.6	179.2	-175.3	176.3	174.3	166.9	1.3	111.9	T227 T228 L229 L233 Q234 E235	T227-R231 WeakPolarHBondContact O-CB 3.48Å; T227-R231 PolarHBondContact O-N 3.04Å; T228-R231 PolarHBondContact O-N 3.15Å; L229-R231 VanDerWaalsContact C-N 3.34Å; L229-R231 PolarHBondContact O-N 3.13Å; R231-L233 VanDerWaalsContact C-N 3.34Å; R231-L233 PolarHBondContact O-N 3.33Å; R231-Q234 PolarHBondContact O-N 3.29Å; R231-E235 PolarHBondContact O-N 3.38Å
232	H	94	Very high	92.6	Very high	58 Å²	58	82 Å²	82	27%	0.269	39%	0.39	S	S	.	.	H	α-helix	trans	-60.7	-44.3	174.1	-179	95.6	0	0	0	111.6	T228 L229 I230 Q234 E235 H236 Y238 Y239	T228-H232 PolarHBondContact O-N 3.36Å; L229-H232 WeakPolarHBondContact O-CB 3.39Å; L229-H232 PolarHBondContact O-N 3.19Å; I230-H232 VanDerWaalsContact C-N 3.28Å; I230-H232 PolarHBondContact O-N 3.06Å; H232-Q234 VanDerWaalsContact C-N 3.31Å; H232-Q234 PolarHBondContact O-N 3.27Å; H232-E235 PolarHBondContact O-N 3.31Å; H232-H236 AromaticContact CE1-CG 3.83Å; H232-H236 AromaticContact CE1-ND1 3.58Å; H232-H236 AromaticContact ND1-ND1 3.83Å; H232-H236 AromaticContact NE2-CG 3.66Å; H232-H236 AromaticContact NE2-ND1 3.72Å; H232-H236 WeakPolarHBondContact O-CB 3.41Å; H232-H236 PolarHBondContact O-N 3.32Å; H232-H236 PolarHBondContact O-ND1 3.15Å; H232-Y238 PolarHBondContact NE2-O 3.21Å; H232-Y239 AromaticContact CD2-CD2 3.91Å; H232-Y239 AromaticContact NE2-CD2 3.92Å
233	L	94.3	Very high	92	Very high	7 Å²	7	82.5 Å²	82.5	4%	0.037	39%	0.391	C	S	.	.	H	α-helix	trans	-72.1	-21.4	-178.5	-67.3	177.9	0	0	0	114.1	V42 F53 F55 L229 I230 R231 E235 H236	V42-L233 HydrophobicContact CG1-CD1 3.95Å; V42-L233 HydrophobicContact CG2-CD1 4.24Å; F53-L233 HydrophobicContact CB-CD1 4.42Å; F53-L233 WeakPolarHBondContact O-CD2 3.4Å; F55-L233 HydrophobicContact CD2-CB 4.06Å; F55-L233 HydrophobicContact CE1-CB 4.34Å; F55-L233 HydrophobicContact CE1-CD1 4.34Å; F55-L233 HydrophobicContact CE2-CB 3.49Å; F55-L233 VanDerWaalsContact CE2-CB 3.49Å; F55-L233 WeakPolarHBondContact CE2-O 3.35Å; F55-L233 HydrophobicContact CZ-CB 3.65Å; F55-L233 HydrophobicContact CZ-CD1 4.43Å; L229-L233 HydrophobicContact CD1-CD1 4.11Å; L229-L233 HydrophobicContact CD1-CG 4.18Å; L229-L233 HydrophobicContact CG-CD1 4.08Å; L229-L233 VanDerWaalsContact O-CG 3.31Å; L229-L233 WeakPolarHBondContact O-CG 3.47Å; L229-L233 PolarHBondContact O-N 3.37Å; I230-L233 CarbonylContact O-C 3.54Å; I230-L233 PolarHBondContact O-N 2.89Å; R231-L233 VanDerWaalsContact C-N 3.34Å; R231-L233 PolarHBondContact O-N 3.33Å; L233-E235 VanDerWaalsContact C-N 3.31Å; L233-H236 CarbonylContact C-O 3.6Å; L233-H236 VanDerWaalsContact C-O 3.3Å; L233-H236 VanDerWaalsContact CA-O 3.23Å; L233-H236 WeakPolarHBondContact CA-O 3.35Å
234	Q	91.8	Very high	90.9	Very high	124 Å²	124	90.6 Å²	90.6	58%	0.579	43%	0.429	S	S	*	.	H	α-helix	trans	-70.3	-31.3	170.9	-73	170	-27.6	0	0	111.5	F55 I230 R231 H232	F55-Q234 HydrophobicContact CE2-CG 4.36Å; F55-Q234 HydrophobicContact CZ-CG 4.46Å; I230-Q234 HydrophobicContact CG2-CG 4.34Å; I230-Q234 WeakPolarHBondContact O-CG 3.46Å; I230-Q234 PolarHBondContact O-N 3.11Å; R231-Q234 PolarHBondContact O-N 3.29Å; H232-Q234 VanDerWaalsContact C-N 3.31Å; H232-Q234 PolarHBondContact O-N 3.27Å
235	E	93.4	Very high	89	Confident	131 Å²	131	95.3 Å²	95.3	61%	0.612	44%	0.443	S	S	*	.	H	α-helix	trans	-93	-25.6	179.3	-65.4	175.1	-174.3	0	0	112.7	R231 H232 L233	R231-E235 PolarHBondContact O-N 3.38Å; H232-E235 PolarHBondContact O-N 3.31Å; L233-E235 VanDerWaalsContact C-N 3.31Å
236	H	93.1	Very high	86.5	Confident	92 Å²	92	94 Å²	94	43%	0.426	45%	0.449	S	S	.	.	S	Bend	trans	-133.6	144.1	-174.1	-52.5	81.6	0	0	0	111.1	H232 L233 Y238	H232-H236 AromaticContact CE1-CG 3.83Å; H232-H236 AromaticContact CE1-ND1 3.58Å; H232-H236 AromaticContact ND1-ND1 3.83Å; H232-H236 AromaticContact NE2-CG 3.66Å; H232-H236 AromaticContact NE2-ND1 3.72Å; H232-H236 WeakPolarHBondContact O-CB 3.41Å; H232-H236 PolarHBondContact O-N 3.32Å; H232-H236 PolarHBondContact O-ND1 3.15Å; L233-H236 CarbonylContact C-O 3.6Å; L233-H236 VanDerWaalsContact C-O 3.3Å; L233-H236 VanDerWaalsContact CA-O 3.23Å; L233-H236 WeakPolarHBondContact CA-O 3.35Å; H236-Y238 PolarHBondContact O-N 3.22Å; H236-Y238 VanDerWaalsContact O-N 3.16Å
237	Q	90.9	Very high	83.7	Confident	169 Å²	169	100.4 Å²	100.4	79%	0.79	48%	0.484	S	S	*	.	S	Bend	trans	-64.5	-25.1	-178.7	-67.9	-177.5	-10.7	0	0	114.1
238	Y	93.9	Very high	81.1	Confident	103 Å²	103	101.5 Å²	101.5	40%	0.404	51%	0.505	S	S	.	.			trans	-150.2	153.7	-175.3	46.7	-95.6	0	0	0	112.5	F53 P62 H232 H236 L240	F53-Y238 CarbonylContact O-C 3.59Å; F53-Y238 VanDerWaalsContact O-CA 3.31Å; F53-Y238 WeakPolarHBondContact O-CA 3.5Å; P62-Y238 HydrophobicContact CB-CD1 4.1Å; P62-Y238 HydrophobicContact CB-CD2 4.03Å; P62-Y238 HydrophobicContact CB-CE1 3.93Å; P62-Y238 HydrophobicContact CB-CE2 3.83Å; P62-Y238 HydrophobicContact CB-CG 4.16Å; P62-Y238 HydrophobicContact CG-CD1 4.39Å; P62-Y238 HydrophobicContact CG-CD2 4.17Å; P62-Y238 HydrophobicContact CG-CE2 4.46Å; P62-Y238 HydrophobicContact CG-CG 4.13Å; H232-Y238 PolarHBondContact NE2-O 3.21Å; H236-Y238 PolarHBondContact O-N 3.22Å; H236-Y238 VanDerWaalsContact O-N 3.16Å; Y238-L240 HydrophobicContact CD2-CD1 4.23Å; Y238-L240 HydrophobicContact CD2-CD2 4.43Å; Y238-L240 HydrophobicContact CD2-CG 4.06Å; Y238-L240 HydrophobicContact CE2-CD1 4.33Å
239	Y	95.8	Very high	78.3	Confident	98 Å²	98	107.3 Å²	107.3	38%	0.384	52%	0.518	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	132.2	166.3	177	-101	0	0	0	109.2	F53 L229 H232 A241	F53-Y239 AromaticContact CD2-CD1 3.67Å; F53-Y239 HydrophobicContact CD2-CD1 3.67Å; F53-Y239 HydrophobicContact CD2-CE1 4.38Å; F53-Y239 HydrophobicContact CE2-CD1 4.24Å; F53-Y239 HydrophobicContact CG-CD1 4.37Å; F53-Y239 PolarHBondContact N-O 3.12Å; F53-Y239 PolarHBondContact O-N 2.83Å; L229-Y239 HydrophobicContact CD1-CD1 3.67Å; L229-Y239 HydrophobicContact CD1-CG 3.77Å; H232-Y239 AromaticContact CD2-CD2 3.91Å; H232-Y239 AromaticContact NE2-CD2 3.92Å; Y239-A241 HydrophobicContact CE1-CB 4.03Å
240	L	94.8	Very high	75.5	Confident	59 Å²	59	109.7 Å²	109.7	31%	0.309	55%	0.548	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	127.9	-178.2	-57.1	176.4	0	0	0	109.6	E51 I52 P62 Y238	E51-L240 WeakPolarHBondContact O-CA 3.42Å; I52-L240 HydrophobicContact CB-CD2 4.14Å; I52-L240 HydrophobicContact CG1-CD2 3.73Å; I52-L240 HydrophobicContact CG2-CD2 3.93Å; P62-L240 HydrophobicContact CG-CD1 4.31Å; P62-L240 HydrophobicContact CG-CD2 3.74Å; Y238-L240 HydrophobicContact CD2-CD1 4.23Å; Y238-L240 HydrophobicContact CD2-CD2 4.43Å; Y238-L240 HydrophobicContact CD2-CG 4.06Å; Y238-L240 HydrophobicContact CE2-CD1 4.33Å
241	A	92.8	Very high	72.7	Confident	28 Å²	28	115.9 Å²	115.9	23%	0.231	58%	0.576	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-122.1	147.4	170.8	0	0	0	0	0	110.2	K50 E51 Y239 R243	K50-A241 CarbonylContact C-O 3.54Å; K50-A241 WeakPolarHBondContact CA-O 3.44Å; E51-A241 HydrophobicContact CB-CB 4.33Å; E51-A241 PolarHBondContact N-O 3.37Å; E51-A241 PolarHBondContact O-N 3.35Å; Y239-A241 HydrophobicContact CE1-CB 4.03Å; A241-R243 PolarHBondContact O-N 3.16Å
242	D	90.9	Very high	69.9	Low	111 Å²	111	116.6 Å²	116.6	59%	0.594	59%	0.586	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-66.3	132.5	168.2	-73.1	-53.4	0	0	0	109.7	K50 Q244	K50-D242 WeakPolarHBondContact CE-OD1 3.46Å; K50-D242 IonicContact NZ-OD1 3.17Å; K50-D242 PolarHBondContact NZ-OD1 3.23Å; K50-D242 IonicContact NZ-OD2 2.98Å; D242-Q244 PolarHBondContact O-N 3.45Å
243	R	81.6	Confident	67.1	Low	128 Å²	128	123.4 Å²	123.4	48%	0.483	62%	0.618	S	S	.	*			trans	-67.9	106	171	-175.6	169.2	-176.6	-170.5	1.9	107.5	Q49 E51 A241 E245	Q49-R243 VanDerWaalsContact O-CB 3.24Å; Q49-R243 WeakPolarHBondContact O-CB 3.35Å; Q49-R243 PolarHBondContact O-N 3.2Å; E51-R243 HydrophobicContact CG-CB 4.32Å; E51-R243 WeakPolarHBondContact OE1-CD 3.44Å; E51-R243 VanDerWaalsContact OE1-CG 3.26Å; E51-R243 WeakPolarHBondContact OE1-CG 3.23Å; E51-R243 IonicContact OE1-NE 3.7Å; A241-R243 PolarHBondContact O-N 3.16Å; R243-E245 PolarHBondContact O-N 3.34Å; R243-E245 VanDerWaalsContact O-N 3.13Å
244	Q	69.7	Low	64.3	Low	173 Å²	173	127.9 Å²	127.9	81%	0.808	65%	0.65	S	S	*	*			trans	-64.2	116.2	167.6	-69.3	-171.7	-31.7	0	0	107.2	D242 T246	D242-Q244 PolarHBondContact O-N 3.45Å; Q244-T246 PolarHBondContact O-N 3.32Å
245	E	49.7	Very low	61.5	Low	167 Å²	167	128.5 Å²	128.5	78%	0.78	66%	0.662	S	S	*	*			trans	-58.2	108.3	165.4	-73.3	-177.1	165.5	0	0	106.7	R243 L247	R243-E245 PolarHBondContact O-N 3.34Å; R243-E245 VanDerWaalsContact O-N 3.13Å; E245-L247 VanDerWaalsContact C-N 3.26Å; E245-L247 PolarHBondContact O-N 2.86Å
246	T	41.2	Very low	58.5	Low	133 Å²	133	127.2 Å²	127.2	82%	0.816	67%	0.673	S	S	*	*			trans	-63.4	95	170.4	49	0	0	0	0	107.1	Q244 G248	Q244-T246 PolarHBondContact O-N 3.32Å; T246-G248 PolarHBondContact O-N 3.08Å
247	L	33	Very low	55.9	Low	157 Å²	157	129.1 Å²	129.1	82%	0.822	69%	0.692	S	S	*	*			trans	-54.7	112.5	157.8	-73.3	168.1	0	0	0	105.7	E245 Y249	E245-L247 VanDerWaalsContact C-N 3.26Å; E245-L247 PolarHBondContact O-N 2.86Å; L247-Y249 PolarHBondContact O-N 3.34Å; L247-Y249 VanDerWaalsContact O-N 3.15Å
248	G	35.4	Very low	53.4	Low	72 Å²	72	130.5 Å²	130.5	74%	0.742	72%	0.72	S	S	*	*			trans	-54	119.5	-171.9	0	0	0	0	0	111.9	T246	T246-G248 PolarHBondContact O-N 3.08Å
249	Y	31.3	Very low	51.3	Low	214 Å²	214	131.9 Å²	131.9	84%	0.839	74%	0.736	S	S	*	*			trans	-107.1	78	157	-103.2	-92.7	0	0	0	107.7	L247	L247-Y249 PolarHBondContact O-N 3.34Å; L247-Y249 VanDerWaalsContact O-N 3.15Å
250	G	35.5	Very low	49	Very low	71 Å²	71	133.7 Å²	133.7	73%	0.732	76%	0.755	S	S	*	*			trans	-94.9	95.5	150.6	0	0	0	0	0	107.1
251	Q	33.6	Very low	46.5	Very low	171 Å²	171	137.8 Å²	137.8	80%	0.799	78%	0.779	S	S	*	*			trans	156.4	99	155.6	-92	170.8	0.6	0	0	108.6
252	E	30.7	Very low	43.7	Very low	182 Å²	182	144.3 Å²	144.3	85%	0.85	81%	0.812	S	S	*	*			trans	-179	59.1	136.6	-97.9	174.8	-171	0	0	108.3
253	E	36.2	Very low	40.8	Very low	202 Å²	202	146.4 Å²	146.4	94%	0.944	83%	0.825	S	S	*	*			trans	-94.2	87.9	149.7	-89.8	-170.2	153.1	0	0	106.9
254	S	34.2	Very low	38.1	Very low	100 Å²	100	147.6 Å²	147.6	70%	0.699	85%	0.848	S	S	*	*			trans	-166	139.5	152.6	59.3	0	0	0	0	109.5
255	V	34	Very low	35.8	Very low	138 Å²	138	145.8 Å²	145.8	84%	0.836	85%	0.851	S	S	*	*			trans	92.5	83.1	168.2	-159.8	0	0	0	0	115.6
256	A	30.2	Very low	34.7	Very low	103 Å²	103	144.2 Å²	144.2	85%	0.851	86%	0.856	S	S	*	*				-155	65	128.1	0	0	0	0	0	109.4
257	T	38.3	Very low	34.2	Very low	132 Å²	132	145.1 Å²	145.1	81%	0.81	86%	0.86	S	S	*	*			trans	-95.8	99	152.6	45	0	0	0	0	106.9
258	S	37.9	Very low	34.3	Very low	199 Å²	199	144 Å²	144	100%	1.392	86%	0.863	S	S	*	*			trans	-167.9	0	150.1	-73.1	0	0	0	0	107.5

Retrieved 258 of 258 residues in 249.4 ms (Link to these results)

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